A0A077ZDP2_TRITR Loading...

Transporter, major facilitator family

AlphaFold DB , UniProt , Accession A0A077ZDP2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 501 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M31.2Very low63.3Low242 Ų24290.1 Ų90.1100%1.19250%0.5SS*.  098.60-72.8178.3-176.400107.6S3M1-S3 PolarHBondContact O-N 2.83Å
2L32.9Very low65.5Low184 Ų18482.6 Ų82.696%0.96346%0.458SS*.  trans-67104.5167-81.9151.8000106S4L2-S4 PolarHBondContact O-N 3.43Å
3S40.5Very low67.3Low103 Ų10383.3 Ų83.372%0.7246%0.456SS*.PPolyproline II helixtrans-54128.617553.90000107.9M1M1-S3 PolarHBondContact O-N 2.83Å
4S44.7Very low68.8Low100 Ų10082.9 Ų82.970%0.69945%0.45SS*.PPolyproline II helixtrans-48.7139.617451.20000109.7L2 R6L2-S4 PolarHBondContact O-N 3.43Å; S4-R6 PolarHBondContact O-N 3.32Å; S4-R6 VanDerWaalsContact O-N 3.08Å
5P58.9Low70.2Confident103 Ų10377.4 Ų77.467%0.66942%0.42SS*.PPolyproline II helixtrans-54.3123.4-178.218.8-29.5000108.8
6R67.7Low71.3Confident136 Ų13672.8 Ų72.851%0.51340%0.395SS..PPolyproline II helixtrans-60138.6-178.1-71.8-169.5-171.6178.44.2108.8S4 S10 E14S4-R6 PolarHBondContact O-N 3.32Å; S4-R6 VanDerWaalsContact O-N 3.08Å; R6-S10 WeakPolarHBondContact CB-OG 3.36Å; R6-E14 IonicContact NH1-OE1 2.64Å; R6-E14 PolarHBondContact NH1-OE1 3.38Å
7P77.9Confident72.1Confident48 Ų4868.6 Ų68.631%0.31237%0.374SS..PPolyproline II helixtrans-66.1145.5179.826.1-32.9000111.1D9 S10 Q478P7-D9 PolarHBondContact O-N 3.16Å; P7-D9 VanDerWaalsContact O-N 3.1Å; P7-S10 WeakPolarHBondContact O-CB 3.32Å; P7-S10 PolarHBondContact O-N 2.89Å; P7-S10 PolarHBondContact O-OG 3.07Å; P7-Q478 VanDerWaalsContact CB-CD 3.43Å; P7-Q478 VanDerWaalsContact CB-OE1 3.29Å
8F84.2Confident73.2Confident8 Ų867 Ų674%0.03536%0.362CS..Hα-helixtrans-54.5-36.5-175.3-175.5-84.5000113.4S10 H11 L12 P239 R240 L243 L255 F273F8-S10 PolarHBondContact O-N 3.39Å; F8-S10 VanDerWaalsContact O-N 3.16Å; F8-H11 PolarHBondContact O-N 2.77Å; F8-H11 VanDerWaalsContact O-N 3.1Å; F8-L12 HydrophobicContact CD1-CD1 3.95Å; F8-L12 HydrophobicContact CD1-CG 4.02Å; F8-L12 HydrophobicContact CE1-CD1 3.64Å; F8-L12 HydrophobicContact CE1-CD2 3.95Å; F8-L12 HydrophobicContact CE1-CG 3.62Å; F8-L12 HydrophobicContact CZ-CD2 4.44Å; F8-L12 HydrophobicContact CZ-CG 4.47Å; F8-L12 PolarHBondContact O-N 3.34Å; F8-P239 HydrophobicContact CE2-CB 4.48Å; F8-P239 HydrophobicContact CZ-CB 3.92Å; F8-P239 HydrophobicContact CZ-CG 4.01Å; F8-R240 HydrophobicContact CD1-CG 3.8Å; F8-R240 VanDerWaalsContact CD1-NH2 3.35Å; F8-R240 HydrophobicContact CD2-CG 4.49Å; F8-R240 HydrophobicContact CE1-CG 3.37Å; F8-R240 HydrophobicContact CE2-CG 4.19Å; F8-R240 HydrophobicContact CG-CG 4.32Å; F8-R240 HydrophobicContact CZ-CG 3.61Å; F8-L243 HydrophobicContact CD2-CD1 3.47Å; F8-L243 VanDerWaalsContact CD2-CD1 3.47Å; F8-L243 HydrophobicContact CE2-CD1 3.33Å; F8-L255 HydrophobicContact CE2-CD1 4.23Å; F8-L255 HydrophobicContact CZ-CD1 4.46Å; F8-L255 HydrophobicContact CZ-CD2 4.42Å; F8-F273 HydrophobicContact CB-CE2 4.25Å; F8-F273 HydrophobicContact CB-CZ 3.72Å; F8-F273 HydrophobicContact CD2-CD2 4.49Å; F8-F273 AromaticContact CD2-CE2 3.61Å; F8-F273 HydrophobicContact CD2-CE2 3.61Å; F8-F273 AromaticContact CD2-CZ 3.95Å; F8-F273 HydrophobicContact CD2-CZ 3.95Å; F8-F273 HydrophobicContact CE2-CE2 4.5Å; F8-F273 HydrophobicContact CG-CE2 4.39Å; F8-F273 HydrophobicContact CG-CZ 4.33Å
9D85.8Confident74.3Confident19 Ų1965.1 Ų65.110%0.10236%0.355CS..Hα-helixtrans-56.9-29.8176.2-7242.1000112.7P7 L12 E13 T184 N185 R188 R240P7-D9 PolarHBondContact O-N 3.16Å; P7-D9 VanDerWaalsContact O-N 3.1Å; D9-L12 WeakPolarHBondContact O-CB 3.49Å; D9-L12 PolarHBondContact O-N 3.02Å; D9-E13 PolarHBondContact O-N 3.34Å; D9-T184 HydrophobicContact CB-CG2 4.19Å; D9-T184 WeakPolarHBondContact O-CG2 3.08Å; D9-N185 PolarHBondContact OD2-N 3.03Å; D9-R188 IonicContact OD1-NH2 2.82Å; D9-R188 PolarHBondContact OD1-NH2 3.04Å; D9-R188 IonicContact OD2-CZ 3.08Å; D9-R188 IonicContact OD2-NH1 3.26Å; D9-R188 IonicContact OD2-NH2 2.64Å; D9-R188 PolarHBondContact OD2-NH2 3.48Å; D9-R240 IonicContact OD1-CZ 3.74Å; D9-R240 IonicContact OD1-NH1 3.1Å; D9-R240 IonicContact OD1-NH2 3.54Å; D9-R240 PolarHBondContact OD1-NH2 3.27Å
10S85.6Confident75.3Confident31 Ų3168.7 Ų68.722%0.21737%0.367CS..Hα-helixtrans-68.3-37.4177.868.60000112.6R6 P7 F8 L12 E13 E14R6-S10 WeakPolarHBondContact CB-OG 3.36Å; P7-S10 WeakPolarHBondContact O-CB 3.32Å; P7-S10 PolarHBondContact O-N 2.89Å; P7-S10 PolarHBondContact O-OG 3.07Å; F8-S10 PolarHBondContact O-N 3.39Å; F8-S10 VanDerWaalsContact O-N 3.16Å; S10-L12 VanDerWaalsContact C-N 3.3Å; S10-L12 PolarHBondContact O-N 2.84Å; S10-E13 PolarHBondContact O-N 3.02Å; S10-E14 WeakPolarHBondContact O-CG 3.34Å; S10-E14 PolarHBondContact O-N 2.97Å
11H87Confident76.3Confident17 Ų1765.6 Ų65.68%0.07935%0.35CS..Hα-helixtrans-66.8-33.9173.3-63.1-61.1000111.7F8 E14 C15 V271 F273F8-H11 PolarHBondContact O-N 2.77Å; F8-H11 VanDerWaalsContact O-N 3.1Å; H11-E14 PolarHBondContact O-N 3.31Å; H11-C15 PolarHBondContact O-N 2.9Å; H11-C15 PolarHBondContact O-SG 3.42Å; H11-V271 HydrophobicContact CB-CG1 4.49Å; H11-V271 WeakPolarHBondContact CD2-CG1 3.38Å; H11-F273 AromaticContact CD2-CE2 3.81Å
12L89.3Confident79.3Confident0 Ų054.1 Ų54.10%029%0.294CS..Hα-helixtrans-68.7-37.9172.7-70179.2000112.5F8 D9 S10 C15 G16 A17 T183 T184 L255F8-L12 HydrophobicContact CD1-CD1 3.95Å; F8-L12 HydrophobicContact CD1-CG 4.02Å; F8-L12 HydrophobicContact CE1-CD1 3.64Å; F8-L12 HydrophobicContact CE1-CD2 3.95Å; F8-L12 HydrophobicContact CE1-CG 3.62Å; F8-L12 HydrophobicContact CZ-CD2 4.44Å; F8-L12 HydrophobicContact CZ-CG 4.47Å; F8-L12 PolarHBondContact O-N 3.34Å; D9-L12 WeakPolarHBondContact O-CB 3.49Å; D9-L12 PolarHBondContact O-N 3.02Å; S10-L12 VanDerWaalsContact C-N 3.3Å; S10-L12 PolarHBondContact O-N 2.84Å; L12-C15 CarbonylContact O-C 3.53Å; L12-C15 PolarHBondContact O-N 3.37Å; L12-G16 CarbonylContact O-C 3.54Å; L12-G16 PolarHBondContact O-N 3.41Å; L12-G16 VanDerWaalsContact O-N 3.15Å; L12-A17 WeakPolarHBondContact O-CA 3.38Å; L12-A17 PolarHBondContact O-N 3.1Å; L12-A17 VanDerWaalsContact O-N 3.12Å; L12-T183 VanDerWaalsContact CD1-O 3.3Å; L12-T183 WeakPolarHBondContact CD1-O 3.5Å; L12-T184 HydrophobicContact CB-CG2 3.67Å; L12-T184 HydrophobicContact CD1-CG2 4.36Å; L12-L255 HydrophobicContact CD2-CD2 3.83Å
13E89.6Confident82.3Confident92 Ų9248.6 Ų48.643%0.4327%0.265SS..Hα-helixtrans-60.6-44.8172.5-74-58.2160.800111.3D9 S10 C15 G16 A17 T184D9-E13 PolarHBondContact O-N 3.34Å; S10-E13 PolarHBondContact O-N 3.02Å; E13-C15 VanDerWaalsContact C-N 3.27Å; E13-C15 PolarHBondContact O-N 3.36Å; E13-G16 WeakPolarHBondContact O-CA 3.32Å; E13-G16 PolarHBondContact O-N 3.02Å; E13-A17 HydrophobicContact CG-CB 4.35Å; E13-A17 WeakPolarHBondContact OE1-CB 3.43Å; E13-A17 VanDerWaalsContact OE2-CB 3.24Å; E13-A17 WeakPolarHBondContact OE2-CB 3.42Å; E13-T184 HydrophobicContact CG-CG2 3.92Å; E13-T184 VanDerWaalsContact OE1-CB 3.31Å; E13-T184 WeakPolarHBondContact OE1-CB 3.35Å; E13-T184 WeakPolarHBondContact OE1-CG2 3.5Å; E13-T184 PolarHBondContact OE1-OG1 3.3Å
14E88.3Confident85Confident78 Ų7846.3 Ų46.336%0.36424%0.244SC..Hα-helixtrans-59.2-38.8175.1-70.9174.9-169.300111.8R6 S10 H11 G16 L267R6-E14 IonicContact NH1-OE1 2.64Å; R6-E14 PolarHBondContact NH1-OE1 3.38Å; S10-E14 WeakPolarHBondContact O-CG 3.34Å; S10-E14 PolarHBondContact O-N 2.97Å; H11-E14 PolarHBondContact O-N 3.31Å; E14-G16 PolarHBondContact O-N 3.32Å; E14-L267 HydrophobicContact CB-CD2 4.04Å; E14-L267 VanDerWaalsContact OE2-CD2 3.26Å; E14-L267 WeakPolarHBondContact OE2-CD2 3.49Å
15C89Confident87.4Confident0 Ų041.6 Ų41.60%021%0.211CC..THydrogen-bonded Turntrans-75.5-2.7175.3-63.10000114H11 L12 E13 I258 A259 N262H11-C15 PolarHBondContact O-N 2.9Å; H11-C15 PolarHBondContact O-SG 3.42Å; L12-C15 CarbonylContact O-C 3.53Å; L12-C15 PolarHBondContact O-N 3.37Å; E13-C15 VanDerWaalsContact C-N 3.27Å; E13-C15 PolarHBondContact O-N 3.36Å; C15-I258 HydrophobicContact CB-CG2 4.02Å; C15-A259 HydrophobicContact CB-CB 4.35Å; C15-N262 WeakPolarHBondContact O-CB 3.38Å; C15-N262 PolarHBondContact O-ND2 3.35Å
16G88.2Confident89.2Confident3 Ų337.1 Ų37.13%0.03118%0.181CC..  trans83.484.8-173.400000112.1L12 E13 E14 F18 S19 Q22 N262L12-G16 CarbonylContact O-C 3.54Å; L12-G16 PolarHBondContact O-N 3.41Å; L12-G16 VanDerWaalsContact O-N 3.15Å; E13-G16 WeakPolarHBondContact O-CA 3.32Å; E13-G16 PolarHBondContact O-N 3.02Å; E14-G16 PolarHBondContact O-N 3.32Å; G16-F18 PolarHBondContact O-N 2.87Å; G16-S19 PolarHBondContact O-N 3.43Å; G16-Q22 PolarHBondContact O-NE2 3.2Å; G16-Q22 PolarHBondContact O-OE1 3.02Å; G16-N262 PolarHBondContact O-ND2 3.44Å
17A84.5Confident90.5Very high3 Ų334.8 Ų34.83%0.02518%0.179CC..THydrogen-bonded Turntrans-56.1-19.7-168.200000117.5L12 E13 T183 T184L12-A17 WeakPolarHBondContact O-CA 3.38Å; L12-A17 PolarHBondContact O-N 3.1Å; L12-A17 VanDerWaalsContact O-N 3.12Å; E13-A17 HydrophobicContact CG-CB 4.35Å; E13-A17 WeakPolarHBondContact OE1-CB 3.43Å; E13-A17 VanDerWaalsContact OE2-CB 3.24Å; E13-A17 WeakPolarHBondContact OE2-CB 3.42Å; A17-T183 WeakPolarHBondContact O-CG2 3.12Å; A17-T184 HydrophobicContact CB-CG2 3.43Å; A17-T184 VanDerWaalsContact CB-CG2 3.43Å; A17-T184 WeakPolarHBondContact CB-OG1 3.48Å
18F92Very high91.4Very high39 Ų3933.1 Ų33.117%0.17117%0.167CC..THydrogen-bonded Turntrans-151.458.8173.3-159.7-109.1000110.5G16 Q22 I23 L26 T183 W187 L190 C191G16-F18 PolarHBondContact O-N 2.87Å; F18-Q22 HydrophobicContact CD2-CB 4.08Å; F18-I23 HydrophobicContact CD1-CG1 4.36Å; F18-I23 HydrophobicContact CE1-CG1 4.01Å; F18-I23 HydrophobicContact CZ-CG1 4.19Å; F18-L26 HydrophobicContact CE2-CD2 4.41Å; F18-L26 HydrophobicContact CZ-CD2 4.06Å; F18-T183 HydrophobicContact CD2-CG2 3.75Å; F18-T183 HydrophobicContact CE2-CG2 4.27Å; F18-W187 HydrophobicContact CB-CB 4.06Å; F18-W187 HydrophobicContact CB-CD2 3.54Å; F18-W187 HydrophobicContact CB-CE3 4.21Å; F18-W187 HydrophobicContact CB-CG 3.45Å; F18-W187 VanDerWaalsContact CB-CG 3.45Å; F18-W187 HydrophobicContact CB-CZ2 4.43Å; F18-W187 HydrophobicContact CD1-CD2 4.08Å; F18-W187 AromaticContact CD1-CE3 3.85Å; F18-W187 HydrophobicContact CD1-CE3 3.85Å; F18-W187 HydrophobicContact CD1-CZ3 4.24Å; F18-W187 HydrophobicContact CD2-CB 3.86Å; F18-W187 HydrophobicContact CD2-CG 4.17Å; F18-W187 HydrophobicContact CE1-CE3 4.46Å; F18-W187 HydrophobicContact CG-CB 4.01Å; F18-W187 AromaticContact CG-CD2 3.82Å; F18-W187 HydrophobicContact CG-CD2 3.82Å; F18-W187 HydrophobicContact CG-CE3 4.05Å; F18-W187 AromaticContact CG-CG 3.82Å; F18-W187 HydrophobicContact CG-CG 3.82Å; F18-L190 HydrophobicContact CD1-CD2 4.49Å; F18-L190 HydrophobicContact CE1-CD2 3.76Å; F18-L190 HydrophobicContact CZ-CD2 4.06Å; F18-C191 WeakPolarHBondContact CE2-SG 3.26Å
19S93.8Very high91.9Very high31 Ų3132.8 Ų32.822%0.21717%0.165CC..SBendtrans-101.4-165.9177-64.70000110.5G16 Y21 Q22 I23 N262G16-S19 PolarHBondContact O-N 3.43Å; S19-Y21 VanDerWaalsContact C-N 3.3Å; S19-Y21 PolarHBondContact O-N 3.38Å; S19-Q22 VanDerWaalsContact N-OE1 3.14Å; S19-Q22 PolarHBondContact O-N 3.27Å; S19-Q22 VanDerWaalsContact O-N 3.14Å; S19-Q22 PolarHBondContact O-OE1 3.44Å; S19-I23 WeakPolarHBondContact O-CG1 3.47Å; S19-I23 PolarHBondContact O-N 3.06Å; S19-N262 WeakPolarHBondContact CB-OD1 3.28Å
20F95.2Very high92.3Very high137 Ų13732.5 Ų32.560%0.60116%0.163SC*.Hα-helixtrans-51.3-44.2-172.4-177.2-99.9000113.7I23 L24 I261 N262F20-I23 PolarHBondContact O-N 2.94Å; F20-L24 WeakPolarHBondContact O-CB 3.2Å; F20-L24 PolarHBondContact O-N 3.38Å; F20-I261 HydrophobicContact CD1-CG2 3.8Å; F20-I261 HydrophobicContact CE1-CG2 4.47Å; F20-N262 PolarHBondContact N-OD1 3.16Å
21Y95.6Very high92.8Very high3 Ų333.6 Ų33.61%0.01217%0.167CC..Hα-helixtrans-62.7-45.8-179.9-178.5-95.3000112.5S19 I23 L24 V25 S236 I258 I261 N262S19-Y21 VanDerWaalsContact C-N 3.3Å; S19-Y21 PolarHBondContact O-N 3.38Å; Y21-I23 VanDerWaalsContact C-N 3.34Å; Y21-I23 PolarHBondContact O-N 3.25Å; Y21-L24 WeakPolarHBondContact O-CB 3.37Å; Y21-L24 PolarHBondContact O-N 3.26Å; Y21-V25 HydrophobicContact CD1-CG2 4.07Å; Y21-V25 HydrophobicContact CE1-CG2 3.58Å; Y21-V25 HydrophobicContact CE2-CG2 4.41Å; Y21-V25 WeakPolarHBondContact O-CG2 3.33Å; Y21-V25 PolarHBondContact O-N 2.76Å; Y21-S236 WeakPolarHBondContact OH-CB 3.48Å; Y21-S236 PolarHBondContact OH-N 3.44Å; Y21-S236 PolarHBondContact OH-OG 3.43Å; Y21-I258 HydrophobicContact CD1-CB 4.27Å; Y21-I258 HydrophobicContact CD1-CD1 4Å; Y21-I258 HydrophobicContact CD1-CG1 3.61Å; Y21-I258 HydrophobicContact CD1-CG2 3.87Å; Y21-I258 HydrophobicContact CE1-CD1 3.65Å; Y21-I258 HydrophobicContact CE1-CG1 3.51Å; Y21-I258 HydrophobicContact CE2-CG1 4.47Å; Y21-I258 HydrophobicContact CG-CG1 4.15Å; Y21-I258 HydrophobicContact CG-CG2 4.23Å; Y21-I261 HydrophobicContact CD2-CD1 3.66Å; Y21-I261 HydrophobicContact CD2-CG2 4.35Å; Y21-I261 HydrophobicContact CE2-CD1 4.11Å; Y21-N262 WeakPolarHBondContact CB-OD1 3.35Å; Y21-N262 PolarHBondContact N-OD1 3.14Å
22Q95.7Very high93.3Very high1 Ų132.8 Ų32.81%0.00516%0.163CC..Hα-helixtrans-67-37.9-179.8-68.382.6-2.100111.6G16 F18 S19 L24 V25 L26 V182 T183 N262G16-Q22 PolarHBondContact O-NE2 3.2Å; G16-Q22 PolarHBondContact O-OE1 3.02Å; F18-Q22 HydrophobicContact CD2-CB 4.08Å; S19-Q22 VanDerWaalsContact N-OE1 3.14Å; S19-Q22 PolarHBondContact O-N 3.27Å; S19-Q22 VanDerWaalsContact O-N 3.14Å; S19-Q22 PolarHBondContact O-OE1 3.44Å; Q22-L24 VanDerWaalsContact C-N 3.32Å; Q22-V25 PolarHBondContact O-N 3.26Å; Q22-L26 WeakPolarHBondContact O-CB 3.2Å; Q22-L26 PolarHBondContact O-N 3.38Å; Q22-V182 HydrophobicContact CG-CB 4.5Å; Q22-V182 HydrophobicContact CG-CG2 4.02Å; Q22-V182 VanDerWaalsContact CG-O 3.24Å; Q22-V182 WeakPolarHBondContact CG-O 3.33Å; Q22-V182 PolarHBondContact NE2-O 2.9Å; Q22-T183 HydrophobicContact CB-CG2 3.81Å; Q22-T183 HydrophobicContact CG-CG2 3.75Å; Q22-N262 PolarHBondContact OE1-ND2 3.13Å
23I95.6Very high93.6Very high69 Ų6932.9 Ų32.935%0.35416%0.163SC..Hα-helixtrans-62.3-42.9172.8-64.9168.6000110F18 S19 F20 Y21 L26 L27F18-I23 HydrophobicContact CD1-CG1 4.36Å; F18-I23 HydrophobicContact CE1-CG1 4.01Å; F18-I23 HydrophobicContact CZ-CG1 4.19Å; S19-I23 WeakPolarHBondContact O-CG1 3.47Å; S19-I23 PolarHBondContact O-N 3.06Å; F20-I23 PolarHBondContact O-N 2.94Å; Y21-I23 VanDerWaalsContact C-N 3.34Å; Y21-I23 PolarHBondContact O-N 3.25Å; I23-L26 PolarHBondContact O-N 3.16Å; I23-L27 HydrophobicContact CG2-CD1 3.9Å; I23-L27 HydrophobicContact CG2-CG 4.23Å; I23-L27 WeakPolarHBondContact O-CB 3.48Å; I23-L27 WeakPolarHBondContact O-CG 3.2Å; I23-L27 PolarHBondContact O-N 2.99Å
24L95.7Very high93.9Very high55 Ų5529.1 Ų29.129%0.28815%0.146SC..Hα-helixtrans-61-46.1176.3-178.366.9000111.8F20 Y21 Q22 L26 L27 I28F20-L24 WeakPolarHBondContact O-CB 3.2Å; F20-L24 PolarHBondContact O-N 3.38Å; Y21-L24 WeakPolarHBondContact O-CB 3.37Å; Y21-L24 PolarHBondContact O-N 3.26Å; Q22-L24 VanDerWaalsContact C-N 3.32Å; L24-L26 VanDerWaalsContact C-N 3.33Å; L24-L26 PolarHBondContact O-N 3.09Å; L24-L27 PolarHBondContact O-N 3.47Å; L24-I28 HydrophobicContact CD1-CD1 3.72Å; L24-I28 HydrophobicContact CD1-CG1 4.14Å; L24-I28 HydrophobicContact CD2-CD1 4.42Å; L24-I28 HydrophobicContact CG-CD1 3.71Å; L24-I28 HydrophobicContact CG-CG1 4.43Å; L24-I28 WeakPolarHBondContact O-CB 3.4Å; L24-I28 VanDerWaalsContact O-CG1 3.24Å; L24-I28 WeakPolarHBondContact O-CG1 3.47Å; L24-I28 PolarHBondContact O-N 2.86Å
25V96.1Very high94.3Very high1 Ų125.4 Ų25.41%0.00613%0.129CC..Hα-helixtrans-60.3-43.5175.8174.40000111.2Y21 Q22 T29 P178 P179 V182 V235Y21-V25 HydrophobicContact CD1-CG2 4.07Å; Y21-V25 HydrophobicContact CE1-CG2 3.58Å; Y21-V25 HydrophobicContact CE2-CG2 4.41Å; Y21-V25 WeakPolarHBondContact O-CG2 3.33Å; Y21-V25 PolarHBondContact O-N 2.76Å; Q22-V25 PolarHBondContact O-N 3.26Å; V25-T29 WeakPolarHBondContact O-CB 3.46Å; V25-T29 VanDerWaalsContact O-CG2 3.32Å; V25-T29 WeakPolarHBondContact O-CG2 3.38Å; V25-T29 PolarHBondContact O-N 3.3Å; V25-T29 VanDerWaalsContact O-N 3.08Å; V25-T29 PolarHBondContact O-OG1 2.95Å; V25-P178 HydrophobicContact CG1-CB 4.2Å; V25-P179 HydrophobicContact CG1-CG 4.31Å; V25-V182 HydrophobicContact CB-CG2 4.33Å; V25-V182 HydrophobicContact CG1-CG2 4.16Å; V25-V182 HydrophobicContact CG2-CG2 4.48Å; V25-V235 HydrophobicContact CG1-CG1 4.38Å; V25-V235 HydrophobicContact CG2-CG1 3.92Å; V25-V235 HydrophobicContact CG2-CG2 4.34Å
26L95.9Very high94.7Very high9 Ų925.4 Ų25.45%0.04713%0.129CC..Hα-helixtrans-60.9-53.7175.7-177.868.4000110.7F18 Q22 I23 L24 I28 T29 Q30 P179 C191 L194F18-L26 HydrophobicContact CE2-CD2 4.41Å; F18-L26 HydrophobicContact CZ-CD2 4.06Å; Q22-L26 WeakPolarHBondContact O-CB 3.2Å; Q22-L26 PolarHBondContact O-N 3.38Å; I23-L26 PolarHBondContact O-N 3.16Å; L24-L26 VanDerWaalsContact C-N 3.33Å; L24-L26 PolarHBondContact O-N 3.09Å; L26-I28 PolarHBondContact O-N 3.25Å; L26-T29 PolarHBondContact O-N 3.38Å; L26-T29 PolarHBondContact O-OG1 3.35Å; L26-Q30 HydrophobicContact CD1-CG 3.65Å; L26-Q30 HydrophobicContact CG-CG 4.17Å; L26-Q30 WeakPolarHBondContact O-CB 3.29Å; L26-Q30 WeakPolarHBondContact O-CG 3.34Å; L26-Q30 PolarHBondContact O-N 3.09Å; L26-P179 HydrophobicContact CD1-CB 3.98Å; L26-P179 HydrophobicContact CD1-CG 4.22Å; L26-C191 HydrophobicContact CD1-CB 3.97Å; L26-L194 HydrophobicContact CD2-CB 4.22Å; L26-L194 HydrophobicContact CD2-CD1 3.76Å
27L95.7Very high95Very high87 Ų8725.2 Ų25.246%0.45513%0.128SC..Hα-helixtrans-59-45.8-178.8-70.9175.5000112.2I23 L24 T29 Q30 L31I23-L27 HydrophobicContact CG2-CD1 3.9Å; I23-L27 HydrophobicContact CG2-CG 4.23Å; I23-L27 WeakPolarHBondContact O-CB 3.48Å; I23-L27 WeakPolarHBondContact O-CG 3.2Å; I23-L27 PolarHBondContact O-N 2.99Å; L24-L27 PolarHBondContact O-N 3.47Å; L27-T29 PolarHBondContact O-N 2.7Å; L27-Q30 PolarHBondContact O-N 2.93Å; L27-L31 HydrophobicContact CB-CD1 4.3Å; L27-L31 WeakPolarHBondContact O-CB 3.48Å; L27-L31 WeakPolarHBondContact O-CG 3.48Å; L27-L31 PolarHBondContact O-N 2.89Å
28I96Very high95.5Very high12 Ų1225.1 Ų25.16%0.06213%0.126CC..Hα-helixtrans-62.1-47.7-179.8-68.3171.3000111L24 L26 S32 A231 V235L24-I28 HydrophobicContact CD1-CD1 3.72Å; L24-I28 HydrophobicContact CD1-CG1 4.14Å; L24-I28 HydrophobicContact CD2-CD1 4.42Å; L24-I28 HydrophobicContact CG-CD1 3.71Å; L24-I28 HydrophobicContact CG-CG1 4.43Å; L24-I28 WeakPolarHBondContact O-CB 3.4Å; L24-I28 VanDerWaalsContact O-CG1 3.24Å; L24-I28 WeakPolarHBondContact O-CG1 3.47Å; L24-I28 PolarHBondContact O-N 2.86Å; L26-I28 PolarHBondContact O-N 3.25Å; I28-S32 PolarHBondContact O-N 2.93Å; I28-S32 PolarHBondContact O-OG 3.27Å; I28-A231 HydrophobicContact CD1-CB 3.95Å; I28-A231 HydrophobicContact CG1-CB 3.88Å; I28-A231 HydrophobicContact CG2-CB 3.96Å; I28-V235 HydrophobicContact CB-CG2 4.34Å; I28-V235 HydrophobicContact CD1-CG2 3.61Å; I28-V235 HydrophobicContact CG2-CG2 4.16Å
29T95.7Very high95.7Very high1 Ų123.2 Ų23.21%0.00612%0.118CC..Hα-helixtrans-69.3-34.6-178.8530000112.9V25 L26 L27 Y171 P179V25-T29 WeakPolarHBondContact O-CB 3.46Å; V25-T29 VanDerWaalsContact O-CG2 3.32Å; V25-T29 WeakPolarHBondContact O-CG2 3.38Å; V25-T29 PolarHBondContact O-N 3.3Å; V25-T29 VanDerWaalsContact O-N 3.08Å; V25-T29 PolarHBondContact O-OG1 2.95Å; L26-T29 PolarHBondContact O-N 3.38Å; L26-T29 PolarHBondContact O-OG1 3.35Å; L27-T29 PolarHBondContact O-N 2.7Å; T29-Y171 WeakPolarHBondContact CA-OH 3.33Å; T29-Y171 PolarHBondContact O-OH 2.99Å; T29-P179 HydrophobicContact CG2-CG 4.44Å; T29-P179 VanDerWaalsContact OG1-CG 3.32Å; T29-P179 WeakPolarHBondContact OG1-CG 3.42Å
30Q94.9Very high95.7Very high13 Ų1321.8 Ų21.86%0.06111%0.108CC..Hα-helixtrans-86.4-34.9-177.6-56.9-37.1-64.500112.9L26 L27 S32 Y33 L194 H195 G196L26-Q30 HydrophobicContact CD1-CG 3.65Å; L26-Q30 HydrophobicContact CG-CG 4.17Å; L26-Q30 WeakPolarHBondContact O-CB 3.29Å; L26-Q30 WeakPolarHBondContact O-CG 3.34Å; L26-Q30 PolarHBondContact O-N 3.09Å; L27-Q30 PolarHBondContact O-N 2.93Å; Q30-S32 VanDerWaalsContact C-N 3.26Å; Q30-S32 PolarHBondContact O-N 3.15Å; Q30-Y33 VanDerWaalsContact O-CB 3.31Å; Q30-Y33 WeakPolarHBondContact O-CB 3.49Å; Q30-Y33 WeakPolarHBondContact O-CD2 3.24Å; Q30-Y33 PolarHBondContact O-N 2.83Å; Q30-L194 WeakPolarHBondContact CG-O 3.43Å; Q30-H195 VanDerWaalsContact OE1-CA 3.25Å; Q30-H195 PolarHBondContact OE1-ND1 2.91Å; Q30-G196 WeakPolarHBondContact O-CA 3.24Å
31L95.4Very high95.5Very high55 Ų5516.3 Ų16.329%0.2889%0.085SC..Hα-helixtrans-69.8-24.5176.9-68.5173.3000112.6L27 Y33 V34 F199 F228L27-L31 HydrophobicContact CB-CD1 4.3Å; L27-L31 WeakPolarHBondContact O-CB 3.48Å; L27-L31 WeakPolarHBondContact O-CG 3.48Å; L27-L31 PolarHBondContact O-N 2.89Å; L31-Y33 PolarHBondContact O-N 2.88Å; L31-Y33 VanDerWaalsContact O-N 3.07Å; L31-V34 WeakPolarHBondContact O-CB 3.34Å; L31-V34 WeakPolarHBondContact O-CG2 3.42Å; L31-V34 PolarHBondContact O-N 3.13Å; L31-F199 HydrophobicContact CD2-CD1 4.03Å; L31-F199 HydrophobicContact CD2-CE1 3.41Å; L31-F199 VanDerWaalsContact CD2-CE1 3.41Å; L31-F199 HydrophobicContact CD2-CZ 3.84Å; L31-F228 HydrophobicContact CB-CD1 3.86Å; L31-F228 HydrophobicContact CB-CE1 3.44Å; L31-F228 VanDerWaalsContact CB-CE1 3.44Å; L31-F228 HydrophobicContact CB-CZ 3.86Å; L31-F228 HydrophobicContact CD1-CE1 3.94Å; L31-F228 HydrophobicContact CG-CE1 4.29Å
32S96.9Very high95.4Very high0 Ų016.2 Ų16.20%09%0.085CC..THydrogen-bonded Turntrans-62.8-14.7173.3-60.60000113.8I28 Q30 V34 T35 V36 Y171 F228 H232I28-S32 PolarHBondContact O-N 2.93Å; I28-S32 PolarHBondContact O-OG 3.27Å; Q30-S32 VanDerWaalsContact C-N 3.26Å; Q30-S32 PolarHBondContact O-N 3.15Å; S32-V34 PolarHBondContact O-N 3.06Å; S32-T35 PolarHBondContact O-N 3.33Å; S32-V36 WeakPolarHBondContact O-CG2 3.39Å; S32-V36 PolarHBondContact O-N 3.06Å; S32-Y171 WeakPolarHBondContact CB-OH 3.21Å; S32-Y171 PolarHBondContact OG-OH 3.48Å; S32-F228 WeakPolarHBondContact OG-CB 3.48Å; S32-H232 PolarHBondContact OG-CE1 2.86Å
33Y96.6Very high95.2Very high1 Ų116.8 Ų16.80%0.0049%0.088CC..Hα-helixtrans-64.2-15.7171.3-83.6-100.8000113.9Q30 L31 T35 V36 S37 Y171 L172 S175 H195 G196 W197 G200Q30-Y33 VanDerWaalsContact O-CB 3.31Å; Q30-Y33 WeakPolarHBondContact O-CB 3.49Å; Q30-Y33 WeakPolarHBondContact O-CD2 3.24Å; Q30-Y33 PolarHBondContact O-N 2.83Å; L31-Y33 PolarHBondContact O-N 2.88Å; L31-Y33 VanDerWaalsContact O-N 3.07Å; Y33-T35 PolarHBondContact O-N 2.92Å; Y33-V36 PolarHBondContact O-N 3.3Å; Y33-S37 WeakPolarHBondContact O-CB 3.33Å; Y33-S37 PolarHBondContact O-N 3.18Å; Y33-S37 PolarHBondContact O-OG 3.03Å; Y33-Y171 HydrophobicContact CD2-CE1 4.07Å; Y33-Y171 HydrophobicContact CE2-CD1 4.16Å; Y33-Y171 AromaticContact CE2-CE1 3.78Å; Y33-Y171 HydrophobicContact CE2-CE1 3.78Å; Y33-L172 HydrophobicContact CD1-CD2 4.25Å; Y33-L172 HydrophobicContact CE1-CD2 3.26Å; Y33-L172 WeakPolarHBondContact OH-CD2 3.24Å; Y33-S175 WeakPolarHBondContact CE2-OG 3.4Å; Y33-S175 PolarHBondContact OH-OG 2.86Å; Y33-H195 AromaticContact CE1-CE1 3.88Å; Y33-H195 AromaticContact CE1-NE2 3.84Å; Y33-H195 AromaticContact CZ-CE1 3.41Å; Y33-H195 VanDerWaalsContact CZ-CE1 3.41Å; Y33-H195 AromaticContact CZ-NE2 3.86Å; Y33-H195 PolarHBondContact OH-CE1 3.3Å; Y33-G196 VanDerWaalsContact CB-C 3.49Å; Y33-G196 VanDerWaalsContact CB-O 3.29Å; Y33-G196 WeakPolarHBondContact CB-O 3.47Å; Y33-G196 VanDerWaalsContact CG-C 3.44Å; Y33-W197 HydrophobicContact CD1-CB 4.04Å; Y33-W197 HydrophobicContact CD1-CE3 4.05Å; Y33-W197 HydrophobicContact CE1-CB 4Å; Y33-W197 AromaticContact CE1-CE3 3.92Å; Y33-W197 HydrophobicContact CE1-CE3 3.92Å; Y33-G200 WeakPolarHBondContact O-CA 3.5Å
34V95.2Very high94.9Very high13 Ų1316 Ų168%0.0799%0.087CC..Hα-helixtrans-53.1-54.4171.5171.80000110.1L31 S32 G38 F199 A203 E224 F228L31-V34 WeakPolarHBondContact O-CB 3.34Å; L31-V34 WeakPolarHBondContact O-CG2 3.42Å; L31-V34 PolarHBondContact O-N 3.13Å; S32-V34 PolarHBondContact O-N 3.06Å; V34-G38 PolarHBondContact O-N 2.76Å; V34-F199 HydrophobicContact CG2-CD1 3.98Å; V34-F199 HydrophobicContact CG2-CE1 3.39Å; V34-F199 HydrophobicContact CG2-CZ 4.28Å; V34-A203 HydrophobicContact CB-CB 4.25Å; V34-A203 HydrophobicContact CG1-CB 4.04Å; V34-A203 HydrophobicContact CG2-CB 3.77Å; V34-E224 HydrophobicContact CG1-CB 3.99Å; V34-E224 HydrophobicContact CG1-CG 4.4Å; V34-E224 WeakPolarHBondContact CG1-OE2 3.34Å; V34-F228 HydrophobicContact CB-CE2 4.26Å; V34-F228 HydrophobicContact CG2-CE2 4.35Å
35T96.6Very high94.7Very high0 Ų013.4 Ų13.40%07%0.073CC..Hα-helixtrans-76.2-41.5176.8-55.70000112.3S32 Y33 G38 S39 C140 V141 L221 G225S32-T35 PolarHBondContact O-N 3.33Å; Y33-T35 PolarHBondContact O-N 2.92Å; T35-G38 PolarHBondContact O-N 3.01Å; T35-S39 WeakPolarHBondContact O-CB 3.38Å; T35-S39 PolarHBondContact O-N 3.16Å; T35-S39 PolarHBondContact O-OG 2.95Å; T35-C140 HydrophobicContact CG2-CB 4.17Å; T35-V141 HydrophobicContact CG2-CG2 4.4Å; T35-L221 WeakPolarHBondContact CG2-O 3.32Å; T35-L221 PolarHBondContact OG1-O 3.1Å; T35-G225 WeakPolarHBondContact OG1-CA 2.93Å; T35-G225 PolarHBondContact OG1-N 3.5Å
36V97.5Very high94.6Very high0 Ų013.3 Ų13.30%07%0.073CC..Hα-helixtrans-70-43.6-172.3173.10000112.1S32 Y33 S39 M40 L137 A168 Y171 L172S32-V36 WeakPolarHBondContact O-CG2 3.39Å; S32-V36 PolarHBondContact O-N 3.06Å; Y33-V36 PolarHBondContact O-N 3.3Å; V36-S39 PolarHBondContact O-N 2.72Å; V36-M40 WeakPolarHBondContact O-CB 3.49Å; V36-M40 PolarHBondContact O-N 3.27Å; V36-L137 HydrophobicContact CG2-CD1 4.08Å; V36-A168 HydrophobicContact CG1-CB 3.97Å; V36-Y171 HydrophobicContact CB-CD1 4.2Å; V36-Y171 HydrophobicContact CG1-CD1 3.95Å; V36-Y171 HydrophobicContact CG1-CG 4.21Å; V36-Y171 HydrophobicContact CG2-CD1 3.7Å; V36-Y171 HydrophobicContact CG2-CD2 4.17Å; V36-Y171 HydrophobicContact CG2-CE1 4.21Å; V36-Y171 HydrophobicContact CG2-CG 3.69Å; V36-L172 HydrophobicContact CG1-CD2 4.29Å
37S94.4Very high94.3Very high0 Ų014 Ų140%08%0.076CC..Hα-helixtrans-65.4-44175.3-68.50000111Y33 S39 M40 L41Y33-S37 WeakPolarHBondContact O-CB 3.33Å; Y33-S37 PolarHBondContact O-N 3.18Å; Y33-S37 PolarHBondContact O-OG 3.03Å; S37-S39 PolarHBondContact O-N 2.91Å; S37-M40 PolarHBondContact O-N 2.93Å; S37-L41 WeakPolarHBondContact O-CB 3.5Å; S37-L41 PolarHBondContact O-N 2.83Å
38G94.5Very high93.9Very high0 Ų011.6 Ų11.60%06%0.063CC..Hα-helixtrans-58.7-36.317600000112.8V34 T35 C42 Y217V34-G38 PolarHBondContact O-N 2.76Å; T35-G38 PolarHBondContact O-N 3.01Å; G38-C42 WeakPolarHBondContact O-CA 3.34Å; G38-C42 VanDerWaalsContact O-CB 3.25Å; G38-C42 WeakPolarHBondContact O-CB 3.48Å; G38-C42 PolarHBondContact O-N 2.68Å; G38-Y217 PolarHBondContact O-OH 3.49Å
39S96.6Very high93.3Very high0 Ų015.9 Ų15.90%08%0.082CC..Hα-helixtrans-71.6-44.1175.3-56.90000112.7T35 V36 S37 L41 C42 N144T35-S39 WeakPolarHBondContact O-CB 3.38Å; T35-S39 PolarHBondContact O-N 3.16Å; T35-S39 PolarHBondContact O-OG 2.95Å; V36-S39 PolarHBondContact O-N 2.72Å; S37-S39 PolarHBondContact O-N 2.91Å; S39-L41 VanDerWaalsContact C-N 3.32Å; S39-L41 PolarHBondContact O-N 3.29Å; S39-C42 PolarHBondContact O-SG 3.4Å; S39-N144 PolarHBondContact OG-ND2 3.01Å
40M93.8Very high92.6Very high0 Ų016.4 Ų16.40%09%0.085CC..Hα-helixtrans-71.1-28.8-178.9-176.458.176.200112.6V36 S37 V109 M110 A168 G169 L172 W197V36-M40 WeakPolarHBondContact O-CB 3.49Å; V36-M40 PolarHBondContact O-N 3.27Å; S37-M40 PolarHBondContact O-N 2.93Å; M40-V109 WeakPolarHBondContact O-CG1 3.42Å; M40-V109 HydrophobicContact SD-CG1 4.07Å; M40-M110 HydrophobicContact SD-SD 4.44Å; M40-A168 HydrophobicContact CB-CB 4.09Å; M40-A168 HydrophobicContact CE-CB 3.76Å; M40-G169 VanDerWaalsContact CE-N 3.28Å; M40-L172 HydrophobicContact CE-CD1 3.8Å; M40-L172 HydrophobicContact CG-CD1 4.43Å; M40-W197 HydrophobicContact CB-CH2 4.21Å; M40-W197 HydrophobicContact CB-CZ3 4.22Å; M40-W197 HydrophobicContact CG-CH2 3.82Å; M40-W197 HydrophobicContact CG-CZ3 4.12Å
41L91.8Very high91.8Very high23 Ų2320.8 Ų20.812%0.1211%0.108CC..THydrogen-bonded Turntrans-114.316.6-177.1-62.5178.3000112.8S37 S39 T43 V44 W197 M204S37-L41 WeakPolarHBondContact O-CB 3.5Å; S37-L41 PolarHBondContact O-N 2.83Å; S39-L41 VanDerWaalsContact C-N 3.32Å; S39-L41 PolarHBondContact O-N 3.29Å; L41-T43 PolarHBondContact O-N 3.27Å; L41-T43 VanDerWaalsContact O-N 3.11Å; L41-V44 HydrophobicContact CB-CG2 4.26Å; L41-V44 WeakPolarHBondContact O-CB 3.38Å; L41-V44 VanDerWaalsContact O-CG2 3.32Å; L41-V44 WeakPolarHBondContact O-CG2 3.33Å; L41-V44 PolarHBondContact O-N 2.91Å; L41-W197 HydrophobicContact CD1-CH2 4.02Å; L41-W197 HydrophobicContact CD1-CZ2 3.67Å; L41-W197 HydrophobicContact CD2-CH2 4.27Å; L41-W197 HydrophobicContact CD2-CZ2 4.25Å; L41-W197 HydrophobicContact CG-CH2 3.95Å; L41-W197 HydrophobicContact CG-CZ2 4.06Å; L41-M204 HydrophobicContact CB-CE 3.62Å; L41-M204 HydrophobicContact CB-SD 3.79Å; L41-M204 HydrophobicContact CD1-SD 3.96Å; L41-M204 HydrophobicContact CG-SD 4.47Å
42C93.2Very high90.8Very high0 Ų019.3 Ų19.30%010%0.101CC..THydrogen-bonded Turntrans-53.5-35.2-178.553.90000112.7G38 S39 V44 F45 D46 Y217G38-C42 WeakPolarHBondContact O-CA 3.34Å; G38-C42 VanDerWaalsContact O-CB 3.25Å; G38-C42 WeakPolarHBondContact O-CB 3.48Å; G38-C42 PolarHBondContact O-N 2.68Å; S39-C42 PolarHBondContact O-SG 3.4Å; C42-V44 PolarHBondContact O-N 3.22Å; C42-F45 PolarHBondContact O-N 3.2Å; C42-D46 WeakPolarHBondContact CB-OD2 3.45Å; C42-D46 PolarHBondContact O-N 3.37Å; C42-Y217 HydrophobicContact CB-CE1 4.4Å
43T91.7Very high89.8Confident13 Ų1326.2 Ų26.28%0.0813%0.131CC..Hα-helixtrans-64.6-13.2-179.959.50000115.1L41 F45 N47 M105 S106 V109 L161L41-T43 PolarHBondContact O-N 3.27Å; L41-T43 VanDerWaalsContact O-N 3.11Å; T43-F45 PolarHBondContact O-N 2.89Å; T43-N47 WeakPolarHBondContact CB-ND2 3.3Å; T43-N47 VanDerWaalsContact O-CB 3.28Å; T43-N47 WeakPolarHBondContact O-CB 3.48Å; T43-N47 PolarHBondContact O-N 3.28Å; T43-N47 PolarHBondContact O-ND2 3.06Å; T43-M105 HydrophobicContact CG2-CB 4.38Å; T43-S106 PolarHBondContact OG1-OG 3.49Å; T43-V109 HydrophobicContact CG2-CG2 3.82Å; T43-L161 HydrophobicContact CG2-CD1 4.34Å
44V89.1Confident88.7Confident53 Ų5327.7 Ų27.732%0.32114%0.144SC..Hα-helixtrans-60.3-38168.5174.50000110.8L41 C42 I332L41-V44 HydrophobicContact CB-CG2 4.26Å; L41-V44 WeakPolarHBondContact O-CB 3.38Å; L41-V44 VanDerWaalsContact O-CG2 3.32Å; L41-V44 WeakPolarHBondContact O-CG2 3.33Å; L41-V44 PolarHBondContact O-N 2.91Å; C42-V44 PolarHBondContact O-N 3.22Å; V44-I332 HydrophobicContact CG1-CD1 3.85Å; V44-I332 HydrophobicContact CG1-CG1 4.33Å
45F92Very high87.7Confident0 Ų027.3 Ų27.30%014%0.141CC..Hα-helixtrans-100.1-37.2179.5-55.8-60000112.1C42 T43 N47 L48 F85 S87 M204 A208 Y217 I332 F333 T336C42-F45 PolarHBondContact O-N 3.2Å; T43-F45 PolarHBondContact O-N 2.89Å; F45-N47 PolarHBondContact O-N 3.14Å; F45-L48 WeakPolarHBondContact O-CB 3.36Å; F45-L48 PolarHBondContact O-N 3.4Å; F45-L48 VanDerWaalsContact O-N 3.14Å; F45-F85 HydrophobicContact CB-CD1 4.05Å; F45-F85 HydrophobicContact CB-CE1 3.76Å; F45-F85 HydrophobicContact CB-CE2 4.44Å; F45-F85 HydrophobicContact CB-CG 4.49Å; F45-F85 HydrophobicContact CB-CZ 3.97Å; F45-S87 VanDerWaalsContact O-CB 3.22Å; F45-S87 WeakPolarHBondContact O-CB 3.39Å; F45-M204 HydrophobicContact CD2-CE 4.07Å; F45-M204 HydrophobicContact CE2-CE 3.49Å; F45-M204 VanDerWaalsContact CE2-CE 3.49Å; F45-M204 HydrophobicContact CZ-CE 4.39Å; F45-A208 HydrophobicContact CD1-CB 4Å; F45-A208 HydrophobicContact CD2-CB 3.57Å; F45-A208 HydrophobicContact CE1-CB 3.83Å; F45-A208 HydrophobicContact CE2-CB 3.35Å; F45-A208 HydrophobicContact CG-CB 3.89Å; F45-A208 HydrophobicContact CZ-CB 3.51Å; F45-Y217 HydrophobicContact CD2-CE1 4.2Å; F45-Y217 HydrophobicContact CD2-CE2 4.17Å; F45-Y217 AromaticContact CD2-CZ 3.8Å; F45-Y217 HydrophobicContact CE2-CE2 4.36Å; F45-I332 HydrophobicContact CD1-CG2 4.42Å; F45-I332 HydrophobicContact CE1-CG1 4.32Å; F45-I332 HydrophobicContact CE1-CG2 4.21Å; F45-F333 HydrophobicContact CD1-CD1 4.4Å; F45-F333 HydrophobicContact CD1-CE1 4.11Å; F45-F333 AromaticContact CE1-CD1 3.75Å; F45-F333 HydrophobicContact CE1-CD1 3.75Å; F45-F333 AromaticContact CE1-CE1 3.93Å; F45-F333 HydrophobicContact CE1-CE1 3.93Å; F45-F333 HydrophobicContact CZ-CD1 4.3Å; F45-T336 HydrophobicContact CZ-CG2 4.41Å
46D92.8Very high86.7Confident0 Ų033 Ų330%017%0.168CC..Hα-helixtrans-65.5-26.8-177.6-64.2-30.8000113.7C42 S87 L88 I89 M105 H218C42-D46 WeakPolarHBondContact CB-OD2 3.45Å; C42-D46 PolarHBondContact O-N 3.37Å; D46-S87 WeakPolarHBondContact O-CB 3.4Å; D46-L88 HydrophobicContact CB-CB 3.87Å; D46-L88 HydrophobicContact CB-CD2 4.48Å; D46-L88 PolarHBondContact O-N 3.08Å; D46-I89 PolarHBondContact O-N 3.27Å; D46-M105 HydrophobicContact CB-CE 4.02Å; D46-H218 IonicContact OD1-NE2 2.71Å; D46-H218 PolarHBondContact OD1-NE2 3.49Å; D46-H218 IonicContact OD2-CE1 3.79Å; D46-H218 IonicContact OD2-NE2 3.48Å; D46-H218 PolarHBondContact OD2-NE2 3.04Å
47N89.7Confident85.5Confident22 Ų2234.5 Ų34.512%0.11818%0.176CC..THydrogen-bonded Turntrans-97.55.7178.8-65.9-26.8000113.7T43 F45 K49 A102 M105 S106T43-N47 WeakPolarHBondContact CB-ND2 3.3Å; T43-N47 VanDerWaalsContact O-CB 3.28Å; T43-N47 WeakPolarHBondContact O-CB 3.48Å; T43-N47 PolarHBondContact O-N 3.28Å; T43-N47 PolarHBondContact O-ND2 3.06Å; F45-N47 PolarHBondContact O-N 3.14Å; N47-K49 PolarHBondContact O-N 2.97Å; N47-A102 HydrophobicContact CB-CB 3.81Å; N47-A102 PolarHBondContact ND2-O 2.95Å; N47-M105 WeakPolarHBondContact OD1-CE 3.48Å; N47-M105 PolarHBondContact OD1-SD 3.5Å; N47-M105 VanDerWaalsContact OD1-SD 3.38Å; N47-S106 PolarHBondContact ND2-OG 3.04Å
48L87.1Confident83.9Confident37 Ų3743.5 Ų43.519%0.19422%0.218CC..PPolyproline II helixtrans-64127.8-176.7-164.769000110.2F45 E84 F85 S87 I332F45-L48 WeakPolarHBondContact O-CB 3.36Å; F45-L48 PolarHBondContact O-N 3.4Å; F45-L48 VanDerWaalsContact O-N 3.14Å; L48-E84 HydrophobicContact CD2-CB 4.28Å; L48-F85 HydrophobicContact CD2-CB 3.76Å; L48-S87 WeakPolarHBondContact O-CB 3.01Å; L48-S87 PolarHBondContact O-OG 3.1Å; L48-I332 HydrophobicContact CD1-CD1 3.7Å; L48-I332 HydrophobicContact CD2-CG2 4.17Å
49K83.2Confident82.2Confident102 Ų10251.7 Ų51.744%0.44326%0.256SS..PPolyproline II helixtrans-89.2146.4177-66.7-174.5178.9-174.70110.6N47N47-K49 PolarHBondContact O-N 2.97Å
50P81.3Confident80.2Confident13 Ų1353.7 Ų53.78%0.08427%0.265CS..PPolyproline II helixtrans-66.6150.3172.726.6-30.9000110.9L73 L81 T83 V90P50-L73 HydrophobicContact CG-CD1 3.98Å; P50-L73 HydrophobicContact CG-CD2 3.57Å; P50-L73 HydrophobicContact CG-CG 4.45Å; P50-L81 HydrophobicContact CB-CB 4.1Å; P50-L81 HydrophobicContact CB-CD1 4.24Å; P50-L81 HydrophobicContact CB-CD2 4.47Å; P50-L81 HydrophobicContact CG-CD1 4.09Å; P50-T83 HydrophobicContact CB-CG2 3.77Å; P50-V90 HydrophobicContact CG-CG2 4.36Å
51I78.2Confident78.2Confident104 Ų10459 Ų5953%0.53329%0.293SS..EExtended strand (participates in β ladder)trans-90.2132.9171.8-58.5172.3000107.8K53 E82I51-K53 PolarHBondContact O-N 3.4Å; I51-E82 PolarHBondContact N-O 3.19Å; I51-E82 PolarHBondContact O-N 3.27Å
52V75.1Confident76.3Confident25 Ų2562.4 Ų62.415%0.15232%0.319CS..EExtended strand (participates in β ladder)trans-80117.5174.6-176.70000108.8I71 L73 A79 L81V52-I71 HydrophobicContact CB-CB 4.17Å; V52-I71 HydrophobicContact CB-CG2 4.38Å; V52-I71 HydrophobicContact CG1-CB 3.93Å; V52-I71 HydrophobicContact CG1-CD1 4.34Å; V52-I71 HydrophobicContact CG1-CG2 3.77Å; V52-L73 VanDerWaalsContact CG2-CA 3.49Å; V52-L73 HydrophobicContact CG2-CB 3.82Å; V52-L73 HydrophobicContact CG2-CD1 3.71Å; V52-L73 HydrophobicContact CG2-CG 4.42Å; V52-A79 HydrophobicContact CG1-CB 4.14Å; V52-L81 HydrophobicContact CG2-CD2 4.18Å
53K76.3Confident74.3Confident145 Ų14567.5 Ų67.563%0.6335%0.346SS*.EExtended strand (participates in β ladder)trans-89.3-43.4-179.7-166.4176.6-166.8140.50112.2I51 T80 E82I51-K53 PolarHBondContact O-N 3.4Å; K53-T80 PolarHBondContact N-O 3.12Å; K53-E82 WeakPolarHBondContact CD-OE2 2.98Å; K53-E82 IonicContact NZ-OE2 3.22Å; K53-E82 PolarHBondContact NZ-OE2 3.35Å
54A73.1Confident72.5Confident32 Ų3270.4 Ų70.426%0.26436%0.36SS..EExtended strand (participates in β ladder)trans-149.9155.6172.600000110.3A79 T80A54-A79 CarbonylContact O-C 3.4Å; A54-A79 WeakPolarHBondContact O-CA 3.45Å; A54-T80 WeakPolarHBondContact CB-OG1 3.5Å; A54-T80 PolarHBondContact N-OG1 3.3Å; A54-T80 PolarHBondContact O-N 3.2Å; A54-T80 PolarHBondContact O-OG1 3.17Å
55C73.1Confident70.6Confident4 Ų476.1 Ų76.13%0.02738%0.383CS..EExtended strand (participates in β ladder)trans-118.6127.6172-175.30000108.9F60 I71 C76C55-F60 HydrophobicContact CB-CD1 4.38Å; C55-I71 HydrophobicContact CB-CD1 4.49Å; C55-I71 HydrophobicContact CB-CG2 4.37Å; C55-C76 WeakPolarHBondContact CA-SG 3.35Å; C55-C76 HydrophobicContact CB-CB 3.85Å; C55-C76 WeakPolarHBondContact CB-SG 3.49Å; C55-C76 WeakPolarHBondContact SG-CB 3.28Å; C55-C76 CovalentContact SG-SG 2.01Å; C55-C76 PolarHBondContact SG-SG 3.42Å
56H75.2Confident68.4Low120 Ų12083.5 Ų83.556%0.55642%0.423SS*.  trans-106.119.9-177.7-63.5-64.9000113.5N78H56-N78 HydrophobicContact CB-CB 4.14Å; H56-N78 PolarHBondContact N-O 3.27Å
57D72.8Confident66Low31 Ų3185.7 Ų85.717%0.16644%0.441CS..  trans-79.8126.1173.7-65.5-24.8000108.9E59 F60 C76 K77 N78D57-E59 PolarHBondContact O-N 3.38Å; D57-F60 PolarHBondContact O-N 2.93Å; D57-C76 WeakPolarHBondContact OD2-CA 3.26Å; D57-K77 PolarHBondContact OD2-N 3.36Å; D57-N78 WeakPolarHBondContact OD1-CB 3.38Å; D57-N78 PolarHBondContact OD1-N 3.13Å; D57-N78 VanDerWaalsContact OD1-N 3.17Å
58E60.9Low64Low189 Ų18991.3 Ų91.388%0.88348%0.482SS*.THydrogen-bonded Turntrans-55.1-25.5-177.1-69.1-176.2163.600113.3F60E58-F60 VanDerWaalsContact C-N 3.33Å
59E58.7Low62.3Low173 Ų17394.3 Ų94.381%0.80850%0.502SS*.THydrogen-bonded Turntrans-72.1-23.8176.2-118.6177173.300113.3D57 S62D57-E59 PolarHBondContact O-N 3.38Å; E59-S62 PolarHBondContact O-OG 2.92Å
60F55.8Low61.1Low42 Ų4295 Ų9518%0.18452%0.519CS..THydrogen-bonded Turntrans-96.1-18.4-169.9-134.6-91.8000114.2C55 D57 E58 S62 L63 I64 I71 K75C55-F60 HydrophobicContact CB-CD1 4.38Å; D57-F60 PolarHBondContact O-N 2.93Å; E58-F60 VanDerWaalsContact C-N 3.33Å; F60-S62 PolarHBondContact O-N 3.45Å; F60-S62 VanDerWaalsContact O-N 3.16Å; F60-L63 HydrophobicContact CD2-CD1 4.43Å; F60-L63 HydrophobicContact CE2-CD1 4.38Å; F60-L63 PolarHBondContact O-N 3.2Å; F60-I64 HydrophobicContact CD1-CD1 4.02Å; F60-I64 HydrophobicContact CD1-CG1 3.87Å; F60-I64 HydrophobicContact CE1-CG1 4.32Å; F60-I64 PolarHBondContact O-N 3.42Å; F60-I71 HydrophobicContact CE1-CG1 4.29Å; F60-I71 HydrophobicContact CE1-CG2 3.96Å; F60-I71 HydrophobicContact CZ-CG2 4.34Å; F60-K75 HydrophobicContact CE2-CB 4.41Å
61D51.8Low60.1Low110 Ų11096.3 Ų96.359%0.58853%0.525SS*.THydrogen-bonded Turntrans-60.6-24.5176.7-93-19.8000112.6
62S51Low59.6Low95 Ų9595 Ų9566%0.66452%0.52SS*.THydrogen-bonded Turntrans-77.3-19.1175.869.30000114.6E59 F60E59-S62 PolarHBondContact O-OG 2.92Å; F60-S62 PolarHBondContact O-N 3.45Å; F60-S62 VanDerWaalsContact O-N 3.16Å
63L51.3Low59.3Low108 Ų10895.1 Ų95.157%0.56552%0.519SS*.THydrogen-bonded Turntrans-97.6-24.5-174.9-81.2158.8000113.6F60 Q65F60-L63 HydrophobicContact CD2-CD1 4.43Å; F60-L63 HydrophobicContact CE2-CD1 4.38Å; F60-L63 PolarHBondContact O-N 3.2Å; L63-Q65 VanDerWaalsContact C-N 3.34Å; L63-Q65 PolarHBondContact O-N 2.95Å
64I53.6Low59.2Low73 Ų7391.1 Ų91.137%0.37451%0.508SS..G310 helixtrans-73.2-25.1-173.1-65.6173.1000112.3F60 N66 I71F60-I64 HydrophobicContact CD1-CD1 4.02Å; F60-I64 HydrophobicContact CD1-CG1 3.87Å; F60-I64 HydrophobicContact CE1-CG1 4.32Å; F60-I64 PolarHBondContact O-N 3.42Å; I64-N66 VanDerWaalsContact C-N 3.29Å; I64-N66 PolarHBondContact O-N 3.25Å; I64-I71 HydrophobicContact CD1-CD1 3.92Å; I64-I71 HydrophobicContact CG1-CD1 4.28Å
65Q50.2Low59.2Low173 Ų17396.3 Ų96.381%0.80853%0.525SS*.G310 helixtrans-71.5-16.4-175-76.7-174.6-9.700114.9L63L63-Q65 VanDerWaalsContact C-N 3.34Å; L63-Q65 PolarHBondContact O-N 2.95Å
66N44.5Very low59.2Low156 Ų15696.6 Ų96.683%0.83453%0.527SS*.G310 helixtrans-121.23.8-171-78.6-20.8000116.1I64I64-N66 VanDerWaalsContact C-N 3.29Å; I64-N66 PolarHBondContact O-N 3.25Å
67A43.9Very low59.2Low46 Ų46100 Ų10038%0.3854%0.54SS..  trans-142.2121.3-177.700000113T69A67-T69 HydrophobicContact CB-CG2 4.06Å; A67-T69 WeakPolarHBondContact CB-OG1 3.41Å; A67-T69 PolarHBondContact O-N 3.29Å
68S48Very low59.3Low139 Ų139103.4 Ų103.497%0.97256%0.558SS**  trans-67.641.5160.150.90000111.6
69T51.5Low60.1Low101 Ų10195.7 Ų95.762%0.6253%0.527SS*.  trans-107.7125.8179.649.10000109.2A67 I71A67-T69 HydrophobicContact CB-CG2 4.06Å; A67-T69 WeakPolarHBondContact CB-OG1 3.41Å; A67-T69 PolarHBondContact O-N 3.29Å; T69-I71 PolarHBondContact O-N 3.27Å
70S56.9Low61.1Low116 Ų11690.2 Ų90.281%0.81151%0.505SS*.  trans-48123.3174.453.20000111.5D72S70-D72 PolarHBondContact O-N 3.46Å
71I60.7Low62.1Low41 Ų4192.3 Ų92.321%0.2152%0.518CS..  trans-62.8123175.6-59.2171.3000108.3V52 C55 F60 I64 T69 L73 C76V52-I71 HydrophobicContact CB-CB 4.17Å; V52-I71 HydrophobicContact CB-CG2 4.38Å; V52-I71 HydrophobicContact CG1-CB 3.93Å; V52-I71 HydrophobicContact CG1-CD1 4.34Å; V52-I71 HydrophobicContact CG1-CG2 3.77Å; C55-I71 HydrophobicContact CB-CD1 4.49Å; C55-I71 HydrophobicContact CB-CG2 4.37Å; F60-I71 HydrophobicContact CE1-CG1 4.29Å; F60-I71 HydrophobicContact CE1-CG2 3.96Å; F60-I71 HydrophobicContact CZ-CG2 4.34Å; I64-I71 HydrophobicContact CD1-CD1 3.92Å; I64-I71 HydrophobicContact CG1-CD1 4.28Å; T69-I71 PolarHBondContact O-N 3.27Å; I71-L73 PolarHBondContact O-N 3.16Å; I71-C76 HydrophobicContact CG2-CB 4.49Å
72D66.8Low63.4Low77 Ų7791.9 Ų91.941%0.41251%0.512SS..  trans-70.4111.6176.7-172.2-6.2000109.3S70 C74 K75S70-D72 PolarHBondContact O-N 3.46Å; D72-C74 PolarHBondContact O-N 2.86Å; D72-C74 PolarHBondContact OD1-N 2.89Å; D72-K75 HydrophobicContact CB-CB 4.38Å; D72-K75 HydrophobicContact CB-CD 3.98Å; D72-K75 HydrophobicContact CB-CG 3.99Å; D72-K75 PolarHBondContact O-N 3.35Å; D72-K75 WeakPolarHBondContact OD2-CE 3.4Å
73L69.5Low64.8Low26 Ų2690.7 Ų90.714%0.13650%0.501CS..THydrogen-bonded Turntrans-42-34178.7177.968.4000113.3P50 V52 I71 L81 A95P50-L73 HydrophobicContact CG-CD1 3.98Å; P50-L73 HydrophobicContact CG-CD2 3.57Å; P50-L73 HydrophobicContact CG-CG 4.45Å; V52-L73 VanDerWaalsContact CG2-CA 3.49Å; V52-L73 HydrophobicContact CG2-CB 3.82Å; V52-L73 HydrophobicContact CG2-CD1 3.71Å; V52-L73 HydrophobicContact CG2-CG 4.42Å; I71-L73 PolarHBondContact O-N 3.16Å; L73-L81 HydrophobicContact CD1-CD1 3.93Å; L73-L81 HydrophobicContact CD1-CD2 3.12Å; L73-L81 HydrophobicContact CD1-CG 4.16Å; L73-A95 HydrophobicContact CD2-CB 4.04Å
74C73.8Confident66.3Low61 Ų6188.6 Ų88.641%0.41249%0.489SS..THydrogen-bonded Turntrans-95.6-3.3-169-52.90000114.1D72 C96D72-C74 PolarHBondContact O-N 2.86Å; D72-C74 PolarHBondContact OD1-N 2.89Å; C74-C96 WeakPolarHBondContact CA-SG 3.23Å; C74-C96 HydrophobicContact CB-CB 3.75Å; C74-C96 WeakPolarHBondContact CB-SG 3.16Å; C74-C96 WeakPolarHBondContact SG-CA 3.31Å; C74-C96 WeakPolarHBondContact SG-CB 3.41Å; C74-C96 CovalentContact SG-SG 2.05Å; C74-C96 PolarHBondContact SG-SG 3.4Å
75K73.7Confident68Low142 Ų14285.2 Ų85.262%0.61747%0.471SS*.THydrogen-bonded Turntrans-95.7-23.5172.4-64.1-174-176.3178.20112.2F60 D72F60-K75 HydrophobicContact CE2-CB 4.41Å; D72-K75 HydrophobicContact CB-CB 4.38Å; D72-K75 HydrophobicContact CB-CD 3.98Å; D72-K75 HydrophobicContact CB-CG 3.99Å; D72-K75 PolarHBondContact O-N 3.35Å; D72-K75 WeakPolarHBondContact OD2-CE 3.4Å
76C73.8Confident70Confident9 Ų979.1 Ų79.16%0.06144%0.444CS..  trans-96.1114.2178.3-172.80000111.1C55 D57 I71 N78 A79C55-C76 WeakPolarHBondContact CA-SG 3.35Å; C55-C76 HydrophobicContact CB-CB 3.85Å; C55-C76 WeakPolarHBondContact CB-SG 3.49Å; C55-C76 WeakPolarHBondContact SG-CB 3.28Å; C55-C76 CovalentContact SG-SG 2.01Å; C55-C76 PolarHBondContact SG-SG 3.42Å; D57-C76 WeakPolarHBondContact OD2-CA 3.26Å; I71-C76 HydrophobicContact CG2-CB 4.49Å; C76-N78 VanDerWaalsContact SG-C 3.51Å; C76-A79 HydrophobicContact CB-CB 3.95Å; C76-A79 VanDerWaalsContact SG-CA 3.56Å; C76-A79 PolarHBondContact SG-N 3.45Å; C76-A79 VanDerWaalsContact SG-N 3.37Å
77K73.3Confident72.3Confident192 Ų19271.7 Ų71.784%0.83540%0.404SS*.THydrogen-bonded Turntrans-72.4-44.5175.3-77.8179.8178.3172.50111.3D57 A79D57-K77 PolarHBondContact OD2-N 3.36Å; K77-A79 PolarHBondContact O-N 2.97Å
78N76.2Confident74.6Confident102 Ų10269.5 Ų69.555%0.54539%0.386SS..THydrogen-bonded Turntrans-101.458.5178.4-70.4-20.8000112H56 D57 C76H56-N78 HydrophobicContact CB-CB 4.14Å; H56-N78 PolarHBondContact N-O 3.27Å; D57-N78 WeakPolarHBondContact OD1-CB 3.38Å; D57-N78 PolarHBondContact OD1-N 3.13Å; D57-N78 VanDerWaalsContact OD1-N 3.17Å; C76-N78 VanDerWaalsContact SG-C 3.51Å
79A77.8Confident76.7Confident27 Ų2762.9 Ų62.922%0.22334%0.34CS..EExtended strand (participates in β ladder)trans-82.6133.6175.800000111.4V52 A54 C76 K77 L81V52-A79 HydrophobicContact CG1-CB 4.14Å; A54-A79 CarbonylContact O-C 3.4Å; A54-A79 WeakPolarHBondContact O-CA 3.45Å; C76-A79 HydrophobicContact CB-CB 3.95Å; C76-A79 VanDerWaalsContact SG-CA 3.56Å; C76-A79 PolarHBondContact SG-N 3.45Å; C76-A79 VanDerWaalsContact SG-N 3.37Å; K77-A79 PolarHBondContact O-N 2.97Å; A79-L81 HydrophobicContact CB-CD2 3.69Å; A79-L81 HydrophobicContact CB-CG 4.43Å
80T78.6Confident78.5Confident58 Ų5860.1 Ų60.136%0.35632%0.323SS..EExtended strand (participates in β ladder)trans-83121.6160.351.50000108.9K53 A54K53-T80 PolarHBondContact N-O 3.12Å; A54-T80 WeakPolarHBondContact CB-OG1 3.5Å; A54-T80 PolarHBondContact N-OG1 3.3Å; A54-T80 PolarHBondContact O-N 3.2Å; A54-T80 PolarHBondContact O-OG1 3.17Å
81L77.5Confident80.1Confident87 Ų8759.3 Ų59.346%0.45531%0.306SS..EExtended strand (participates in β ladder)trans-105.5134-173.7-56.6-175.8000110.7P50 V52 L73 A79P50-L81 HydrophobicContact CB-CB 4.1Å; P50-L81 HydrophobicContact CB-CD1 4.24Å; P50-L81 HydrophobicContact CB-CD2 4.47Å; P50-L81 HydrophobicContact CG-CD1 4.09Å; V52-L81 HydrophobicContact CG2-CD2 4.18Å; L73-L81 HydrophobicContact CD1-CD1 3.93Å; L73-L81 HydrophobicContact CD1-CD2 3.12Å; L73-L81 HydrophobicContact CD1-CG 4.16Å; A79-L81 HydrophobicContact CB-CD2 3.69Å; A79-L81 HydrophobicContact CB-CG 4.43Å
82E80Confident81.5Confident100 Ų10058.7 Ų58.747%0.46730%0.303SS..EExtended strand (participates in β ladder)trans-107.8113.4169.2-167.7164.9164.700108.7I51 K53I51-E82 PolarHBondContact N-O 3.19Å; I51-E82 PolarHBondContact O-N 3.27Å; K53-E82 WeakPolarHBondContact CD-OE2 2.98Å; K53-E82 IonicContact NZ-OE2 3.22Å; K53-E82 PolarHBondContact NZ-OE2 3.35Å
83T78.5Confident82.5Confident70 Ų7058 Ų5843%0.42931%0.314SS..  trans-103.5114.2177.250.80000109.9P50 F85P50-T83 HydrophobicContact CB-CG2 3.77Å; T83-F85 PolarHBondContact O-N 3.1Å
84E83.1Confident83.3Confident64 Ų6458.8 Ų58.830%0.29932%0.316SS..SBendtrans-65.3-27.5168.6-67.2-160.4147.100111.9L48 R212 I332 F333L48-E84 HydrophobicContact CD2-CB 4.28Å; E84-R212 WeakPolarHBondContact O-CD 3.45Å; E84-R212 PolarHBondContact O-NH1 2.86Å; E84-I332 PolarHBondContact OE2-N 3.28Å; E84-F333 HydrophobicContact CB-CE2 4.35Å
85F89.4Confident83.5Confident3 Ų356.8 Ų56.81%0.01330%0.304CS..SBendtrans-149.1130.1-178.9-168.8-93.9000109.9F45 L48 T83 S87 A208 R213 W214 Y217 F333F45-F85 HydrophobicContact CB-CD1 4.05Å; F45-F85 HydrophobicContact CB-CE1 3.76Å; F45-F85 HydrophobicContact CB-CE2 4.44Å; F45-F85 HydrophobicContact CB-CG 4.49Å; F45-F85 HydrophobicContact CB-CZ 3.97Å; L48-F85 HydrophobicContact CD2-CB 3.76Å; T83-F85 PolarHBondContact O-N 3.1Å; F85-S87 PolarHBondContact O-N 2.61Å; F85-S87 VanDerWaalsContact O-N 3.1Å; F85-A208 HydrophobicContact CE2-CB 4.07Å; F85-R213 VanDerWaalsContact CZ-C 3.46Å; F85-W214 HydrophobicContact CE1-CB 4Å; F85-Y217 HydrophobicContact CZ-CD1 4.5Å; F85-Y217 HydrophobicContact CZ-CG 4.13Å; F85-F333 HydrophobicContact CB-CZ 4.06Å; F85-F333 AromaticContact CD2-CE1 3.86Å; F85-F333 HydrophobicContact CD2-CE1 3.86Å; F85-F333 AromaticContact CD2-CZ 3.9Å; F85-F333 HydrophobicContact CD2-CZ 3.9Å; F85-F333 HydrophobicContact CG-CZ 4.44Å
86D91.9Very high83.6Confident44 Ų4453 Ų5324%0.23530%0.295CS..BIsolated β-bridgetrans-75.193.5173.5178.519.6000108.8R212 R213 W214D86-R212 PolarHBondContact N-O 2.83Å; D86-R213 HydrophobicContact CB-CB 4.08Å; D86-R213 HydrophobicContact CB-CG 3.98Å; D86-R213 WeakPolarHBondContact O-CA 3.16Å; D86-R213 IonicContact OD2-CZ 2.69Å; D86-R213 IonicContact OD2-NE 3.82Å; D86-R213 PolarHBondContact OD2-NE 3.26Å; D86-R213 VanDerWaalsContact OD2-NE 3.1Å; D86-R213 IonicContact OD2-NH2 3.26Å; D86-R213 PolarHBondContact OD2-NH2 3.39Å; D86-W214 PolarHBondContact O-N 2.85Å
87S93.2Very high83.1Confident0 Ų059.5 Ų59.50%032%0.322CS..  trans-88.8156.7-167.566.90000113.3F45 D46 L48 F85 I89 V90 H91F45-S87 VanDerWaalsContact O-CB 3.22Å; F45-S87 WeakPolarHBondContact O-CB 3.39Å; D46-S87 WeakPolarHBondContact O-CB 3.4Å; L48-S87 WeakPolarHBondContact O-CB 3.01Å; L48-S87 PolarHBondContact O-OG 3.1Å; F85-S87 PolarHBondContact O-N 2.61Å; F85-S87 VanDerWaalsContact O-N 3.1Å; S87-I89 VanDerWaalsContact C-N 3.28Å; S87-I89 PolarHBondContact O-N 3.35Å; S87-I89 WeakPolarHBondContact OG-CG2 3.4Å; S87-V90 PolarHBondContact O-N 2.5Å; S87-V90 VanDerWaalsContact O-N 3.13Å; S87-V90 VanDerWaalsContact OG-CG2 3.27Å; S87-V90 WeakPolarHBondContact OG-CG2 3.43Å; S87-H91 PolarHBondContact O-N 3.01Å
88L93.3Very high82.5Confident0 Ų052.1 Ų52.10%030%0.3CS..Hα-helixtrans-62.8-34.5-179.4-177.553.3000112.4D46 V90 H91 L92 M105 A151 V157 W214D46-L88 HydrophobicContact CB-CB 3.87Å; D46-L88 HydrophobicContact CB-CD2 4.48Å; D46-L88 PolarHBondContact O-N 3.08Å; L88-V90 VanDerWaalsContact C-N 3.3Å; L88-V90 PolarHBondContact O-N 3.19Å; L88-H91 PolarHBondContact O-N 3.18Å; L88-L92 HydrophobicContact CD1-CD1 4.24Å; L88-L92 HydrophobicContact CD1-CG 4.14Å; L88-L92 HydrophobicContact CG-CD1 4.24Å; L88-L92 WeakPolarHBondContact O-CG 3.38Å; L88-L92 PolarHBondContact O-N 3.29Å; L88-M105 HydrophobicContact CB-CE 4.26Å; L88-M105 HydrophobicContact CD2-CE 3.89Å; L88-M105 HydrophobicContact CG-CE 4.06Å; L88-A151 HydrophobicContact CD1-CB 4.25Å; L88-V157 HydrophobicContact CD1-CG2 4.32Å; L88-V157 HydrophobicContact CD2-CG1 3.55Å; L88-V157 HydrophobicContact CD2-CG2 4.27Å; L88-V157 HydrophobicContact CG-CG1 4.29Å; L88-W214 HydrophobicContact CB-CB 4.13Å; L88-W214 HydrophobicContact CB-CD2 4.1Å; L88-W214 HydrophobicContact CB-CE3 4.37Å; L88-W214 HydrophobicContact CB-CG 3.97Å; L88-W214 HydrophobicContact CD1-CD2 3.72Å; L88-W214 HydrophobicContact CD1-CE3 3.72Å; L88-W214 HydrophobicContact CD1-CG 4.41Å; L88-W214 HydrophobicContact CD1-CH2 4.06Å; L88-W214 HydrophobicContact CD1-CZ2 4Å; L88-W214 HydrophobicContact CD1-CZ3 3.9Å; L88-W214 HydrophobicContact CD2-CE3 4.37Å; L88-W214 HydrophobicContact CG-CD2 4.41Å; L88-W214 HydrophobicContact CG-CE3 4.37Å
89I90.5Very high82.2Confident1 Ų151.4 Ų51.41%0.00530%0.303CS..Hα-helixtrans-65.4-33.9176.3-163.6169.9000112.4D46 S87 F94 A95 V101 A102D46-I89 PolarHBondContact O-N 3.27Å; S87-I89 VanDerWaalsContact C-N 3.28Å; S87-I89 PolarHBondContact O-N 3.35Å; S87-I89 WeakPolarHBondContact OG-CG2 3.4Å; I89-F94 HydrophobicContact CG1-CB 3.85Å; I89-F94 PolarHBondContact O-N 3.29Å; I89-A95 PolarHBondContact O-N 3.12Å; I89-V101 HydrophobicContact CD1-CB 4.42Å; I89-V101 HydrophobicContact CD1-CG1 4.43Å; I89-V101 HydrophobicContact CG1-CG1 4.49Å; I89-A102 HydrophobicContact CD1-CB 3.94Å
90V89.6Confident82.4Confident43 Ų4358.4 Ų58.426%0.26133%0.325SS..Hα-helixtrans-71.3-45.7174.2173.60000109.9P50 S87 L88 L92 G93 A95P50-V90 HydrophobicContact CG-CG2 4.36Å; S87-V90 PolarHBondContact O-N 2.5Å; S87-V90 VanDerWaalsContact O-N 3.13Å; S87-V90 VanDerWaalsContact OG-CG2 3.27Å; S87-V90 WeakPolarHBondContact OG-CG2 3.43Å; L88-V90 VanDerWaalsContact C-N 3.3Å; L88-V90 PolarHBondContact O-N 3.19Å; V90-L92 VanDerWaalsContact C-N 3.29Å; V90-L92 PolarHBondContact O-N 3.36Å; V90-G93 PolarHBondContact O-N 3Å; V90-A95 HydrophobicContact CG2-CB 4.08Å
91H90.7Very high82.9Confident99 Ų9956 Ų5646%0.45831%0.311SS..Hα-helixtrans-55.9-41.1177.8177.265.5000113.3S87 L88 G93 W214S87-H91 PolarHBondContact O-N 3.01Å; L88-H91 PolarHBondContact O-N 3.18Å; H91-G93 PolarHBondContact O-N 2.87Å; H91-W214 VanDerWaalsContact CB-NE1 3.31Å; H91-W214 AromaticContact CD2-CE2 3.83Å; H91-W214 AromaticContact CD2-CZ2 3.42Å; H91-W214 VanDerWaalsContact CD2-CZ2 3.42Å; H91-W214 WeakPolarHBondContact CD2-CZ2 3.43Å; H91-W214 AromaticContact CD2-NE1 3.9Å; H91-W214 AromaticContact CG-CE2 3.85Å; H91-W214 AromaticContact CG-CZ2 3.86Å; H91-W214 AromaticContact CG-NE1 3.43Å; H91-W214 AromaticContact ND1-NE1 3.99Å; H91-W214 AromaticContact NE2-CZ2 3.71Å
92L90.8Very high83.3Confident28 Ų2852.6 Ų52.615%0.14730%0.295CS..THydrogen-bonded Turntrans-78.9-0.7178.5-65.7172.3000113.9L88 V90 F94 L154 V157L88-L92 HydrophobicContact CD1-CD1 4.24Å; L88-L92 HydrophobicContact CD1-CG 4.14Å; L88-L92 HydrophobicContact CG-CD1 4.24Å; L88-L92 WeakPolarHBondContact O-CG 3.38Å; L88-L92 PolarHBondContact O-N 3.29Å; V90-L92 VanDerWaalsContact C-N 3.29Å; V90-L92 PolarHBondContact O-N 3.36Å; L92-F94 VanDerWaalsContact C-N 3.32Å; L92-F94 HydrophobicContact CB-CD2 3.46Å; L92-F94 VanDerWaalsContact CB-CD2 3.46Å; L92-F94 HydrophobicContact CB-CE2 3.85Å; L92-F94 HydrophobicContact CD1-CD2 4.36Å; L92-F94 WeakPolarHBondContact O-CD2 3.33Å; L92-F94 WeakPolarHBondContact O-CE2 3.43Å; L92-F94 PolarHBondContact O-N 3.49Å; L92-L154 HydrophobicContact CD1-CD1 4.28Å; L92-V157 HydrophobicContact CD1-CB 4.41Å; L92-V157 HydrophobicContact CD1-CG1 4.43Å; L92-V157 HydrophobicContact CD1-CG2 4.12Å; L92-V157 HydrophobicContact CD2-CG2 4.46Å
93G87.1Confident83.5Confident61 Ų6151.6 Ų51.663%0.62930%0.296SS*.THydrogen-bonded Turntrans72.820.3-178.200000114.4V90 H91V90-G93 PolarHBondContact O-N 3Å; H91-G93 PolarHBondContact O-N 2.87Å
94F85.9Confident84Confident44 Ų4449.5 Ų49.519%0.19328%0.284CS..  trans-10210.9-179.6-66.5-71.5000113.7I89 L92 C96 K97 V101 L154I89-F94 HydrophobicContact CG1-CB 3.85Å; I89-F94 PolarHBondContact O-N 3.29Å; L92-F94 VanDerWaalsContact C-N 3.32Å; L92-F94 HydrophobicContact CB-CD2 3.46Å; L92-F94 VanDerWaalsContact CB-CD2 3.46Å; L92-F94 HydrophobicContact CB-CE2 3.85Å; L92-F94 HydrophobicContact CD1-CD2 4.36Å; L92-F94 WeakPolarHBondContact O-CD2 3.33Å; L92-F94 WeakPolarHBondContact O-CE2 3.43Å; L92-F94 PolarHBondContact O-N 3.49Å; F94-C96 PolarHBondContact O-N 3.02Å; F94-K97 HydrophobicContact CD1-CB 3.89Å; F94-K97 HydrophobicContact CD1-CD 3.74Å; F94-K97 HydrophobicContact CD1-CG 4.37Å; F94-K97 HydrophobicContact CE1-CD 3.88Å; F94-K97 PolarHBondContact O-N 3.05Å; F94-K97 VanDerWaalsContact O-N 3.13Å; F94-V101 HydrophobicContact CB-CB 4.3Å; F94-V101 HydrophobicContact CB-CG1 4Å; F94-V101 HydrophobicContact CB-CG2 4.24Å; F94-V101 HydrophobicContact CD1-CG2 4.03Å; F94-V101 HydrophobicContact CD2-CG1 4.37Å; F94-V101 HydrophobicContact CG-CG1 4.16Å; F94-V101 HydrophobicContact CG-CG2 4.19Å; F94-L154 HydrophobicContact CE2-CB 3.98Å; F94-L154 HydrophobicContact CE2-CD2 4.28Å; F94-L154 HydrophobicContact CZ-CB 4.38Å; F94-L154 HydrophobicContact CZ-CD2 4.27Å
95A78.7Confident84.5Confident18 Ų1846.5 Ų46.515%0.14927%0.27CS..SBendtrans-51.1-32.5176.700000112.6L73 I89 V90L73-A95 HydrophobicContact CD2-CB 4.04Å; I89-A95 PolarHBondContact O-N 3.12Å; V90-A95 HydrophobicContact CG2-CB 4.08Å
96C75.2Confident84.5Confident64 Ų6448.1 Ų48.143%0.43228%0.281SS..SBendtrans-100.3-16.8180-86.60000117.7C74 F94 G98C74-C96 WeakPolarHBondContact CA-SG 3.23Å; C74-C96 HydrophobicContact CB-CB 3.75Å; C74-C96 WeakPolarHBondContact CB-SG 3.16Å; C74-C96 WeakPolarHBondContact SG-CA 3.31Å; C74-C96 WeakPolarHBondContact SG-CB 3.41Å; C74-C96 CovalentContact SG-SG 2.05Å; C74-C96 PolarHBondContact SG-SG 3.4Å; F94-C96 PolarHBondContact O-N 3.02Å; C96-G98 VanDerWaalsContact C-N 3.27Å; C96-G98 PolarHBondContact O-N 2.91Å
97K63.2Low84.4Confident145 Ų14549 Ų4963%0.6329%0.289SS*.SBendtrans-85.674.8178.6-84.1-176.4173179.10110.2F94F94-K97 HydrophobicContact CD1-CB 3.89Å; F94-K97 HydrophobicContact CD1-CD 3.74Å; F94-K97 HydrophobicContact CD1-CG 4.37Å; F94-K97 HydrophobicContact CE1-CD 3.88Å; F94-K97 PolarHBondContact O-N 3.05Å; F94-K97 VanDerWaalsContact O-N 3.13Å
98G60.9Low84.4Confident36 Ų3649.5 Ų49.537%0.37129%0.292SS..Hα-helixtrans62.9156.715800000117.5C96 Y100C96-G98 VanDerWaalsContact C-N 3.27Å; C96-G98 PolarHBondContact O-N 2.91Å; G98-Y100 PolarHBondContact O-N 3.05Å
99S70Confident84.4Confident88 Ų8849.5 Ų49.562%0.61529%0.292SS*.Hα-helixtrans-53.4-18.4165.748.50000113.3T103S99-T103 VanDerWaalsContact O-CB 3.27Å; S99-T103 WeakPolarHBondContact O-CB 3.17Å; S99-T103 PolarHBondContact O-N 3.38Å; S99-T103 PolarHBondContact O-OG1 3.24Å
100Y82Confident84.5Confident173 Ų17350.7 Ų50.768%0.67830%0.298SS*.Hα-helixtrans-61-49.7-178.3-178-99.9000114.1G98 A102 T103 S104G98-Y100 PolarHBondContact O-N 3.05Å; Y100-A102 PolarHBondContact O-N 3.27Å; Y100-T103 CarbonylContact O-C 3.2Å; Y100-T103 WeakPolarHBondContact O-CB 3.48Å; Y100-T103 PolarHBondContact O-N 2.93Å; Y100-T103 VanDerWaalsContact O-N 3.16Å; Y100-S104 PolarHBondContact O-N 3.45Å; Y100-S104 PolarHBondContact O-OG 3.01Å
101V88.8Confident84.6Confident9 Ų950.5 Ų50.56%0.05530%0.301CS..Hα-helixtrans-64.4-46.9-175.2177.20000111I89 F94 T103 S104 M105 L154I89-V101 HydrophobicContact CD1-CB 4.42Å; I89-V101 HydrophobicContact CD1-CG1 4.43Å; I89-V101 HydrophobicContact CG1-CG1 4.49Å; F94-V101 HydrophobicContact CB-CB 4.3Å; F94-V101 HydrophobicContact CB-CG1 4Å; F94-V101 HydrophobicContact CB-CG2 4.24Å; F94-V101 HydrophobicContact CD1-CG2 4.03Å; F94-V101 HydrophobicContact CD2-CG1 4.37Å; F94-V101 HydrophobicContact CG-CG1 4.16Å; F94-V101 HydrophobicContact CG-CG2 4.19Å; V101-T103 VanDerWaalsContact C-N 3.29Å; V101-T103 PolarHBondContact O-N 3.16Å; V101-S104 PolarHBondContact O-N 3.26Å; V101-M105 HydrophobicContact CG1-SD 4.07Å; V101-M105 WeakPolarHBondContact O-CG 3.45Å; V101-M105 PolarHBondContact O-N 3.29Å; V101-L154 HydrophobicContact CG1-CD1 3.78Å; V101-L154 HydrophobicContact CG1-CD2 4.2Å; V101-L154 HydrophobicContact CG2-CD2 4.45Å
102A86.5Confident84.9Confident15 Ų1545.8 Ų45.812%0.12428%0.279CS..Hα-helixtrans-58-41.4173.700000112.3N47 I89 Y100 M105 S106N47-A102 HydrophobicContact CB-CB 3.81Å; N47-A102 PolarHBondContact ND2-O 2.95Å; I89-A102 HydrophobicContact CD1-CB 3.94Å; Y100-A102 PolarHBondContact O-N 3.27Å; A102-M105 PolarHBondContact O-N 3.25Å; A102-S106 WeakPolarHBondContact O-CB 3.05Å; A102-S106 PolarHBondContact O-N 3.17Å; A102-S106 PolarHBondContact O-OG 3.3Å
103T84.6Confident85.1Confident79 Ų7944.4 Ų44.449%0.48527%0.272SS..Hα-helixtrans-65.4-42.9177-57.90000111.2S99 Y100 V101 S106 T107S99-T103 VanDerWaalsContact O-CB 3.27Å; S99-T103 WeakPolarHBondContact O-CB 3.17Å; S99-T103 PolarHBondContact O-N 3.38Å; S99-T103 PolarHBondContact O-OG1 3.24Å; Y100-T103 CarbonylContact O-C 3.2Å; Y100-T103 WeakPolarHBondContact O-CB 3.48Å; Y100-T103 PolarHBondContact O-N 2.93Å; Y100-T103 VanDerWaalsContact O-N 3.16Å; V101-T103 VanDerWaalsContact C-N 3.29Å; V101-T103 PolarHBondContact O-N 3.16Å; T103-S106 PolarHBondContact O-N 2.79Å; T103-T107 VanDerWaalsContact O-CB 3.31Å; T103-T107 WeakPolarHBondContact O-CB 3.2Å; T103-T107 PolarHBondContact O-N 3.49Å; T103-T107 PolarHBondContact O-OG1 3.13Å
104S89.6Confident85.4Confident26 Ų2643 Ų4318%0.18225%0.251CS..Hα-helixtrans-64.2-42.1177.1-68.10000111.9Y100 V101 T107 A108Y100-S104 PolarHBondContact O-N 3.45Å; Y100-S104 PolarHBondContact O-OG 3.01Å; V101-S104 PolarHBondContact O-N 3.26Å; S104-T107 PolarHBondContact O-N 3.01Å; S104-A108 WeakPolarHBondContact O-CB 3.38Å; S104-A108 PolarHBondContact O-N 3.43Å
105M91.6Very high85.9Confident0 Ų044.6 Ų44.60%026%0.261CS..Hα-helixtrans-60.1-46.9174.4-72.6169.964.200111.4T43 D46 N47 L88 V101 A102 T107 A108 V109 L154 V157 L161T43-M105 HydrophobicContact CG2-CB 4.38Å; D46-M105 HydrophobicContact CB-CE 4.02Å; N47-M105 WeakPolarHBondContact OD1-CE 3.48Å; N47-M105 PolarHBondContact OD1-SD 3.5Å; N47-M105 VanDerWaalsContact OD1-SD 3.38Å; L88-M105 HydrophobicContact CB-CE 4.26Å; L88-M105 HydrophobicContact CD2-CE 3.89Å; L88-M105 HydrophobicContact CG-CE 4.06Å; V101-M105 HydrophobicContact CG1-SD 4.07Å; V101-M105 WeakPolarHBondContact O-CG 3.45Å; V101-M105 PolarHBondContact O-N 3.29Å; A102-M105 PolarHBondContact O-N 3.25Å; M105-T107 VanDerWaalsContact C-N 3.35Å; M105-T107 PolarHBondContact O-N 3.48Å; M105-A108 WeakPolarHBondContact O-CB 3.35Å; M105-A108 PolarHBondContact O-N 3.05Å; M105-V109 PolarHBondContact O-N 3.01Å; M105-L154 HydrophobicContact CG-CD1 4.48Å; M105-V157 HydrophobicContact CE-CG1 4.25Å; M105-L161 HydrophobicContact CB-CD1 3.67Å; M105-L161 HydrophobicContact CE-CD1 3.87Å; M105-L161 HydrophobicContact CG-CD1 3.87Å
106S89.5Confident86.8Confident37 Ų3743.7 Ų43.726%0.25925%0.254SS..Hα-helixtrans-63.9-40.7176.6-56.50000112.2T43 N47 A102 T103 A108 V109 M110T43-S106 PolarHBondContact OG1-OG 3.49Å; N47-S106 PolarHBondContact ND2-OG 3.04Å; A102-S106 WeakPolarHBondContact O-CB 3.05Å; A102-S106 PolarHBondContact O-N 3.17Å; A102-S106 PolarHBondContact O-OG 3.3Å; T103-S106 PolarHBondContact O-N 2.79Å; S106-A108 VanDerWaalsContact C-N 3.33Å; S106-A108 PolarHBondContact O-N 2.98Å; S106-V109 PolarHBondContact O-N 3.24Å; S106-M110 WeakPolarHBondContact O-CG 3.47Å; S106-M110 PolarHBondContact O-N 3.11Å; S106-M110 VanDerWaalsContact O-N 3.09Å
107T90Very high87.8Confident63 Ų6340.7 Ų40.739%0.38723%0.233SC..Hα-helixtrans-64.1-39.8177.9-58.10000111T103 S104 M105 M110 A111T103-T107 VanDerWaalsContact O-CB 3.31Å; T103-T107 WeakPolarHBondContact O-CB 3.2Å; T103-T107 PolarHBondContact O-N 3.49Å; T103-T107 PolarHBondContact O-OG1 3.13Å; S104-T107 PolarHBondContact O-N 3.01Å; M105-T107 VanDerWaalsContact C-N 3.35Å; M105-T107 PolarHBondContact O-N 3.48Å; T107-M110 PolarHBondContact O-N 3.33Å; T107-A111 VanDerWaalsContact O-CB 3.24Å; T107-A111 WeakPolarHBondContact O-CB 3.37Å; T107-A111 PolarHBondContact O-N 2.99Å
108A94.1Very high89.4Confident10 Ų1036.9 Ų36.98%0.08322%0.219CC..Hα-helixtrans-59.7-49.1177.600000111.6S104 M105 S106 M110 A111 G112 I158 L161 F162S104-A108 WeakPolarHBondContact O-CB 3.38Å; S104-A108 PolarHBondContact O-N 3.43Å; M105-A108 WeakPolarHBondContact O-CB 3.35Å; M105-A108 PolarHBondContact O-N 3.05Å; S106-A108 VanDerWaalsContact C-N 3.33Å; S106-A108 PolarHBondContact O-N 2.98Å; A108-M110 PolarHBondContact O-N 3.03Å; A108-A111 PolarHBondContact O-N 3.13Å; A108-G112 PolarHBondContact O-N 2.65Å; A108-I158 HydrophobicContact CB-CG2 3.97Å; A108-L161 HydrophobicContact CB-CB 4.43Å; A108-F162 HydrophobicContact CB-CB 4.36Å; A108-F162 WeakPolarHBondContact O-CA 3.25Å; A108-F162 WeakPolarHBondContact O-CD2 3.14Å
109V93.8Very high91.1Very high0 Ų037.8 Ų37.80%022%0.218CC..Hα-helixtrans-59.4-45.9176-177.50000111M40 T43 M105 S106 G112 G113 L161 G165M40-V109 WeakPolarHBondContact O-CG1 3.42Å; M40-V109 HydrophobicContact SD-CG1 4.07Å; T43-V109 HydrophobicContact CG2-CG2 3.82Å; M105-V109 PolarHBondContact O-N 3.01Å; S106-V109 PolarHBondContact O-N 3.24Å; V109-G112 PolarHBondContact O-N 3.2Å; V109-G113 PolarHBondContact O-N 3.15Å; V109-L161 HydrophobicContact CG2-CB 3.71Å; V109-L161 HydrophobicContact CG2-CD1 4.46Å; V109-L161 HydrophobicContact CG2-CD2 4.15Å; V109-L161 HydrophobicContact CG2-CG 4.32Å; V109-G165 VanDerWaalsContact O-CA 3.26Å; V109-G165 WeakPolarHBondContact O-CA 3.4Å
110M91.2Very high92.4Very high26 Ų2634 Ų3413%0.12819%0.19CC..Hα-helixtrans-68.2-40.3-178.1-65.5-61.3156.300112.7M40 S106 T107 A108 G112 G113 V114M40-M110 HydrophobicContact SD-SD 4.44Å; S106-M110 WeakPolarHBondContact O-CG 3.47Å; S106-M110 PolarHBondContact O-N 3.11Å; S106-M110 VanDerWaalsContact O-N 3.09Å; T107-M110 PolarHBondContact O-N 3.33Å; A108-M110 PolarHBondContact O-N 3.03Å; M110-G112 VanDerWaalsContact C-N 3.34Å; M110-G113 WeakPolarHBondContact O-CA 3.12Å; M110-G113 PolarHBondContact O-N 3.38Å; M110-G113 VanDerWaalsContact O-N 3.14Å; M110-V114 WeakPolarHBondContact O-CG2 3.26Å; M110-V114 PolarHBondContact O-N 2.83Å
111A93.3Very high93.1Very high39 Ų3925.8 Ų25.832%0.32216%0.158SC..Hα-helixtrans-62.8-42.617500000111.1T107 A108 G113 V114 I115 F162T107-A111 VanDerWaalsContact O-CB 3.24Å; T107-A111 WeakPolarHBondContact O-CB 3.37Å; T107-A111 PolarHBondContact O-N 2.99Å; A108-A111 PolarHBondContact O-N 3.13Å; A111-G113 VanDerWaalsContact C-N 3.33Å; A111-G113 PolarHBondContact O-N 2.81Å; A111-V114 PolarHBondContact O-N 2.87Å; A111-I115 WeakPolarHBondContact O-CG1 2.99Å; A111-I115 PolarHBondContact O-N 3.32Å; A111-I115 VanDerWaalsContact O-N 3.09Å; A111-F162 HydrophobicContact CB-CD2 4.22Å; A111-F162 HydrophobicContact CB-CE2 4.15Å
112G96.4Very high93.4Very high0 Ų029.2 Ų29.20%017%0.17CC..Hα-helixtrans-53.6-52.7168.800000110.6A108 V109 M110 V114 I115 G116 F162 F166A108-G112 PolarHBondContact O-N 2.65Å; V109-G112 PolarHBondContact O-N 3.2Å; M110-G112 VanDerWaalsContact C-N 3.34Å; G112-V114 VanDerWaalsContact C-N 3.32Å; G112-V114 PolarHBondContact O-N 3.01Å; G112-I115 PolarHBondContact O-N 3.28Å; G112-I115 VanDerWaalsContact O-N 3.16Å; G112-G116 PolarHBondContact O-N 3.17Å; G112-F162 VanDerWaalsContact CA-CE2 3.5Å; G112-F162 WeakPolarHBondContact CA-O 3.39Å; G112-F166 VanDerWaalsContact C-CA 3.48Å; G112-F166 VanDerWaalsContact C-N 3.29Å; G112-F166 WeakPolarHBondContact O-CA 3.31Å
113G94.5Very high93.9Very high0 Ų030.7 Ų30.70%018%0.176CC..Hα-helixtrans-55.4-41179.200000114.5V109 M110 A111 S117 G165V109-G113 PolarHBondContact O-N 3.15Å; M110-G113 WeakPolarHBondContact O-CA 3.12Å; M110-G113 PolarHBondContact O-N 3.38Å; M110-G113 VanDerWaalsContact O-N 3.14Å; A111-G113 VanDerWaalsContact C-N 3.33Å; A111-G113 PolarHBondContact O-N 2.81Å; G113-S117 WeakPolarHBondContact O-CB 3.43Å; G113-S117 PolarHBondContact O-N 3.41Å; G113-S117 PolarHBondContact O-OG 3.48Å; G113-G165 WeakPolarHBondContact CA-O 3.14Å; G113-G165 VanDerWaalsContact N-C 3.28Å; G113-G165 PolarHBondContact N-O 3.35Å
114V94Very high94.5Very high30 Ų3027 Ų2718%0.18215%0.153CC..Hα-helixtrans-61.1-54.7174.4166.10000110.7M110 A111 G112 G116 S117 I118 V429 R432M110-V114 WeakPolarHBondContact O-CG2 3.26Å; M110-V114 PolarHBondContact O-N 2.83Å; A111-V114 PolarHBondContact O-N 2.87Å; G112-V114 VanDerWaalsContact C-N 3.32Å; G112-V114 PolarHBondContact O-N 3.01Å; V114-G116 PolarHBondContact O-N 2.94Å; V114-S117 WeakPolarHBondContact O-CB 3.32Å; V114-S117 PolarHBondContact O-N 3.15Å; V114-I118 PolarHBondContact O-N 3.18Å; V114-V429 HydrophobicContact CG1-CG1 4.01Å; V114-V429 HydrophobicContact CG1-CG2 4.05Å; V114-R432 HydrophobicContact CG2-CB 3.39Å; V114-R432 HydrophobicContact CG2-CG 3.93Å
115I96.4Very high94.7Very high78 Ų7826 Ų2640%0.415%0.146SC..Hα-helixtrans-66.4-42.1-175.2-66.1171.2000110.2A111 G112 S117 I118 V119 F162 F166A111-I115 WeakPolarHBondContact O-CG1 2.99Å; A111-I115 PolarHBondContact O-N 3.32Å; A111-I115 VanDerWaalsContact O-N 3.09Å; G112-I115 PolarHBondContact O-N 3.28Å; G112-I115 VanDerWaalsContact O-N 3.16Å; I115-S117 VanDerWaalsContact C-N 3.33Å; I115-S117 PolarHBondContact O-N 2.95Å; I115-I118 PolarHBondContact O-N 3.49Å; I115-V119 HydrophobicContact CG2-CG2 4.22Å; I115-V119 WeakPolarHBondContact O-CG2 3.39Å; I115-V119 PolarHBondContact O-N 2.74Å; I115-F162 HydrophobicContact CB-CZ 4.46Å; I115-F162 HydrophobicContact CD1-CE2 3.84Å; I115-F162 HydrophobicContact CD1-CZ 3.67Å; I115-F166 HydrophobicContact CB-CD2 4.36Å; I115-F166 HydrophobicContact CG2-CD2 4.01Å; I115-F166 HydrophobicContact CG2-CE2 3.97Å
116G97.3Very high94.8Very high0 Ų029.7 Ų29.70%016%0.16CC..Hα-helixtrans-59.8-40.5176.100000113.2G112 V114 I118 V119 F120 F166G112-G116 PolarHBondContact O-N 3.17Å; V114-G116 PolarHBondContact O-N 2.94Å; G116-I118 VanDerWaalsContact C-N 3.31Å; G116-I118 PolarHBondContact O-N 3.26Å; G116-V119 PolarHBondContact O-N 3.06Å; G116-F120 WeakPolarHBondContact O-CB 3.32Å; G116-F120 WeakPolarHBondContact O-CD2 3.42Å; G116-F120 PolarHBondContact O-N 2.86Å; G116-F166 VanDerWaalsContact CA-O 3.25Å; G116-F166 WeakPolarHBondContact CA-O 3.26Å
117S95.7Very high95Very high0 Ų033.9 Ų33.90%017%0.173CC..Hα-helixtrans-62.2-38177.2-62.50000112.8G113 V114 I115 G121 G169 G425 N428G113-S117 WeakPolarHBondContact O-CB 3.43Å; G113-S117 PolarHBondContact O-N 3.41Å; G113-S117 PolarHBondContact O-OG 3.48Å; V114-S117 WeakPolarHBondContact O-CB 3.32Å; V114-S117 PolarHBondContact O-N 3.15Å; I115-S117 VanDerWaalsContact C-N 3.33Å; I115-S117 PolarHBondContact O-N 2.95Å; S117-G121 WeakPolarHBondContact O-CA 3.44Å; S117-G121 PolarHBondContact O-N 3.25Å; S117-G121 VanDerWaalsContact O-N 3.08Å; S117-G169 PolarHBondContact OG-O 2.87Å; S117-G425 WeakPolarHBondContact O-CA 3.44Å; S117-N428 PolarHBondContact OG-ND2 2.68Å
118I96.4Very high95.2Very high65 Ų6530.9 Ų30.933%0.33316%0.155SC..Hα-helixtrans-73.2-53.2177.2-61.7171.9000109.6V114 I115 G116 F120 G121 Y122 Y291 V429V114-I118 PolarHBondContact O-N 3.18Å; I115-I118 PolarHBondContact O-N 3.49Å; G116-I118 VanDerWaalsContact C-N 3.31Å; G116-I118 PolarHBondContact O-N 3.26Å; I118-F120 PolarHBondContact O-N 2.82Å; I118-G121 PolarHBondContact O-N 3.18Å; I118-Y122 PolarHBondContact O-N 3.42Å; I118-Y122 VanDerWaalsContact O-N 3.08Å; I118-Y291 HydrophobicContact CG2-CD2 4.46Å; I118-Y291 HydrophobicContact CG2-CE2 3.68Å; I118-Y291 PolarHBondContact O-OH 3.23Å; I118-V429 HydrophobicContact CD1-CG2 3.9Å; I118-V429 HydrophobicContact CG1-CG2 3.67Å
119V97.6Very high95.3Very high56 Ų5630.5 Ų30.534%0.33915%0.151SC..Hα-helixtrans-60.5-51.6-175.71730000110.8I115 G116 G121 Y122 L123 F166I115-V119 HydrophobicContact CG2-CG2 4.22Å; I115-V119 WeakPolarHBondContact O-CG2 3.39Å; I115-V119 PolarHBondContact O-N 2.74Å; G116-V119 PolarHBondContact O-N 3.06Å; V119-G121 PolarHBondContact O-N 3.29Å; V119-Y122 PolarHBondContact O-N 2.8Å; V119-L123 HydrophobicContact CG1-CD1 3.85Å; V119-L123 HydrophobicContact CG1-CG 4.28Å; V119-L123 VanDerWaalsContact O-CG 3.31Å; V119-L123 WeakPolarHBondContact O-CG 3.3Å; V119-L123 PolarHBondContact O-N 2.72Å; V119-F166 HydrophobicContact CB-CE2 3.99Å; V119-F166 HydrophobicContact CB-CZ 4.12Å; V119-F166 HydrophobicContact CG1-CE2 4.34Å; V119-F166 HydrophobicContact CG1-CZ 3.97Å; V119-F166 HydrophobicContact CG2-CE2 4.01Å; V119-F166 HydrophobicContact CG2-CZ 4.45Å
120F97.4Very high95.5Very high9 Ų932.9 Ų32.94%0.03916%0.162CC..Hα-helixtrans-75.5-23.2-178.9-76.9-74.3000113.6G116 I118 Y122 L123 A124 C136 F166 F167 I174G116-F120 WeakPolarHBondContact O-CB 3.32Å; G116-F120 WeakPolarHBondContact O-CD2 3.42Å; G116-F120 PolarHBondContact O-N 2.86Å; I118-F120 PolarHBondContact O-N 2.82Å; F120-Y122 VanDerWaalsContact C-N 3.34Å; F120-L123 HydrophobicContact CD1-CB 4.45Å; F120-L123 HydrophobicContact CD1-CD1 3.84Å; F120-L123 HydrophobicContact CE1-CD1 3.95Å; F120-L123 HydrophobicContact CG-CD1 4.49Å; F120-L123 PolarHBondContact O-N 3.08Å; F120-A124 WeakPolarHBondContact O-CB 3.29Å; F120-A124 PolarHBondContact O-N 3.21Å; F120-C136 WeakPolarHBondContact CD1-SG 3.29Å; F120-C136 VanDerWaalsContact CD2-SG 3.58Å; F120-C136 VanDerWaalsContact CE1-SG 3.51Å; F120-C136 WeakPolarHBondContact CG-SG 3.22Å; F120-F166 HydrophobicContact CD2-CE1 4.23Å; F120-F166 HydrophobicContact CD2-CZ 4.27Å; F120-F166 AromaticContact CE2-CD1 3.93Å; F120-F166 HydrophobicContact CE2-CD1 3.93Å; F120-F166 AromaticContact CE2-CE1 3.37Å; F120-F166 HydrophobicContact CE2-CE1 3.37Å; F120-F166 AromaticContact CE2-CZ 3.79Å; F120-F166 HydrophobicContact CE2-CZ 3.79Å; F120-F166 HydrophobicContact CZ-CE1 4.06Å; F120-F167 AromaticContact CE2-CD1 3.84Å; F120-F167 HydrophobicContact CE2-CD1 3.84Å; F120-F167 HydrophobicContact CE2-CE1 4.25Å; F120-F167 AromaticContact CZ-CD1 3.81Å; F120-F167 HydrophobicContact CZ-CD1 3.81Å; F120-F167 AromaticContact CZ-CE1 3.96Å; F120-F167 HydrophobicContact CZ-CE1 3.96Å; F120-I174 HydrophobicContact CB-CD1 3.92Å
121G95.9Very high95.8Very high0 Ų034.3 Ų34.30%017%0.173CC..Hα-helixtrans-58.5-47.6167.100000111.2S117 I118 V119 D125 S421 M422S117-G121 WeakPolarHBondContact O-CA 3.44Å; S117-G121 PolarHBondContact O-N 3.25Å; S117-G121 VanDerWaalsContact O-N 3.08Å; I118-G121 PolarHBondContact O-N 3.18Å; V119-G121 PolarHBondContact O-N 3.29Å; G121-D125 PolarHBondContact O-N 3.41Å; G121-S421 VanDerWaalsContact O-CB 3.27Å; G121-S421 WeakPolarHBondContact O-CB 3.15Å; G121-M422 PolarHBondContact O-N 2.71Å
122Y96.4Very high96Very high80 Ų8032.7 Ų32.731%0.31416%0.159SC..Hα-helixtrans-65.1-49.6173.8177.6-99.5000112.7I118 V119 F120 A124 D125 R126 Y291 M422I118-Y122 PolarHBondContact O-N 3.42Å; I118-Y122 VanDerWaalsContact O-N 3.08Å; V119-Y122 PolarHBondContact O-N 2.8Å; F120-Y122 VanDerWaalsContact C-N 3.34Å; Y122-A124 VanDerWaalsContact C-N 3.26Å; Y122-A124 PolarHBondContact O-N 3.05Å; Y122-D125 PolarHBondContact O-N 2.95Å; Y122-R126 HydrophobicContact CE1-CB 4.25Å; Y122-R126 HydrophobicContact CE1-CG 4.3Å; Y122-R126 VanDerWaalsContact O-CB 3.24Å; Y122-R126 WeakPolarHBondContact O-CB 3.35Å; Y122-R126 PolarHBondContact O-N 2.82Å; Y122-Y291 PolarHBondContact N-OH 3.39Å; Y122-M422 HydrophobicContact CD2-SD 3.79Å
123L96.8Very high96Very high47 Ų4732.9 Ų32.925%0.24616%0.16CC..Hα-helixtrans-60.5-36-178.7-65175.7000112V119 F120 R126 F127 S132V119-L123 HydrophobicContact CG1-CD1 3.85Å; V119-L123 HydrophobicContact CG1-CG 4.28Å; V119-L123 VanDerWaalsContact O-CG 3.31Å; V119-L123 WeakPolarHBondContact O-CG 3.3Å; V119-L123 PolarHBondContact O-N 2.72Å; F120-L123 HydrophobicContact CD1-CB 4.45Å; F120-L123 HydrophobicContact CD1-CD1 3.84Å; F120-L123 HydrophobicContact CE1-CD1 3.95Å; F120-L123 HydrophobicContact CG-CD1 4.49Å; F120-L123 PolarHBondContact O-N 3.08Å; L123-R126 PolarHBondContact O-N 3.37Å; L123-F127 HydrophobicContact CB-CD2 4.32Å; L123-F127 HydrophobicContact CD2-CD2 3.56Å; L123-F127 HydrophobicContact CD2-CE2 3.49Å; L123-F127 VanDerWaalsContact CD2-CE2 3.49Å; L123-F127 WeakPolarHBondContact O-CA 3.35Å; L123-F127 WeakPolarHBondContact O-CB 3.44Å; L123-F127 PolarHBondContact O-N 2.91Å; L123-S132 VanDerWaalsContact C-OG 3.31Å; L123-S132 PolarHBondContact O-OG 2.98Å
124A96.5Very high96.2Very high0 Ų034 Ų340%017%0.166CC..Hα-helixtrans-68.5-40.1178.800000113.1F120 Y122 G128 R129 S132 I174F120-A124 WeakPolarHBondContact O-CB 3.29Å; F120-A124 PolarHBondContact O-N 3.21Å; Y122-A124 VanDerWaalsContact C-N 3.26Å; Y122-A124 PolarHBondContact O-N 3.05Å; A124-G128 WeakPolarHBondContact CA-O 3.44Å; A124-G128 CarbonylContact O-C 3.6Å; A124-G128 WeakPolarHBondContact O-CA 3.38Å; A124-G128 PolarHBondContact O-N 3.13Å; A124-R129 PolarHBondContact O-NH1 2.93Å; A124-S132 VanDerWaalsContact CA-OG 3.29Å; A124-S132 WeakPolarHBondContact CA-OG 3.15Å; A124-S132 PolarHBondContact N-OG 3.41Å; A124-I174 HydrophobicContact CB-CD1 3.72Å; A124-I174 HydrophobicContact CB-CG1 3.65Å; A124-I174 HydrophobicContact CB-CG2 4.08Å
125D94Very high96.4Very high5 Ų535.5 Ų35.53%0.02718%0.178CC..Hα-helixtrans-70.7-35.4174-72.2-21.7000111.2G121 Y122 R129 W241 H245 V419 R420 S421 M422G121-D125 PolarHBondContact O-N 3.41Å; Y122-D125 PolarHBondContact O-N 2.95Å; D125-R129 VanDerWaalsContact CA-NH1 3.26Å; D125-R129 IonicContact OD1-CZ 3.37Å; D125-R129 IonicContact OD1-NH1 3.67Å; D125-R129 PolarHBondContact OD1-NH1 2.69Å; D125-R129 IonicContact OD1-NH2 3.93Å; D125-R129 PolarHBondContact OD1-NH2 3.48Å; D125-R129 VanDerWaalsContact OD1-NH2 3.08Å; D125-W241 PolarHBondContact O-NE1 3.41Å; D125-H245 PolarHBondContact O-CE1 3.35Å; D125-H245 VanDerWaalsContact O-CE1 3.23Å; D125-H245 PolarHBondContact O-NE2 3.03Å; D125-V419 VanDerWaalsContact OD2-CA 3.25Å; D125-V419 WeakPolarHBondContact OD2-CA 3.44Å; D125-R420 PolarHBondContact OD2-N 3.13Å; D125-S421 VanDerWaalsContact OD1-CB 3.22Å; D125-S421 WeakPolarHBondContact OD1-CB 3.5Å; D125-S421 PolarHBondContact OD1-N 3.37Å; D125-S421 VanDerWaalsContact OD1-N 3.13Å; D125-S421 PolarHBondContact OD1-OG 2.84Å; D125-S421 PolarHBondContact OD2-N 3.07Å; D125-M422 HydrophobicContact CB-CE 4.13Å; D125-M422 HydrophobicContact CB-CG 4.42Å; D125-M422 WeakPolarHBondContact OD2-CG 3.48Å; D125-M422 PolarHBondContact OD2-N 2.64Å
126R92.8Very high96.5Very high78 Ų7831.8 Ų31.829%0.29416%0.159SC..Hα-helixtrans-78.2-48.5-177.2-179.456.9172.5-162.115.6115.2Y122 L123 N288Y122-R126 HydrophobicContact CE1-CB 4.25Å; Y122-R126 HydrophobicContact CE1-CG 4.3Å; Y122-R126 VanDerWaalsContact O-CB 3.24Å; Y122-R126 WeakPolarHBondContact O-CB 3.35Å; Y122-R126 PolarHBondContact O-N 2.82Å; L123-R126 PolarHBondContact O-N 3.37Å; R126-N288 VanDerWaalsContact CZ-OD1 3.29Å; R126-N288 PolarHBondContact NH1-ND2 3.3Å; R126-N288 PolarHBondContact NH1-OD1 2.83Å; R126-N288 VanDerWaalsContact NH2-CG 3.35Å; R126-N288 PolarHBondContact NH2-ND2 3.47Å; R126-N288 VanDerWaalsContact NH2-ND2 3.13Å; R126-N288 PolarHBondContact NH2-OD1 3.15Å
127F94.2Very high96.6Very high125 Ų12531.8 Ų31.855%0.54816%0.159SC..Hα-helixtrans-113.8-6.4-167.6-62-66.4000113.1L123 P131L123-F127 HydrophobicContact CB-CD2 4.32Å; L123-F127 HydrophobicContact CD2-CD2 3.56Å; L123-F127 HydrophobicContact CD2-CE2 3.49Å; L123-F127 VanDerWaalsContact CD2-CE2 3.49Å; L123-F127 WeakPolarHBondContact O-CA 3.35Å; L123-F127 WeakPolarHBondContact O-CB 3.44Å; L123-F127 PolarHBondContact O-N 2.91Å; F127-P131 VanDerWaalsContact O-CG 3.26Å; F127-P131 WeakPolarHBondContact O-CG 3.49Å
128G94.8Very high96.7Very high0 Ų033.4 Ų33.40%017%0.172CC..  trans112.6158.1177.700000113.5A124 S132 E237 W241A124-G128 WeakPolarHBondContact CA-O 3.44Å; A124-G128 CarbonylContact O-C 3.6Å; A124-G128 WeakPolarHBondContact O-CA 3.38Å; A124-G128 PolarHBondContact O-N 3.13Å; G128-S132 WeakPolarHBondContact O-CB 3.28Å; G128-S132 PolarHBondContact O-OG 3.41Å; G128-E237 WeakPolarHBondContact CA-OE2 3.4Å; G128-W241 VanDerWaalsContact CA-CE2 3.45Å; G128-W241 VanDerWaalsContact N-CZ2 3.29Å
129R96.5Very high96.8Very high2 Ų230.7 Ų30.71%0.00816%0.16CC..Hα-helixtrans-70.7-44.6-178.4-47.7-61.6-177-131.212.1111A124 D125 L133 I174 P178 E181 E237 T417 S421A124-R129 PolarHBondContact O-NH1 2.93Å; D125-R129 VanDerWaalsContact CA-NH1 3.26Å; D125-R129 IonicContact OD1-CZ 3.37Å; D125-R129 IonicContact OD1-NH1 3.67Å; D125-R129 PolarHBondContact OD1-NH1 2.69Å; D125-R129 IonicContact OD1-NH2 3.93Å; D125-R129 PolarHBondContact OD1-NH2 3.48Å; D125-R129 VanDerWaalsContact OD1-NH2 3.08Å; R129-L133 WeakPolarHBondContact O-CB 3.41Å; R129-L133 WeakPolarHBondContact O-CG 3.41Å; R129-L133 PolarHBondContact O-N 2.91Å; R129-I174 HydrophobicContact CB-CG2 4.26Å; R129-P178 HydrophobicContact CB-CG 4.14Å; R129-E181 IonicContact CZ-OE1 3.26Å; R129-E181 IonicContact NE-OE1 3.42Å; R129-E181 PolarHBondContact NE-OE1 3.23Å; R129-E181 IonicContact NE-OE2 3.76Å; R129-E181 IonicContact NH2-OE1 3.1Å; R129-E181 PolarHBondContact NH2-OE1 3.38Å; R129-E237 VanDerWaalsContact CB-OE1 3.23Å; R129-E237 WeakPolarHBondContact CB-OE1 3Å; R129-E237 WeakPolarHBondContact CG-OE1 3.4Å; R129-E237 VanDerWaalsContact N-CD 3.33Å; R129-E237 PolarHBondContact N-OE1 3.14Å; R129-E237 PolarHBondContact N-OE2 3.36Å; R129-T417 PolarHBondContact NH2-O 2.71Å; R129-S421 VanDerWaalsContact CZ-OG 3.29Å; R129-S421 PolarHBondContact NH1-OG 3.26Å; R129-S421 VanDerWaalsContact NH1-OG 3.16Å
130K97Very high96.8Very high51 Ų5128 Ų2822%0.22214%0.144CC..Hα-helixtrans-62.9-55.6-175.2178.8-178.2-179.7169.30113S132 L133 I134 H232 F233 V235 E237K130-S132 VanDerWaalsContact C-N 3.26Å; K130-S132 PolarHBondContact O-N 2.96Å; K130-L133 PolarHBondContact O-N 3.28Å; K130-I134 HydrophobicContact CD-CD1 4.49Å; K130-I134 HydrophobicContact CG-CD1 3.84Å; K130-I134 WeakPolarHBondContact O-CG1 3.44Å; K130-I134 PolarHBondContact O-N 2.81Å; K130-H232 WeakPolarHBondContact CE-O 3Å; K130-F233 PolarHBondContact NZ-O 3.35Å; K130-V235 VanDerWaalsContact CD-O 3.29Å; K130-V235 WeakPolarHBondContact CD-O 3.47Å; K130-V235 WeakPolarHBondContact CE-O 3.24Å; K130-V235 PolarHBondContact NZ-O 3.33Å; K130-E237 WeakPolarHBondContact CB-OE2 3.23Å; K130-E237 PolarHBondContact N-OE1 2.86Å; K130-E237 PolarHBondContact N-OE2 3.45Å
131P97.7Very high96.9Very high55 Ų5528 Ų2836%0.35715%0.145SC..Hα-helixtrans-62.8-37.2-178.224.2-32.9000111.3F127 I134 S135 E237F127-P131 VanDerWaalsContact O-CG 3.26Å; F127-P131 WeakPolarHBondContact O-CG 3.49Å; P131-I134 PolarHBondContact O-N 3Å; P131-S135 WeakPolarHBondContact O-CB 3.29Å; P131-S135 PolarHBondContact O-N 2.98Å; P131-S135 PolarHBondContact O-OG 3.5Å; P131-E237 VanDerWaalsContact CD-OE2 3.28Å; P131-E237 WeakPolarHBondContact CD-OE2 3.31Å
132S97.7Very high97Very high5 Ų533 Ų334%0.03517%0.17CC..Hα-helixtrans-64.7-43.5177.8-56.50000112.2L123 A124 G128 K130 S135 C136L123-S132 VanDerWaalsContact C-OG 3.31Å; L123-S132 PolarHBondContact O-OG 2.98Å; A124-S132 VanDerWaalsContact CA-OG 3.29Å; A124-S132 WeakPolarHBondContact CA-OG 3.15Å; A124-S132 PolarHBondContact N-OG 3.41Å; G128-S132 WeakPolarHBondContact O-CB 3.28Å; G128-S132 PolarHBondContact O-OG 3.41Å; K130-S132 VanDerWaalsContact C-N 3.26Å; K130-S132 PolarHBondContact O-N 2.96Å; S132-S135 PolarHBondContact O-N 2.84Å; S132-C136 PolarHBondContact O-N 2.76Å; S132-C136 PolarHBondContact O-SG 3.35Å
133L97.5Very high97.1Very high4 Ų430 Ų302%0.02116%0.16CC..Hα-helixtrans-63.5-43.1174.7-79.7168.4000112.9R129 K130 S135 C136 L137 Y171 I174 P178R129-L133 WeakPolarHBondContact O-CB 3.41Å; R129-L133 WeakPolarHBondContact O-CG 3.41Å; R129-L133 PolarHBondContact O-N 2.91Å; K130-L133 PolarHBondContact O-N 3.28Å; L133-S135 VanDerWaalsContact C-N 3.35Å; L133-C136 PolarHBondContact O-N 3.39Å; L133-L137 WeakPolarHBondContact O-CB 3.39Å; L133-L137 PolarHBondContact O-N 3.22Å; L133-Y171 HydrophobicContact CB-CE2 4.47Å; L133-Y171 HydrophobicContact CD2-CD2 3.65Å; L133-Y171 HydrophobicContact CD2-CE2 3.49Å; L133-Y171 VanDerWaalsContact CD2-CE2 3.49Å; L133-Y171 HydrophobicContact CD2-CG 4.22Å; L133-I174 HydrophobicContact CD1-CG2 3.95Å; L133-I174 HydrophobicContact CD2-CB 3.8Å; L133-I174 HydrophobicContact CD2-CG2 3.94Å; L133-I174 HydrophobicContact CG-CB 4.03Å; L133-I174 HydrophobicContact CG-CG2 3.61Å; L133-P178 HydrophobicContact CD1-CG 3.67Å
134I98.2Very high97.2Very high25 Ų2527.7 Ų27.713%0.12815%0.148CC..Hα-helixtrans-61.8-45.6177.2-69.8172.5000109.9K130 P131 L137 A138 L229 H232 F233K130-I134 HydrophobicContact CD-CD1 4.49Å; K130-I134 HydrophobicContact CG-CD1 3.84Å; K130-I134 WeakPolarHBondContact O-CG1 3.44Å; K130-I134 PolarHBondContact O-N 2.81Å; P131-I134 PolarHBondContact O-N 3Å; I134-L137 PolarHBondContact O-N 3.16Å; I134-A138 WeakPolarHBondContact O-CB 3.47Å; I134-A138 PolarHBondContact O-N 3.08Å; I134-L229 HydrophobicContact CG2-CD1 4.05Å; I134-H232 HydrophobicContact CD1-CB 4.27Å; I134-H232 HydrophobicContact CG1-CB 3.72Å; I134-F233 HydrophobicContact CD1-CD1 4.12Å; I134-F233 HydrophobicContact CD1-CE1 4.05Å; I134-F233 HydrophobicContact CD1-CG 4.42Å; I134-F233 HydrophobicContact CD1-CZ 4.28Å; I134-F233 HydrophobicContact CG2-CE2 4.34Å; I134-F233 HydrophobicContact CG2-CZ 3.93Å
135S98.2Very high97.3Very high60 Ų6029.9 Ų29.942%0.4216%0.159SC..Hα-helixtrans-61-45177.3-65.30000112.5P131 S132 L133 G139P131-S135 WeakPolarHBondContact O-CB 3.29Å; P131-S135 PolarHBondContact O-N 2.98Å; P131-S135 PolarHBondContact O-OG 3.5Å; S132-S135 PolarHBondContact O-N 2.84Å; L133-S135 VanDerWaalsContact C-N 3.35Å; S135-G139 PolarHBondContact O-N 3.39Å
136C98.4Very high97.5Very high0 Ų032.2 Ų32.20%017%0.174CC..Hα-helixtrans-59.2-51.9174.6-68.80000111.6F120 S132 L133 A138 G139 C140 F167 G170 Y171F120-C136 WeakPolarHBondContact CD1-SG 3.29Å; F120-C136 VanDerWaalsContact CD2-SG 3.58Å; F120-C136 VanDerWaalsContact CE1-SG 3.51Å; F120-C136 WeakPolarHBondContact CG-SG 3.22Å; S132-C136 PolarHBondContact O-N 2.76Å; S132-C136 PolarHBondContact O-SG 3.35Å; L133-C136 PolarHBondContact O-N 3.39Å; C136-A138 PolarHBondContact O-N 2.65Å; C136-G139 PolarHBondContact O-N 3.22Å; C136-C140 PolarHBondContact O-N 3.34Å; C136-F167 WeakPolarHBondContact CB-O 3.09Å; C136-F167 WeakPolarHBondContact O-CB 3.33Å; C136-G170 VanDerWaalsContact SG-C 3.54Å; C136-Y171 HydrophobicContact CB-CD2 4.03Å; C136-Y171 PolarHBondContact SG-N 3.36Å
137L98.3Very high97.8Very high0 Ų028.5 Ų28.50%016%0.16CC..Hα-helixtrans-67.8-39.8-176.1-174.457.2000112V36 L133 I134 G139 C140 V141 Y171 F228 L229V36-L137 HydrophobicContact CG2-CD1 4.08Å; L133-L137 WeakPolarHBondContact O-CB 3.39Å; L133-L137 PolarHBondContact O-N 3.22Å; I134-L137 PolarHBondContact O-N 3.16Å; L137-G139 VanDerWaalsContact C-N 3.32Å; L137-G139 PolarHBondContact O-N 2.64Å; L137-C140 PolarHBondContact O-N 3.23Å; L137-V141 WeakPolarHBondContact O-CG2 3.17Å; L137-V141 PolarHBondContact O-N 2.92Å; L137-Y171 HydrophobicContact CB-CD2 4.21Å; L137-Y171 HydrophobicContact CB-CE2 4.11Å; L137-Y171 HydrophobicContact CD2-CE2 4.5Å; L137-F228 HydrophobicContact CD2-CB 4.27Å; L137-L229 HydrophobicContact CB-CD1 4.28Å; L137-L229 HydrophobicContact CD2-CB 4.12Å; L137-L229 HydrophobicContact CD2-CD1 4.47Å; L137-L229 HydrophobicContact CG-CB 4.27Å; L137-L229 HydrophobicContact CG-CD1 4.33Å
138A98.5Very high97.9Very high35 Ų3523.6 Ų23.629%0.28914%0.14SC..Hα-helixtrans-61-41.7174.300000111.7I134 C136 V141 L142 L229I134-A138 WeakPolarHBondContact O-CB 3.47Å; I134-A138 PolarHBondContact O-N 3.08Å; C136-A138 PolarHBondContact O-N 2.65Å; A138-V141 PolarHBondContact O-N 2.78Å; A138-L142 VanDerWaalsContact O-CB 3.28Å; A138-L142 WeakPolarHBondContact O-CB 3.37Å; A138-L142 PolarHBondContact O-N 3.37Å; A138-L229 HydrophobicContact CB-CD1 4Å; A138-L229 HydrophobicContact CB-CD2 4.11Å
139G98.5Very high98Very high7 Ų730 Ų307%0.07217%0.169CC..Hα-helixtrans-61-47.5174.200000112.3S135 C136 L137 V141 L142 I143S135-G139 PolarHBondContact O-N 3.39Å; C136-G139 PolarHBondContact O-N 3.22Å; L137-G139 VanDerWaalsContact C-N 3.32Å; L137-G139 PolarHBondContact O-N 2.64Å; G139-V141 PolarHBondContact O-N 3.37Å; G139-L142 PolarHBondContact O-N 3.28Å; G139-I143 VanDerWaalsContact O-CG1 3.25Å; G139-I143 WeakPolarHBondContact O-CG1 3.44Å; G139-I143 PolarHBondContact O-N 2.88Å
140C98.5Very high98Very high0 Ų032.7 Ų32.70%018%0.182CC..Hα-helixtrans-58.9-46.5174.6-710000112.2T35 C136 L137 N144 A168T35-C140 HydrophobicContact CG2-CB 4.17Å; C136-C140 PolarHBondContact O-N 3.34Å; L137-C140 PolarHBondContact O-N 3.23Å; C140-N144 WeakPolarHBondContact O-CB 3.33Å; C140-N144 PolarHBondContact O-N 3.29Å; C140-N144 VanDerWaalsContact O-N 3.14Å; C140-N144 PolarHBondContact O-ND2 3.23Å; C140-A168 PolarHBondContact SG-N 3.31Å; C140-A168 VanDerWaalsContact SG-N 3.4Å
141V98.6Very high97.9Very high9 Ų930.3 Ų30.36%0.05517%0.172CC..Hα-helixtrans-61-51.3179.3166.80000110.7T35 L137 A138 G139 I143 N144 L145 I226T35-V141 HydrophobicContact CG2-CG2 4.4Å; L137-V141 WeakPolarHBondContact O-CG2 3.17Å; L137-V141 PolarHBondContact O-N 2.92Å; A138-V141 PolarHBondContact O-N 2.78Å; G139-V141 PolarHBondContact O-N 3.37Å; V141-I143 PolarHBondContact O-N 2.88Å; V141-N144 PolarHBondContact O-N 3.23Å; V141-L145 HydrophobicContact CG1-CD1 3.83Å; V141-L145 HydrophobicContact CG1-CG 4.46Å; V141-L145 VanDerWaalsContact O-CG 3.29Å; V141-L145 WeakPolarHBondContact O-CG 3.43Å; V141-L145 PolarHBondContact O-N 2.9Å; V141-I226 HydrophobicContact CG1-CG1 3.94Å
142L98.5Very high97.6Very high104 Ų10435.5 Ų35.555%0.54519%0.191SC..Hα-helixtrans-61.3-48.5-176.7179.864.4000111.9A138 G139 N144 L145 V146A138-L142 VanDerWaalsContact O-CB 3.28Å; A138-L142 WeakPolarHBondContact O-CB 3.37Å; A138-L142 PolarHBondContact O-N 3.37Å; G139-L142 PolarHBondContact O-N 3.28Å; L142-N144 VanDerWaalsContact C-N 3.34Å; L142-N144 PolarHBondContact O-N 3.03Å; L142-L145 PolarHBondContact O-N 3.49Å; L142-V146 HydrophobicContact CD1-CG2 4Å; L142-V146 HydrophobicContact CG-CG2 4.43Å; L142-V146 WeakPolarHBondContact O-CB 3.12Å; L142-V146 VanDerWaalsContact O-CG2 3.31Å; L142-V146 WeakPolarHBondContact O-CG2 3.3Å; L142-V146 PolarHBondContact O-N 2.66Å
143I98.5Very high97.3Very high17 Ų1736.5 Ų36.59%0.08720%0.202CC..Hα-helixtrans-66.4-38.6-177.3-58.1-63.2000111G139 V141 L145 V146 L147 M160 L163 L164 F167G139-I143 VanDerWaalsContact O-CG1 3.25Å; G139-I143 WeakPolarHBondContact O-CG1 3.44Å; G139-I143 PolarHBondContact O-N 2.88Å; V141-I143 PolarHBondContact O-N 2.88Å; I143-L145 VanDerWaalsContact C-N 3.34Å; I143-L145 PolarHBondContact O-N 3.31Å; I143-V146 PolarHBondContact O-N 3.22Å; I143-L147 WeakPolarHBondContact O-CB 3.36Å; I143-L147 PolarHBondContact O-N 3.45Å; I143-M160 HydrophobicContact CD1-SD 4.05Å; I143-M160 HydrophobicContact CG2-CB 4.15Å; I143-M160 HydrophobicContact CG2-SD 4.05Å; I143-L163 HydrophobicContact CD1-CB 4.24Å; I143-L163 HydrophobicContact CD1-CD1 4Å; I143-L163 HydrophobicContact CG1-CB 4.19Å; I143-L164 HydrophobicContact CB-CD2 3.79Å; I143-L164 HydrophobicContact CB-CG 4.12Å; I143-L164 HydrophobicContact CG2-CD1 4.29Å; I143-L164 HydrophobicContact CG2-CD2 3.82Å; I143-L164 HydrophobicContact CG2-CG 3.59Å; I143-F167 HydrophobicContact CG1-CD2 4.35Å; I143-F167 HydrophobicContact CG1-CE2 4.27Å
144N98.6Very high97.1Very high0 Ų038.3 Ų38.30%021%0.212CC..Hα-helixtrans-63.7-36.8174.3-85.1-61.6000113S39 C140 V141 L142 P148 L164 H218S39-N144 PolarHBondContact OG-ND2 3.01Å; C140-N144 WeakPolarHBondContact O-CB 3.33Å; C140-N144 PolarHBondContact O-N 3.29Å; C140-N144 VanDerWaalsContact O-N 3.14Å; C140-N144 PolarHBondContact O-ND2 3.23Å; V141-N144 PolarHBondContact O-N 3.23Å; L142-N144 VanDerWaalsContact C-N 3.34Å; L142-N144 PolarHBondContact O-N 3.03Å; N144-P148 WeakPolarHBondContact O-CD 3.45Å; N144-L164 VanDerWaalsContact ND2-CD2 3.31Å; N144-L164 WeakPolarHBondContact ND2-CD2 3.37Å; N144-H218 WeakPolarHBondContact CB-O 3.45Å; N144-H218 CarbonylContact O-C 3.6Å; N144-H218 PolarHBondContact OD1-ND1 3.36Å
145L98.4Very high96.9Very high46 Ų4642.2 Ų42.224%0.24124%0.237CC..Hα-helixtrans-70.7-34.2176.1-69.4173.7000112.5V141 L142 I143 F149 L219 I223V141-L145 HydrophobicContact CG1-CD1 3.83Å; V141-L145 HydrophobicContact CG1-CG 4.46Å; V141-L145 VanDerWaalsContact O-CG 3.29Å; V141-L145 WeakPolarHBondContact O-CG 3.43Å; V141-L145 PolarHBondContact O-N 2.9Å; L142-L145 PolarHBondContact O-N 3.49Å; I143-L145 VanDerWaalsContact C-N 3.34Å; I143-L145 PolarHBondContact O-N 3.31Å; L145-F149 VanDerWaalsContact O-CD2 3.23Å; L145-F149 WeakPolarHBondContact O-CD2 3.21Å; L145-F149 WeakPolarHBondContact O-CE2 3.19Å; L145-L219 HydrophobicContact CD2-CD2 4.33Å; L145-I223 HydrophobicContact CD2-CG1 4.06Å
146V98.2Very high96.8Very high54 Ų5442 Ų4233%0.32723%0.233SC..Hα-helixtrans-86.6-40.4-174.5172.60000112.6L142 I143 P148 F149 I150L142-V146 HydrophobicContact CD1-CG2 4Å; L142-V146 HydrophobicContact CG-CG2 4.43Å; L142-V146 WeakPolarHBondContact O-CB 3.12Å; L142-V146 VanDerWaalsContact O-CG2 3.31Å; L142-V146 WeakPolarHBondContact O-CG2 3.3Å; L142-V146 PolarHBondContact O-N 2.66Å; I143-V146 PolarHBondContact O-N 3.22Å; V146-P148 VanDerWaalsContact C-CD 3.47Å; V146-P148 VanDerWaalsContact C-N 3.34Å; V146-F149 PolarHBondContact O-N 2.97Å; V146-I150 HydrophobicContact CG1-CD1 3.67Å; V146-I150 HydrophobicContact CG1-CG1 4.04Å; V146-I150 HydrophobicContact CG1-CG2 4.19Å
147L98Very high96.8Very high0 Ų042 Ų420%023%0.233CC..Hα-helixtrans-48.3-46.2-173.6169.164.6000113.5I143 F149 I150 A151 V157 M160 L164 W214I143-L147 WeakPolarHBondContact O-CB 3.36Å; I143-L147 PolarHBondContact O-N 3.45Å; L147-F149 PolarHBondContact O-N 2.94Å; L147-I150 PolarHBondContact O-N 2.89Å; L147-I150 VanDerWaalsContact O-N 3.16Å; L147-A151 HydrophobicContact CD1-CB 4.03Å; L147-A151 WeakPolarHBondContact O-CB 3.42Å; L147-A151 PolarHBondContact O-N 3.49Å; L147-A151 VanDerWaalsContact O-N 3.13Å; L147-V157 HydrophobicContact CD1-CG2 4.4Å; L147-M160 HydrophobicContact CD1-CB 3.77Å; L147-M160 HydrophobicContact CD1-CG 4.16Å; L147-L164 HydrophobicContact CD2-CD1 4.22Å; L147-W214 HydrophobicContact CG-CZ3 4.45Å
148P97.6Very high96.7Very high22 Ų2244.7 Ų44.714%0.14325%0.247CC..Hα-helixtrans-55.4-26.1178.7-34.444.6000115.8N144 V146 W214 N215 H218 L219N144-P148 WeakPolarHBondContact O-CD 3.45Å; V146-P148 VanDerWaalsContact C-CD 3.47Å; V146-P148 VanDerWaalsContact C-N 3.34Å; P148-W214 HydrophobicContact CB-CZ3 4.45Å; P148-W214 HydrophobicContact CG-CZ3 4.49Å; P148-N215 HydrophobicContact CB-CB 4.02Å; P148-N215 VanDerWaalsContact CG-O 3.31Å; P148-N215 WeakPolarHBondContact CG-O 3.36Å; P148-H218 HydrophobicContact CG-CB 3.72Å; P148-L219 HydrophobicContact CB-CD1 4.36Å; P148-L219 HydrophobicContact CB-CG 4.28Å; P148-L219 HydrophobicContact CG-CG 4.04Å
149F97.5Very high96.6Very high135 Ų13547.2 Ų47.259%0.59226%0.255SS*.Hα-helixtrans-94.9-15.9-176.5-57.6-72.2000113.9L145 V146 L147 H152 L219L145-F149 VanDerWaalsContact O-CD2 3.23Å; L145-F149 WeakPolarHBondContact O-CD2 3.21Å; L145-F149 WeakPolarHBondContact O-CE2 3.19Å; V146-F149 PolarHBondContact O-N 2.97Å; L147-F149 PolarHBondContact O-N 2.94Å; F149-H152 PolarHBondContact O-NE2 3.47Å; F149-H152 VanDerWaalsContact O-NE2 3.16Å; F149-L219 HydrophobicContact CE2-CD2 4Å; F149-L219 HydrophobicContact CZ-CD1 4.49Å; F149-L219 HydrophobicContact CZ-CD2 4.12Å
150I96.5Very high96.6Very high57 Ų5748.3 Ų48.329%0.29226%0.258SS..Hα-helixtrans-120.80.2-173.166.2166.3000113.6V146 L147 H152 V156 M160V146-I150 HydrophobicContact CG1-CD1 3.67Å; V146-I150 HydrophobicContact CG1-CG1 4.04Å; V146-I150 HydrophobicContact CG1-CG2 4.19Å; L147-I150 PolarHBondContact O-N 2.89Å; L147-I150 VanDerWaalsContact O-N 3.16Å; I150-H152 PolarHBondContact O-N 3.41Å; I150-V156 HydrophobicContact CB-CG1 4.47Å; I150-V156 HydrophobicContact CD1-CG1 3.95Å; I150-V156 HydrophobicContact CG1-CG1 4.12Å; I150-V156 WeakPolarHBondContact O-CG1 3.48Å; I150-M160 HydrophobicContact CD1-CE 3.7Å; I150-M160 HydrophobicContact CD1-CG 3.97Å; I150-M160 HydrophobicContact CD1-SD 3.89Å
151A94.1Very high96.6Very high2 Ų248.3 Ų48.32%0.01726%0.258CS..  trans-74.249-177.200000114L88 L147 V157 W214L88-A151 HydrophobicContact CD1-CB 4.25Å; L147-A151 HydrophobicContact CD1-CB 4.03Å; L147-A151 WeakPolarHBondContact O-CB 3.42Å; L147-A151 PolarHBondContact O-N 3.49Å; L147-A151 VanDerWaalsContact O-N 3.13Å; A151-V157 HydrophobicContact CB-CG2 3.69Å; A151-W214 HydrophobicContact CB-CH2 3.52Å; A151-W214 HydrophobicContact CB-CZ2 4.39Å; A151-W214 HydrophobicContact CB-CZ3 3.93Å
152H90.7Very high96.5Very high163 Ų16350.8 Ų50.876%0.75527%0.269SS*.SBendtrans-83.8-10.6-178.3-57.5-59.4000114.1F149 I150F149-H152 PolarHBondContact O-NE2 3.47Å; F149-H152 VanDerWaalsContact O-NE2 3.16Å; I150-H152 PolarHBondContact O-N 3.41Å
153G92.4Very high96.6Very high26 Ų2648.3 Ų48.327%0.26826%0.255SS..SBendtrans-157.3153.1-176.800000112.8T155 V156 V157G153-T155 VanDerWaalsContact C-N 3.3Å; G153-T155 PolarHBondContact O-N 2.9Å; G153-V156 PolarHBondContact O-N 3.47Å; G153-V157 PolarHBondContact O-N 2.76Å; G153-V157 VanDerWaalsContact O-N 3.14Å
154L92Very high96.5Very high42 Ų4247.5 Ų47.522%0.2225%0.251CS..Hα-helixtrans-58.3-39.9-173.8-17860.3000112.8L92 F94 V101 M105 V156 V157 I158L92-L154 HydrophobicContact CD1-CD1 4.28Å; F94-L154 HydrophobicContact CE2-CB 3.98Å; F94-L154 HydrophobicContact CE2-CD2 4.28Å; F94-L154 HydrophobicContact CZ-CB 4.38Å; F94-L154 HydrophobicContact CZ-CD2 4.27Å; V101-L154 HydrophobicContact CG1-CD1 3.78Å; V101-L154 HydrophobicContact CG1-CD2 4.2Å; V101-L154 HydrophobicContact CG2-CD2 4.45Å; M105-L154 HydrophobicContact CG-CD1 4.48Å; L154-V156 PolarHBondContact O-N 3.21Å; L154-V157 PolarHBondContact O-N 3.19Å; L154-I158 HydrophobicContact CD1-CD1 4.06Å; L154-I158 HydrophobicContact CD1-CG1 4.12Å; L154-I158 HydrophobicContact CD2-CD1 4.47Å; L154-I158 HydrophobicContact CG-CD1 3.89Å; L154-I158 HydrophobicContact CG-CG1 4.35Å; L154-I158 WeakPolarHBondContact O-CB 3.31Å; L154-I158 WeakPolarHBondContact O-CG1 3.44Å; L154-I158 PolarHBondContact O-N 3.31Å
155T95.3Very high96.5Very high107 Ų10747.5 Ų47.566%0.65625%0.251SS*.Hα-helixtrans-61.1-45.2179.6-51.30000111.9G153 V157 I158 I159G153-T155 VanDerWaalsContact C-N 3.3Å; G153-T155 PolarHBondContact O-N 2.9Å; T155-V157 VanDerWaalsContact C-N 3.34Å; T155-I158 PolarHBondContact O-N 2.81Å; T155-I159 HydrophobicContact CG2-CD1 4.19Å; T155-I159 WeakPolarHBondContact O-CG1 3.36Å; T155-I159 PolarHBondContact O-N 3.04Å; T155-I159 VanDerWaalsContact O-N 3.09Å
156V96.6Very high96.5Very high56 Ų5647 Ų4734%0.33925%0.247SC..Hα-helixtrans-64-44.3178.51790000110I150 G153 L154 I158 I159 M160I150-V156 HydrophobicContact CB-CG1 4.47Å; I150-V156 HydrophobicContact CD1-CG1 3.95Å; I150-V156 HydrophobicContact CG1-CG1 4.12Å; I150-V156 WeakPolarHBondContact O-CG1 3.48Å; G153-V156 PolarHBondContact O-N 3.47Å; L154-V156 PolarHBondContact O-N 3.21Å; V156-I158 PolarHBondContact O-N 2.61Å; V156-I159 PolarHBondContact O-N 3.04Å; V156-M160 HydrophobicContact CG1-CG 4.33Å; V156-M160 VanDerWaalsContact O-CG 3.31Å; V156-M160 WeakPolarHBondContact O-CG 3.39Å; V156-M160 PolarHBondContact O-N 3.39Å
157V96.8Very high96.5Very high0 Ų046.3 Ų46.30%024%0.24CC..Hα-helixtrans-60-47.2177.2167.60000111.5L88 L92 M105 L147 A151 G153 L154 T155 I159 M160 L161L88-V157 HydrophobicContact CD1-CG2 4.32Å; L88-V157 HydrophobicContact CD2-CG1 3.55Å; L88-V157 HydrophobicContact CD2-CG2 4.27Å; L88-V157 HydrophobicContact CG-CG1 4.29Å; L92-V157 HydrophobicContact CD1-CB 4.41Å; L92-V157 HydrophobicContact CD1-CG1 4.43Å; L92-V157 HydrophobicContact CD1-CG2 4.12Å; L92-V157 HydrophobicContact CD2-CG2 4.46Å; M105-V157 HydrophobicContact CE-CG1 4.25Å; L147-V157 HydrophobicContact CD1-CG2 4.4Å; A151-V157 HydrophobicContact CB-CG2 3.69Å; G153-V157 PolarHBondContact O-N 2.76Å; G153-V157 VanDerWaalsContact O-N 3.14Å; L154-V157 PolarHBondContact O-N 3.19Å; T155-V157 VanDerWaalsContact C-N 3.34Å; V157-I159 VanDerWaalsContact C-N 3.31Å; V157-I159 PolarHBondContact O-N 3.07Å; V157-M160 PolarHBondContact O-N 3.29Å; V157-L161 HydrophobicContact CG1-CD1 3.85Å; V157-L161 HydrophobicContact CG1-CG 4.09Å; V157-L161 WeakPolarHBondContact O-CB 3.32Å; V157-L161 VanDerWaalsContact O-CG 3.28Å; V157-L161 WeakPolarHBondContact O-CG 3.33Å; V157-L161 PolarHBondContact O-N 2.9Å
158I96.3Very high96.4Very high56 Ų5646.3 Ų46.329%0.28724%0.24SC..Hα-helixtrans-58.4-43.4178-75.4176.2000111.2A108 L154 T155 V156 F162A108-I158 HydrophobicContact CB-CG2 3.97Å; L154-I158 HydrophobicContact CD1-CD1 4.06Å; L154-I158 HydrophobicContact CD1-CG1 4.12Å; L154-I158 HydrophobicContact CD2-CD1 4.47Å; L154-I158 HydrophobicContact CG-CD1 3.89Å; L154-I158 HydrophobicContact CG-CG1 4.35Å; L154-I158 WeakPolarHBondContact O-CB 3.31Å; L154-I158 WeakPolarHBondContact O-CG1 3.44Å; L154-I158 PolarHBondContact O-N 3.31Å; T155-I158 PolarHBondContact O-N 2.81Å; V156-I158 PolarHBondContact O-N 2.61Å; I158-F162 WeakPolarHBondContact O-CB 3.22Å; I158-F162 PolarHBondContact O-N 3.04Å
159I98Very high96.4Very high88 Ų8845.3 Ų45.345%0.45123%0.233SC..Hα-helixtrans-64-45.5177.9-67.1166.8000110.7T155 V156 V157 F162 L163T155-I159 HydrophobicContact CG2-CD1 4.19Å; T155-I159 WeakPolarHBondContact O-CG1 3.36Å; T155-I159 PolarHBondContact O-N 3.04Å; T155-I159 VanDerWaalsContact O-N 3.09Å; V156-I159 PolarHBondContact O-N 3.04Å; V157-I159 VanDerWaalsContact C-N 3.31Å; V157-I159 PolarHBondContact O-N 3.07Å; I159-F162 WeakPolarHBondContact O-CB 3.41Å; I159-F162 PolarHBondContact O-N 3.2Å; I159-L163 HydrophobicContact CG2-CD1 4.28Å; I159-L163 WeakPolarHBondContact O-CG 3.42Å; I159-L163 PolarHBondContact O-N 2.99Å
160M98.1Very high96.3Very high31 Ų3138.9 Ų38.915%0.15321%0.205CC..Hα-helixtrans-67-40.2-179.7-67.7-60.6140.900112.4I143 L147 I150 V156 V157 F162 L163 L164I143-M160 HydrophobicContact CD1-SD 4.05Å; I143-M160 HydrophobicContact CG2-CB 4.15Å; I143-M160 HydrophobicContact CG2-SD 4.05Å; L147-M160 HydrophobicContact CD1-CB 3.77Å; L147-M160 HydrophobicContact CD1-CG 4.16Å; I150-M160 HydrophobicContact CD1-CE 3.7Å; I150-M160 HydrophobicContact CD1-CG 3.97Å; I150-M160 HydrophobicContact CD1-SD 3.89Å; V156-M160 HydrophobicContact CG1-CG 4.33Å; V156-M160 VanDerWaalsContact O-CG 3.31Å; V156-M160 WeakPolarHBondContact O-CG 3.39Å; V156-M160 PolarHBondContact O-N 3.39Å; V157-M160 PolarHBondContact O-N 3.29Å; M160-F162 VanDerWaalsContact C-N 3.34Å; M160-L163 HydrophobicContact CE-CD1 4.39Å; M160-L163 PolarHBondContact O-N 3.32Å; M160-L163 HydrophobicContact SD-CD1 4.29Å; M160-L164 PolarHBondContact O-N 3.27Å
161L97.6Very high96.4Very high0 Ų036.1 Ų36.10%019%0.191CC..Hα-helixtrans-63.1-40.6173.9-73.5-174000111.6T43 M105 A108 V109 V157 L163 L164 G165T43-L161 HydrophobicContact CG2-CD1 4.34Å; M105-L161 HydrophobicContact CB-CD1 3.67Å; M105-L161 HydrophobicContact CE-CD1 3.87Å; M105-L161 HydrophobicContact CG-CD1 3.87Å; A108-L161 HydrophobicContact CB-CB 4.43Å; V109-L161 HydrophobicContact CG2-CB 3.71Å; V109-L161 HydrophobicContact CG2-CD1 4.46Å; V109-L161 HydrophobicContact CG2-CD2 4.15Å; V109-L161 HydrophobicContact CG2-CG 4.32Å; V157-L161 HydrophobicContact CG1-CD1 3.85Å; V157-L161 HydrophobicContact CG1-CG 4.09Å; V157-L161 WeakPolarHBondContact O-CB 3.32Å; V157-L161 VanDerWaalsContact O-CG 3.28Å; V157-L161 WeakPolarHBondContact O-CG 3.33Å; V157-L161 PolarHBondContact O-N 2.9Å; L161-L163 PolarHBondContact O-N 3.35Å; L161-L164 HydrophobicContact CD2-CD1 4.2Å; L161-L164 PolarHBondContact O-N 2.97Å; L161-G165 PolarHBondContact O-N 3.5Å
162F98Very high96.4Very high61 Ų6136.7 Ų36.727%0.26819%0.194SC..Hα-helixtrans-59.3-45.3171.5175.7-86.4000111.7A108 A111 G112 I115 I158 I159 M160 G165 F166A108-F162 HydrophobicContact CB-CB 4.36Å; A108-F162 WeakPolarHBondContact O-CA 3.25Å; A108-F162 WeakPolarHBondContact O-CD2 3.14Å; A111-F162 HydrophobicContact CB-CD2 4.22Å; A111-F162 HydrophobicContact CB-CE2 4.15Å; G112-F162 VanDerWaalsContact CA-CE2 3.5Å; G112-F162 WeakPolarHBondContact CA-O 3.39Å; I115-F162 HydrophobicContact CB-CZ 4.46Å; I115-F162 HydrophobicContact CD1-CE2 3.84Å; I115-F162 HydrophobicContact CD1-CZ 3.67Å; I158-F162 WeakPolarHBondContact O-CB 3.22Å; I158-F162 PolarHBondContact O-N 3.04Å; I159-F162 WeakPolarHBondContact O-CB 3.41Å; I159-F162 PolarHBondContact O-N 3.2Å; M160-F162 VanDerWaalsContact C-N 3.34Å; F162-G165 PolarHBondContact O-N 3.05Å; F162-F166 WeakPolarHBondContact O-CB 3.35Å; F162-F166 PolarHBondContact O-N 2.81Å
163L98.6Very high96.6Very high51 Ų5129 Ų2927%0.26716%0.158SC..Hα-helixtrans-65.4-40178-69174.5000112.5I143 I159 M160 L161 G165 F166 F167I143-L163 HydrophobicContact CD1-CB 4.24Å; I143-L163 HydrophobicContact CD1-CD1 4Å; I143-L163 HydrophobicContact CG1-CB 4.19Å; I159-L163 HydrophobicContact CG2-CD1 4.28Å; I159-L163 WeakPolarHBondContact O-CG 3.42Å; I159-L163 PolarHBondContact O-N 2.99Å; M160-L163 HydrophobicContact CE-CD1 4.39Å; M160-L163 PolarHBondContact O-N 3.32Å; M160-L163 HydrophobicContact SD-CD1 4.29Å; L161-L163 PolarHBondContact O-N 3.35Å; L163-G165 VanDerWaalsContact C-N 3.32Å; L163-G165 PolarHBondContact O-N 3.44Å; L163-F166 WeakPolarHBondContact O-CB 3.41Å; L163-F166 PolarHBondContact O-N 3.31Å; L163-F167 HydrophobicContact CB-CE2 4.45Å; L163-F167 WeakPolarHBondContact O-CD2 3.16Å; L163-F167 PolarHBondContact O-N 3.31Å
164L98.2Very high96.8Very high0 Ų027.7 Ų27.70%015%0.145CC..Hα-helixtrans-57-48.3171.8-79.1173.6000111I143 N144 L147 M160 L161 F166 A168I143-L164 HydrophobicContact CB-CD2 3.79Å; I143-L164 HydrophobicContact CB-CG 4.12Å; I143-L164 HydrophobicContact CG2-CD1 4.29Å; I143-L164 HydrophobicContact CG2-CD2 3.82Å; I143-L164 HydrophobicContact CG2-CG 3.59Å; N144-L164 VanDerWaalsContact ND2-CD2 3.31Å; N144-L164 WeakPolarHBondContact ND2-CD2 3.37Å; L147-L164 HydrophobicContact CD2-CD1 4.22Å; M160-L164 PolarHBondContact O-N 3.27Å; L161-L164 HydrophobicContact CD2-CD1 4.2Å; L161-L164 PolarHBondContact O-N 2.97Å; L164-F166 VanDerWaalsContact C-N 3.35Å; L164-F166 PolarHBondContact O-N 3.43Å; L164-A168 WeakPolarHBondContact O-CB 3.23Å; L164-A168 PolarHBondContact O-N 2.94Å
165G97.1Very high96.9Very high0 Ų025.7 Ų25.70%014%0.135CC..Hα-helixtrans-56-47.5173.500000112.4V109 G113 L161 F162 L163 A168 G169V109-G165 VanDerWaalsContact O-CA 3.26Å; V109-G165 WeakPolarHBondContact O-CA 3.4Å; G113-G165 WeakPolarHBondContact CA-O 3.14Å; G113-G165 VanDerWaalsContact N-C 3.28Å; G113-G165 PolarHBondContact N-O 3.35Å; L161-G165 PolarHBondContact O-N 3.5Å; F162-G165 PolarHBondContact O-N 3.05Å; L163-G165 VanDerWaalsContact C-N 3.32Å; L163-G165 PolarHBondContact O-N 3.44Å; G165-A168 PolarHBondContact O-N 3.29Å; G165-G169 PolarHBondContact O-N 3.37Å
166F98.1Very high96.8Very high35 Ų3520.9 Ų20.915%0.15411%0.105CC..Hα-helixtrans-57.1-53.1-179.7176.2-95.8000112.6G112 I115 G116 V119 F120 F162 L163 L164 G170G112-F166 VanDerWaalsContact C-CA 3.48Å; G112-F166 VanDerWaalsContact C-N 3.29Å; G112-F166 WeakPolarHBondContact O-CA 3.31Å; I115-F166 HydrophobicContact CB-CD2 4.36Å; I115-F166 HydrophobicContact CG2-CD2 4.01Å; I115-F166 HydrophobicContact CG2-CE2 3.97Å; G116-F166 VanDerWaalsContact CA-O 3.25Å; G116-F166 WeakPolarHBondContact CA-O 3.26Å; V119-F166 HydrophobicContact CB-CE2 3.99Å; V119-F166 HydrophobicContact CB-CZ 4.12Å; V119-F166 HydrophobicContact CG1-CE2 4.34Å; V119-F166 HydrophobicContact CG1-CZ 3.97Å; V119-F166 HydrophobicContact CG2-CE2 4.01Å; V119-F166 HydrophobicContact CG2-CZ 4.45Å; F120-F166 HydrophobicContact CD2-CE1 4.23Å; F120-F166 HydrophobicContact CD2-CZ 4.27Å; F120-F166 AromaticContact CE2-CD1 3.93Å; F120-F166 HydrophobicContact CE2-CD1 3.93Å; F120-F166 AromaticContact CE2-CE1 3.37Å; F120-F166 HydrophobicContact CE2-CE1 3.37Å; F120-F166 AromaticContact CE2-CZ 3.79Å; F120-F166 HydrophobicContact CE2-CZ 3.79Å; F120-F166 HydrophobicContact CZ-CE1 4.06Å; F162-F166 WeakPolarHBondContact O-CB 3.35Å; F162-F166 PolarHBondContact O-N 2.81Å; L163-F166 WeakPolarHBondContact O-CB 3.41Å; L163-F166 PolarHBondContact O-N 3.31Å; L164-F166 VanDerWaalsContact C-N 3.35Å; L164-F166 PolarHBondContact O-N 3.43Å; F166-G170 PolarHBondContact O-N 2.86Å; F166-G170 VanDerWaalsContact O-N 3.15Å
167F98.6Very high96.6Very high41 Ų4118.2 Ų18.218%0.189%0.089CC..Hα-helixtrans-69.4-40.4179.6-69.5-62.1000112.5F120 C136 I143 L163 G170 Y171F120-F167 AromaticContact CE2-CD1 3.84Å; F120-F167 HydrophobicContact CE2-CD1 3.84Å; F120-F167 HydrophobicContact CE2-CE1 4.25Å; F120-F167 AromaticContact CZ-CD1 3.81Å; F120-F167 HydrophobicContact CZ-CD1 3.81Å; F120-F167 AromaticContact CZ-CE1 3.96Å; F120-F167 HydrophobicContact CZ-CE1 3.96Å; C136-F167 WeakPolarHBondContact CB-O 3.09Å; C136-F167 WeakPolarHBondContact O-CB 3.33Å; I143-F167 HydrophobicContact CG1-CD2 4.35Å; I143-F167 HydrophobicContact CG1-CE2 4.27Å; L163-F167 HydrophobicContact CB-CE2 4.45Å; L163-F167 WeakPolarHBondContact O-CD2 3.16Å; L163-F167 PolarHBondContact O-N 3.31Å; F167-G170 PolarHBondContact O-N 2.98Å; F167-Y171 PolarHBondContact O-N 3.48Å
168A97.6Very high96.5Very high0 Ų018.7 Ų18.70%09%0.092CC..Hα-helixtrans-65.1-43.2178.600000111.3V36 M40 C140 L164 G165 G170 Y171 L172V36-A168 HydrophobicContact CG1-CB 3.97Å; M40-A168 HydrophobicContact CB-CB 4.09Å; M40-A168 HydrophobicContact CE-CB 3.76Å; C140-A168 PolarHBondContact SG-N 3.31Å; C140-A168 VanDerWaalsContact SG-N 3.4Å; L164-A168 WeakPolarHBondContact O-CB 3.23Å; L164-A168 PolarHBondContact O-N 2.94Å; G165-A168 PolarHBondContact O-N 3.29Å; A168-G170 VanDerWaalsContact C-N 3.34Å; A168-G170 PolarHBondContact O-N 3.24Å; A168-Y171 WeakPolarHBondContact O-CB 3.49Å; A168-Y171 PolarHBondContact O-N 3.37Å; A168-Y171 VanDerWaalsContact O-N 3.14Å; A168-L172 WeakPolarHBondContact O-CG 3.25Å; A168-L172 PolarHBondContact O-N 3.4Å
169G95.7Very high96.4Very high0 Ų016.1 Ų16.10%08%0.079CC..Hα-helixtrans-59.8-42.8176.900000112.4M40 S117 G165 Y171 L172 V173M40-G169 VanDerWaalsContact CE-N 3.28Å; S117-G169 PolarHBondContact OG-O 2.87Å; G165-G169 PolarHBondContact O-N 3.37Å; G169-Y171 PolarHBondContact O-N 3.24Å; G169-L172 PolarHBondContact O-N 3.13Å; G169-V173 PolarHBondContact O-N 3.05Å
170G97.2Very high96.2Very high0 Ų012 Ų120%06%0.058CC..Hα-helixtrans-60.4-43.917300000112.8C136 F166 F167 A168 L172 V173 I174C136-G170 VanDerWaalsContact SG-C 3.54Å; F166-G170 PolarHBondContact O-N 2.86Å; F166-G170 VanDerWaalsContact O-N 3.15Å; F167-G170 PolarHBondContact O-N 2.98Å; A168-G170 VanDerWaalsContact C-N 3.34Å; A168-G170 PolarHBondContact O-N 3.24Å; G170-L172 PolarHBondContact O-N 3.46Å; G170-V173 PolarHBondContact O-N 3.47Å; G170-I174 WeakPolarHBondContact O-CD1 3.44Å; G170-I174 WeakPolarHBondContact O-CG1 3.42Å; G170-I174 PolarHBondContact O-N 3.21Å
171Y97.7Very high95.9Very high0 Ų010.5 Ų10.50%05%0.051CC..Hα-helixtrans-59.7-44.2176.6-163.7-87.5000112.2T29 S32 Y33 V36 L133 C136 L137 F167 A168 G169 V173 I174 S175 H232T29-Y171 WeakPolarHBondContact CA-OH 3.33Å; T29-Y171 PolarHBondContact O-OH 2.99Å; S32-Y171 WeakPolarHBondContact CB-OH 3.21Å; S32-Y171 PolarHBondContact OG-OH 3.48Å; Y33-Y171 HydrophobicContact CD2-CE1 4.07Å; Y33-Y171 HydrophobicContact CE2-CD1 4.16Å; Y33-Y171 AromaticContact CE2-CE1 3.78Å; Y33-Y171 HydrophobicContact CE2-CE1 3.78Å; V36-Y171 HydrophobicContact CB-CD1 4.2Å; V36-Y171 HydrophobicContact CG1-CD1 3.95Å; V36-Y171 HydrophobicContact CG1-CG 4.21Å; V36-Y171 HydrophobicContact CG2-CD1 3.7Å; V36-Y171 HydrophobicContact CG2-CD2 4.17Å; V36-Y171 HydrophobicContact CG2-CE1 4.21Å; V36-Y171 HydrophobicContact CG2-CG 3.69Å; L133-Y171 HydrophobicContact CB-CE2 4.47Å; L133-Y171 HydrophobicContact CD2-CD2 3.65Å; L133-Y171 HydrophobicContact CD2-CE2 3.49Å; L133-Y171 VanDerWaalsContact CD2-CE2 3.49Å; L133-Y171 HydrophobicContact CD2-CG 4.22Å; C136-Y171 HydrophobicContact CB-CD2 4.03Å; C136-Y171 PolarHBondContact SG-N 3.36Å; L137-Y171 HydrophobicContact CB-CD2 4.21Å; L137-Y171 HydrophobicContact CB-CE2 4.11Å; L137-Y171 HydrophobicContact CD2-CE2 4.5Å; F167-Y171 PolarHBondContact O-N 3.48Å; A168-Y171 WeakPolarHBondContact O-CB 3.49Å; A168-Y171 PolarHBondContact O-N 3.37Å; A168-Y171 VanDerWaalsContact O-N 3.14Å; G169-Y171 PolarHBondContact O-N 3.24Å; Y171-V173 VanDerWaalsContact C-N 3.26Å; Y171-V173 PolarHBondContact O-N 3.19Å; Y171-I174 PolarHBondContact O-N 3.01Å; Y171-S175 VanDerWaalsContact CE1-CB 3.41Å; Y171-S175 VanDerWaalsContact O-CB 3.26Å; Y171-S175 WeakPolarHBondContact O-CB 3.32Å; Y171-S175 PolarHBondContact O-N 2.8Å; Y171-S175 PolarHBondContact O-OG 2.83Å; Y171-H232 AromaticContact CE2-NE2 4Å; Y171-H232 PolarHBondContact OH-CE1 2.7Å; Y171-H232 VanDerWaalsContact OH-CE1 3.29Å; Y171-H232 PolarHBondContact OH-NE2 3.21Å
172L94.5Very high95.7Very high13 Ų1310.7 Ų10.77%0.0685%0.051CC..Hα-helixtrans-57.3-37.5-179.8-67.8179000113.3Y33 V36 M40 A168 G169 G170 W197Y33-L172 HydrophobicContact CD1-CD2 4.25Å; Y33-L172 HydrophobicContact CE1-CD2 3.26Å; Y33-L172 WeakPolarHBondContact OH-CD2 3.24Å; V36-L172 HydrophobicContact CG1-CD2 4.29Å; M40-L172 HydrophobicContact CE-CD1 3.8Å; M40-L172 HydrophobicContact CG-CD1 4.43Å; A168-L172 WeakPolarHBondContact O-CG 3.25Å; A168-L172 PolarHBondContact O-N 3.4Å; G169-L172 PolarHBondContact O-N 3.13Å; G170-L172 PolarHBondContact O-N 3.46Å; L172-W197 HydrophobicContact CD1-CZ3 4.02Å; L172-W197 HydrophobicContact CD2-CE3 3.69Å; L172-W197 HydrophobicContact CD2-CZ3 3.75Å
173V94.4Very high95.4Very high1 Ų17.8 Ų7.81%0.0064%0.039CC..Hα-helixtrans-69.4-45-179.6171.20000110.8G169 G170 Y171 S421 R424 N428G169-V173 PolarHBondContact O-N 3.05Å; G170-V173 PolarHBondContact O-N 3.47Å; Y171-V173 VanDerWaalsContact C-N 3.26Å; Y171-V173 PolarHBondContact O-N 3.19Å; V173-S421 VanDerWaalsContact CG1-O 3.24Å; V173-S421 WeakPolarHBondContact CG1-O 3.44Å; V173-R424 HydrophobicContact CG1-CB 3.88Å; V173-R424 PolarHBondContact O-NE 3.01Å; V173-R424 PolarHBondContact O-NH2 3.29Å; V173-N428 HydrophobicContact CG2-CB 3.98Å
174I95.7Very high95Very high0 Ų05.5 Ų5.50%03%0.027CC..Hα-helixtrans-87.4-37.2-168-51.4161.3000112.3F120 A124 R129 L133 G170 Y171 V176 V177 P178F120-I174 HydrophobicContact CB-CD1 3.92Å; A124-I174 HydrophobicContact CB-CD1 3.72Å; A124-I174 HydrophobicContact CB-CG1 3.65Å; A124-I174 HydrophobicContact CB-CG2 4.08Å; R129-I174 HydrophobicContact CB-CG2 4.26Å; L133-I174 HydrophobicContact CD1-CG2 3.95Å; L133-I174 HydrophobicContact CD2-CB 3.8Å; L133-I174 HydrophobicContact CD2-CG2 3.94Å; L133-I174 HydrophobicContact CG-CB 4.03Å; L133-I174 HydrophobicContact CG-CG2 3.61Å; G170-I174 WeakPolarHBondContact O-CD1 3.44Å; G170-I174 WeakPolarHBondContact O-CG1 3.42Å; G170-I174 PolarHBondContact O-N 3.21Å; Y171-I174 PolarHBondContact O-N 3.01Å; I174-V176 PolarHBondContact O-N 3.48Å; I174-V177 WeakPolarHBondContact O-CB 3.49Å; I174-V177 PolarHBondContact O-N 3.38Å; I174-P178 WeakPolarHBondContact O-CD 3.39Å
175S95.2Very high94.3Very high0 Ų06.1 Ų6.10%03%0.03CC..THydrogen-bonded Turntrans-57.9-27.6-165.767.20000115.7Y33 Y171 P179Y33-S175 WeakPolarHBondContact CE2-OG 3.4Å; Y33-S175 PolarHBondContact OH-OG 2.86Å; Y171-S175 VanDerWaalsContact CE1-CB 3.41Å; Y171-S175 VanDerWaalsContact O-CB 3.26Å; Y171-S175 WeakPolarHBondContact O-CB 3.32Å; Y171-S175 PolarHBondContact O-N 2.8Å; Y171-S175 PolarHBondContact O-OG 2.83Å; S175-P179 VanDerWaalsContact O-CD 3.3Å; S175-P179 WeakPolarHBondContact O-CD 3.27Å
176V92.2Very high93.8Very high5 Ų514 Ų143%0.036%0.06CC..THydrogen-bonded Turntrans-81.8-19.7-179.8-171.40000111.7I174 V180 N192 H195 V412 R424I174-V176 PolarHBondContact O-N 3.48Å; V176-V180 WeakPolarHBondContact O-CG2 3.36Å; V176-N192 WeakPolarHBondContact CG1-OD1 3.49Å; V176-H195 WeakPolarHBondContact CG2-ND1 3.41Å; V176-V412 HydrophobicContact CG1-CG2 4.44Å; V176-R424 VanDerWaalsContact CB-NH2 3.3Å
177V93.6Very high93.4Very high0 Ų015 Ų150%06%0.063CC..Hα-helixtrans-72.4-51.7-174.6177.80000112.1I174 V180 E181 V412 R420I174-V177 WeakPolarHBondContact O-CB 3.49Å; I174-V177 PolarHBondContact O-N 3.38Å; V177-V180 PolarHBondContact O-N 3.4Å; V177-V180 VanDerWaalsContact O-N 3.13Å; V177-E181 HydrophobicContact CG1-CG 3.87Å; V177-E181 WeakPolarHBondContact CG1-OE1 3.18Å; V177-E181 WeakPolarHBondContact O-CG 3.22Å; V177-E181 PolarHBondContact O-N 3.32Å; V177-V412 HydrophobicContact CG2-CG2 4.5Å; V177-R420 HydrophobicContact CG2-CG 4.34Å
178P94.9Very high93.1Very high11 Ų1113 Ų137%0.0715%0.054CC..Hα-helixtrans-57.7-47.5-177.1-19.625.9000114.7V25 R129 L133 I174 V180 E181 V182V25-P178 HydrophobicContact CG1-CB 4.2Å; R129-P178 HydrophobicContact CB-CG 4.14Å; L133-P178 HydrophobicContact CD1-CG 3.67Å; I174-P178 WeakPolarHBondContact O-CD 3.39Å; P178-V180 PolarHBondContact O-N 3.45Å; P178-E181 PolarHBondContact O-N 3.38Å; P178-E181 VanDerWaalsContact O-N 3.13Å; P178-V182 WeakPolarHBondContact O-CG2 3.43Å; P178-V182 PolarHBondContact O-N 3.14Å
179P94.3Very high92.8Very high2 Ų213.2 Ų13.21%0.0136%0.055CC..Hα-helixtrans-58-34178.1-2535.1000112.8V25 L26 T29 S175 T183 C191V25-P179 HydrophobicContact CG1-CG 4.31Å; L26-P179 HydrophobicContact CD1-CB 3.98Å; L26-P179 HydrophobicContact CD1-CG 4.22Å; T29-P179 HydrophobicContact CG2-CG 4.44Å; T29-P179 VanDerWaalsContact OG1-CG 3.32Å; T29-P179 WeakPolarHBondContact OG1-CG 3.42Å; S175-P179 VanDerWaalsContact O-CD 3.3Å; S175-P179 WeakPolarHBondContact O-CD 3.27Å; P179-T183 WeakPolarHBondContact O-CB 3.23Å; P179-T183 WeakPolarHBondContact O-CG2 3.48Å; P179-T183 PolarHBondContact O-OG1 3.03Å; P179-C191 HydrophobicContact CB-CB 4.2Å
180V92.2Very high92.7Very high1 Ų114.2 Ų14.21%0.0066%0.06CC..Hα-helixtrans-77.9-34.9178.4175.80000112.1V176 V177 P178 T183 R188 V412 L479V176-V180 WeakPolarHBondContact O-CG2 3.36Å; V177-V180 PolarHBondContact O-N 3.4Å; V177-V180 VanDerWaalsContact O-N 3.13Å; P178-V180 PolarHBondContact O-N 3.45Å; V180-T183 PolarHBondContact O-OG1 2.88Å; V180-R188 HydrophobicContact CG1-CB 4.3Å; V180-R188 HydrophobicContact CG1-CG 3.8Å; V180-V412 HydrophobicContact CB-CG1 3.77Å; V180-V412 HydrophobicContact CG1-CB 4.25Å; V180-V412 HydrophobicContact CG1-CG1 3.26Å; V180-V412 HydrophobicContact CG2-CG1 4.3Å; V180-L479 HydrophobicContact CG1-CD1 4.39Å
181E93Very high92.5Very high0 Ų014.4 Ų14.40%06%0.062CC..Hα-helixtrans-73.8-26.7179.9-73-179.1174.500113.1R129 V177 P178 S238 R240 R420R129-E181 IonicContact CZ-OE1 3.26Å; R129-E181 IonicContact NE-OE1 3.42Å; R129-E181 PolarHBondContact NE-OE1 3.23Å; R129-E181 IonicContact NE-OE2 3.76Å; R129-E181 IonicContact NH2-OE1 3.1Å; R129-E181 PolarHBondContact NH2-OE1 3.38Å; V177-E181 HydrophobicContact CG1-CG 3.87Å; V177-E181 WeakPolarHBondContact CG1-OE1 3.18Å; V177-E181 WeakPolarHBondContact O-CG 3.22Å; V177-E181 PolarHBondContact O-N 3.32Å; P178-E181 PolarHBondContact O-N 3.38Å; P178-E181 VanDerWaalsContact O-N 3.13Å; E181-S238 WeakPolarHBondContact OE2-CB 3.31Å; E181-S238 PolarHBondContact OE2-OG 2.99Å; E181-R240 PolarHBondContact O-NE 2.93Å; E181-R420 IonicContact OE1-CZ 3.69Å; E181-R420 IonicContact OE1-NH1 3.38Å; E181-R420 PolarHBondContact OE1-NH1 3.27Å
182V92.9Very high92.2Very high3 Ų314.5 Ų14.52%0.0186%0.062CC..THydrogen-bonded Turntrans-93.81.8176.8-55.20000114.3Q22 V25 P178Q22-V182 HydrophobicContact CG-CB 4.5Å; Q22-V182 HydrophobicContact CG-CG2 4.02Å; Q22-V182 VanDerWaalsContact CG-O 3.24Å; Q22-V182 WeakPolarHBondContact CG-O 3.33Å; Q22-V182 PolarHBondContact NE2-O 2.9Å; V25-V182 HydrophobicContact CB-CG2 4.33Å; V25-V182 HydrophobicContact CG1-CG2 4.16Å; V25-V182 HydrophobicContact CG2-CG2 4.48Å; P178-V182 WeakPolarHBondContact O-CG2 3.43Å; P178-V182 PolarHBondContact O-N 3.14Å
183T92.3Very high92.1Very high0 Ų014.2 Ų14.20%06%0.061CC..SBendtrans-123.4170.2179.462.90000111.8L12 A17 F18 Q22 P179 V180L12-T183 VanDerWaalsContact CD1-O 3.3Å; L12-T183 WeakPolarHBondContact CD1-O 3.5Å; A17-T183 WeakPolarHBondContact O-CG2 3.12Å; F18-T183 HydrophobicContact CD2-CG2 3.75Å; F18-T183 HydrophobicContact CE2-CG2 4.27Å; Q22-T183 HydrophobicContact CB-CG2 3.81Å; Q22-T183 HydrophobicContact CG-CG2 3.75Å; P179-T183 WeakPolarHBondContact O-CB 3.23Å; P179-T183 WeakPolarHBondContact O-CG2 3.48Å; P179-T183 PolarHBondContact O-OG1 3.03Å; V180-T183 PolarHBondContact O-OG1 2.88Å
184T89.3Confident92Very high4 Ų418 Ų183%0.0258%0.081CC..  trans-101.3163.4179.964.80000111.5D9 L12 E13 A17 R186 W187 R188D9-T184 HydrophobicContact CB-CG2 4.19Å; D9-T184 WeakPolarHBondContact O-CG2 3.08Å; L12-T184 HydrophobicContact CB-CG2 3.67Å; L12-T184 HydrophobicContact CD1-CG2 4.36Å; E13-T184 HydrophobicContact CG-CG2 3.92Å; E13-T184 VanDerWaalsContact OE1-CB 3.31Å; E13-T184 WeakPolarHBondContact OE1-CB 3.35Å; E13-T184 WeakPolarHBondContact OE1-CG2 3.5Å; E13-T184 PolarHBondContact OE1-OG1 3.3Å; A17-T184 HydrophobicContact CB-CG2 3.43Å; A17-T184 VanDerWaalsContact CB-CG2 3.43Å; A17-T184 WeakPolarHBondContact CB-OG1 3.48Å; T184-R186 PolarHBondContact O-N 3.07Å; T184-W187 PolarHBondContact O-N 2.89Å; T184-R188 WeakPolarHBondContact O-CG 3.42Å; T184-R188 PolarHBondContact O-N 3.45Å
185N83.5Confident91.7Very high12 Ų1218.6 Ų18.66%0.0648%0.084CC..Hα-helixtrans-46.5-37-177-167.4-61000113.6D9 W187 R359 Y476 L477D9-N185 PolarHBondContact OD2-N 3.03Å; N185-W187 PolarHBondContact O-N 3.31Å; N185-R359 PolarHBondContact OD1-NH1 2.95Å; N185-R359 PolarHBondContact OD1-NH2 3.45Å; N185-Y476 VanDerWaalsContact ND2-CA 3.32Å; N185-Y476 WeakPolarHBondContact ND2-CA 3.31Å; N185-Y476 PolarHBondContact ND2-N 3.35Å; N185-Y476 PolarHBondContact OD1-N 2.97Å; N185-L477 PolarHBondContact ND2-N 3.26Å; N185-L477 PolarHBondContact ND2-O 3.07Å
186R86.4Confident91.6Very high166 Ų16618.7 Ų18.763%0.6268%0.084SC*.Hα-helixtrans-55.9-33.7178.7-179.9178.1175.8177.21.8113.5T184T184-R186 PolarHBondContact O-N 3.07Å
187W91.3Very high91.6Very high56 Ų5620 Ų2021%0.2129%0.089CC..Hα-helixtrans-109.2-11.6-170.1-57.3107.6000113.8F18 T184 N185 M189 L190 C191F18-W187 HydrophobicContact CB-CB 4.06Å; F18-W187 HydrophobicContact CB-CD2 3.54Å; F18-W187 HydrophobicContact CB-CE3 4.21Å; F18-W187 HydrophobicContact CB-CG 3.45Å; F18-W187 VanDerWaalsContact CB-CG 3.45Å; F18-W187 HydrophobicContact CB-CZ2 4.43Å; F18-W187 HydrophobicContact CD1-CD2 4.08Å; F18-W187 AromaticContact CD1-CE3 3.85Å; F18-W187 HydrophobicContact CD1-CE3 3.85Å; F18-W187 HydrophobicContact CD1-CZ3 4.24Å; F18-W187 HydrophobicContact CD2-CB 3.86Å; F18-W187 HydrophobicContact CD2-CG 4.17Å; F18-W187 HydrophobicContact CE1-CE3 4.46Å; F18-W187 HydrophobicContact CG-CB 4.01Å; F18-W187 AromaticContact CG-CD2 3.82Å; F18-W187 HydrophobicContact CG-CD2 3.82Å; F18-W187 HydrophobicContact CG-CE3 4.05Å; F18-W187 AromaticContact CG-CG 3.82Å; F18-W187 HydrophobicContact CG-CG 3.82Å; T184-W187 PolarHBondContact O-N 2.89Å; N185-W187 PolarHBondContact O-N 3.31Å; W187-M189 VanDerWaalsContact C-N 3.3Å; W187-M189 PolarHBondContact O-N 2.98Å; W187-L190 HydrophobicContact CE3-CD2 3.98Å; W187-L190 HydrophobicContact CZ3-CD2 4.22Å; W187-L190 WeakPolarHBondContact O-CB 3.24Å; W187-L190 PolarHBondContact O-N 3.49Å; W187-C191 PolarHBondContact O-N 3.01Å; W187-C191 PolarHBondContact O-SG 2.86Å
188R91.9Very high91.5Very high0 Ų020.3 Ų20.30%09%0.091CC..Hα-helixtrans-56.6-42.3-177.8-60.1-175.1173.6131.813.8112.8D9 V180 T184 L190 C191 N192 L409 L477D9-R188 IonicContact OD1-NH2 2.82Å; D9-R188 PolarHBondContact OD1-NH2 3.04Å; D9-R188 IonicContact OD2-CZ 3.08Å; D9-R188 IonicContact OD2-NH1 3.26Å; D9-R188 IonicContact OD2-NH2 2.64Å; D9-R188 PolarHBondContact OD2-NH2 3.48Å; V180-R188 HydrophobicContact CG1-CB 4.3Å; V180-R188 HydrophobicContact CG1-CG 3.8Å; T184-R188 WeakPolarHBondContact O-CG 3.42Å; T184-R188 PolarHBondContact O-N 3.45Å; R188-L190 VanDerWaalsContact C-N 3.34Å; R188-L190 PolarHBondContact O-N 3.38Å; R188-C191 PolarHBondContact O-N 3.37Å; R188-N192 WeakPolarHBondContact O-CB 3.33Å; R188-N192 PolarHBondContact O-N 3.02Å; R188-L409 HydrophobicContact CB-CD1 3.65Å; R188-L477 PolarHBondContact NH1-O 3Å
189M91.3Very high91.5Very high3 Ų324.2 Ų24.22%0.01511%0.107CC..Hα-helixtrans-63.4-40.7178-174.161.476.700111.8W187 N192 C193 P350 Y351 S354 R359 I406 L409W187-M189 VanDerWaalsContact C-N 3.3Å; W187-M189 PolarHBondContact O-N 2.98Å; M189-N192 PolarHBondContact O-N 3.34Å; M189-C193 WeakPolarHBondContact O-CB 3.35Å; M189-C193 PolarHBondContact O-N 2.98Å; M189-C193 PolarHBondContact O-SG 3.49Å; M189-P350 HydrophobicContact SD-CB 4.14Å; M189-Y351 HydrophobicContact CB-CD2 4.45Å; M189-Y351 HydrophobicContact CG-CD2 4.31Å; M189-S354 WeakPolarHBondContact CG-OG 3.36Å; M189-R359 HydrophobicContact CE-CG 3.77Å; M189-I406 HydrophobicContact CE-CD1 3.3Å; M189-I406 HydrophobicContact SD-CD1 4.18Å; M189-L409 HydrophobicContact CB-CD2 4.2Å; M189-L409 HydrophobicContact CE-CD2 3.29Å; M189-L409 HydrophobicContact SD-CD2 3.8Å
190L93.2Very high91.5Very high22 Ų2224.1 Ų24.112%0.11511%0.106CC..Hα-helixtrans-62.3-48.5177.2-179.760.1000110.8F18 W187 R188 N192 C193 L194 F348 Y351F18-L190 HydrophobicContact CD1-CD2 4.49Å; F18-L190 HydrophobicContact CE1-CD2 3.76Å; F18-L190 HydrophobicContact CZ-CD2 4.06Å; W187-L190 HydrophobicContact CE3-CD2 3.98Å; W187-L190 HydrophobicContact CZ3-CD2 4.22Å; W187-L190 WeakPolarHBondContact O-CB 3.24Å; W187-L190 PolarHBondContact O-N 3.49Å; R188-L190 VanDerWaalsContact C-N 3.34Å; R188-L190 PolarHBondContact O-N 3.38Å; L190-N192 PolarHBondContact O-N 2.92Å; L190-C193 PolarHBondContact O-N 3.13Å; L190-L194 HydrophobicContact CD1-CD1 3.87Å; L190-L194 HydrophobicContact CD1-CG 4.16Å; L190-L194 HydrophobicContact CG-CD1 3.98Å; L190-L194 WeakPolarHBondContact O-CB 3.46Å; L190-L194 WeakPolarHBondContact O-CG 3.36Å; L190-L194 PolarHBondContact O-N 3.36Å; L190-F348 HydrophobicContact CD1-CE2 4.05Å; L190-F348 HydrophobicContact CD1-CZ 4.25Å; L190-Y351 HydrophobicContact CB-CD2 3.93Å; L190-Y351 HydrophobicContact CB-CE2 3.69Å; L190-Y351 HydrophobicContact CD1-CD1 4.19Å; L190-Y351 HydrophobicContact CD1-CD2 4.26Å; L190-Y351 HydrophobicContact CD1-CE1 4.07Å; L190-Y351 HydrophobicContact CD1-CE2 4.17Å; L190-Y351 HydrophobicContact CD1-CG 4.28Å; L190-Y351 HydrophobicContact CG-CE2 4.37Å
191C92.8Very high91.6Very high4 Ų424 Ų243%0.02711%0.106CC..Hα-helixtrans-55.2-43.5177.4-61.30000111.6F18 L26 P179 W187 R188F18-C191 WeakPolarHBondContact CE2-SG 3.26Å; L26-C191 HydrophobicContact CD1-CB 3.97Å; P179-C191 HydrophobicContact CB-CB 4.2Å; W187-C191 PolarHBondContact O-N 3.01Å; W187-C191 PolarHBondContact O-SG 2.86Å; R188-C191 PolarHBondContact O-N 3.37Å
192N91Very high91.7Very high2 Ų225.8 Ų25.81%0.01112%0.115CC..Hα-helixtrans-76.4-33-178.4-173.783.2000113.2V176 R188 M189 L190 L194 H195 K405 H408 L409V176-N192 WeakPolarHBondContact CG1-OD1 3.49Å; R188-N192 WeakPolarHBondContact O-CB 3.33Å; R188-N192 PolarHBondContact O-N 3.02Å; M189-N192 PolarHBondContact O-N 3.34Å; L190-N192 PolarHBondContact O-N 2.92Å; N192-L194 VanDerWaalsContact C-N 3.32Å; N192-H195 WeakPolarHBondContact O-CB 3.28Å; N192-H195 PolarHBondContact O-N 2.92Å; N192-K405 PolarHBondContact ND2-O 2.95Å; N192-H408 WeakPolarHBondContact OD1-CB 3.25Å; N192-L409 HydrophobicContact CB-CB 4.33Å; N192-L409 HydrophobicContact CB-CD1 4.44Å; N192-L409 PolarHBondContact OD1-N 3.09Å
193C92.2Very high91.9Very high6 Ų626.4 Ų26.44%0.04112%0.12CC..Hα-helixtrans-64.7-41.1172.5-69.60000110.7M189 L190 H195 F348 K405M189-C193 WeakPolarHBondContact O-CB 3.35Å; M189-C193 PolarHBondContact O-N 2.98Å; M189-C193 PolarHBondContact O-SG 3.49Å; L190-C193 PolarHBondContact O-N 3.13Å; C193-H195 PolarHBondContact O-N 3.49Å; C193-F348 HydrophobicContact CB-CD2 4.09Å; C193-K405 PolarHBondContact O-NZ 3.16Å
194L92.3Very high92Very high80 Ų8026.4 Ų26.442%0.41912%0.12SC..THydrogen-bonded Turntrans-73.716.8174.1-65.3175.3000114.1L26 Q30 L190 N192 G196 F348L26-L194 HydrophobicContact CD2-CB 4.22Å; L26-L194 HydrophobicContact CD2-CD1 3.76Å; Q30-L194 WeakPolarHBondContact CG-O 3.43Å; L190-L194 HydrophobicContact CD1-CD1 3.87Å; L190-L194 HydrophobicContact CD1-CG 4.16Å; L190-L194 HydrophobicContact CG-CD1 3.98Å; L190-L194 WeakPolarHBondContact O-CB 3.46Å; L190-L194 WeakPolarHBondContact O-CG 3.36Å; L190-L194 PolarHBondContact O-N 3.36Å; N192-L194 VanDerWaalsContact C-N 3.32Å; L194-G196 PolarHBondContact O-N 3.08Å; L194-F348 HydrophobicContact CD2-CE2 4.19Å
195H90.8Very high92.3Very high14 Ų1426.3 Ų26.37%0.06512%0.12CC..  trans-52.2138.7175.1177.872.4000112.4Q30 Y33 V176 N192 C193 W197 P198Q30-H195 VanDerWaalsContact OE1-CA 3.25Å; Q30-H195 PolarHBondContact OE1-ND1 2.91Å; Y33-H195 AromaticContact CE1-CE1 3.88Å; Y33-H195 AromaticContact CE1-NE2 3.84Å; Y33-H195 AromaticContact CZ-CE1 3.41Å; Y33-H195 VanDerWaalsContact CZ-CE1 3.41Å; Y33-H195 AromaticContact CZ-NE2 3.86Å; Y33-H195 PolarHBondContact OH-CE1 3.3Å; V176-H195 WeakPolarHBondContact CG2-ND1 3.41Å; N192-H195 WeakPolarHBondContact O-CB 3.28Å; N192-H195 PolarHBondContact O-N 2.92Å; C193-H195 PolarHBondContact O-N 3.49Å; H195-W197 VanDerWaalsContact CD2-CB 3.41Å; H195-W197 WeakPolarHBondContact CD2-CB 3.48Å; H195-W197 PolarHBondContact CD2-N 2.9Å; H195-W197 WeakPolarHBondContact NE2-CB 3.39Å; H195-W197 PolarHBondContact O-N 3.44Å; H195-P198 WeakPolarHBondContact O-CD 3.31Å
196G92.8Very high92.9Very high1 Ų130.2 Ų30.21%0.0114%0.14CC..SBendtrans-73.5-17.3-168.400000115.7Q30 Y33 L194 F199 G200Q30-G196 WeakPolarHBondContact O-CA 3.24Å; Y33-G196 VanDerWaalsContact CB-C 3.49Å; Y33-G196 VanDerWaalsContact CB-O 3.29Å; Y33-G196 WeakPolarHBondContact CB-O 3.47Å; Y33-G196 VanDerWaalsContact CG-C 3.44Å; L194-G196 PolarHBondContact O-N 3.08Å; G196-F199 CarbonylContact O-C 3.59Å; G196-F199 WeakPolarHBondContact O-CB 3.4Å; G196-F199 PolarHBondContact O-N 3.27Å; G196-F199 VanDerWaalsContact O-N 3.1Å; G196-G200 PolarHBondContact O-N 2.79Å
197W91.7Very high93.4Very high32 Ų3222.7 Ų22.712%0.12111%0.113CC..Hα-helixtrans-53.4-48.8-176.2-177.7-90.5000115Y33 M40 L41 L172 H195 F199 G200 C201Y33-W197 HydrophobicContact CD1-CB 4.04Å; Y33-W197 HydrophobicContact CD1-CE3 4.05Å; Y33-W197 HydrophobicContact CE1-CB 4Å; Y33-W197 AromaticContact CE1-CE3 3.92Å; Y33-W197 HydrophobicContact CE1-CE3 3.92Å; M40-W197 HydrophobicContact CB-CH2 4.21Å; M40-W197 HydrophobicContact CB-CZ3 4.22Å; M40-W197 HydrophobicContact CG-CH2 3.82Å; M40-W197 HydrophobicContact CG-CZ3 4.12Å; L41-W197 HydrophobicContact CD1-CH2 4.02Å; L41-W197 HydrophobicContact CD1-CZ2 3.67Å; L41-W197 HydrophobicContact CD2-CH2 4.27Å; L41-W197 HydrophobicContact CD2-CZ2 4.25Å; L41-W197 HydrophobicContact CG-CH2 3.95Å; L41-W197 HydrophobicContact CG-CZ2 4.06Å; L172-W197 HydrophobicContact CD1-CZ3 4.02Å; L172-W197 HydrophobicContact CD2-CE3 3.69Å; L172-W197 HydrophobicContact CD2-CZ3 3.75Å; H195-W197 VanDerWaalsContact CD2-CB 3.41Å; H195-W197 WeakPolarHBondContact CD2-CB 3.48Å; H195-W197 PolarHBondContact CD2-N 2.9Å; H195-W197 WeakPolarHBondContact NE2-CB 3.39Å; H195-W197 PolarHBondContact O-N 3.44Å; W197-F199 VanDerWaalsContact C-N 3.32Å; W197-F199 PolarHBondContact O-N 3.49Å; W197-G200 PolarHBondContact O-N 2.88Å; W197-C201 PolarHBondContact O-N 3.25Å; W197-C201 PolarHBondContact O-SG 2.95Å; W197-C201 VanDerWaalsContact O-SG 3.37Å
198P92.5Very high93.6Very high8 Ų820 Ų205%0.05210%0.102CC..Hα-helixtrans-62.9-38.8177.8-18.333.4000112.3H195 C201 M202 G340 K343H195-P198 WeakPolarHBondContact O-CD 3.31Å; P198-C201 PolarHBondContact O-N 3.07Å; P198-M202 PolarHBondContact O-N 3.13Å; P198-M202 VanDerWaalsContact O-N 3.13Å; P198-G340 VanDerWaalsContact CB-O 3.28Å; P198-G340 WeakPolarHBondContact CB-O 3.38Å; P198-K343 HydrophobicContact CB-CB 3.99Å; P198-K343 HydrophobicContact CG-CB 4.07Å
199F93.6Very high93.8Very high92 Ų9225.8 Ų25.840%0.40413%0.125SC..Hα-helixtrans-63.8-43.7174.3179.2-104.8000111.6L31 V34 G196 W197 C201 M202 A203L31-F199 HydrophobicContact CD2-CD1 4.03Å; L31-F199 HydrophobicContact CD2-CE1 3.41Å; L31-F199 VanDerWaalsContact CD2-CE1 3.41Å; L31-F199 HydrophobicContact CD2-CZ 3.84Å; V34-F199 HydrophobicContact CG2-CD1 3.98Å; V34-F199 HydrophobicContact CG2-CE1 3.39Å; V34-F199 HydrophobicContact CG2-CZ 4.28Å; G196-F199 CarbonylContact O-C 3.59Å; G196-F199 WeakPolarHBondContact O-CB 3.4Å; G196-F199 PolarHBondContact O-N 3.27Å; G196-F199 VanDerWaalsContact O-N 3.1Å; W197-F199 VanDerWaalsContact C-N 3.32Å; W197-F199 PolarHBondContact O-N 3.49Å; F199-C201 VanDerWaalsContact C-N 3.33Å; F199-C201 PolarHBondContact O-N 3.08Å; F199-M202 HydrophobicContact CB-CE 4.47Å; F199-M202 HydrophobicContact CD2-CE 4.35Å; F199-M202 PolarHBondContact O-N 3.49Å; F199-A203 WeakPolarHBondContact O-CB 3.28Å; F199-A203 PolarHBondContact O-N 3.01Å
200G95.5Very high94.1Very high0 Ų031.5 Ų31.50%016%0.155CC..Hα-helixtrans-60.1-39.5174.300000112.9Y33 G196 W197 A203 M204Y33-G200 WeakPolarHBondContact O-CA 3.5Å; G196-G200 PolarHBondContact O-N 2.79Å; W197-G200 PolarHBondContact O-N 2.88Å; G200-A203 PolarHBondContact O-N 3.45Å; G200-M204 WeakPolarHBondContact O-CB 3.31Å; G200-M204 VanDerWaalsContact O-CG 3.28Å; G200-M204 WeakPolarHBondContact O-CG 3.37Å; G200-M204 PolarHBondContact O-N 2.92Å
201C93Very high94.3Very high0 Ų032 Ų320%016%0.159CC..Hα-helixtrans-62.8-41.3174.3-68.70000112.5W197 P198 F199 M204 A205 M339W197-C201 PolarHBondContact O-N 3.25Å; W197-C201 PolarHBondContact O-SG 2.95Å; W197-C201 VanDerWaalsContact O-SG 3.37Å; P198-C201 PolarHBondContact O-N 3.07Å; F199-C201 VanDerWaalsContact C-N 3.33Å; F199-C201 PolarHBondContact O-N 3.08Å; C201-M204 VanDerWaalsContact O-CG 3.24Å; C201-M204 WeakPolarHBondContact O-CG 3.4Å; C201-A205 WeakPolarHBondContact O-CB 3.42Å; C201-A205 PolarHBondContact O-N 3.16Å; C201-M339 HydrophobicContact CB-CE 4.35Å
202M95.5Very high94.4Very high37 Ų3736.4 Ų36.418%0.18218%0.175CC..Hα-helixtrans-67.2-44.4175.4-70.2-176.6-67.100111.5P198 F199 A205 L206 F337 L341P198-M202 PolarHBondContact O-N 3.13Å; P198-M202 VanDerWaalsContact O-N 3.13Å; F199-M202 HydrophobicContact CB-CE 4.47Å; F199-M202 HydrophobicContact CD2-CE 4.35Å; F199-M202 PolarHBondContact O-N 3.49Å; M202-A205 PolarHBondContact O-N 2.77Å; M202-L206 PolarHBondContact O-N 2.99Å; M202-F337 HydrophobicContact CB-CD2 3.76Å; M202-F337 HydrophobicContact CB-CE2 3.67Å; M202-F337 HydrophobicContact CB-CZ 4.42Å; M202-F337 HydrophobicContact CG-CD2 3.97Å; M202-F337 HydrophobicContact CG-CE2 3.94Å; M202-F337 HydrophobicContact CG-CG 4.35Å; M202-F337 HydrophobicContact CG-CZ 4.28Å; M202-F337 HydrophobicContact SD-CE1 4.44Å; M202-F337 HydrophobicContact SD-CE2 4.27Å; M202-F337 HydrophobicContact SD-CZ 4.07Å; M202-L341 HydrophobicContact SD-CB 4.01Å; M202-L341 HydrophobicContact SD-CD1 4.29Å
203A96.4Very high94.6Very high16 Ų1642.2 Ų42.213%0.13220%0.197CC..Hα-helixtrans-63.6-49.7179.900000111.6V34 F199 G200 A205 L206 T207V34-A203 HydrophobicContact CB-CB 4.25Å; V34-A203 HydrophobicContact CG1-CB 4.04Å; V34-A203 HydrophobicContact CG2-CB 3.77Å; F199-A203 WeakPolarHBondContact O-CB 3.28Å; F199-A203 PolarHBondContact O-N 3.01Å; G200-A203 PolarHBondContact O-N 3.45Å; A203-A205 VanDerWaalsContact C-N 3.26Å; A203-A205 PolarHBondContact O-N 3.27Å; A203-L206 CarbonylContact O-C 3.6Å; A203-L206 WeakPolarHBondContact O-CB 3.38Å; A203-L206 PolarHBondContact O-N 2.66Å; A203-L206 VanDerWaalsContact O-N 3.07Å; A203-T207 PolarHBondContact O-N 3.23Å; A203-T207 PolarHBondContact O-OG1 2.92Å; A203-T207 VanDerWaalsContact O-OG1 3.05Å
204M95.2Very high94.8Very high0 Ų042.2 Ų42.20%020%0.196CC..Hα-helixtrans-61-35.2178.371.7176.2-78.200112.5L41 F45 G200 C201 T207 A208L41-M204 HydrophobicContact CB-CE 3.62Å; L41-M204 HydrophobicContact CB-SD 3.79Å; L41-M204 HydrophobicContact CD1-SD 3.96Å; L41-M204 HydrophobicContact CG-SD 4.47Å; F45-M204 HydrophobicContact CD2-CE 4.07Å; F45-M204 HydrophobicContact CE2-CE 3.49Å; F45-M204 VanDerWaalsContact CE2-CE 3.49Å; F45-M204 HydrophobicContact CZ-CE 4.39Å; G200-M204 WeakPolarHBondContact O-CB 3.31Å; G200-M204 VanDerWaalsContact O-CG 3.28Å; G200-M204 WeakPolarHBondContact O-CG 3.37Å; G200-M204 PolarHBondContact O-N 2.92Å; C201-M204 VanDerWaalsContact O-CG 3.24Å; C201-M204 WeakPolarHBondContact O-CG 3.4Å; M204-T207 PolarHBondContact O-N 3.3Å; M204-A208 VanDerWaalsContact O-CB 3.3Å; M204-A208 WeakPolarHBondContact O-CB 3.29Å; M204-A208 PolarHBondContact O-N 3.45Å
205A94.9Very high95Very high2 Ų240.3 Ų40.32%0.01719%0.186CC..Hα-helixtrans-66-40.8176.500000111.3C201 M202 A203 Y209 T336 F337C201-A205 WeakPolarHBondContact O-CB 3.42Å; C201-A205 PolarHBondContact O-N 3.16Å; M202-A205 PolarHBondContact O-N 2.77Å; A203-A205 VanDerWaalsContact C-N 3.26Å; A203-A205 PolarHBondContact O-N 3.27Å; A205-Y209 WeakPolarHBondContact O-CB 3.1Å; A205-Y209 PolarHBondContact O-N 3.04Å; A205-T336 HydrophobicContact CB-CG2 3.91Å; A205-F337 HydrophobicContact CB-CB 4.02Å
206L96.9Very high95.4Very high94 Ų9442.1 Ų42.149%0.49220%0.198SC..Hα-helixtrans-65.4-47.1174-179.161.4000111.3M202 A203 A208 Y209 L210M202-L206 PolarHBondContact O-N 2.99Å; A203-L206 CarbonylContact O-C 3.6Å; A203-L206 WeakPolarHBondContact O-CB 3.38Å; A203-L206 PolarHBondContact O-N 2.66Å; A203-L206 VanDerWaalsContact O-N 3.07Å; L206-A208 VanDerWaalsContact C-N 3.32Å; L206-A208 PolarHBondContact O-N 3.39Å; L206-Y209 WeakPolarHBondContact O-CB 3.44Å; L206-Y209 PolarHBondContact O-N 3.13Å; L206-Y209 VanDerWaalsContact O-N 3.16Å; L206-L210 HydrophobicContact CD1-CD1 4.09Å; L206-L210 HydrophobicContact CD1-CG 4.13Å; L206-L210 HydrophobicContact CG-CD1 3.99Å; L206-L210 HydrophobicContact CG-CG 4.42Å; L206-L210 VanDerWaalsContact O-CG 3.31Å; L206-L210 WeakPolarHBondContact O-CG 3.4Å; L206-L210 PolarHBondContact O-N 2.98Å
207T97.4Very high95.6Very high8 Ų842.1 Ų42.15%0.04920%0.198CC..Hα-helixtrans-59-43.4177.4-54.10000111A203 M204 L210 T211 Y217 A220 L221 E224A203-T207 PolarHBondContact O-N 3.23Å; A203-T207 PolarHBondContact O-OG1 2.92Å; A203-T207 VanDerWaalsContact O-OG1 3.05Å; M204-T207 PolarHBondContact O-N 3.3Å; T207-L210 PolarHBondContact O-N 3.24Å; T207-T211 HydrophobicContact CG2-CG2 4.37Å; T207-T211 WeakPolarHBondContact O-CB 3.45Å; T207-T211 VanDerWaalsContact O-CG2 3.31Å; T207-T211 WeakPolarHBondContact O-CG2 3.45Å; T207-T211 PolarHBondContact O-N 2.68Å; T207-T211 PolarHBondContact O-OG1 2.98Å; T207-Y217 HydrophobicContact CG2-CD2 3.94Å; T207-Y217 HydrophobicContact CG2-CE2 4.19Å; T207-A220 HydrophobicContact CG2-CB 3.53Å; T207-L221 HydrophobicContact CG2-CD2 4.42Å; T207-E224 VanDerWaalsContact CG2-OE1 3.3Å; T207-E224 WeakPolarHBondContact CG2-OE1 3.45Å; T207-E224 PolarHBondContact OG1-OE1 2.93Å; T207-E224 PolarHBondContact OG1-OE2 3.34Å
208A95.9Very high95.9Very high0 Ų040.6 Ų40.60%019%0.192CC..Hα-helixtrans-65.6-39.3176.400000112.5F45 F85 M204 L206 R212 Y217 F333F45-A208 HydrophobicContact CD1-CB 4Å; F45-A208 HydrophobicContact CD2-CB 3.57Å; F45-A208 HydrophobicContact CE1-CB 3.83Å; F45-A208 HydrophobicContact CE2-CB 3.35Å; F45-A208 HydrophobicContact CG-CB 3.89Å; F45-A208 HydrophobicContact CZ-CB 3.51Å; F85-A208 HydrophobicContact CE2-CB 4.07Å; M204-A208 VanDerWaalsContact O-CB 3.3Å; M204-A208 WeakPolarHBondContact O-CB 3.29Å; M204-A208 PolarHBondContact O-N 3.45Å; L206-A208 VanDerWaalsContact C-N 3.32Å; L206-A208 PolarHBondContact O-N 3.39Å; A208-R212 PolarHBondContact O-N 3.44Å; A208-Y217 HydrophobicContact CB-CD2 3.84Å; A208-Y217 HydrophobicContact CB-CE2 3.77Å; A208-F333 HydrophobicContact CB-CD1 3.85Å; A208-F333 HydrophobicContact CB-CE1 3.73Å
209Y95.9Very high96.2Very high120 Ų12042.5 Ų42.547%0.47120%0.202SC..Hα-helixtrans-64.2-39.8175.5175.1-94.7000112.8A205 L206 R212 F333A205-Y209 WeakPolarHBondContact O-CB 3.1Å; A205-Y209 PolarHBondContact O-N 3.04Å; L206-Y209 WeakPolarHBondContact O-CB 3.44Å; L206-Y209 PolarHBondContact O-N 3.13Å; L206-Y209 VanDerWaalsContact O-N 3.16Å; Y209-R212 VanDerWaalsContact CD2-NH2 3.33Å; Y209-R212 VanDerWaalsContact O-CD 3.3Å; Y209-R212 WeakPolarHBondContact O-CD 3.38Å; Y209-R212 WeakPolarHBondContact O-CG 3.15Å; Y209-R212 PolarHBondContact O-NE 3.05Å; Y209-F333 HydrophobicContact CD2-CB 4.29Å; Y209-F333 AromaticContact CD2-CD2 3.87Å; Y209-F333 HydrophobicContact CD2-CD2 3.87Å; Y209-F333 HydrophobicContact CD2-CG 4.14Å
210L97.1Very high96.4Very high124 Ų12439.1 Ų39.165%0.64919%0.191SC*.Hα-helixtrans-75.5-34.5-179.2-67.9175.1000112.6L206 T207L206-L210 HydrophobicContact CD1-CD1 4.09Å; L206-L210 HydrophobicContact CD1-CG 4.13Å; L206-L210 HydrophobicContact CG-CD1 3.99Å; L206-L210 HydrophobicContact CG-CG 4.42Å; L206-L210 VanDerWaalsContact O-CG 3.31Å; L206-L210 WeakPolarHBondContact O-CG 3.4Å; L206-L210 PolarHBondContact O-N 2.98Å; T207-L210 PolarHBondContact O-N 3.24Å
211T96.7Very high96.5Very high32 Ų3239.1 Ų39.120%0.19619%0.191CC..Hα-helixtrans-89-36.4-175.753.80000113.5T207 R213 T216 Y217 A220T207-T211 HydrophobicContact CG2-CG2 4.37Å; T207-T211 WeakPolarHBondContact O-CB 3.45Å; T207-T211 VanDerWaalsContact O-CG2 3.31Å; T207-T211 WeakPolarHBondContact O-CG2 3.45Å; T207-T211 PolarHBondContact O-N 2.68Å; T207-T211 PolarHBondContact O-OG1 2.98Å; T211-R213 PolarHBondContact O-N 2.89Å; T211-T216 PolarHBondContact O-OG1 3.37Å; T211-Y217 WeakPolarHBondContact OG1-CB 3.26Å; T211-A220 HydrophobicContact CG2-CB 3.89Å
212R94.5Very high96.8Very high96 Ų9639.1 Ų39.136%0.36219%0.191SC..  trans57.11.5179-61.3-63.2-171.3132.14.7116.9E84 D86 A208 Y209 F333E84-R212 WeakPolarHBondContact O-CD 3.45Å; E84-R212 PolarHBondContact O-NH1 2.86Å; D86-R212 PolarHBondContact N-O 2.83Å; A208-R212 PolarHBondContact O-N 3.44Å; Y209-R212 VanDerWaalsContact CD2-NH2 3.33Å; Y209-R212 VanDerWaalsContact O-CD 3.3Å; Y209-R212 WeakPolarHBondContact O-CD 3.38Å; Y209-R212 WeakPolarHBondContact O-CG 3.15Å; Y209-R212 PolarHBondContact O-NE 3.05Å; R212-F333 VanDerWaalsContact NH1-CE2 3.31Å
213R96Very high96.9Very high125 Ų12542.1 Ų42.147%0.47221%0.206SC..BIsolated β-bridgetrans-139.1140.1178.7-44.7177.965.3-177.2-2.3111F85 D86 T211 N215 T216 Y217F85-R213 VanDerWaalsContact CZ-C 3.46Å; D86-R213 HydrophobicContact CB-CB 4.08Å; D86-R213 HydrophobicContact CB-CG 3.98Å; D86-R213 WeakPolarHBondContact O-CA 3.16Å; D86-R213 IonicContact OD2-CZ 2.69Å; D86-R213 IonicContact OD2-NE 3.82Å; D86-R213 PolarHBondContact OD2-NE 3.26Å; D86-R213 VanDerWaalsContact OD2-NE 3.1Å; D86-R213 IonicContact OD2-NH2 3.26Å; D86-R213 PolarHBondContact OD2-NH2 3.39Å; T211-R213 PolarHBondContact O-N 2.89Å; R213-N215 VanDerWaalsContact C-N 3.32Å; R213-N215 WeakPolarHBondContact CB-OD1 3.5Å; R213-N215 PolarHBondContact O-N 3.07Å; R213-T216 WeakPolarHBondContact CB-OG1 3.41Å; R213-T216 PolarHBondContact O-N 2.81Å; R213-T216 PolarHBondContact O-OG1 3.22Å; R213-Y217 VanDerWaalsContact O-CB 3.26Å; R213-Y217 WeakPolarHBondContact O-CB 3.44Å; R213-Y217 PolarHBondContact O-N 3.1Å
214W96Very high96.9Very high5 Ų544 Ų442%0.01921%0.213CC..Hα-helixtrans-56.1-43.3-175.173.7-91.3000112.6F85 D86 L88 H91 L147 P148 A151 Y217 H218F85-W214 HydrophobicContact CE1-CB 4Å; D86-W214 PolarHBondContact O-N 2.85Å; L88-W214 HydrophobicContact CB-CB 4.13Å; L88-W214 HydrophobicContact CB-CD2 4.1Å; L88-W214 HydrophobicContact CB-CE3 4.37Å; L88-W214 HydrophobicContact CB-CG 3.97Å; L88-W214 HydrophobicContact CD1-CD2 3.72Å; L88-W214 HydrophobicContact CD1-CE3 3.72Å; L88-W214 HydrophobicContact CD1-CG 4.41Å; L88-W214 HydrophobicContact CD1-CH2 4.06Å; L88-W214 HydrophobicContact CD1-CZ2 4Å; L88-W214 HydrophobicContact CD1-CZ3 3.9Å; L88-W214 HydrophobicContact CD2-CE3 4.37Å; L88-W214 HydrophobicContact CG-CD2 4.41Å; L88-W214 HydrophobicContact CG-CE3 4.37Å; H91-W214 VanDerWaalsContact CB-NE1 3.31Å; H91-W214 AromaticContact CD2-CE2 3.83Å; H91-W214 AromaticContact CD2-CZ2 3.42Å; H91-W214 VanDerWaalsContact CD2-CZ2 3.42Å; H91-W214 WeakPolarHBondContact CD2-CZ2 3.43Å; H91-W214 AromaticContact CD2-NE1 3.9Å; H91-W214 AromaticContact CG-CE2 3.85Å; H91-W214 AromaticContact CG-CZ2 3.86Å; H91-W214 AromaticContact CG-NE1 3.43Å; H91-W214 AromaticContact ND1-NE1 3.99Å; H91-W214 AromaticContact NE2-CZ2 3.71Å; L147-W214 HydrophobicContact CG-CZ3 4.45Å; P148-W214 HydrophobicContact CB-CZ3 4.45Å; P148-W214 HydrophobicContact CG-CZ3 4.49Å; A151-W214 HydrophobicContact CB-CH2 3.52Å; A151-W214 HydrophobicContact CB-CZ2 4.39Å; A151-W214 HydrophobicContact CB-CZ3 3.93Å; W214-Y217 WeakPolarHBondContact O-CB 3.44Å; W214-Y217 PolarHBondContact O-N 3.43Å; W214-H218 PolarHBondContact O-CD2 3.43Å; W214-H218 PolarHBondContact O-N 3.2Å
215N97.4Very high97Very high41 Ų4144 Ų4422%0.21921%0.213CC..Hα-helixtrans-67-46.5-176.860.3-12.3000112P148 R213 Y217 L219P148-N215 HydrophobicContact CB-CB 4.02Å; P148-N215 VanDerWaalsContact CG-O 3.31Å; P148-N215 WeakPolarHBondContact CG-O 3.36Å; R213-N215 VanDerWaalsContact C-N 3.32Å; R213-N215 WeakPolarHBondContact CB-OD1 3.5Å; R213-N215 PolarHBondContact O-N 3.07Å; N215-Y217 VanDerWaalsContact C-N 3.31Å; N215-L219 PolarHBondContact O-N 3.23Å
216T97.7Very high97.2Very high52 Ų5247.5 Ų47.532%0.31923%0.23SC..Hα-helixtrans-68.6-31.3175.248.40000112.2T211 R213 A220T211-T216 PolarHBondContact O-OG1 3.37Å; R213-T216 WeakPolarHBondContact CB-OG1 3.41Å; R213-T216 PolarHBondContact O-N 2.81Å; R213-T216 PolarHBondContact O-OG1 3.22Å; T216-A220 VanDerWaalsContact O-CB 3.25Å; T216-A220 WeakPolarHBondContact O-CB 3.45Å; T216-A220 PolarHBondContact O-N 2.97Å
217Y98.1Very high97.2Very high0 Ų046.8 Ų46.80%023%0.231CC..Hα-helixtrans-64.2-49.8175.2172-107.7000111.6G38 C42 F45 F85 T207 A208 T211 R213 W214 N215 A220 L221G38-Y217 PolarHBondContact O-OH 3.49Å; C42-Y217 HydrophobicContact CB-CE1 4.4Å; F45-Y217 HydrophobicContact CD2-CE1 4.2Å; F45-Y217 HydrophobicContact CD2-CE2 4.17Å; F45-Y217 AromaticContact CD2-CZ 3.8Å; F45-Y217 HydrophobicContact CE2-CE2 4.36Å; F85-Y217 HydrophobicContact CZ-CD1 4.5Å; F85-Y217 HydrophobicContact CZ-CG 4.13Å; T207-Y217 HydrophobicContact CG2-CD2 3.94Å; T207-Y217 HydrophobicContact CG2-CE2 4.19Å; A208-Y217 HydrophobicContact CB-CD2 3.84Å; A208-Y217 HydrophobicContact CB-CE2 3.77Å; T211-Y217 WeakPolarHBondContact OG1-CB 3.26Å; R213-Y217 VanDerWaalsContact O-CB 3.26Å; R213-Y217 WeakPolarHBondContact O-CB 3.44Å; R213-Y217 PolarHBondContact O-N 3.1Å; W214-Y217 WeakPolarHBondContact O-CB 3.44Å; W214-Y217 PolarHBondContact O-N 3.43Å; N215-Y217 VanDerWaalsContact C-N 3.31Å; Y217-A220 PolarHBondContact O-N 2.82Å; Y217-L221 HydrophobicContact CD1-CD1 4.27Å; Y217-L221 HydrophobicContact CE1-CD1 3.63Å; Y217-L221 HydrophobicContact CE1-CG 4.4Å; Y217-L221 HydrophobicContact CE2-CD1 4.17Å; Y217-L221 HydrophobicContact CE2-CD2 4.28Å; Y217-L221 HydrophobicContact CE2-CG 4.17Å; Y217-L221 WeakPolarHBondContact O-CG 3.16Å; Y217-L221 PolarHBondContact O-N 3.34Å
218H98.4Very high97.2Very high0 Ų048.5 Ų48.50%024%0.238CC..Hα-helixtrans-64-42.9175.4-77.6-73.8000112.3D46 N144 P148 W214 A220 L221 G222D46-H218 IonicContact OD1-NE2 2.71Å; D46-H218 PolarHBondContact OD1-NE2 3.49Å; D46-H218 IonicContact OD2-CE1 3.79Å; D46-H218 IonicContact OD2-NE2 3.48Å; D46-H218 PolarHBondContact OD2-NE2 3.04Å; N144-H218 WeakPolarHBondContact CB-O 3.45Å; N144-H218 CarbonylContact O-C 3.6Å; N144-H218 PolarHBondContact OD1-ND1 3.36Å; P148-H218 HydrophobicContact CG-CB 3.72Å; W214-H218 PolarHBondContact O-CD2 3.43Å; W214-H218 PolarHBondContact O-N 3.2Å; H218-A220 VanDerWaalsContact C-N 3.29Å; H218-A220 PolarHBondContact O-N 2.67Å; H218-L221 PolarHBondContact O-N 3.26Å; H218-G222 PolarHBondContact O-N 3.31Å
219L98.3Very high97.3Very high49 Ų4949.9 Ų49.926%0.25725%0.245SC..Hα-helixtrans-55.6-46172.6-85.4162.6000111.5L145 P148 F149 N215 G222 I223L145-L219 HydrophobicContact CD2-CD2 4.33Å; P148-L219 HydrophobicContact CB-CD1 4.36Å; P148-L219 HydrophobicContact CB-CG 4.28Å; P148-L219 HydrophobicContact CG-CG 4.04Å; F149-L219 HydrophobicContact CE2-CD2 4Å; F149-L219 HydrophobicContact CZ-CD1 4.49Å; F149-L219 HydrophobicContact CZ-CD2 4.12Å; N215-L219 PolarHBondContact O-N 3.23Å; L219-G222 PolarHBondContact O-N 3.24Å; L219-I223 VanDerWaalsContact O-CG1 3.26Å; L219-I223 WeakPolarHBondContact O-CG1 3.31Å; L219-I223 PolarHBondContact O-N 2.98Å
220A98.3Very high97.4Very high20 Ų2047.9 Ų47.917%0.16525%0.245CC..Hα-helixtrans-61.7-47.7178.400000111.9T207 T211 T216 Y217 H218 G222 I223 E224T207-A220 HydrophobicContact CG2-CB 3.53Å; T211-A220 HydrophobicContact CG2-CB 3.89Å; T216-A220 VanDerWaalsContact O-CB 3.25Å; T216-A220 WeakPolarHBondContact O-CB 3.45Å; T216-A220 PolarHBondContact O-N 2.97Å; Y217-A220 PolarHBondContact O-N 2.82Å; H218-A220 VanDerWaalsContact C-N 3.29Å; H218-A220 PolarHBondContact O-N 2.67Å; A220-G222 VanDerWaalsContact C-N 3.28Å; A220-G222 PolarHBondContact O-N 3.13Å; A220-I223 PolarHBondContact O-N 2.87Å; A220-I223 VanDerWaalsContact O-N 3.17Å; A220-E224 WeakPolarHBondContact O-CB 3.11Å; A220-E224 WeakPolarHBondContact O-CG 3.36Å; A220-E224 PolarHBondContact O-N 3.3Å
221L97.9Very high97.4Very high0 Ų043 Ų430%022%0.223CC..Hα-helixtrans-58.4-40.1176.5-70.6-179.1000112.6T35 T207 Y217 H218 G225T35-L221 WeakPolarHBondContact CG2-O 3.32Å; T35-L221 PolarHBondContact OG1-O 3.1Å; T207-L221 HydrophobicContact CG2-CD2 4.42Å; Y217-L221 HydrophobicContact CD1-CD1 4.27Å; Y217-L221 HydrophobicContact CE1-CD1 3.63Å; Y217-L221 HydrophobicContact CE1-CG 4.4Å; Y217-L221 HydrophobicContact CE2-CD1 4.17Å; Y217-L221 HydrophobicContact CE2-CD2 4.28Å; Y217-L221 HydrophobicContact CE2-CG 4.17Å; Y217-L221 WeakPolarHBondContact O-CG 3.16Å; Y217-L221 PolarHBondContact O-N 3.34Å; H218-L221 PolarHBondContact O-N 3.26Å; L221-G225 PolarHBondContact O-N 3.47Å
222G98.1Very high97.3Very high0 Ų041.7 Ų41.70%022%0.215CC..Hα-helixtrans-62.2-49.2175.400000111.7H218 L219 A220 G225H218-G222 PolarHBondContact O-N 3.31Å; L219-G222 PolarHBondContact O-N 3.24Å; A220-G222 VanDerWaalsContact C-N 3.28Å; A220-G222 PolarHBondContact O-N 3.13Å; G222-G225 PolarHBondContact O-N 2.85Å
223I98.2Very high97.4Very high100 Ų10042.9 Ų42.951%0.51322%0.223SC..Hα-helixtrans-64.2-45.6179.3-67.5165.9000111.5L145 L219 A220 G225 I226 P227L145-I223 HydrophobicContact CD2-CG1 4.06Å; L219-I223 VanDerWaalsContact O-CG1 3.26Å; L219-I223 WeakPolarHBondContact O-CG1 3.31Å; L219-I223 PolarHBondContact O-N 2.98Å; A220-I223 PolarHBondContact O-N 2.87Å; A220-I223 VanDerWaalsContact O-N 3.17Å; I223-G225 PolarHBondContact O-N 3.46Å; I223-I226 PolarHBondContact O-N 3.29Å; I223-I226 VanDerWaalsContact O-N 3.15Å; I223-P227 WeakPolarHBondContact O-CD 3.17Å
224E96.9Very high97.3Very high57 Ų5743.1 Ų43.127%0.26623%0.227SC..Hα-helixtrans-58-29177.4-74.5169.6-175.700112.1V34 T207 A220 P227 F228V34-E224 HydrophobicContact CG1-CB 3.99Å; V34-E224 HydrophobicContact CG1-CG 4.4Å; V34-E224 WeakPolarHBondContact CG1-OE2 3.34Å; T207-E224 VanDerWaalsContact CG2-OE1 3.3Å; T207-E224 WeakPolarHBondContact CG2-OE1 3.45Å; T207-E224 PolarHBondContact OG1-OE1 2.93Å; T207-E224 PolarHBondContact OG1-OE2 3.34Å; A220-E224 WeakPolarHBondContact O-CB 3.11Å; A220-E224 WeakPolarHBondContact O-CG 3.36Å; A220-E224 PolarHBondContact O-N 3.3Å; E224-P227 WeakPolarHBondContact O-CD 3.25Å; E224-F228 WeakPolarHBondContact O-CD2 3.15Å; E224-F228 VanDerWaalsContact O-CE2 3.23Å; E224-F228 WeakPolarHBondContact O-CE2 3.33Å
225G97.4Very high97.2Very high0 Ų043.4 Ų43.40%023%0.23CC..Hα-helixtrans-79.6-21.9-179.800000114.8T35 L221 G222 I223 F228 L229T35-G225 WeakPolarHBondContact OG1-CA 2.93Å; T35-G225 PolarHBondContact OG1-N 3.5Å; L221-G225 PolarHBondContact O-N 3.47Å; G222-G225 PolarHBondContact O-N 2.85Å; I223-G225 PolarHBondContact O-N 3.46Å; G225-F228 PolarHBondContact O-N 3.47Å; G225-L229 WeakPolarHBondContact O-CB 3.35Å; G225-L229 PolarHBondContact O-N 2.88Å
226I98.2Very high97.1Very high74 Ų7442 Ų4238%0.37922%0.223SC..Hα-helixtrans-60.2-49.3-175.6-65.3169.8000112.1V141 I223 F228 L229 V230V141-I226 HydrophobicContact CG1-CG1 3.94Å; I223-I226 PolarHBondContact O-N 3.29Å; I223-I226 VanDerWaalsContact O-N 3.15Å; I226-F228 VanDerWaalsContact C-N 3.27Å; I226-F228 PolarHBondContact O-N 3.06Å; I226-L229 WeakPolarHBondContact O-CB 3.26Å; I226-L229 PolarHBondContact O-N 2.72Å; I226-V230 HydrophobicContact CG2-CG2 4.5Å; I226-V230 WeakPolarHBondContact O-CG2 3.48Å; I226-V230 PolarHBondContact O-N 2.93Å
227P97.7Very high97Very high80 Ų8040.9 Ų40.952%0.51921%0.214SC..Hα-helixtrans-58.4-39.9178.1-24.534.6000112.5I223 E224 V230 A231I223-P227 WeakPolarHBondContact O-CD 3.17Å; E224-P227 WeakPolarHBondContact O-CD 3.25Å; P227-V230 PolarHBondContact O-N 3.19Å; P227-A231 WeakPolarHBondContact O-CB 3.36Å; P227-A231 PolarHBondContact O-N 2.69Å
228F96.4Very high96.9Very high43 Ų4341 Ų4119%0.18922%0.215CC..Hα-helixtrans-73.8-32.4-179.9-54.9-56.6000112.7L31 S32 V34 L137 E224 G225 I226 A231 H232L31-F228 HydrophobicContact CB-CD1 3.86Å; L31-F228 HydrophobicContact CB-CE1 3.44Å; L31-F228 VanDerWaalsContact CB-CE1 3.44Å; L31-F228 HydrophobicContact CB-CZ 3.86Å; L31-F228 HydrophobicContact CD1-CE1 3.94Å; L31-F228 HydrophobicContact CG-CE1 4.29Å; S32-F228 WeakPolarHBondContact OG-CB 3.48Å; V34-F228 HydrophobicContact CB-CE2 4.26Å; V34-F228 HydrophobicContact CG2-CE2 4.35Å; L137-F228 HydrophobicContact CD2-CB 4.27Å; E224-F228 WeakPolarHBondContact O-CD2 3.15Å; E224-F228 VanDerWaalsContact O-CE2 3.23Å; E224-F228 WeakPolarHBondContact O-CE2 3.33Å; G225-F228 PolarHBondContact O-N 3.47Å; I226-F228 VanDerWaalsContact C-N 3.27Å; I226-F228 PolarHBondContact O-N 3.06Å; F228-A231 PolarHBondContact O-N 3.13Å; F228-H232 PolarHBondContact O-N 3.18Å; F228-H232 VanDerWaalsContact O-N 3.17Å; F228-H232 PolarHBondContact O-ND1 3.29Å
229L97.7Very high96.6Very high30 Ų3041 Ų4116%0.15722%0.215CC..Hα-helixtrans-62.6-48.1170.9177.660.3000110.9I134 L137 A138 G225 I226 A231 H232 F233I134-L229 HydrophobicContact CG2-CD1 4.05Å; L137-L229 HydrophobicContact CB-CD1 4.28Å; L137-L229 HydrophobicContact CD2-CB 4.12Å; L137-L229 HydrophobicContact CD2-CD1 4.47Å; L137-L229 HydrophobicContact CG-CB 4.27Å; L137-L229 HydrophobicContact CG-CD1 4.33Å; A138-L229 HydrophobicContact CB-CD1 4Å; A138-L229 HydrophobicContact CB-CD2 4.11Å; G225-L229 WeakPolarHBondContact O-CB 3.35Å; G225-L229 PolarHBondContact O-N 2.88Å; I226-L229 WeakPolarHBondContact O-CB 3.26Å; I226-L229 PolarHBondContact O-N 2.72Å; L229-A231 VanDerWaalsContact C-N 3.29Å; L229-A231 PolarHBondContact O-N 2.57Å; L229-H232 PolarHBondContact O-N 2.99Å; L229-F233 WeakPolarHBondContact O-CD2 3.35Å
230V97.7Very high96.2Very high78 Ų7838.9 Ų38.947%0.47320%0.204SC..Hα-helixtrans-61-40.9175.2175.40000110.6I226 P227 H232 F233 F234I226-V230 HydrophobicContact CG2-CG2 4.5Å; I226-V230 WeakPolarHBondContact O-CG2 3.48Å; I226-V230 PolarHBondContact O-N 2.93Å; P227-V230 PolarHBondContact O-N 3.19Å; V230-H232 VanDerWaalsContact C-N 3.28Å; V230-H232 PolarHBondContact O-N 3.05Å; V230-F233 WeakPolarHBondContact O-CB 3.39Å; V230-F233 PolarHBondContact O-N 3.42Å; V230-F233 VanDerWaalsContact O-N 3.13Å; V230-F234 HydrophobicContact CG1-CE2 4.17Å
231A97Very high96Very high22 Ų2238.8 Ų38.818%0.18220%0.199CC..Hα-helixtrans-59.2-35.517900000113.3I28 P227 F228 L229 F233 F234I28-A231 HydrophobicContact CD1-CB 3.95Å; I28-A231 HydrophobicContact CG1-CB 3.88Å; I28-A231 HydrophobicContact CG2-CB 3.96Å; P227-A231 WeakPolarHBondContact O-CB 3.36Å; P227-A231 PolarHBondContact O-N 2.69Å; F228-A231 PolarHBondContact O-N 3.13Å; L229-A231 VanDerWaalsContact C-N 3.29Å; L229-A231 PolarHBondContact O-N 2.57Å; A231-F233 PolarHBondContact O-N 3.13Å; A231-F234 PolarHBondContact O-N 2.91Å
232H96.4Very high95.7Very high4 Ų439.3 Ų39.32%0.01920%0.202CC..Hα-helixtrans-62.2-24.4178.2-82.883.1000113.8S32 K130 I134 Y171 F228 L229 V230 F234 V235S32-H232 PolarHBondContact OG-CE1 2.86Å; K130-H232 WeakPolarHBondContact CE-O 3Å; I134-H232 HydrophobicContact CD1-CB 4.27Å; I134-H232 HydrophobicContact CG1-CB 3.72Å; Y171-H232 AromaticContact CE2-NE2 4Å; Y171-H232 PolarHBondContact OH-CE1 2.7Å; Y171-H232 VanDerWaalsContact OH-CE1 3.29Å; Y171-H232 PolarHBondContact OH-NE2 3.21Å; F228-H232 PolarHBondContact O-N 3.18Å; F228-H232 VanDerWaalsContact O-N 3.17Å; F228-H232 PolarHBondContact O-ND1 3.29Å; L229-H232 PolarHBondContact O-N 2.99Å; V230-H232 VanDerWaalsContact C-N 3.28Å; V230-H232 PolarHBondContact O-N 3.05Å; H232-F234 PolarHBondContact O-N 2.94Å; H232-V235 PolarHBondContact O-N 2.99Å
233F95.9Very high95.2Very high120 Ų12039.8 Ų39.853%0.52621%0.205SC..THydrogen-bonded Turntrans-66.6-25.6175.7-72-84.8000112.6K130 I134 L229 V230 A231K130-F233 PolarHBondContact NZ-O 3.35Å; I134-F233 HydrophobicContact CD1-CD1 4.12Å; I134-F233 HydrophobicContact CD1-CE1 4.05Å; I134-F233 HydrophobicContact CD1-CG 4.42Å; I134-F233 HydrophobicContact CD1-CZ 4.28Å; I134-F233 HydrophobicContact CG2-CE2 4.34Å; I134-F233 HydrophobicContact CG2-CZ 3.93Å; L229-F233 WeakPolarHBondContact O-CD2 3.35Å; V230-F233 WeakPolarHBondContact O-CB 3.39Å; V230-F233 PolarHBondContact O-N 3.42Å; V230-F233 VanDerWaalsContact O-N 3.13Å; A231-F233 PolarHBondContact O-N 3.13Å
234F92.9Very high94.5Very high130 Ų13037.5 Ų37.557%0.5719%0.192SC*.THydrogen-bonded Turntrans-80.4-21.3178.1-61.2-81.5000113.7V230 A231 H232 R257V230-F234 HydrophobicContact CG1-CE2 4.17Å; A231-F234 PolarHBondContact O-N 2.91Å; H232-F234 PolarHBondContact O-N 2.94Å; F234-R257 PolarHBondContact O-NH2 3.29Å
235V94.5Very high94Very high11 Ų1136 Ų367%0.06719%0.185CC..SBendtrans-73.1137.6175.2177.30000109.7V25 I28 K130 H232V25-V235 HydrophobicContact CG1-CG1 4.38Å; V25-V235 HydrophobicContact CG2-CG1 3.92Å; V25-V235 HydrophobicContact CG2-CG2 4.34Å; I28-V235 HydrophobicContact CB-CG2 4.34Å; I28-V235 HydrophobicContact CD1-CG2 3.61Å; I28-V235 HydrophobicContact CG2-CG2 4.16Å; K130-V235 VanDerWaalsContact CD-O 3.29Å; K130-V235 WeakPolarHBondContact CD-O 3.47Å; K130-V235 WeakPolarHBondContact CE-O 3.24Å; K130-V235 PolarHBondContact NZ-O 3.33Å; H232-V235 PolarHBondContact O-N 2.99Å
236S95.3Very high93.4Very high13 Ų1337.3 Ų37.39%0.09120%0.198CC..PPolyproline II helixtrans-85.2156.3173.9-48.90000110.9Y21 R257Y21-S236 WeakPolarHBondContact OH-CB 3.48Å; Y21-S236 PolarHBondContact OH-N 3.44Å; Y21-S236 PolarHBondContact OH-OG 3.43Å; S236-R257 PolarHBondContact OG-NH1 3.06Å
237E96.4Very high92.9Very high28 Ų2836.5 Ų36.513%0.13119%0.193CC..PPolyproline II helixtrans-60.8154.1171-173.453.6-94.700110.9G128 R129 K130 P131 P239 W241 L242G128-E237 WeakPolarHBondContact CA-OE2 3.4Å; R129-E237 VanDerWaalsContact CB-OE1 3.23Å; R129-E237 WeakPolarHBondContact CB-OE1 3Å; R129-E237 WeakPolarHBondContact CG-OE1 3.4Å; R129-E237 VanDerWaalsContact N-CD 3.33Å; R129-E237 PolarHBondContact N-OE1 3.14Å; R129-E237 PolarHBondContact N-OE2 3.36Å; K130-E237 WeakPolarHBondContact CB-OE2 3.23Å; K130-E237 PolarHBondContact N-OE1 2.86Å; K130-E237 PolarHBondContact N-OE2 3.45Å; P131-E237 VanDerWaalsContact CD-OE2 3.28Å; P131-E237 WeakPolarHBondContact CD-OE2 3.31Å; E237-P239 WeakPolarHBondContact O-CD 3Å; E237-W241 HydrophobicContact CG-CD2 4.47Å; E237-W241 HydrophobicContact CG-CE3 3.7Å; E237-W241 HydrophobicContact CG-CZ3 4.2Å; E237-L242 HydrophobicContact CB-CD1 4.32Å; E237-L242 HydrophobicContact CB-CG 4.46Å; E237-L242 HydrophobicContact CG-CD2 4.32Å; E237-L242 HydrophobicContact CG-CG 4.15Å
238S94.5Very high92.4Very high3 Ų334.3 Ų34.32%0.02118%0.178CC..PPolyproline II helixtrans-57.21211771700000111.4E181 R240 W241 L242E181-S238 WeakPolarHBondContact OE2-CB 3.31Å; E181-S238 PolarHBondContact OE2-OG 2.99Å; S238-R240 PolarHBondContact O-N 3.45Å; S238-R240 PolarHBondContact OG-N 2.86Å; S238-W241 PolarHBondContact O-N 3.34Å; S238-W241 PolarHBondContact OG-N 2.92Å; S238-L242 WeakPolarHBondContact O-CG 3.38Å; S238-L242 PolarHBondContact O-N 3.41Å
239P92.9Very high92Very high0 Ų036.3 Ų36.30%019%0.194CC..Hα-helixtrans-64.9-26.6176.619-23.5000112.3F8 E237 L243 V254 L255 I258F8-P239 HydrophobicContact CE2-CB 4.48Å; F8-P239 HydrophobicContact CZ-CB 3.92Å; F8-P239 HydrophobicContact CZ-CG 4.01Å; E237-P239 WeakPolarHBondContact O-CD 3Å; P239-L243 WeakPolarHBondContact O-CG 3.44Å; P239-L243 PolarHBondContact O-N 3.26Å; P239-L243 VanDerWaalsContact O-N 3.12Å; P239-V254 HydrophobicContact CB-CG1 4.17Å; P239-V254 HydrophobicContact CG-CG1 4.15Å; P239-L255 HydrophobicContact CB-CD1 4.32Å; P239-L255 HydrophobicContact CB-CD2 4.13Å; P239-L255 HydrophobicContact CB-CG 3.91Å; P239-L255 HydrophobicContact CG-CD2 4.02Å; P239-L255 HydrophobicContact CG-CG 4.32Å; P239-I258 HydrophobicContact CG-CD1 4.38Å
240R90.7Very high91.7Very high3 Ų340.5 Ų40.51%0.01121%0.211CC..Hα-helixtrans-68.1-46.3171.7-65.7-171.2-168.9-106.71.5111.8F8 D9 E181 S238 L242 L243 Q244 T417 E481F8-R240 HydrophobicContact CD1-CG 3.8Å; F8-R240 VanDerWaalsContact CD1-NH2 3.35Å; F8-R240 HydrophobicContact CD2-CG 4.49Å; F8-R240 HydrophobicContact CE1-CG 3.37Å; F8-R240 HydrophobicContact CE2-CG 4.19Å; F8-R240 HydrophobicContact CG-CG 4.32Å; F8-R240 HydrophobicContact CZ-CG 3.61Å; D9-R240 IonicContact OD1-CZ 3.74Å; D9-R240 IonicContact OD1-NH1 3.1Å; D9-R240 IonicContact OD1-NH2 3.54Å; D9-R240 PolarHBondContact OD1-NH2 3.27Å; E181-R240 PolarHBondContact O-NE 2.93Å; S238-R240 PolarHBondContact O-N 3.45Å; S238-R240 PolarHBondContact OG-N 2.86Å; R240-L242 VanDerWaalsContact C-N 3.29Å; R240-L242 PolarHBondContact O-N 2.94Å; R240-L243 PolarHBondContact O-N 2.78Å; R240-Q244 WeakPolarHBondContact O-CG 3.45Å; R240-Q244 PolarHBondContact O-N 2.96Å; R240-T417 HydrophobicContact CB-CG2 4.05Å; R240-E481 IonicContact CZ-OE1 2.86Å; R240-E481 IonicContact NH1-OE1 2.8Å; R240-E481 PolarHBondContact NH1-OE1 2.88Å
241W92.5Very high91.4Very high19 Ų1936.8 Ų36.87%0.07219%0.189CC..Hα-helixtrans-58.7-44.1177.6-178.188.6000111D125 G128 E237 S238 L243 Q244 H245D125-W241 PolarHBondContact O-NE1 3.41Å; G128-W241 VanDerWaalsContact CA-CE2 3.45Å; G128-W241 VanDerWaalsContact N-CZ2 3.29Å; E237-W241 HydrophobicContact CG-CD2 4.47Å; E237-W241 HydrophobicContact CG-CE3 3.7Å; E237-W241 HydrophobicContact CG-CZ3 4.2Å; S238-W241 PolarHBondContact O-N 3.34Å; S238-W241 PolarHBondContact OG-N 2.92Å; W241-L243 PolarHBondContact O-N 3.16Å; W241-Q244 PolarHBondContact O-N 3.13Å; W241-H245 AromaticContact CD1-CE1 3.52Å; W241-H245 AromaticContact CD1-ND1 3.68Å; W241-H245 AromaticContact CD2-ND1 3.7Å; W241-H245 AromaticContact CE2-CD2 3.87Å; W241-H245 AromaticContact CE2-CE1 3.41Å; W241-H245 VanDerWaalsContact CE2-CE1 3.41Å; W241-H245 AromaticContact CE2-CG 3.68Å; W241-H245 AromaticContact CE2-ND1 3.37Å; W241-H245 AromaticContact CE2-NE2 3.71Å; W241-H245 AromaticContact CG-ND1 3.88Å; W241-H245 HydrophobicContact CH2-CB 4.31Å; W241-H245 HydrophobicContact CZ2-CB 4.36Å; W241-H245 AromaticContact CZ2-CD2 3.53Å; W241-H245 AromaticContact CZ2-CE1 3.87Å; W241-H245 AromaticContact CZ2-CG 3.63Å; W241-H245 AromaticContact CZ2-ND1 3.82Å; W241-H245 AromaticContact CZ2-NE2 3.7Å; W241-H245 HydrophobicContact CZ3-CB 4.46Å; W241-H245 AromaticContact NE1-CE1 3.01Å; W241-H245 PolarHBondContact NE1-CE1 2.84Å; W241-H245 AromaticContact NE1-ND1 3.38Å; W241-H245 PolarHBondContact NE1-ND1 3.15Å; W241-H245 AromaticContact NE1-NE2 3.52Å; W241-H245 WeakPolarHBondContact O-CB 3.42Å; W241-H245 PolarHBondContact O-N 3.39Å; W241-H245 PolarHBondContact O-ND1 2.86Å
242L92.3Very high91Very high10 Ų1037 Ų375%0.05219%0.185CC..Hα-helixtrans-59.9-43.7177.5-71.8169.1000112.5E237 S238 R240 H245 Q247 K250 A251 V254E237-L242 HydrophobicContact CB-CD1 4.32Å; E237-L242 HydrophobicContact CB-CG 4.46Å; E237-L242 HydrophobicContact CG-CD2 4.32Å; E237-L242 HydrophobicContact CG-CG 4.15Å; S238-L242 WeakPolarHBondContact O-CG 3.38Å; S238-L242 PolarHBondContact O-N 3.41Å; R240-L242 VanDerWaalsContact C-N 3.29Å; R240-L242 PolarHBondContact O-N 2.94Å; L242-H245 PolarHBondContact O-N 3.01Å; L242-Q247 HydrophobicContact CD2-CB 4.29Å; L242-Q247 WeakPolarHBondContact O-CA 3.2Å; L242-Q247 WeakPolarHBondContact O-CB 3.33Å; L242-Q247 PolarHBondContact O-N 3.29Å; L242-K250 HydrophobicContact CD1-CB 4.25Å; L242-K250 HydrophobicContact CD2-CB 4.18Å; L242-K250 HydrophobicContact CD2-CD 4.48Å; L242-A251 HydrophobicContact CB-CB 3.79Å; L242-V254 HydrophobicContact CD1-CB 4.42Å; L242-V254 HydrophobicContact CD1-CG2 3.73Å
243L87.4Confident90.8Very high11 Ų1144.5 Ų44.56%0.05822%0.218CC..Hα-helixtrans-63.2-44175.9-74.5174.2000112.1F8 P239 R240 W241 H245 G246 P248 A251 F273F8-L243 HydrophobicContact CD2-CD1 3.47Å; F8-L243 VanDerWaalsContact CD2-CD1 3.47Å; F8-L243 HydrophobicContact CE2-CD1 3.33Å; P239-L243 WeakPolarHBondContact O-CG 3.44Å; P239-L243 PolarHBondContact O-N 3.26Å; P239-L243 VanDerWaalsContact O-N 3.12Å; R240-L243 PolarHBondContact O-N 2.78Å; W241-L243 PolarHBondContact O-N 3.16Å; L243-H245 PolarHBondContact O-N 3.47Å; L243-G246 PolarHBondContact O-N 3.27Å; L243-P248 HydrophobicContact CD2-CB 4.15Å; L243-A251 HydrophobicContact CD2-CB 3.75Å; L243-A251 HydrophobicContact CG-CB 3.67Å; L243-F273 HydrophobicContact CD1-CD2 3.57Å; L243-F273 HydrophobicContact CD1-CE2 3.9Å; L243-F273 HydrophobicContact CD1-CG 4.22Å; L243-F273 HydrophobicContact CD2-CB 4.27Å; L243-F273 HydrophobicContact CD2-CD2 4.2Å
244Q83.9Confident90.7Very high52 Ų5239.7 Ų39.724%0.24320%0.199CC..Hα-helixtrans-68.8-16.6179.3-64.2-49.5-6000113.5R240 W241 T417 V418R240-Q244 WeakPolarHBondContact O-CG 3.45Å; R240-Q244 PolarHBondContact O-N 2.96Å; W241-Q244 PolarHBondContact O-N 3.13Å; Q244-T417 HydrophobicContact CG-CG2 4Å; Q244-V418 HydrophobicContact CB-CG1 3.87Å; Q244-V418 HydrophobicContact CG-CG1 4.18Å
245H87Confident90.7Very high25 Ų2533.5 Ų33.512%0.11617%0.171CC..THydrogen-bonded Turntrans-103.624.9177.4-73.171.2000112.8D125 W241 L242 L243 Q247D125-H245 PolarHBondContact O-CE1 3.35Å; D125-H245 VanDerWaalsContact O-CE1 3.23Å; D125-H245 PolarHBondContact O-NE2 3.03Å; W241-H245 AromaticContact CD1-CE1 3.52Å; W241-H245 AromaticContact CD1-ND1 3.68Å; W241-H245 AromaticContact CD2-ND1 3.7Å; W241-H245 AromaticContact CE2-CD2 3.87Å; W241-H245 AromaticContact CE2-CE1 3.41Å; W241-H245 VanDerWaalsContact CE2-CE1 3.41Å; W241-H245 AromaticContact CE2-CG 3.68Å; W241-H245 AromaticContact CE2-ND1 3.37Å; W241-H245 AromaticContact CE2-NE2 3.71Å; W241-H245 AromaticContact CG-ND1 3.88Å; W241-H245 HydrophobicContact CH2-CB 4.31Å; W241-H245 HydrophobicContact CZ2-CB 4.36Å; W241-H245 AromaticContact CZ2-CD2 3.53Å; W241-H245 AromaticContact CZ2-CE1 3.87Å; W241-H245 AromaticContact CZ2-CG 3.63Å; W241-H245 AromaticContact CZ2-ND1 3.82Å; W241-H245 AromaticContact CZ2-NE2 3.7Å; W241-H245 HydrophobicContact CZ3-CB 4.46Å; W241-H245 AromaticContact NE1-CE1 3.01Å; W241-H245 PolarHBondContact NE1-CE1 2.84Å; W241-H245 AromaticContact NE1-ND1 3.38Å; W241-H245 PolarHBondContact NE1-ND1 3.15Å; W241-H245 AromaticContact NE1-NE2 3.52Å; W241-H245 WeakPolarHBondContact O-CB 3.42Å; W241-H245 PolarHBondContact O-N 3.39Å; W241-H245 PolarHBondContact O-ND1 2.86Å; L242-H245 PolarHBondContact O-N 3.01Å; L243-H245 PolarHBondContact O-N 3.47Å; H245-Q247 VanDerWaalsContact C-N 3.27Å; H245-Q247 PolarHBondContact O-N 3.47Å
246G84.1Confident90.5Very high27 Ų2739 Ų3928%0.27819%0.191SC..THydrogen-bonded Turntrans65.626174.100000114L243 P248 S284L243-G246 PolarHBondContact O-N 3.27Å; G246-P248 WeakPolarHBondContact O-CD 3.39Å; G246-S284 WeakPolarHBondContact CA-OG 3.47Å
247Q88.4Confident90.4Very high58 Ų5843.6 Ų43.627%0.27121%0.206SC..  trans-116.458.9-178.6-67.6171.954.800112.1L242 H245 T249 K250 A251L242-Q247 HydrophobicContact CD2-CB 4.29Å; L242-Q247 WeakPolarHBondContact O-CA 3.2Å; L242-Q247 WeakPolarHBondContact O-CB 3.33Å; L242-Q247 PolarHBondContact O-N 3.29Å; H245-Q247 VanDerWaalsContact C-N 3.27Å; H245-Q247 PolarHBondContact O-N 3.47Å; Q247-T249 PolarHBondContact O-N 3.43Å; Q247-K250 HydrophobicContact CB-CB 4.3Å; Q247-K250 HydrophobicContact CB-CD 4.33Å; Q247-K250 PolarHBondContact O-N 3.38Å; Q247-A251 PolarHBondContact O-N 2.82Å
248P86Confident90.3Very high33 Ų3342.3 Ų42.321%0.21420%0.2CC..Hα-helixtrans-62.6-38.7-175.427-34.8000112.9L243 G246 K250 A251 H252 Y274L243-P248 HydrophobicContact CD2-CB 4.15Å; G246-P248 WeakPolarHBondContact O-CD 3.39Å; P248-K250 VanDerWaalsContact C-N 3.33Å; P248-K250 PolarHBondContact O-N 3.09Å; P248-A251 WeakPolarHBondContact O-CB 3.26Å; P248-A251 PolarHBondContact O-N 2.95Å; P248-A251 VanDerWaalsContact O-N 3.16Å; P248-H252 WeakPolarHBondContact O-CB 3.48Å; P248-H252 PolarHBondContact O-N 3.21Å; P248-Y274 HydrophobicContact CB-CD2 4.4Å; P248-Y274 HydrophobicContact CG-CD2 4.46Å
249T88.1Confident90.3Very high85 Ų8542.2 Ų42.252%0.52120%0.2SC..Hα-helixtrans-60.2-41.9178.2-54.70000111.8Q247 K253 D280Q247-T249 PolarHBondContact O-N 3.43Å; T249-K253 PolarHBondContact O-N 2.96Å; T249-K253 VanDerWaalsContact O-N 3.09Å; T249-D280 PolarHBondContact OG1-OD1 3.41Å
250K91.9Very high90.3Very high119 Ų11946.4 Ų46.452%0.51723%0.229SC..Hα-helixtrans-70.8-40.2174.9-69.5179.2-169.3168.50111.8L242 Q247 P248 H252 K253 V254L242-K250 HydrophobicContact CD1-CB 4.25Å; L242-K250 HydrophobicContact CD2-CB 4.18Å; L242-K250 HydrophobicContact CD2-CD 4.48Å; Q247-K250 HydrophobicContact CB-CB 4.3Å; Q247-K250 HydrophobicContact CB-CD 4.33Å; Q247-K250 PolarHBondContact O-N 3.38Å; P248-K250 VanDerWaalsContact C-N 3.33Å; P248-K250 PolarHBondContact O-N 3.09Å; K250-H252 VanDerWaalsContact C-N 3.34Å; K250-H252 PolarHBondContact O-N 3.05Å; K250-K253 PolarHBondContact O-N 3.32Å; K250-V254 WeakPolarHBondContact O-CG2 3.44Å; K250-V254 PolarHBondContact O-N 3.19Å
251A91Very high90.5Very high0 Ų049 Ų490%024%0.242CC..Hα-helixtrans-59.6-44.5176.300000111.7L242 L243 Q247 P248 V254 L255L242-A251 HydrophobicContact CB-CB 3.79Å; L243-A251 HydrophobicContact CD2-CB 3.75Å; L243-A251 HydrophobicContact CG-CB 3.67Å; Q247-A251 PolarHBondContact O-N 2.82Å; P248-A251 WeakPolarHBondContact O-CB 3.26Å; P248-A251 PolarHBondContact O-N 2.95Å; P248-A251 VanDerWaalsContact O-N 3.16Å; A251-V254 PolarHBondContact O-N 2.82Å; A251-L255 WeakPolarHBondContact O-CG 3.42Å; A251-L255 PolarHBondContact O-N 2.78Å
252H89.2Confident90.7Very high25 Ų2548.8 Ų48.812%0.11624%0.243CC..Hα-helixtrans-62.8-42175.6-171.858.6000112.2P248 K250 V254 L255 R256 H269 V271P248-H252 WeakPolarHBondContact O-CB 3.48Å; P248-H252 PolarHBondContact O-N 3.21Å; K250-H252 VanDerWaalsContact C-N 3.34Å; K250-H252 PolarHBondContact O-N 3.05Å; H252-V254 VanDerWaalsContact C-N 3.33Å; H252-V254 PolarHBondContact O-N 3.27Å; H252-L255 PolarHBondContact O-N 3.49Å; H252-R256 VanDerWaalsContact NE2-CZ 3.32Å; H252-R256 PolarHBondContact NE2-NE 3.41Å; H252-R256 VanDerWaalsContact NE2-NE 3.16Å; H252-R256 PolarHBondContact NE2-NH2 3.47Å; H252-R256 WeakPolarHBondContact O-CB 3.49Å; H252-R256 PolarHBondContact O-N 3.47Å; H252-H269 PolarHBondContact CE1-O 3.2Å; H252-V271 HydrophobicContact CB-CG2 4.18Å; H252-V271 WeakPolarHBondContact ND1-CG2 3.49Å
253K92Very high90.7Very high162 Ų16259.6 Ų59.670%0.70428%0.283SS*.Hα-helixtrans-60.2-42.1174.5-173.3176.7-177.9175.10111.8T249 K250 R257T249-K253 PolarHBondContact O-N 2.96Å; T249-K253 VanDerWaalsContact O-N 3.09Å; K250-K253 PolarHBondContact O-N 3.32Å; K253-R257 WeakPolarHBondContact O-CB 3.27Å; K253-R257 PolarHBondContact O-N 2.75Å
254V93.8Very high90.9Very high19 Ų1965.4 Ų65.412%0.11530%0.304CS..Hα-helixtrans-62.9-48.8175170.10000110.5P239 L242 K250 A251 H252 R256 R257 I258P239-V254 HydrophobicContact CB-CG1 4.17Å; P239-V254 HydrophobicContact CG-CG1 4.15Å; L242-V254 HydrophobicContact CD1-CB 4.42Å; L242-V254 HydrophobicContact CD1-CG2 3.73Å; K250-V254 WeakPolarHBondContact O-CG2 3.44Å; K250-V254 PolarHBondContact O-N 3.19Å; A251-V254 PolarHBondContact O-N 2.82Å; H252-V254 VanDerWaalsContact C-N 3.33Å; H252-V254 PolarHBondContact O-N 3.27Å; V254-R256 PolarHBondContact O-N 2.92Å; V254-R257 WeakPolarHBondContact O-CB 3.32Å; V254-R257 PolarHBondContact O-N 3.41Å; V254-R257 VanDerWaalsContact O-N 3.1Å; V254-I258 HydrophobicContact CG1-CD1 3.94Å; V254-I258 HydrophobicContact CG1-CG1 4.38Å; V254-I258 WeakPolarHBondContact O-CG1 3.3Å; V254-I258 PolarHBondContact O-N 2.88Å
255L92.7Very high90.9Very high0 Ų069.2 Ų69.20%032%0.322CS..Hα-helixtrans-62.6-40.6179.9-73164.8000112.6F8 L12 P239 A251 H252 R257 I258 A259 L267 V271F8-L255 HydrophobicContact CE2-CD1 4.23Å; F8-L255 HydrophobicContact CZ-CD1 4.46Å; F8-L255 HydrophobicContact CZ-CD2 4.42Å; L12-L255 HydrophobicContact CD2-CD2 3.83Å; P239-L255 HydrophobicContact CB-CD1 4.32Å; P239-L255 HydrophobicContact CB-CD2 4.13Å; P239-L255 HydrophobicContact CB-CG 3.91Å; P239-L255 HydrophobicContact CG-CD2 4.02Å; P239-L255 HydrophobicContact CG-CG 4.32Å; A251-L255 WeakPolarHBondContact O-CG 3.42Å; A251-L255 PolarHBondContact O-N 2.78Å; H252-L255 PolarHBondContact O-N 3.49Å; L255-R257 VanDerWaalsContact C-N 3.33Å; L255-R257 PolarHBondContact O-N 3.32Å; L255-I258 HydrophobicContact CD2-CD1 4.49Å; L255-I258 WeakPolarHBondContact O-CB 3.45Å; L255-I258 PolarHBondContact O-N 3.17Å; L255-A259 PolarHBondContact O-N 2.86Å; L255-L267 HydrophobicContact CB-CD1 3.6Å; L255-V271 HydrophobicContact CD1-CG1 4.43Å; L255-V271 HydrophobicContact CD1-CG2 3.63Å
256R91.6Very high90.2Very high126 Ų12672.5 Ų72.548%0.47535%0.346SS..Hα-helixtrans-59.9-41.2171.4-79.9-172172.2172.12.7112.5H252 V254 I258 A259 S260H252-R256 VanDerWaalsContact NE2-CZ 3.32Å; H252-R256 PolarHBondContact NE2-NE 3.41Å; H252-R256 VanDerWaalsContact NE2-NE 3.16Å; H252-R256 PolarHBondContact NE2-NH2 3.47Å; H252-R256 WeakPolarHBondContact O-CB 3.49Å; H252-R256 PolarHBondContact O-N 3.47Å; V254-R256 PolarHBondContact O-N 2.92Å; R256-I258 VanDerWaalsContact C-N 3.34Å; R256-A259 PolarHBondContact O-N 3.23Å; R256-S260 WeakPolarHBondContact O-CB 3.33Å; R256-S260 PolarHBondContact O-N 3.15Å
257R93.1Very high89.9Confident111 Ų11171.6 Ų71.642%0.41933%0.334SS..Hα-helixtrans-62.6-42.3174.7-178.9179.2179.1-167.71.4111.3F234 S236 K253 V254 L255 S260 I261F234-R257 PolarHBondContact O-NH2 3.29Å; S236-R257 PolarHBondContact OG-NH1 3.06Å; K253-R257 WeakPolarHBondContact O-CB 3.27Å; K253-R257 PolarHBondContact O-N 2.75Å; V254-R257 WeakPolarHBondContact O-CB 3.32Å; V254-R257 PolarHBondContact O-N 3.41Å; V254-R257 VanDerWaalsContact O-N 3.1Å; L255-R257 VanDerWaalsContact C-N 3.33Å; L255-R257 PolarHBondContact O-N 3.32Å; R257-S260 PolarHBondContact O-N 3.29Å; R257-I261 HydrophobicContact CG-CD1 3.91Å; R257-I261 WeakPolarHBondContact O-CG1 3.38Å; R257-I261 PolarHBondContact O-N 3.03Å
258I94.3Very high88.8Confident0 Ų076.5 Ų76.50%036%0.355CS..Hα-helixtrans-61.2-50.5176.2-64.3173.8000110.2C15 Y21 P239 V254 L255 R256 S260 I261 N262C15-I258 HydrophobicContact CB-CG2 4.02Å; Y21-I258 HydrophobicContact CD1-CB 4.27Å; Y21-I258 HydrophobicContact CD1-CD1 4Å; Y21-I258 HydrophobicContact CD1-CG1 3.61Å; Y21-I258 HydrophobicContact CD1-CG2 3.87Å; Y21-I258 HydrophobicContact CE1-CD1 3.65Å; Y21-I258 HydrophobicContact CE1-CG1 3.51Å; Y21-I258 HydrophobicContact CE2-CG1 4.47Å; Y21-I258 HydrophobicContact CG-CG1 4.15Å; Y21-I258 HydrophobicContact CG-CG2 4.23Å; P239-I258 HydrophobicContact CG-CD1 4.38Å; V254-I258 HydrophobicContact CG1-CD1 3.94Å; V254-I258 HydrophobicContact CG1-CG1 4.38Å; V254-I258 WeakPolarHBondContact O-CG1 3.3Å; V254-I258 PolarHBondContact O-N 2.88Å; L255-I258 HydrophobicContact CD2-CD1 4.49Å; L255-I258 WeakPolarHBondContact O-CB 3.45Å; L255-I258 PolarHBondContact O-N 3.17Å; R256-I258 VanDerWaalsContact C-N 3.34Å; I258-S260 VanDerWaalsContact C-N 3.3Å; I258-S260 PolarHBondContact O-N 3.44Å; I258-I261 PolarHBondContact O-N 3.4Å; I258-N262 VanDerWaalsContact O-CB 3.32Å; I258-N262 WeakPolarHBondContact O-CB 3.48Å; I258-N262 PolarHBondContact O-N 3.26Å
259A93Very high87.7Confident1 Ų181.4 Ų81.41%0.00837%0.374CS..Hα-helixtrans-57.4-43.7177.500000111.7C15 L255 R256 N262 R263 R264C15-A259 HydrophobicContact CB-CB 4.35Å; L255-A259 PolarHBondContact O-N 2.86Å; R256-A259 PolarHBondContact O-N 3.23Å; A259-N262 CarbonylContact O-C 3.43Å; A259-N262 PolarHBondContact O-N 3.15Å; A259-R263 PolarHBondContact O-N 3.5Å; A259-R264 HydrophobicContact CB-CB 4.23Å; A259-R264 PolarHBondContact O-N 3.43Å
260S93.7Very high86.3Confident88 Ų8879.3 Ų79.362%0.61537%0.366SS*.Hα-helixtrans-61.6-49.4177.4177.50000112.5R256 R257 I258 N262 R263R256-S260 WeakPolarHBondContact O-CB 3.33Å; R256-S260 PolarHBondContact O-N 3.15Å; R257-S260 PolarHBondContact O-N 3.29Å; I258-S260 VanDerWaalsContact C-N 3.3Å; I258-S260 PolarHBondContact O-N 3.44Å; S260-N262 PolarHBondContact O-N 3.36Å; S260-R263 PolarHBondContact O-N 3.43Å
261I94.8Very high84.7Confident57 Ų5774.2 Ų74.229%0.29234%0.344SS..Hα-helixtrans-60.9-38.3177.7-68.9169.1000110.6F20 Y21 R257 I258 R263F20-I261 HydrophobicContact CD1-CG2 3.8Å; F20-I261 HydrophobicContact CE1-CG2 4.47Å; Y21-I261 HydrophobicContact CD2-CD1 3.66Å; Y21-I261 HydrophobicContact CD2-CG2 4.35Å; Y21-I261 HydrophobicContact CE2-CD1 4.11Å; R257-I261 HydrophobicContact CG-CD1 3.91Å; R257-I261 WeakPolarHBondContact O-CG1 3.38Å; R257-I261 PolarHBondContact O-N 3.03Å; I258-I261 PolarHBondContact O-N 3.4Å; I261-R263 PolarHBondContact O-N 3.48Å
262N95.6Very high82.9Confident16 Ų1677.3 Ų77.39%0.08637%0.37CS..THydrogen-bonded Turntrans-814178.1-71-20.5000114C15 G16 S19 F20 Y21 Q22 I258 A259 S260 R264C15-N262 WeakPolarHBondContact O-CB 3.38Å; C15-N262 PolarHBondContact O-ND2 3.35Å; G16-N262 PolarHBondContact O-ND2 3.44Å; S19-N262 WeakPolarHBondContact CB-OD1 3.28Å; F20-N262 PolarHBondContact N-OD1 3.16Å; Y21-N262 WeakPolarHBondContact CB-OD1 3.35Å; Y21-N262 PolarHBondContact N-OD1 3.14Å; Q22-N262 PolarHBondContact OE1-ND2 3.13Å; I258-N262 VanDerWaalsContact O-CB 3.32Å; I258-N262 WeakPolarHBondContact O-CB 3.48Å; I258-N262 PolarHBondContact O-N 3.26Å; A259-N262 CarbonylContact O-C 3.43Å; A259-N262 PolarHBondContact O-N 3.15Å; S260-N262 PolarHBondContact O-N 3.36Å; N262-R264 VanDerWaalsContact C-N 3.27Å; N262-R264 HydrophobicContact CB-CG 4.16Å; N262-R264 PolarHBondContact O-N 3.43Å
263R93.8Very high81.3Confident236 Ų23679.5 Ų79.589%0.89138%0.38SS*.THydrogen-bonded Turntrans53.841.7-178.3-53.5-178.6-178.3-176.1-0.5112.9A259 S260 I261A259-R263 PolarHBondContact O-N 3.5Å; S260-R263 PolarHBondContact O-N 3.43Å; I261-R263 PolarHBondContact O-N 3.48Å
264R91.1Very high79.2Confident134 Ų13476.6 Ų76.651%0.50637%0.365SS..PPolyproline II helixtrans-101.4158.5174.6-64.2-64.3-176.9169.1-0.3110.9A259 N262A259-R264 HydrophobicContact CB-CB 4.23Å; A259-R264 PolarHBondContact O-N 3.43Å; N262-R264 VanDerWaalsContact C-N 3.27Å; N262-R264 HydrophobicContact CB-CG 4.16Å; N262-R264 PolarHBondContact O-N 3.43Å
265E84.3Confident76.6Confident132 Ų13280.8 Ų80.862%0.61739%0.393SS*.PPolyproline II helixtrans-57.3142.3174.4-75.2-164.8170.300110.4L267 K268E265-L267 PolarHBondContact O-N 3.38Å; E265-K268 WeakPolarHBondContact OE2-CE 3.4Å; E265-K268 IonicContact OE2-NZ 2.83Å; E265-K268 PolarHBondContact OE2-NZ 3.37Å
266P72.9Confident73.9Confident94 Ų9487.9 Ų87.961%0.6143%0.43SS*.PPolyproline II helixtrans-56.8136.2172.4-18.529.4000110.1K268P266-K268 PolarHBondContact O-N 2.91Å
267L76.7Confident71.5Confident8 Ų885.4 Ų85.44%0.04244%0.444CS..  trans-53.3115.3174.7-70.4168.4000109.8E14 L255 E265 H269E14-L267 HydrophobicContact CB-CD2 4.04Å; E14-L267 VanDerWaalsContact OE2-CD2 3.26Å; E14-L267 WeakPolarHBondContact OE2-CD2 3.49Å; L255-L267 HydrophobicContact CB-CD1 3.6Å; E265-L267 PolarHBondContact O-N 3.38Å; L267-H269 VanDerWaalsContact C-N 3.29Å; L267-H269 PolarHBondContact O-N 3.07Å
268K65.6Low69.2Low160 Ų16082.4 Ų82.470%0.69644%0.443SS*.SBendtrans-68.9-26.6-172.3-69.9-179.5-179.5166.50113E265 P266E265-K268 WeakPolarHBondContact OE2-CE 3.4Å; E265-K268 IonicContact OE2-NZ 2.83Å; E265-K268 PolarHBondContact OE2-NZ 3.37Å; P266-K268 PolarHBondContact O-N 2.91Å
269H63.1Low66.7Low136 Ų13688 Ų8863%0.6347%0.473SS*.SBendtrans-115.5143.8175.5-59-67.4000109.2H252 L267 V271H252-H269 PolarHBondContact CE1-O 3.2Å; L267-H269 VanDerWaalsContact C-N 3.29Å; L267-H269 PolarHBondContact O-N 3.07Å; H269-V271 PolarHBondContact O-N 3.48Å
270A57.5Low64.4Low41 Ų4193.9 Ų93.934%0.33950%0.504SS..  trans-51136.5158.400000106.9A272A270-A272 VanDerWaalsContact C-N 3.33Å; A270-A272 PolarHBondContact O-N 2.97Å
271V59.6Low62Low12 Ų1298 Ų987%0.07351%0.514CS..  trans-58.1103.9-179.3-1540000106.7H11 H252 L255 H269 F273H11-V271 HydrophobicContact CB-CG1 4.49Å; H11-V271 WeakPolarHBondContact CD2-CG1 3.38Å; H252-V271 HydrophobicContact CB-CG2 4.18Å; H252-V271 WeakPolarHBondContact ND1-CG2 3.49Å; L255-V271 HydrophobicContact CD1-CG1 4.43Å; L255-V271 HydrophobicContact CD1-CG2 3.63Å; H269-V271 PolarHBondContact O-N 3.48Å; V271-F273 HydrophobicContact CB-CD2 4Å; V271-F273 HydrophobicContact CB-CE2 4.38Å; V271-F273 HydrophobicContact CG1-CD2 3.27Å; V271-F273 HydrophobicContact CG1-CE2 3.21Å; V271-F273 HydrophobicContact CG1-CZ 4.45Å; V271-F273 PolarHBondContact O-N 3.09Å
272A51.9Low59.6Low66 Ų66102.8 Ų102.855%0.54554%0.535SS..THydrogen-bonded Turntrans-76.453-164.900000111.4A270A270-A272 VanDerWaalsContact C-N 3.33Å; A270-A272 PolarHBondContact O-N 2.97Å
273F55.6Low57.3Low71 Ų71110.4 Ų110.431%0.31157%0.57SS.*THydrogen-bonded Turntrans-87-17.2172-74.4-67000111.9F8 H11 L243 V271F8-F273 HydrophobicContact CB-CE2 4.25Å; F8-F273 HydrophobicContact CB-CZ 3.72Å; F8-F273 HydrophobicContact CD2-CD2 4.49Å; F8-F273 AromaticContact CD2-CE2 3.61Å; F8-F273 HydrophobicContact CD2-CE2 3.61Å; F8-F273 AromaticContact CD2-CZ 3.95Å; F8-F273 HydrophobicContact CD2-CZ 3.95Å; F8-F273 HydrophobicContact CE2-CE2 4.5Å; F8-F273 HydrophobicContact CG-CE2 4.39Å; F8-F273 HydrophobicContact CG-CZ 4.33Å; H11-F273 AromaticContact CD2-CE2 3.81Å; L243-F273 HydrophobicContact CD1-CD2 3.57Å; L243-F273 HydrophobicContact CD1-CE2 3.9Å; L243-F273 HydrophobicContact CD1-CG 4.22Å; L243-F273 HydrophobicContact CD2-CB 4.27Å; L243-F273 HydrophobicContact CD2-CD2 4.2Å; V271-F273 HydrophobicContact CB-CD2 4Å; V271-F273 HydrophobicContact CB-CE2 4.38Å; V271-F273 HydrophobicContact CG1-CD2 3.27Å; V271-F273 HydrophobicContact CG1-CE2 3.21Å; V271-F273 HydrophobicContact CG1-CZ 4.45Å; V271-F273 PolarHBondContact O-N 3.09Å
274Y48.1Very low55.3Low101 Ų101101 Ų10140%0.39654%0.541SS..SBendtrans-131137.7169.5-78.8-91.4000108.3P248 D276P248-Y274 HydrophobicContact CB-CD2 4.4Å; P248-Y274 HydrophobicContact CG-CD2 4.46Å; Y274-D276 PolarHBondContact O-N 3.49Å
275P40Very low53.6Low107 Ų107101.9 Ų101.970%0.69556%0.556SS**  trans-55.8133.1177.1-17.729000109.3G277 A278P275-G277 PolarHBondContact O-N 2.9Å; P275-A278 PolarHBondContact O-N 3.36Å; P275-A278 VanDerWaalsContact O-N 3.09Å
276D36.3Very low52.7Low148 Ų14898.4 Ų98.479%0.79154%0.543SS*.THydrogen-bonded Turntrans-53.5105.9168.6-74.7-39.8000107.6Y274Y274-D276 PolarHBondContact O-N 3.49Å
277G41.7Very low52.8Low74 Ų7496.2 Ų96.276%0.76353%0.528SS*.THydrogen-bonded Turntrans130.8-8.7-174.300000116P275 D279P275-G277 PolarHBondContact O-N 2.9Å; G277-D279 PolarHBondContact O-N 3Å
278A44.9Very low53Low49 Ų49100 Ų10041%0.40555%0.548SS..  trans-71.698.2160.200000107.6P275 D280P275-A278 PolarHBondContact O-N 3.36Å; P275-A278 VanDerWaalsContact O-N 3.09Å; A278-D280 PolarHBondContact O-N 3.42Å
279D40.7Very low54Low118 Ų11893.5 Ų93.563%0.63152%0.519SS*.  trans-45.9136.5172.4-95-35.2000109.4G277 Q281 Q282G277-D279 PolarHBondContact O-N 3Å; D279-Q281 HydrophobicContact CB-CB 4.22Å; D279-Q281 PolarHBondContact O-N 3.12Å; D279-Q282 PolarHBondContact O-N 3.21Å
280D45.5Very low55.4Low123 Ų12389.7 Ų89.766%0.65851%0.506SS*.THydrogen-bonded Turntrans-52.8-7.6170.7-87.9-31.7000112.2T249 A278T249-D280 PolarHBondContact OG1-OD1 3.41Å; A278-D280 PolarHBondContact O-N 3.42Å
281Q42.1Very low57.1Low174 Ų17490.2 Ų90.281%0.81350%0.499SS*.THydrogen-bonded Turntrans-85-17.9176.2-61.9-172.3400114.9D279 E283D279-Q281 HydrophobicContact CB-CB 4.22Å; D279-Q281 PolarHBondContact O-N 3.12Å; Q281-E283 PolarHBondContact O-N 3.27Å
282Q45Very low58.7Low159 Ų15996.7 Ų96.774%0.74353%0.527SS*.SBendtrans-81.882.4168.4-136165.916.400106.6D279 S284D279-Q282 PolarHBondContact O-N 3.21Å; Q282-S284 PolarHBondContact O-N 3.25Å
283E46.6Very low60.5Low175 Ų17594.4 Ų94.482%0.81851%0.506SS*.  trans-50.495.2162.9-85.5-172154.200106.4Q281 N285Q281-E283 PolarHBondContact O-N 3.27Å; E283-N285 PolarHBondContact O-N 3.18Å
284S52.4Low62.2Low40 Ų4091.1 Ų91.128%0.2849%0.491SS..  trans-53.8114.8169.559.60000104.6G246 Q282 V286G246-S284 WeakPolarHBondContact CA-OG 3.47Å; Q282-S284 PolarHBondContact O-N 3.25Å; S284-V286 VanDerWaalsContact C-N 3.32Å; S284-V286 WeakPolarHBondContact O-CA 3.11Å; S284-V286 WeakPolarHBondContact O-CG2 3.08Å; S284-V286 PolarHBondContact O-N 3.03Å
285N54.6Low64.3Low152 Ų15291.3 Ų91.381%0.81350%0.498SS*.  trans-44.398-175-88.5-37.5000109.2E283 V287E283-N285 PolarHBondContact O-N 3.18Å; N285-V287 WeakPolarHBondContact O-CG2 3.3Å; N285-V287 PolarHBondContact O-N 3.22Å
286V65.7Low66.6Low59 Ų5994.7 Ų94.736%0.35850%0.497SS..  trans-69109.6-172.4176.50000105.2S284 N288S284-V286 VanDerWaalsContact C-N 3.32Å; S284-V286 WeakPolarHBondContact O-CA 3.11Å; S284-V286 WeakPolarHBondContact O-CG2 3.08Å; S284-V286 PolarHBondContact O-N 3.03Å; V286-N288 PolarHBondContact O-N 3.07Å; V286-N288 VanDerWaalsContact O-N 3.16Å; V286-N288 PolarHBondContact O-OD1 3.19Å; V286-N288 VanDerWaalsContact O-OD1 3.13Å
287V75.2Confident69.1Low48 Ų4887.7 Ų87.729%0.29146%0.46SS..  trans-74.3116.9-172.4179.60000108.9N285 Y289 K486N285-V287 WeakPolarHBondContact O-CG2 3.3Å; N285-V287 PolarHBondContact O-N 3.22Å; V287-Y289 HydrophobicContact CB-CE2 3.95Å; V287-Y289 HydrophobicContact CG1-CD1 4.27Å; V287-Y289 HydrophobicContact CG1-CD2 4.39Å; V287-Y289 HydrophobicContact CG1-CE1 3.83Å; V287-Y289 HydrophobicContact CG1-CE2 3.94Å; V287-Y289 WeakPolarHBondContact O-CD2 3.38Å; V287-Y289 WeakPolarHBondContact O-CE2 3.24Å; V287-Y289 PolarHBondContact O-N 3.34Å; V287-K486 HydrophobicContact CG1-CD 3.56Å
288N81.1Confident71.2Confident86 Ų8692.6 Ų92.646%0.4646%0.46SS..  trans-81.9108.5-180-62.4-24.6000108.9R126 V286R126-N288 VanDerWaalsContact CZ-OD1 3.29Å; R126-N288 PolarHBondContact NH1-ND2 3.3Å; R126-N288 PolarHBondContact NH1-OD1 2.83Å; R126-N288 VanDerWaalsContact NH2-CG 3.35Å; R126-N288 PolarHBondContact NH2-ND2 3.47Å; R126-N288 VanDerWaalsContact NH2-ND2 3.13Å; R126-N288 PolarHBondContact NH2-OD1 3.15Å; V286-N288 PolarHBondContact O-N 3.07Å; V286-N288 VanDerWaalsContact O-N 3.16Å; V286-N288 PolarHBondContact O-OD1 3.19Å; V286-N288 VanDerWaalsContact O-OD1 3.13Å
289Y87.3Confident73.1Confident24 Ų2495 Ų959%0.09447%0.469CS..  trans-90.2148.5177.8-63.6-76.2000111.8V287 D293 V418 V419 M483 K486V287-Y289 HydrophobicContact CB-CE2 3.95Å; V287-Y289 HydrophobicContact CG1-CD1 4.27Å; V287-Y289 HydrophobicContact CG1-CD2 4.39Å; V287-Y289 HydrophobicContact CG1-CE1 3.83Å; V287-Y289 HydrophobicContact CG1-CE2 3.94Å; V287-Y289 WeakPolarHBondContact O-CD2 3.38Å; V287-Y289 WeakPolarHBondContact O-CE2 3.24Å; V287-Y289 PolarHBondContact O-N 3.34Å; Y289-D293 HydrophobicContact CD1-CB 4.29Å; Y289-V418 HydrophobicContact CD2-CB 3.66Å; Y289-V418 HydrophobicContact CD2-CG1 4.36Å; Y289-V418 HydrophobicContact CD2-CG2 4.01Å; Y289-V418 HydrophobicContact CE2-CB 3.48Å; Y289-V418 VanDerWaalsContact CE2-CB 3.48Å; Y289-V418 HydrophobicContact CE2-CG1 3.8Å; Y289-V418 HydrophobicContact CE2-CG2 3.63Å; Y289-V419 HydrophobicContact CD1-CG1 4.25Å; Y289-V419 HydrophobicContact CD2-CG1 4.44Å; Y289-V419 HydrophobicContact CG-CG1 3.88Å; Y289-M483 HydrophobicContact CD1-CE 3.1Å; Y289-M483 HydrophobicContact CE1-CE 3.17Å; Y289-M483 HydrophobicContact CG-CE 4.13Å; Y289-K486 HydrophobicContact CE1-CD 3.69Å; Y289-K486 HydrophobicContact CE1-CG 4.33Å
290T92.4Very high75.5Confident56 Ų5689.5 Ų89.534%0.34444%0.44SS..  trans-128.3168178.866.50000110.2F292 D293T290-F292 PolarHBondContact O-N 2.98Å; T290-F292 VanDerWaalsContact O-N 3.15Å; T290-F292 PolarHBondContact OG1-N 2.89Å; T290-D293 PolarHBondContact N-OD2 2.86Å; T290-D293 WeakPolarHBondContact O-CB 3.2Å; T290-D293 PolarHBondContact O-N 2.93Å; T290-D293 PolarHBondContact OG1-OD2 3.22Å
291Y93.1Very high77.8Confident53 Ų5385.8 Ų85.821%0.20842%0.42CS..Hα-helixtrans-57.6-27.5174.5-78.8-72.7000113.9I118 Y122 D293 L294 M422 V426I118-Y291 HydrophobicContact CG2-CD2 4.46Å; I118-Y291 HydrophobicContact CG2-CE2 3.68Å; I118-Y291 PolarHBondContact O-OH 3.23Å; Y122-Y291 PolarHBondContact N-OH 3.39Å; Y291-D293 VanDerWaalsContact C-N 3.28Å; Y291-D293 PolarHBondContact O-N 2.77Å; Y291-L294 HydrophobicContact CD1-CD1 3.97Å; Y291-L294 PolarHBondContact O-N 2.95Å; Y291-M422 HydrophobicContact CD1-CB 4.18Å; Y291-M422 HydrophobicContact CD2-SD 4.46Å; Y291-M422 HydrophobicContact CE1-CB 3.57Å; Y291-M422 HydrophobicContact CE1-CG 3.92Å; Y291-M422 WeakPolarHBondContact CE1-O 3.31Å; Y291-M422 HydrophobicContact CE2-CG 4.24Å; Y291-M422 HydrophobicContact CE2-SD 4.38Å; Y291-V426 HydrophobicContact CD1-CG2 3.89Å; Y291-V426 HydrophobicContact CE1-CG2 3.77Å
292F92.1Very high80.2Confident148 Ų14880.9 Ų80.965%0.64940%0.399SS*.Hα-helixtrans-66.8-30.4176.9-71.7-76.2000112.8T290 L294 I295 R296T290-F292 PolarHBondContact O-N 2.98Å; T290-F292 VanDerWaalsContact O-N 3.15Å; T290-F292 PolarHBondContact OG1-N 2.89Å; F292-L294 VanDerWaalsContact C-N 3.27Å; F292-L294 PolarHBondContact O-N 3.35Å; F292-I295 PolarHBondContact O-N 3.23Å; F292-I295 VanDerWaalsContact O-N 3.14Å; F292-R296 PolarHBondContact O-N 3.13Å; F292-R296 VanDerWaalsContact O-N 3.16Å
293D90.6Very high82.5Confident18 Ų1873.9 Ų73.910%0.09637%0.367CS..Hα-helixtrans-69-29.2-179.7-58.8-63000111.8Y289 T290 Y291 I295 R296 D297 M483Y289-D293 HydrophobicContact CD1-CB 4.29Å; T290-D293 PolarHBondContact N-OD2 2.86Å; T290-D293 WeakPolarHBondContact O-CB 3.2Å; T290-D293 PolarHBondContact O-N 2.93Å; T290-D293 PolarHBondContact OG1-OD2 3.22Å; Y291-D293 VanDerWaalsContact C-N 3.28Å; Y291-D293 PolarHBondContact O-N 2.77Å; D293-I295 PolarHBondContact O-N 3.37Å; D293-R296 PolarHBondContact O-N 3.33Å; D293-D297 PolarHBondContact O-N 2.93Å; D293-D297 VanDerWaalsContact O-N 3.13Å; D293-M483 HydrophobicContact CB-CE 3.47Å; D293-M483 VanDerWaalsContact CB-CE 3.47Å; D293-M483 HydrophobicContact CB-SD 4.42Å
294L91.9Very high84.8Confident2 Ų266 Ų661%0.0133%0.33CS..Hα-helixtrans-63.1-31.8173-69.2101000112.7Y291 F292 V300 L304 V419 M422 S423Y291-L294 HydrophobicContact CD1-CD1 3.97Å; Y291-L294 PolarHBondContact O-N 2.95Å; F292-L294 VanDerWaalsContact C-N 3.27Å; F292-L294 PolarHBondContact O-N 3.35Å; L294-V300 HydrophobicContact CB-CG1 4.49Å; L294-V300 HydrophobicContact CD2-CG1 4.32Å; L294-V300 HydrophobicContact CG-CG1 4.46Å; L294-L304 HydrophobicContact CB-CD2 4.27Å; L294-L304 HydrophobicContact CD2-CD1 4.4Å; L294-L304 HydrophobicContact CD2-CD2 4.15Å; L294-V419 HydrophobicContact CG-CB 4.48Å; L294-M422 HydrophobicContact CD1-CB 4.08Å; L294-M422 HydrophobicContact CD1-SD 4.48Å; L294-S423 WeakPolarHBondContact CD2-OG 3.49Å
295I91.1Very high86.9Confident105 Ų10569 Ų6954%0.53834%0.343SS..Hα-helixtrans-81.3-30.5-179.7-54.1173000110.5F292 D293F292-I295 PolarHBondContact O-N 3.23Å; F292-I295 VanDerWaalsContact O-N 3.14Å; D293-I295 PolarHBondContact O-N 3.37Å
296R88.6Confident88.9Confident177 Ų17762 Ų6267%0.66831%0.305SS*.Hα-helixtrans-71.3-42.6178.7-72.1177.5173.9-177.6-3.4111.9F292 D293 K298 I485F292-R296 PolarHBondContact O-N 3.13Å; F292-R296 VanDerWaalsContact O-N 3.16Å; D293-R296 PolarHBondContact O-N 3.33Å; R296-K298 PolarHBondContact O-N 2.97Å; R296-I485 HydrophobicContact CB-CD1 3.76Å; R296-I485 WeakPolarHBondContact O-CD1 3.48Å
297D87.9Confident90.3Very high2 Ų259.1 Ų59.11%0.01129%0.288CS..  trans-79.8105.2-177.5-167.7-26.5000111.5D293 V299 V300 L301 M483 S484 I485D293-D297 PolarHBondContact O-N 2.93Å; D293-D297 VanDerWaalsContact O-N 3.13Å; D297-V299 PolarHBondContact O-N 2.84Å; D297-V299 WeakPolarHBondContact OD1-CA 3.4Å; D297-V299 VanDerWaalsContact OD1-CB 3.26Å; D297-V299 WeakPolarHBondContact OD1-CB 3.22Å; D297-V299 PolarHBondContact OD1-N 3.28Å; D297-V300 HydrophobicContact CB-CB 4.19Å; D297-V300 HydrophobicContact CB-CG2 4.09Å; D297-V300 PolarHBondContact O-N 3.38Å; D297-L301 WeakPolarHBondContact O-CB 3.37Å; D297-L301 PolarHBondContact O-N 2.85Å; D297-M483 HydrophobicContact CB-SD 4.1Å; D297-M483 WeakPolarHBondContact OD2-CB 3.43Å; D297-S484 PolarHBondContact OD1-OG 3.1Å; D297-S484 PolarHBondContact OD2-N 2.99Å; D297-S484 PolarHBondContact OD2-OG 3.23Å; D297-I485 VanDerWaalsContact CA-CD1 3.42Å; D297-I485 HydrophobicContact CB-CD1 3.73Å; D297-I485 HydrophobicContact CB-CG1 4.01Å
298K85.3Confident91.3Very high176 Ų17657.5 Ų57.577%0.76528%0.279SS*.Hα-helixtrans-59.6-29.4178.6-67-176.5-178.9177.40113.1R296 V300 L302R296-K298 PolarHBondContact O-N 2.97Å; K298-V300 VanDerWaalsContact C-N 3.28Å; K298-L302 PolarHBondContact O-N 2.9Å
299V86.7Confident92.1Very high99 Ų9955.4 Ų55.460%0.627%0.265SS*.Hα-helixtrans-69.7-31.2178.7-176.10000110.6D297 P303D297-V299 PolarHBondContact O-N 2.84Å; D297-V299 WeakPolarHBondContact OD1-CA 3.4Å; D297-V299 VanDerWaalsContact OD1-CB 3.26Å; D297-V299 WeakPolarHBondContact OD1-CB 3.22Å; D297-V299 PolarHBondContact OD1-N 3.28Å; V299-P303 WeakPolarHBondContact O-CD 3.41Å; V299-P303 VanDerWaalsContact O-CG 3.31Å; V299-P303 WeakPolarHBondContact O-CG 3.49Å
300V90.4Very high92.5Very high3 Ų354.3 Ų54.32%0.01826%0.261CS..Hα-helixtrans-87.2-43.8175.5179.60000111.3L294 D297 K298 L302 P303 L304 F415 P416 M483L294-V300 HydrophobicContact CB-CG1 4.49Å; L294-V300 HydrophobicContact CD2-CG1 4.32Å; L294-V300 HydrophobicContact CG-CG1 4.46Å; D297-V300 HydrophobicContact CB-CB 4.19Å; D297-V300 HydrophobicContact CB-CG2 4.09Å; D297-V300 PolarHBondContact O-N 3.38Å; K298-V300 VanDerWaalsContact C-N 3.28Å; V300-L302 PolarHBondContact O-N 3.1Å; V300-P303 WeakPolarHBondContact O-CD 3.14Å; V300-L304 VanDerWaalsContact O-CB 3.25Å; V300-L304 WeakPolarHBondContact O-CB 3.45Å; V300-L304 PolarHBondContact O-N 3.3Å; V300-F415 HydrophobicContact CG1-CD1 4.04Å; V300-F415 HydrophobicContact CG1-CE1 4.36Å; V300-P416 HydrophobicContact CG2-CG 4.02Å; V300-M483 HydrophobicContact CG2-CG 4.15Å; V300-M483 HydrophobicContact CG2-SD 4.2Å
301L93.5Very high92.6Very high45 Ų4551.9 Ų51.924%0.23625%0.245CC..Hα-helixtrans-59.7-43.7-174.2178.160.9000112.4D297 L304 L305D297-L301 WeakPolarHBondContact O-CB 3.37Å; D297-L301 PolarHBondContact O-N 2.85Å; L301-L304 WeakPolarHBondContact O-CB 3.26Å; L301-L304 PolarHBondContact O-N 2.89Å; L301-L305 HydrophobicContact CD1-CD1 4.06Å; L301-L305 HydrophobicContact CD1-CD2 4.35Å; L301-L305 HydrophobicContact CD1-CG 3.95Å; L301-L305 HydrophobicContact CG-CD1 4.07Å; L301-L305 HydrophobicContact CG-CG 4.36Å; L301-L305 WeakPolarHBondContact O-CG 3.48Å; L301-L305 PolarHBondContact O-N 2.9Å
302L93Very high92.7Very high72 Ų7251.9 Ų51.938%0.37725%0.246SC..Hα-helixtrans-65.9-52-176.1178.869.7000112.1K298 V300 L304 L305 V306 Y470K298-L302 PolarHBondContact O-N 2.9Å; V300-L302 PolarHBondContact O-N 3.1Å; L302-L304 PolarHBondContact O-N 3.41Å; L302-L305 PolarHBondContact O-N 3.23Å; L302-V306 VanDerWaalsContact O-CG2 3.3Å; L302-V306 WeakPolarHBondContact O-CG2 3.45Å; L302-V306 PolarHBondContact O-N 3.19Å; L302-V306 VanDerWaalsContact O-N 3.12Å; L302-Y470 HydrophobicContact CD1-CD1 3.79Å; L302-Y470 HydrophobicContact CD1-CE1 4.41Å; L302-Y470 HydrophobicContact CD1-CG 3.89Å; L302-Y470 HydrophobicContact CD2-CD1 3.88Å; L302-Y470 HydrophobicContact CD2-CG 4.34Å; L302-Y470 HydrophobicContact CG-CD1 4.31Å; L302-Y470 HydrophobicContact CG-CG 4.4Å
303P93.5Very high92.8Very high12 Ų1244.9 Ų44.98%0.07822%0.216CC..Hα-helixtrans-55.5-37168.7-28.236000113.8V299 V300 V306 L307 L414 F415 L471V299-P303 WeakPolarHBondContact O-CD 3.41Å; V299-P303 VanDerWaalsContact O-CG 3.31Å; V299-P303 WeakPolarHBondContact O-CG 3.49Å; V300-P303 WeakPolarHBondContact O-CD 3.14Å; P303-V306 PolarHBondContact O-N 2.95Å; P303-L307 VanDerWaalsContact O-CB 3.29Å; P303-L307 WeakPolarHBondContact O-CB 3.41Å; P303-L307 WeakPolarHBondContact O-CG 3.4Å; P303-L307 PolarHBondContact O-N 2.79Å; P303-L414 HydrophobicContact CB-CB 4.36Å; P303-L414 HydrophobicContact CB-CD1 4.16Å; P303-F415 HydrophobicContact CB-CE1 4.05Å; P303-L471 HydrophobicContact CB-CD1 4.37Å
304L95.3Very high92.9Very high9 Ų944 Ų445%0.04721%0.211CC..Hα-helixtrans-60.6-48.6178-172.173.5000111.8L294 V300 L301 L302 S308 F415 V426 V427L294-L304 HydrophobicContact CB-CD2 4.27Å; L294-L304 HydrophobicContact CD2-CD1 4.4Å; L294-L304 HydrophobicContact CD2-CD2 4.15Å; V300-L304 VanDerWaalsContact O-CB 3.25Å; V300-L304 WeakPolarHBondContact O-CB 3.45Å; V300-L304 PolarHBondContact O-N 3.3Å; L301-L304 WeakPolarHBondContact O-CB 3.26Å; L301-L304 PolarHBondContact O-N 2.89Å; L302-L304 PolarHBondContact O-N 3.41Å; L304-S308 WeakPolarHBondContact O-CB 3.42Å; L304-S308 PolarHBondContact O-N 3.29Å; L304-S308 PolarHBondContact O-OG 3.26Å; L304-F415 HydrophobicContact CB-CE1 4.05Å; L304-F415 HydrophobicContact CB-CZ 4.17Å; L304-F415 HydrophobicContact CD1-CE1 4.1Å; L304-F415 HydrophobicContact CD1-CE2 4.26Å; L304-F415 HydrophobicContact CD1-CZ 3.7Å; L304-V426 HydrophobicContact CD1-CB 4.17Å; L304-V426 HydrophobicContact CD1-CG1 4.31Å; L304-V426 HydrophobicContact CD2-CG1 4.29Å; L304-V426 HydrophobicContact CG-CG1 4.37Å; L304-V427 HydrophobicContact CD1-CG2 3.82Å
305L96.2Very high92.9Very high103 Ų10343.9 Ų43.954%0.53921%0.21SC..Hα-helixtrans-64.7-44.5179.1-69174.7000111.7L301 L302 S308 Y309L301-L305 HydrophobicContact CD1-CD1 4.06Å; L301-L305 HydrophobicContact CD1-CD2 4.35Å; L301-L305 HydrophobicContact CD1-CG 3.95Å; L301-L305 HydrophobicContact CG-CD1 4.07Å; L301-L305 HydrophobicContact CG-CG 4.36Å; L301-L305 WeakPolarHBondContact O-CG 3.48Å; L301-L305 PolarHBondContact O-N 2.9Å; L302-L305 PolarHBondContact O-N 3.23Å; L305-S308 PolarHBondContact O-N 2.9Å; L305-Y309 PolarHBondContact O-N 3.31Å
306V96.3Very high92.9Very high4 Ų438.9 Ų38.92%0.02419%0.185CC..Hα-helixtrans-64.9-46.5-179.6177.20000110.8L302 P303 Y309 S310 M466 V467 Y470 L471L302-V306 VanDerWaalsContact O-CG2 3.3Å; L302-V306 WeakPolarHBondContact O-CG2 3.45Å; L302-V306 PolarHBondContact O-N 3.19Å; L302-V306 VanDerWaalsContact O-N 3.12Å; P303-V306 PolarHBondContact O-N 2.95Å; V306-Y309 PolarHBondContact O-N 3.22Å; V306-S310 VanDerWaalsContact O-CB 3.28Å; V306-S310 WeakPolarHBondContact O-CB 3.25Å; V306-S310 PolarHBondContact O-N 3.46Å; V306-M466 HydrophobicContact CG1-CB 4.27Å; V306-V467 HydrophobicContact CG1-CG2 4.18Å; V306-Y470 HydrophobicContact CG2-CD2 4.33Å; V306-Y470 HydrophobicContact CG2-CG 4.37Å; V306-L471 HydrophobicContact CB-CD1 4.33Å; V306-L471 HydrophobicContact CG1-CB 4.37Å; V306-L471 HydrophobicContact CG1-CD1 4.09Å
307L95.6Very high92.9Very high0 Ų030.6 Ų30.60%015%0.154CC..Hα-helixtrans-67.7-36.5176.9-73.6176.5000112.1P303 S310 W311 M410 L414 F415 V427 L471P303-L307 VanDerWaalsContact O-CB 3.29Å; P303-L307 WeakPolarHBondContact O-CB 3.41Å; P303-L307 WeakPolarHBondContact O-CG 3.4Å; P303-L307 PolarHBondContact O-N 2.79Å; L307-S310 WeakPolarHBondContact O-CB 3.21Å; L307-S310 PolarHBondContact O-N 3.47Å; L307-W311 PolarHBondContact O-N 3.05Å; L307-M410 HydrophobicContact CD2-CB 4.28Å; L307-L414 HydrophobicContact CD1-CD1 4.13Å; L307-F415 HydrophobicContact CD1-CE2 3.95Å; L307-F415 HydrophobicContact CD1-CZ 3.75Å; L307-V427 HydrophobicContact CB-CG1 4.29Å; L307-V427 HydrophobicContact CB-CG2 4.07Å; L307-L471 HydrophobicContact CD2-CD2 4.32Å; L307-L471 HydrophobicContact CG-CD1 4.36Å
308S96.5Very high92.7Very high14 Ų1430.7 Ų30.710%0.09816%0.155CC..Hα-helixtrans-60.5-47174.6-64.20000111.3L304 L305 S310 W311 F312 S430L304-S308 WeakPolarHBondContact O-CB 3.42Å; L304-S308 PolarHBondContact O-N 3.29Å; L304-S308 PolarHBondContact O-OG 3.26Å; L305-S308 PolarHBondContact O-N 2.9Å; S308-S310 VanDerWaalsContact C-N 3.32Å; S308-S310 PolarHBondContact O-N 3.42Å; S308-W311 PolarHBondContact O-N 2.99Å; S308-F312 WeakPolarHBondContact O-CB 3.33Å; S308-F312 PolarHBondContact O-N 3.02Å; S308-S430 VanDerWaalsContact CB-OG 3.32Å; S308-S430 WeakPolarHBondContact CB-OG 3.4Å; S308-S430 WeakPolarHBondContact O-CB 3.48Å
309Y97Very high92.3Very high42 Ų4223.9 Ų23.917%0.16513%0.125CC..Hα-helixtrans-64.4-37.9174.5-178.3-99.2000112.2L305 V306 F312 S313 M459 L462 H463 M466L305-Y309 PolarHBondContact O-N 3.31Å; V306-Y309 PolarHBondContact O-N 3.22Å; Y309-F312 PolarHBondContact O-N 3.11Å; Y309-S313 WeakPolarHBondContact O-CB 3.28Å; Y309-S313 PolarHBondContact O-N 3.49Å; Y309-S313 PolarHBondContact O-OG 3.5Å; Y309-M459 WeakPolarHBondContact OH-CA 3.38Å; Y309-M459 PolarHBondContact OH-O 3.41Å; Y309-L462 HydrophobicContact CE1-CB 4.35Å; Y309-L462 HydrophobicContact CE1-CD2 4.39Å; Y309-L462 HydrophobicContact CE1-CG 4.1Å; Y309-L462 HydrophobicContact CE2-CD2 4.07Å; Y309-H463 HydrophobicContact CD1-CB 4.31Å; Y309-H463 HydrophobicContact CE1-CB 3.7Å; Y309-M466 HydrophobicContact CD1-SD 3.57Å; Y309-M466 VanDerWaalsContact CD1-SD 3.57Å; Y309-M466 HydrophobicContact CE1-SD 4.22Å; Y309-M466 HydrophobicContact CG-CE 4.43Å; Y309-M466 HydrophobicContact CG-SD 3.76Å
310S95.8Very high91.4Very high0 Ų019.3 Ų19.30%010%0.097CC..Hα-helixtrans-61.1-45.2176.8-1700000112.3V306 L307 S308 S313 G314 N407 H463V306-S310 VanDerWaalsContact O-CB 3.28Å; V306-S310 WeakPolarHBondContact O-CB 3.25Å; V306-S310 PolarHBondContact O-N 3.46Å; L307-S310 WeakPolarHBondContact O-CB 3.21Å; L307-S310 PolarHBondContact O-N 3.47Å; S308-S310 VanDerWaalsContact C-N 3.32Å; S308-S310 PolarHBondContact O-N 3.42Å; S310-S313 PolarHBondContact O-OG 3.36Å; S310-G314 PolarHBondContact O-N 3.42Å; S310-N407 WeakPolarHBondContact CB-ND2 3.44Å; S310-N407 PolarHBondContact OG-ND2 3.01Å; S310-N407 PolarHBondContact OG-OD1 3.27Å; S310-H463 WeakPolarHBondContact CA-NE2 3.22Å; S310-H463 WeakPolarHBondContact CB-NE2 3.4Å; S310-H463 PolarHBondContact OG-CE1 2.9Å; S310-H463 PolarHBondContact OG-NE2 3.14Å
311W94.4Very high90.1Very high5 Ų520.2 Ų20.22%0.01910%0.102CC..Hα-helixtrans-71.1-34.6175.8-78.955.4000112.7L307 S308 G315 W404 N407 H408 V427 N428L307-W311 PolarHBondContact O-N 3.05Å; S308-W311 PolarHBondContact O-N 2.99Å; W311-G315 WeakPolarHBondContact O-CA 3.46Å; W311-G315 PolarHBondContact O-N 2.95Å; W311-W404 HydrophobicContact CB-CZ3 4.35Å; W311-W404 HydrophobicContact CD2-CE3 4.46Å; W311-W404 AromaticContact CD2-CZ3 3.76Å; W311-W404 HydrophobicContact CD2-CZ3 3.76Å; W311-W404 AromaticContact CE3-CZ3 3.72Å; W311-W404 HydrophobicContact CE3-CZ3 3.72Å; W311-W404 HydrophobicContact CG-CZ3 4.05Å; W311-W404 HydrophobicContact CZ3-CZ3 4.39Å; W311-W404 WeakPolarHBondContact O-CH2 3.13Å; W311-N407 VanDerWaalsContact CD1-ND2 3.34Å; W311-H408 AromaticContact CH2-CE1 3.14Å; W311-H408 WeakPolarHBondContact CH2-CE1 3.36Å; W311-H408 AromaticContact CH2-ND1 3.26Å; W311-H408 VanDerWaalsContact CH2-ND1 3.26Å; W311-H408 WeakPolarHBondContact CH2-ND1 3.06Å; W311-H408 AromaticContact CH2-NE2 3.99Å; W311-H408 AromaticContact CZ2-CE1 3.73Å; W311-H408 AromaticContact CZ2-CG 3.99Å; W311-H408 AromaticContact CZ2-ND1 3.45Å; W311-H408 WeakPolarHBondContact CZ2-ND1 3.46Å; W311-H408 AromaticContact CZ3-CE1 3.88Å; W311-V427 HydrophobicContact CB-CG1 3.98Å; W311-V427 HydrophobicContact CD2-CG1 3.33Å; W311-V427 HydrophobicContact CE3-CG1 3.98Å; W311-V427 HydrophobicContact CG-CG1 3.31Å; W311-V427 HydrophobicContact CZ2-CG1 4.03Å; W311-V427 VanDerWaalsContact NE1-CG1 3.31Å; W311-N428 HydrophobicContact CZ3-CB 4.07Å; W311-N428 WeakPolarHBondContact CZ3-OD1 3.49Å
312F95.2Very high88.5Confident54 Ų5419.5 Ų19.524%0.23710%0.096CC..Hα-helixtrans-65.4-55.8174.7-179.3-96.8000111.1S308 Y309 G315 V316 S430 L433 A434 V437 M459S308-F312 WeakPolarHBondContact O-CB 3.33Å; S308-F312 PolarHBondContact O-N 3.02Å; Y309-F312 PolarHBondContact O-N 3.11Å; F312-G315 CarbonylContact O-C 3.56Å; F312-G315 WeakPolarHBondContact O-CA 3.35Å; F312-G315 PolarHBondContact O-N 3.29Å; F312-G315 VanDerWaalsContact O-N 3.12Å; F312-V316 HydrophobicContact CD1-CG2 4.4Å; F312-V316 HydrophobicContact CE1-CG2 4.03Å; F312-V316 HydrophobicContact CE2-CG2 4.43Å; F312-V316 HydrophobicContact CZ-CG2 4.04Å; F312-V316 WeakPolarHBondContact O-CG2 3.37Å; F312-V316 PolarHBondContact O-N 3.21Å; F312-S430 WeakPolarHBondContact CD2-O 3.22Å; F312-L433 HydrophobicContact CD2-CB 4.33Å; F312-L433 HydrophobicContact CE2-CB 4.24Å; F312-A434 HydrophobicContact CD2-CB 3.76Å; F312-A434 HydrophobicContact CE2-CB 4.11Å; F312-A434 HydrophobicContact CG-CB 4.23Å; F312-A434 WeakPolarHBondContact O-CB 3.38Å; F312-V437 HydrophobicContact CE2-CG2 4.28Å; F312-V437 HydrophobicContact CZ-CB 4.47Å; F312-V437 HydrophobicContact CZ-CG1 4.48Å; F312-V437 HydrophobicContact CZ-CG2 4.2Å; F312-M459 HydrophobicContact CD1-CE 3.6Å; F312-M459 HydrophobicContact CE1-CE 3.47Å; F312-M459 VanDerWaalsContact CE1-CE 3.47Å
313S94.6Very high86.7Confident0 Ų021.9 Ų21.90%010%0.104CC..Hα-helixtrans-62.4-46.4-179.657.60000112.5Y309 S310 G315 V316 I317 H463Y309-S313 WeakPolarHBondContact O-CB 3.28Å; Y309-S313 PolarHBondContact O-N 3.49Å; Y309-S313 PolarHBondContact O-OG 3.5Å; S310-S313 PolarHBondContact O-OG 3.36Å; S313-G315 VanDerWaalsContact C-N 3.25Å; S313-G315 PolarHBondContact O-N 3.02Å; S313-V316 PolarHBondContact O-N 3.03Å; S313-I317 WeakPolarHBondContact O-CD1 3.48Å; S313-I317 VanDerWaalsContact O-CG1 3.3Å; S313-I317 WeakPolarHBondContact O-CG1 3.26Å; S313-I317 PolarHBondContact O-N 2.93Å; S313-I317 VanDerWaalsContact O-N 3.14Å; S313-H463 PolarHBondContact OG-ND1 2.87Å; S313-H463 VanDerWaalsContact OG-ND1 3.08Å
314G92.7Very high84.8Confident0 Ų027 Ų270%013%0.131CC..Hα-helixtrans-59.9-37.1172.900000112.2S310 S318 W404S310-G314 PolarHBondContact O-N 3.42Å; G314-S318 WeakPolarHBondContact O-CB 3.27Å; G314-S318 PolarHBondContact O-N 2.79Å; G314-S318 PolarHBondContact O-OG 3.43Å; G314-W404 VanDerWaalsContact C-CZ2 3.49Å
315G91.4Very high82.6Confident0 Ų029.5 Ų29.50%014%0.144CC..Hα-helixtrans-61.1-50.2173.800000112.9W311 F312 S313 I317 S318 F319W311-G315 WeakPolarHBondContact O-CA 3.46Å; W311-G315 PolarHBondContact O-N 2.95Å; F312-G315 CarbonylContact O-C 3.56Å; F312-G315 WeakPolarHBondContact O-CA 3.35Å; F312-G315 PolarHBondContact O-N 3.29Å; F312-G315 VanDerWaalsContact O-N 3.12Å; S313-G315 VanDerWaalsContact C-N 3.25Å; S313-G315 PolarHBondContact O-N 3.02Å; G315-I317 VanDerWaalsContact C-N 3.33Å; G315-I317 PolarHBondContact O-N 2.64Å; G315-S318 PolarHBondContact O-N 3.26Å; G315-F319 WeakPolarHBondContact O-CB 3.35Å; G315-F319 WeakPolarHBondContact O-CD2 3.4Å; G315-F319 WeakPolarHBondContact O-CG 3.1Å; G315-F319 PolarHBondContact O-N 3.03Å
316V90.7Very high80.3Confident0 Ų027.6 Ų27.60%015%0.149CC..Hα-helixtrans-61.2-46-177.5169.90000110F312 S313 G320 A434 V437 V441 Y456 M459F312-V316 HydrophobicContact CD1-CG2 4.4Å; F312-V316 HydrophobicContact CE1-CG2 4.03Å; F312-V316 HydrophobicContact CE2-CG2 4.43Å; F312-V316 HydrophobicContact CZ-CG2 4.04Å; F312-V316 WeakPolarHBondContact O-CG2 3.37Å; F312-V316 PolarHBondContact O-N 3.21Å; S313-V316 PolarHBondContact O-N 3.03Å; V316-G320 WeakPolarHBondContact O-CA 3.31Å; V316-G320 PolarHBondContact O-N 3.26Å; V316-A434 HydrophobicContact CG2-CB 3.65Å; V316-V437 HydrophobicContact CG2-CB 4.28Å; V316-V437 HydrophobicContact CG2-CG1 4.19Å; V316-V441 HydrophobicContact CG1-CB 4.43Å; V316-V441 HydrophobicContact CG1-CG2 4.12Å; V316-Y456 HydrophobicContact CG1-CD1 4.19Å; V316-Y456 HydrophobicContact CG1-CE1 3.81Å; V316-M459 HydrophobicContact CB-CE 4.27Å; V316-M459 HydrophobicContact CB-SD 4.3Å; V316-M459 HydrophobicContact CG1-SD 4.06Å; V316-M459 HydrophobicContact CG2-CE 4.15Å
317I89.2Confident78.2Confident3 Ų330.9 Ų30.92%0.01518%0.184CC..Hα-helixtrans-67-46.9-179.9-61.3164.8000110.9S313 G315 I321 T370 Y456 T460S313-I317 WeakPolarHBondContact O-CD1 3.48Å; S313-I317 VanDerWaalsContact O-CG1 3.3Å; S313-I317 WeakPolarHBondContact O-CG1 3.26Å; S313-I317 PolarHBondContact O-N 2.93Å; S313-I317 VanDerWaalsContact O-N 3.14Å; G315-I317 VanDerWaalsContact C-N 3.33Å; G315-I317 PolarHBondContact O-N 2.64Å; I317-I321 HydrophobicContact CG2-CD1 4.21Å; I317-I321 WeakPolarHBondContact O-CG1 3.38Å; I317-I321 PolarHBondContact O-N 3.32Å; I317-T370 HydrophobicContact CD1-CG2 4.3Å; I317-T370 HydrophobicContact CG2-CG2 4.08Å; I317-Y456 HydrophobicContact CG1-CD1 3.84Å; I317-Y456 HydrophobicContact CG1-CG 4Å; I317-T460 HydrophobicContact CD1-CG2 3.5Å
318S84Confident76.3Confident4 Ų436.3 Ų36.33%0.02821%0.21CC..Hα-helixtrans-61.3-60.9-179.9-63.50000110G314 G315 G320 I321 Y322 I400 W404G314-S318 WeakPolarHBondContact O-CB 3.27Å; G314-S318 PolarHBondContact O-N 2.79Å; G314-S318 PolarHBondContact O-OG 3.43Å; G315-S318 PolarHBondContact O-N 3.26Å; S318-G320 VanDerWaalsContact C-N 3.34Å; S318-G320 PolarHBondContact O-N 2.85Å; S318-I321 PolarHBondContact O-N 3.39Å; S318-Y322 WeakPolarHBondContact O-CD2 3.37Å; S318-Y322 WeakPolarHBondContact O-CE2 3.38Å; S318-Y322 PolarHBondContact O-N 3.47Å; S318-Y322 VanDerWaalsContact O-N 3.13Å; S318-I400 VanDerWaalsContact OG-CG2 3.3Å; S318-I400 WeakPolarHBondContact OG-CG2 3.47Å; S318-W404 PolarHBondContact OG-NE1 3.43Å
319F76.4Confident74.5Confident33 Ų3340.6 Ų40.615%0.14525%0.247CC..Hα-helixtrans-64.5-37.8-175-65.7-54.7000112.4G315 I321 Y322 F323 A438G315-F319 WeakPolarHBondContact O-CB 3.35Å; G315-F319 WeakPolarHBondContact O-CD2 3.4Å; G315-F319 WeakPolarHBondContact O-CG 3.1Å; G315-F319 PolarHBondContact O-N 3.03Å; F319-I321 VanDerWaalsContact C-N 3.32Å; F319-I321 PolarHBondContact O-N 3.21Å; F319-Y322 PolarHBondContact O-N 2.97Å; F319-F323 HydrophobicContact CB-CD2 4.45Å; F319-F323 HydrophobicContact CB-CE2 4.2Å; F319-F323 WeakPolarHBondContact O-CD2 3.37Å; F319-F323 PolarHBondContact O-N 3.28Å; F319-A438 HydrophobicContact CB-CB 3.53Å
320G68.6Low73.4Confident2 Ų241.1 Ų41.12%0.02127%0.265CS..Hα-helixtrans-59.1-42.6-178.400000112.6V316 S318V316-G320 WeakPolarHBondContact O-CA 3.31Å; V316-G320 PolarHBondContact O-N 3.26Å; S318-G320 VanDerWaalsContact C-N 3.34Å; S318-G320 PolarHBondContact O-N 2.85Å
321I61.5Low72.8Confident22 Ų2242.9 Ų42.911%0.11328%0.277CS..Hα-helixtrans-81.5-29.2179.6-48.9168000111.4I317 S318 F319 F323 D324 L325 I397 Y456I317-I321 HydrophobicContact CG2-CD1 4.21Å; I317-I321 WeakPolarHBondContact O-CG1 3.38Å; I317-I321 PolarHBondContact O-N 3.32Å; S318-I321 PolarHBondContact O-N 3.39Å; F319-I321 VanDerWaalsContact C-N 3.32Å; F319-I321 PolarHBondContact O-N 3.21Å; I321-F323 PolarHBondContact O-N 3.14Å; I321-D324 WeakPolarHBondContact O-CB 3.5Å; I321-D324 PolarHBondContact O-N 3.36Å; I321-L325 PolarHBondContact O-N 3.09Å; I321-I397 HydrophobicContact CB-CD1 3.77Å; I321-I397 HydrophobicContact CB-CG1 3.92Å; I321-I397 HydrophobicContact CD1-CD1 4.28Å; I321-I397 HydrophobicContact CD1-CG1 3.63Å; I321-I397 HydrophobicContact CG1-CG1 4.38Å; I321-I397 HydrophobicContact CG2-CD1 3.21Å; I321-I397 HydrophobicContact CG2-CG1 3.83Å; I321-Y456 HydrophobicContact CG1-CE2 4.21Å
322Y61.3Low72.4Confident30 Ų3044 Ų4412%0.11828%0.283CS..Hα-helixtrans-65.7-35.4174.9-74.5-57.4000113.3S318 F319 D324 L325 M339 K343 I397S318-Y322 WeakPolarHBondContact O-CD2 3.37Å; S318-Y322 WeakPolarHBondContact O-CE2 3.38Å; S318-Y322 PolarHBondContact O-N 3.47Å; S318-Y322 VanDerWaalsContact O-N 3.13Å; F319-Y322 PolarHBondContact O-N 2.97Å; Y322-D324 PolarHBondContact O-N 3.2Å; Y322-L325 HydrophobicContact CD1-CD1 3.86Å; Y322-L325 HydrophobicContact CE1-CD1 4.38Å; Y322-L325 WeakPolarHBondContact O-CB 3.48Å; Y322-L325 PolarHBondContact O-N 2.86Å; Y322-M339 HydrophobicContact CD1-CG 4Å; Y322-M339 HydrophobicContact CD1-SD 3.6Å; Y322-M339 VanDerWaalsContact CD1-SD 3.6Å; Y322-M339 HydrophobicContact CE1-CG 3.57Å; Y322-M339 HydrophobicContact CE1-SD 3.74Å; Y322-M339 HydrophobicContact CG-SD 4.17Å; Y322-K343 PolarHBondContact OH-NZ 2.85Å; Y322-I397 HydrophobicContact CE1-CG2 4.19Å; Y322-I397 HydrophobicContact CE2-CG2 4.42Å; Y322-I397 WeakPolarHBondContact OH-CG2 3.46Å
323F54.2Low72.2Confident122 Ų12241.7 Ų41.754%0.53527%0.273SS..Hα-helixtrans-66.8-29175.6-77.7-65000112.4F319 I321 G326 P439F319-F323 HydrophobicContact CB-CD2 4.45Å; F319-F323 HydrophobicContact CB-CE2 4.2Å; F319-F323 WeakPolarHBondContact O-CD2 3.37Å; F319-F323 PolarHBondContact O-N 3.28Å; I321-F323 PolarHBondContact O-N 3.14Å; F323-G326 PolarHBondContact O-N 3.39Å; F323-P439 HydrophobicContact CD2-CG 3.84Å; F323-P439 HydrophobicContact CE2-CG 3.7Å; F323-P439 HydrophobicContact CZ-CG 4.36Å
324D53.4Low71.9Confident121 Ų12146.6 Ų46.665%0.64730%0.299SS*.Hα-helixtrans-71.1-31.7177.5-149.931.1000112.2I321 Y322 G326 G327I321-D324 WeakPolarHBondContact O-CB 3.5Å; I321-D324 PolarHBondContact O-N 3.36Å; Y322-D324 PolarHBondContact O-N 3.2Å; D324-G326 PolarHBondContact O-N 2.84Å; D324-G326 VanDerWaalsContact O-N 3.16Å; D324-G327 PolarHBondContact O-N 3.3Å; D324-G327 VanDerWaalsContact O-N 3.07Å
325L50.3Low71.6Confident61 Ų6149.4 Ų49.432%0.31931%0.311SS..Hα-helixtrans-61.3-22.8171.6-67.4173.4000113.2I321 Y322 G327 M328I321-L325 PolarHBondContact O-N 3.09Å; Y322-L325 HydrophobicContact CD1-CD1 3.86Å; Y322-L325 HydrophobicContact CE1-CD1 4.38Å; Y322-L325 WeakPolarHBondContact O-CB 3.48Å; Y322-L325 PolarHBondContact O-N 2.86Å; L325-G327 PolarHBondContact O-N 3.47Å; L325-M328 HydrophobicContact CD2-CG 4.44Å; L325-M328 HydrophobicContact CD2-SD 3.33Å; L325-M328 WeakPolarHBondContact CD2-SD 3.4Å; L325-M328 WeakPolarHBondContact O-CB 3.49Å; L325-M328 PolarHBondContact O-N 2.94Å; L325-M328 VanDerWaalsContact O-N 3.13Å
326G48.2Very low71.4Confident62 Ų6250 Ų5064%0.63932%0.315SS*.THydrogen-bonded Turntrans-59.1-29.5174.400000112.9F323 D324F323-G326 PolarHBondContact O-N 3.39Å; D324-G326 PolarHBondContact O-N 2.84Å; D324-G326 VanDerWaalsContact O-N 3.16Å
327G50.9Low71.5Confident74 Ų7453.7 Ų53.776%0.76333%0.331SS*.THydrogen-bonded Turntrans-81.8-11.8177.400000115D324 L325D324-G327 PolarHBondContact O-N 3.3Å; D324-G327 VanDerWaalsContact O-N 3.07Å; L325-G327 PolarHBondContact O-N 3.47Å
328M56.1Low71.5Confident113 Ų11357.8 Ų57.856%0.55735%0.352SS*.SBendtrans-70.9140.1179.1-69.3-174.267.200111.3L325 K335L325-M328 HydrophobicContact CD2-CG 4.44Å; L325-M328 HydrophobicContact CD2-SD 3.33Å; L325-M328 WeakPolarHBondContact CD2-SD 3.4Å; L325-M328 WeakPolarHBondContact O-CB 3.49Å; L325-M328 PolarHBondContact O-N 2.94Å; L325-M328 VanDerWaalsContact O-N 3.13Å; M328-K335 PolarHBondContact O-NZ 3.29Å
329A58.5Low71.5Confident105 Ų10559.5 Ų59.587%0.86836%0.36SS*.SBendtrans-60.6147.7174.800000112
330G73.6Confident72.1Confident52 Ų5258 Ų5854%0.53635%0.354SS..SBendtrans115.9170.9177.100000114I332 K335G330-I332 PolarHBondContact O-N 2.93Å; G330-K335 WeakPolarHBondContact O-CE 3.25Å; G330-K335 PolarHBondContact O-NZ 3.43Å
331S84.6Confident73.2Confident37 Ų3761.5 Ų61.526%0.25937%0.372SS..  trans-63.7131.7-174.5179.20000112.4F333 L334 K335S331-F333 VanDerWaalsContact C-N 3.26Å; S331-F333 PolarHBondContact O-N 3.16Å; S331-F333 VanDerWaalsContact OG-CD2 3.25Å; S331-F333 WeakPolarHBondContact OG-CD2 3.35Å; S331-F333 PolarHBondContact OG-N 3.09Å; S331-L334 PolarHBondContact O-N 3.48Å; S331-K335 VanDerWaalsContact O-CE 3.28Å; S331-K335 WeakPolarHBondContact O-CE 3.35Å; S331-K335 PolarHBondContact O-N 3.05Å
332I85.2Confident74.5Confident28 Ų2864 Ų6414%0.14438%0.382CS..Hα-helixtrans-59.8-37.6176-169.7165.1000112.1V44 F45 L48 E84 G330 L334 K335 T336V44-I332 HydrophobicContact CG1-CD1 3.85Å; V44-I332 HydrophobicContact CG1-CG1 4.33Å; F45-I332 HydrophobicContact CD1-CG2 4.42Å; F45-I332 HydrophobicContact CE1-CG1 4.32Å; F45-I332 HydrophobicContact CE1-CG2 4.21Å; L48-I332 HydrophobicContact CD1-CD1 3.7Å; L48-I332 HydrophobicContact CD2-CG2 4.17Å; E84-I332 PolarHBondContact OE2-N 3.28Å; G330-I332 PolarHBondContact O-N 2.93Å; I332-L334 PolarHBondContact O-N 3.14Å; I332-K335 PolarHBondContact O-N 3.22Å; I332-T336 PolarHBondContact O-N 3.26Å; I332-T336 PolarHBondContact O-OG1 2.97Å
333F90.7Very high75.7Confident7 Ų763.8 Ų63.83%0.03138%0.381CS..Hα-helixtrans-60.7-46.9179.8-48.8-67000111.7F45 E84 F85 A208 Y209 R212 S331 T336 F337F45-F333 HydrophobicContact CD1-CD1 4.4Å; F45-F333 HydrophobicContact CD1-CE1 4.11Å; F45-F333 AromaticContact CE1-CD1 3.75Å; F45-F333 HydrophobicContact CE1-CD1 3.75Å; F45-F333 AromaticContact CE1-CE1 3.93Å; F45-F333 HydrophobicContact CE1-CE1 3.93Å; F45-F333 HydrophobicContact CZ-CD1 4.3Å; E84-F333 HydrophobicContact CB-CE2 4.35Å; F85-F333 HydrophobicContact CB-CZ 4.06Å; F85-F333 AromaticContact CD2-CE1 3.86Å; F85-F333 HydrophobicContact CD2-CE1 3.86Å; F85-F333 AromaticContact CD2-CZ 3.9Å; F85-F333 HydrophobicContact CD2-CZ 3.9Å; F85-F333 HydrophobicContact CG-CZ 4.44Å; A208-F333 HydrophobicContact CB-CD1 3.85Å; A208-F333 HydrophobicContact CB-CE1 3.73Å; Y209-F333 HydrophobicContact CD2-CB 4.29Å; Y209-F333 AromaticContact CD2-CD2 3.87Å; Y209-F333 HydrophobicContact CD2-CD2 3.87Å; Y209-F333 HydrophobicContact CD2-CG 4.14Å; R212-F333 VanDerWaalsContact NH1-CE2 3.31Å; S331-F333 VanDerWaalsContact C-N 3.26Å; S331-F333 PolarHBondContact O-N 3.16Å; S331-F333 VanDerWaalsContact OG-CD2 3.25Å; S331-F333 WeakPolarHBondContact OG-CD2 3.35Å; S331-F333 PolarHBondContact OG-N 3.09Å; F333-T336 PolarHBondContact O-N 3.33Å; F333-F337 WeakPolarHBondContact O-CB 3.26Å; F333-F337 PolarHBondContact O-N 2.94Å
334L89.5Confident77.4Confident102 Ų10259.3 Ų59.353%0.53437%0.37SS..Hα-helixtrans-64.6-42.7179.3-177.961.4000110.9S331 I332 F337 L338S331-L334 PolarHBondContact O-N 3.48Å; I332-L334 PolarHBondContact O-N 3.14Å; L334-F337 PolarHBondContact O-N 2.79Å; L334-L338 HydrophobicContact CD1-CD1 4.1Å; L334-L338 HydrophobicContact CD1-CG 4.03Å; L334-L338 HydrophobicContact CG-CD1 3.91Å; L334-L338 HydrophobicContact CG-CG 4.26Å; L334-L338 WeakPolarHBondContact O-CB 3.34Å; L334-L338 VanDerWaalsContact O-CG 3.26Å; L334-L338 WeakPolarHBondContact O-CG 3.36Å; L334-L338 PolarHBondContact O-N 3.38Å
335K85.6Confident79.2Confident59 Ų5957.2 Ų57.226%0.25736%0.362SS..Hα-helixtrans-60.4-46.4176.6-77.7178.2-83.8178.50111.9M328 G330 S331 I332 F337 L338 M339M328-K335 PolarHBondContact O-NZ 3.29Å; G330-K335 WeakPolarHBondContact O-CE 3.25Å; G330-K335 PolarHBondContact O-NZ 3.43Å; S331-K335 VanDerWaalsContact O-CE 3.28Å; S331-K335 WeakPolarHBondContact O-CE 3.35Å; S331-K335 PolarHBondContact O-N 3.05Å; I332-K335 PolarHBondContact O-N 3.22Å; K335-F337 VanDerWaalsContact C-N 3.35Å; K335-F337 PolarHBondContact O-N 3.34Å; K335-L338 PolarHBondContact O-N 3.43Å; K335-M339 WeakPolarHBondContact O-CB 3.25Å; K335-M339 PolarHBondContact O-N 3.17Å
336T87.9Confident81Confident13 Ų1354.9 Ų54.98%0.0835%0.35CS..Hα-helixtrans-64.4-39.7177.5-53.30000111.7F45 A205 I332 F333 M339 G340F45-T336 HydrophobicContact CZ-CG2 4.41Å; A205-T336 HydrophobicContact CB-CG2 3.91Å; I332-T336 PolarHBondContact O-N 3.26Å; I332-T336 PolarHBondContact O-OG1 2.97Å; F333-T336 PolarHBondContact O-N 3.33Å; T336-M339 HydrophobicContact CG2-CE 4.27Å; T336-M339 PolarHBondContact O-N 3.27Å; T336-G340 PolarHBondContact O-N 3.31Å; T336-G340 VanDerWaalsContact O-N 3.1Å
337F92Very high83Confident78 Ų7852 Ų5234%0.34232%0.319SS..Hα-helixtrans-64.6-49.3176.2-174.4-86.7000111.9M202 A205 F333 L334 K335 M339 G340 L341M202-F337 HydrophobicContact CB-CD2 3.76Å; M202-F337 HydrophobicContact CB-CE2 3.67Å; M202-F337 HydrophobicContact CB-CZ 4.42Å; M202-F337 HydrophobicContact CG-CD2 3.97Å; M202-F337 HydrophobicContact CG-CE2 3.94Å; M202-F337 HydrophobicContact CG-CG 4.35Å; M202-F337 HydrophobicContact CG-CZ 4.28Å; M202-F337 HydrophobicContact SD-CE1 4.44Å; M202-F337 HydrophobicContact SD-CE2 4.27Å; M202-F337 HydrophobicContact SD-CZ 4.07Å; A205-F337 HydrophobicContact CB-CB 4.02Å; F333-F337 WeakPolarHBondContact O-CB 3.26Å; F333-F337 PolarHBondContact O-N 2.94Å; L334-F337 PolarHBondContact O-N 2.79Å; K335-F337 VanDerWaalsContact C-N 3.35Å; K335-F337 PolarHBondContact O-N 3.34Å; F337-M339 VanDerWaalsContact C-N 3.28Å; F337-M339 PolarHBondContact O-N 2.85Å; F337-G340 PolarHBondContact O-N 2.92Å; F337-G340 VanDerWaalsContact O-N 3.07Å; F337-L341 PolarHBondContact O-N 3.44Å
338L89Confident84.9Confident89 Ų8952.5 Ų52.547%0.46630%0.301SS..Hα-helixtrans-62.4-35.4178.7-70.8176.8000112L334 K335 L341 F342L334-L338 HydrophobicContact CD1-CD1 4.1Å; L334-L338 HydrophobicContact CD1-CG 4.03Å; L334-L338 HydrophobicContact CG-CD1 3.91Å; L334-L338 HydrophobicContact CG-CG 4.26Å; L334-L338 WeakPolarHBondContact O-CB 3.34Å; L334-L338 VanDerWaalsContact O-CG 3.26Å; L334-L338 WeakPolarHBondContact O-CG 3.36Å; L334-L338 PolarHBondContact O-N 3.38Å; K335-L338 PolarHBondContact O-N 3.43Å; L338-L341 HydrophobicContact CD2-CD2 4.46Å; L338-L341 PolarHBondContact O-N 3.39Å; L338-F342 VanDerWaalsContact O-CB 3.3Å; L338-F342 WeakPolarHBondContact O-CB 3.3Å; L338-F342 PolarHBondContact O-N 3.44Å
339M83.7Confident86.6Confident40 Ų4051 Ų5120%0.19729%0.294CS..Hα-helixtrans-60.6-47.1171.4176.7-171.367.600111.4C201 Y322 K335 T336 F337 L341 F342 K343C201-M339 HydrophobicContact CB-CE 4.35Å; Y322-M339 HydrophobicContact CD1-CG 4Å; Y322-M339 HydrophobicContact CD1-SD 3.6Å; Y322-M339 VanDerWaalsContact CD1-SD 3.6Å; Y322-M339 HydrophobicContact CE1-CG 3.57Å; Y322-M339 HydrophobicContact CE1-SD 3.74Å; Y322-M339 HydrophobicContact CG-SD 4.17Å; K335-M339 WeakPolarHBondContact O-CB 3.25Å; K335-M339 PolarHBondContact O-N 3.17Å; T336-M339 HydrophobicContact CG2-CE 4.27Å; T336-M339 PolarHBondContact O-N 3.27Å; F337-M339 VanDerWaalsContact C-N 3.28Å; F337-M339 PolarHBondContact O-N 2.85Å; M339-L341 VanDerWaalsContact C-N 3.33Å; M339-L341 PolarHBondContact O-N 2.93Å; M339-F342 PolarHBondContact O-N 3.07Å; M339-K343 WeakPolarHBondContact O-CB 3.43Å; M339-K343 WeakPolarHBondContact O-CG 3.31Å; M339-K343 PolarHBondContact O-N 3.48Å
340G89.8Confident88.2Confident0 Ų046 Ų460%025%0.253CS..Hα-helixtrans-60.5-43.2176.200000111.9P198 T336 F337 G344P198-G340 VanDerWaalsContact CB-O 3.28Å; P198-G340 WeakPolarHBondContact CB-O 3.38Å; T336-G340 PolarHBondContact O-N 3.31Å; T336-G340 VanDerWaalsContact O-N 3.1Å; F337-G340 PolarHBondContact O-N 2.92Å; F337-G340 VanDerWaalsContact O-N 3.07Å; G340-G344 PolarHBondContact O-N 3.35Å
341L91.3Very high89.1Confident77 Ų7745.2 Ų45.240%0.40323%0.234SC..Hα-helixtrans-62.6-48.6177.4-178.661000111.8M202 F337 L338 M339 K343 G344 T345M202-L341 HydrophobicContact SD-CB 4.01Å; M202-L341 HydrophobicContact SD-CD1 4.29Å; F337-L341 PolarHBondContact O-N 3.44Å; L338-L341 HydrophobicContact CD2-CD2 4.46Å; L338-L341 PolarHBondContact O-N 3.39Å; M339-L341 VanDerWaalsContact C-N 3.33Å; M339-L341 PolarHBondContact O-N 2.93Å; L341-K343 PolarHBondContact O-N 3.36Å; L341-G344 WeakPolarHBondContact O-CA 3.41Å; L341-G344 PolarHBondContact O-N 2.95Å; L341-G344 VanDerWaalsContact O-N 3.09Å; L341-T345 HydrophobicContact CD1-CG2 4.34Å; L341-T345 WeakPolarHBondContact O-CG2 3.31Å; L341-T345 PolarHBondContact O-N 3.48Å; L341-T345 PolarHBondContact O-OG1 3.01Å
342F87.8Confident89.5Confident75 Ų7546.9 Ų46.933%0.32924%0.244SC..Hα-helixtrans-59.7-47.4179.3-173.3-103.6000111.4L338 M339 G344 T345 T346 I397 G398L338-F342 VanDerWaalsContact O-CB 3.3Å; L338-F342 WeakPolarHBondContact O-CB 3.3Å; L338-F342 PolarHBondContact O-N 3.44Å; M339-F342 PolarHBondContact O-N 3.07Å; F342-G344 PolarHBondContact O-N 3.44Å; F342-T345 PolarHBondContact O-N 2.94Å; F342-T345 PolarHBondContact O-OG1 2.91Å; F342-T346 HydrophobicContact CD1-CG2 4.12Å; F342-T346 HydrophobicContact CD2-CG2 4.19Å; F342-T346 HydrophobicContact CE1-CG2 3.85Å; F342-T346 HydrophobicContact CE2-CG2 3.9Å; F342-T346 HydrophobicContact CG-CG2 4.31Å; F342-T346 HydrophobicContact CZ-CG2 3.74Å; F342-T346 WeakPolarHBondContact O-CG2 3.42Å; F342-T346 PolarHBondContact O-N 3.1Å; F342-T346 PolarHBondContact O-OG1 2.93Å; F342-I397 HydrophobicContact CE1-CG2 4.27Å; F342-G398 VanDerWaalsContact CE1-CA 3.4Å; F342-G398 VanDerWaalsContact CZ-CA 3.41Å
343K87.8Confident89.8Confident24 Ų2449 Ų4910%0.10426%0.255CS..Hα-helixtrans-58.4-35.5173.9-79-173.2144.582.20113.4P198 Y322 M339 L341 G347 D401P198-K343 HydrophobicContact CB-CB 3.99Å; P198-K343 HydrophobicContact CG-CB 4.07Å; Y322-K343 PolarHBondContact OH-NZ 2.85Å; M339-K343 WeakPolarHBondContact O-CB 3.43Å; M339-K343 WeakPolarHBondContact O-CG 3.31Å; M339-K343 PolarHBondContact O-N 3.48Å; L341-K343 PolarHBondContact O-N 3.36Å; K343-G347 WeakPolarHBondContact O-CA 3.42Å; K343-G347 PolarHBondContact O-N 2.99Å; K343-D401 WeakPolarHBondContact CA-OD2 3.07Å; K343-D401 WeakPolarHBondContact CG-OD2 3.36Å
344G89.4Confident89.8Confident28 Ų2848.9 Ų48.929%0.28926%0.255SS..Hα-helixtrans-66.6-47.6177.200000111.6G340 L341 F342 F348G340-G344 PolarHBondContact O-N 3.35Å; L341-G344 WeakPolarHBondContact O-CA 3.41Å; L341-G344 PolarHBondContact O-N 2.95Å; L341-G344 VanDerWaalsContact O-N 3.09Å; F342-G344 PolarHBondContact O-N 3.44Å; G344-F348 PolarHBondContact O-N 2.85Å
345T91Very high89.6Confident78 Ų7848.9 Ų48.948%0.47925%0.251SS..Hα-helixtrans-72.3-49.9-176.556.40000112.1L341 F342 G347 F348L341-T345 HydrophobicContact CD1-CG2 4.34Å; L341-T345 WeakPolarHBondContact O-CG2 3.31Å; L341-T345 PolarHBondContact O-N 3.48Å; L341-T345 PolarHBondContact O-OG1 3.01Å; F342-T345 PolarHBondContact O-N 2.94Å; F342-T345 PolarHBondContact O-OG1 2.91Å; T345-G347 VanDerWaalsContact C-N 3.28Å; T345-G347 PolarHBondContact O-N 2.94Å; T345-F348 PolarHBondContact O-N 3.39Å; T345-F348 VanDerWaalsContact O-N 3.12Å
346T89.5Confident89.7Confident12 Ų1251.4 Ų51.47%0.07427%0.271CS..Hα-helixtrans-63.2-38.4176.258.80000110.9F342 F348 I349 D401F342-T346 HydrophobicContact CD1-CG2 4.12Å; F342-T346 HydrophobicContact CD2-CG2 4.19Å; F342-T346 HydrophobicContact CE1-CG2 3.85Å; F342-T346 HydrophobicContact CE2-CG2 3.9Å; F342-T346 HydrophobicContact CG-CG2 4.31Å; F342-T346 HydrophobicContact CZ-CG2 3.74Å; F342-T346 WeakPolarHBondContact O-CG2 3.42Å; F342-T346 PolarHBondContact O-N 3.1Å; F342-T346 PolarHBondContact O-OG1 2.93Å; T346-F348 PolarHBondContact O-N 3.13Å; T346-I349 VanDerWaalsContact O-CB 3.31Å; T346-I349 WeakPolarHBondContact O-CB 3.47Å; T346-I349 WeakPolarHBondContact O-CG1 3.39Å; T346-I349 PolarHBondContact O-N 3.1Å; T346-D401 WeakPolarHBondContact OG1-CB 3.48Å; T346-D401 PolarHBondContact OG1-OD2 3.29Å
347G88.3Confident89.8Confident0 Ų055 Ų550%029%0.289CS..THydrogen-bonded Turntrans-66.6-12.8175.900000115K343 T345 P350 K405K343-G347 WeakPolarHBondContact O-CA 3.42Å; K343-G347 PolarHBondContact O-N 2.99Å; T345-G347 VanDerWaalsContact C-N 3.28Å; T345-G347 PolarHBondContact O-N 2.94Å; G347-P350 WeakPolarHBondContact O-CD 3.24Å; G347-K405 WeakPolarHBondContact O-CG 3.45Å
348F91.4Very high89.7Confident86 Ų8651.3 Ų51.338%0.37727%0.274SS..THydrogen-bonded Turntrans-89.3-18.6175.2-158.2-101.8000112.9L190 C193 L194 G344 T345 T346 P350 Y351 P352L190-F348 HydrophobicContact CD1-CE2 4.05Å; L190-F348 HydrophobicContact CD1-CZ 4.25Å; C193-F348 HydrophobicContact CB-CD2 4.09Å; L194-F348 HydrophobicContact CD2-CE2 4.19Å; G344-F348 PolarHBondContact O-N 2.85Å; T345-F348 PolarHBondContact O-N 3.39Å; T345-F348 VanDerWaalsContact O-N 3.12Å; T346-F348 PolarHBondContact O-N 3.13Å; F348-P350 VanDerWaalsContact C-CD 3.44Å; F348-P350 VanDerWaalsContact C-N 3.34Å; F348-Y351 AromaticContact CE1-CD1 3.86Å; F348-Y351 HydrophobicContact CE1-CD1 3.86Å; F348-Y351 HydrophobicContact CE2-CD1 4.38Å; F348-Y351 AromaticContact CZ-CD1 3.65Å; F348-Y351 HydrophobicContact CZ-CD1 3.65Å; F348-Y351 HydrophobicContact CZ-CE1 4.27Å; F348-Y351 HydrophobicContact CZ-CG 4.42Å; F348-Y351 WeakPolarHBondContact O-CB 3.48Å; F348-Y351 PolarHBondContact O-N 3.06Å; F348-Y351 VanDerWaalsContact O-N 3.07Å; F348-P352 VanDerWaalsContact O-CD 3.32Å; F348-P352 WeakPolarHBondContact O-CD 3.39Å
349I92.1Very high89.8Confident80 Ų8047.5 Ų47.541%0.4125%0.253SS..THydrogen-bonded Turntrans-52.7-41.5179.7-63.2171.5000113.1T346 Y351 P352 L353 P402T346-I349 VanDerWaalsContact O-CB 3.31Å; T346-I349 WeakPolarHBondContact O-CB 3.47Å; T346-I349 WeakPolarHBondContact O-CG1 3.39Å; T346-I349 PolarHBondContact O-N 3.1Å; I349-Y351 PolarHBondContact O-N 2.99Å; I349-P352 VanDerWaalsContact O-CD 3.27Å; I349-P352 WeakPolarHBondContact O-CD 3.45Å; I349-P352 WeakPolarHBondContact O-CG 3.29Å; I349-L353 HydrophobicContact CG2-CD1 3.61Å; I349-L353 HydrophobicContact CG2-CG 4.43Å; I349-P402 HydrophobicContact CB-CG 4.43Å; I349-P402 HydrophobicContact CD1-CG 4.49Å
350P92.4Very high90.3Very high0 Ų047.8 Ų47.80%025%0.253CS..Hα-helixtrans-61.2-27178.8-27.937.7000114.8M189 G347 F348 L353 S354 I362 P402 K405 I406M189-P350 HydrophobicContact SD-CB 4.14Å; G347-P350 WeakPolarHBondContact O-CD 3.24Å; F348-P350 VanDerWaalsContact C-CD 3.44Å; F348-P350 VanDerWaalsContact C-N 3.34Å; P350-L353 PolarHBondContact O-N 3.42Å; P350-S354 WeakPolarHBondContact O-CB 3.4Å; P350-S354 PolarHBondContact O-N 2.64Å; P350-S354 PolarHBondContact O-OG 3.25Å; P350-I362 HydrophobicContact CB-CG2 4.28Å; P350-I362 HydrophobicContact CG-CG2 4.32Å; P350-P402 HydrophobicContact CG-CB 3.79Å; P350-K405 HydrophobicContact CG-CB 4.14Å; P350-I406 HydrophobicContact CB-CD1 3.9Å; P350-I406 HydrophobicContact CB-CG1 4.43Å
351Y92.8Very high90.5Very high37 Ų3750.3 Ų50.315%0.14527%0.269CS..Hα-helixtrans-60.3-59.7-175.5171.7-120.4000113.2M189 L190 F348 I349 L353 S354 K355M189-Y351 HydrophobicContact CB-CD2 4.45Å; M189-Y351 HydrophobicContact CG-CD2 4.31Å; L190-Y351 HydrophobicContact CB-CD2 3.93Å; L190-Y351 HydrophobicContact CB-CE2 3.69Å; L190-Y351 HydrophobicContact CD1-CD1 4.19Å; L190-Y351 HydrophobicContact CD1-CD2 4.26Å; L190-Y351 HydrophobicContact CD1-CE1 4.07Å; L190-Y351 HydrophobicContact CD1-CE2 4.17Å; L190-Y351 HydrophobicContact CD1-CG 4.28Å; L190-Y351 HydrophobicContact CG-CE2 4.37Å; F348-Y351 AromaticContact CE1-CD1 3.86Å; F348-Y351 HydrophobicContact CE1-CD1 3.86Å; F348-Y351 HydrophobicContact CE2-CD1 4.38Å; F348-Y351 AromaticContact CZ-CD1 3.65Å; F348-Y351 HydrophobicContact CZ-CD1 3.65Å; F348-Y351 HydrophobicContact CZ-CE1 4.27Å; F348-Y351 HydrophobicContact CZ-CG 4.42Å; F348-Y351 WeakPolarHBondContact O-CB 3.48Å; F348-Y351 PolarHBondContact O-N 3.06Å; F348-Y351 VanDerWaalsContact O-N 3.07Å; I349-Y351 PolarHBondContact O-N 2.99Å; Y351-L353 VanDerWaalsContact C-N 3.35Å; Y351-L353 PolarHBondContact O-N 3.34Å; Y351-S354 PolarHBondContact O-OG 3.48Å; Y351-K355 PolarHBondContact OH-NZ 3.28Å
352P92.5Very high90.6Very high72 Ų7246.9 Ų46.947%0.46825%0.251SS..Hα-helixtrans-63.2-40.6177.424.7-34000112F348 I349 S354 K355F348-P352 VanDerWaalsContact O-CD 3.32Å; F348-P352 WeakPolarHBondContact O-CD 3.39Å; I349-P352 VanDerWaalsContact O-CD 3.27Å; I349-P352 WeakPolarHBondContact O-CD 3.45Å; I349-P352 WeakPolarHBondContact O-CG 3.29Å; P352-S354 PolarHBondContact O-N 3.11Å; P352-K355 PolarHBondContact O-N 3.46Å
353L92.2Very high91Very high71 Ų7143.3 Ų43.337%0.37224%0.236SC..Hα-helixtrans-66.7-35.6-177.1-67.1-178.8000112.9I349 P350 Y351 K355 V356 L357 I362I349-L353 HydrophobicContact CG2-CD1 3.61Å; I349-L353 HydrophobicContact CG2-CG 4.43Å; P350-L353 PolarHBondContact O-N 3.42Å; Y351-L353 VanDerWaalsContact C-N 3.35Å; Y351-L353 PolarHBondContact O-N 3.34Å; L353-K355 PolarHBondContact O-N 3.45Å; L353-K355 VanDerWaalsContact O-N 3.15Å; L353-V356 PolarHBondContact O-N 2.96Å; L353-L357 HydrophobicContact CB-CD1 4.43Å; L353-L357 HydrophobicContact CD2-CD1 4.39Å; L353-L357 PolarHBondContact O-N 3.1Å; L353-I362 HydrophobicContact CB-CD1 3.58Å; L353-I362 HydrophobicContact CB-CG1 4.12Å
354S89.1Confident91.4Very high5 Ų543.4 Ų43.44%0.03524%0.238CC..Hα-helixtrans-64.3-23.1-176.270.50000113.4M189 P350 Y351 P352 V356 G358M189-S354 WeakPolarHBondContact CG-OG 3.36Å; P350-S354 WeakPolarHBondContact O-CB 3.4Å; P350-S354 PolarHBondContact O-N 2.64Å; P350-S354 PolarHBondContact O-OG 3.25Å; Y351-S354 PolarHBondContact O-OG 3.48Å; P352-S354 PolarHBondContact O-N 3.11Å; S354-V356 VanDerWaalsContact C-N 3.27Å; S354-G358 PolarHBondContact O-N 3.14Å
355K85.9Confident91.6Very high103 Ų10345.6 Ų45.645%0.44825%0.246SC..Hα-helixtrans-73.4-19.3174.7-65.5-177.5-177.81740112.6Y351 P352 L353 R475Y351-K355 PolarHBondContact OH-NZ 3.28Å; P352-K355 PolarHBondContact O-N 3.46Å; L353-K355 PolarHBondContact O-N 3.45Å; L353-K355 VanDerWaalsContact O-N 3.15Å; K355-R475 VanDerWaalsContact O-CZ 3.27Å; K355-R475 PolarHBondContact O-NH2 2.94Å
356V88.6Confident91.8Very high111 Ų11142.3 Ų42.367%0.67323%0.226SC*.Hα-helixtrans-110.1-50.6-178-173.30000110.5L353 S354 R475L353-V356 PolarHBondContact O-N 2.96Å; S354-V356 VanDerWaalsContact C-N 3.27Å; V356-R475 VanDerWaalsContact C-NH1 3.25Å; V356-R475 PolarHBondContact O-NH1 3.16Å
357L89.9Confident92.1Very high89 Ų8941.8 Ų41.847%0.46622%0.223SC..Hα-helixtrans-90.7-21.5-171.5-60.2176.1000113.9L353 P361 I362L353-L357 HydrophobicContact CB-CD1 4.43Å; L353-L357 HydrophobicContact CD2-CD1 4.39Å; L353-L357 PolarHBondContact O-N 3.1Å; L357-P361 HydrophobicContact CB-CB 4.35Å; L357-P361 VanDerWaalsContact O-CG 3.31Å; L357-P361 WeakPolarHBondContact O-CG 3.22Å; L357-I362 HydrophobicContact CB-CG1 4.33Å; L357-I362 HydrophobicContact CD1-CG1 4.43Å
358G88.6Confident92.5Very high1 Ų143.8 Ų43.81%0.0124%0.235CC..  trans82.8-168.5-164.200000112.4S354 I362S354-G358 PolarHBondContact O-N 3.14Å; G358-I362 WeakPolarHBondContact O-CD1 3.33Å; G358-I362 WeakPolarHBondContact O-CG1 3.27Å
359R92Very high92.6Very high9 Ų943.2 Ų43.23%0.03424%0.235CC..SBendtrans-98.9-43.6-168.9-64.584.9-161.5-116.88.9110.6N185 M189 I362 L363 I406 L409 M410 E413 E473 T474N185-R359 PolarHBondContact OD1-NH1 2.95Å; N185-R359 PolarHBondContact OD1-NH2 3.45Å; M189-R359 HydrophobicContact CE-CG 3.77Å; R359-I362 PolarHBondContact O-N 3.34Å; R359-L363 PolarHBondContact O-N 3.48Å; R359-L363 VanDerWaalsContact O-N 3.11Å; R359-I406 HydrophobicContact CB-CD1 4.29Å; R359-I406 HydrophobicContact CB-CG2 4.08Å; R359-I406 HydrophobicContact CG-CD1 4.45Å; R359-L409 HydrophobicContact CG-CD2 4.29Å; R359-M410 HydrophobicContact CB-CE 3.55Å; R359-E413 IonicContact NH1-OE1 3.56Å; R359-E413 PolarHBondContact NH1-OE1 2.78Å; R359-E413 VanDerWaalsContact NH1-OE1 3.1Å; R359-E413 IonicContact NH1-OE2 3.57Å; R359-E413 PolarHBondContact NH1-OE2 3.35Å; R359-E473 WeakPolarHBondContact CB-OE1 3.32Å; R359-E473 WeakPolarHBondContact CD-OE1 3.32Å; R359-E473 VanDerWaalsContact N-CD 3.3Å; R359-E473 PolarHBondContact N-OE1 2.92Å; R359-E473 PolarHBondContact N-OE2 3.2Å; R359-T474 PolarHBondContact NH1-O 2.75Å
360K93.3Very high92.7Very high46 Ų4639.4 Ų39.420%0.222%0.216CC..Hα-helixtrans-63.5-43.7-178.1179.9178.9-179.8171.90112.5I362 L363 V364 M410 V467 I468 L471 E473K360-I362 VanDerWaalsContact C-N 3.34Å; K360-I362 PolarHBondContact O-N 2.96Å; K360-L363 WeakPolarHBondContact O-CB 3.16Å; K360-L363 PolarHBondContact O-N 3.43Å; K360-V364 HydrophobicContact CG-CG2 4.4Å; K360-V364 WeakPolarHBondContact O-CG2 3.29Å; K360-V364 PolarHBondContact O-N 3.33Å; K360-M410 HydrophobicContact CB-CE 4.01Å; K360-V467 WeakPolarHBondContact CE-O 3.3Å; K360-V467 HydrophobicContact CG-CG1 4.29Å; K360-V467 PolarHBondContact NZ-O 3Å; K360-I468 PolarHBondContact NZ-O 3.13Å; K360-L471 WeakPolarHBondContact CD-O 3.2Å; K360-L471 VanDerWaalsContact CE-O 3.3Å; K360-L471 WeakPolarHBondContact CE-O 3.35Å; K360-L471 PolarHBondContact NZ-O 3.44Å; K360-E473 WeakPolarHBondContact CB-OE2 3.47Å; K360-E473 PolarHBondContact N-OE2 3.08Å
361P94.5Very high92.8Very high52 Ų5240 Ų4034%0.33822%0.22SC..Hα-helixtrans-62.3-39.6177-28.539.7000113L357 L363 V364 T365 E473L357-P361 HydrophobicContact CB-CB 4.35Å; L357-P361 VanDerWaalsContact O-CG 3.31Å; L357-P361 WeakPolarHBondContact O-CG 3.22Å; P361-L363 VanDerWaalsContact C-N 3.34Å; P361-L363 PolarHBondContact O-N 2.9Å; P361-V364 PolarHBondContact O-N 3.41Å; P361-T365 WeakPolarHBondContact O-CB 3.48Å; P361-T365 PolarHBondContact O-N 2.72Å; P361-T365 PolarHBondContact O-OG1 2.89Å; P361-E473 WeakPolarHBondContact CD-OE2 3.31Å
362I94.4Very high93Very high6 Ų645.5 Ų45.53%0.03125%0.245CC..Hα-helixtrans-61.8-45.8177-61.1172.6000110.4P350 L353 L357 G358 R359 K360 T365 S366 I406P350-I362 HydrophobicContact CB-CG2 4.28Å; P350-I362 HydrophobicContact CG-CG2 4.32Å; L353-I362 HydrophobicContact CB-CD1 3.58Å; L353-I362 HydrophobicContact CB-CG1 4.12Å; L357-I362 HydrophobicContact CB-CG1 4.33Å; L357-I362 HydrophobicContact CD1-CG1 4.43Å; G358-I362 WeakPolarHBondContact O-CD1 3.33Å; G358-I362 WeakPolarHBondContact O-CG1 3.27Å; R359-I362 PolarHBondContact O-N 3.34Å; K360-I362 VanDerWaalsContact C-N 3.34Å; K360-I362 PolarHBondContact O-N 2.96Å; I362-T365 PolarHBondContact O-N 3.22Å; I362-S366 VanDerWaalsContact O-CB 3.29Å; I362-S366 WeakPolarHBondContact O-CB 3.43Å; I362-S366 PolarHBondContact O-N 2.62Å; I362-S366 PolarHBondContact O-OG 3.29Å; I362-I406 HydrophobicContact CB-CD1 4.18Å; I362-I406 HydrophobicContact CB-CG1 4.08Å; I362-I406 HydrophobicContact CD1-CD1 4.31Å; I362-I406 HydrophobicContact CG2-CD1 4.09Å; I362-I406 HydrophobicContact CG2-CG1 3.8Å
363L95Very high93Very high0 Ų042.4 Ų42.40%023%0.225CC..Hα-helixtrans-56.4-51.9175.6176.958.8000111.1R359 K360 P361 S366 I367 M403 I406 M410 V467 L471R359-L363 PolarHBondContact O-N 3.48Å; R359-L363 VanDerWaalsContact O-N 3.11Å; K360-L363 WeakPolarHBondContact O-CB 3.16Å; K360-L363 PolarHBondContact O-N 3.43Å; P361-L363 VanDerWaalsContact C-N 3.34Å; P361-L363 PolarHBondContact O-N 2.9Å; L363-S366 WeakPolarHBondContact O-CB 3.41Å; L363-S366 PolarHBondContact O-N 3.42Å; L363-I367 HydrophobicContact CD1-CD1 3.74Å; L363-I367 HydrophobicContact CD1-CG1 4.36Å; L363-I367 HydrophobicContact CG-CD1 3.91Å; L363-I367 VanDerWaalsContact O-CD1 3.31Å; L363-I367 WeakPolarHBondContact O-CD1 3.28Å; L363-I367 VanDerWaalsContact O-CG1 3.24Å; L363-I367 WeakPolarHBondContact O-CG1 3.46Å; L363-I367 PolarHBondContact O-N 3.3Å; L363-I367 VanDerWaalsContact O-N 3.15Å; L363-M403 HydrophobicContact CD1-CB 3.91Å; L363-M403 HydrophobicContact CD1-CG 3.16Å; L363-I406 HydrophobicContact CB-CB 4.28Å; L363-I406 HydrophobicContact CB-CG2 3.84Å; L363-I406 HydrophobicContact CD2-CG2 4.38Å; L363-M410 HydrophobicContact CD2-SD 4.07Å; L363-V467 HydrophobicContact CD2-CB 4.47Å; L363-V467 HydrophobicContact CD2-CG1 3.63Å; L363-V467 HydrophobicContact CD2-CG2 3.93Å; L363-V467 HydrophobicContact CG-CG1 4.07Å; L363-V467 HydrophobicContact CG-CG2 4.43Å; L363-L471 HydrophobicContact CD2-CD2 3.84Å
364V95.8Very high93Very high25 Ų2539.3 Ų39.315%0.15221%0.209CC..Hα-helixtrans-62.2-48.5-179.31740000111.3K360 P361 S366 I367 V368 I464 V467 I468K360-V364 HydrophobicContact CG-CG2 4.4Å; K360-V364 WeakPolarHBondContact O-CG2 3.29Å; K360-V364 PolarHBondContact O-N 3.33Å; P361-V364 PolarHBondContact O-N 3.41Å; V364-S366 VanDerWaalsContact C-N 3.29Å; V364-S366 PolarHBondContact O-N 3.21Å; V364-I367 PolarHBondContact O-N 3.03Å; V364-V368 HydrophobicContact CG1-CG2 4.06Å; V364-V368 WeakPolarHBondContact O-CB 3.47Å; V364-V368 WeakPolarHBondContact O-CG2 3.48Å; V364-V368 PolarHBondContact O-N 2.88Å; V364-I464 HydrophobicContact CG1-CG2 4.46Å; V364-V467 HydrophobicContact CG2-CG1 3.7Å; V364-I468 HydrophobicContact CG1-CD1 4.21Å; V364-I468 HydrophobicContact CG1-CG1 4.38Å; V364-I468 HydrophobicContact CG2-CG1 3.96Å
365T95.4Very high93.3Very high75 Ų7543.7 Ų43.746%0.4623%0.226SC..Hα-helixtrans-59.3-41.1179.5-60.30000111.9P361 I362 I367 V368 I369P361-T365 WeakPolarHBondContact O-CB 3.48Å; P361-T365 PolarHBondContact O-N 2.72Å; P361-T365 PolarHBondContact O-OG1 2.89Å; I362-T365 PolarHBondContact O-N 3.22Å; T365-I367 PolarHBondContact O-N 3.34Å; T365-V368 PolarHBondContact O-N 2.62Å; T365-I369 HydrophobicContact CG2-CD1 3.94Å; T365-I369 HydrophobicContact CG2-CG1 4.46Å; T365-I369 VanDerWaalsContact O-CG1 3.31Å; T365-I369 WeakPolarHBondContact O-CG1 3.36Å; T365-I369 PolarHBondContact O-N 3.22Å
366S94.7Very high93.7Very high9 Ų939.7 Ų39.76%0.06321%0.213CC..Hα-helixtrans-60.2-46.6177.5-59.70000111.8I362 L363 V364 T370 A399 P402I362-S366 VanDerWaalsContact O-CB 3.29Å; I362-S366 WeakPolarHBondContact O-CB 3.43Å; I362-S366 PolarHBondContact O-N 2.62Å; I362-S366 PolarHBondContact O-OG 3.29Å; L363-S366 WeakPolarHBondContact O-CB 3.41Å; L363-S366 PolarHBondContact O-N 3.42Å; V364-S366 VanDerWaalsContact C-N 3.29Å; V364-S366 PolarHBondContact O-N 3.21Å; S366-T370 PolarHBondContact O-N 3.35Å; S366-T370 VanDerWaalsContact O-N 3.08Å; S366-T370 PolarHBondContact O-OG1 2.95Å; S366-A399 VanDerWaalsContact CB-O 3.24Å; S366-A399 WeakPolarHBondContact CB-O 3.33Å; S366-P402 WeakPolarHBondContact OG-CB 3.21Å
367I95.1Very high93.8Very high0 Ų034.4 Ų34.40%018%0.181CC..Hα-helixtrans-70.5-36.3178.8-55.2155.3000110.8L363 V364 T365 T370 S371 M403 T460 H463 I464 V467L363-I367 HydrophobicContact CD1-CD1 3.74Å; L363-I367 HydrophobicContact CD1-CG1 4.36Å; L363-I367 HydrophobicContact CG-CD1 3.91Å; L363-I367 VanDerWaalsContact O-CD1 3.31Å; L363-I367 WeakPolarHBondContact O-CD1 3.28Å; L363-I367 VanDerWaalsContact O-CG1 3.24Å; L363-I367 WeakPolarHBondContact O-CG1 3.46Å; L363-I367 PolarHBondContact O-N 3.3Å; L363-I367 VanDerWaalsContact O-N 3.15Å; V364-I367 PolarHBondContact O-N 3.03Å; T365-I367 PolarHBondContact O-N 3.34Å; I367-T370 WeakPolarHBondContact O-CB 3.32Å; I367-T370 PolarHBondContact O-N 2.81Å; I367-S371 WeakPolarHBondContact O-CB 3.49Å; I367-S371 PolarHBondContact O-N 3.01Å; I367-M403 HydrophobicContact CD1-CG 4.38Å; I367-M403 HydrophobicContact CG1-CG 4.01Å; I367-T460 HydrophobicContact CG2-CG2 4.04Å; I367-H463 WeakPolarHBondContact CD1-CE1 3.3Å; I367-H463 VanDerWaalsContact CD1-NE2 3.31Å; I367-H463 WeakPolarHBondContact CD1-NE2 3.36Å; I367-H463 HydrophobicContact CG2-CB 4.14Å; I367-I464 HydrophobicContact CB-CG1 4.01Å; I367-I464 HydrophobicContact CG2-CD1 4.06Å; I367-I464 HydrophobicContact CG2-CG1 3.59Å; I367-V467 HydrophobicContact CD1-CG2 4.39Å
368V96.4Very high94Very high42 Ų4230.6 Ų30.626%0.25516%0.162SC..Hα-helixtrans-62.4-47.6176.2167.10000111.1V364 T365 T370 S371 F372 I464V364-V368 HydrophobicContact CG1-CG2 4.06Å; V364-V368 WeakPolarHBondContact O-CB 3.47Å; V364-V368 WeakPolarHBondContact O-CG2 3.48Å; V364-V368 PolarHBondContact O-N 2.88Å; T365-V368 PolarHBondContact O-N 2.62Å; V368-T370 VanDerWaalsContact C-N 3.29Å; V368-T370 PolarHBondContact O-N 3.31Å; V368-S371 WeakPolarHBondContact O-CB 3.28Å; V368-S371 PolarHBondContact O-N 3.34Å; V368-S371 VanDerWaalsContact O-N 3.14Å; V368-F372 HydrophobicContact CG1-CD2 3.58Å; V368-F372 HydrophobicContact CG1-CE2 3.39Å; V368-F372 WeakPolarHBondContact O-CD2 3.18Å; V368-F372 PolarHBondContact O-N 2.95Å; V368-I464 HydrophobicContact CB-CD1 4.46Å; V368-I464 HydrophobicContact CG2-CD1 3.68Å; V368-I464 HydrophobicContact CG2-CG1 4.11Å
369I95.1Very high94.3Very high74 Ų7435.6 Ų35.638%0.37919%0.187SC..Hα-helixtrans-60.2-43.5175.8-65.4165.3000110.1T365 S371 F372 S373 I395 A399T365-I369 HydrophobicContact CG2-CD1 3.94Å; T365-I369 HydrophobicContact CG2-CG1 4.46Å; T365-I369 VanDerWaalsContact O-CG1 3.31Å; T365-I369 WeakPolarHBondContact O-CG1 3.36Å; T365-I369 PolarHBondContact O-N 3.22Å; I369-S371 VanDerWaalsContact C-N 3.32Å; I369-S371 PolarHBondContact O-N 3.33Å; I369-F372 PolarHBondContact O-N 3.38Å; I369-S373 WeakPolarHBondContact O-CB 3.29Å; I369-S373 PolarHBondContact O-N 3.48Å; I369-I395 HydrophobicContact CG2-CG2 4.23Å; I369-A399 HydrophobicContact CB-CB 3.85Å; I369-A399 HydrophobicContact CG2-CB 3.55Å
370T93.6Very high94.4Very high1 Ų137.1 Ų37.11%0.00620%0.196CC..Hα-helixtrans-60.3-43.1175.5-50.80000111.2I317 S366 I367 V368 S373 A374 I400 T460I317-T370 HydrophobicContact CD1-CG2 4.3Å; I317-T370 HydrophobicContact CG2-CG2 4.08Å; S366-T370 PolarHBondContact O-N 3.35Å; S366-T370 VanDerWaalsContact O-N 3.08Å; S366-T370 PolarHBondContact O-OG1 2.95Å; I367-T370 WeakPolarHBondContact O-CB 3.32Å; I367-T370 PolarHBondContact O-N 2.81Å; V368-T370 VanDerWaalsContact C-N 3.29Å; V368-T370 PolarHBondContact O-N 3.31Å; T370-S373 WeakPolarHBondContact CA-OG 3.38Å; T370-S373 PolarHBondContact O-N 3.09Å; T370-S373 PolarHBondContact O-OG 2.6Å; T370-A374 PolarHBondContact O-N 3.41Å; T370-I400 HydrophobicContact CG2-CD1 4.29Å; T370-T460 HydrophobicContact CG2-CG2 4.11Å
371S94.9Very high94.3Very high13 Ų1338.7 Ų38.79%0.09120%0.201CC..Hα-helixtrans-63.2-45.3178.5-164.20000111.9I367 V368 I369 S373 A374 W375 T460I367-S371 WeakPolarHBondContact O-CB 3.49Å; I367-S371 PolarHBondContact O-N 3.01Å; V368-S371 WeakPolarHBondContact O-CB 3.28Å; V368-S371 PolarHBondContact O-N 3.34Å; V368-S371 VanDerWaalsContact O-N 3.14Å; I369-S371 VanDerWaalsContact C-N 3.32Å; I369-S371 PolarHBondContact O-N 3.33Å; S371-S373 VanDerWaalsContact C-N 3.31Å; S371-S373 PolarHBondContact O-N 3.29Å; S371-A374 PolarHBondContact O-N 3Å; S371-W375 PolarHBondContact O-N 3Å; S371-T460 WeakPolarHBondContact CA-OG1 3.4Å; S371-T460 WeakPolarHBondContact CB-OG1 3.3Å; S371-T460 PolarHBondContact OG-OG1 3.47Å
372F95.4Very high94.3Very high151 Ų15143.3 Ų43.366%0.66221%0.213SC*.Hα-helixtrans-63.3-38.7174.8-80.4-62.9000111.8V368 I369 G376V368-F372 HydrophobicContact CG1-CD2 3.58Å; V368-F372 HydrophobicContact CG1-CE2 3.39Å; V368-F372 WeakPolarHBondContact O-CD2 3.18Å; V368-F372 PolarHBondContact O-N 2.95Å; I369-F372 PolarHBondContact O-N 3.38Å; F372-G376 WeakPolarHBondContact O-CA 3.5Å; F372-G376 PolarHBondContact O-N 2.94Å
373S93.2Very high94.3Very high8 Ų848.1 Ų48.16%0.05624%0.242CC..Hα-helixtrans-64.5-41.7176.877.70000112I369 T370 S371 T377 L392 G396I369-S373 WeakPolarHBondContact O-CB 3.29Å; I369-S373 PolarHBondContact O-N 3.48Å; T370-S373 WeakPolarHBondContact CA-OG 3.38Å; T370-S373 PolarHBondContact O-N 3.09Å; T370-S373 PolarHBondContact O-OG 2.6Å; S371-S373 VanDerWaalsContact C-N 3.31Å; S371-S373 PolarHBondContact O-N 3.29Å; S373-T377 WeakPolarHBondContact O-CB 3.5Å; S373-T377 PolarHBondContact O-N 3.45Å; S373-T377 PolarHBondContact O-OG1 3.48Å; S373-L392 WeakPolarHBondContact CB-O 3.35Å; S373-L392 VanDerWaalsContact O-CD2 3.23Å; S373-L392 WeakPolarHBondContact O-CD2 3.43Å; S373-G396 WeakPolarHBondContact OG-CA 3.17Å
374A93Very high94.2Very high5 Ų551.1 Ų51.14%0.04127%0.273CS..Hα-helixtrans-68-51.9179.900000111.6T370 S371 G376 T377 V378T370-A374 PolarHBondContact O-N 3.41Å; S371-A374 PolarHBondContact O-N 3Å; A374-G376 PolarHBondContact O-N 3.46Å; A374-T377 WeakPolarHBondContact O-CB 3.35Å; A374-T377 PolarHBondContact O-N 3.08Å; A374-T377 VanDerWaalsContact O-N 3.16Å; A374-V378 PolarHBondContact O-N 3.4Å
375W95.2Very high94Very high98 Ų9854.5 Ų54.537%0.37129%0.286SS..Hα-helixtrans-67.5-36.4178.1-75.6109.8000112.9S371 T377 V378 I379 G457S371-W375 PolarHBondContact O-N 3Å; W375-T377 PolarHBondContact O-N 3.02Å; W375-V378 HydrophobicContact CE3-CG2 4.47Å; W375-V378 WeakPolarHBondContact O-CB 3.33Å; W375-V378 PolarHBondContact O-N 3.12Å; W375-I379 WeakPolarHBondContact O-CG1 3.39Å; W375-I379 PolarHBondContact O-N 3.33Å; W375-G457 VanDerWaalsContact NE1-CA 3.34Å; W375-G457 PolarHBondContact NE1-O 2.97Å; W375-G457 VanDerWaalsContact NE1-O 3.08Å
376G93.6Very high93.5Very high18 Ų1853 Ų5319%0.18628%0.281CS..Hα-helixtrans-61.5-34.7172.700000112F372 A374 V378 I379 L380F372-G376 WeakPolarHBondContact O-CA 3.5Å; F372-G376 PolarHBondContact O-N 2.94Å; A374-G376 PolarHBondContact O-N 3.46Å; G376-V378 VanDerWaalsContact C-N 3.34Å; G376-V378 PolarHBondContact O-N 3.38Å; G376-I379 PolarHBondContact O-N 2.88Å; G376-L380 VanDerWaalsContact O-CG 3.31Å; G376-L380 WeakPolarHBondContact O-CG 3.44Å; G376-L380 PolarHBondContact O-N 3.48Å
377T91.4Very high93.2Very high0 Ų058.6 Ų58.60%031%0.306CS..Hα-helixtrans-65.9-39.4176.3-60.10000111.1S373 A374 W375 L380 Y381 M389 L392 F453S373-T377 WeakPolarHBondContact O-CB 3.5Å; S373-T377 PolarHBondContact O-N 3.45Å; S373-T377 PolarHBondContact O-OG1 3.48Å; A374-T377 WeakPolarHBondContact O-CB 3.35Å; A374-T377 PolarHBondContact O-N 3.08Å; A374-T377 VanDerWaalsContact O-N 3.16Å; W375-T377 PolarHBondContact O-N 3.02Å; T377-L380 PolarHBondContact O-N 3.34Å; T377-Y381 PolarHBondContact O-N 3.17Å; T377-Y381 VanDerWaalsContact O-N 3.16Å; T377-M389 HydrophobicContact CG2-CB 3.72Å; T377-M389 HydrophobicContact CG2-CE 3.64Å; T377-M389 HydrophobicContact CG2-CG 3.71Å; T377-M389 HydrophobicContact CG2-SD 4.49Å; T377-L392 VanDerWaalsContact N-CD2 3.34Å; T377-F453 HydrophobicContact CG2-CB 4.44Å; T377-F453 HydrophobicContact CG2-CD1 3.66Å; T377-F453 HydrophobicContact CG2-CD2 3.7Å; T377-F453 HydrophobicContact CG2-CE1 3.72Å; T377-F453 HydrophobicContact CG2-CE2 3.75Å; T377-F453 HydrophobicContact CG2-CG 3.66Å; T377-F453 HydrophobicContact CG2-CZ 3.76Å
378V92.8Very high92.8Very high10 Ų1064.3 Ų64.36%0.06133%0.329CS..Hα-helixtrans-63-44.3173.1179.50000111A374 W375 G376 Y381 Y382 P450 F453 M454A374-V378 PolarHBondContact O-N 3.4Å; W375-V378 HydrophobicContact CE3-CG2 4.47Å; W375-V378 WeakPolarHBondContact O-CB 3.33Å; W375-V378 PolarHBondContact O-N 3.12Å; G376-V378 VanDerWaalsContact C-N 3.34Å; G376-V378 PolarHBondContact O-N 3.38Å; V378-Y381 WeakPolarHBondContact O-CB 3.32Å; V378-Y381 PolarHBondContact O-N 3.4Å; V378-Y382 HydrophobicContact CG1-CD2 3.92Å; V378-Y382 HydrophobicContact CG1-CE2 3.71Å; V378-Y382 VanDerWaalsContact O-CD2 3.25Å; V378-Y382 WeakPolarHBondContact O-CD2 3.36Å; V378-Y382 PolarHBondContact O-N 3.3Å; V378-P450 HydrophobicContact CB-CB 4.47Å; V378-P450 HydrophobicContact CG1-CB 4.25Å; V378-P450 HydrophobicContact CG2-CB 4.23Å; V378-F453 HydrophobicContact CG2-CB 3.74Å; V378-M454 HydrophobicContact CG1-CG 4.09Å; V378-M454 HydrophobicContact CG2-CG 3.66Å
379I95.4Very high92.3Very high105 Ų10563.4 Ų63.454%0.53832%0.322SS..Hα-helixtrans-62.7-46178.2-66.5165.6000110.9W375 G376 Y381 Y382 V383W375-I379 WeakPolarHBondContact O-CG1 3.39Å; W375-I379 PolarHBondContact O-N 3.33Å; G376-I379 PolarHBondContact O-N 2.88Å; I379-Y381 PolarHBondContact O-N 3.26Å; I379-Y382 PolarHBondContact O-N 2.64Å; I379-Y382 VanDerWaalsContact O-N 3.15Å; I379-V383 HydrophobicContact CG2-CG2 4.07Å; I379-V383 WeakPolarHBondContact O-CG2 3.38Å; I379-V383 PolarHBondContact O-N 3.06Å
380L93.4Very high91.7Very high42 Ų4263.8 Ų63.822%0.2233%0.329CS..Hα-helixtrans-57.7-38.7178.3-75.1172.5000112.1G376 T377 G384 K385 M389 L392G376-L380 VanDerWaalsContact O-CG 3.31Å; G376-L380 WeakPolarHBondContact O-CG 3.44Å; G376-L380 PolarHBondContact O-N 3.48Å; T377-L380 PolarHBondContact O-N 3.34Å; L380-G384 PolarHBondContact O-N 3.36Å; L380-K385 HydrophobicContact CD2-CB 3.8Å; L380-K385 CarbonylContact O-C 3.41Å; L380-K385 WeakPolarHBondContact O-CA 3.21Å; L380-K385 PolarHBondContact O-N 2.96Å; L380-M389 HydrophobicContact CB-CG 4.37Å; L380-L392 HydrophobicContact CD1-CB 4.48Å; L380-L392 HydrophobicContact CD1-CD2 3.94Å
381Y91.6Very high91.4Very high79 Ų7968 Ų6831%0.3136%0.355SS..Hα-helixtrans-60.2-50.9175-178.4-95000111.8T377 V378 I379 V383 G384 A386 M389 L448 A449 P450T377-Y381 PolarHBondContact O-N 3.17Å; T377-Y381 VanDerWaalsContact O-N 3.16Å; V378-Y381 WeakPolarHBondContact O-CB 3.32Å; V378-Y381 PolarHBondContact O-N 3.4Å; I379-Y381 PolarHBondContact O-N 3.26Å; Y381-V383 VanDerWaalsContact C-N 3.34Å; Y381-V383 PolarHBondContact O-N 3.37Å; Y381-G384 PolarHBondContact O-N 2.86Å; Y381-G384 VanDerWaalsContact O-N 3.16Å; Y381-A386 HydrophobicContact CD2-CB 4.45Å; Y381-M389 HydrophobicContact CD2-CE 4.35Å; Y381-M389 HydrophobicContact CD2-SD 3.95Å; Y381-M389 HydrophobicContact CG-SD 4.49Å; Y381-L448 HydrophobicContact CE1-CD1 4.21Å; Y381-A449 HydrophobicContact CD2-CB 4.09Å; Y381-A449 HydrophobicContact CE2-CB 3.62Å; Y381-P450 HydrophobicContact CD1-CB 4.2Å; Y381-P450 HydrophobicContact CD1-CG 3.52Å; Y381-P450 HydrophobicContact CE1-CG 3.77Å; Y381-P450 HydrophobicContact CG-CB 4.2Å; Y381-P450 HydrophobicContact CG-CG 3.94Å
382Y94.3Very high91Very high149 Ų14969.3 Ų69.358%0.58436%0.361SS*.Hα-helixtrans-71.6-24.2-177.7-73.7-67000114.3V378 I379 G384 P450V378-Y382 HydrophobicContact CG1-CD2 3.92Å; V378-Y382 HydrophobicContact CG1-CE2 3.71Å; V378-Y382 VanDerWaalsContact O-CD2 3.25Å; V378-Y382 WeakPolarHBondContact O-CD2 3.36Å; V378-Y382 PolarHBondContact O-N 3.3Å; I379-Y382 PolarHBondContact O-N 2.64Å; I379-Y382 VanDerWaalsContact O-N 3.15Å; Y382-G384 PolarHBondContact O-N 2.89Å; Y382-P450 HydrophobicContact CE2-CG 4.49Å
383V95.5Very high90.4Very high106 Ų10662.6 Ų62.664%0.64233%0.333SS*.THydrogen-bonded Turntrans-841.3174.8179.90000111.8I379 Y381 K385I379-V383 HydrophobicContact CG2-CG2 4.07Å; I379-V383 WeakPolarHBondContact O-CG2 3.38Å; I379-V383 PolarHBondContact O-N 3.06Å; Y381-V383 VanDerWaalsContact C-N 3.34Å; Y381-V383 PolarHBondContact O-N 3.37Å; V383-K385 VanDerWaalsContact C-N 3.34Å; V383-K385 HydrophobicContact CG1-CG 4.4Å
384G92Very high89.9Confident64 Ų6465.9 Ų65.966%0.6635%0.353SS*.THydrogen-bonded Turntrans7523.1179.300000113.8L380 Y381 Y382L380-G384 PolarHBondContact O-N 3.36Å; Y381-G384 PolarHBondContact O-N 2.86Å; Y381-G384 VanDerWaalsContact O-N 3.16Å; Y382-G384 PolarHBondContact O-N 2.89Å
385K92.2Very high89.6Confident95 Ų9569.9 Ų69.941%0.41337%0.372SS..  trans-11137.7179.4-69.7-60.5-167.8-179.80111.8L380 V383 E387 Y388L380-K385 HydrophobicContact CD2-CB 3.8Å; L380-K385 CarbonylContact O-C 3.41Å; L380-K385 WeakPolarHBondContact O-CA 3.21Å; L380-K385 PolarHBondContact O-N 2.96Å; V383-K385 VanDerWaalsContact C-N 3.34Å; V383-K385 HydrophobicContact CG1-CG 4.4Å; K385-E387 IonicContact NZ-OE1 3.94Å; K385-E387 PolarHBondContact O-N 3.48Å; K385-E387 VanDerWaalsContact O-N 3.1Å; K385-Y388 HydrophobicContact CB-CD2 4.16Å; K385-Y388 HydrophobicContact CD-CD2 4.46Å; K385-Y388 HydrophobicContact CD-CE2 4.18Å; K385-Y388 PolarHBondContact O-N 3.12Å; K385-Y388 VanDerWaalsContact O-N 3.15Å
386A85.4Confident89.2Confident44 Ų4465.2 Ų65.236%0.36436%0.355SS..G310 helixtrans-58.6-24.4-176.800000113.7Y381 Y388 M389Y381-A386 HydrophobicContact CD2-CB 4.45Å; A386-Y388 PolarHBondContact O-N 3.31Å; A386-Y388 VanDerWaalsContact O-N 3.16Å; A386-M389 HydrophobicContact CB-SD 3.73Å; A386-M389 VanDerWaalsContact O-CB 3.31Å; A386-M389 WeakPolarHBondContact O-CB 3.37Å; A386-M389 VanDerWaalsContact O-CG 3.25Å; A386-M389 WeakPolarHBondContact O-CG 3.17Å; A386-M389 PolarHBondContact O-N 2.9Å; A386-M389 VanDerWaalsContact O-N 3.08Å
387E87Confident88.6Confident127 Ų12764.8 Ų64.859%0.59335%0.348SS*.G310 helixtrans-56.3-28.1175.767.3-173.4161.200114K385 P390K385-E387 IonicContact NZ-OE1 3.94Å; K385-E387 PolarHBondContact O-N 3.48Å; K385-E387 VanDerWaalsContact O-N 3.1Å; E387-P390 WeakPolarHBondContact O-CD 3.44Å
388Y87.8Confident88.2Confident120 Ų12065.4 Ų65.447%0.47135%0.354SS..G310 helixtrans-92.1-4.5-179.9-60.8-75.2000113.9K385 A386 P390 V391 L392K385-Y388 HydrophobicContact CB-CD2 4.16Å; K385-Y388 HydrophobicContact CD-CD2 4.46Å; K385-Y388 HydrophobicContact CD-CE2 4.18Å; K385-Y388 PolarHBondContact O-N 3.12Å; K385-Y388 VanDerWaalsContact O-N 3.15Å; A386-Y388 PolarHBondContact O-N 3.31Å; A386-Y388 VanDerWaalsContact O-N 3.16Å; Y388-P390 VanDerWaalsContact C-CD 3.48Å; Y388-V391 PolarHBondContact O-N 2.81Å; Y388-L392 PolarHBondContact O-N 2.93Å
389M86.5Confident88.1Confident22 Ų2265.5 Ų65.511%0.10836%0.356CS..Hα-helixtrans-55.7-43.7179.6-66.4171.365.700112.9T377 L380 Y381 A386 V391 L392 A393 F453T377-M389 HydrophobicContact CG2-CB 3.72Å; T377-M389 HydrophobicContact CG2-CE 3.64Å; T377-M389 HydrophobicContact CG2-CG 3.71Å; T377-M389 HydrophobicContact CG2-SD 4.49Å; L380-M389 HydrophobicContact CB-CG 4.37Å; Y381-M389 HydrophobicContact CD2-CE 4.35Å; Y381-M389 HydrophobicContact CD2-SD 3.95Å; Y381-M389 HydrophobicContact CG-SD 4.49Å; A386-M389 HydrophobicContact CB-SD 3.73Å; A386-M389 VanDerWaalsContact O-CB 3.31Å; A386-M389 WeakPolarHBondContact O-CB 3.37Å; A386-M389 VanDerWaalsContact O-CG 3.25Å; A386-M389 WeakPolarHBondContact O-CG 3.17Å; A386-M389 PolarHBondContact O-N 2.9Å; A386-M389 VanDerWaalsContact O-N 3.08Å; M389-V391 VanDerWaalsContact C-N 3.32Å; M389-V391 PolarHBondContact O-N 3.48Å; M389-L392 PolarHBondContact O-N 3.36Å; M389-A393 WeakPolarHBondContact O-CB 3.3Å; M389-A393 PolarHBondContact O-N 2.94Å; M389-F453 HydrophobicContact CE-CD2 4.26Å; M389-F453 HydrophobicContact CE-CE2 3.94Å
390P81.8Confident87.7Confident83 Ų8360.5 Ų60.554%0.53933%0.33SS..Hα-helixtrans-62.8-37.1179.5-23.235.4000113.2E387 Y388 L392 A393 V394E387-P390 WeakPolarHBondContact O-CD 3.44Å; Y388-P390 VanDerWaalsContact C-CD 3.48Å; P390-L392 VanDerWaalsContact C-N 3.34Å; P390-L392 PolarHBondContact O-N 2.88Å; P390-A393 PolarHBondContact O-N 2.92Å; P390-V394 WeakPolarHBondContact O-CG2 3.36Å; P390-V394 PolarHBondContact O-N 3.27Å
391V86.2Confident87.5Confident89 Ų8958.8 Ų58.854%0.53932%0.322SS..Hα-helixtrans-61.7-47178.8179.30000110Y388 M389 V394 I395Y388-V391 PolarHBondContact O-N 2.81Å; M389-V391 VanDerWaalsContact C-N 3.32Å; M389-V391 PolarHBondContact O-N 3.48Å; V391-V394 PolarHBondContact O-N 2.98Å; V391-I395 HydrophobicContact CG1-CD1 4.43Å; V391-I395 WeakPolarHBondContact O-CG1 3.28Å; V391-I395 PolarHBondContact O-N 3.29Å; V391-I395 VanDerWaalsContact O-N 3.17Å
392L87.5Confident87.5Confident41 Ų4155.4 Ų55.422%0.21531%0.309CS..Hα-helixtrans-70.2-35.6-179.1-15764.8000111.6S373 T377 L380 Y388 M389 P390 I395 G396S373-L392 WeakPolarHBondContact CB-O 3.35Å; S373-L392 VanDerWaalsContact O-CD2 3.23Å; S373-L392 WeakPolarHBondContact O-CD2 3.43Å; T377-L392 VanDerWaalsContact N-CD2 3.34Å; L380-L392 HydrophobicContact CD1-CB 4.48Å; L380-L392 HydrophobicContact CD1-CD2 3.94Å; Y388-L392 PolarHBondContact O-N 2.93Å; M389-L392 PolarHBondContact O-N 3.36Å; P390-L392 VanDerWaalsContact C-N 3.34Å; P390-L392 PolarHBondContact O-N 2.88Å; L392-I395 HydrophobicContact CD1-CD1 4.29Å; L392-I395 PolarHBondContact O-N 2.98Å; L392-G396 PolarHBondContact O-N 3.36Å
393A83.7Confident87.4Confident10 Ų1048.3 Ų48.38%0.08328%0.282CS..Hα-helixtrans-60.3-44.3172.700000112.1M389 P390 I395 G396 I397 F453M389-A393 WeakPolarHBondContact O-CB 3.3Å; M389-A393 PolarHBondContact O-N 2.94Å; P390-A393 PolarHBondContact O-N 2.92Å; A393-I395 VanDerWaalsContact C-N 3.33Å; A393-I395 PolarHBondContact O-N 2.94Å; A393-G396 WeakPolarHBondContact O-CA 3.24Å; A393-G396 PolarHBondContact O-N 3.2Å; A393-G396 VanDerWaalsContact O-N 3.12Å; A393-I397 WeakPolarHBondContact O-CG1 3.39Å; A393-I397 PolarHBondContact O-N 3.49Å; A393-F453 HydrophobicContact CB-CE1 4.03Å; A393-F453 HydrophobicContact CB-CZ 4.35Å
394V82.1Confident87.1Confident77 Ų7744.8 Ų44.847%0.46726%0.257SS..Hα-helixtrans-62.1-39.6176.6170.70000111.7P390 V391 G396 I397 G398P390-V394 WeakPolarHBondContact O-CG2 3.36Å; P390-V394 PolarHBondContact O-N 3.27Å; V391-V394 PolarHBondContact O-N 2.98Å; V394-G396 VanDerWaalsContact C-N 3.32Å; V394-G396 PolarHBondContact O-N 3.21Å; V394-I397 PolarHBondContact O-N 3.33Å; V394-G398 PolarHBondContact O-N 3.21Å
395I86.1Confident87.1Confident88 Ų8842.2 Ų42.245%0.45123%0.227SC..Hα-helixtrans-61.1-43.7173.7-66.8167.6000110.5I369 V391 L392 A393 I397 G398 A399I369-I395 HydrophobicContact CG2-CG2 4.23Å; V391-I395 HydrophobicContact CG1-CD1 4.43Å; V391-I395 WeakPolarHBondContact O-CG1 3.28Å; V391-I395 PolarHBondContact O-N 3.29Å; V391-I395 VanDerWaalsContact O-N 3.17Å; L392-I395 HydrophobicContact CD1-CD1 4.29Å; L392-I395 PolarHBondContact O-N 2.98Å; A393-I395 VanDerWaalsContact C-N 3.33Å; A393-I395 PolarHBondContact O-N 2.94Å; I395-I397 PolarHBondContact O-N 2.85Å; I395-G398 PolarHBondContact O-N 3.08Å; I395-A399 WeakPolarHBondContact O-CB 3Å; I395-A399 PolarHBondContact O-N 2.8Å
396G86.7Confident87.2Confident1 Ų137.7 Ų37.71%0.0121%0.208CC..Hα-helixtrans-59.2-43.7175.600000113.3S373 L392 A393 V394 A399 I400S373-G396 WeakPolarHBondContact OG-CA 3.17Å; L392-G396 PolarHBondContact O-N 3.36Å; A393-G396 WeakPolarHBondContact O-CA 3.24Å; A393-G396 PolarHBondContact O-N 3.2Å; A393-G396 VanDerWaalsContact O-N 3.12Å; V394-G396 VanDerWaalsContact C-N 3.32Å; V394-G396 PolarHBondContact O-N 3.21Å; G396-A399 PolarHBondContact O-N 3.37Å; G396-I400 PolarHBondContact O-N 2.94Å
397I80.7Confident87.6Confident9 Ų935.6 Ų35.65%0.04619%0.19CC..Hα-helixtrans-63.5-45.4175.2-59.6163.2000110.6I321 Y322 F342 A393 V394 I395 A399 I400I321-I397 HydrophobicContact CB-CD1 3.77Å; I321-I397 HydrophobicContact CB-CG1 3.92Å; I321-I397 HydrophobicContact CD1-CD1 4.28Å; I321-I397 HydrophobicContact CD1-CG1 3.63Å; I321-I397 HydrophobicContact CG1-CG1 4.38Å; I321-I397 HydrophobicContact CG2-CD1 3.21Å; I321-I397 HydrophobicContact CG2-CG1 3.83Å; Y322-I397 HydrophobicContact CE1-CG2 4.19Å; Y322-I397 HydrophobicContact CE2-CG2 4.42Å; Y322-I397 WeakPolarHBondContact OH-CG2 3.46Å; F342-I397 HydrophobicContact CE1-CG2 4.27Å; A393-I397 WeakPolarHBondContact O-CG1 3.39Å; A393-I397 PolarHBondContact O-N 3.49Å; V394-I397 PolarHBondContact O-N 3.33Å; I395-I397 PolarHBondContact O-N 2.85Å; I397-A399 PolarHBondContact O-N 3.34Å; I397-I400 WeakPolarHBondContact O-CG2 3.31Å; I397-I400 PolarHBondContact O-N 3.15Å
398G83.8Confident87.8Confident12 Ų1230.7 Ų30.712%0.12417%0.167CC..Hα-helixtrans-60.7-34.8178.300000113F342 V394 I395 P402F342-G398 VanDerWaalsContact CE1-CA 3.4Å; F342-G398 VanDerWaalsContact CZ-CA 3.41Å; V394-G398 PolarHBondContact O-N 3.21Å; I395-G398 PolarHBondContact O-N 3.08Å; G398-P402 WeakPolarHBondContact O-CD 3.39Å
399A89.8Confident88Confident12 Ų1225 Ų2510%0.09915%0.145CC..Hα-helixtrans-73.8-25.217900000113.6S366 I369 I395 G396 I397 P402S366-A399 VanDerWaalsContact CB-O 3.24Å; S366-A399 WeakPolarHBondContact CB-O 3.33Å; I369-A399 HydrophobicContact CB-CB 3.85Å; I369-A399 HydrophobicContact CG2-CB 3.55Å; I395-A399 WeakPolarHBondContact O-CB 3Å; I395-A399 PolarHBondContact O-N 2.8Å; G396-A399 PolarHBondContact O-N 3.37Å; I397-A399 PolarHBondContact O-N 3.34Å; A399-P402 WeakPolarHBondContact O-CD 3.41Å
400I88.6Confident88.3Confident0 Ų023.9 Ų23.90%014%0.14CC..Hα-helixtrans-79-24.5-178.5-152.365000113.3S318 T370 G396 I397 M403 W404S318-I400 VanDerWaalsContact OG-CG2 3.3Å; S318-I400 WeakPolarHBondContact OG-CG2 3.47Å; T370-I400 HydrophobicContact CG2-CD1 4.29Å; G396-I400 PolarHBondContact O-N 2.94Å; I397-I400 WeakPolarHBondContact O-CG2 3.31Å; I397-I400 PolarHBondContact O-N 3.15Å; I400-M403 HydrophobicContact CD1-CB 4.29Å; I400-M403 HydrophobicContact CD1-CG 4.41Å; I400-M403 HydrophobicContact CD1-SD 3.75Å; I400-M403 HydrophobicContact CG1-SD 4.19Å; I400-M403 WeakPolarHBondContact O-CA 3.3Å; I400-M403 VanDerWaalsContact O-CB 3.24Å; I400-M403 WeakPolarHBondContact O-CB 3.24Å; I400-M403 PolarHBondContact O-N 2.85Å; I400-M403 VanDerWaalsContact O-N 3.13Å; I400-W404 VanDerWaalsContact O-CD1 3.3Å; I400-W404 PolarHBondContact O-N 3.3Å; I400-W404 VanDerWaalsContact O-N 3.1Å
401D88Confident88.8Confident7 Ų720 Ų204%0.03711%0.114CC..Hα-helixtrans-65.9-42.6-179.1-79.4-28.1000113.9K343 T346 M403 W404 K405K343-D401 WeakPolarHBondContact CA-OD2 3.07Å; K343-D401 WeakPolarHBondContact CG-OD2 3.36Å; T346-D401 WeakPolarHBondContact OG1-CB 3.48Å; T346-D401 PolarHBondContact OG1-OD2 3.29Å; D401-M403 PolarHBondContact O-N 3.29Å; D401-W404 WeakPolarHBondContact O-CB 3.24Å; D401-W404 PolarHBondContact O-N 2.83Å; D401-K405 PolarHBondContact O-N 2.86Å
402P91.5Very high89Confident8 Ų815.7 Ų15.75%0.0529%0.088CC..Hα-helixtrans-52.2-39.9167.3-31.937.2000113.5I349 P350 S366 G398 A399 K405 I406I349-P402 HydrophobicContact CB-CG 4.43Å; I349-P402 HydrophobicContact CD1-CG 4.49Å; P350-P402 HydrophobicContact CG-CB 3.79Å; S366-P402 WeakPolarHBondContact OG-CB 3.21Å; G398-P402 WeakPolarHBondContact O-CD 3.39Å; A399-P402 WeakPolarHBondContact O-CD 3.41Å; P402-K405 PolarHBondContact O-N 3.13Å; P402-I406 PolarHBondContact O-N 3.39Å; P402-I406 VanDerWaalsContact O-N 3.1Å
403M92.4Very high89.1Confident0 Ų014.3 Ų14.30%08%0.081CC..Hα-helixtrans-60.3-45.4174.5175-117.273.800110.9L363 I367 I400 D401 K405 I406 N407L363-M403 HydrophobicContact CD1-CB 3.91Å; L363-M403 HydrophobicContact CD1-CG 3.16Å; I367-M403 HydrophobicContact CD1-CG 4.38Å; I367-M403 HydrophobicContact CG1-CG 4.01Å; I400-M403 HydrophobicContact CD1-CB 4.29Å; I400-M403 HydrophobicContact CD1-CG 4.41Å; I400-M403 HydrophobicContact CD1-SD 3.75Å; I400-M403 HydrophobicContact CG1-SD 4.19Å; I400-M403 WeakPolarHBondContact O-CA 3.3Å; I400-M403 VanDerWaalsContact O-CB 3.24Å; I400-M403 WeakPolarHBondContact O-CB 3.24Å; I400-M403 PolarHBondContact O-N 2.85Å; I400-M403 VanDerWaalsContact O-N 3.13Å; D401-M403 PolarHBondContact O-N 3.29Å; M403-K405 VanDerWaalsContact C-N 3.26Å; M403-K405 PolarHBondContact O-N 3.44Å; M403-I406 PolarHBondContact O-N 2.69Å; M403-N407 HydrophobicContact CE-CB 4.35Å; M403-N407 WeakPolarHBondContact CE-ND2 3.43Å; M403-N407 VanDerWaalsContact O-CB 3.29Å; M403-N407 WeakPolarHBondContact O-CB 3.3Å; M403-N407 PolarHBondContact O-N 2.9Å
404W90.7Very high89.5Confident31 Ų3115.1 Ų15.112%0.1178%0.084CC..Hα-helixtrans-56.9-41.8179.4-81.3109.1000112.2W311 G314 S318 I400 D401 N407 H408W311-W404 HydrophobicContact CB-CZ3 4.35Å; W311-W404 HydrophobicContact CD2-CE3 4.46Å; W311-W404 AromaticContact CD2-CZ3 3.76Å; W311-W404 HydrophobicContact CD2-CZ3 3.76Å; W311-W404 AromaticContact CE3-CZ3 3.72Å; W311-W404 HydrophobicContact CE3-CZ3 3.72Å; W311-W404 HydrophobicContact CG-CZ3 4.05Å; W311-W404 HydrophobicContact CZ3-CZ3 4.39Å; W311-W404 WeakPolarHBondContact O-CH2 3.13Å; G314-W404 VanDerWaalsContact C-CZ2 3.49Å; S318-W404 PolarHBondContact OG-NE1 3.43Å; I400-W404 VanDerWaalsContact O-CD1 3.3Å; I400-W404 PolarHBondContact O-N 3.3Å; I400-W404 VanDerWaalsContact O-N 3.1Å; D401-W404 WeakPolarHBondContact O-CB 3.24Å; D401-W404 PolarHBondContact O-N 2.83Å; W404-N407 WeakPolarHBondContact O-CB 2.79Å; W404-N407 PolarHBondContact O-N 3.3Å; W404-H408 PolarHBondContact O-CD2 2.95Å; W404-H408 PolarHBondContact O-N 2.88Å
405K92.1Very high89.9Confident11 Ų1111.5 Ų11.55%0.0486%0.061CC..Hα-helixtrans-67-49.7178.6-59.4-68.3-173.51680111.1N192 C193 G347 P350 D401 P402 M403 N407 H408 L409N192-K405 PolarHBondContact ND2-O 2.95Å; C193-K405 PolarHBondContact O-NZ 3.16Å; G347-K405 WeakPolarHBondContact O-CG 3.45Å; P350-K405 HydrophobicContact CG-CB 4.14Å; D401-K405 PolarHBondContact O-N 2.86Å; P402-K405 PolarHBondContact O-N 3.13Å; M403-K405 VanDerWaalsContact C-N 3.26Å; M403-K405 PolarHBondContact O-N 3.44Å; K405-N407 PolarHBondContact O-N 3.38Å; K405-H408 PolarHBondContact O-N 3.43Å; K405-L409 PolarHBondContact O-N 3.24Å
406I93.2Very high90Very high0 Ų07.6 Ų7.60%04%0.042CC..Hα-helixtrans-57.8-42.5177.5-63.1-57.2000111M189 P350 R359 I362 L363 P402 M403 L409 M410M189-I406 HydrophobicContact CE-CD1 3.3Å; M189-I406 HydrophobicContact SD-CD1 4.18Å; P350-I406 HydrophobicContact CB-CD1 3.9Å; P350-I406 HydrophobicContact CB-CG1 4.43Å; R359-I406 HydrophobicContact CB-CD1 4.29Å; R359-I406 HydrophobicContact CB-CG2 4.08Å; R359-I406 HydrophobicContact CG-CD1 4.45Å; I362-I406 HydrophobicContact CB-CD1 4.18Å; I362-I406 HydrophobicContact CB-CG1 4.08Å; I362-I406 HydrophobicContact CD1-CD1 4.31Å; I362-I406 HydrophobicContact CG2-CD1 4.09Å; I362-I406 HydrophobicContact CG2-CG1 3.8Å; L363-I406 HydrophobicContact CB-CB 4.28Å; L363-I406 HydrophobicContact CB-CG2 3.84Å; L363-I406 HydrophobicContact CD2-CG2 4.38Å; P402-I406 PolarHBondContact O-N 3.39Å; P402-I406 VanDerWaalsContact O-N 3.1Å; M403-I406 PolarHBondContact O-N 2.69Å; I406-L409 PolarHBondContact O-N 3.08Å; I406-M410 HydrophobicContact CG2-CE 3.96Å; I406-M410 HydrophobicContact CG2-CG 3.96Å; I406-M410 HydrophobicContact CG2-SD 3.78Å; I406-M410 WeakPolarHBondContact O-CB 3.34Å; I406-M410 WeakPolarHBondContact O-CG 3.31Å; I406-M410 PolarHBondContact O-N 3.32Å
407N93.2Very high90Very high0 Ų07.6 Ų7.60%04%0.042CC..Hα-helixtrans-60.5-46177.2-92.14.9000113.8S310 W311 M403 W404 K405 L409 M410 S411S310-N407 WeakPolarHBondContact CB-ND2 3.44Å; S310-N407 PolarHBondContact OG-ND2 3.01Å; S310-N407 PolarHBondContact OG-OD1 3.27Å; W311-N407 VanDerWaalsContact CD1-ND2 3.34Å; M403-N407 HydrophobicContact CE-CB 4.35Å; M403-N407 WeakPolarHBondContact CE-ND2 3.43Å; M403-N407 VanDerWaalsContact O-CB 3.29Å; M403-N407 WeakPolarHBondContact O-CB 3.3Å; M403-N407 PolarHBondContact O-N 2.9Å; W404-N407 WeakPolarHBondContact O-CB 2.79Å; W404-N407 PolarHBondContact O-N 3.3Å; K405-N407 PolarHBondContact O-N 3.38Å; N407-L409 VanDerWaalsContact C-N 3.28Å; N407-L409 PolarHBondContact O-N 2.83Å; N407-M410 PolarHBondContact O-N 3.47Å; N407-S411 WeakPolarHBondContact O-CB 3.42Å; N407-S411 PolarHBondContact O-N 3.02Å; N407-S411 PolarHBondContact O-OG 3.48Å
408H91.6Very high90.3Very high23 Ų237.5 Ų7.511%0.1064%0.042CC..Hα-helixtrans-59.5-41.3174.4-83.8-67.3000111.5N192 W311 W404 K405 S411 R424N192-H408 WeakPolarHBondContact OD1-CB 3.25Å; W311-H408 AromaticContact CH2-CE1 3.14Å; W311-H408 WeakPolarHBondContact CH2-CE1 3.36Å; W311-H408 AromaticContact CH2-ND1 3.26Å; W311-H408 VanDerWaalsContact CH2-ND1 3.26Å; W311-H408 WeakPolarHBondContact CH2-ND1 3.06Å; W311-H408 AromaticContact CH2-NE2 3.99Å; W311-H408 AromaticContact CZ2-CE1 3.73Å; W311-H408 AromaticContact CZ2-CG 3.99Å; W311-H408 AromaticContact CZ2-ND1 3.45Å; W311-H408 WeakPolarHBondContact CZ2-ND1 3.46Å; W311-H408 AromaticContact CZ3-CE1 3.88Å; W404-H408 PolarHBondContact O-CD2 2.95Å; W404-H408 PolarHBondContact O-N 2.88Å; K405-H408 PolarHBondContact O-N 3.43Å; H408-S411 PolarHBondContact O-OG 3.36Å; H408-R424 PolarHBondContact O-NH1 3.12Å; H408-R424 VanDerWaalsContact O-NH1 3.13Å
409L91.9Very high90.7Very high0 Ų07 Ų70%04%0.036CC..Hα-helixtrans-69.3-48.8178.4-179.763.1000112R188 M189 N192 R359 K405 I406 N407 S411 V412 E413R188-L409 HydrophobicContact CB-CD1 3.65Å; M189-L409 HydrophobicContact CB-CD2 4.2Å; M189-L409 HydrophobicContact CE-CD2 3.29Å; M189-L409 HydrophobicContact SD-CD2 3.8Å; N192-L409 HydrophobicContact CB-CB 4.33Å; N192-L409 HydrophobicContact CB-CD1 4.44Å; N192-L409 PolarHBondContact OD1-N 3.09Å; R359-L409 HydrophobicContact CG-CD2 4.29Å; K405-L409 PolarHBondContact O-N 3.24Å; I406-L409 PolarHBondContact O-N 3.08Å; N407-L409 VanDerWaalsContact C-N 3.28Å; N407-L409 PolarHBondContact O-N 2.83Å; L409-S411 PolarHBondContact O-N 3.14Å; L409-V412 WeakPolarHBondContact O-CA 3.42Å; L409-V412 WeakPolarHBondContact O-CB 3.39Å; L409-V412 PolarHBondContact O-N 2.83Å; L409-E413 HydrophobicContact CD1-CG 3.95Å; L409-E413 HydrophobicContact CG-CG 4.09Å; L409-E413 PolarHBondContact O-N 2.9Å
410M92.5Very high90.9Very high0 Ų06.4 Ų6.40%03%0.031CC..Hα-helixtrans-60.6-34.1179.4-77.5-172.1165.200111.8L307 R359 K360 L363 I406 N407 V412 E413 L414 L471 T474L307-M410 HydrophobicContact CD2-CB 4.28Å; R359-M410 HydrophobicContact CB-CE 3.55Å; K360-M410 HydrophobicContact CB-CE 4.01Å; L363-M410 HydrophobicContact CD2-SD 4.07Å; I406-M410 HydrophobicContact CG2-CE 3.96Å; I406-M410 HydrophobicContact CG2-CG 3.96Å; I406-M410 HydrophobicContact CG2-SD 3.78Å; I406-M410 WeakPolarHBondContact O-CB 3.34Å; I406-M410 WeakPolarHBondContact O-CG 3.31Å; I406-M410 PolarHBondContact O-N 3.32Å; N407-M410 PolarHBondContact O-N 3.47Å; M410-V412 PolarHBondContact O-N 3.33Å; M410-E413 PolarHBondContact O-N 3.42Å; M410-L414 HydrophobicContact CB-CD1 4.04Å; M410-L414 VanDerWaalsContact O-CB 3.26Å; M410-L414 WeakPolarHBondContact O-CB 3.48Å; M410-L414 WeakPolarHBondContact O-CG 3.08Å; M410-L414 PolarHBondContact O-N 3.46Å; M410-L471 HydrophobicContact CE-CD2 4.31Å; M410-L471 HydrophobicContact SD-CD2 3.4Å; M410-L471 WeakPolarHBondContact SD-CD2 3.39Å; M410-L471 HydrophobicContact SD-CG 4.23Å; M410-T474 HydrophobicContact CG-CG2 4.29Å
411S92Very high91.1Very high0 Ų06.4 Ų6.40%03%0.031CC..Hα-helixtrans-64.1-22.4172.576.40000113.5N407 H408 L409 F415 R424N407-S411 WeakPolarHBondContact O-CB 3.42Å; N407-S411 PolarHBondContact O-N 3.02Å; N407-S411 PolarHBondContact O-OG 3.48Å; H408-S411 PolarHBondContact O-OG 3.36Å; L409-S411 PolarHBondContact O-N 3.14Å; S411-F415 WeakPolarHBondContact O-CD2 3.3Å; S411-R424 PolarHBondContact OG-NH1 3.12Å
412V90.8Very high91.4Very high0 Ų06.1 Ų6.10%03%0.03CC..Hα-helixtrans-88.4-39.8172.5178.60000111.1V176 V177 V180 L409 M410 R420 L479V176-V412 HydrophobicContact CG1-CG2 4.44Å; V177-V412 HydrophobicContact CG2-CG2 4.5Å; V180-V412 HydrophobicContact CB-CG1 3.77Å; V180-V412 HydrophobicContact CG1-CB 4.25Å; V180-V412 HydrophobicContact CG1-CG1 3.26Å; V180-V412 HydrophobicContact CG2-CG1 4.3Å; L409-V412 WeakPolarHBondContact O-CA 3.42Å; L409-V412 WeakPolarHBondContact O-CB 3.39Å; L409-V412 PolarHBondContact O-N 2.83Å; M410-V412 PolarHBondContact O-N 3.33Å; V412-R420 PolarHBondContact O-NE 3.49Å; V412-L479 HydrophobicContact CG1-CD2 4.45Å
413E90.2Very high91.6Very high11 Ų115.8 Ų5.85%0.0513%0.027CC..Hα-helixtrans-76.4-29.8-174.5-67.8-174.6151.400113.9R359 L409 M410 T474 L479 P480R359-E413 IonicContact NH1-OE1 3.56Å; R359-E413 PolarHBondContact NH1-OE1 2.78Å; R359-E413 VanDerWaalsContact NH1-OE1 3.1Å; R359-E413 IonicContact NH1-OE2 3.57Å; R359-E413 PolarHBondContact NH1-OE2 3.35Å; L409-E413 HydrophobicContact CD1-CG 3.95Å; L409-E413 HydrophobicContact CG-CG 4.09Å; L409-E413 PolarHBondContact O-N 2.9Å; M410-E413 PolarHBondContact O-N 3.42Å; E413-T474 HydrophobicContact CB-CG2 4.14Å; E413-T474 WeakPolarHBondContact OE2-CB 3.43Å; E413-T474 PolarHBondContact OE2-OG1 3.05Å; E413-L479 HydrophobicContact CB-CD2 4.37Å; E413-L479 HydrophobicContact CG-CD2 4.16Å; E413-P480 WeakPolarHBondContact O-CD 3.35Å
414L91.3Very high91.7Very high28 Ų285.9 Ų5.915%0.1473%0.028CC..SBendtrans-89.2-29-178.1-67169.5000113.3P303 L307 M410 L471 P472 T474P303-L414 HydrophobicContact CB-CB 4.36Å; P303-L414 HydrophobicContact CB-CD1 4.16Å; L307-L414 HydrophobicContact CD1-CD1 4.13Å; M410-L414 HydrophobicContact CB-CD1 4.04Å; M410-L414 VanDerWaalsContact O-CB 3.26Å; M410-L414 WeakPolarHBondContact O-CB 3.48Å; M410-L414 WeakPolarHBondContact O-CG 3.08Å; M410-L414 PolarHBondContact O-N 3.46Å; L414-L471 HydrophobicContact CD1-CD1 3.59Å; L414-L471 HydrophobicContact CD1-CG 4.14Å; L414-P472 HydrophobicContact CD2-CG 3.7Å; L414-T474 HydrophobicContact CD1-CG2 4.38Å; L414-T474 HydrophobicContact CD2-CG2 3.49Å; L414-T474 VanDerWaalsContact CD2-CG2 3.49Å; L414-T474 HydrophobicContact CG-CG2 3.75Å
415F91.4Very high91.9Very high0 Ų04.4 Ų4.40%02%0.022CC..SBendtrans-92.5132.3-174.4-59-43.1000112.5V300 P303 L304 L307 S411 R420 S423 V427V300-F415 HydrophobicContact CG1-CD1 4.04Å; V300-F415 HydrophobicContact CG1-CE1 4.36Å; P303-F415 HydrophobicContact CB-CE1 4.05Å; L304-F415 HydrophobicContact CB-CE1 4.05Å; L304-F415 HydrophobicContact CB-CZ 4.17Å; L304-F415 HydrophobicContact CD1-CE1 4.1Å; L304-F415 HydrophobicContact CD1-CE2 4.26Å; L304-F415 HydrophobicContact CD1-CZ 3.7Å; L307-F415 HydrophobicContact CD1-CE2 3.95Å; L307-F415 HydrophobicContact CD1-CZ 3.75Å; S411-F415 WeakPolarHBondContact O-CD2 3.3Å; F415-R420 HydrophobicContact CB-CB 4.46Å; F415-R420 PolarHBondContact O-NE 2.94Å; F415-R420 PolarHBondContact O-NH2 3.38Å; F415-R420 VanDerWaalsContact O-NH2 3.07Å; F415-S423 VanDerWaalsContact CE2-CB 3.44Å; F415-S423 WeakPolarHBondContact CG-OG 3.33Å; F415-V427 HydrophobicContact CE2-CG2 4.16Å; F415-V427 HydrophobicContact CZ-CG2 4.28Å
416P88.3Confident92Very high6 Ų66 Ų64%0.0393%0.033CC..  trans-58.8143.8178.9-2533.9000112.9V300 V418 V419 R420 P480 M483V300-P416 HydrophobicContact CG2-CG 4.02Å; P416-V418 HydrophobicContact CB-CG2 4.08Å; P416-V418 PolarHBondContact O-N 3.46Å; P416-V418 VanDerWaalsContact O-N 3.09Å; P416-V419 HydrophobicContact CB-CG2 4.21Å; P416-V419 HydrophobicContact CG-CG2 4.31Å; P416-V419 CarbonylContact O-C 3.46Å; P416-V419 PolarHBondContact O-N 3.45Å; P416-R420 WeakPolarHBondContact O-CA 3.27Å; P416-R420 WeakPolarHBondContact O-CB 3.5Å; P416-R420 PolarHBondContact O-N 3.01Å; P416-P480 CarbonylContact C-O 3.56Å; P416-P480 VanDerWaalsContact CA-O 3.23Å; P416-P480 WeakPolarHBondContact CA-O 3.23Å; P416-P480 HydrophobicContact CB-CB 4.34Å; P416-P480 HydrophobicContact CG-CB 4.19Å; P416-P480 HydrophobicContact CG-CG 4.45Å; P416-M483 HydrophobicContact CB-CG 4.38Å; P416-M483 HydrophobicContact CG-CG 4.03Å
417T86.8Confident92Very high1 Ų16 Ų61%0.0063%0.033CC..THydrogen-bonded Turntrans-51.2-38.1-177-590000113.3R129 R240 Q244 V419 R420 P480 E481R129-T417 PolarHBondContact NH2-O 2.71Å; R240-T417 HydrophobicContact CB-CG2 4.05Å; Q244-T417 HydrophobicContact CG-CG2 4Å; T417-V419 VanDerWaalsContact C-N 3.29Å; T417-V419 PolarHBondContact O-N 3Å; T417-R420 VanDerWaalsContact CA-NH1 3.35Å; T417-R420 PolarHBondContact OG1-NH1 3Å; T417-R420 PolarHBondContact OG1-NH2 3.16Å; T417-P480 PolarHBondContact N-O 3.22Å; T417-P480 PolarHBondContact OG1-O 3.45Å; T417-E481 VanDerWaalsContact CB-OE2 3.29Å; T417-E481 WeakPolarHBondContact CB-OE2 3.38Å; T417-E481 PolarHBondContact N-O 3.37Å; T417-E481 PolarHBondContact OG1-OE2 3.25Å
418V87.1Confident91.9Very high8 Ų86.4 Ų6.45%0.0484%0.035CC..THydrogen-bonded Turntrans-66.6-21.6-179.8-67.50000115.4Q244 Y289 P416 E481Q244-V418 HydrophobicContact CB-CG1 3.87Å; Q244-V418 HydrophobicContact CG-CG1 4.18Å; Y289-V418 HydrophobicContact CD2-CB 3.66Å; Y289-V418 HydrophobicContact CD2-CG1 4.36Å; Y289-V418 HydrophobicContact CD2-CG2 4.01Å; Y289-V418 HydrophobicContact CE2-CB 3.48Å; Y289-V418 VanDerWaalsContact CE2-CB 3.48Å; Y289-V418 HydrophobicContact CE2-CG1 3.8Å; Y289-V418 HydrophobicContact CE2-CG2 3.63Å; P416-V418 HydrophobicContact CB-CG2 4.08Å; P416-V418 PolarHBondContact O-N 3.46Å; P416-V418 VanDerWaalsContact O-N 3.09Å; V418-E481 PolarHBondContact N-O 3.16Å
419V91.3Very high91.9Very high0 Ų06.5 Ų6.50%04%0.037CC..THydrogen-bonded Turntrans-130.48.9-178.8-61.30000113.1D125 Y289 L294 P416 T417 S421 M422 S423 M483D125-V419 VanDerWaalsContact OD2-CA 3.25Å; D125-V419 WeakPolarHBondContact OD2-CA 3.44Å; Y289-V419 HydrophobicContact CD1-CG1 4.25Å; Y289-V419 HydrophobicContact CD2-CG1 4.44Å; Y289-V419 HydrophobicContact CG-CG1 3.88Å; L294-V419 HydrophobicContact CG-CB 4.48Å; P416-V419 HydrophobicContact CB-CG2 4.21Å; P416-V419 HydrophobicContact CG-CG2 4.31Å; P416-V419 CarbonylContact O-C 3.46Å; P416-V419 PolarHBondContact O-N 3.45Å; T417-V419 VanDerWaalsContact C-N 3.29Å; T417-V419 PolarHBondContact O-N 3Å; V419-S421 VanDerWaalsContact C-N 3.35Å; V419-S421 PolarHBondContact O-N 3.33Å; V419-M422 HydrophobicContact CB-CE 3.85Å; V419-M422 HydrophobicContact CG1-CE 3.58Å; V419-M422 PolarHBondContact O-N 3.27Å; V419-S423 PolarHBondContact O-N 3.2Å; V419-S423 PolarHBondContact O-OG 2.8Å; V419-S423 VanDerWaalsContact O-OG 3.05Å; V419-M483 HydrophobicContact CG1-CE 3.99Å; V419-M483 HydrophobicContact CG1-SD 4.02Å; V419-M483 HydrophobicContact CG2-CG 4.16Å; V419-M483 HydrophobicContact CG2-SD 4.05Å
420R93.3Very high92Very high0 Ų07.5 Ų7.50%04%0.044CC..Hα-helixtrans-61.1-42.3-170.1178.6-179.4-74.2123.216.8112.2D125 V177 E181 V412 F415 P416 T417 R424 P480D125-R420 PolarHBondContact OD2-N 3.13Å; V177-R420 HydrophobicContact CG2-CG 4.34Å; E181-R420 IonicContact OE1-CZ 3.69Å; E181-R420 IonicContact OE1-NH1 3.38Å; E181-R420 PolarHBondContact OE1-NH1 3.27Å; V412-R420 PolarHBondContact O-NE 3.49Å; F415-R420 HydrophobicContact CB-CB 4.46Å; F415-R420 PolarHBondContact O-NE 2.94Å; F415-R420 PolarHBondContact O-NH2 3.38Å; F415-R420 VanDerWaalsContact O-NH2 3.07Å; P416-R420 WeakPolarHBondContact O-CA 3.27Å; P416-R420 WeakPolarHBondContact O-CB 3.5Å; P416-R420 PolarHBondContact O-N 3.01Å; T417-R420 VanDerWaalsContact CA-NH1 3.35Å; T417-R420 PolarHBondContact OG1-NH1 3Å; T417-R420 PolarHBondContact OG1-NH2 3.16Å; R420-R424 WeakPolarHBondContact O-CB 3.34Å; R420-R424 WeakPolarHBondContact O-CG 3.45Å; R420-R424 PolarHBondContact O-N 2.72Å; R420-R424 VanDerWaalsContact O-N 3.09Å; R420-P480 PolarHBondContact NH2-O 3.48Å
421S94Very high91.9Very high0 Ų07.5 Ų7.50%04%0.044CC..Hα-helixtrans-74.6-37.4-178.1-47.40000110.6G121 D125 R129 V173 V419 R424 G425G121-S421 VanDerWaalsContact O-CB 3.27Å; G121-S421 WeakPolarHBondContact O-CB 3.15Å; D125-S421 VanDerWaalsContact OD1-CB 3.22Å; D125-S421 WeakPolarHBondContact OD1-CB 3.5Å; D125-S421 PolarHBondContact OD1-N 3.37Å; D125-S421 VanDerWaalsContact OD1-N 3.13Å; D125-S421 PolarHBondContact OD1-OG 2.84Å; D125-S421 PolarHBondContact OD2-N 3.07Å; R129-S421 VanDerWaalsContact CZ-OG 3.29Å; R129-S421 PolarHBondContact NH1-OG 3.26Å; R129-S421 VanDerWaalsContact NH1-OG 3.16Å; V173-S421 VanDerWaalsContact CG1-O 3.24Å; V173-S421 WeakPolarHBondContact CG1-O 3.44Å; V419-S421 VanDerWaalsContact C-N 3.35Å; V419-S421 PolarHBondContact O-N 3.33Å; S421-R424 PolarHBondContact O-N 2.8Å; S421-G425 PolarHBondContact O-N 3.17Å
422M94.8Very high91.6Very high2 Ų28.1 Ų8.11%0.015%0.047CC..Hα-helixtrans-59.7-50.5171.7-74.8-172-7200111.6G121 Y122 D125 Y291 L294 V419 R424 G425 V426G121-M422 PolarHBondContact O-N 2.71Å; Y122-M422 HydrophobicContact CD2-SD 3.79Å; D125-M422 HydrophobicContact CB-CE 4.13Å; D125-M422 HydrophobicContact CB-CG 4.42Å; D125-M422 WeakPolarHBondContact OD2-CG 3.48Å; D125-M422 PolarHBondContact OD2-N 2.64Å; Y291-M422 HydrophobicContact CD1-CB 4.18Å; Y291-M422 HydrophobicContact CD2-SD 4.46Å; Y291-M422 HydrophobicContact CE1-CB 3.57Å; Y291-M422 HydrophobicContact CE1-CG 3.92Å; Y291-M422 WeakPolarHBondContact CE1-O 3.31Å; Y291-M422 HydrophobicContact CE2-CG 4.24Å; Y291-M422 HydrophobicContact CE2-SD 4.38Å; L294-M422 HydrophobicContact CD1-CB 4.08Å; L294-M422 HydrophobicContact CD1-SD 4.48Å; V419-M422 HydrophobicContact CB-CE 3.85Å; V419-M422 HydrophobicContact CG1-CE 3.58Å; V419-M422 PolarHBondContact O-N 3.27Å; M422-R424 VanDerWaalsContact C-N 3.32Å; M422-R424 PolarHBondContact O-N 3.48Å; M422-G425 WeakPolarHBondContact O-CA 3.31Å; M422-G425 PolarHBondContact O-N 3.43Å; M422-V426 PolarHBondContact O-N 3.16Å
423S95.5Very high91.4Very high0 Ų012 Ų120%07%0.067CC..Hα-helixtrans-57.9-45.1177.6-57.70000111.8L294 F415 V419 G425 V426 V427L294-S423 WeakPolarHBondContact CD2-OG 3.49Å; F415-S423 VanDerWaalsContact CE2-CB 3.44Å; F415-S423 WeakPolarHBondContact CG-OG 3.33Å; V419-S423 PolarHBondContact O-N 3.2Å; V419-S423 PolarHBondContact O-OG 2.8Å; V419-S423 VanDerWaalsContact O-OG 3.05Å; S423-G425 VanDerWaalsContact C-N 3.29Å; S423-G425 PolarHBondContact O-N 3.32Å; S423-V426 PolarHBondContact O-N 3.2Å; S423-V427 WeakPolarHBondContact O-CG2 3.49Å; S423-V427 PolarHBondContact O-N 3.36Å
424R94.3Very high91.4Very high2 Ų211.5 Ų11.51%0.0087%0.065CC..Hα-helixtrans-63.7-35.1175.3-76.4178.760.2106.14112.4V173 V176 H408 S411 R420 S421 M422 V427 N428V173-R424 HydrophobicContact CG1-CB 3.88Å; V173-R424 PolarHBondContact O-NE 3.01Å; V173-R424 PolarHBondContact O-NH2 3.29Å; V176-R424 VanDerWaalsContact CB-NH2 3.3Å; H408-R424 PolarHBondContact O-NH1 3.12Å; H408-R424 VanDerWaalsContact O-NH1 3.13Å; S411-R424 PolarHBondContact OG-NH1 3.12Å; R420-R424 WeakPolarHBondContact O-CB 3.34Å; R420-R424 WeakPolarHBondContact O-CG 3.45Å; R420-R424 PolarHBondContact O-N 2.72Å; R420-R424 VanDerWaalsContact O-N 3.09Å; S421-R424 PolarHBondContact O-N 2.8Å; M422-R424 VanDerWaalsContact C-N 3.32Å; M422-R424 PolarHBondContact O-N 3.48Å; R424-V427 PolarHBondContact O-N 2.97Å; R424-N428 VanDerWaalsContact O-CB 3.27Å; R424-N428 WeakPolarHBondContact O-CB 3.34Å; R424-N428 PolarHBondContact O-N 3.04Å
425G93.9Very high90.9Very high0 Ų010.8 Ų10.80%06%0.062CC..Hα-helixtrans-55.6-52.3171.700000111.4S117 S421 M422 S423 V427 N428 V429S117-G425 WeakPolarHBondContact O-CA 3.44Å; S421-G425 PolarHBondContact O-N 3.17Å; M422-G425 WeakPolarHBondContact O-CA 3.31Å; M422-G425 PolarHBondContact O-N 3.43Å; S423-G425 VanDerWaalsContact C-N 3.29Å; S423-G425 PolarHBondContact O-N 3.32Å; G425-V427 PolarHBondContact O-N 3.49Å; G425-N428 PolarHBondContact O-N 3.25Å; G425-V429 WeakPolarHBondContact O-CG2 3.33Å; G425-V429 PolarHBondContact O-N 3.13Å
426V94.5Very high90.4Very high46 Ų4614.6 Ų14.628%0.2798%0.082SC..Hα-helixtrans-59.7-47.6177.9177.90000111.6Y291 L304 M422 S423 N428 V429 S430Y291-V426 HydrophobicContact CD1-CG2 3.89Å; Y291-V426 HydrophobicContact CE1-CG2 3.77Å; L304-V426 HydrophobicContact CD1-CB 4.17Å; L304-V426 HydrophobicContact CD1-CG1 4.31Å; L304-V426 HydrophobicContact CD2-CG1 4.29Å; L304-V426 HydrophobicContact CG-CG1 4.37Å; M422-V426 PolarHBondContact O-N 3.16Å; S423-V426 PolarHBondContact O-N 3.2Å; V426-N428 VanDerWaalsContact C-N 3.31Å; V426-N428 PolarHBondContact O-N 3.47Å; V426-V429 WeakPolarHBondContact O-CB 3.08Å; V426-V429 PolarHBondContact O-N 3.27Å; V426-S430 PolarHBondContact O-N 3.07Å; V426-S430 PolarHBondContact O-OG 3.35Å
427V94.4Very high90.3Very high0 Ų017 Ų170%010%0.096CC..Hα-helixtrans-63.4-37.4179.7173.50000111.6L304 L307 W311 F415 S423 R424 G425 S430 S431L304-V427 HydrophobicContact CD1-CG2 3.82Å; L307-V427 HydrophobicContact CB-CG1 4.29Å; L307-V427 HydrophobicContact CB-CG2 4.07Å; W311-V427 HydrophobicContact CB-CG1 3.98Å; W311-V427 HydrophobicContact CD2-CG1 3.33Å; W311-V427 HydrophobicContact CE3-CG1 3.98Å; W311-V427 HydrophobicContact CG-CG1 3.31Å; W311-V427 HydrophobicContact CZ2-CG1 4.03Å; W311-V427 VanDerWaalsContact NE1-CG1 3.31Å; F415-V427 HydrophobicContact CE2-CG2 4.16Å; F415-V427 HydrophobicContact CZ-CG2 4.28Å; S423-V427 WeakPolarHBondContact O-CG2 3.49Å; S423-V427 PolarHBondContact O-N 3.36Å; R424-V427 PolarHBondContact O-N 2.97Å; G425-V427 PolarHBondContact O-N 3.49Å; V427-S430 WeakPolarHBondContact O-CB 3.42Å; V427-S430 PolarHBondContact O-N 3.2Å; V427-S431 PolarHBondContact O-N 3.38Å
428N90.9Very high90.3Very high8 Ų817 Ų174%0.04310%0.096CC..Hα-helixtrans-68.2-35.6177-166.342.9000112.2S117 V173 W311 R424 G425 V426 S430 S431 R432S117-N428 PolarHBondContact OG-ND2 2.68Å; V173-N428 HydrophobicContact CG2-CB 3.98Å; W311-N428 HydrophobicContact CZ3-CB 4.07Å; W311-N428 WeakPolarHBondContact CZ3-OD1 3.49Å; R424-N428 VanDerWaalsContact O-CB 3.27Å; R424-N428 WeakPolarHBondContact O-CB 3.34Å; R424-N428 PolarHBondContact O-N 3.04Å; G425-N428 PolarHBondContact O-N 3.25Å; V426-N428 VanDerWaalsContact C-N 3.31Å; V426-N428 PolarHBondContact O-N 3.47Å; N428-S430 PolarHBondContact O-N 2.85Å; N428-S431 WeakPolarHBondContact O-CB 3.36Å; N428-S431 PolarHBondContact O-N 2.95Å; N428-S431 VanDerWaalsContact O-N 3.12Å; N428-R432 PolarHBondContact O-N 3.42Å
429V91.9Very high89.9Confident24 Ų2418.6 Ų18.615%0.14511%0.107CC..Hα-helixtrans-57.1-41.6172.7171.40000110.6V114 I118 G425 V426 S431 R432 L433V114-V429 HydrophobicContact CG1-CG1 4.01Å; V114-V429 HydrophobicContact CG1-CG2 4.05Å; I118-V429 HydrophobicContact CD1-CG2 3.9Å; I118-V429 HydrophobicContact CG1-CG2 3.67Å; G425-V429 WeakPolarHBondContact O-CG2 3.33Å; G425-V429 PolarHBondContact O-N 3.13Å; V426-V429 WeakPolarHBondContact O-CB 3.08Å; V426-V429 PolarHBondContact O-N 3.27Å; V429-S431 VanDerWaalsContact C-N 3.34Å; V429-S431 PolarHBondContact O-N 3.43Å; V429-R432 PolarHBondContact O-N 3.3Å; V429-R432 VanDerWaalsContact O-N 3.08Å; V429-L433 HydrophobicContact CG1-CD1 4.18Å; V429-L433 HydrophobicContact CG1-CG 4.31Å; V429-L433 WeakPolarHBondContact O-CG 3.47Å; V429-L433 PolarHBondContact O-N 3.37Å
430S93Very high89.7Confident21 Ų2124.7 Ų24.715%0.14714%0.135CC..Hα-helixtrans-59.9-41.2176-49.80000112.5S308 F312 V426 V427 N428 R432 L433 A434S308-S430 VanDerWaalsContact CB-OG 3.32Å; S308-S430 WeakPolarHBondContact CB-OG 3.4Å; S308-S430 WeakPolarHBondContact O-CB 3.48Å; F312-S430 WeakPolarHBondContact CD2-O 3.22Å; V426-S430 PolarHBondContact O-N 3.07Å; V426-S430 PolarHBondContact O-OG 3.35Å; V427-S430 WeakPolarHBondContact O-CB 3.42Å; V427-S430 PolarHBondContact O-N 3.2Å; N428-S430 PolarHBondContact O-N 2.85Å; S430-R432 VanDerWaalsContact C-N 3.35Å; S430-R432 PolarHBondContact O-N 3.35Å; S430-L433 PolarHBondContact O-N 3.47Å; S430-A434 PolarHBondContact O-N 3.16Å
431S89.8Confident89.4Confident1 Ų125.3 Ų25.31%0.00714%0.139CC..Hα-helixtrans-64.3-37172.9167.10000112.9V427 N428 V429 A434 S435V427-S431 PolarHBondContact O-N 3.38Å; N428-S431 WeakPolarHBondContact O-CB 3.36Å; N428-S431 PolarHBondContact O-N 2.95Å; N428-S431 VanDerWaalsContact O-N 3.12Å; V429-S431 VanDerWaalsContact C-N 3.34Å; V429-S431 PolarHBondContact O-N 3.43Å; S431-A434 WeakPolarHBondContact O-CB 3.37Å; S431-A434 PolarHBondContact O-N 3.14Å; S431-S435 PolarHBondContact O-N 2.78Å; S431-S435 VanDerWaalsContact O-N 3.17Å
432R85.9Confident88.8Confident13 Ų1326.3 Ų26.35%0.04915%0.147CC..Hα-helixtrans-70-41177.5-66-55.2102.6-168.88.1111.9V114 N428 V429 S430 A434 S435 L436V114-R432 HydrophobicContact CG2-CB 3.39Å; V114-R432 HydrophobicContact CG2-CG 3.93Å; N428-R432 PolarHBondContact O-N 3.42Å; V429-R432 PolarHBondContact O-N 3.3Å; V429-R432 VanDerWaalsContact O-N 3.08Å; S430-R432 VanDerWaalsContact C-N 3.35Å; S430-R432 PolarHBondContact O-N 3.35Å; R432-A434 PolarHBondContact O-N 2.89Å; R432-S435 WeakPolarHBondContact O-CB 3.4Å; R432-S435 PolarHBondContact O-N 2.89Å; R432-S435 PolarHBondContact O-OG 3.37Å; R432-L436 PolarHBondContact O-N 2.83Å
433L87.5Confident88.1Confident82 Ų8232.6 Ų32.643%0.42917%0.172SC..Hα-helixtrans-58.2-39.6172.2-69.6174.7000111F312 V429 S430 S435 L436 V437F312-L433 HydrophobicContact CD2-CB 4.33Å; F312-L433 HydrophobicContact CE2-CB 4.24Å; V429-L433 HydrophobicContact CG1-CD1 4.18Å; V429-L433 HydrophobicContact CG1-CG 4.31Å; V429-L433 WeakPolarHBondContact O-CG 3.47Å; V429-L433 PolarHBondContact O-N 3.37Å; S430-L433 PolarHBondContact O-N 3.47Å; L433-S435 VanDerWaalsContact C-N 3.27Å; L433-S435 PolarHBondContact O-N 3.23Å; L433-L436 HydrophobicContact CD2-CD1 4.46Å; L433-L436 WeakPolarHBondContact O-CB 3.46Å; L433-L436 PolarHBondContact O-N 3.41Å; L433-V437 WeakPolarHBondContact O-CG2 3.08Å; L433-V437 PolarHBondContact O-N 3.24Å; L433-V437 VanDerWaalsContact O-N 3.16Å
434A89.9Confident87.6Confident0 Ų034.9 Ų34.90%018%0.184CC..Hα-helixtrans-61.2-33.3174.200000113.6F312 V316 S430 S431 R432 L436 V437 A438F312-A434 HydrophobicContact CD2-CB 3.76Å; F312-A434 HydrophobicContact CE2-CB 4.11Å; F312-A434 HydrophobicContact CG-CB 4.23Å; F312-A434 WeakPolarHBondContact O-CB 3.38Å; V316-A434 HydrophobicContact CG2-CB 3.65Å; S430-A434 PolarHBondContact O-N 3.16Å; S431-A434 WeakPolarHBondContact O-CB 3.37Å; S431-A434 PolarHBondContact O-N 3.14Å; R432-A434 PolarHBondContact O-N 2.89Å; A434-L436 PolarHBondContact O-N 3.24Å; A434-V437 PolarHBondContact O-N 3.48Å; A434-A438 VanDerWaalsContact O-CB 3.25Å; A434-A438 WeakPolarHBondContact O-CB 3.3Å; A434-A438 PolarHBondContact O-N 3.05Å
435S81.1Confident87.1Confident12 Ų1237.3 Ų37.38%0.08420%0.201CC..Hα-helixtrans-66.2-25.4174.5760000113.7S431 R432 L433 P439S431-S435 PolarHBondContact O-N 2.78Å; S431-S435 VanDerWaalsContact O-N 3.17Å; R432-S435 WeakPolarHBondContact O-CB 3.4Å; R432-S435 PolarHBondContact O-N 2.89Å; R432-S435 PolarHBondContact O-OG 3.37Å; L433-S435 VanDerWaalsContact C-N 3.27Å; L433-S435 PolarHBondContact O-N 3.23Å; S435-P439 WeakPolarHBondContact O-CD 3.4Å
436L80Confident86.6Confident80 Ų8041.5 Ų41.542%0.41923%0.227SC..Hα-helixtrans-79.7-36.1173.9-60.6174.1000111.6R432 L433 A434R432-L436 PolarHBondContact O-N 2.83Å; L433-L436 HydrophobicContact CD2-CD1 4.46Å; L433-L436 WeakPolarHBondContact O-CB 3.46Å; L433-L436 PolarHBondContact O-N 3.41Å; A434-L436 PolarHBondContact O-N 3.24Å
437V87.5Confident86.4Confident58 Ų5846.6 Ų46.635%0.35225%0.245SC..Hα-helixtrans-78.3-35.9-179.1175.80000111.9F312 V316 L433 A434 Q440 V441F312-V437 HydrophobicContact CE2-CG2 4.28Å; F312-V437 HydrophobicContact CZ-CB 4.47Å; F312-V437 HydrophobicContact CZ-CG1 4.48Å; F312-V437 HydrophobicContact CZ-CG2 4.2Å; V316-V437 HydrophobicContact CG2-CB 4.28Å; V316-V437 HydrophobicContact CG2-CG1 4.19Å; L433-V437 WeakPolarHBondContact O-CG2 3.08Å; L433-V437 PolarHBondContact O-N 3.24Å; L433-V437 VanDerWaalsContact O-N 3.16Å; A434-V437 PolarHBondContact O-N 3.48Å; V437-Q440 WeakPolarHBondContact O-CB 3.46Å; V437-Q440 PolarHBondContact O-N 3.29Å; V437-V441 HydrophobicContact CG1-CG2 3.83Å; V437-V441 PolarHBondContact O-N 2.91Å
438A86.1Confident86Confident0 Ų049.3 Ų49.30%026%0.26CS..Hα-helixtrans-51.1-51.7-176.100000114.7F319 A434 Q440 V441 A442F319-A438 HydrophobicContact CB-CB 3.53Å; A434-A438 VanDerWaalsContact O-CB 3.25Å; A434-A438 WeakPolarHBondContact O-CB 3.3Å; A434-A438 PolarHBondContact O-N 3.05Å; A438-Q440 PolarHBondContact O-N 3.47Å; A438-V441 PolarHBondContact O-N 3.41Å; A438-A442 PolarHBondContact O-N 2.97Å
439P79.2Confident85.7Confident42 Ų4250.7 Ų50.727%0.27327%0.272SS..Hα-helixtrans-60-34.7177.8-23.632.6000113.1F323 S435 A442 Y443F323-P439 HydrophobicContact CD2-CG 3.84Å; F323-P439 HydrophobicContact CE2-CG 3.7Å; F323-P439 HydrophobicContact CZ-CG 4.36Å; S435-P439 WeakPolarHBondContact O-CD 3.4Å; P439-A442 PolarHBondContact O-N 2.91Å; P439-Y443 WeakPolarHBondContact O-CB 3.36Å; P439-Y443 PolarHBondContact O-N 3.18Å
440Q85.3Confident85.6Confident128 Ų12849.5 Ų49.560%0.59827%0.265SS*.Hα-helixtrans-69.5-39.8178.6-53-54.6-42.900111V437 A438 Y443V437-Q440 WeakPolarHBondContact O-CB 3.46Å; V437-Q440 PolarHBondContact O-N 3.29Å; A438-Q440 PolarHBondContact O-N 3.47Å; Q440-Y443 PolarHBondContact O-N 3.43Å
441V87.4Confident85.5Confident12 Ų1251.1 Ų51.17%0.07327%0.272CS..Hα-helixtrans-65.1-42.8174177.80000110.6V316 V437 A438 Y443 L444 P452 I455 Y456V316-V441 HydrophobicContact CG1-CB 4.43Å; V316-V441 HydrophobicContact CG1-CG2 4.12Å; V437-V441 HydrophobicContact CG1-CG2 3.83Å; V437-V441 PolarHBondContact O-N 2.91Å; A438-V441 PolarHBondContact O-N 3.41Å; V441-Y443 VanDerWaalsContact C-N 3.34Å; V441-Y443 PolarHBondContact O-N 2.88Å; V441-L444 WeakPolarHBondContact O-CB 3.41Å; V441-L444 PolarHBondContact O-N 2.93Å; V441-P452 HydrophobicContact CG1-CB 4.17Å; V441-P452 WeakPolarHBondContact O-CG 3.25Å; V441-I455 HydrophobicContact CG1-CB 4.06Å; V441-I455 HydrophobicContact CG1-CD1 3.95Å; V441-I455 HydrophobicContact CG1-CG2 3.94Å; V441-I455 HydrophobicContact CG2-CG2 4.4Å; V441-Y456 HydrophobicContact CB-CE1 4.3Å; V441-Y456 HydrophobicContact CG1-CD1 4.21Å; V441-Y456 HydrophobicContact CG1-CE1 3.43Å; V441-Y456 VanDerWaalsContact CG1-CE1 3.43Å
442A81.2Confident85.5Confident22 Ų2251.3 Ų51.318%0.18227%0.273CS..Hα-helixtrans-62.2-40.6176.700000112.2A438 P439 L444 S445A438-A442 PolarHBondContact O-N 2.97Å; P439-A442 PolarHBondContact O-N 2.91Å; A442-L444 PolarHBondContact O-N 2.95Å; A442-L444 VanDerWaalsContact O-N 3.1Å; A442-S445 WeakPolarHBondContact O-CB 3.25Å; A442-S445 PolarHBondContact O-N 3.35Å; A442-S445 VanDerWaalsContact O-N 3.09Å; A442-S445 PolarHBondContact O-OG 3.17Å
443Y80.7Confident85.7Confident134 Ų13452.2 Ų52.253%0.52528%0.277SS..Hα-helixtrans-57.7-26.2178.5-177.8-99.9000113.4P439 Q440 V441 S445 T446 F447P439-Y443 WeakPolarHBondContact O-CB 3.36Å; P439-Y443 PolarHBondContact O-N 3.18Å; Q440-Y443 PolarHBondContact O-N 3.43Å; V441-Y443 VanDerWaalsContact C-N 3.34Å; V441-Y443 PolarHBondContact O-N 2.88Å; Y443-S445 PolarHBondContact O-N 3.49Å; Y443-S445 VanDerWaalsContact O-N 3.1Å; Y443-T446 HydrophobicContact CD2-CG2 4.21Å; Y443-T446 HydrophobicContact CE2-CG2 4.16Å; Y443-T446 WeakPolarHBondContact O-CB 3.46Å; Y443-T446 WeakPolarHBondContact O-CG2 3.26Å; Y443-T446 PolarHBondContact O-N 3.29Å; Y443-T446 PolarHBondContact O-OG1 2.05Å; Y443-F447 HydrophobicContact CD1-CE2 4.09Å; Y443-F447 AromaticContact CE1-CE2 3.69Å; Y443-F447 HydrophobicContact CE1-CE2 3.69Å; Y443-F447 HydrophobicContact CE1-CZ 4.08Å
444L86Confident86Confident48 Ų4851.5 Ų51.525%0.25127%0.273SS..G310 helixtrans-63.3-17.6178.8-65.6165.6000113.7V441 A442 T446 F447 L448 L451 I455V441-L444 WeakPolarHBondContact O-CB 3.41Å; V441-L444 PolarHBondContact O-N 2.93Å; A442-L444 PolarHBondContact O-N 2.95Å; A442-L444 VanDerWaalsContact O-N 3.1Å; L444-T446 PolarHBondContact O-N 3.19Å; L444-F447 HydrophobicContact CD2-CD2 4.18Å; L444-F447 HydrophobicContact CD2-CE2 4.41Å; L444-F447 PolarHBondContact O-N 3Å; L444-F447 VanDerWaalsContact O-N 3.16Å; L444-L448 PolarHBondContact O-N 3.31Å; L444-L451 HydrophobicContact CB-CB 4.25Å; L444-L451 HydrophobicContact CB-CD2 3.59Å; L444-L451 HydrophobicContact CB-CG 4.5Å; L444-L451 HydrophobicContact CD1-CD2 3.89Å; L444-L451 HydrophobicContact CD2-CD2 3.98Å; L444-L451 HydrophobicContact CG-CD2 4Å; L444-I455 HydrophobicContact CD1-CD1 3.46Å; L444-I455 VanDerWaalsContact CD1-CD1 3.46Å
445S83.8Confident86.2Confident53 Ų5353.9 Ų53.937%0.37129%0.285SS..G310 helixtrans-59.2-25.2171.865.90000113.1A442 Y443 F447 L448 A449A442-S445 WeakPolarHBondContact O-CB 3.25Å; A442-S445 PolarHBondContact O-N 3.35Å; A442-S445 VanDerWaalsContact O-N 3.09Å; A442-S445 PolarHBondContact O-OG 3.17Å; Y443-S445 PolarHBondContact O-N 3.49Å; Y443-S445 VanDerWaalsContact O-N 3.1Å; S445-F447 VanDerWaalsContact C-N 3.3Å; S445-F447 PolarHBondContact O-N 2.97Å; S445-L448 CarbonylContact O-C 3.47Å; S445-A449 PolarHBondContact O-N 2.65Å
446T83.5Confident86.7Confident88 Ų8853.6 Ų53.654%0.5428%0.282SS..G310 helixtrans-68.4-28.3177.861.80000113Y443 L444Y443-T446 HydrophobicContact CD2-CG2 4.21Å; Y443-T446 HydrophobicContact CE2-CG2 4.16Å; Y443-T446 WeakPolarHBondContact O-CB 3.46Å; Y443-T446 WeakPolarHBondContact O-CG2 3.26Å; Y443-T446 PolarHBondContact O-N 3.29Å; Y443-T446 PolarHBondContact O-OG1 2.05Å; L444-T446 PolarHBondContact O-N 3.19Å
447F88.6Confident87.3Confident152 Ų15249.8 Ų49.867%0.66726%0.262SS*.THydrogen-bonded Turntrans-86.1-46.4173.6-59.5-76.3000111.1Y443 L444 S445Y443-F447 HydrophobicContact CD1-CE2 4.09Å; Y443-F447 AromaticContact CE1-CE2 3.69Å; Y443-F447 HydrophobicContact CE1-CE2 3.69Å; Y443-F447 HydrophobicContact CE1-CZ 4.08Å; L444-F447 HydrophobicContact CD2-CD2 4.18Å; L444-F447 HydrophobicContact CD2-CE2 4.41Å; L444-F447 PolarHBondContact O-N 3Å; L444-F447 VanDerWaalsContact O-N 3.16Å; S445-F447 VanDerWaalsContact C-N 3.3Å; S445-F447 PolarHBondContact O-N 2.97Å
448L87Confident87.7Confident58 Ų5850 Ų5030%0.30427%0.266SS..  trans-150.7115.6178.9-179.261.5000109.7Y381 L444 S445 P450 L451Y381-L448 HydrophobicContact CE1-CD1 4.21Å; L444-L448 PolarHBondContact O-N 3.31Å; S445-L448 CarbonylContact O-C 3.47Å; L448-P450 HydrophobicContact CD1-CG 4.11Å; L448-P450 HydrophobicContact CD2-CG 4.22Å; L448-P450 HydrophobicContact CG-CG 3.79Å; L448-L451 HydrophobicContact CB-CB 4.34Å; L448-L451 HydrophobicContact CB-CD1 4.35Å; L448-L451 HydrophobicContact CD2-CD1 3.98Å; L448-L451 VanDerWaalsContact O-CB 3.28Å; L448-L451 WeakPolarHBondContact O-CB 3.28Å; L448-L451 PolarHBondContact O-N 3.02Å
449A84.8Confident88.2Confident36 Ų3651 Ų5130%0.29827%0.271SS..THydrogen-bonded Turntrans-49.7-42.7-174.400000115.5Y381 S445 L451 P452Y381-A449 HydrophobicContact CD2-CB 4.09Å; Y381-A449 HydrophobicContact CE2-CB 3.62Å; S445-A449 PolarHBondContact O-N 2.65Å; A449-L451 VanDerWaalsContact C-N 3.34Å; A449-L451 PolarHBondContact O-N 3.02Å; A449-P452 WeakPolarHBondContact O-CD 3.46Å
450P89Confident88.9Confident0 Ų049 Ų490%026%0.258CS..THydrogen-bonded Turntrans-77-9.4178.629.6-39.6000115.4V378 Y381 Y382 L448 F453 M454V378-P450 HydrophobicContact CB-CB 4.47Å; V378-P450 HydrophobicContact CG1-CB 4.25Å; V378-P450 HydrophobicContact CG2-CB 4.23Å; Y381-P450 HydrophobicContact CD1-CB 4.2Å; Y381-P450 HydrophobicContact CD1-CG 3.52Å; Y381-P450 HydrophobicContact CE1-CG 3.77Å; Y381-P450 HydrophobicContact CG-CB 4.2Å; Y381-P450 HydrophobicContact CG-CG 3.94Å; Y382-P450 HydrophobicContact CE2-CG 4.49Å; L448-P450 HydrophobicContact CD1-CG 4.11Å; L448-P450 HydrophobicContact CD2-CG 4.22Å; L448-P450 HydrophobicContact CG-CG 3.79Å; P450-F453 WeakPolarHBondContact O-CB 3.39Å; P450-F453 PolarHBondContact O-N 3.48Å; P450-F453 VanDerWaalsContact O-N 3.07Å; P450-M454 PolarHBondContact O-N 3.03Å; P450-M454 VanDerWaalsContact O-N 3.1Å
451L90.8Very high89.5Confident54 Ų5446.1 Ų46.128%0.28325%0.248SC..Hα-helixtrans-58-44-171.1-148.291.9000114.1L444 L448 A449 F453 M454 I455L444-L451 HydrophobicContact CB-CB 4.25Å; L444-L451 HydrophobicContact CB-CD2 3.59Å; L444-L451 HydrophobicContact CB-CG 4.5Å; L444-L451 HydrophobicContact CD1-CD2 3.89Å; L444-L451 HydrophobicContact CD2-CD2 3.98Å; L444-L451 HydrophobicContact CG-CD2 4Å; L448-L451 HydrophobicContact CB-CB 4.34Å; L448-L451 HydrophobicContact CB-CD1 4.35Å; L448-L451 HydrophobicContact CD2-CD1 3.98Å; L448-L451 VanDerWaalsContact O-CB 3.28Å; L448-L451 WeakPolarHBondContact O-CB 3.28Å; L448-L451 PolarHBondContact O-N 3.02Å; A449-L451 VanDerWaalsContact C-N 3.34Å; A449-L451 PolarHBondContact O-N 3.02Å; L451-F453 VanDerWaalsContact C-N 3.27Å; L451-F453 PolarHBondContact O-N 2.94Å; L451-M454 WeakPolarHBondContact O-CB 3.38Å; L451-M454 PolarHBondContact O-N 3.29Å; L451-I455 PolarHBondContact O-N 3.22Å
452P89.8Confident89.9Confident5 Ų549.1 Ų49.13%0.03226%0.264CS..Hα-helixtrans-60-39.5176.6-20.631.7000112V441 A449 M454 I455 Y456V441-P452 HydrophobicContact CG1-CB 4.17Å; V441-P452 WeakPolarHBondContact O-CG 3.25Å; A449-P452 WeakPolarHBondContact O-CD 3.46Å; P452-M454 VanDerWaalsContact C-N 3.34Å; P452-M454 PolarHBondContact O-N 2.94Å; P452-I455 WeakPolarHBondContact O-CB 3.42Å; P452-I455 PolarHBondContact O-N 3.37Å; P452-Y456 HydrophobicContact CB-CE2 3.9Å; P452-Y456 WeakPolarHBondContact O-CD1 3.01Å; P452-Y456 VanDerWaalsContact O-CD2 3.26Å; P452-Y456 WeakPolarHBondContact O-CD2 3.25Å; P452-Y456 PolarHBondContact O-N 3.35Å
453F91Very high90.7Very high33 Ų3348.1 Ų48.115%0.14526%0.255CS..Hα-helixtrans-68.5-31.6179.8-61.4-80.1000112.7T377 V378 M389 A393 P450 L451 Y456 G457T377-F453 HydrophobicContact CG2-CB 4.44Å; T377-F453 HydrophobicContact CG2-CD1 3.66Å; T377-F453 HydrophobicContact CG2-CD2 3.7Å; T377-F453 HydrophobicContact CG2-CE1 3.72Å; T377-F453 HydrophobicContact CG2-CE2 3.75Å; T377-F453 HydrophobicContact CG2-CG 3.66Å; T377-F453 HydrophobicContact CG2-CZ 3.76Å; V378-F453 HydrophobicContact CG2-CB 3.74Å; M389-F453 HydrophobicContact CE-CD2 4.26Å; M389-F453 HydrophobicContact CE-CE2 3.94Å; A393-F453 HydrophobicContact CB-CE1 4.03Å; A393-F453 HydrophobicContact CB-CZ 4.35Å; P450-F453 WeakPolarHBondContact O-CB 3.39Å; P450-F453 PolarHBondContact O-N 3.48Å; P450-F453 VanDerWaalsContact O-N 3.07Å; L451-F453 VanDerWaalsContact C-N 3.27Å; L451-F453 PolarHBondContact O-N 2.94Å; F453-Y456 HydrophobicContact CD1-CD2 4.21Å; F453-Y456 PolarHBondContact O-N 3.29Å; F453-G457 PolarHBondContact O-N 2.81Å
454M93.2Very high91.4Very high67 Ų6743 Ų4333%0.3324%0.237SC..Hα-helixtrans-65.6-40.2171.4-63.9173.166.500111.5V378 P450 L451 P452 S458V378-M454 HydrophobicContact CG1-CG 4.09Å; V378-M454 HydrophobicContact CG2-CG 3.66Å; P450-M454 PolarHBondContact O-N 3.03Å; P450-M454 VanDerWaalsContact O-N 3.1Å; L451-M454 WeakPolarHBondContact O-CB 3.38Å; L451-M454 PolarHBondContact O-N 3.29Å; P452-M454 VanDerWaalsContact C-N 3.34Å; P452-M454 PolarHBondContact O-N 2.94Å; M454-S458 WeakPolarHBondContact O-CB 3.09Å; M454-S458 PolarHBondContact O-N 2.01Å; M454-S458 PolarHBondContact O-OG 3.19Å
455I93.6Very high91.9Very high49 Ų4945.5 Ų45.525%0.25125%0.249SC..Hα-helixtrans-65.7-48.1175.2-65.5167.8000109.7V441 L444 L451 P452 G457 S458 M459V441-I455 HydrophobicContact CG1-CB 4.06Å; V441-I455 HydrophobicContact CG1-CD1 3.95Å; V441-I455 HydrophobicContact CG1-CG2 3.94Å; V441-I455 HydrophobicContact CG2-CG2 4.4Å; L444-I455 HydrophobicContact CD1-CD1 3.46Å; L444-I455 VanDerWaalsContact CD1-CD1 3.46Å; L451-I455 PolarHBondContact O-N 3.22Å; P452-I455 WeakPolarHBondContact O-CB 3.42Å; P452-I455 PolarHBondContact O-N 3.37Å; I455-G457 PolarHBondContact O-N 3.02Å; I455-S458 PolarHBondContact O-N 3.34Å; I455-S458 PolarHBondContact O-OG 2.83Å; I455-M459 HydrophobicContact CG2-CG 4.36Å; I455-M459 HydrophobicContact CG2-SD 3.99Å; I455-M459 WeakPolarHBondContact O-CB 3.46Å; I455-M459 VanDerWaalsContact O-CG 3.26Å; I455-M459 WeakPolarHBondContact O-CG 3.45Å; I455-M459 PolarHBondContact O-N 2.64Å
456Y92.2Very high92.5Very high7 Ų745.4 Ų45.43%0.02724%0.244CC..Hα-helixtrans-58.2-47.6177-58-26000111.6V316 I317 I321 V441 P452 F453 S458 M459 T460V316-Y456 HydrophobicContact CG1-CD1 4.19Å; V316-Y456 HydrophobicContact CG1-CE1 3.81Å; I317-Y456 HydrophobicContact CG1-CD1 3.84Å; I317-Y456 HydrophobicContact CG1-CG 4Å; I321-Y456 HydrophobicContact CG1-CE2 4.21Å; V441-Y456 HydrophobicContact CB-CE1 4.3Å; V441-Y456 HydrophobicContact CG1-CD1 4.21Å; V441-Y456 HydrophobicContact CG1-CE1 3.43Å; V441-Y456 VanDerWaalsContact CG1-CE1 3.43Å; P452-Y456 HydrophobicContact CB-CE2 3.9Å; P452-Y456 WeakPolarHBondContact O-CD1 3.01Å; P452-Y456 VanDerWaalsContact O-CD2 3.26Å; P452-Y456 WeakPolarHBondContact O-CD2 3.25Å; P452-Y456 PolarHBondContact O-N 3.35Å; F453-Y456 HydrophobicContact CD1-CD2 4.21Å; F453-Y456 PolarHBondContact O-N 3.29Å; Y456-S458 PolarHBondContact O-N 3Å; Y456-M459 PolarHBondContact O-N 2.67Å; Y456-T460 WeakPolarHBondContact O-CG2 2.92Å; Y456-T460 PolarHBondContact O-N 3.23Å; Y456-T460 PolarHBondContact O-OG1 3.48Å
457G93.4Very high93.1Very high0 Ų041.2 Ų41.20%022%0.218CC..Hα-helixtrans-63.8-36.8179.700000113.9W375 F453 I455 T460 V461W375-G457 VanDerWaalsContact NE1-CA 3.34Å; W375-G457 PolarHBondContact NE1-O 2.97Å; W375-G457 VanDerWaalsContact NE1-O 3.08Å; F453-G457 PolarHBondContact O-N 2.81Å; I455-G457 PolarHBondContact O-N 3.02Å; G457-T460 WeakPolarHBondContact CA-OG1 2.87Å; G457-T460 PolarHBondContact O-OG1 3.23Å; G457-V461 VanDerWaalsContact O-CG2 3.3Å; G457-V461 WeakPolarHBondContact O-CG2 2.96Å; G457-V461 PolarHBondContact O-N 3.31Å
458S95.3Very high93.4Very high61 Ų6138.4 Ų38.443%0.42721%0.209SC..Hα-helixtrans-71.9-41175.156.10000111.9M454 I455 Y456 T460 V461 L462M454-S458 WeakPolarHBondContact O-CB 3.09Å; M454-S458 PolarHBondContact O-N 2.01Å; M454-S458 PolarHBondContact O-OG 3.19Å; I455-S458 PolarHBondContact O-N 3.34Å; I455-S458 PolarHBondContact O-OG 2.83Å; Y456-S458 PolarHBondContact O-N 3Å; S458-T460 VanDerWaalsContact C-N 3.33Å; S458-T460 PolarHBondContact O-N 3.45Å; S458-V461 PolarHBondContact O-N 2.9Å; S458-L462 PolarHBondContact O-N 2.96Å
459M95.4Very high93.7Very high23 Ų2343.9 Ų43.911%0.11323%0.226CC..Hα-helixtrans-60.7-41.7175.3-71-177.684.100111.9Y309 F312 V316 I455 Y456 L462 H463Y309-M459 WeakPolarHBondContact OH-CA 3.38Å; Y309-M459 PolarHBondContact OH-O 3.41Å; F312-M459 HydrophobicContact CD1-CE 3.6Å; F312-M459 HydrophobicContact CE1-CE 3.47Å; F312-M459 VanDerWaalsContact CE1-CE 3.47Å; V316-M459 HydrophobicContact CB-CE 4.27Å; V316-M459 HydrophobicContact CB-SD 4.3Å; V316-M459 HydrophobicContact CG1-SD 4.06Å; V316-M459 HydrophobicContact CG2-CE 4.15Å; I455-M459 HydrophobicContact CG2-CG 4.36Å; I455-M459 HydrophobicContact CG2-SD 3.99Å; I455-M459 WeakPolarHBondContact O-CB 3.46Å; I455-M459 VanDerWaalsContact O-CG 3.26Å; I455-M459 WeakPolarHBondContact O-CG 3.45Å; I455-M459 PolarHBondContact O-N 2.64Å; Y456-M459 PolarHBondContact O-N 2.67Å; M459-L462 PolarHBondContact O-N 3.31Å; M459-H463 VanDerWaalsContact O-CB 3.28Å; M459-H463 WeakPolarHBondContact O-CB 3.39Å; M459-H463 PolarHBondContact O-N 3.08Å
460T95.5Very high94.1Very high0 Ų047.3 Ų47.30%023%0.232CC..Hα-helixtrans-67.3-36.7178.150.40000112.7I317 I367 T370 S371 Y456 G457 S458 H463 I464I317-T460 HydrophobicContact CD1-CG2 3.5Å; I367-T460 HydrophobicContact CG2-CG2 4.04Å; T370-T460 HydrophobicContact CG2-CG2 4.11Å; S371-T460 WeakPolarHBondContact CA-OG1 3.4Å; S371-T460 WeakPolarHBondContact CB-OG1 3.3Å; S371-T460 PolarHBondContact OG-OG1 3.47Å; Y456-T460 WeakPolarHBondContact O-CG2 2.92Å; Y456-T460 PolarHBondContact O-N 3.23Å; Y456-T460 PolarHBondContact O-OG1 3.48Å; G457-T460 WeakPolarHBondContact CA-OG1 2.87Å; G457-T460 PolarHBondContact O-OG1 3.23Å; S458-T460 VanDerWaalsContact C-N 3.33Å; S458-T460 PolarHBondContact O-N 3.45Å; T460-H463 WeakPolarHBondContact O-CB 3.39Å; T460-H463 PolarHBondContact O-N 2.95Å; T460-I464 WeakPolarHBondContact O-CD1 3.37Å; T460-I464 VanDerWaalsContact O-CG1 3.25Å; T460-I464 WeakPolarHBondContact O-CG1 3.4Å; T460-I464 PolarHBondContact O-N 3.17Å
461V96.7Very high94.2Very high66 Ų6647.4 Ų47.440%0.423%0.232SC..Hα-helixtrans-62.1-48.9175.6169.30000110.7G457 S458 H463 I464 I465G457-V461 VanDerWaalsContact O-CG2 3.3Å; G457-V461 WeakPolarHBondContact O-CG2 2.96Å; G457-V461 PolarHBondContact O-N 3.31Å; S458-V461 PolarHBondContact O-N 2.9Å; V461-H463 VanDerWaalsContact C-N 3.25Å; V461-H463 PolarHBondContact O-N 3.17Å; V461-I464 PolarHBondContact O-N 3.34Å; V461-I465 HydrophobicContact CG1-CD1 4.16Å; V461-I465 WeakPolarHBondContact O-CG1 3.4Å; V461-I465 PolarHBondContact O-N 3.42Å; V461-I465 VanDerWaalsContact O-N 3.17Å
462L96.9Very high94.2Very high76 Ų7647.9 Ų47.940%0.39824%0.238SC..Hα-helixtrans-61-38.4175.6-18058.7000111.5Y309 S458 M459 I465 M466Y309-L462 HydrophobicContact CE1-CB 4.35Å; Y309-L462 HydrophobicContact CE1-CD2 4.39Å; Y309-L462 HydrophobicContact CE1-CG 4.1Å; Y309-L462 HydrophobicContact CE2-CD2 4.07Å; S458-L462 PolarHBondContact O-N 2.96Å; M459-L462 PolarHBondContact O-N 3.31Å; L462-I465 PolarHBondContact O-N 3.09Å; L462-M466 HydrophobicContact CD1-CE 3.91Å; L462-M466 HydrophobicContact CD1-CG 4.34Å; L462-M466 HydrophobicContact CD2-CE 4.07Å; L462-M466 HydrophobicContact CG-CE 3.94Å; L462-M466 WeakPolarHBondContact O-CG 3.26Å; L462-M466 PolarHBondContact O-N 3.1Å
463H96.7Very high94.1Very high0 Ų050.6 Ų50.60%025%0.251CS..Hα-helixtrans-61-46.6178-170.1-179.8000111.8Y309 S310 S313 I367 M459 T460 V461 I465 M466 V467Y309-H463 HydrophobicContact CD1-CB 4.31Å; Y309-H463 HydrophobicContact CE1-CB 3.7Å; S310-H463 WeakPolarHBondContact CA-NE2 3.22Å; S310-H463 WeakPolarHBondContact CB-NE2 3.4Å; S310-H463 PolarHBondContact OG-CE1 2.9Å; S310-H463 PolarHBondContact OG-NE2 3.14Å; S313-H463 PolarHBondContact OG-ND1 2.87Å; S313-H463 VanDerWaalsContact OG-ND1 3.08Å; I367-H463 WeakPolarHBondContact CD1-CE1 3.3Å; I367-H463 VanDerWaalsContact CD1-NE2 3.31Å; I367-H463 WeakPolarHBondContact CD1-NE2 3.36Å; I367-H463 HydrophobicContact CG2-CB 4.14Å; M459-H463 VanDerWaalsContact O-CB 3.28Å; M459-H463 WeakPolarHBondContact O-CB 3.39Å; M459-H463 PolarHBondContact O-N 3.08Å; T460-H463 WeakPolarHBondContact O-CB 3.39Å; T460-H463 PolarHBondContact O-N 2.95Å; V461-H463 VanDerWaalsContact C-N 3.25Å; V461-H463 PolarHBondContact O-N 3.17Å; H463-I465 VanDerWaalsContact C-N 3.33Å; H463-I465 PolarHBondContact O-N 2.73Å; H463-M466 PolarHBondContact O-N 2.98Å; H463-V467 WeakPolarHBondContact O-CG2 3.37Å; H463-V467 PolarHBondContact O-N 3.27Å
464I97Very high93.9Very high28 Ų2849 Ų4914%0.14424%0.244CC..Hα-helixtrans-58.5-46.6176.9-68.4158.2000110.5V364 I367 V368 T460 V461 M466 V467 I468V364-I464 HydrophobicContact CG1-CG2 4.46Å; I367-I464 HydrophobicContact CB-CG1 4.01Å; I367-I464 HydrophobicContact CG2-CD1 4.06Å; I367-I464 HydrophobicContact CG2-CG1 3.59Å; V368-I464 HydrophobicContact CB-CD1 4.46Å; V368-I464 HydrophobicContact CG2-CD1 3.68Å; V368-I464 HydrophobicContact CG2-CG1 4.11Å; T460-I464 WeakPolarHBondContact O-CD1 3.37Å; T460-I464 VanDerWaalsContact O-CG1 3.25Å; T460-I464 WeakPolarHBondContact O-CG1 3.4Å; T460-I464 PolarHBondContact O-N 3.17Å; V461-I464 PolarHBondContact O-N 3.34Å; I464-M466 PolarHBondContact O-N 2.9Å; I464-V467 PolarHBondContact O-N 3.4Å; I464-I468 HydrophobicContact CG2-CD1 3.59Å; I464-I468 HydrophobicContact CG2-CG1 4.36Å; I464-I468 WeakPolarHBondContact O-CB 3.37Å; I464-I468 VanDerWaalsContact O-CG1 3.3Å; I464-I468 WeakPolarHBondContact O-CG1 3.44Å; I464-I468 PolarHBondContact O-N 3.47Å
465I96.7Very high93.2Very high99 Ų9948.9 Ų48.951%0.50824%0.24SC..Hα-helixtrans-60.1-48.4180-64.9166.2000110.7V461 L462 H463 V467 I468 R469V461-I465 HydrophobicContact CG1-CD1 4.16Å; V461-I465 WeakPolarHBondContact O-CG1 3.4Å; V461-I465 PolarHBondContact O-N 3.42Å; V461-I465 VanDerWaalsContact O-N 3.17Å; L462-I465 PolarHBondContact O-N 3.09Å; H463-I465 VanDerWaalsContact C-N 3.33Å; H463-I465 PolarHBondContact O-N 2.73Å; I465-V467 PolarHBondContact O-N 3.18Å; I465-I468 PolarHBondContact O-N 2.86Å; I465-R469 VanDerWaalsContact O-CB 3.3Å; I465-R469 WeakPolarHBondContact O-CB 3.48Å; I465-R469 PolarHBondContact O-N 2.89Å
466M95.9Very high92.3Very high51 Ų5153.9 Ų53.925%0.25126%0.256SS..Hα-helixtrans-61.5-46.1-179.4-72.4-169.2177.500112.2V306 Y309 L462 H463 I464 R469 Y470V306-M466 HydrophobicContact CG1-CB 4.27Å; Y309-M466 HydrophobicContact CD1-SD 3.57Å; Y309-M466 VanDerWaalsContact CD1-SD 3.57Å; Y309-M466 HydrophobicContact CE1-SD 4.22Å; Y309-M466 HydrophobicContact CG-CE 4.43Å; Y309-M466 HydrophobicContact CG-SD 3.76Å; L462-M466 HydrophobicContact CD1-CE 3.91Å; L462-M466 HydrophobicContact CD1-CG 4.34Å; L462-M466 HydrophobicContact CD2-CE 4.07Å; L462-M466 HydrophobicContact CG-CE 3.94Å; L462-M466 WeakPolarHBondContact O-CG 3.26Å; L462-M466 PolarHBondContact O-N 3.1Å; H463-M466 PolarHBondContact O-N 2.98Å; I464-M466 PolarHBondContact O-N 2.9Å; M466-R469 PolarHBondContact O-N 2.96Å; M466-Y470 WeakPolarHBondContact O-CB 3.42Å; M466-Y470 WeakPolarHBondContact O-CD2 3.42Å; M466-Y470 PolarHBondContact O-N 3.32Å
467V95.3Very high91.6Very high0 Ų058.2 Ų58.20%028%0.28CS..Hα-helixtrans-64.9-45.4-179.6170.10000111V306 K360 L363 V364 I367 H463 I464 I465 R469 L471V306-V467 HydrophobicContact CG1-CG2 4.18Å; K360-V467 WeakPolarHBondContact CE-O 3.3Å; K360-V467 HydrophobicContact CG-CG1 4.29Å; K360-V467 PolarHBondContact NZ-O 3Å; L363-V467 HydrophobicContact CD2-CB 4.47Å; L363-V467 HydrophobicContact CD2-CG1 3.63Å; L363-V467 HydrophobicContact CD2-CG2 3.93Å; L363-V467 HydrophobicContact CG-CG1 4.07Å; L363-V467 HydrophobicContact CG-CG2 4.43Å; V364-V467 HydrophobicContact CG2-CG1 3.7Å; I367-V467 HydrophobicContact CD1-CG2 4.39Å; H463-V467 WeakPolarHBondContact O-CG2 3.37Å; H463-V467 PolarHBondContact O-N 3.27Å; I464-V467 PolarHBondContact O-N 3.4Å; I465-V467 PolarHBondContact O-N 3.18Å; V467-R469 VanDerWaalsContact C-N 3.35Å; V467-R469 PolarHBondContact O-N 2.95Å; V467-L471 HydrophobicContact CG1-CB 4.37Å; V467-L471 HydrophobicContact CG1-CD2 4.28Å; V467-L471 WeakPolarHBondContact O-CB 3.43Å; V467-L471 PolarHBondContact O-N 2.96Å
468I94.9Very high90.8Very high94 Ų9463.6 Ų63.648%0.48231%0.305SS..Hα-helixtrans-62.4-44.2179.8-70.1174.3000110.6K360 V364 I464 I465K360-I468 PolarHBondContact NZ-O 3.13Å; V364-I468 HydrophobicContact CG1-CD1 4.21Å; V364-I468 HydrophobicContact CG1-CG1 4.38Å; V364-I468 HydrophobicContact CG2-CG1 3.96Å; I464-I468 HydrophobicContact CG2-CD1 3.59Å; I464-I468 HydrophobicContact CG2-CG1 4.36Å; I464-I468 WeakPolarHBondContact O-CB 3.37Å; I464-I468 VanDerWaalsContact O-CG1 3.3Å; I464-I468 WeakPolarHBondContact O-CG1 3.44Å; I464-I468 PolarHBondContact O-N 3.47Å; I465-I468 PolarHBondContact O-N 2.86Å
469R93.7Very high89.9Confident172 Ų17261 Ų6165%0.64929%0.286SS*.Hα-helixtrans-79.4-33.7-170.9-174.359.6-177.585.1-4.5114.5I465 M466 V467I465-R469 VanDerWaalsContact O-CB 3.3Å; I465-R469 WeakPolarHBondContact O-CB 3.48Å; I465-R469 PolarHBondContact O-N 2.89Å; M466-R469 PolarHBondContact O-N 2.96Å; V467-R469 VanDerWaalsContact C-N 3.35Å; V467-R469 PolarHBondContact O-N 2.95Å
470Y92.5Very high89.1Confident108 Ų10862 Ų6242%0.42429%0.294SS..Hα-helixtrans-122.8-20.8-164.1-59.6-63.2000114.7L302 V306 M466L302-Y470 HydrophobicContact CD1-CD1 3.79Å; L302-Y470 HydrophobicContact CD1-CE1 4.41Å; L302-Y470 HydrophobicContact CD1-CG 3.89Å; L302-Y470 HydrophobicContact CD2-CD1 3.88Å; L302-Y470 HydrophobicContact CD2-CG 4.34Å; L302-Y470 HydrophobicContact CG-CD1 4.31Å; L302-Y470 HydrophobicContact CG-CG 4.4Å; V306-Y470 HydrophobicContact CG2-CD2 4.33Å; V306-Y470 HydrophobicContact CG2-CG 4.37Å; M466-Y470 WeakPolarHBondContact O-CB 3.42Å; M466-Y470 WeakPolarHBondContact O-CD2 3.42Å; M466-Y470 PolarHBondContact O-N 3.32Å
471L91.8Very high88.2Confident2 Ų263.9 Ų63.91%0.0130%0.303CS..PPolyproline II helixtrans-92.1124.5-178.4-148.466.7000110.7P303 V306 L307 K360 L363 M410 L414 V467P303-L471 HydrophobicContact CB-CD1 4.37Å; V306-L471 HydrophobicContact CB-CD1 4.33Å; V306-L471 HydrophobicContact CG1-CB 4.37Å; V306-L471 HydrophobicContact CG1-CD1 4.09Å; L307-L471 HydrophobicContact CD2-CD2 4.32Å; L307-L471 HydrophobicContact CG-CD1 4.36Å; K360-L471 WeakPolarHBondContact CD-O 3.2Å; K360-L471 VanDerWaalsContact CE-O 3.3Å; K360-L471 WeakPolarHBondContact CE-O 3.35Å; K360-L471 PolarHBondContact NZ-O 3.44Å; L363-L471 HydrophobicContact CD2-CD2 3.84Å; M410-L471 HydrophobicContact CE-CD2 4.31Å; M410-L471 HydrophobicContact SD-CD2 3.4Å; M410-L471 WeakPolarHBondContact SD-CD2 3.39Å; M410-L471 HydrophobicContact SD-CG 4.23Å; L414-L471 HydrophobicContact CD1-CD1 3.59Å; L414-L471 HydrophobicContact CD1-CG 4.14Å; V467-L471 HydrophobicContact CG1-CB 4.37Å; V467-L471 HydrophobicContact CG1-CD2 4.28Å; V467-L471 WeakPolarHBondContact O-CB 3.43Å; V467-L471 PolarHBondContact O-N 2.96Å
472P90Very high87.1Confident64 Ų6462.3 Ų62.342%0.41629%0.294SS..PPolyproline II helixtrans-78.9161.117532-32.9000111.4L414L414-P472 HydrophobicContact CD2-CG 3.7Å
473E89.6Confident86Confident62 Ų6258.9 Ų58.929%0.2928%0.276SS..PPolyproline II helixtrans-74.4134.7168.8178.355.7-108.300109.6R359 K360 P361 R475 L477R359-E473 WeakPolarHBondContact CB-OE1 3.32Å; R359-E473 WeakPolarHBondContact CD-OE1 3.32Å; R359-E473 VanDerWaalsContact N-CD 3.3Å; R359-E473 PolarHBondContact N-OE1 2.92Å; R359-E473 PolarHBondContact N-OE2 3.2Å; K360-E473 WeakPolarHBondContact CB-OE2 3.47Å; K360-E473 PolarHBondContact N-OE2 3.08Å; P361-E473 WeakPolarHBondContact CD-OE2 3.31Å; E473-R475 HydrophobicContact CG-CB 3.87Å; E473-R475 WeakPolarHBondContact OE1-CB 3.25Å; E473-R475 PolarHBondContact OE1-N 3.16Å; E473-L477 VanDerWaalsContact O-CD1 3.32Å; E473-L477 WeakPolarHBondContact O-CD1 3.31Å
474T85.1Confident84.9Confident1 Ų160.7 Ų60.71%0.00629%0.289CS..  trans-103.7-3.2-176.660.20000113.1R359 M410 E413 L414 Y476 L477R359-T474 PolarHBondContact NH1-O 2.75Å; M410-T474 HydrophobicContact CG-CG2 4.29Å; E413-T474 HydrophobicContact CB-CG2 4.14Å; E413-T474 WeakPolarHBondContact OE2-CB 3.43Å; E413-T474 PolarHBondContact OE2-OG1 3.05Å; L414-T474 HydrophobicContact CD1-CG2 4.38Å; L414-T474 HydrophobicContact CD2-CG2 3.49Å; L414-T474 VanDerWaalsContact CD2-CG2 3.49Å; L414-T474 HydrophobicContact CG-CG2 3.75Å; T474-Y476 PolarHBondContact O-N 3.47Å; T474-L477 PolarHBondContact O-N 3.49Å; T474-L477 VanDerWaalsContact O-N 3.13Å
475R79.3Confident83.1Confident64 Ų6462 Ų6224%0.24230%0.295CS..THydrogen-bonded Turntrans-53.6124.9178.7-165.2-171.7174167.7-11.2111.9K355 V356 E473 L477K355-R475 VanDerWaalsContact O-CZ 3.27Å; K355-R475 PolarHBondContact O-NH2 2.94Å; V356-R475 VanDerWaalsContact C-NH1 3.25Å; V356-R475 PolarHBondContact O-NH1 3.16Å; E473-R475 HydrophobicContact CG-CB 3.87Å; E473-R475 WeakPolarHBondContact OE1-CB 3.25Å; E473-R475 PolarHBondContact OE1-N 3.16Å; R475-L477 PolarHBondContact O-N 3.15Å; R475-L477 VanDerWaalsContact O-N 3.13Å
476Y75Confident81.3Confident153 Ų15359.5 Ų59.560%0.628%0.28SS*.THydrogen-bonded Turntrans61.210.3179.6-53.4-53.8000116.2N185 T474N185-Y476 VanDerWaalsContact ND2-CA 3.32Å; N185-Y476 WeakPolarHBondContact ND2-CA 3.31Å; N185-Y476 PolarHBondContact ND2-N 3.35Å; N185-Y476 PolarHBondContact OD1-N 2.97Å; T474-Y476 PolarHBondContact O-N 3.47Å
477L77Confident79.5Confident98 Ų9862.2 Ų62.251%0.51329%0.291SS..PPolyproline II helixtrans-77.6147.1171.3-63.1-176.5000111.5N185 R188 E473 T474 R475N185-L477 PolarHBondContact ND2-N 3.26Å; N185-L477 PolarHBondContact ND2-O 3.07Å; R188-L477 PolarHBondContact NH1-O 3Å; E473-L477 VanDerWaalsContact O-CD1 3.32Å; E473-L477 WeakPolarHBondContact O-CD1 3.31Å; T474-L477 PolarHBondContact O-N 3.49Å; T474-L477 VanDerWaalsContact O-N 3.13Å; R475-L477 PolarHBondContact O-N 3.15Å; R475-L477 VanDerWaalsContact O-N 3.13Å
478Q76.7Confident77.6Confident114 Ų11466.4 Ų66.453%0.53331%0.314SS..PPolyproline II helixtrans-74.3155.6169.9-66.6-176.716.500110.1P7P7-Q478 VanDerWaalsContact CB-CD 3.43Å; P7-Q478 VanDerWaalsContact CB-OE1 3.29Å
479L76.3Confident75.7Confident7 Ų767.1 Ų67.14%0.03732%0.315CS..PPolyproline II helixtrans-68.3131.5175.4-65.2176.5000109.2V180 V412 E413 E481V180-L479 HydrophobicContact CG1-CD1 4.39Å; V412-L479 HydrophobicContact CG1-CD2 4.45Å; E413-L479 HydrophobicContact CB-CD2 4.37Å; E413-L479 HydrophobicContact CG-CD2 4.16Å; L479-E481 PolarHBondContact O-N 3.18Å
480P79.4Confident73.7Confident43 Ų4363.8 Ų63.828%0.27931%0.306SS..PPolyproline II helixtrans-63.8135169.324.1-28000108.9E413 P416 T417 R420E413-P480 WeakPolarHBondContact O-CD 3.35Å; P416-P480 CarbonylContact C-O 3.56Å; P416-P480 VanDerWaalsContact CA-O 3.23Å; P416-P480 WeakPolarHBondContact CA-O 3.23Å; P416-P480 HydrophobicContact CB-CB 4.34Å; P416-P480 HydrophobicContact CG-CB 4.19Å; P416-P480 HydrophobicContact CG-CG 4.45Å; T417-P480 PolarHBondContact N-O 3.22Å; T417-P480 PolarHBondContact OG1-O 3.45Å; R420-P480 PolarHBondContact NH2-O 3.48Å
481E75Confident71.5Confident39 Ų3963.3 Ų63.318%0.18231%0.311CS..  trans-97-48.9-177.1-64.8-62.2174.500111.6R240 T417 V418 L479R240-E481 IonicContact CZ-OE1 2.86Å; R240-E481 IonicContact NH1-OE1 2.8Å; R240-E481 PolarHBondContact NH1-OE1 2.88Å; T417-E481 VanDerWaalsContact CB-OE2 3.29Å; T417-E481 WeakPolarHBondContact CB-OE2 3.38Å; T417-E481 PolarHBondContact N-O 3.37Å; T417-E481 PolarHBondContact OG1-OE2 3.25Å; V418-E481 PolarHBondContact N-O 3.16Å; L479-E481 PolarHBondContact O-N 3.18Å
482T75.5Confident69.4Low34 Ų3468.1 Ų68.121%0.20934%0.337CS..SBendtrans-121.1161179.855.70000112.5K487T482-K487 WeakPolarHBondContact OG1-CE 3.4Å; T482-K487 WeakPolarHBondContact OG1-CG 3.43Å
483M73.8Confident67.4Low4 Ų467.6 Ų67.62%0.0234%0.338CS..  trans-72.9152.5174.5-76.4-162.4-60.700112.4Y289 D293 D297 V300 P416 V419 K487Y289-M483 HydrophobicContact CD1-CE 3.1Å; Y289-M483 HydrophobicContact CE1-CE 3.17Å; Y289-M483 HydrophobicContact CG-CE 4.13Å; D293-M483 HydrophobicContact CB-CE 3.47Å; D293-M483 VanDerWaalsContact CB-CE 3.47Å; D293-M483 HydrophobicContact CB-SD 4.42Å; D297-M483 HydrophobicContact CB-SD 4.1Å; D297-M483 WeakPolarHBondContact OD2-CB 3.43Å; V300-M483 HydrophobicContact CG2-CG 4.15Å; V300-M483 HydrophobicContact CG2-SD 4.2Å; P416-M483 HydrophobicContact CB-CG 4.38Å; P416-M483 HydrophobicContact CG-CG 4.03Å; V419-M483 HydrophobicContact CG1-CE 3.99Å; V419-M483 HydrophobicContact CG1-SD 4.02Å; V419-M483 HydrophobicContact CG2-CG 4.16Å; V419-M483 HydrophobicContact CG2-SD 4.05Å; M483-K487 PolarHBondContact O-N 3.49Å
484S72.7Confident65.2Low38 Ų3872.2 Ų72.227%0.26635%0.354SS..Hα-helixtrans-70.3-40.9-174.268.30000111.7D297 K486 K487 D488D297-S484 PolarHBondContact OD1-OG 3.1Å; D297-S484 PolarHBondContact OD2-N 2.99Å; D297-S484 PolarHBondContact OD2-OG 3.23Å; S484-K486 PolarHBondContact O-N 2.86Å; S484-K486 VanDerWaalsContact O-N 3.13Å; S484-K487 WeakPolarHBondContact O-CB 3.37Å; S484-K487 PolarHBondContact O-N 3.27Å; S484-K487 VanDerWaalsContact O-N 3.07Å; S484-D488 PolarHBondContact O-N 3.02Å
485I59Low63.4Low55 Ų5575.8 Ų75.828%0.28238%0.376SS..Hα-helixtrans-51.9-43.2-179.9-64.2-178.5000111.2R296 D297 D488 E489R296-I485 HydrophobicContact CB-CD1 3.76Å; R296-I485 WeakPolarHBondContact O-CD1 3.48Å; D297-I485 VanDerWaalsContact CA-CD1 3.42Å; D297-I485 HydrophobicContact CB-CD1 3.73Å; D297-I485 HydrophobicContact CB-CG1 4.01Å; I485-D488 PolarHBondContact O-N 2.9Å; I485-E489 WeakPolarHBondContact O-CG 3.39Å; I485-E489 PolarHBondContact O-N 3.07Å
486K59.9Low62Low46 Ų4676.6 Ų76.620%0.239%0.388CS..Hα-helixtrans-87.1-20.9-176.2-61.4-154.3177.3179.10114.1V287 Y289 S484 D488 Q490V287-K486 HydrophobicContact CG1-CD 3.56Å; Y289-K486 HydrophobicContact CE1-CD 3.69Å; Y289-K486 HydrophobicContact CE1-CG 4.33Å; S484-K486 PolarHBondContact O-N 2.86Å; S484-K486 VanDerWaalsContact O-N 3.13Å; K486-D488 VanDerWaalsContact C-N 3.31Å; K486-Q490 WeakPolarHBondContact O-CB 3.41Å; K486-Q490 WeakPolarHBondContact O-CG 3.09Å; K486-Q490 PolarHBondContact O-N 3.1Å
487K57.8Low60.7Low108 Ų10875.6 Ų75.647%0.4739%0.389SS..Hα-helixtrans-63.9-41.7164.1-94.7178.6168.8177.50110.6T482 M483 S484 Q490 N491T482-K487 WeakPolarHBondContact OG1-CE 3.4Å; T482-K487 WeakPolarHBondContact OG1-CG 3.43Å; M483-K487 PolarHBondContact O-N 3.49Å; S484-K487 WeakPolarHBondContact O-CB 3.37Å; S484-K487 PolarHBondContact O-N 3.27Å; S484-K487 VanDerWaalsContact O-N 3.07Å; K487-Q490 PolarHBondContact O-N 3.22Å; K487-N491 WeakPolarHBondContact O-CB 3.39Å; K487-N491 VanDerWaalsContact O-CG 3.28Å; K487-N491 PolarHBondContact O-N 3.29Å; K487-N491 PolarHBondContact O-ND2 3.22Å
488D55Low59.4Low89 Ų8974.6 Ų74.648%0.47639%0.39SS..Hα-helixtrans-70.3-39.9178.8-62.2-23.5000111.2S484 I485 K486 N492S484-D488 PolarHBondContact O-N 3.02Å; I485-D488 PolarHBondContact O-N 2.9Å; K486-D488 VanDerWaalsContact C-N 3.31Å; D488-N492 VanDerWaalsContact O-CB 3.28Å; D488-N492 WeakPolarHBondContact O-CB 3.49Å; D488-N492 PolarHBondContact O-N 3.1Å; D488-N492 PolarHBondContact O-ND2 3.44Å
489E55.2Low58.2Low109 Ų10974 Ų7451%0.50939%0.394SS..Hα-helixtrans-62.4-44.1172.6-72.7170.4179.600112.6I485 N492 A493I485-E489 WeakPolarHBondContact O-CG 3.39Å; I485-E489 PolarHBondContact O-N 3.07Å; E489-N492 PolarHBondContact O-N 3.35Å; E489-A493 WeakPolarHBondContact O-CB 3.28Å; E489-A493 PolarHBondContact O-N 2.96Å
490Q51Low56.8Low101 Ų10180 Ų8047%0.47243%0.427SS..Hα-helixtrans-65.4-46.9176.6-80.1-179.4-15.700111.5K486 K487 N492 A493 Y494K486-Q490 WeakPolarHBondContact O-CB 3.41Å; K486-Q490 WeakPolarHBondContact O-CG 3.09Å; K486-Q490 PolarHBondContact O-N 3.1Å; K487-Q490 PolarHBondContact O-N 3.22Å; Q490-N492 VanDerWaalsContact C-N 3.31Å; Q490-N492 PolarHBondContact O-N 3.17Å; Q490-A493 PolarHBondContact O-N 3.45Å; Q490-Y494 HydrophobicContact CB-CE2 4.46Å; Q490-Y494 WeakPolarHBondContact O-CD2 3.44Å; Q490-Y494 PolarHBondContact O-N 3.1Å
491N47.3Very low54.8Low99 Ų9986.8 Ų86.853%0.52947%0.467SS..Hα-helixtrans-58.7-45.2176.9-77.7-15.1000111K487 A493 Y494 T495K487-N491 WeakPolarHBondContact O-CB 3.39Å; K487-N491 VanDerWaalsContact O-CG 3.28Å; K487-N491 PolarHBondContact O-N 3.29Å; K487-N491 PolarHBondContact O-ND2 3.22Å; N491-A493 PolarHBondContact O-N 2.68Å; N491-Y494 PolarHBondContact O-N 2.83Å; N491-T495 PolarHBondContact O-N 3.27Å; N491-T495 PolarHBondContact O-OG1 3.04Å
492N47.2Very low53.8Low103 Ų10389.2 Ų89.255%0.55148%0.481SS*.Hα-helixtrans-63.4-39.4177.3-74-21000112.5D488 E489 Q490 Y494 T495 T496D488-N492 VanDerWaalsContact O-CB 3.28Å; D488-N492 WeakPolarHBondContact O-CB 3.49Å; D488-N492 PolarHBondContact O-N 3.1Å; D488-N492 PolarHBondContact O-ND2 3.44Å; E489-N492 PolarHBondContact O-N 3.35Å; Q490-N492 VanDerWaalsContact C-N 3.31Å; Q490-N492 PolarHBondContact O-N 3.17Å; N492-Y494 PolarHBondContact O-N 3.35Å; N492-T495 PolarHBondContact O-N 3.15Å; N492-T496 PolarHBondContact O-N 3.29Å; N492-T496 PolarHBondContact O-OG1 2.96Å
493A47.2Very low52.7Low53 Ų5392.1 Ų92.144%0.43850%0.495SS..Hα-helixtrans-60.4-45.1175.200000111.6E489 Q490 N491 T495 T496 E497E489-A493 WeakPolarHBondContact O-CB 3.28Å; E489-A493 PolarHBondContact O-N 2.96Å; Q490-A493 PolarHBondContact O-N 3.45Å; N491-A493 PolarHBondContact O-N 2.68Å; A493-T495 PolarHBondContact O-N 3.27Å; A493-T496 PolarHBondContact O-N 3.16Å; A493-E497 PolarHBondContact O-N 3.19Å
494Y44.7Very low51.5Low158 Ų15896.9 Ų96.962%0.6252%0.521SS*.Hα-helixtrans-64-39.4175.5-72.7-66.9000112.8Q490 N491 N492 T496 E497 S498Q490-Y494 HydrophobicContact CB-CE2 4.46Å; Q490-Y494 WeakPolarHBondContact O-CD2 3.44Å; Q490-Y494 PolarHBondContact O-N 3.1Å; N491-Y494 PolarHBondContact O-N 2.83Å; N492-Y494 PolarHBondContact O-N 3.35Å; Y494-T496 VanDerWaalsContact C-N 3.29Å; Y494-T496 PolarHBondContact O-N 3.44Å; Y494-E497 PolarHBondContact O-N 3.47Å; Y494-S498 WeakPolarHBondContact O-CB 3.25Å; Y494-S498 PolarHBondContact O-N 2.83Å; Y494-S498 PolarHBondContact O-OG 3.33Å
495T46.5Very low50.3Low77 Ų77100.4 Ų100.447%0.47254%0.536SS..Hα-helixtrans-62.9-39.8175.5-16.70000111.3N491 N492 A493 S498 T499N491-T495 PolarHBondContact O-N 3.27Å; N491-T495 PolarHBondContact O-OG1 3.04Å; N492-T495 PolarHBondContact O-N 3.15Å; A493-T495 PolarHBondContact O-N 3.27Å; T495-S498 WeakPolarHBondContact CA-OG 3.33Å; T495-S498 PolarHBondContact O-N 3.03Å; T495-S498 PolarHBondContact O-OG 3.47Å; T495-T499 PolarHBondContact O-N 3.48Å; T495-T499 VanDerWaalsContact O-N 3.11Å; T495-T499 PolarHBondContact O-OG1 3.16Å
496T48.9Very low49.7Very low80 Ų80103.3 Ų103.349%0.49155%0.552SS.*Hα-helixtrans-72.4-33.9-177.2-35.70000112.4N492 A493 Y494 T499 N500N492-T496 PolarHBondContact O-N 3.29Å; N492-T496 PolarHBondContact O-OG1 2.96Å; A493-T496 PolarHBondContact O-N 3.16Å; Y494-T496 VanDerWaalsContact C-N 3.29Å; Y494-T496 PolarHBondContact O-N 3.44Å; T496-T499 PolarHBondContact O-OG1 3.41Å; T496-N500 PolarHBondContact O-ND2 3.32Å
497E48.8Very low49.1Very low133 Ų133107.1 Ų107.162%0.62158%0.576SS**Hα-helixtrans-69.8-38.9171-77.2-178.6167.900111.5A493 Y494 T499 N500A493-E497 PolarHBondContact O-N 3.19Å; Y494-E497 PolarHBondContact O-N 3.47Å; E497-T499 VanDerWaalsContact C-N 3.3Å; E497-T499 PolarHBondContact O-N 3.29Å; E497-N500 PolarHBondContact O-N 3.16Å
498S49.2Very low48.4Very low76 Ų76107 Ų10753%0.53158%0.583SS.*Hα-helixtrans-71-18.8178.5670000115Y494 T495Y494-S498 WeakPolarHBondContact O-CB 3.25Å; Y494-S498 PolarHBondContact O-N 2.83Å; Y494-S498 PolarHBondContact O-OG 3.33Å; T495-S498 WeakPolarHBondContact CA-OG 3.33Å; T495-S498 PolarHBondContact O-N 3.03Å; T495-S498 PolarHBondContact O-OG 3.47Å
499T51.2Low47.9Very low102 Ų102108.4 Ų108.463%0.62659%0.592SS**THydrogen-bonded Turntrans-90.4-8.1172.646.40000113.9T495 T496 E497T495-T499 PolarHBondContact O-N 3.48Å; T495-T499 VanDerWaalsContact O-N 3.11Å; T495-T499 PolarHBondContact O-OG1 3.16Å; T496-T499 PolarHBondContact O-OG1 3.41Å; E497-T499 VanDerWaalsContact C-N 3.3Å; E497-T499 PolarHBondContact O-N 3.29Å
500N46.8Very low47.3Very low134 Ų134108.3 Ų108.372%0.71760%0.599SS**  trans-104.48.6178.6-75.2-35.8000113.3T496 E497T496-N500 PolarHBondContact O-ND2 3.32Å; E497-N500 PolarHBondContact O-N 3.16Å
501V39.1Very low47Very low184 Ų184109 Ų109100%1.11561%0.61SS**  trans-115.80169.8-177.70000107.8

Retrieved 501 of 501 residues in 435.1 ms (Link to these results)

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