A0A3Q0KIK1_SCHMA Loading...

Rhodopsin-like orphan GPCR,putative

AlphaFold DB , UniProt , Accession A0A3Q0KIK1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 357 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
1M34.2Very low51.4Low226 Ų226110.8 Ų110.8100%1.11354%0.54SS*.  0116.60-73.6174.6-167.700108.9A3M1-A3 VanDerWaalsContact C-N 3.26Å; M1-A3 PolarHBondContact O-N 3.05Å; M1-A3 VanDerWaalsContact O-N 3.12Å
2R28.4Very low53.9Low241 Ų241102.8 Ų102.891%0.90950%0.503SS*.  trans-85.970.4176.5-162.3-172.4-79176.4-5.3108K4R2-K4 PolarHBondContact O-N 3.19Å
3A37.1Very low56Low61 Ų6195.3 Ų95.350%0.50447%0.466SS..  trans-69.692.3170.500000107M1 F5M1-A3 VanDerWaalsContact C-N 3.26Å; M1-A3 PolarHBondContact O-N 3.05Å; M1-A3 VanDerWaalsContact O-N 3.12Å; A3-F5 HydrophobicContact CB-CD2 3.54Å; A3-F5 HydrophobicContact CB-CE2 3.77Å; A3-F5 PolarHBondContact O-N 2.94Å
4K34.3Very low57.9Low193 Ų19391 Ų9184%0.83945%0.446SS*.  trans-61.682.1156.2-90-175.8171.9-177.60105.7R2 N6R2-K4 PolarHBondContact O-N 3.19Å; K4-N6 VanDerWaalsContact C-N 3.3Å; K4-N6 PolarHBondContact O-N 3.02Å
5F47Very low59.5Low97 Ų9787.1 Ų87.143%0.42543%0.428SS..  trans-7096.8169.7-99.9-83.5000106.7A3 S7 P13 L14A3-F5 HydrophobicContact CB-CD2 3.54Å; A3-F5 HydrophobicContact CB-CE2 3.77Å; A3-F5 PolarHBondContact O-N 2.94Å; F5-S7 PolarHBondContact O-N 3.39Å; F5-P13 HydrophobicContact CE1-CG 4.3Å; F5-P13 HydrophobicContact CZ-CG 4.17Å; F5-L14 HydrophobicContact CD2-CD1 3.61Å; F5-L14 HydrophobicContact CE2-CD1 3.69Å; F5-L14 HydrophobicContact CE2-CG 4.38Å
6N44Very low61Low161 Ų16181.8 Ų81.886%0.86140%0.402SS*.  trans-6765149.9-95-1.4000106.9K4 T8K4-N6 VanDerWaalsContact C-N 3.3Å; K4-N6 PolarHBondContact O-N 3.02Å; N6-T8 PolarHBondContact O-N 3.43Å; N6-T8 VanDerWaalsContact O-N 3.13Å
7S56.1Low62.5Low22 Ų2278.8 Ų78.815%0.15439%0.388CS..  trans-74.7108.1170.9570000106F5 D9 T12 R198F5-S7 PolarHBondContact O-N 3.39Å; S7-D9 PolarHBondContact O-N 2.94Å; S7-D9 VanDerWaalsContact O-N 3.14Å; S7-T12 WeakPolarHBondContact OG-CG2 3.38Å; S7-R198 PolarHBondContact OG-NH1 3.23Å
8T64.8Low63.8Low88 Ų8876.8 Ų76.854%0.5438%0.381SS..  trans-63-6.7167.350.10000111.9N6 R198 N199N6-T8 PolarHBondContact O-N 3.43Å; N6-T8 VanDerWaalsContact O-N 3.13Å; T8-R198 CarbonylContact O-C 3.45Å; T8-R198 VanDerWaalsContact O-CA 3.26Å; T8-R198 WeakPolarHBondContact O-CA 3.46Å; T8-N199 WeakPolarHBondContact O-CB 3.1Å; T8-N199 PolarHBondContact O-N 3.49Å; T8-N199 PolarHBondContact O-ND2 2.98Å
9D75Confident65Low37 Ų3773.5 Ų73.520%0.19837%0.365CS..BIsolated β-bridgetrans-111.8148-167.6-66.8-4.6000111.8S7 L119 R198 N199S7-D9 PolarHBondContact O-N 2.94Å; S7-D9 VanDerWaalsContact O-N 3.14Å; D9-L119 HydrophobicContact CB-CD1 3.91Å; D9-R198 PolarHBondContact O-NH1 3.47Å; D9-N199 PolarHBondContact OD1-ND2 2.76Å
10F67.9Low66.1Low67 Ų6770.7 Ų70.729%0.29435%0.352SS..SBendtrans-69.8-41179.9-174.8-89.1000111.5R198 N199 I200F10-R198 HydrophobicContact CB-CB 4.29Å; F10-N199 WeakPolarHBondContact CB-O 3.39Å; F10-N199 PolarHBondContact N-O 2.9Å; F10-I200 HydrophobicContact CB-CB 3.84Å; F10-I200 HydrophobicContact CB-CD1 4.41Å; F10-I200 HydrophobicContact CB-CG1 4.27Å; F10-I200 HydrophobicContact CD1-CD1 3.93Å; F10-I200 HydrophobicContact CD2-CD1 4.38Å; F10-I200 HydrophobicContact CE1-CD1 4.3Å; F10-I200 HydrophobicContact CG-CB 4.25Å; F10-I200 HydrophobicContact CG-CD1 3.98Å; F10-I200 HydrophobicContact CG-CG1 4.38Å
11Y76.7Confident67.2Low26 Ų2670.6 Ų70.610%0.10235%0.353CS..SBendtrans-88.4136.4170-62.2-62.3000109.9D15 R98 T102 F103 L119Y11-D15 VanDerWaalsContact CA-OD2 3.27Å; Y11-D15 WeakPolarHBondContact CA-OD2 3.37Å; Y11-R98 PolarHBondContact OH-NH2 2.9Å; Y11-T102 HydrophobicContact CD1-CG2 4.4Å; Y11-T102 HydrophobicContact CG-CG2 4.2Å; Y11-F103 HydrophobicContact CD1-CE1 4.35Å; Y11-F103 AromaticContact CD1-CZ 3.92Å; Y11-F103 HydrophobicContact CD1-CZ 3.92Å; Y11-F103 AromaticContact CE1-CZ 3.83Å; Y11-F103 HydrophobicContact CE1-CZ 3.83Å; Y11-L119 HydrophobicContact CD2-CD1 4.02Å
12T81.2Confident69.7Low15 Ų1563.4 Ų63.49%0.09232%0.317CS..  trans-124.4151.8174.680.30000110.4S7 L14 D15S7-T12 WeakPolarHBondContact OG-CG2 3.38Å; T12-L14 PolarHBondContact O-N 3.33Å; T12-L14 PolarHBondContact OG1-N 3.19Å; T12-D15 WeakPolarHBondContact CB-OD1 3.44Å; T12-D15 VanDerWaalsContact N-CG 3.25Å; T12-D15 PolarHBondContact N-OD1 3.12Å; T12-D15 VanDerWaalsContact N-OD1 3.15Å; T12-D15 PolarHBondContact N-OD2 3.04Å; T12-D15 WeakPolarHBondContact O-CB 3.47Å; T12-D15 PolarHBondContact O-N 3.07Å; T12-D15 PolarHBondContact OG1-N 3.07Å; T12-D15 PolarHBondContact OG1-OD1 3.36Å
13P81.2Confident72.6Confident5 Ų555.3 Ų55.33%0.03229%0.291CS..THydrogen-bonded Turntrans-62.5-14.4175.825.9-35.5000113.1F5 P106 Y114F5-P13 HydrophobicContact CE1-CG 4.3Å; F5-P13 HydrophobicContact CZ-CG 4.17Å; P13-P106 HydrophobicContact CB-CB 4.09Å; P13-P106 VanDerWaalsContact O-CB 3.27Å; P13-P106 WeakPolarHBondContact O-CB 3.42Å; P13-Y114 HydrophobicContact CB-CD1 3.46Å; P13-Y114 VanDerWaalsContact CB-CD1 3.46Å; P13-Y114 HydrophobicContact CB-CD2 4.31Å; P13-Y114 HydrophobicContact CB-CE1 3.96Å; P13-Y114 HydrophobicContact CB-CG 3.66Å; P13-Y114 HydrophobicContact CG-CD1 3.8Å; P13-Y114 HydrophobicContact CG-CD2 4.46Å; P13-Y114 HydrophobicContact CG-CE1 3.73Å; P13-Y114 HydrophobicContact CG-CE2 4.41Å; P13-Y114 HydrophobicContact CG-CG 4.16Å
14L83.1Confident75.1Confident35 Ų3559.9 Ų59.918%0.18330%0.302CS..THydrogen-bonded Turntrans-95.62.3178.3-64.1174.6000112.7F5 T12 T16 L17 V18 L21F5-L14 HydrophobicContact CD2-CD1 3.61Å; F5-L14 HydrophobicContact CE2-CD1 3.69Å; F5-L14 HydrophobicContact CE2-CG 4.38Å; T12-L14 PolarHBondContact O-N 3.33Å; T12-L14 PolarHBondContact OG1-N 3.19Å; L14-T16 PolarHBondContact O-N 3.1Å; L14-T16 VanDerWaalsContact O-N 3.12Å; L14-L17 HydrophobicContact CD2-CB 4.27Å; L14-L17 HydrophobicContact CD2-CD1 4.15Å; L14-L17 CarbonylContact O-C 3.57Å; L14-L17 PolarHBondContact O-N 3.29Å; L14-V18 HydrophobicContact CB-CB 4.24Å; L14-V18 WeakPolarHBondContact O-CB 3.37Å; L14-V18 WeakPolarHBondContact O-CG1 3.46Å; L14-V18 PolarHBondContact O-N 3.45Å; L14-L21 HydrophobicContact CD2-CD1 4.45Å
15D81.7Confident77.8Confident32 Ų3256.4 Ų56.417%0.17129%0.289CS..THydrogen-bonded Turntrans-56.4-35.9-176.7-71.3-9.7000111.9Y11 T12 S38 R303Y11-D15 VanDerWaalsContact CA-OD2 3.27Å; Y11-D15 WeakPolarHBondContact CA-OD2 3.37Å; T12-D15 WeakPolarHBondContact CB-OD1 3.44Å; T12-D15 VanDerWaalsContact N-CG 3.25Å; T12-D15 PolarHBondContact N-OD1 3.12Å; T12-D15 VanDerWaalsContact N-OD1 3.15Å; T12-D15 PolarHBondContact N-OD2 3.04Å; T12-D15 WeakPolarHBondContact O-CB 3.47Å; T12-D15 PolarHBondContact O-N 3.07Å; T12-D15 PolarHBondContact OG1-N 3.07Å; T12-D15 PolarHBondContact OG1-OD1 3.36Å; D15-S38 PolarHBondContact O-OG 3.18Å; D15-R303 PolarHBondContact O-NH1 3.13Å
16T83.7Confident79.6Confident2 Ų254.8 Ų54.81%0.01230%0.3CS..THydrogen-bonded Turntrans-88.22.1177.152.90000114.4L14 S38 L41 F103L14-T16 PolarHBondContact O-N 3.1Å; L14-T16 VanDerWaalsContact O-N 3.12Å; T16-S38 WeakPolarHBondContact O-CB 3.39Å; T16-L41 HydrophobicContact CG2-CD2 4.24Å; T16-L41 HydrophobicContact CG2-CG 4.25Å; T16-F103 HydrophobicContact CG2-CB 4.24Å; T16-F103 HydrophobicContact CG2-CD1 3.95Å
17L86.7Confident81.6Confident32 Ų3251 Ų5117%0.16828%0.277CS..THydrogen-bonded Turntrans-127.2-32.5-172.7-62.4171.3000113.6L14 D19 C20 L21 F107 A110L14-L17 HydrophobicContact CD2-CB 4.27Å; L14-L17 HydrophobicContact CD2-CD1 4.15Å; L14-L17 CarbonylContact O-C 3.57Å; L14-L17 PolarHBondContact O-N 3.29Å; L17-D19 VanDerWaalsContact C-N 3.33Å; L17-D19 PolarHBondContact O-N 2.94Å; L17-C20 PolarHBondContact O-N 3.34Å; L17-C20 VanDerWaalsContact O-N 3.16Å; L17-L21 HydrophobicContact CB-CD1 4.41Å; L17-L21 WeakPolarHBondContact O-CG 3.48Å; L17-L21 PolarHBondContact O-N 2.97Å; L17-F107 HydrophobicContact CD2-CD2 3.79Å; L17-F107 HydrophobicContact CD2-CE2 4.09Å; L17-F107 HydrophobicContact CG-CD2 4.5Å; L17-A110 VanDerWaalsContact CD1-C 3.48Å
18V86Confident82.8Confident43 Ų4355.8 Ų55.826%0.26131%0.308SS..Hα-helixtrans-59.8-39.5-168.868.70000112.6L14 C20 L21 M22L14-V18 HydrophobicContact CB-CB 4.24Å; L14-V18 WeakPolarHBondContact O-CB 3.37Å; L14-V18 WeakPolarHBondContact O-CG1 3.46Å; L14-V18 PolarHBondContact O-N 3.45Å; V18-C20 VanDerWaalsContact C-N 3.32Å; V18-C20 PolarHBondContact O-N 2.99Å; V18-L21 PolarHBondContact O-N 3.26Å; V18-M22 HydrophobicContact CG2-CG 4.34Å; V18-M22 WeakPolarHBondContact O-CB 3.35Å; V18-M22 WeakPolarHBondContact O-CG 3.41Å; V18-M22 PolarHBondContact O-N 3Å
19D85.4Confident83.6Confident14 Ų1459 Ų598%0.07532%0.321CS..Hα-helixtrans-66.9-37.4-178.5-61.7-15.5000112.2L17 M22 L23 L34 C35 S38 R303L17-D19 VanDerWaalsContact C-N 3.33Å; L17-D19 PolarHBondContact O-N 2.94Å; D19-M22 PolarHBondContact O-N 2.92Å; D19-L23 WeakPolarHBondContact O-CB 2.94Å; D19-L23 PolarHBondContact O-N 2.91Å; D19-L34 HydrophobicContact CB-CB 4.11Å; D19-L34 WeakPolarHBondContact OD2-CB 3.49Å; D19-C35 HydrophobicContact CB-CB 4.18Å; D19-S38 PolarHBondContact OD2-OG 3.36Å; D19-R303 IonicContact OD1-CZ 3.56Å; D19-R303 IonicContact OD1-NE 3.94Å; D19-R303 IonicContact OD1-NH1 3.56Å; D19-R303 PolarHBondContact OD1-NH1 2.95Å; D19-R303 IonicContact OD1-NH2 3.79Å; D19-R303 PolarHBondContact OD1-NH2 2.89Å; D19-R303 IonicContact OD2-CZ 3.32Å; D19-R303 IonicContact OD2-NE 3.3Å; D19-R303 PolarHBondContact OD2-NE 3.38Å; D19-R303 IonicContact OD2-NH1 2.72Å; D19-R303 PolarHBondContact OD2-NH1 3.32Å; D19-R303 IonicContact OD2-NH2 2.67Å; D19-R303 PolarHBondContact OD2-NH2 3.48Å
20C88.5Confident83.9Confident16 Ų1658.6 Ų58.611%0.10832%0.323CS..Hα-helixtrans-72.3-40.5177.4-61.30000110.9L17 V18 M22 L23 E24 C35L17-C20 PolarHBondContact O-N 3.34Å; L17-C20 VanDerWaalsContact O-N 3.16Å; V18-C20 VanDerWaalsContact C-N 3.32Å; V18-C20 PolarHBondContact O-N 2.99Å; C20-M22 VanDerWaalsContact C-N 3.29Å; C20-M22 PolarHBondContact O-N 2.94Å; C20-L23 PolarHBondContact O-N 3.43Å; C20-E24 WeakPolarHBondContact O-CB 3.37Å; C20-E24 WeakPolarHBondContact O-CG 3.49Å; C20-E24 PolarHBondContact O-N 3.4Å; C20-C35 WeakPolarHBondContact CA-SG 3.46Å; C20-C35 HydrophobicContact CB-CB 4.06Å; C20-C35 WeakPolarHBondContact CB-SG 3.42Å; C20-C35 WeakPolarHBondContact SG-CA 3.44Å; C20-C35 WeakPolarHBondContact SG-CB 3.13Å; C20-C35 PolarHBondContact SG-O 3.38Å; C20-C35 VanDerWaalsContact SG-O 3.38Å; C20-C35 CovalentContact SG-SG 2.05Å; C20-C35 PolarHBondContact SG-SG 3.04Å
21L89.1Confident84.8Confident69 Ų6956.5 Ų56.536%0.36132%0.317SS..Hα-helixtrans-61.1-38.9172.7-68.7171.7000111.9L14 L17 V18 Q25L14-L21 HydrophobicContact CD2-CD1 4.45Å; L17-L21 HydrophobicContact CB-CD1 4.41Å; L17-L21 WeakPolarHBondContact O-CG 3.48Å; L17-L21 PolarHBondContact O-N 2.97Å; V18-L21 PolarHBondContact O-N 3.26Å; L21-Q25 WeakPolarHBondContact O-CB 3.44Å; L21-Q25 WeakPolarHBondContact O-CG 3.42Å; L21-Q25 PolarHBondContact O-N 2.8Å
22M86.6Confident85.4Confident76 Ų7661.8 Ų61.837%0.37434%0.341SS..Hα-helixtrans-66-40.1176-72.4-68-151.300111.7V18 D19 C20 G26 H27 A30V18-M22 HydrophobicContact CG2-CG 4.34Å; V18-M22 WeakPolarHBondContact O-CB 3.35Å; V18-M22 WeakPolarHBondContact O-CG 3.41Å; V18-M22 PolarHBondContact O-N 3Å; D19-M22 PolarHBondContact O-N 2.92Å; C20-M22 VanDerWaalsContact C-N 3.29Å; C20-M22 PolarHBondContact O-N 2.94Å; M22-G26 PolarHBondContact O-N 3.2Å; M22-H27 HydrophobicContact CB-CB 4.42Å; M22-H27 PolarHBondContact O-CD2 3.13Å; M22-H27 PolarHBondContact O-N 3.24Å; M22-H27 HydrophobicContact SD-CB 4.25Å; M22-H27 PolarHBondContact SD-CD2 3.14Å; M22-A30 HydrophobicContact CB-CB 4.14Å
23L88.9Confident85.7Confident70 Ų7066.1 Ų66.137%0.36636%0.362SS..Hα-helixtrans-66.8-44.7177.2-170.970.5000111.9D19 C20 Q25 G26 A30 K32 C35D19-L23 WeakPolarHBondContact O-CB 2.94Å; D19-L23 PolarHBondContact O-N 2.91Å; C20-L23 PolarHBondContact O-N 3.43Å; L23-Q25 VanDerWaalsContact C-N 3.3Å; L23-Q25 PolarHBondContact O-N 2.61Å; L23-G26 PolarHBondContact O-N 3.23Å; L23-G26 VanDerWaalsContact O-N 3.12Å; L23-A30 HydrophobicContact CB-CB 4.11Å; L23-A30 HydrophobicContact CD1-CB 3.95Å; L23-K32 HydrophobicContact CD2-CB 4.37Å; L23-K32 HydrophobicContact CD2-CG 4.33Å; L23-C35 HydrophobicContact CD2-CB 4.23Å
24E89.5Confident86Confident157 Ų15766.5 Ų66.573%0.73436%0.364SS*.Hα-helixtrans-64-34.6177.1-74.5175.5-178.100112.5C20 G26C20-E24 WeakPolarHBondContact O-CB 3.37Å; C20-E24 WeakPolarHBondContact O-CG 3.49Å; C20-E24 PolarHBondContact O-N 3.4Å; E24-G26 PolarHBondContact O-N 3.44Å
25Q90.4Very high86.3Confident121 Ų12165.3 Ų65.357%0.56536%0.358SS*.THydrogen-bonded Turntrans-79.6-2.3176.2-71.6172.821.700113.7L21 L23 H27L21-Q25 WeakPolarHBondContact O-CB 3.44Å; L21-Q25 WeakPolarHBondContact O-CG 3.42Å; L21-Q25 PolarHBondContact O-N 2.8Å; L23-Q25 VanDerWaalsContact C-N 3.3Å; L23-Q25 PolarHBondContact O-N 2.61Å; Q25-H27 PolarHBondContact OE1-NE2 3.14Å
26G85.3Confident86.7Confident63 Ų6368.7 Ų68.765%0.64937%0.373SS*.THydrogen-bonded Turntrans70.429.617800000114.4M22 L23 E24M22-G26 PolarHBondContact O-N 3.2Å; L23-G26 PolarHBondContact O-N 3.23Å; L23-G26 VanDerWaalsContact O-N 3.12Å; E24-G26 PolarHBondContact O-N 3.44Å
27H85.3Confident86.9Confident80 Ų8069.6 Ų69.637%0.3738%0.377SS..  trans-66139.3177.3-75.8-82.9000111.4M22 Q25 N29 A30M22-H27 HydrophobicContact CB-CB 4.42Å; M22-H27 PolarHBondContact O-CD2 3.13Å; M22-H27 PolarHBondContact O-N 3.24Å; M22-H27 HydrophobicContact SD-CB 4.25Å; M22-H27 PolarHBondContact SD-CD2 3.14Å; Q25-H27 PolarHBondContact OE1-NE2 3.14Å; H27-N29 PolarHBondContact O-N 3.35Å; H27-A30 HydrophobicContact CB-CB 4.42Å; H27-A30 VanDerWaalsContact O-CB 3.26Å; H27-A30 WeakPolarHBondContact O-CB 3.49Å; H27-A30 PolarHBondContact O-N 3.45Å
28P82.8Confident87.1Confident124 Ų12468.1 Ų68.181%0.80537%0.37SS*.THydrogen-bonded Turntrans-65.5-24.4-174.425.5-34.9000113.9
29N80.3Confident87.4Confident155 Ų15569.3 Ų69.383%0.82937%0.374SS*.THydrogen-bonded Turntrans-95.78178.7-65.3-15.4000113H27 S31H27-N29 PolarHBondContact O-N 3.35Å; N29-S31 PolarHBondContact O-N 3.03Å
30A82.3Confident87.7Confident28 Ų2871.9 Ų71.923%0.23139%0.39CS..  trans-72.9126.5-179.700000110.9M22 L23 H27M22-A30 HydrophobicContact CB-CB 4.14Å; L23-A30 HydrophobicContact CB-CB 4.11Å; L23-A30 HydrophobicContact CD1-CB 3.95Å; H27-A30 HydrophobicContact CB-CB 4.42Å; H27-A30 VanDerWaalsContact O-CB 3.26Å; H27-A30 WeakPolarHBondContact O-CB 3.49Å; H27-A30 PolarHBondContact O-N 3.45Å
31S86.5Confident87.8Confident24 Ų2471.4 Ų71.417%0.16839%0.386CS..  trans-103.8126.3175.4167.80000110.3N29 I33 L34 C35 E300N29-S31 PolarHBondContact O-N 3.03Å; S31-I33 PolarHBondContact O-N 3.39Å; S31-I33 PolarHBondContact OG-N 3.14Å; S31-L34 PolarHBondContact O-N 3.26Å; S31-L34 PolarHBondContact OG-N 3.49Å; S31-C35 PolarHBondContact O-N 3.41Å; S31-E300 WeakPolarHBondContact CB-OE1 3.42Å; S31-E300 PolarHBondContact OG-OE1 3.45Å
32K88.6Confident87.9Confident137 Ų13768.1 Ų68.160%0.59637%0.369SS*.Hα-helixtrans-62.6-34174.7-173176.8179.5179.80111.9L23 H36L23-K32 HydrophobicContact CD2-CB 4.37Å; L23-K32 HydrophobicContact CD2-CG 4.33Å; K32-H36 WeakPolarHBondContact CE-NE2 3.32Å; K32-H36 PolarHBondContact O-CD2 2.96Å; K32-H36 PolarHBondContact O-N 3.47Å; K32-H36 VanDerWaalsContact O-N 3.08Å
33I88Confident88.3Confident105 Ų10566.3 Ų66.354%0.53836%0.364SS..Hα-helixtrans-66.7-46.8-179.7-62.6173.3000110.1S31 C35 H36 I37S31-I33 PolarHBondContact O-N 3.39Å; S31-I33 PolarHBondContact OG-N 3.14Å; I33-C35 PolarHBondContact O-N 3.09Å; I33-H36 PolarHBondContact O-N 2.95Å; I33-I37 HydrophobicContact CG2-CD1 3.92Å; I33-I37 HydrophobicContact CG2-CG1 4.49Å; I33-I37 WeakPolarHBondContact O-CG1 3.29Å; I33-I37 PolarHBondContact O-N 3.36Å
34L86.3Confident88.5Confident13 Ų1364.7 Ų64.77%0.06836%0.355CS..Hα-helixtrans-55.8-48.6175.8-88.5165.5000111.9D19 S31 H36 I37 S38 E300 R303D19-L34 HydrophobicContact CB-CB 4.11Å; D19-L34 WeakPolarHBondContact OD2-CB 3.49Å; S31-L34 PolarHBondContact O-N 3.26Å; S31-L34 PolarHBondContact OG-N 3.49Å; L34-H36 PolarHBondContact O-N 3.49Å; L34-I37 PolarHBondContact O-N 3.4Å; L34-S38 PolarHBondContact O-N 2.92Å; L34-S38 PolarHBondContact O-OG 3.46Å; L34-E300 HydrophobicContact CD1-CG 3.68Å; L34-E300 HydrophobicContact CD2-CB 4.36Å; L34-E300 HydrophobicContact CD2-CG 4.15Å; L34-E300 HydrophobicContact CG-CB 4.39Å; L34-E300 HydrophobicContact CG-CG 3.75Å; L34-R303 HydrophobicContact CD2-CB 4.28Å; L34-R303 VanDerWaalsContact CD2-CD 3.43Å; L34-R303 HydrophobicContact CD2-CG 4.02Å
35C89.8Confident88.7Confident11 Ų1157.2 Ų57.27%0.07432%0.32CS..Hα-helixtrans-58.1-45.8174.6170.70000112.4D19 C20 L23 S31 I33 I37 S38 I39D19-C35 HydrophobicContact CB-CB 4.18Å; C20-C35 WeakPolarHBondContact CA-SG 3.46Å; C20-C35 HydrophobicContact CB-CB 4.06Å; C20-C35 WeakPolarHBondContact CB-SG 3.42Å; C20-C35 WeakPolarHBondContact SG-CA 3.44Å; C20-C35 WeakPolarHBondContact SG-CB 3.13Å; C20-C35 PolarHBondContact SG-O 3.38Å; C20-C35 VanDerWaalsContact SG-O 3.38Å; C20-C35 CovalentContact SG-SG 2.05Å; C20-C35 PolarHBondContact SG-SG 3.04Å; L23-C35 HydrophobicContact CD2-CB 4.23Å; S31-C35 PolarHBondContact O-N 3.41Å; I33-C35 PolarHBondContact O-N 3.09Å; C35-I37 PolarHBondContact O-N 3.42Å; C35-S38 PolarHBondContact O-N 3.16Å; C35-I39 WeakPolarHBondContact O-CG1 3.33Å; C35-I39 PolarHBondContact O-N 3.04Å
36H90.5Very high88.9Confident103 Ų10351.9 Ų51.948%0.47730%0.297SS..Hα-helixtrans-61.2-43176.8-76.8-55.6000112.8K32 I33 L34 S38 I39 V40K32-H36 WeakPolarHBondContact CE-NE2 3.32Å; K32-H36 PolarHBondContact O-CD2 2.96Å; K32-H36 PolarHBondContact O-N 3.47Å; K32-H36 VanDerWaalsContact O-N 3.08Å; I33-H36 PolarHBondContact O-N 2.95Å; L34-H36 PolarHBondContact O-N 3.49Å; H36-S38 VanDerWaalsContact C-N 3.33Å; H36-S38 PolarHBondContact O-N 3.02Å; H36-I39 PolarHBondContact O-N 3.19Å; H36-V40 VanDerWaalsContact O-CG2 3.29Å; H36-V40 WeakPolarHBondContact O-CG2 3.42Å; H36-V40 PolarHBondContact O-N 2.95Å
37I89.1Confident89.4Confident20 Ų2055.5 Ų55.510%0.10329%0.292CS..Hα-helixtrans-59.5-45.7176.1-70.7169.5000110.5I33 L34 C35 V40 L41 R303 F304 L307I33-I37 HydrophobicContact CG2-CD1 3.92Å; I33-I37 HydrophobicContact CG2-CG1 4.49Å; I33-I37 WeakPolarHBondContact O-CG1 3.29Å; I33-I37 PolarHBondContact O-N 3.36Å; L34-I37 PolarHBondContact O-N 3.4Å; C35-I37 PolarHBondContact O-N 3.42Å; I37-V40 PolarHBondContact O-N 3.11Å; I37-L41 WeakPolarHBondContact O-CB 3.33Å; I37-L41 PolarHBondContact O-N 3.23Å; I37-R303 HydrophobicContact CG2-CB 4.13Å; I37-F304 HydrophobicContact CD1-CD2 4.42Å; I37-L307 HydrophobicContact CG2-CB 4.18Å; I37-L307 HydrophobicContact CG2-CD2 4.12Å
38S89.7Confident89.9Confident2 Ų254.9 Ų54.91%0.01429%0.294CS..Hα-helixtrans-63.8-41.6179-76.10000113.1D15 T16 D19 L34 C35 H36 L41 G42 R303D15-S38 PolarHBondContact O-OG 3.18Å; T16-S38 WeakPolarHBondContact O-CB 3.39Å; D19-S38 PolarHBondContact OD2-OG 3.36Å; L34-S38 PolarHBondContact O-N 2.92Å; L34-S38 PolarHBondContact O-OG 3.46Å; C35-S38 PolarHBondContact O-N 3.16Å; H36-S38 VanDerWaalsContact C-N 3.33Å; H36-S38 PolarHBondContact O-N 3.02Å; S38-L41 PolarHBondContact O-N 3.16Å; S38-G42 PolarHBondContact O-N 2.75Å; S38-R303 PolarHBondContact OG-NH1 2.98Å
39I91.6Very high90.5Very high68 Ų6849 Ų4935%0.34926%0.255SS..Hα-helixtrans-62.2-45.8174.4-70167.8000110.6C35 H36 S43 F107C35-I39 WeakPolarHBondContact O-CG1 3.33Å; C35-I39 PolarHBondContact O-N 3.04Å; H36-I39 PolarHBondContact O-N 3.19Å; I39-S43 WeakPolarHBondContact O-CB 3.41Å; I39-S43 PolarHBondContact O-N 3.48Å; I39-S43 PolarHBondContact O-OG 3.12Å; I39-F107 HydrophobicContact CG2-CZ 4.45Å
40V92.3Very high91.3Very high67 Ų6743 Ų4341%0.40623%0.225SC..Hα-helixtrans-64-47.5-179.9171.50000110.5H36 I37 S43 I44 L307H36-V40 VanDerWaalsContact O-CG2 3.29Å; H36-V40 WeakPolarHBondContact O-CG2 3.42Å; H36-V40 PolarHBondContact O-N 2.95Å; I37-V40 PolarHBondContact O-N 3.11Å; V40-S43 PolarHBondContact O-N 3.32Å; V40-I44 HydrophobicContact CG1-CD1 3.71Å; V40-I44 HydrophobicContact CG1-CG1 4.41Å; V40-I44 WeakPolarHBondContact O-CB 3.45Å; V40-I44 VanDerWaalsContact O-CG1 3.26Å; V40-I44 WeakPolarHBondContact O-CG1 3.49Å; V40-I44 PolarHBondContact O-N 2.98Å; V40-L307 HydrophobicContact CG1-CD1 4.02Å
41L91Very high92Very high7 Ų746.6 Ų46.64%0.03724%0.244CC..Hα-helixtrans-59.1-51.4177.4174.459.1000111.3T16 I37 S38 S43 I44 M45 F103 L306 L307 N310T16-L41 HydrophobicContact CG2-CD2 4.24Å; T16-L41 HydrophobicContact CG2-CG 4.25Å; I37-L41 WeakPolarHBondContact O-CB 3.33Å; I37-L41 PolarHBondContact O-N 3.23Å; S38-L41 PolarHBondContact O-N 3.16Å; L41-S43 PolarHBondContact O-N 3.32Å; L41-I44 PolarHBondContact O-N 3.01Å; L41-M45 HydrophobicContact CD1-CG 4.06Å; L41-M45 WeakPolarHBondContact O-CB 3.06Å; L41-M45 WeakPolarHBondContact O-CG 3.35Å; L41-M45 PolarHBondContact O-N 3.2Å; L41-F103 HydrophobicContact CD2-CD1 4.2Å; L41-L306 HydrophobicContact CD2-CD2 3.94Å; L41-L306 HydrophobicContact CD2-CG 4.24Å; L41-L307 HydrophobicContact CB-CD1 4Å; L41-L307 HydrophobicContact CD1-CD1 4.44Å; L41-N310 HydrophobicContact CD1-CB 3.65Å; L41-N310 VanDerWaalsContact CD1-ND2 3.28Å; L41-N310 WeakPolarHBondContact CD1-ND2 3.33Å
42G91.9Very high92.4Very high0 Ų046.6 Ų46.60%024%0.242CC..Hα-helixtrans-59.2-44.9178.400000112.1S38 M45 A46 F107S38-G42 PolarHBondContact O-N 2.75Å; G42-M45 PolarHBondContact O-N 2.88Å; G42-A46 WeakPolarHBondContact O-CB 3.37Å; G42-A46 PolarHBondContact O-N 2.85Å; G42-F107 VanDerWaalsContact CA-CG 3.47Å; G42-F107 WeakPolarHBondContact O-CD1 3.25Å
43S93.6Very high92.8Very high38 Ų3840.1 Ų40.127%0.26621%0.213SC..Hα-helixtrans-65.9-44179.8-59.40000112.6I39 V40 L41 M45 Y47I39-S43 WeakPolarHBondContact O-CB 3.41Å; I39-S43 PolarHBondContact O-N 3.48Å; I39-S43 PolarHBondContact O-OG 3.12Å; V40-S43 PolarHBondContact O-N 3.32Å; L41-S43 PolarHBondContact O-N 3.32Å; S43-M45 VanDerWaalsContact C-N 3.33Å; S43-M45 PolarHBondContact O-N 3.01Å; S43-Y47 PolarHBondContact O-N 3.28Å
44I93.9Very high93.3Very high35 Ų3538.4 Ų38.418%0.17921%0.208CC..Iπ-helixtrans-59.8-48175.7-71.7170.6000109.3V40 L41 V48 F49 I311V40-I44 HydrophobicContact CG1-CD1 3.71Å; V40-I44 HydrophobicContact CG1-CG1 4.41Å; V40-I44 WeakPolarHBondContact O-CB 3.45Å; V40-I44 VanDerWaalsContact O-CG1 3.26Å; V40-I44 WeakPolarHBondContact O-CG1 3.49Å; V40-I44 PolarHBondContact O-N 2.98Å; L41-I44 PolarHBondContact O-N 3.01Å; I44-V48 HydrophobicContact CG2-CB 4.44Å; I44-V48 CarbonylContact O-C 3.57Å; I44-V48 WeakPolarHBondContact O-CA 3.45Å; I44-V48 WeakPolarHBondContact O-CB 3.25Å; I44-V48 PolarHBondContact O-N 2.74Å; I44-V48 VanDerWaalsContact O-N 3.07Å; I44-F49 PolarHBondContact O-N 3.07Å; I44-I311 HydrophobicContact CD1-CG1 4.2Å
45M94.1Very high93.8Very high1 Ų139.9 Ų39.91%0.00522%0.222CC..Iπ-helixtrans-74.5-31.9-176-67.3-49.6-4500113.8L41 G42 S43 F49 W99 F100 F103 G104 N310 N314L41-M45 HydrophobicContact CD1-CG 4.06Å; L41-M45 WeakPolarHBondContact O-CB 3.06Å; L41-M45 WeakPolarHBondContact O-CG 3.35Å; L41-M45 PolarHBondContact O-N 3.2Å; G42-M45 PolarHBondContact O-N 2.88Å; S43-M45 VanDerWaalsContact C-N 3.33Å; S43-M45 PolarHBondContact O-N 3.01Å; M45-F49 HydrophobicContact CE-CB 3.66Å; M45-F49 HydrophobicContact CE-CD1 4.02Å; M45-F49 HydrophobicContact CE-CD2 4.13Å; M45-F49 HydrophobicContact CE-CG 3.62Å; M45-F49 HydrophobicContact SD-CB 4.27Å; M45-W99 HydrophobicContact CE-CB 3.3Å; M45-W99 HydrophobicContact CE-CG 4.33Å; M45-W99 HydrophobicContact SD-CB 4.28Å; M45-F100 WeakPolarHBondContact O-CD2 3.32Å; M45-F103 HydrophobicContact CB-CB 4.03Å; M45-F103 HydrophobicContact CG-CB 4.07Å; M45-G104 VanDerWaalsContact C-CA 3.49Å; M45-N310 HydrophobicContact SD-CB 4.28Å; M45-N310 PolarHBondContact SD-OD1 3.46Å; M45-N314 PolarHBondContact SD-ND2 3.09Å
46A94.7Very high94.2Very high8 Ų839.4 Ų39.47%0.06622%0.219CC..Iπ-helixtrans-79.3-38.2-178.900000113G42 P50 G104 F107 A108G42-A46 WeakPolarHBondContact O-CB 3.37Å; G42-A46 PolarHBondContact O-N 2.85Å; A46-P50 WeakPolarHBondContact O-CG 3.44Å; A46-G104 WeakPolarHBondContact CB-O 3.14Å; A46-F107 HydrophobicContact CB-CB 4.47Å; A46-F107 HydrophobicContact CB-CD1 3.9Å; A46-A108 HydrophobicContact CB-CB 4.2Å
47Y95.4Very high94.5Very high139 Ų13936.5 Ų36.555%0.54521%0.207SC..Iπ-helixtrans-121-37.7-167.7-55.8-62.8000113.7S43 F107S43-Y47 PolarHBondContact O-N 3.28Å; Y47-F107 HydrophobicContact CE2-CD1 4.34Å; Y47-F107 HydrophobicContact CE2-CE1 4.14Å
48V95Very high94.9Very high68 Ų6840.2 Ų40.241%0.41223%0.225SC..Iπ-helixtrans-81.2-47.7-178.6-178.30000110.9I44 V51 I52I44-V48 HydrophobicContact CG2-CB 4.44Å; I44-V48 CarbonylContact O-C 3.57Å; I44-V48 WeakPolarHBondContact O-CA 3.45Å; I44-V48 WeakPolarHBondContact O-CB 3.25Å; I44-V48 PolarHBondContact O-N 2.74Å; I44-V48 VanDerWaalsContact O-N 3.07Å; V48-V51 PolarHBondContact O-N 2.8Å; V48-I52 HydrophobicContact CG1-CD1 3.68Å; V48-I52 HydrophobicContact CG1-CG1 4.33Å; V48-I52 PolarHBondContact O-N 2.94Å; V48-I52 VanDerWaalsContact O-N 3.13Å
49F95.6Very high95.2Very high0 Ų040.5 Ų40.50%023%0.228CC..Hα-helixtrans-57.5-47-178.8166.8-95.5000112.5I44 M45 V51 I52 G53 V91 G95 W96 F100 F317I44-F49 PolarHBondContact O-N 3.07Å; M45-F49 HydrophobicContact CE-CB 3.66Å; M45-F49 HydrophobicContact CE-CD1 4.02Å; M45-F49 HydrophobicContact CE-CD2 4.13Å; M45-F49 HydrophobicContact CE-CG 3.62Å; M45-F49 HydrophobicContact SD-CB 4.27Å; F49-V51 VanDerWaalsContact C-N 3.27Å; F49-V51 PolarHBondContact O-N 3.47Å; F49-I52 CarbonylContact O-C 3.52Å; F49-I52 PolarHBondContact O-N 3.48Å; F49-I52 VanDerWaalsContact O-N 3.15Å; F49-G53 PolarHBondContact O-N 3.46Å; F49-V91 HydrophobicContact CE2-CG2 4.43Å; F49-V91 HydrophobicContact CZ-CG2 4.5Å; F49-G95 VanDerWaalsContact CE2-CA 3.47Å; F49-W96 HydrophobicContact CE1-CD2 4.01Å; F49-W96 HydrophobicContact CE1-CE3 4.17Å; F49-W96 HydrophobicContact CE1-CG 4.45Å; F49-W96 HydrophobicContact CE1-CZ2 4.38Å; F49-W96 HydrophobicContact CE1-CZ3 4.43Å; F49-W96 HydrophobicContact CZ-CD2 4.21Å; F49-W96 HydrophobicContact CZ-CG 4.27Å; F49-F100 HydrophobicContact CD1-CB 3.71Å; F49-F100 AromaticContact CD1-CD2 3.99Å; F49-F100 HydrophobicContact CD1-CD2 3.99Å; F49-F100 HydrophobicContact CD1-CG 4.18Å; F49-F100 HydrophobicContact CE1-CB 3.56Å; F49-F100 HydrophobicContact CE1-CD2 4.43Å; F49-F100 HydrophobicContact CE1-CG 4.19Å; F49-F317 AromaticContact CD2-CD2 3.9Å; F49-F317 HydrophobicContact CD2-CD2 3.9Å; F49-F317 HydrophobicContact CD2-CE2 4.03Å; F49-F317 AromaticContact CE2-CD2 3.66Å; F49-F317 HydrophobicContact CE2-CD2 3.66Å; F49-F317 AromaticContact CE2-CE2 3.58Å; F49-F317 HydrophobicContact CE2-CE2 3.58Å; F49-F317 HydrophobicContact CE2-CZ 4.47Å
50P97Very high95.5Very high28 Ų2837.4 Ų37.418%0.18221%0.212CC..Hα-helixtrans-58.8-37.8-179.4-29.739.3000113.4A46 V54 W96 F100A46-P50 WeakPolarHBondContact O-CG 3.44Å; P50-V54 WeakPolarHBondContact O-CB 3.49Å; P50-V54 VanDerWaalsContact O-CG2 3.26Å; P50-V54 WeakPolarHBondContact O-CG2 3.44Å; P50-V54 PolarHBondContact O-N 3.33Å; P50-W96 HydrophobicContact CB-CH2 4.1Å; P50-F100 HydrophobicContact CG-CD2 3.77Å; P50-F100 HydrophobicContact CG-CE2 3.46Å; P50-F100 VanDerWaalsContact CG-CE2 3.46Å; P50-F100 HydrophobicContact CG-CZ 4.32Å
51V96.6Very high95.8Very high105 Ų10537.2 Ų37.264%0.63621%0.213SC*.Hα-helixtrans-64.5-49.1176.2178.90000110.4V48 F49 A55V48-V51 PolarHBondContact O-N 2.8Å; F49-V51 VanDerWaalsContact C-N 3.27Å; F49-V51 PolarHBondContact O-N 3.47Å; V51-A55 VanDerWaalsContact O-CB 3.29Å; V51-A55 WeakPolarHBondContact O-CB 3.47Å; V51-A55 PolarHBondContact O-N 2.94Å
52I96.3Very high96Very high24 Ų2439.9 Ų39.912%0.12323%0.226CC..Hα-helixtrans-64.8-43.7178.8-64176.4000110.9V48 F49 A55 D56 F317 L318V48-I52 HydrophobicContact CG1-CD1 3.68Å; V48-I52 HydrophobicContact CG1-CG1 4.33Å; V48-I52 PolarHBondContact O-N 2.94Å; V48-I52 VanDerWaalsContact O-N 3.13Å; F49-I52 CarbonylContact O-C 3.52Å; F49-I52 PolarHBondContact O-N 3.48Å; F49-I52 VanDerWaalsContact O-N 3.15Å; I52-A55 PolarHBondContact O-N 3.19Å; I52-D56 VanDerWaalsContact O-CB 3.25Å; I52-D56 WeakPolarHBondContact O-CB 3.34Å; I52-D56 PolarHBondContact O-N 2.9Å; I52-F317 HydrophobicContact CG2-CB 3.63Å; I52-L318 HydrophobicContact CD1-CB 4.49Å; I52-L318 HydrophobicContact CG2-CB 4.21Å
53G96.9Very high96.2Very high0 Ų039.9 Ų39.90%023%0.226CC..Hα-helixtrans-68-38.6-17700000112.9F49 L57F49-G53 PolarHBondContact O-N 3.46Å; G53-L57 WeakPolarHBondContact O-CB 3.45Å; G53-L57 WeakPolarHBondContact O-CG 3.44Å; G53-L57 PolarHBondContact O-N 3.37Å
54V97.7Very high96.4Very high69 Ų6938.4 Ų38.442%0.41822%0.216SC..Hα-helixtrans-67.6-45171.4171.30000110.6P50 D56 L57 I58 W96P50-V54 WeakPolarHBondContact O-CB 3.49Å; P50-V54 VanDerWaalsContact O-CG2 3.26Å; P50-V54 WeakPolarHBondContact O-CG2 3.44Å; P50-V54 PolarHBondContact O-N 3.33Å; V54-D56 VanDerWaalsContact C-N 3.31Å; V54-D56 PolarHBondContact O-N 3.13Å; V54-L57 PolarHBondContact O-N 3.22Å; V54-I58 HydrophobicContact CG1-CD1 3.63Å; V54-I58 HydrophobicContact CG1-CG1 4.31Å; V54-I58 VanDerWaalsContact O-CG1 3.32Å; V54-I58 WeakPolarHBondContact O-CG1 3.31Å; V54-I58 PolarHBondContact O-N 2.98Å; V54-W96 HydrophobicContact CG2-CH2 4.19Å; V54-W96 HydrophobicContact CG2-CZ2 3.8Å
55A97.2Very high96.4Very high45 Ų4540.3 Ų40.337%0.37223%0.23SC..Hα-helixtrans-60.3-41.8177.500000111.9V51 I52 S59V51-A55 VanDerWaalsContact O-CB 3.29Å; V51-A55 WeakPolarHBondContact O-CB 3.47Å; V51-A55 PolarHBondContact O-N 2.94Å; I52-A55 PolarHBondContact O-N 3.19Å; A55-S59 WeakPolarHBondContact O-CB 3.39Å; A55-S59 PolarHBondContact O-N 3.38Å; A55-S59 PolarHBondContact O-OG 3.43Å
56D97.2Very high96.5Very high1 Ų140.7 Ų40.71%0.00523%0.232CC..Hα-helixtrans-59.8-53175.2-173.380000111.5I52 V54 I58 S59 N60 V91 F317 S320 S321I52-D56 VanDerWaalsContact O-CB 3.25Å; I52-D56 WeakPolarHBondContact O-CB 3.34Å; I52-D56 PolarHBondContact O-N 2.9Å; V54-D56 VanDerWaalsContact C-N 3.31Å; V54-D56 PolarHBondContact O-N 3.13Å; D56-I58 PolarHBondContact O-N 3.22Å; D56-S59 PolarHBondContact O-N 3.31Å; D56-S59 PolarHBondContact O-OG 3.3Å; D56-N60 VanDerWaalsContact CG-ND2 3.3Å; D56-N60 WeakPolarHBondContact O-CB 3.44Å; D56-N60 PolarHBondContact O-N 3.47Å; D56-N60 PolarHBondContact O-ND2 3.31Å; D56-N60 VanDerWaalsContact O-ND2 3.16Å; D56-N60 PolarHBondContact OD1-ND2 2.93Å; D56-N60 PolarHBondContact OD2-ND2 3.14Å; D56-V91 HydrophobicContact CB-CG2 4.38Å; D56-V91 WeakPolarHBondContact OD2-CB 3.3Å; D56-V91 WeakPolarHBondContact OD2-CG1 3.22Å; D56-F317 VanDerWaalsContact OD1-O 3.05Å; D56-S320 WeakPolarHBondContact OD1-CB 3.44Å; D56-S320 PolarHBondContact OD1-OG 3.17Å; D56-S321 PolarHBondContact OD1-N 3.24Å; D56-S321 VanDerWaalsContact OD1-N 3.13Å
57L97.7Very high96.4Very high42 Ų4240.3 Ų40.322%0.2223%0.229CC..Hα-helixtrans-55.8-49.6176.9-77.3173.4000112.4G53 V54 C61 I88 V91 I92G53-L57 WeakPolarHBondContact O-CB 3.45Å; G53-L57 WeakPolarHBondContact O-CG 3.44Å; G53-L57 PolarHBondContact O-N 3.37Å; V54-L57 PolarHBondContact O-N 3.22Å; L57-C61 VanDerWaalsContact O-CB 3.27Å; L57-C61 WeakPolarHBondContact O-CB 3.38Å; L57-C61 PolarHBondContact O-N 3.34Å; L57-C61 PolarHBondContact O-SG 3.42Å; L57-I88 HydrophobicContact CD2-CG2 3.95Å; L57-V91 HydrophobicContact CD2-CG1 3.45Å; L57-V91 VanDerWaalsContact CD2-CG1 3.45Å; L57-V91 HydrophobicContact CG-CG1 3.77Å; L57-I92 HydrophobicContact CD2-CD1 4.29Å; L57-I92 HydrophobicContact CD2-CG1 4.04Å
58I97.6Very high96.3Very high97 Ų9735.2 Ų35.250%0.49721%0.211SC..Hα-helixtrans-63-50-178.7-67.7171000110.3V54 D56 N60 C61 I62V54-I58 HydrophobicContact CG1-CD1 3.63Å; V54-I58 HydrophobicContact CG1-CG1 4.31Å; V54-I58 VanDerWaalsContact O-CG1 3.32Å; V54-I58 WeakPolarHBondContact O-CG1 3.31Å; V54-I58 PolarHBondContact O-N 2.98Å; D56-I58 PolarHBondContact O-N 3.22Å; I58-N60 PolarHBondContact O-N 3.32Å; I58-C61 PolarHBondContact O-N 3.39Å; I58-I62 HydrophobicContact CG2-CD1 3.91Å; I58-I62 WeakPolarHBondContact O-CG1 3.49Å; I58-I62 PolarHBondContact O-N 2.73Å
59S96.7Very high96.1Very high9 Ų940.3 Ų40.36%0.06322%0.224CC..Hα-helixtrans-61-46.2-178700000111.7A55 D56 I62 V63 S321A55-S59 WeakPolarHBondContact O-CB 3.39Å; A55-S59 PolarHBondContact O-N 3.38Å; A55-S59 PolarHBondContact O-OG 3.43Å; D56-S59 PolarHBondContact O-N 3.31Å; D56-S59 PolarHBondContact O-OG 3.3Å; S59-I62 WeakPolarHBondContact O-CB 3.25Å; S59-I62 PolarHBondContact O-N 3.4Å; S59-V63 WeakPolarHBondContact O-CB 3.48Å; S59-V63 WeakPolarHBondContact O-CG2 3.22Å; S59-V63 PolarHBondContact O-N 2.96Å; S59-S321 WeakPolarHBondContact OG-CA 3.35Å
60N97.7Very high95.8Very high2 Ų246.3 Ų46.31%0.01125%0.247CC..Hα-helixtrans-70.9-33.2-179.3-77.2-53.6000112.2D56 I58 V63 A64 A84 I88 S320D56-N60 VanDerWaalsContact CG-ND2 3.3Å; D56-N60 WeakPolarHBondContact O-CB 3.44Å; D56-N60 PolarHBondContact O-N 3.47Å; D56-N60 PolarHBondContact O-ND2 3.31Å; D56-N60 VanDerWaalsContact O-ND2 3.16Å; D56-N60 PolarHBondContact OD1-ND2 2.93Å; D56-N60 PolarHBondContact OD2-ND2 3.14Å; I58-N60 PolarHBondContact O-N 3.32Å; N60-V63 PolarHBondContact O-N 3.03Å; N60-A64 WeakPolarHBondContact O-CB 3.48Å; N60-A64 PolarHBondContact O-N 2.87Å; N60-A84 HydrophobicContact CB-CB 4.19Å; N60-I88 HydrophobicContact CB-CD1 3.99Å; N60-I88 HydrophobicContact CB-CG1 3.6Å; N60-S320 PolarHBondContact ND2-OG 3.03Å; N60-S320 PolarHBondContact OD1-OG 3.27Å
61C97.7Very high95.3Very high64 Ų6445.7 Ų45.743%0.43224%0.242SC..Hα-helixtrans-60.9-44.1170.2-78.50000111.7L57 I58 T65L57-C61 VanDerWaalsContact O-CB 3.27Å; L57-C61 WeakPolarHBondContact O-CB 3.38Å; L57-C61 PolarHBondContact O-N 3.34Å; L57-C61 PolarHBondContact O-SG 3.42Å; I58-C61 PolarHBondContact O-N 3.39Å; C61-T65 WeakPolarHBondContact O-CB 3.36Å; C61-T65 PolarHBondContact O-N 2.9Å; C61-T65 PolarHBondContact O-OG1 3.5Å
62I96.3Very high94.6Very high62 Ų6244 Ų4432%0.31823%0.227SC..Hα-helixtrans-63.5-48175.9-67.1166000110.4I58 S59 T65 I66 I324 L338I58-I62 HydrophobicContact CG2-CD1 3.91Å; I58-I62 WeakPolarHBondContact O-CG1 3.49Å; I58-I62 PolarHBondContact O-N 2.73Å; S59-I62 WeakPolarHBondContact O-CB 3.25Å; S59-I62 PolarHBondContact O-N 3.4Å; I62-T65 PolarHBondContact O-N 3.32Å; I62-I66 HydrophobicContact CG2-CD1 3.69Å; I62-I66 HydrophobicContact CG2-CG1 4.38Å; I62-I66 WeakPolarHBondContact O-CG1 3.45Å; I62-I66 PolarHBondContact O-N 3.44Å; I62-I324 HydrophobicContact CB-CD1 4.15Å; I62-I324 HydrophobicContact CD1-CD1 4.39Å; I62-I324 HydrophobicContact CG2-CD1 3.84Å; I62-L338 HydrophobicContact CG2-CD1 3.68Å
63V95.9Very high93.7Very high0 Ų050 Ų500%026%0.255CS..Hα-helixtrans-59.9-49.4179.9169.20000110.9S59 N60 T65 I66 F67 A84 I324 Y327 F334S59-V63 WeakPolarHBondContact O-CB 3.48Å; S59-V63 WeakPolarHBondContact O-CG2 3.22Å; S59-V63 PolarHBondContact O-N 2.96Å; N60-V63 PolarHBondContact O-N 3.03Å; V63-T65 VanDerWaalsContact C-N 3.34Å; V63-T65 PolarHBondContact O-N 3.18Å; V63-I66 PolarHBondContact O-N 2.85Å; V63-F67 HydrophobicContact CG1-CD2 3.55Å; V63-F67 HydrophobicContact CG1-CE2 3.7Å; V63-F67 WeakPolarHBondContact O-CB 3.32Å; V63-F67 WeakPolarHBondContact O-CD2 3.45Å; V63-F67 PolarHBondContact O-N 2.88Å; V63-A84 HydrophobicContact CB-CB 4.15Å; V63-A84 HydrophobicContact CG1-CB 3.73Å; V63-I324 HydrophobicContact CG2-CB 3.91Å; V63-I324 HydrophobicContact CG2-CD1 4.32Å; V63-I324 HydrophobicContact CG2-CG1 3.99Å; V63-Y327 HydrophobicContact CG1-CD2 4.03Å; V63-Y327 HydrophobicContact CG1-CE2 3.67Å; V63-Y327 HydrophobicContact CG2-CD2 4.02Å; V63-Y327 HydrophobicContact CG2-CE2 4.18Å; V63-F334 HydrophobicContact CG2-CE2 4.43Å; V63-F334 HydrophobicContact CG2-CZ 4.08Å
64A96.4Very high93Very high7 Ų752.1 Ų52.16%0.05827%0.266CS..Hα-helixtrans-58.2-47.3177.200000110.6N60 I66 F67 L68 A84 L85N60-A64 WeakPolarHBondContact O-CB 3.48Å; N60-A64 PolarHBondContact O-N 2.87Å; A64-I66 PolarHBondContact O-N 3.37Å; A64-F67 PolarHBondContact O-N 3.47Å; A64-L68 HydrophobicContact CB-CD1 4.48Å; A64-L68 WeakPolarHBondContact O-CA 3.31Å; A64-L68 WeakPolarHBondContact O-CB 3.48Å; A64-L68 WeakPolarHBondContact O-CG 3.34Å; A64-L68 PolarHBondContact O-N 3.27Å; A64-A84 HydrophobicContact CB-CB 4.05Å; A64-L85 HydrophobicContact CB-CD2 4.04Å; A64-L85 HydrophobicContact CB-CG 4.39Å
65T95.6Very high92.4Very high76 Ų7650.1 Ų50.147%0.46625%0.251SS..Hα-helixtrans-60.8-48177.9-57.50000111.6C61 I62 V63 F67 Y69 Y70C61-T65 WeakPolarHBondContact O-CB 3.36Å; C61-T65 PolarHBondContact O-N 2.9Å; C61-T65 PolarHBondContact O-OG1 3.5Å; I62-T65 PolarHBondContact O-N 3.32Å; V63-T65 VanDerWaalsContact C-N 3.34Å; V63-T65 PolarHBondContact O-N 3.18Å; T65-F67 PolarHBondContact O-N 2.91Å; T65-Y69 WeakPolarHBondContact O-CA 3.18Å; T65-Y69 WeakPolarHBondContact O-CB 3.12Å; T65-Y69 PolarHBondContact O-N 3.24Å; T65-Y70 HydrophobicContact CG2-CE2 4.19Å
66I94.7Very high91.8Very high9 Ų948.2 Ų48.25%0.04623%0.234CC..Iπ-helixtrans-63.9-46-178.4-68172.8000111.2I62 V63 A64 Y70 L71 F334 I337 L338I62-I66 HydrophobicContact CG2-CD1 3.69Å; I62-I66 HydrophobicContact CG2-CG1 4.38Å; I62-I66 WeakPolarHBondContact O-CG1 3.45Å; I62-I66 PolarHBondContact O-N 3.44Å; V63-I66 PolarHBondContact O-N 2.85Å; A64-I66 PolarHBondContact O-N 3.37Å; I66-Y70 WeakPolarHBondContact O-CB 3.26Å; I66-Y70 PolarHBondContact O-N 3.48Å; I66-Y70 VanDerWaalsContact O-N 3.12Å; I66-L71 HydrophobicContact CG2-CD1 3.89Å; I66-L71 HydrophobicContact CG2-CG 4.33Å; I66-L71 PolarHBondContact O-N 3.05Å; I66-F334 HydrophobicContact CB-CD2 4.08Å; I66-F334 HydrophobicContact CB-CE2 3.76Å; I66-F334 HydrophobicContact CD1-CD2 4.32Å; I66-F334 HydrophobicContact CD1-CE1 4.44Å; I66-F334 HydrophobicContact CD1-CE2 3.77Å; I66-F334 HydrophobicContact CD1-CZ 3.81Å; I66-F334 HydrophobicContact CG1-CE2 4.36Å; I66-F334 HydrophobicContact CG2-CD2 3.41Å; I66-F334 VanDerWaalsContact CG2-CD2 3.41Å; I66-F334 HydrophobicContact CG2-CE2 3.65Å; I66-F334 HydrophobicContact CG2-CG 4.29Å; I66-I337 HydrophobicContact CD1-CG2 4.47Å; I66-I337 HydrophobicContact CG1-CG2 4.15Å; I66-I337 HydrophobicContact CG2-CB 4.43Å; I66-I337 HydrophobicContact CG2-CD1 4.41Å; I66-I337 HydrophobicContact CG2-CG2 4.18Å; I66-L338 HydrophobicContact CD1-CB 4.14Å; I66-L338 HydrophobicContact CD1-CD1 3.86Å
67F93.6Very high91.4Very high0 Ų049.4 Ų49.40%024%0.24CC..Iπ-helixtrans-76.8-43.5-176.4-76-44.4000113.8V63 A64 T65 L71 Q72 F77 L80 Y327 I331 F334V63-F67 HydrophobicContact CG1-CD2 3.55Å; V63-F67 HydrophobicContact CG1-CE2 3.7Å; V63-F67 WeakPolarHBondContact O-CB 3.32Å; V63-F67 WeakPolarHBondContact O-CD2 3.45Å; V63-F67 PolarHBondContact O-N 2.88Å; A64-F67 PolarHBondContact O-N 3.47Å; T65-F67 PolarHBondContact O-N 2.91Å; F67-L71 HydrophobicContact CD1-CB 4.24Å; F67-L71 HydrophobicContact CD1-CD1 3.99Å; F67-L71 HydrophobicContact CE1-CD1 4.07Å; F67-L71 CarbonylContact O-C 3.57Å; F67-Q72 PolarHBondContact O-N 2.97Å; F67-F77 WeakPolarHBondContact CB-O 3.27Å; F67-F77 HydrophobicContact CD1-CB 3.67Å; F67-F77 AromaticContact CD1-CD1 3.98Å; F67-F77 HydrophobicContact CD1-CD1 3.98Å; F67-F77 AromaticContact CD1-CG 3.84Å; F67-F77 HydrophobicContact CD1-CG 3.84Å; F67-F77 HydrophobicContact CE1-CB 4.27Å; F67-F77 AromaticContact CE1-CD1 3.66Å; F67-F77 HydrophobicContact CE1-CD1 3.66Å; F67-F77 HydrophobicContact CE1-CE1 4.2Å; F67-F77 AromaticContact CE1-CG 3.98Å; F67-F77 HydrophobicContact CE1-CG 3.98Å; F67-F77 HydrophobicContact CG-CB 4.36Å; F67-L80 HydrophobicContact CD2-CB 3.73Å; F67-L80 HydrophobicContact CE1-CD1 4.39Å; F67-L80 HydrophobicContact CE2-CB 3.75Å; F67-L80 HydrophobicContact CE2-CD1 4Å; F67-L80 HydrophobicContact CG-CB 4.32Å; F67-L80 HydrophobicContact CZ-CB 4.36Å; F67-L80 HydrophobicContact CZ-CD1 3.85Å; F67-Y327 AromaticContact CE2-CD2 3.64Å; F67-Y327 HydrophobicContact CE2-CD2 3.64Å; F67-Y327 AromaticContact CE2-CE2 3.8Å; F67-Y327 HydrophobicContact CE2-CE2 3.8Å; F67-Y327 HydrophobicContact CE2-CG 4.06Å; F67-Y327 HydrophobicContact CZ-CD1 4.4Å; F67-Y327 HydrophobicContact CZ-CD2 4.07Å; F67-Y327 HydrophobicContact CZ-CG 4.01Å; F67-I331 HydrophobicContact CE1-CD1 4.21Å; F67-I331 HydrophobicContact CZ-CD1 3.88Å; F67-F334 HydrophobicContact CD1-CD2 4.34Å; F67-F334 HydrophobicContact CD2-CE2 4.46Å; F67-F334 AromaticContact CE1-CD2 3.74Å; F67-F334 HydrophobicContact CE1-CD2 3.74Å; F67-F334 HydrophobicContact CE1-CE2 4.44Å; F67-F334 HydrophobicContact CE2-CD2 4.08Å; F67-F334 HydrophobicContact CE2-CE2 4.03Å; F67-F334 AromaticContact CZ-CD2 3.59Å; F67-F334 HydrophobicContact CZ-CD2 3.59Å; F67-F334 HydrophobicContact CZ-CE2 4.01Å; F67-F334 HydrophobicContact CZ-CG 4.41Å
68L93.3Very high91.1Very high31 Ų3147.5 Ų47.516%0.16223%0.23CC..Iπ-helixtrans-84.1-13.9-178.4-59.3178.8000113.6A64 Q72 I78 V82 L85 W169A64-L68 HydrophobicContact CB-CD1 4.48Å; A64-L68 WeakPolarHBondContact O-CA 3.31Å; A64-L68 WeakPolarHBondContact O-CB 3.48Å; A64-L68 WeakPolarHBondContact O-CG 3.34Å; A64-L68 PolarHBondContact O-N 3.27Å; L68-Q72 VanDerWaalsContact C-CG 3.4Å; L68-Q72 WeakPolarHBondContact O-CG 3.49Å; L68-Q72 PolarHBondContact O-NE2 3.38Å; L68-I78 HydrophobicContact CD2-CG2 4.29Å; L68-V82 HydrophobicContact CD2-CG2 4.19Å; L68-L85 HydrophobicContact CD1-CD1 3.61Å; L68-L85 HydrophobicContact CD1-CG 4.05Å; L68-W169 HydrophobicContact CD2-CH2 4.29Å
69Y91.3Very high90.9Very high175 Ų17543 Ų4369%0.68621%0.206SC*.Iπ-helixtrans-112.1-50.4176-170.4-103.4000111.8T65T65-Y69 WeakPolarHBondContact O-CA 3.18Å; T65-Y69 WeakPolarHBondContact O-CB 3.12Å; T65-Y69 PolarHBondContact O-N 3.24Å
70Y88.3Confident90.7Very high127 Ų12742.7 Ų42.750%0.49820%0.204SC..Iπ-helixtrans-91.9-25.4-171.5-63.7-80.9000114.5T65 I66 I337T65-Y70 HydrophobicContact CG2-CE2 4.19Å; I66-Y70 WeakPolarHBondContact O-CB 3.26Å; I66-Y70 PolarHBondContact O-N 3.48Å; I66-Y70 VanDerWaalsContact O-N 3.12Å; Y70-I337 HydrophobicContact CD2-CG2 4.3Å; Y70-I337 HydrophobicContact CG-CG2 4.22Å
71L87Confident90.6Very high15 Ų1542.6 Ų42.68%0.07920%0.203CC..  trans-120.117.9-171.5-67.7-179000114.6I66 F67 H73 N74 F77 K333 F334 I337I66-L71 HydrophobicContact CG2-CD1 3.89Å; I66-L71 HydrophobicContact CG2-CG 4.33Å; I66-L71 PolarHBondContact O-N 3.05Å; F67-L71 HydrophobicContact CD1-CB 4.24Å; F67-L71 HydrophobicContact CD1-CD1 3.99Å; F67-L71 HydrophobicContact CE1-CD1 4.07Å; F67-L71 CarbonylContact O-C 3.57Å; L71-H73 PolarHBondContact O-N 3.18Å; L71-N74 PolarHBondContact O-N 3.42Å; L71-F77 HydrophobicContact CB-CB 4.3Å; L71-F77 HydrophobicContact CB-CD2 3.74Å; L71-F77 HydrophobicContact CB-CE2 4.46Å; L71-F77 HydrophobicContact CB-CG 4.29Å; L71-F77 HydrophobicContact CD1-CD2 4.34Å; L71-F77 HydrophobicContact CD1-CE2 4.44Å; L71-F77 WeakPolarHBondContact O-CB 3.49Å; L71-F77 WeakPolarHBondContact O-CD2 3.17Å; L71-K333 HydrophobicContact CD1-CB 4.39Å; L71-K333 HydrophobicContact CD2-CB 4.06Å; L71-K333 HydrophobicContact CD2-CD 4.44Å; L71-F334 HydrophobicContact CD1-CB 4.39Å; L71-I337 HydrophobicContact CD1-CD1 3.99Å; L71-I337 HydrophobicContact CD2-CD1 3.49Å; L71-I337 VanDerWaalsContact CD2-CD1 3.49Å; L71-I337 HydrophobicContact CG-CD1 3.57Å
72Q81.4Confident90.5Very high68 Ų6839.8 Ų39.832%0.31818%0.184SC..THydrogen-bonded Turntrans-58.8-4.2179.7-65-168.3-31.200115.5F67 L68 N74F67-Q72 PolarHBondContact O-N 2.97Å; L68-Q72 VanDerWaalsContact C-CG 3.4Å; L68-Q72 WeakPolarHBondContact O-CG 3.49Å; L68-Q72 PolarHBondContact O-NE2 3.38Å; Q72-N74 VanDerWaalsContact C-N 3.29Å; Q72-N74 PolarHBondContact O-N 2.96Å
73H78.4Confident90.5Very high152 Ų15236.8 Ų36.870%0.70417%0.169SC*.THydrogen-bonded Turntrans-67.2-27.7178.9-61.1-81000113.5L71 K165L71-H73 PolarHBondContact O-N 3.18Å; H73-K165 PolarHBondContact ND1-NZ 3.42Å
74N81.8Confident90.5Very high43 Ų4336.9 Ų36.923%0.2317%0.17CC..SBendtrans-104.3129.9178-172.5-6.4000110.1L71 Q72 Q76 F77 I78 R262L71-N74 PolarHBondContact O-N 3.42Å; Q72-N74 VanDerWaalsContact C-N 3.29Å; Q72-N74 PolarHBondContact O-N 2.96Å; N74-Q76 VanDerWaalsContact C-N 3.26Å; N74-Q76 PolarHBondContact O-N 3.33Å; N74-Q76 PolarHBondContact OD1-N 2.89Å; N74-F77 HydrophobicContact CB-CB 4.32Å; N74-F77 HydrophobicContact CB-CD2 3.39Å; N74-F77 HydrophobicContact CB-CE2 3.75Å; N74-F77 HydrophobicContact CB-CG 3.87Å; N74-F77 HydrophobicContact CB-CZ 4.48Å; N74-F77 WeakPolarHBondContact O-CB 3.44Å; N74-F77 PolarHBondContact O-N 3.42Å; N74-I78 PolarHBondContact O-N 3.04Å; N74-R262 PolarHBondContact ND2-NH1 3.49Å; N74-R262 PolarHBondContact OD1-NH2 3.02Å
75R83.6Confident90.5Very high28 Ų2840.2 Ų40.211%0.10619%0.186CC..Hα-helixtrans-52.2-42.1178.6-59.2-179.747.3178.4-4.4112.9F77 I78 Y79 D149 F160 V168R75-F77 VanDerWaalsContact C-N 3.32Å; R75-F77 PolarHBondContact O-N 2.79Å; R75-I78 WeakPolarHBondContact O-CB 3.39Å; R75-I78 PolarHBondContact O-N 3.18Å; R75-Y79 PolarHBondContact O-N 3.44Å; R75-D149 IonicContact CZ-OD1 3.72Å; R75-D149 IonicContact NE-OD1 2.84Å; R75-D149 IonicContact NH2-OD1 3.24Å; R75-D149 PolarHBondContact NH2-OD1 3.46Å; R75-F160 PolarHBondContact NH1-O 3.45Å; R75-V168 HydrophobicContact CB-CG2 3.65Å; R75-V168 HydrophobicContact CG-CG2 3.49Å; R75-V168 VanDerWaalsContact CG-CG2 3.49Å
76Q85.2Confident90.5Very high4 Ų436.6 Ų36.62%0.01916%0.164CC..Hα-helixtrans-69.3-28.1178.7-88.6-175.91900114.6N74 I78 Y79 L80 R262 M266N74-Q76 VanDerWaalsContact C-N 3.26Å; N74-Q76 PolarHBondContact O-N 3.33Å; N74-Q76 PolarHBondContact OD1-N 2.89Å; Q76-I78 VanDerWaalsContact C-N 3.29Å; Q76-Y79 HydrophobicContact CG-CD2 4.42Å; Q76-Y79 PolarHBondContact O-N 3.35Å; Q76-L80 WeakPolarHBondContact O-CG 3.33Å; Q76-L80 PolarHBondContact O-N 2.82Å; Q76-R262 VanDerWaalsContact OE1-CZ 3.28Å; Q76-M266 HydrophobicContact CB-CE 4.23Å; Q76-M266 HydrophobicContact CG-CE 4.23Å
77F89.5Confident90.6Very high27 Ų2736.2 Ų36.212%0.11816%0.162CC..Hα-helixtrans-68.9-35.6175.1-63.6-22.2000110.2F67 L71 N74 R75 Y79 L80 G81 I331F67-F77 WeakPolarHBondContact CB-O 3.27Å; F67-F77 HydrophobicContact CD1-CB 3.67Å; F67-F77 AromaticContact CD1-CD1 3.98Å; F67-F77 HydrophobicContact CD1-CD1 3.98Å; F67-F77 AromaticContact CD1-CG 3.84Å; F67-F77 HydrophobicContact CD1-CG 3.84Å; F67-F77 HydrophobicContact CE1-CB 4.27Å; F67-F77 AromaticContact CE1-CD1 3.66Å; F67-F77 HydrophobicContact CE1-CD1 3.66Å; F67-F77 HydrophobicContact CE1-CE1 4.2Å; F67-F77 AromaticContact CE1-CG 3.98Å; F67-F77 HydrophobicContact CE1-CG 3.98Å; F67-F77 HydrophobicContact CG-CB 4.36Å; L71-F77 HydrophobicContact CB-CB 4.3Å; L71-F77 HydrophobicContact CB-CD2 3.74Å; L71-F77 HydrophobicContact CB-CE2 4.46Å; L71-F77 HydrophobicContact CB-CG 4.29Å; L71-F77 HydrophobicContact CD1-CD2 4.34Å; L71-F77 HydrophobicContact CD1-CE2 4.44Å; L71-F77 WeakPolarHBondContact O-CB 3.49Å; L71-F77 WeakPolarHBondContact O-CD2 3.17Å; N74-F77 HydrophobicContact CB-CB 4.32Å; N74-F77 HydrophobicContact CB-CD2 3.39Å; N74-F77 HydrophobicContact CB-CE2 3.75Å; N74-F77 HydrophobicContact CB-CG 3.87Å; N74-F77 HydrophobicContact CB-CZ 4.48Å; N74-F77 WeakPolarHBondContact O-CB 3.44Å; N74-F77 PolarHBondContact O-N 3.42Å; R75-F77 VanDerWaalsContact C-N 3.32Å; R75-F77 PolarHBondContact O-N 2.79Å; F77-Y79 PolarHBondContact O-N 3.48Å; F77-L80 HydrophobicContact CD1-CD1 4.34Å; F77-L80 PolarHBondContact O-N 3.09Å; F77-G81 PolarHBondContact O-N 2.97Å; F77-I331 HydrophobicContact CE1-CD1 4.03Å; F77-I331 HydrophobicContact CE1-CG2 4.12Å; F77-I331 HydrophobicContact CZ-CG2 3.9Å
78I91.5Very high90.8Very high2 Ų237.4 Ų37.41%0.0117%0.168CC..Hα-helixtrans-59.7-47.4172.8-54.8175000110.6L68 N74 R75 Q76 L80 G81 V82 V168 W169 I172L68-I78 HydrophobicContact CD2-CG2 4.29Å; N74-I78 PolarHBondContact O-N 3.04Å; R75-I78 WeakPolarHBondContact O-CB 3.39Å; R75-I78 PolarHBondContact O-N 3.18Å; Q76-I78 VanDerWaalsContact C-N 3.29Å; I78-L80 PolarHBondContact O-N 3.21Å; I78-G81 PolarHBondContact O-N 3.39Å; I78-V82 WeakPolarHBondContact O-CG2 3.46Å; I78-V82 PolarHBondContact O-N 2.96Å; I78-V168 HydrophobicContact CB-CG1 3.98Å; I78-V168 HydrophobicContact CD1-CB 4.28Å; I78-V168 HydrophobicContact CD1-CG1 4.11Å; I78-V168 HydrophobicContact CG2-CG1 3.9Å; I78-W169 HydrophobicContact CG2-CH2 4.35Å; I78-W169 HydrophobicContact CG2-CZ2 3.97Å; I78-I172 HydrophobicContact CG2-CD1 3.64Å
79Y92.9Very high90.9Very high1 Ų138.2 Ų38.20%0.00418%0.176CC..Hα-helixtrans-61-42.2177.1-61.7-50.3000113.1R75 Q76 F77 G81 V82 L83 I145 M146 D149 V168 I171 I172R75-Y79 PolarHBondContact O-N 3.44Å; Q76-Y79 HydrophobicContact CG-CD2 4.42Å; Q76-Y79 PolarHBondContact O-N 3.35Å; F77-Y79 PolarHBondContact O-N 3.48Å; Y79-G81 VanDerWaalsContact C-N 3.31Å; Y79-G81 PolarHBondContact O-N 3.03Å; Y79-V82 PolarHBondContact O-N 3.21Å; Y79-L83 WeakPolarHBondContact O-CB 3.39Å; Y79-L83 PolarHBondContact O-N 2.99Å; Y79-I145 HydrophobicContact CD1-CG2 4.22Å; Y79-I145 HydrophobicContact CE1-CG2 3.58Å; Y79-I145 HydrophobicContact CE2-CG2 4.13Å; Y79-M146 HydrophobicContact CD2-CG 4.17Å; Y79-M146 HydrophobicContact CG-CG 4.04Å; Y79-D149 HydrophobicContact CE2-CB 3.91Å; Y79-V168 HydrophobicContact CD1-CG1 4.22Å; Y79-V168 HydrophobicContact CE1-CG1 3.66Å; Y79-V168 HydrophobicContact CE2-CG1 4.46Å; Y79-I171 HydrophobicContact CE1-CG2 4.42Å; Y79-I172 HydrophobicContact CD1-CD1 4.02Å; Y79-I172 HydrophobicContact CD1-CG1 3.95Å; Y79-I172 HydrophobicContact CE1-CD1 4.13Å; Y79-I172 HydrophobicContact CE1-CG1 3.86Å
80L92.8Very high91.1Very high3 Ų330 Ų302%0.01614%0.144CC..Hα-helixtrans-64.3-36.3175.9-70.3176.1000112.4F67 Q76 F77 I78 L83 A84 M146 M266 L269 Y327 I331F67-L80 HydrophobicContact CD2-CB 3.73Å; F67-L80 HydrophobicContact CE1-CD1 4.39Å; F67-L80 HydrophobicContact CE2-CB 3.75Å; F67-L80 HydrophobicContact CE2-CD1 4Å; F67-L80 HydrophobicContact CG-CB 4.32Å; F67-L80 HydrophobicContact CZ-CB 4.36Å; F67-L80 HydrophobicContact CZ-CD1 3.85Å; Q76-L80 WeakPolarHBondContact O-CG 3.33Å; Q76-L80 PolarHBondContact O-N 2.82Å; F77-L80 HydrophobicContact CD1-CD1 4.34Å; F77-L80 PolarHBondContact O-N 3.09Å; I78-L80 PolarHBondContact O-N 3.21Å; L80-L83 HydrophobicContact CD2-CD2 4.48Å; L80-L83 PolarHBondContact O-N 3.31Å; L80-A84 PolarHBondContact O-N 3.46Å; L80-A84 VanDerWaalsContact O-N 3.09Å; L80-M146 HydrophobicContact CD2-SD 3.81Å; L80-M146 HydrophobicContact CG-SD 4.34Å; L80-M266 HydrophobicContact CD1-CE 3.82Å; L80-M266 HydrophobicContact CD2-CE 3.81Å; L80-M266 HydrophobicContact CD2-SD 4.1Å; L80-M266 HydrophobicContact CG-CE 3.83Å; L80-L269 HydrophobicContact CD2-CD2 3.96Å; L80-Y327 HydrophobicContact CD1-CE1 4.15Å; L80-Y327 HydrophobicContact CD2-CE1 4.09Å; L80-I331 HydrophobicContact CD1-CD1 4.43Å
81G94.6Very high91.6Very high0 Ų024 Ų240%012%0.12CC..Hα-helixtrans-66.4-41.2174.600000112.7F77 I78 Y79 A84 L85F77-G81 PolarHBondContact O-N 2.97Å; I78-G81 PolarHBondContact O-N 3.39Å; Y79-G81 VanDerWaalsContact C-N 3.31Å; Y79-G81 PolarHBondContact O-N 3.03Å; G81-A84 WeakPolarHBondContact O-CB 3.5Å; G81-A84 PolarHBondContact O-N 2.76Å; G81-L85 PolarHBondContact O-N 3.39Å
82V96.3Very high92Very high5 Ų526.6 Ų26.63%0.0313%0.134CC..Hα-helixtrans-70.7-34.8175.2173.20000112L68 I78 Y79 A84 L85 S86 F138 I142 W169 I172L68-V82 HydrophobicContact CD2-CG2 4.19Å; I78-V82 WeakPolarHBondContact O-CG2 3.46Å; I78-V82 PolarHBondContact O-N 2.96Å; Y79-V82 PolarHBondContact O-N 3.21Å; V82-A84 VanDerWaalsContact C-N 3.29Å; V82-A84 PolarHBondContact O-N 3.29Å; V82-L85 WeakPolarHBondContact O-CB 3.47Å; V82-L85 PolarHBondContact O-N 2.9Å; V82-S86 PolarHBondContact O-N 3.35Å; V82-F138 HydrophobicContact CG1-CE1 3.7Å; V82-F138 HydrophobicContact CG1-CZ 3.43Å; V82-F138 VanDerWaalsContact CG1-CZ 3.43Å; V82-I142 HydrophobicContact CG1-CD1 3.77Å; V82-I142 HydrophobicContact CG1-CG1 4.17Å; V82-W169 HydrophobicContact CG2-CH2 4.46Å; V82-W169 HydrophobicContact CG2-CZ3 4.33Å; V82-I172 HydrophobicContact CG1-CG2 4.05Å; V82-I172 HydrophobicContact CG2-CD1 3.97Å; V82-I172 HydrophobicContact CG2-CG2 4.31Å
83L95.5Very high92.7Very high0 Ų024 Ų240%012%0.123CC..Hα-helixtrans-57.7-45171.1-178.766.8000110.8Y79 L80 L85 S86 D87 R139 I142 F143 M146 L269Y79-L83 WeakPolarHBondContact O-CB 3.39Å; Y79-L83 PolarHBondContact O-N 2.99Å; L80-L83 HydrophobicContact CD2-CD2 4.48Å; L80-L83 PolarHBondContact O-N 3.31Å; L83-L85 VanDerWaalsContact C-N 3.31Å; L83-L85 PolarHBondContact O-N 3.15Å; L83-S86 WeakPolarHBondContact O-CA 3.23Å; L83-S86 VanDerWaalsContact O-CB 3.28Å; L83-S86 WeakPolarHBondContact O-CB 3.36Å; L83-S86 PolarHBondContact O-N 3.34Å; L83-D87 PolarHBondContact O-N 3.44Å; L83-R139 HydrophobicContact CD1-CG 4Å; L83-I142 HydrophobicContact CB-CG2 3.89Å; L83-I142 HydrophobicContact CD1-CB 4.42Å; L83-I142 HydrophobicContact CD1-CG2 4.13Å; L83-F143 HydrophobicContact CD1-CD2 4.13Å; L83-F143 HydrophobicContact CD1-CE1 4.36Å; L83-F143 HydrophobicContact CD1-CE2 3.73Å; L83-F143 HydrophobicContact CD1-CZ 3.87Å; L83-F143 HydrophobicContact CD2-CE1 3.77Å; L83-F143 HydrophobicContact CD2-CE2 4.47Å; L83-F143 HydrophobicContact CD2-CZ 3.75Å; L83-F143 HydrophobicContact CG-CZ 4.41Å; L83-M146 HydrophobicContact CD2-CE 3.9Å; L83-L269 HydrophobicContact CD2-CD2 4.38Å
84A96.4Very high93.4Very high2 Ų216.7 Ų16.72%0.0179%0.089CC..Hα-helixtrans-61.8-36.8176.600000112.6N60 V63 A64 L80 G81 V82 S86 D87 I88N60-A84 HydrophobicContact CB-CB 4.19Å; V63-A84 HydrophobicContact CB-CB 4.15Å; V63-A84 HydrophobicContact CG1-CB 3.73Å; A64-A84 HydrophobicContact CB-CB 4.05Å; L80-A84 PolarHBondContact O-N 3.46Å; L80-A84 VanDerWaalsContact O-N 3.09Å; G81-A84 WeakPolarHBondContact O-CB 3.5Å; G81-A84 PolarHBondContact O-N 2.76Å; V82-A84 VanDerWaalsContact C-N 3.29Å; V82-A84 PolarHBondContact O-N 3.29Å; A84-S86 VanDerWaalsContact C-N 3.34Å; A84-D87 PolarHBondContact O-N 2.86Å; A84-I88 VanDerWaalsContact O-CG1 3.29Å; A84-I88 WeakPolarHBondContact O-CG1 3.32Å; A84-I88 PolarHBondContact O-N 3.21Å
85L96.8Very high94Very high76 Ų7614.7 Ų14.740%0.3988%0.078SC..Hα-helixtrans-64.9-38.5172.1-66.1178.7000112.3A64 L68 G81 V82 L83 D87 I88 S89A64-L85 HydrophobicContact CB-CD2 4.04Å; A64-L85 HydrophobicContact CB-CG 4.39Å; L68-L85 HydrophobicContact CD1-CD1 3.61Å; L68-L85 HydrophobicContact CD1-CG 4.05Å; G81-L85 PolarHBondContact O-N 3.39Å; V82-L85 WeakPolarHBondContact O-CB 3.47Å; V82-L85 PolarHBondContact O-N 2.9Å; L83-L85 VanDerWaalsContact C-N 3.31Å; L83-L85 PolarHBondContact O-N 3.15Å; L85-D87 VanDerWaalsContact C-N 3.34Å; L85-I88 HydrophobicContact CD2-CD1 4.36Å; L85-S89 PolarHBondContact O-N 2.94Å; L85-S89 PolarHBondContact O-OG 3.01Å
86S96Very high94.6Very high0 Ų016.4 Ų16.40%09%0.085CC..Hα-helixtrans-63.3-42.6174.3-162.70000111.2V82 L83 A84 S89 I90 T135 F138 R139V82-S86 PolarHBondContact O-N 3.35Å; L83-S86 WeakPolarHBondContact O-CA 3.23Å; L83-S86 VanDerWaalsContact O-CB 3.28Å; L83-S86 WeakPolarHBondContact O-CB 3.36Å; L83-S86 PolarHBondContact O-N 3.34Å; A84-S86 VanDerWaalsContact C-N 3.34Å; S86-S89 WeakPolarHBondContact O-CB 3.49Å; S86-S89 PolarHBondContact O-N 3.46Å; S86-S89 VanDerWaalsContact O-N 3.13Å; S86-I90 VanDerWaalsContact O-CG1 3.31Å; S86-I90 WeakPolarHBondContact O-CG1 3.34Å; S86-I90 PolarHBondContact O-N 3.34Å; S86-T135 PolarHBondContact OG-O 3.32Å; S86-F138 WeakPolarHBondContact OG-CD1 3.49Å; S86-R139 WeakPolarHBondContact OG-CA 3.47Å; S86-R139 WeakPolarHBondContact OG-CB 3.48Å; S86-R139 PolarHBondContact OG-N 3.41Å; S86-R139 VanDerWaalsContact OG-N 3.13Å
87D96.1Very high95Very high2 Ų219.6 Ų19.61%0.01110%0.101CC..Hα-helixtrans-64.9-42.7179.3-72.4-8.8000111.9L83 A84 L85 S89 I90 V91 R139 S320L83-D87 PolarHBondContact O-N 3.44Å; A84-D87 PolarHBondContact O-N 2.86Å; L85-D87 VanDerWaalsContact C-N 3.34Å; D87-S89 VanDerWaalsContact C-N 3.25Å; D87-S89 PolarHBondContact O-N 3.32Å; D87-I90 PolarHBondContact O-N 3.23Å; D87-I90 VanDerWaalsContact O-N 3.16Å; D87-V91 PolarHBondContact O-N 3.23Å; D87-R139 WeakPolarHBondContact OD1-CD 3.45Å; D87-R139 IonicContact OD1-CZ 3.37Å; D87-R139 IonicContact OD1-NE 2.58Å; D87-R139 IonicContact OD1-NH1 2.71Å; D87-R139 PolarHBondContact OD1-NH1 3.08Å; D87-R139 IonicContact OD2-NH1 3.12Å; D87-R139 PolarHBondContact OD2-NH1 3.4Å; D87-S320 VanDerWaalsContact CB-OG 3.26Å; D87-S320 WeakPolarHBondContact CB-OG 3.36Å; D87-S320 WeakPolarHBondContact OD2-CB 3.45Å; D87-S320 PolarHBondContact OD2-OG 2.84Å
88I97.7Very high95.1Very high25 Ų2520 Ų2013%0.12810%0.102CC..Hα-helixtrans-54.5-45.2170.2-69.9162.6000110.6L57 N60 A84 L85 I90 V91 I92L57-I88 HydrophobicContact CD2-CG2 3.95Å; N60-I88 HydrophobicContact CB-CD1 3.99Å; N60-I88 HydrophobicContact CB-CG1 3.6Å; A84-I88 VanDerWaalsContact O-CG1 3.29Å; A84-I88 WeakPolarHBondContact O-CG1 3.32Å; A84-I88 PolarHBondContact O-N 3.21Å; L85-I88 HydrophobicContact CD2-CD1 4.36Å; I88-I90 VanDerWaalsContact C-N 3.33Å; I88-I90 PolarHBondContact O-N 3.26Å; I88-V91 VanDerWaalsContact O-CG1 3.24Å; I88-V91 WeakPolarHBondContact O-CG1 3.32Å; I88-V91 PolarHBondContact O-N 2.95Å; I88-I92 HydrophobicContact CG2-CD1 3.78Å; I88-I92 VanDerWaalsContact O-CG1 3.25Å; I88-I92 WeakPolarHBondContact O-CG1 3.36Å; I88-I92 PolarHBondContact O-N 3.42Å; I88-I92 VanDerWaalsContact O-N 3.08Å
89S96.8Very high95Very high47 Ų4720.1 Ų20.133%0.32910%0.102SC..Hα-helixtrans-67-36.2-178.1-530000112L85 S86 D87 T93 T135L85-S89 PolarHBondContact O-N 2.94Å; L85-S89 PolarHBondContact O-OG 3.01Å; S86-S89 WeakPolarHBondContact O-CB 3.49Å; S86-S89 PolarHBondContact O-N 3.46Å; S86-S89 VanDerWaalsContact O-N 3.13Å; D87-S89 VanDerWaalsContact C-N 3.25Å; D87-S89 PolarHBondContact O-N 3.32Å; S89-T93 VanDerWaalsContact O-CB 3.28Å; S89-T93 WeakPolarHBondContact O-CB 3.33Å; S89-T93 PolarHBondContact O-N 3.01Å; S89-T93 PolarHBondContact O-OG1 2.97Å; S89-T135 VanDerWaalsContact CB-CG2 3.43Å
90I95.5Very high95.1Very high3 Ų322 Ų222%0.01511%0.111CC..Hα-helixtrans-69.5-48.1176.5-66.3169.7000110.7S86 D87 I88 I92 T93 I94 R139 W313 F317S86-I90 VanDerWaalsContact O-CG1 3.31Å; S86-I90 WeakPolarHBondContact O-CG1 3.34Å; S86-I90 PolarHBondContact O-N 3.34Å; D87-I90 PolarHBondContact O-N 3.23Å; D87-I90 VanDerWaalsContact O-N 3.16Å; I88-I90 VanDerWaalsContact C-N 3.33Å; I88-I90 PolarHBondContact O-N 3.26Å; I90-I92 VanDerWaalsContact C-N 3.26Å; I90-I92 PolarHBondContact O-N 3.01Å; I90-T93 PolarHBondContact O-N 3.45Å; I90-I94 HydrophobicContact CG2-CD1 3.89Å; I90-I94 HydrophobicContact CG2-CG1 4.42Å; I90-I94 WeakPolarHBondContact O-CB 3.46Å; I90-I94 PolarHBondContact O-N 3.42Å; I90-R139 HydrophobicContact CD1-CB 3.62Å; I90-R139 HydrophobicContact CD1-CG 4.03Å; I90-W313 HydrophobicContact CG2-CZ3 3.8Å; I90-F317 HydrophobicContact CG2-CE1 3.93Å
91V96.9Very high95.1Very high0 Ų022.6 Ų22.60%012%0.115CC..Iπ-helixtrans-63.8-35.1-17969.40000111.4F49 D56 L57 D87 I88 G95 W96 F317F49-V91 HydrophobicContact CE2-CG2 4.43Å; F49-V91 HydrophobicContact CZ-CG2 4.5Å; D56-V91 HydrophobicContact CB-CG2 4.38Å; D56-V91 WeakPolarHBondContact OD2-CB 3.3Å; D56-V91 WeakPolarHBondContact OD2-CG1 3.22Å; L57-V91 HydrophobicContact CD2-CG1 3.45Å; L57-V91 VanDerWaalsContact CD2-CG1 3.45Å; L57-V91 HydrophobicContact CG-CG1 3.77Å; D87-V91 PolarHBondContact O-N 3.23Å; I88-V91 VanDerWaalsContact O-CG1 3.24Å; I88-V91 WeakPolarHBondContact O-CG1 3.32Å; I88-V91 PolarHBondContact O-N 2.95Å; V91-G95 CarbonylContact O-C 3.39Å; V91-G95 WeakPolarHBondContact O-CA 3.32Å; V91-G95 PolarHBondContact O-N 2.93Å; V91-W96 PolarHBondContact O-N 2.82Å; V91-F317 HydrophobicContact CB-CD1 4.02Å; V91-F317 HydrophobicContact CB-CE1 4Å; V91-F317 HydrophobicContact CG2-CD1 4.03Å; V91-F317 HydrophobicContact CG2-CE1 4.19Å; V91-F317 HydrophobicContact CG2-CG 4.34Å
92I96.8Very high94.9Very high70 Ų7022.8 Ų22.836%0.35912%0.116SC..Iπ-helixtrans-66-55.6172.6-67.4170.2000110.1L57 I88 I90 W96 L97L57-I92 HydrophobicContact CD2-CD1 4.29Å; L57-I92 HydrophobicContact CD2-CG1 4.04Å; I88-I92 HydrophobicContact CG2-CD1 3.78Å; I88-I92 VanDerWaalsContact O-CG1 3.25Å; I88-I92 WeakPolarHBondContact O-CG1 3.36Å; I88-I92 PolarHBondContact O-N 3.42Å; I88-I92 VanDerWaalsContact O-N 3.08Å; I90-I92 VanDerWaalsContact C-N 3.26Å; I90-I92 PolarHBondContact O-N 3.01Å; I92-W96 PolarHBondContact O-N 3.3Å; I92-L97 HydrophobicContact CG2-CD1 4.29Å; I92-L97 HydrophobicContact CG2-CG 4.34Å; I92-L97 WeakPolarHBondContact O-CG 3.34Å; I92-L97 PolarHBondContact O-N 3.46Å
93T94.9Very high94.6Very high13 Ų1322.5 Ų22.58%0.0811%0.114CC..Iπ-helixtrans-66.9-45.7-171.8-53.70000112.3S89 I90 L97 Y128 F131 Q132S89-T93 VanDerWaalsContact O-CB 3.28Å; S89-T93 WeakPolarHBondContact O-CB 3.33Å; S89-T93 PolarHBondContact O-N 3.01Å; S89-T93 PolarHBondContact O-OG1 2.97Å; I90-T93 PolarHBondContact O-N 3.45Å; T93-L97 WeakPolarHBondContact O-CB 3.19Å; T93-Y128 HydrophobicContact CG2-CE2 4.12Å; T93-Y128 WeakPolarHBondContact O-CE2 3.45Å; T93-F131 HydrophobicContact CG2-CB 4.05Å; T93-Q132 HydrophobicContact CG2-CB 4.19Å
94I93.7Very high94.5Very high0 Ų022.5 Ų22.50%011%0.114CC..Iπ-helixtrans-93.6-47.7-172.2-61.7-177.3000110.5I90 W99 Q132 C136 W313 F317I90-I94 HydrophobicContact CG2-CD1 3.89Å; I90-I94 HydrophobicContact CG2-CG1 4.42Å; I90-I94 WeakPolarHBondContact O-CB 3.46Å; I90-I94 PolarHBondContact O-N 3.42Å; I94-W99 PolarHBondContact O-N 3.26Å; I94-Q132 HydrophobicContact CD1-CG 3.88Å; I94-Q132 HydrophobicContact CG1-CG 4Å; I94-C136 VanDerWaalsContact CD1-SG 3.57Å; I94-W313 HydrophobicContact CD1-CE3 4.22Å; I94-W313 HydrophobicContact CD1-CH2 3.23Å; I94-W313 HydrophobicContact CD1-CZ2 3.59Å; I94-W313 HydrophobicContact CD1-CZ3 3.58Å; I94-W313 HydrophobicContact CG2-CD2 3.67Å; I94-W313 HydrophobicContact CG2-CE3 3.91Å; I94-W313 HydrophobicContact CG2-CG 4.09Å; I94-W313 HydrophobicContact CG2-CH2 4.49Å; I94-W313 HydrophobicContact CG2-CZ2 4.26Å; I94-W313 HydrophobicContact CG2-CZ3 4.32Å; I94-F317 HydrophobicContact CB-CZ 4.27Å; I94-F317 HydrophobicContact CG2-CZ 4.16Å
95G94.7Very high94.4Very high0 Ų024.7 Ų24.70%013%0.125CC..Iπ-helixtrans-71.1-65.7-178.700000112.4F49 V91 W99 F100F49-G95 VanDerWaalsContact CE2-CA 3.47Å; V91-G95 CarbonylContact O-C 3.39Å; V91-G95 WeakPolarHBondContact O-CA 3.32Å; V91-G95 PolarHBondContact O-N 2.93Å; G95-W99 PolarHBondContact O-N 3.18Å; G95-F100 WeakPolarHBondContact O-CB 3.38Å; G95-F100 PolarHBondContact O-N 3.41Å
96W96.1Very high94.2Very high65 Ų6521 Ų2125%0.24611%0.106CC..Iπ-helixtrans-79.5-33.7-170.2-71.3106.7000114.9F49 P50 V54 V91 I92 F100 P101F49-W96 HydrophobicContact CE1-CD2 4.01Å; F49-W96 HydrophobicContact CE1-CE3 4.17Å; F49-W96 HydrophobicContact CE1-CG 4.45Å; F49-W96 HydrophobicContact CE1-CZ2 4.38Å; F49-W96 HydrophobicContact CE1-CZ3 4.43Å; F49-W96 HydrophobicContact CZ-CD2 4.21Å; F49-W96 HydrophobicContact CZ-CG 4.27Å; P50-W96 HydrophobicContact CB-CH2 4.1Å; V54-W96 HydrophobicContact CG2-CH2 4.19Å; V54-W96 HydrophobicContact CG2-CZ2 3.8Å; V91-W96 PolarHBondContact O-N 2.82Å; I92-W96 PolarHBondContact O-N 3.3Å; W96-F100 AromaticContact CE3-CD1 3.97Å; W96-F100 HydrophobicContact CE3-CD1 3.97Å; W96-F100 HydrophobicContact CE3-CG 4.32Å; W96-F100 AromaticContact CZ3-CD1 3.96Å; W96-F100 HydrophobicContact CZ3-CD1 3.96Å; W96-F100 HydrophobicContact CZ3-CE1 4.11Å; W96-F100 HydrophobicContact CZ3-CG 4.31Å; W96-P101 WeakPolarHBondContact O-CD 3.25Å; W96-P101 WeakPolarHBondContact O-CG 3.47Å
97L93.7Very high94Very high70 Ų7022.7 Ų22.737%0.36611%0.114SC..Iπ-helixtrans-87.6-28.6-179.3-67.4-179000113.5I92 T93 I117I92-L97 HydrophobicContact CG2-CD1 4.29Å; I92-L97 HydrophobicContact CG2-CG 4.34Å; I92-L97 WeakPolarHBondContact O-CG 3.34Å; I92-L97 PolarHBondContact O-N 3.46Å; T93-L97 WeakPolarHBondContact O-CB 3.19Å; L97-I117 HydrophobicContact CB-CD1 4.27Å; L97-I117 HydrophobicContact CD1-CD1 4.24Å; L97-I117 HydrophobicContact CD2-CD1 4.4Å; L97-I117 WeakPolarHBondContact O-CG2 3.5Å
98R91.1Very high93.8Very high37 Ų3725 Ų2514%0.1413%0.132CC..Iπ-helixtrans-111.1-70.7-178.7-179.9174.4178.1-179.55.4113Y11 F100 P101 T102 Y128Y11-R98 PolarHBondContact OH-NH2 2.9Å; R98-F100 PolarHBondContact O-N 3.03Å; R98-P101 WeakPolarHBondContact O-CD 3.29Å; R98-T102 WeakPolarHBondContact O-CB 3.42Å; R98-T102 PolarHBondContact O-N 2.97Å; R98-T102 PolarHBondContact O-OG1 3.35Å; R98-Y128 HydrophobicContact CB-CE2 3.86Å; R98-Y128 WeakPolarHBondContact CB-OH 3.36Å; R98-Y128 VanDerWaalsContact CD-CZ 3.42Å; R98-Y128 WeakPolarHBondContact CD-OH 3.34Å
99W90.5Very high93.6Very high3 Ų325.6 Ų25.61%0.01114%0.137CC..Iπ-helixtrans-66.6-43.6-164.9-69.1120.3000113M45 I94 G95 F103 L306 L309 N310 W313M45-W99 HydrophobicContact CE-CB 3.3Å; M45-W99 HydrophobicContact CE-CG 4.33Å; M45-W99 HydrophobicContact SD-CB 4.28Å; I94-W99 PolarHBondContact O-N 3.26Å; G95-W99 PolarHBondContact O-N 3.18Å; W99-F103 AromaticContact CE3-CD2 3.43Å; W99-F103 HydrophobicContact CE3-CD2 3.43Å; W99-F103 VanDerWaalsContact CE3-CD2 3.43Å; W99-F103 AromaticContact CE3-CE2 3.25Å; W99-F103 HydrophobicContact CE3-CE2 3.25Å; W99-F103 HydrophobicContact CE3-CZ 4.4Å; W99-F103 AromaticContact CZ3-CD2 3.86Å; W99-F103 HydrophobicContact CZ3-CD2 3.86Å; W99-F103 AromaticContact CZ3-CE2 3.26Å; W99-F103 HydrophobicContact CZ3-CE2 3.26Å; W99-F103 HydrophobicContact CZ3-CZ 4.04Å; W99-F103 PolarHBondContact O-N 3.19Å; W99-L306 HydrophobicContact CH2-CD1 3.75Å; W99-L306 HydrophobicContact CZ3-CD1 3.71Å; W99-L309 HydrophobicContact CH2-CB 4.29Å; W99-L309 HydrophobicContact CZ2-CB 4.42Å; W99-N310 VanDerWaalsContact CD2-OD1 3.24Å; W99-N310 WeakPolarHBondContact CH2-ND2 3.5Å; W99-N310 VanDerWaalsContact CZ3-CG 3.42Å; W99-N310 WeakPolarHBondContact CZ3-ND2 3.19Å; W99-N310 WeakPolarHBondContact CZ3-OD1 3.46Å; W99-W313 AromaticContact CE2-CD1 3.62Å; W99-W313 AromaticContact CZ2-CD1 3.61Å; W99-W313 AromaticContact CZ2-NE1 3.99Å; W99-W313 AromaticContact NE1-CD1 3.18Å; W99-W313 AromaticContact NE1-CG 3.57Å; W99-W313 AromaticContact NE1-NE1 3.69Å
100F94.2Very high93.3Very high42 Ų4226.7 Ų26.718%0.18415%0.149CC..Iπ-helixtrans-64-51.6179.5178.2-105.4000112.6M45 F49 P50 G95 W96 R98 T102 G104 L105M45-F100 WeakPolarHBondContact O-CD2 3.32Å; F49-F100 HydrophobicContact CD1-CB 3.71Å; F49-F100 AromaticContact CD1-CD2 3.99Å; F49-F100 HydrophobicContact CD1-CD2 3.99Å; F49-F100 HydrophobicContact CD1-CG 4.18Å; F49-F100 HydrophobicContact CE1-CB 3.56Å; F49-F100 HydrophobicContact CE1-CD2 4.43Å; F49-F100 HydrophobicContact CE1-CG 4.19Å; P50-F100 HydrophobicContact CG-CD2 3.77Å; P50-F100 HydrophobicContact CG-CE2 3.46Å; P50-F100 VanDerWaalsContact CG-CE2 3.46Å; P50-F100 HydrophobicContact CG-CZ 4.32Å; G95-F100 WeakPolarHBondContact O-CB 3.38Å; G95-F100 PolarHBondContact O-N 3.41Å; W96-F100 AromaticContact CE3-CD1 3.97Å; W96-F100 HydrophobicContact CE3-CD1 3.97Å; W96-F100 HydrophobicContact CE3-CG 4.32Å; W96-F100 AromaticContact CZ3-CD1 3.96Å; W96-F100 HydrophobicContact CZ3-CD1 3.96Å; W96-F100 HydrophobicContact CZ3-CE1 4.11Å; W96-F100 HydrophobicContact CZ3-CG 4.31Å; R98-F100 PolarHBondContact O-N 3.03Å; F100-T102 VanDerWaalsContact C-N 3.31Å; F100-T102 PolarHBondContact O-N 3.39Å; F100-G104 CarbonylContact O-C 3.55Å; F100-G104 VanDerWaalsContact O-CA 3.3Å; F100-G104 WeakPolarHBondContact O-CA 3.08Å; F100-G104 PolarHBondContact O-N 2.96Å; F100-L105 HydrophobicContact CE1-CD1 4.43Å; F100-L105 HydrophobicContact CZ-CD1 4.38Å; F100-L105 PolarHBondContact O-N 3.05Å
101P92.9Very high92.8Very high14 Ų1427.1 Ų27.19%0.09115%0.154CC..Iπ-helixtrans-70.9-23.3179.5-20.635000114.5W96 R98 P106 Y115W96-P101 WeakPolarHBondContact O-CD 3.25Å; W96-P101 WeakPolarHBondContact O-CG 3.47Å; R98-P101 WeakPolarHBondContact O-CD 3.29Å; P101-P106 WeakPolarHBondContact O-CD 3.49Å; P101-P106 WeakPolarHBondContact O-CG 3.32Å; P101-Y115 CarbonylContact C-O 3.59Å; P101-Y115 WeakPolarHBondContact CB-O 3.41Å; P101-Y115 PolarHBondContact O-N 3.11Å
102T90.1Very high92.4Very high4 Ų433.8 Ų33.83%0.02519%0.19CC..Iπ-helixtrans-82-37.8179.8-57.10000112.4Y11 R98 F100 P106 F116Y11-T102 HydrophobicContact CD1-CG2 4.4Å; Y11-T102 HydrophobicContact CG-CG2 4.2Å; R98-T102 WeakPolarHBondContact O-CB 3.42Å; R98-T102 PolarHBondContact O-N 2.97Å; R98-T102 PolarHBondContact O-OG1 3.35Å; F100-T102 VanDerWaalsContact C-N 3.31Å; F100-T102 PolarHBondContact O-N 3.39Å; T102-P106 WeakPolarHBondContact O-CG 3.47Å; T102-F116 HydrophobicContact CG2-CD1 3.73Å; T102-F116 HydrophobicContact CG2-CE1 3.63Å
103F91Very high92.1Very high0 Ų033.8 Ų33.80%019%0.194CC..Iπ-helixtrans-126.3-35.7-172.9-58.3-76.9000114.3Y11 T16 L41 M45 W99 F107 L306Y11-F103 HydrophobicContact CD1-CE1 4.35Å; Y11-F103 AromaticContact CD1-CZ 3.92Å; Y11-F103 HydrophobicContact CD1-CZ 3.92Å; Y11-F103 AromaticContact CE1-CZ 3.83Å; Y11-F103 HydrophobicContact CE1-CZ 3.83Å; T16-F103 HydrophobicContact CG2-CB 4.24Å; T16-F103 HydrophobicContact CG2-CD1 3.95Å; L41-F103 HydrophobicContact CD2-CD1 4.2Å; M45-F103 HydrophobicContact CB-CB 4.03Å; M45-F103 HydrophobicContact CG-CB 4.07Å; W99-F103 AromaticContact CE3-CD2 3.43Å; W99-F103 HydrophobicContact CE3-CD2 3.43Å; W99-F103 VanDerWaalsContact CE3-CD2 3.43Å; W99-F103 AromaticContact CE3-CE2 3.25Å; W99-F103 HydrophobicContact CE3-CE2 3.25Å; W99-F103 HydrophobicContact CE3-CZ 4.4Å; W99-F103 AromaticContact CZ3-CD2 3.86Å; W99-F103 HydrophobicContact CZ3-CD2 3.86Å; W99-F103 AromaticContact CZ3-CE2 3.26Å; W99-F103 HydrophobicContact CZ3-CE2 3.26Å; W99-F103 HydrophobicContact CZ3-CZ 4.04Å; W99-F103 PolarHBondContact O-N 3.19Å; F103-F107 WeakPolarHBondContact O-CB 3.26Å; F103-F107 PolarHBondContact O-N 2.9Å; F103-L306 HydrophobicContact CE1-CD2 3.75Å; F103-L306 HydrophobicContact CZ-CD1 4.19Å; F103-L306 HydrophobicContact CZ-CD2 3.8Å; F103-L306 HydrophobicContact CZ-CG 4.42Å
104G93.1Very high91.8Very high0 Ų038.3 Ų38.30%021%0.21CC..Iπ-helixtrans-76-54.5-177.700000112.7M45 A46 F100 F107 A108M45-G104 VanDerWaalsContact C-CA 3.49Å; A46-G104 WeakPolarHBondContact CB-O 3.14Å; F100-G104 CarbonylContact O-C 3.55Å; F100-G104 VanDerWaalsContact O-CA 3.3Å; F100-G104 WeakPolarHBondContact O-CA 3.08Å; F100-G104 PolarHBondContact O-N 2.96Å; G104-F107 PolarHBondContact O-N 3.35Å; G104-A108 WeakPolarHBondContact O-CB 3.31Å; G104-A108 PolarHBondContact O-N 2.88Å
105L93.1Very high91.6Very high47 Ų4743.7 Ų43.725%0.24623%0.231CC..Hα-helixtrans-62.4-43-178.6-166.564000113.1F100 F107 A108 T109 T113F100-L105 HydrophobicContact CE1-CD1 4.43Å; F100-L105 HydrophobicContact CZ-CD1 4.38Å; F100-L105 PolarHBondContact O-N 3.05Å; L105-F107 VanDerWaalsContact C-N 3.35Å; L105-F107 PolarHBondContact O-N 3.16Å; L105-A108 PolarHBondContact O-N 3Å; L105-T109 HydrophobicContact CD1-CG2 4.34Å; L105-T109 WeakPolarHBondContact O-CB 3.42Å; L105-T109 WeakPolarHBondContact O-CG2 3.28Å; L105-T109 PolarHBondContact O-N 3.42Å; L105-T109 PolarHBondContact O-OG1 2.6Å; L105-T113 CarbonylContact C-O 3.52Å; L105-T113 HydrophobicContact CD2-CG2 3.51Å; L105-T113 HydrophobicContact CG-CG2 3.99Å; L105-T113 WeakPolarHBondContact CG-O 3.44Å
106P92.4Very high91.4Very high0 Ų044.3 Ų44.30%023%0.234CC..Hα-helixtrans-67.5-37.4177.4-19.134.3000111.3P13 P101 T102 T109 A110 G111 T113P13-P106 HydrophobicContact CB-CB 4.09Å; P13-P106 VanDerWaalsContact O-CB 3.27Å; P13-P106 WeakPolarHBondContact O-CB 3.42Å; P101-P106 WeakPolarHBondContact O-CD 3.49Å; P101-P106 WeakPolarHBondContact O-CG 3.32Å; T102-P106 WeakPolarHBondContact O-CG 3.47Å; P106-T109 CarbonylContact O-C 3.4Å; P106-T109 PolarHBondContact O-N 3.21Å; P106-A110 CarbonylContact O-C 3.57Å; P106-A110 PolarHBondContact O-N 3.43Å; P106-G111 PolarHBondContact O-N 3.06Å; P106-T113 WeakPolarHBondContact CA-O 3.48Å
107F92.7Very high91Very high35 Ų3542.6 Ų42.615%0.15423%0.229CC..Hα-helixtrans-63.7-45.9175.4-173.8-101.2000112.1L17 I39 G42 A46 Y47 F103 G104 L105 T109 A110L17-F107 HydrophobicContact CD2-CD2 3.79Å; L17-F107 HydrophobicContact CD2-CE2 4.09Å; L17-F107 HydrophobicContact CG-CD2 4.5Å; I39-F107 HydrophobicContact CG2-CZ 4.45Å; G42-F107 VanDerWaalsContact CA-CG 3.47Å; G42-F107 WeakPolarHBondContact O-CD1 3.25Å; A46-F107 HydrophobicContact CB-CB 4.47Å; A46-F107 HydrophobicContact CB-CD1 3.9Å; Y47-F107 HydrophobicContact CE2-CD1 4.34Å; Y47-F107 HydrophobicContact CE2-CE1 4.14Å; F103-F107 WeakPolarHBondContact O-CB 3.26Å; F103-F107 PolarHBondContact O-N 2.9Å; G104-F107 PolarHBondContact O-N 3.35Å; L105-F107 VanDerWaalsContact C-N 3.35Å; L105-F107 PolarHBondContact O-N 3.16Å; F107-T109 VanDerWaalsContact C-N 3.25Å; F107-T109 PolarHBondContact O-N 2.88Å; F107-A110 PolarHBondContact O-N 2.84Å
108A93Very high90.7Very high49 Ų4939.5 Ų39.541%0.40521%0.213SC..Hα-helixtrans-65.1-27.3178.600000113.5A46 G104 L105A46-A108 HydrophobicContact CB-CB 4.2Å; G104-A108 WeakPolarHBondContact O-CB 3.31Å; G104-A108 PolarHBondContact O-N 2.88Å; L105-A108 PolarHBondContact O-N 3Å
109T93.1Very high90.5Very high38 Ų3838.3 Ų38.323%0.23321%0.21CC..THydrogen-bonded Turntrans-108.513.4-175.962.30000113.5L105 P106 F107 G111 N112 T113L105-T109 HydrophobicContact CD1-CG2 4.34Å; L105-T109 WeakPolarHBondContact O-CB 3.42Å; L105-T109 WeakPolarHBondContact O-CG2 3.28Å; L105-T109 PolarHBondContact O-N 3.42Å; L105-T109 PolarHBondContact O-OG1 2.6Å; P106-T109 CarbonylContact O-C 3.4Å; P106-T109 PolarHBondContact O-N 3.21Å; F107-T109 VanDerWaalsContact C-N 3.25Å; F107-T109 PolarHBondContact O-N 2.88Å; T109-G111 PolarHBondContact O-N 2.73Å; T109-N112 VanDerWaalsContact O-CB 3.32Å; T109-N112 WeakPolarHBondContact O-CB 3.46Å; T109-N112 PolarHBondContact O-N 3.07Å; T109-N112 VanDerWaalsContact O-N 3.09Å; T109-N112 PolarHBondContact O-ND2 3.17Å; T109-N112 PolarHBondContact OG1-N 3.36Å; T109-T113 PolarHBondContact OG1-N 3.34Å; T109-T113 PolarHBondContact OG1-O 3.21Å
110A90Very high90.3Very high70 Ų7042.2 Ų42.258%0.57923%0.234SC*.THydrogen-bonded Turntrans52.334.1-175.900000114L17 P106 F107L17-A110 VanDerWaalsContact CD1-C 3.48Å; P106-A110 CarbonylContact O-C 3.57Å; P106-A110 PolarHBondContact O-N 3.43Å; F107-A110 PolarHBondContact O-N 2.84Å
111G85.6Confident90.2Very high12 Ų1242.6 Ų42.612%0.12424%0.242CC..THydrogen-bonded Turntrans91-0.3178.900000115P106 T109P106-G111 PolarHBondContact O-N 3.06Å; T109-G111 PolarHBondContact O-N 2.73Å
112N88.7Confident90.1Very high140 Ų14044.5 Ų44.575%0.74925%0.253SS*.SBendtrans-73.6-34.9-175.5-69.9-25.4000113.7T109T109-N112 VanDerWaalsContact O-CB 3.32Å; T109-N112 WeakPolarHBondContact O-CB 3.46Å; T109-N112 PolarHBondContact O-N 3.07Å; T109-N112 VanDerWaalsContact O-N 3.09Å; T109-N112 PolarHBondContact O-ND2 3.17Å; T109-N112 PolarHBondContact OG1-N 3.36Å
113T89.6Confident90.2Very high71 Ų7148.8 Ų48.844%0.43628%0.279SS..SBendtrans-123.3122-178.4-47.60000109.9L105 P106 T109L105-T113 CarbonylContact C-O 3.52Å; L105-T113 HydrophobicContact CD2-CG2 3.51Å; L105-T113 HydrophobicContact CG-CG2 3.99Å; L105-T113 WeakPolarHBondContact CG-O 3.44Å; P106-T113 WeakPolarHBondContact CA-O 3.48Å; T109-T113 PolarHBondContact OG1-N 3.34Å; T109-T113 PolarHBondContact OG1-O 3.21Å
114Y89.4Confident90.2Very high108 Ų10849.8 Ų49.842%0.42429%0.287SS..  trans-152.3155.2-178.262.4-89.7000110.7P13 F116P13-Y114 HydrophobicContact CB-CD1 3.46Å; P13-Y114 VanDerWaalsContact CB-CD1 3.46Å; P13-Y114 HydrophobicContact CB-CD2 4.31Å; P13-Y114 HydrophobicContact CB-CE1 3.96Å; P13-Y114 HydrophobicContact CB-CG 3.66Å; P13-Y114 HydrophobicContact CG-CD1 3.8Å; P13-Y114 HydrophobicContact CG-CD2 4.46Å; P13-Y114 HydrophobicContact CG-CE1 3.73Å; P13-Y114 HydrophobicContact CG-CE2 4.41Å; P13-Y114 HydrophobicContact CG-CG 4.16Å; Y114-F116 AromaticContact CD2-CD2 3.87Å; Y114-F116 HydrophobicContact CD2-CD2 3.87Å; Y114-F116 AromaticContact CD2-CE2 3.31Å; Y114-F116 HydrophobicContact CD2-CE2 3.31Å; Y114-F116 AromaticContact CD2-CZ 3.82Å; Y114-F116 HydrophobicContact CD2-CZ 3.82Å; Y114-F116 HydrophobicContact CE2-CD2 4.22Å; Y114-F116 AromaticContact CE2-CE2 3.71Å; Y114-F116 HydrophobicContact CE2-CE2 3.71Å; Y114-F116 HydrophobicContact CG-CE2 4.27Å; Y114-F116 HydrophobicContact CG-CZ 4.39Å
115Y89.6Confident90.2Very high112 Ų11249.8 Ų49.844%0.43929%0.287SS..  trans-150.4127.7172.2-175.5-114000111.1P101 I117P101-Y115 CarbonylContact C-O 3.59Å; P101-Y115 WeakPolarHBondContact CB-O 3.41Å; P101-Y115 PolarHBondContact O-N 3.11Å; Y115-I117 HydrophobicContact CD1-CB 4.25Å; Y115-I117 HydrophobicContact CE1-CB 3.66Å; Y115-I117 HydrophobicContact CE1-CD1 4.48Å; Y115-I117 HydrophobicContact CE1-CG1 4.04Å
116F89.7Confident90.2Very high14 Ų1450.9 Ų50.96%0.06129%0.289CS..  trans-114.284.5179.6-52.3-59.3000109.7T102 Y114 S118 L119 T120T102-F116 HydrophobicContact CG2-CD1 3.73Å; T102-F116 HydrophobicContact CG2-CE1 3.63Å; Y114-F116 AromaticContact CD2-CD2 3.87Å; Y114-F116 HydrophobicContact CD2-CD2 3.87Å; Y114-F116 AromaticContact CD2-CE2 3.31Å; Y114-F116 HydrophobicContact CD2-CE2 3.31Å; Y114-F116 AromaticContact CD2-CZ 3.82Å; Y114-F116 HydrophobicContact CD2-CZ 3.82Å; Y114-F116 HydrophobicContact CE2-CD2 4.22Å; Y114-F116 AromaticContact CE2-CE2 3.71Å; Y114-F116 HydrophobicContact CE2-CE2 3.71Å; Y114-F116 HydrophobicContact CG-CE2 4.27Å; Y114-F116 HydrophobicContact CG-CZ 4.39Å; F116-S118 PolarHBondContact O-N 2.95Å; F116-S118 VanDerWaalsContact O-N 3.17Å; F116-L119 HydrophobicContact CB-CB 3.95Å; F116-L119 HydrophobicContact CB-CD1 4.07Å; F116-L119 HydrophobicContact CB-CG 4.14Å; F116-L119 HydrophobicContact CG-CD1 4.34Å; F116-L119 PolarHBondContact O-N 3.47Å; F116-T120 PolarHBondContact O-N 3.24Å; F116-T120 PolarHBondContact O-OG1 2.9Å
117I87.9Confident90.3Very high28 Ų2855.1 Ų55.114%0.14431%0.312CS..G310 helixtrans-53.4-41.4-176.6-168.1167.1000112.1L97 Y115 L119 S124 Y128L97-I117 HydrophobicContact CB-CD1 4.27Å; L97-I117 HydrophobicContact CD1-CD1 4.24Å; L97-I117 HydrophobicContact CD2-CD1 4.4Å; L97-I117 WeakPolarHBondContact O-CG2 3.5Å; Y115-I117 HydrophobicContact CD1-CB 4.25Å; Y115-I117 HydrophobicContact CE1-CB 3.66Å; Y115-I117 HydrophobicContact CE1-CD1 4.48Å; Y115-I117 HydrophobicContact CE1-CG1 4.04Å; I117-L119 VanDerWaalsContact C-N 3.27Å; I117-L119 PolarHBondContact O-N 2.84Å; I117-S124 WeakPolarHBondContact O-CB 3.36Å; I117-S124 PolarHBondContact O-OG 3.25Å; I117-Y128 HydrophobicContact CG2-CD2 3.55Å; I117-Y128 HydrophobicContact CG2-CE2 4.01Å; I117-Y128 HydrophobicContact CG2-CG 4.08Å
118S86.3Confident90.4Very high5 Ų554 Ų544%0.03531%0.306CS..G310 helixtrans-72.6-16.5-17858.60000114.1F116 C125 C201F116-S118 PolarHBondContact O-N 2.95Å; F116-S118 VanDerWaalsContact O-N 3.17Å; S118-C125 WeakPolarHBondContact O-CB 3.19Å; S118-C201 WeakPolarHBondContact O-CB 3.22Å
119L87.3Confident90.4Very high12 Ų1252.1 Ų52.16%0.06329%0.29CS..G310 helixtrans-105.4-3.3-175.9-58.8-178.2000113.4D9 Y11 F116 I117 S121 L192 C201D9-L119 HydrophobicContact CB-CD1 3.91Å; Y11-L119 HydrophobicContact CD2-CD1 4.02Å; F116-L119 HydrophobicContact CB-CB 3.95Å; F116-L119 HydrophobicContact CB-CD1 4.07Å; F116-L119 HydrophobicContact CB-CG 4.14Å; F116-L119 HydrophobicContact CG-CD1 4.34Å; F116-L119 PolarHBondContact O-N 3.47Å; I117-L119 VanDerWaalsContact C-N 3.27Å; I117-L119 PolarHBondContact O-N 2.84Å; L119-S121 PolarHBondContact O-N 3.21Å; L119-L192 HydrophobicContact CD2-CD1 3.72Å; L119-C201 HydrophobicContact CD2-CB 4.21Å
120T87.6Confident90.5Very high86 Ų8652 Ų5253%0.52829%0.286SS..SBendtrans-65.7-38.2-177.3-56.80000112.7F116F116-T120 PolarHBondContact O-N 3.24Å; F116-T120 PolarHBondContact O-OG1 2.9Å
121S90.4Very high90.7Very high49 Ų4953.6 Ų53.634%0.34328%0.281SS..  trans-164.8164.4177.667.40000110.8L119 T123 S124 C125L119-S121 PolarHBondContact O-N 3.21Å; S121-T123 VanDerWaalsContact C-N 3.27Å; S121-T123 PolarHBondContact O-N 3.08Å; S121-S124 PolarHBondContact O-N 3.49Å; S121-S124 VanDerWaalsContact O-N 3.16Å; S121-S124 WeakPolarHBondContact OG-CB 3.32Å; S121-S124 PolarHBondContact OG-N 3.44Å; S121-C125 PolarHBondContact O-N 2.71Å
122T90.7Very high91.1Very high54 Ų5453.2 Ų53.233%0.33128%0.275SS..Hα-helixtrans-53.9-43.2170.6-71.30000112.1S124 C125 K126 D191T122-S124 PolarHBondContact O-N 3.09Å; T122-C125 WeakPolarHBondContact O-CB 3.32Å; T122-C125 PolarHBondContact O-N 3.06Å; T122-K126 HydrophobicContact CG2-CD 4.17Å; T122-K126 WeakPolarHBondContact O-CG 3.42Å; T122-K126 PolarHBondContact O-N 3.13Å; T122-D191 WeakPolarHBondContact CB-OD1 3.23Å; T122-D191 WeakPolarHBondContact CG2-OD1 3.37Å; T122-D191 PolarHBondContact OG1-OD1 2.83Å
123T92.4Very high91.4Very high94 Ų9446.5 Ų46.558%0.57724%0.24SC*.Hα-helixtrans-64.1-42.6178.3-54.80000111.2S121 K126 L127S121-T123 VanDerWaalsContact C-N 3.27Å; S121-T123 PolarHBondContact O-N 3.08Å; T123-K126 PolarHBondContact O-N 3.09Å; T123-L127 HydrophobicContact CG2-CD1 3.93Å; T123-L127 HydrophobicContact CG2-CG 4.39Å; T123-L127 WeakPolarHBondContact O-CB 3.44Å; T123-L127 WeakPolarHBondContact O-CG 3.09Å; T123-L127 PolarHBondContact O-N 3.48Å
124S91.6Very high91.7Very high22 Ų2243.8 Ų43.815%0.15422%0.222CC..Hα-helixtrans-64.1-42.7177.4-162.30000111.8I117 S121 T122 L127 Y128I117-S124 WeakPolarHBondContact O-CB 3.36Å; I117-S124 PolarHBondContact O-OG 3.25Å; S121-S124 PolarHBondContact O-N 3.49Å; S121-S124 VanDerWaalsContact O-N 3.16Å; S121-S124 WeakPolarHBondContact OG-CB 3.32Å; S121-S124 PolarHBondContact OG-N 3.44Å; T122-S124 PolarHBondContact O-N 3.09Å; S124-L127 PolarHBondContact O-N 3.23Å; S124-Y128 WeakPolarHBondContact O-CB 3.47Å; S124-Y128 PolarHBondContact O-N 2.79Å
125C92.5Very high91.9Very high0 Ų039.2 Ų39.20%021%0.206CC..Hα-helixtrans-54.9-53.8173171.30000111.4S118 S121 T122 L127 Y128 V129 C201S118-C125 WeakPolarHBondContact O-CB 3.19Å; S121-C125 PolarHBondContact O-N 2.71Å; T122-C125 WeakPolarHBondContact O-CB 3.32Å; T122-C125 PolarHBondContact O-N 3.06Å; C125-L127 PolarHBondContact O-N 3.45Å; C125-Y128 PolarHBondContact O-N 3.33Å; C125-V129 WeakPolarHBondContact O-CB 3.08Å; C125-V129 VanDerWaalsContact O-CG2 3.28Å; C125-V129 WeakPolarHBondContact O-CG2 3.42Å; C125-V129 PolarHBondContact O-N 2.93Å; C125-C201 WeakPolarHBondContact CA-SG 3.29Å; C125-C201 HydrophobicContact CB-CB 3.8Å; C125-C201 WeakPolarHBondContact CB-SG 3.43Å; C125-C201 VanDerWaalsContact SG-CA 3.5Å; C125-C201 WeakPolarHBondContact SG-CB 3.36Å; C125-C201 CovalentContact SG-SG 2.03Å; C125-C201 PolarHBondContact SG-SG 3.33Å
126K94.3Very high92.1Very high69 Ų6934.1 Ų34.130%0.319%0.186SC..Hα-helixtrans-61.1-45.4-178.8-72.6-179.5177.6-179.60112.8T122 T123 F130 S187 S190T122-K126 HydrophobicContact CG2-CD 4.17Å; T122-K126 WeakPolarHBondContact O-CG 3.42Å; T122-K126 PolarHBondContact O-N 3.13Å; T123-K126 PolarHBondContact O-N 3.09Å; K126-F130 VanDerWaalsContact O-CB 3.31Å; K126-F130 WeakPolarHBondContact O-CB 3.45Å; K126-F130 PolarHBondContact O-N 3.14Å; K126-S187 PolarHBondContact O-OG 3.4Å; K126-S190 WeakPolarHBondContact CE-O 3.24Å; K126-S190 WeakPolarHBondContact CG-O 3.17Å
127L94.7Very high92.4Very high90 Ų9033.4 Ų33.447%0.47118%0.183SC..Hα-helixtrans-67.1-45.2179.4-73.5174.9000111.6T123 S124 C125 V129 F130 F131T123-L127 HydrophobicContact CG2-CD1 3.93Å; T123-L127 HydrophobicContact CG2-CG 4.39Å; T123-L127 WeakPolarHBondContact O-CB 3.44Å; T123-L127 WeakPolarHBondContact O-CG 3.09Å; T123-L127 PolarHBondContact O-N 3.48Å; S124-L127 PolarHBondContact O-N 3.23Å; C125-L127 PolarHBondContact O-N 3.45Å; L127-V129 PolarHBondContact O-N 3.08Å; L127-F130 WeakPolarHBondContact O-CB 3.47Å; L127-F130 PolarHBondContact O-N 2.98Å; L127-F131 WeakPolarHBondContact O-CD2 3.39Å; L127-F131 PolarHBondContact O-N 3Å
128Y94Very high92.8Very high10 Ų1033.2 Ų33.24%0.03918%0.181CC..Hα-helixtrans-59.6-49.3177.2171.2-93000111.1T93 R98 I117 S124 C125 F130 F131 Q132T93-Y128 HydrophobicContact CG2-CE2 4.12Å; T93-Y128 WeakPolarHBondContact O-CE2 3.45Å; R98-Y128 HydrophobicContact CB-CE2 3.86Å; R98-Y128 WeakPolarHBondContact CB-OH 3.36Å; R98-Y128 VanDerWaalsContact CD-CZ 3.42Å; R98-Y128 WeakPolarHBondContact CD-OH 3.34Å; I117-Y128 HydrophobicContact CG2-CD2 3.55Å; I117-Y128 HydrophobicContact CG2-CE2 4.01Å; I117-Y128 HydrophobicContact CG2-CG 4.08Å; S124-Y128 WeakPolarHBondContact O-CB 3.47Å; S124-Y128 PolarHBondContact O-N 2.79Å; C125-Y128 PolarHBondContact O-N 3.33Å; Y128-F130 VanDerWaalsContact C-N 3.29Å; Y128-F130 PolarHBondContact O-N 2.88Å; Y128-F131 PolarHBondContact O-N 2.61Å; Y128-Q132 HydrophobicContact CE1-CB 4.31Å; Y128-Q132 VanDerWaalsContact CE1-OE1 3.24Å; Y128-Q132 WeakPolarHBondContact O-CB 3.41Å; Y128-Q132 PolarHBondContact O-N 2.95Å; Y128-Q132 PolarHBondContact OH-OE1 3.06Å
129V93Very high93.2Very high10 Ų1033.6 Ų33.66%0.06118%0.182CC..Hα-helixtrans-61.9-39.8177.9172.70000110.8C125 L127 Q132 S133 I186C125-V129 WeakPolarHBondContact O-CB 3.08Å; C125-V129 VanDerWaalsContact O-CG2 3.28Å; C125-V129 WeakPolarHBondContact O-CG2 3.42Å; C125-V129 PolarHBondContact O-N 2.93Å; L127-V129 PolarHBondContact O-N 3.08Å; V129-Q132 PolarHBondContact O-N 3.38Å; V129-S133 VanDerWaalsContact O-CB 3.26Å; V129-S133 WeakPolarHBondContact O-CB 3.44Å; V129-S133 PolarHBondContact O-N 3.01Å; V129-S133 PolarHBondContact O-OG 2.93Å; V129-I186 HydrophobicContact CG1-CB 4.47Å; V129-I186 HydrophobicContact CG1-CG2 3.52Å
130F95.1Very high93.5Very high36 Ų3633 Ų3316%0.15818%0.179CC..Hα-helixtrans-57.8-54.1174.2176.4-103.3000112.2K126 L127 Y128 Q132 S133 L134 I180 S183 L184K126-F130 VanDerWaalsContact O-CB 3.31Å; K126-F130 WeakPolarHBondContact O-CB 3.45Å; K126-F130 PolarHBondContact O-N 3.14Å; L127-F130 WeakPolarHBondContact O-CB 3.47Å; L127-F130 PolarHBondContact O-N 2.98Å; Y128-F130 VanDerWaalsContact C-N 3.29Å; Y128-F130 PolarHBondContact O-N 2.88Å; F130-Q132 VanDerWaalsContact C-N 3.35Å; F130-Q132 PolarHBondContact O-N 3.32Å; F130-S133 PolarHBondContact O-N 3.39Å; F130-L134 HydrophobicContact CE1-CD2 3.88Å; F130-L134 HydrophobicContact CZ-CD2 4.04Å; F130-L134 VanDerWaalsContact O-CB 3.24Å; F130-L134 WeakPolarHBondContact O-CB 3.36Å; F130-L134 PolarHBondContact O-N 3.32Å; F130-I180 HydrophobicContact CE2-CG2 4.39Å; F130-I180 HydrophobicContact CZ-CG2 4.3Å; F130-S183 WeakPolarHBondContact CD2-OG 3.28Å; F130-S183 WeakPolarHBondContact CE2-OG 3.49Å; F130-L184 HydrophobicContact CD2-CD2 4.49Å; F130-L184 HydrophobicContact CE2-CD2 4.06Å
131F95.2Very high93.8Very high104 Ų10429.5 Ų29.546%0.45616%0.157SC..Hα-helixtrans-65.9-38.5-178.4-77.1-65.9000112.1T93 L127 Y128 S133 T135T93-F131 HydrophobicContact CG2-CB 4.05Å; L127-F131 WeakPolarHBondContact O-CD2 3.39Å; L127-F131 PolarHBondContact O-N 3Å; Y128-F131 PolarHBondContact O-N 2.61Å; F131-S133 VanDerWaalsContact C-N 3.34Å; F131-S133 PolarHBondContact O-N 3.15Å; F131-T135 WeakPolarHBondContact O-CB 3.49Å; F131-T135 VanDerWaalsContact O-CG2 3.23Å; F131-T135 WeakPolarHBondContact O-CG2 3.33Å; F131-T135 PolarHBondContact O-N 3.16Å; F131-T135 PolarHBondContact O-OG1 3.37Å
132Q93.7Very high94Very high3 Ų327.1 Ų27.11%0.01414%0.14CC..Hα-helixtrans-58.5-50.4173.5177.217521.800110.2T93 I94 Y128 V129 F130 T135 C136T93-Q132 HydrophobicContact CG2-CB 4.19Å; I94-Q132 HydrophobicContact CD1-CG 3.88Å; I94-Q132 HydrophobicContact CG1-CG 4Å; Y128-Q132 HydrophobicContact CE1-CB 4.31Å; Y128-Q132 VanDerWaalsContact CE1-OE1 3.24Å; Y128-Q132 WeakPolarHBondContact O-CB 3.41Å; Y128-Q132 PolarHBondContact O-N 2.95Å; Y128-Q132 PolarHBondContact OH-OE1 3.06Å; V129-Q132 PolarHBondContact O-N 3.38Å; F130-Q132 VanDerWaalsContact C-N 3.35Å; F130-Q132 PolarHBondContact O-N 3.32Å; Q132-T135 PolarHBondContact O-OG1 3.02Å; Q132-T135 VanDerWaalsContact O-OG1 3.1Å; Q132-C136 PolarHBondContact O-N 3.17Å; Q132-C136 PolarHBondContact O-SG 3.13Å
133S93.9Very high94.1Very high0 Ų024.6 Ų24.60%013%0.125CC..Hα-helixtrans-64.3-47.3-179.5-75.10000112.3V129 F130 F131 T135 C136 I137 I186 S218V129-S133 VanDerWaalsContact O-CB 3.26Å; V129-S133 WeakPolarHBondContact O-CB 3.44Å; V129-S133 PolarHBondContact O-N 3.01Å; V129-S133 PolarHBondContact O-OG 2.93Å; F130-S133 PolarHBondContact O-N 3.39Å; F131-S133 VanDerWaalsContact C-N 3.34Å; F131-S133 PolarHBondContact O-N 3.15Å; S133-T135 PolarHBondContact O-N 3.13Å; S133-C136 PolarHBondContact O-N 3.27Å; S133-I137 WeakPolarHBondContact O-CB 3.47Å; S133-I137 WeakPolarHBondContact O-CD1 3.35Å; S133-I137 WeakPolarHBondContact O-CG1 3.28Å; S133-I137 PolarHBondContact O-N 3.38Å; S133-I186 WeakPolarHBondContact OG-CD1 3.26Å; S133-S218 WeakPolarHBondContact CA-OG 3.28Å; S133-S218 WeakPolarHBondContact CB-OG 3.29Å; S133-S218 PolarHBondContact OG-OG 3.49Å
134L95.7Very high94Very high14 Ų1421.8 Ų21.87%0.07311%0.106CC..Hα-helixtrans-57.5-49.4-179.9175.659.5000111.5F130 I137 F138 F176 I180F130-L134 HydrophobicContact CE1-CD2 3.88Å; F130-L134 HydrophobicContact CZ-CD2 4.04Å; F130-L134 VanDerWaalsContact O-CB 3.24Å; F130-L134 WeakPolarHBondContact O-CB 3.36Å; F130-L134 PolarHBondContact O-N 3.32Å; L134-I137 PolarHBondContact O-N 2.9Å; L134-F138 WeakPolarHBondContact O-CB 3.24Å; L134-F138 PolarHBondContact O-N 3.2Å; L134-F176 HydrophobicContact CD1-CE2 4.27Å; L134-F176 HydrophobicContact CD2-CE2 4.34Å; L134-F176 HydrophobicContact CD2-CZ 4.45Å; L134-I180 HydrophobicContact CD1-CB 4.49Å; L134-I180 HydrophobicContact CD1-CG1 3.71Å; L134-I180 HydrophobicContact CD2-CG1 4.36Å
135T95.1Very high94.1Very high12 Ų1221.7 Ų21.77%0.07410%0.104CC..Hα-helixtrans-66-41.1-175.853.80000112.3S86 S89 F131 Q132 S133 R139S86-T135 PolarHBondContact OG-O 3.32Å; S89-T135 VanDerWaalsContact CB-CG2 3.43Å; F131-T135 WeakPolarHBondContact O-CB 3.49Å; F131-T135 VanDerWaalsContact O-CG2 3.23Å; F131-T135 WeakPolarHBondContact O-CG2 3.33Å; F131-T135 PolarHBondContact O-N 3.16Å; F131-T135 PolarHBondContact O-OG1 3.37Å; Q132-T135 PolarHBondContact O-OG1 3.02Å; Q132-T135 VanDerWaalsContact O-OG1 3.1Å; S133-T135 PolarHBondContact O-N 3.13Å; T135-R139 PolarHBondContact O-N 3.33Å
136C94Very high93.9Very high4 Ų421.7 Ų21.73%0.02710%0.104CC..Hα-helixtrans-69.6-45.2175.7-71.80000113.5I94 Q132 S133 F138 R139 G140 S218 Y219I94-C136 VanDerWaalsContact CD1-SG 3.57Å; Q132-C136 PolarHBondContact O-N 3.17Å; Q132-C136 PolarHBondContact O-SG 3.13Å; S133-C136 PolarHBondContact O-N 3.27Å; C136-F138 VanDerWaalsContact C-N 3.29Å; C136-F138 PolarHBondContact O-N 2.89Å; C136-R139 PolarHBondContact O-N 2.92Å; C136-G140 PolarHBondContact O-N 3.44Å; C136-S218 WeakPolarHBondContact CB-O 3.25Å; C136-Y219 PolarHBondContact SG-O 3.38Å
137I95.1Very high93.7Very high0 Ų018.4 Ų18.40%09%0.089CC..Hα-helixtrans-62.4-42.2176.9-65.6165.3000109.6S133 L134 G140 N141 M182 L217S133-I137 WeakPolarHBondContact O-CB 3.47Å; S133-I137 WeakPolarHBondContact O-CD1 3.35Å; S133-I137 WeakPolarHBondContact O-CG1 3.28Å; S133-I137 PolarHBondContact O-N 3.38Å; L134-I137 PolarHBondContact O-N 2.9Å; I137-G140 PolarHBondContact O-N 3.24Å; I137-N141 WeakPolarHBondContact CG2-ND2 3.1Å; I137-N141 WeakPolarHBondContact O-CB 3.26Å; I137-N141 PolarHBondContact O-N 3.05Å; I137-M182 HydrophobicContact CD1-CB 3.9Å; I137-M182 HydrophobicContact CG2-CB 4.11Å; I137-M182 HydrophobicContact CG2-CE 4.03Å; I137-M182 HydrophobicContact CG2-SD 3.85Å; I137-L217 WeakPolarHBondContact CG1-O 3.24Å
138F95.7Very high93.3Very high23 Ų2318.4 Ų18.410%0.1019%0.086CC..Hα-helixtrans-61.2-48.9177.7-174.2-120.7000111.5V82 S86 L134 C136 G140 N141 I142 I172 V175 F176 S179V82-F138 HydrophobicContact CG1-CE1 3.7Å; V82-F138 HydrophobicContact CG1-CZ 3.43Å; V82-F138 VanDerWaalsContact CG1-CZ 3.43Å; S86-F138 WeakPolarHBondContact OG-CD1 3.49Å; L134-F138 WeakPolarHBondContact O-CB 3.24Å; L134-F138 PolarHBondContact O-N 3.2Å; C136-F138 VanDerWaalsContact C-N 3.29Å; C136-F138 PolarHBondContact O-N 2.89Å; F138-G140 VanDerWaalsContact C-N 3.35Å; F138-G140 PolarHBondContact O-N 3.25Å; F138-N141 PolarHBondContact O-N 2.97Å; F138-I142 HydrophobicContact CD2-CG1 4.33Å; F138-I142 HydrophobicContact CE1-CG1 4.28Å; F138-I142 HydrophobicContact CE2-CD1 3.87Å; F138-I142 HydrophobicContact CE2-CG1 4.07Å; F138-I142 HydrophobicContact CZ-CD1 3.93Å; F138-I142 HydrophobicContact CZ-CG1 4.06Å; F138-I142 VanDerWaalsContact O-CG1 3.32Å; F138-I142 WeakPolarHBondContact O-CG1 3.29Å; F138-I142 PolarHBondContact O-N 3.3Å; F138-I172 HydrophobicContact CZ-CG2 4.48Å; F138-V175 HydrophobicContact CD2-CG1 4.44Å; F138-F176 HydrophobicContact CD2-CB 4.32Å; F138-F176 AromaticContact CD2-CD2 3.9Å; F138-F176 HydrophobicContact CD2-CD2 3.9Å; F138-F176 HydrophobicContact CE2-CB 3.84Å; F138-F176 AromaticContact CE2-CD2 3.84Å; F138-F176 HydrophobicContact CE2-CD2 3.84Å; F138-F176 HydrophobicContact CE2-CG 4.34Å; F138-F176 HydrophobicContact CG-CD2 4.32Å; F138-F176 HydrophobicContact CZ-CD2 4.22Å; F138-S179 WeakPolarHBondContact CA-OG 3.33Å
139R94.6Very high92.9Very high13 Ų1318.1 Ų18.15%0.0499%0.085CC..Hα-helixtrans-52.7-51.5172.8174.3179.2161.8123.4-3.8111.8L83 S86 D87 I90 T135 C136 N141 I142 F143L83-R139 HydrophobicContact CD1-CG 4Å; S86-R139 WeakPolarHBondContact OG-CA 3.47Å; S86-R139 WeakPolarHBondContact OG-CB 3.48Å; S86-R139 PolarHBondContact OG-N 3.41Å; S86-R139 VanDerWaalsContact OG-N 3.13Å; D87-R139 WeakPolarHBondContact OD1-CD 3.45Å; D87-R139 IonicContact OD1-CZ 3.37Å; D87-R139 IonicContact OD1-NE 2.58Å; D87-R139 IonicContact OD1-NH1 2.71Å; D87-R139 PolarHBondContact OD1-NH1 3.08Å; D87-R139 IonicContact OD2-NH1 3.12Å; D87-R139 PolarHBondContact OD2-NH1 3.4Å; I90-R139 HydrophobicContact CD1-CB 3.62Å; I90-R139 HydrophobicContact CD1-CG 4.03Å; T135-R139 PolarHBondContact O-N 3.33Å; C136-R139 PolarHBondContact O-N 2.92Å; R139-N141 VanDerWaalsContact C-N 3.35Å; R139-N141 PolarHBondContact O-N 3.39Å; R139-I142 PolarHBondContact O-N 2.97Å; R139-F143 HydrophobicContact CG-CD2 4.04Å; R139-F143 HydrophobicContact CG-CE2 3.75Å; R139-F143 VanDerWaalsContact O-CD2 3.28Å; R139-F143 WeakPolarHBondContact O-CD2 3.18Å; R139-F143 PolarHBondContact O-N 3.03Å; R139-F143 VanDerWaalsContact O-N 3.13Å
140G93.3Very high92.2Very high0 Ų018.1 Ų18.10%08%0.084CC..Hα-helixtrans-59.4-43.6179.300000112.7C136 I137 F138 F143 L144C136-G140 PolarHBondContact O-N 3.44Å; I137-G140 PolarHBondContact O-N 3.24Å; F138-G140 VanDerWaalsContact C-N 3.35Å; F138-G140 PolarHBondContact O-N 3.25Å; G140-F143 WeakPolarHBondContact O-CB 3.42Å; G140-F143 PolarHBondContact O-N 3.15Å; G140-L144 PolarHBondContact O-N 3.49Å
141N94.8Very high91.3Very high12 Ų1218.5 Ų18.56%0.0649%0.087CC..Hα-helixtrans-69.8-32.9179.3-68.8-12000112.3I137 F138 R139 L144 I145 V175 S179I137-N141 WeakPolarHBondContact CG2-ND2 3.1Å; I137-N141 WeakPolarHBondContact O-CB 3.26Å; I137-N141 PolarHBondContact O-N 3.05Å; F138-N141 PolarHBondContact O-N 2.97Å; R139-N141 VanDerWaalsContact C-N 3.35Å; R139-N141 PolarHBondContact O-N 3.39Å; N141-L144 WeakPolarHBondContact O-CB 3.37Å; N141-L144 PolarHBondContact O-N 2.97Å; N141-I145 WeakPolarHBondContact O-CG1 3.29Å; N141-I145 PolarHBondContact O-N 2.84Å; N141-V175 HydrophobicContact CB-CG1 3.36Å; N141-S179 PolarHBondContact ND2-OG 2.91Å
142I94.5Very high90.5Very high0 Ų017 Ų170%08%0.084CC..Hα-helixtrans-63.6-43.5172.5-66.8-61.1000110.7V82 L83 F138 R139 L144 I145 M146V82-I142 HydrophobicContact CG1-CD1 3.77Å; V82-I142 HydrophobicContact CG1-CG1 4.17Å; L83-I142 HydrophobicContact CB-CG2 3.89Å; L83-I142 HydrophobicContact CD1-CB 4.42Å; L83-I142 HydrophobicContact CD1-CG2 4.13Å; F138-I142 HydrophobicContact CD2-CG1 4.33Å; F138-I142 HydrophobicContact CE1-CG1 4.28Å; F138-I142 HydrophobicContact CE2-CD1 3.87Å; F138-I142 HydrophobicContact CE2-CG1 4.07Å; F138-I142 HydrophobicContact CZ-CD1 3.93Å; F138-I142 HydrophobicContact CZ-CG1 4.06Å; F138-I142 VanDerWaalsContact O-CG1 3.32Å; F138-I142 WeakPolarHBondContact O-CG1 3.29Å; F138-I142 PolarHBondContact O-N 3.3Å; R139-I142 PolarHBondContact O-N 2.97Å; I142-L144 VanDerWaalsContact C-N 3.29Å; I142-L144 PolarHBondContact O-N 3.08Å; I142-I145 HydrophobicContact CD1-CD1 4.15Å; I142-I145 PolarHBondContact O-N 3.2Å; I142-M146 HydrophobicContact CG2-CE 4.32Å; I142-M146 WeakPolarHBondContact O-CG 3.45Å; I142-M146 PolarHBondContact O-N 3.29Å
143F92.2Very high89.5Confident0 Ų019 Ų190%09%0.094CC..Hα-helixtrans-57.1-43.9172.1-79.2-62.6000112.2L83 R139 G140 M146 A147 F225 V228 L269 H270 A273L83-F143 HydrophobicContact CD1-CD2 4.13Å; L83-F143 HydrophobicContact CD1-CE1 4.36Å; L83-F143 HydrophobicContact CD1-CE2 3.73Å; L83-F143 HydrophobicContact CD1-CZ 3.87Å; L83-F143 HydrophobicContact CD2-CE1 3.77Å; L83-F143 HydrophobicContact CD2-CE2 4.47Å; L83-F143 HydrophobicContact CD2-CZ 3.75Å; L83-F143 HydrophobicContact CG-CZ 4.41Å; R139-F143 HydrophobicContact CG-CD2 4.04Å; R139-F143 HydrophobicContact CG-CE2 3.75Å; R139-F143 VanDerWaalsContact O-CD2 3.28Å; R139-F143 WeakPolarHBondContact O-CD2 3.18Å; R139-F143 PolarHBondContact O-N 3.03Å; R139-F143 VanDerWaalsContact O-N 3.13Å; G140-F143 WeakPolarHBondContact O-CB 3.42Å; G140-F143 PolarHBondContact O-N 3.15Å; F143-M146 HydrophobicContact CD1-CE 3.42Å; F143-M146 VanDerWaalsContact CD1-CE 3.42Å; F143-M146 HydrophobicContact CE1-CE 3.85Å; F143-M146 HydrophobicContact CG-CE 4.2Å; F143-M146 PolarHBondContact O-N 2.71Å; F143-A147 PolarHBondContact O-N 2.84Å; F143-F225 AromaticContact CD2-CE1 3.6Å; F143-F225 HydrophobicContact CD2-CE1 3.6Å; F143-F225 AromaticContact CD2-CZ 3.79Å; F143-F225 HydrophobicContact CD2-CZ 3.79Å; F143-F225 AromaticContact CE2-CE1 3.74Å; F143-F225 HydrophobicContact CE2-CE1 3.74Å; F143-F225 AromaticContact CE2-CZ 3.74Å; F143-F225 HydrophobicContact CE2-CZ 3.74Å; F143-F225 HydrophobicContact CG-CE1 4.08Å; F143-F225 HydrophobicContact CZ-CE1 4.32Å; F143-V228 HydrophobicContact CB-CG2 4.08Å; F143-L269 HydrophobicContact CE1-CD2 4.13Å; F143-L269 HydrophobicContact CE1-CG 4.37Å; F143-H270 AromaticContact CD1-CD2 3.37Å; F143-H270 WeakPolarHBondContact CD1-CD2 3.5Å; F143-H270 AromaticContact CD1-NE2 3.44Å; F143-H270 WeakPolarHBondContact CD1-NE2 3.05Å; F143-H270 AromaticContact CE1-CD2 3.57Å; F143-H270 AromaticContact CE1-NE2 3.95Å; F143-A273 HydrophobicContact CE2-CB 4.46Å; F143-A273 HydrophobicContact CZ-CB 3.98Å
144L92.1Very high88.2Confident36 Ų3622.3 Ų22.319%0.18811%0.111CC..Hα-helixtrans-59-49.9177.6-165.282.4000111.9G140 N141 I142 M146 A147 F148 I227 V228G140-L144 PolarHBondContact O-N 3.49Å; N141-L144 WeakPolarHBondContact O-CB 3.37Å; N141-L144 PolarHBondContact O-N 2.97Å; I142-L144 VanDerWaalsContact C-N 3.29Å; I142-L144 PolarHBondContact O-N 3.08Å; L144-M146 VanDerWaalsContact C-N 3.32Å; L144-M146 PolarHBondContact O-N 3.06Å; L144-A147 WeakPolarHBondContact O-CB 3.37Å; L144-A147 PolarHBondContact O-N 3.44Å; L144-A147 VanDerWaalsContact O-N 3.15Å; L144-F148 HydrophobicContact CD1-CE2 3.95Å; L144-F148 HydrophobicContact CD2-CD2 4.36Å; L144-F148 HydrophobicContact CD2-CE2 3.96Å; L144-F148 HydrophobicContact CG-CD2 3.85Å; L144-F148 HydrophobicContact CG-CE2 3.64Å; L144-F148 VanDerWaalsContact O-CD2 3.29Å; L144-F148 WeakPolarHBondContact O-CD2 3.41Å; L144-F148 PolarHBondContact O-N 3.18Å; L144-I227 HydrophobicContact CD1-CB 3.83Å; L144-I227 HydrophobicContact CD1-CD1 4.41Å; L144-I227 HydrophobicContact CD1-CG2 3.52Å; L144-V228 HydrophobicContact CB-CG2 4.43Å; L144-V228 HydrophobicContact CD1-CG2 4.27Å
145I92.4Very high86.9Confident20 Ų2027.4 Ų27.410%0.10313%0.134CC..Hα-helixtrans-60.3-42.9176.7-61.6164.5000110.7Y79 N141 I142 A147 F148 D149 I171 V175Y79-I145 HydrophobicContact CD1-CG2 4.22Å; Y79-I145 HydrophobicContact CE1-CG2 3.58Å; Y79-I145 HydrophobicContact CE2-CG2 4.13Å; N141-I145 WeakPolarHBondContact O-CG1 3.29Å; N141-I145 PolarHBondContact O-N 2.84Å; I142-I145 HydrophobicContact CD1-CD1 4.15Å; I142-I145 PolarHBondContact O-N 3.2Å; I145-A147 PolarHBondContact O-N 2.99Å; I145-F148 PolarHBondContact O-N 3.01Å; I145-D149 VanDerWaalsContact O-CB 3.23Å; I145-D149 WeakPolarHBondContact O-CB 3.35Å; I145-D149 PolarHBondContact O-N 2.98Å; I145-I171 HydrophobicContact CD1-CG2 4Å; I145-I171 HydrophobicContact CG1-CG2 4.39Å; I145-I171 HydrophobicContact CG2-CG2 3.85Å; I145-V175 HydrophobicContact CD1-CB 3.62Å; I145-V175 HydrophobicContact CD1-CG1 3.85Å; I145-V175 HydrophobicContact CD1-CG2 3.16Å; I145-V175 HydrophobicContact CG1-CG2 3.68Å
146M89.6Confident85.6Confident0 Ų032.8 Ų32.80%016%0.157CC..Hα-helixtrans-61.4-32.4179-72.9-167.1-61.100112.3Y79 L80 L83 I142 F143 L144 R150 M266Y79-M146 HydrophobicContact CD2-CG 4.17Å; Y79-M146 HydrophobicContact CG-CG 4.04Å; L80-M146 HydrophobicContact CD2-SD 3.81Å; L80-M146 HydrophobicContact CG-SD 4.34Å; L83-M146 HydrophobicContact CD2-CE 3.9Å; I142-M146 HydrophobicContact CG2-CE 4.32Å; I142-M146 WeakPolarHBondContact O-CG 3.45Å; I142-M146 PolarHBondContact O-N 3.29Å; F143-M146 HydrophobicContact CD1-CE 3.42Å; F143-M146 VanDerWaalsContact CD1-CE 3.42Å; F143-M146 HydrophobicContact CE1-CE 3.85Å; F143-M146 HydrophobicContact CG-CE 4.2Å; F143-M146 PolarHBondContact O-N 2.71Å; L144-M146 VanDerWaalsContact C-N 3.32Å; L144-M146 PolarHBondContact O-N 3.06Å; M146-R150 WeakPolarHBondContact O-CG 3.37Å; M146-R150 PolarHBondContact O-N 3.27Å; M146-R150 PolarHBondContact O-NE 2.78Å; M146-M266 HydrophobicContact SD-CE 4.16Å; M146-M266 HydrophobicContact SD-SD 4.41Å
147A88.1Confident84.1Confident0 Ų036 Ų360%018%0.177CC..Hα-helixtrans-71-48.7171.900000112.1F143 L144 I145 R150 L151 V228 I231F143-A147 PolarHBondContact O-N 2.84Å; L144-A147 WeakPolarHBondContact O-CB 3.37Å; L144-A147 PolarHBondContact O-N 3.44Å; L144-A147 VanDerWaalsContact O-N 3.15Å; I145-A147 PolarHBondContact O-N 2.99Å; A147-R150 WeakPolarHBondContact O-CB 3.28Å; A147-R150 PolarHBondContact O-N 3.4Å; A147-L151 PolarHBondContact O-N 2.89Å; A147-V228 HydrophobicContact CB-CG1 4.28Å; A147-V228 HydrophobicContact CB-CG2 4.14Å; A147-I231 HydrophobicContact CB-CB 4.2Å; A147-I231 HydrophobicContact CB-CD1 4.12Å; A147-I231 HydrophobicContact CB-CG2 3.89Å
148F87.8Confident82.1Confident89 Ų8943.3 Ų43.339%0.3922%0.216SC..Hα-helixtrans-64-43178.2-80.6-67.1000113.5L144 I145 R150 L151 L152 I231L144-F148 HydrophobicContact CD1-CE2 3.95Å; L144-F148 HydrophobicContact CD2-CD2 4.36Å; L144-F148 HydrophobicContact CD2-CE2 3.96Å; L144-F148 HydrophobicContact CG-CD2 3.85Å; L144-F148 HydrophobicContact CG-CE2 3.64Å; L144-F148 VanDerWaalsContact O-CD2 3.29Å; L144-F148 WeakPolarHBondContact O-CD2 3.41Å; L144-F148 PolarHBondContact O-N 3.18Å; I145-F148 PolarHBondContact O-N 3.01Å; F148-R150 VanDerWaalsContact C-N 3.26Å; F148-R150 PolarHBondContact O-N 2.88Å; F148-L151 WeakPolarHBondContact O-CB 3.17Å; F148-L151 PolarHBondContact O-N 3.13Å; F148-L151 VanDerWaalsContact O-N 3.15Å; F148-L152 WeakPolarHBondContact O-CB 3.36Å; F148-L152 WeakPolarHBondContact O-CG 3.28Å; F148-L152 PolarHBondContact O-N 3.45Å; F148-I231 HydrophobicContact CD1-CD1 4.21Å; F148-I231 HydrophobicContact CD2-CD1 4.22Å; F148-I231 HydrophobicContact CE1-CD1 3.89Å; F148-I231 HydrophobicContact CE2-CD1 3.91Å; F148-I231 HydrophobicContact CG-CD1 4.36Å; F148-I231 HydrophobicContact CZ-CD1 3.73Å
149D84.5Confident80.3Confident5 Ų547.6 Ų47.63%0.02724%0.239CC..Hα-helixtrans-58.8-39.8177.4-174.784.9000110.9R75 Y79 I145 L153R75-D149 IonicContact CZ-OD1 3.72Å; R75-D149 IonicContact NE-OD1 2.84Å; R75-D149 IonicContact NH2-OD1 3.24Å; R75-D149 PolarHBondContact NH2-OD1 3.46Å; Y79-D149 HydrophobicContact CE2-CB 3.91Å; I145-D149 VanDerWaalsContact O-CB 3.23Å; I145-D149 WeakPolarHBondContact O-CB 3.35Å; I145-D149 PolarHBondContact O-N 2.98Å; D149-L153 WeakPolarHBondContact O-CB 3.39Å; D149-L153 WeakPolarHBondContact O-CD1 3.35Å; D149-L153 WeakPolarHBondContact O-CG 3.31Å; D149-L153 PolarHBondContact O-N 3.26Å; D149-L153 WeakPolarHBondContact OD2-CD1 3.36Å
150R78.1Confident78.5Confident9 Ų948.7 Ų48.73%0.03425%0.245CC..Hα-helixtrans-65.1-47.9173-79.4-177.4-66.4151.29.6112.4M146 A147 F148 L152 L153 I154 D232 H270M146-R150 WeakPolarHBondContact O-CG 3.37Å; M146-R150 PolarHBondContact O-N 3.27Å; M146-R150 PolarHBondContact O-NE 2.78Å; A147-R150 WeakPolarHBondContact O-CB 3.28Å; A147-R150 PolarHBondContact O-N 3.4Å; F148-R150 VanDerWaalsContact C-N 3.26Å; F148-R150 PolarHBondContact O-N 2.88Å; R150-L152 VanDerWaalsContact C-N 3.29Å; R150-L152 PolarHBondContact O-N 3.03Å; R150-L153 PolarHBondContact O-N 3.26Å; R150-I154 WeakPolarHBondContact O-CG1 3.43Å; R150-I154 PolarHBondContact O-N 2.93Å; R150-D232 IonicContact CZ-OD1 3.71Å; R150-D232 VanDerWaalsContact CZ-OD1 3.26Å; R150-D232 IonicContact CZ-OD2 2.73Å; R150-D232 IonicContact NH1-OD1 3.26Å; R150-D232 PolarHBondContact NH1-OD1 3.31Å; R150-D232 IonicContact NH1-OD2 3.68Å; R150-D232 PolarHBondContact NH1-OD2 3.04Å; R150-D232 IonicContact NH2-OD1 3.72Å; R150-D232 PolarHBondContact NH2-OD1 2.72Å; R150-D232 IonicContact NH2-OD2 3.36Å; R150-D232 PolarHBondContact NH2-OD2 3.45Å; R150-H270 PolarHBondContact NH2-CE1 3.4Å; R150-H270 PolarHBondContact NH2-ND1 3.3Å; R150-H270 VanDerWaalsContact NH2-ND1 3.14Å
151L78Confident77Confident45 Ų4557.8 Ų57.824%0.23628%0.284CS..Hα-helixtrans-56.9-45.8179.4-171.671.8000111A147 F148 I154 H155 I231A147-L151 PolarHBondContact O-N 2.89Å; F148-L151 WeakPolarHBondContact O-CB 3.17Å; F148-L151 PolarHBondContact O-N 3.13Å; F148-L151 VanDerWaalsContact O-N 3.15Å; L151-I154 PolarHBondContact O-N 3.02Å; L151-H155 WeakPolarHBondContact CD1-CE1 3.46Å; L151-H155 PolarHBondContact O-N 3.17Å; L151-H155 VanDerWaalsContact O-N 3.08Å; L151-H155 PolarHBondContact O-ND1 3.2Å; L151-I231 HydrophobicContact CB-CG2 4.37Å
152L76.9Confident75.3Confident73 Ų7366 Ų6638%0.38232%0.319SS..Hα-helixtrans-68.1-42.2179.9-69.9173.5000112.9F148 R150 I154 K156 F160F148-L152 WeakPolarHBondContact O-CB 3.36Å; F148-L152 WeakPolarHBondContact O-CG 3.28Å; F148-L152 PolarHBondContact O-N 3.45Å; R150-L152 VanDerWaalsContact C-N 3.29Å; R150-L152 PolarHBondContact O-N 3.03Å; L152-I154 PolarHBondContact O-N 3.23Å; L152-I154 VanDerWaalsContact O-N 3.14Å; L152-K156 CarbonylContact O-C 3.37Å; L152-K156 WeakPolarHBondContact O-CA 3.18Å; L152-K156 PolarHBondContact O-N 3.27Å; L152-F160 HydrophobicContact CB-CD1 4.43Å; L152-F160 HydrophobicContact CB-CE1 4.19Å; L152-F160 HydrophobicContact CB-CE2 4.34Å; L152-F160 HydrophobicContact CB-CZ 4.17Å; L152-F160 HydrophobicContact CD1-CE1 4.28Å; L152-F160 HydrophobicContact CD1-CE2 4.03Å; L152-F160 HydrophobicContact CD1-CZ 3.64Å
153L72.5Confident73.8Confident45 Ų4569.8 Ų69.824%0.23634%0.337CS..Hα-helixtrans-59-25.7177.7-81.9167.9000113D149 R150 P157 F160D149-L153 WeakPolarHBondContact O-CB 3.39Å; D149-L153 WeakPolarHBondContact O-CD1 3.35Å; D149-L153 WeakPolarHBondContact O-CG 3.31Å; D149-L153 PolarHBondContact O-N 3.26Å; D149-L153 WeakPolarHBondContact OD2-CD1 3.36Å; R150-L153 PolarHBondContact O-N 3.26Å; L153-P157 VanDerWaalsContact O-CA 3.25Å; L153-P157 WeakPolarHBondContact O-CA 3.4Å; L153-P157 WeakPolarHBondContact O-CB 2.88Å; L153-F160 HydrophobicContact CD2-CB 3.98Å; L153-F160 HydrophobicContact CD2-CD1 4.06Å; L153-F160 HydrophobicContact CG-CD1 4.12Å
154I66.4Low72.6Confident69 Ų6973.6 Ų73.635%0.35436%0.361SS..Hα-helixtrans-100.5-39.5-173.4-63.3174000111.8R150 L151 L152 K156 F235R150-I154 WeakPolarHBondContact O-CG1 3.43Å; R150-I154 PolarHBondContact O-N 2.93Å; L151-I154 PolarHBondContact O-N 3.02Å; L152-I154 PolarHBondContact O-N 3.23Å; L152-I154 VanDerWaalsContact O-N 3.14Å; I154-K156 VanDerWaalsContact C-N 3.35Å; I154-F235 HydrophobicContact CB-CE2 4.01Å; I154-F235 HydrophobicContact CD1-CD2 4.26Å; I154-F235 HydrophobicContact CD1-CE1 4.21Å; I154-F235 HydrophobicContact CD1-CE2 3.13Å; I154-F235 HydrophobicContact CD1-CZ 3.1Å; I154-F235 HydrophobicContact CG1-CE2 4.11Å; I154-F235 HydrophobicContact CG1-CZ 4.39Å; I154-F235 HydrophobicContact CG2-CE2 3.86Å; I154-F235 HydrophobicContact CG2-CZ 4.47Å
155H68.4Low71.8Confident121 Ų12176.3 Ų76.356%0.5637%0.372SS*.Hα-helixtrans-72-31.1173.7-70.581.2000112.1L151L151-H155 WeakPolarHBondContact CD1-CE1 3.46Å; L151-H155 PolarHBondContact O-N 3.17Å; L151-H155 VanDerWaalsContact O-N 3.08Å; L151-H155 PolarHBondContact O-ND1 3.2Å
156K67.9Low71.4Confident124 Ų12483.4 Ų83.454%0.53940%0.398SS..  trans-138.261.8-176.2-66.6-174.1173.4-1720112.6L152 I154 L158 L159 F160L152-K156 CarbonylContact O-C 3.37Å; L152-K156 WeakPolarHBondContact O-CA 3.18Å; L152-K156 PolarHBondContact O-N 3.27Å; I154-K156 VanDerWaalsContact C-N 3.35Å; K156-L158 VanDerWaalsContact C-N 3.3Å; K156-L158 PolarHBondContact O-N 2.87Å; K156-L159 HydrophobicContact CB-CB 4.45Å; K156-L159 HydrophobicContact CB-CD1 4.22Å; K156-L159 HydrophobicContact CD-CD1 3.8Å; K156-L159 HydrophobicContact CG-CD1 4.34Å; K156-L159 PolarHBondContact O-N 2.82Å; K156-F160 PolarHBondContact O-N 2.95Å
157P62.4Low71.3Confident71 Ų7185 Ų8546%0.46141%0.408SS..Hα-helixtrans-60.6-36.6-17623.9-33.9000113.3L153 F160 K161L153-P157 VanDerWaalsContact O-CA 3.25Å; L153-P157 WeakPolarHBondContact O-CA 3.4Å; L153-P157 WeakPolarHBondContact O-CB 2.88Å; P157-F160 PolarHBondContact O-N 3.22Å; P157-K161 WeakPolarHBondContact O-CB 3.16Å; P157-K161 PolarHBondContact O-N 2.92Å; P157-K161 VanDerWaalsContact O-N 3.14Å
158L55.1Low71.3Confident154 Ų15485 Ų8581%0.80641%0.408SS*.Hα-helixtrans-70.7-34.4-175.2-65.6174.9000113.3K156K156-L158 VanDerWaalsContact C-N 3.3Å; K156-L158 PolarHBondContact O-N 2.87Å
159L57.7Low71.6Confident114 Ų11485.4 Ų85.460%0.59741%0.407SS*.Hα-helixtrans-74.6-40.3176.6-76.2157.7000110.8K156K156-L159 HydrophobicContact CB-CB 4.45Å; K156-L159 HydrophobicContact CB-CD1 4.22Å; K156-L159 HydrophobicContact CD-CD1 3.8Å; K156-L159 HydrophobicContact CG-CD1 4.34Å; K156-L159 PolarHBondContact O-N 2.82Å
160F57Low72Confident36 Ų3688.8 Ų88.816%0.15843%0.425CS..Hα-helixtrans-86-20.5-169.6-119.1-121000115.4R75 L152 L153 K156 P157 K162 H163R75-F160 PolarHBondContact NH1-O 3.45Å; L152-F160 HydrophobicContact CB-CD1 4.43Å; L152-F160 HydrophobicContact CB-CE1 4.19Å; L152-F160 HydrophobicContact CB-CE2 4.34Å; L152-F160 HydrophobicContact CB-CZ 4.17Å; L152-F160 HydrophobicContact CD1-CE1 4.28Å; L152-F160 HydrophobicContact CD1-CE2 4.03Å; L152-F160 HydrophobicContact CD1-CZ 3.64Å; L153-F160 HydrophobicContact CD2-CB 3.98Å; L153-F160 HydrophobicContact CD2-CD1 4.06Å; L153-F160 HydrophobicContact CG-CD1 4.12Å; K156-F160 PolarHBondContact O-N 2.95Å; P157-F160 PolarHBondContact O-N 3.22Å; F160-K162 PolarHBondContact O-N 3.49Å; F160-H163 AromaticContact CD2-CD2 3.74Å; F160-H163 AromaticContact CD2-NE2 3.86Å; F160-H163 AromaticContact CG-CD2 4Å; F160-H163 PolarHBondContact O-N 3.42Å
161K61.5Low72.7Confident190 Ų19090.6 Ų90.683%0.82643%0.434SS*.THydrogen-bonded Turntrans-66.9-23.8177.5-168.8177.1178.9-174.80112.8P157P157-K161 WeakPolarHBondContact O-CB 3.16Å; P157-K161 PolarHBondContact O-N 2.92Å; P157-K161 VanDerWaalsContact O-N 3.14Å
162K57.8Low73.5Confident185 Ų18589 Ų8980%0.80443%0.426SS*.THydrogen-bonded Turntrans-80.2-11.4-179-71.9-172.1177.8-176.20114.4F160F160-K162 PolarHBondContact O-N 3.49Å
163H62.9Low74.4Confident80 Ų8089.1 Ų89.137%0.3743%0.43SS..  trans-75.1127.7-175.1-69.6-60.7000112.4F160 T167F160-H163 AromaticContact CD2-CD2 3.74Å; F160-H163 AromaticContact CD2-NE2 3.86Å; F160-H163 AromaticContact CG-CD2 4Å; F160-H163 PolarHBondContact O-N 3.42Å; H163-T167 HydrophobicContact CB-CG2 4.37Å
164P68.2Low75.6Confident79 Ų7990.2 Ų90.251%0.51344%0.439SS..  trans-69.1162.3178.929-34.7000111.9Y166 T167P164-Y166 PolarHBondContact O-N 2.87Å; P164-T167 WeakPolarHBondContact O-CB 3.41Å; P164-T167 PolarHBondContact O-N 3.25Å; P164-T167 PolarHBondContact O-OG1 2.93Å
165K75.2Confident77Confident94 Ų9487.9 Ų87.941%0.40943%0.427SS..Hα-helixtrans-50.9-33.1175.9-64.8-176179.6-1720113.1H73 T167 V168H73-K165 PolarHBondContact ND1-NZ 3.42Å; K165-T167 VanDerWaalsContact C-N 3.29Å; K165-T167 PolarHBondContact O-N 3.48Å; K165-V168 PolarHBondContact O-N 2.83Å
166Y84.5Confident78.3Confident169 Ų16986.1 Ų86.166%0.66342%0.418SS*.Hα-helixtrans-59.3-36.2179.3-173.7-113.7000113P164 V168 W169 I170P164-Y166 PolarHBondContact O-N 2.87Å; Y166-V168 PolarHBondContact O-N 3.27Å; Y166-W169 PolarHBondContact O-N 3.35Å; Y166-W169 VanDerWaalsContact O-N 3.14Å; Y166-I170 HydrophobicContact CD1-CD1 3.73Å; Y166-I170 HydrophobicContact CD1-CG1 4.16Å; Y166-I170 HydrophobicContact CE1-CD1 3.51Å; Y166-I170 HydrophobicContact CE1-CG1 3.89Å; Y166-I170 WeakPolarHBondContact O-CG1 3.17Å; Y166-I170 PolarHBondContact O-N 3.26Å; Y166-I170 VanDerWaalsContact O-N 3.09Å
167T86.6Confident79.7Confident34 Ų3484.8 Ų84.821%0.20942%0.416CS..Hα-helixtrans-60.6-34178.7-54.30000112.4H163 P164 K165 I170 I171H163-T167 HydrophobicContact CB-CG2 4.37Å; P164-T167 WeakPolarHBondContact O-CB 3.41Å; P164-T167 PolarHBondContact O-N 3.25Å; P164-T167 PolarHBondContact O-OG1 2.93Å; K165-T167 VanDerWaalsContact C-N 3.29Å; K165-T167 PolarHBondContact O-N 3.48Å; T167-I170 PolarHBondContact O-N 2.96Å; T167-I171 HydrophobicContact CG2-CD1 4.13Å; T167-I171 VanDerWaalsContact O-CG1 3.29Å; T167-I171 WeakPolarHBondContact O-CG1 3.45Å; T167-I171 PolarHBondContact O-N 2.99Å
168V89.2Confident81.3Confident0 Ų085.1 Ų85.10%041%0.413CS..Hα-helixtrans-66.7-41.8178.3179.10000111.1R75 I78 Y79 K165 Y166 I171 I172R75-V168 HydrophobicContact CB-CG2 3.65Å; R75-V168 HydrophobicContact CG-CG2 3.49Å; R75-V168 VanDerWaalsContact CG-CG2 3.49Å; I78-V168 HydrophobicContact CB-CG1 3.98Å; I78-V168 HydrophobicContact CD1-CB 4.28Å; I78-V168 HydrophobicContact CD1-CG1 4.11Å; I78-V168 HydrophobicContact CG2-CG1 3.9Å; Y79-V168 HydrophobicContact CD1-CG1 4.22Å; Y79-V168 HydrophobicContact CE1-CG1 3.66Å; Y79-V168 HydrophobicContact CE2-CG1 4.46Å; K165-V168 PolarHBondContact O-N 2.83Å; Y166-V168 PolarHBondContact O-N 3.27Å; V168-I171 PolarHBondContact O-N 3.35Å; V168-I172 HydrophobicContact CG1-CD1 3.75Å; V168-I172 WeakPolarHBondContact O-CD1 3.26Å; V168-I172 VanDerWaalsContact O-CG1 3.31Å; V168-I172 WeakPolarHBondContact O-CG1 3.4Å; V168-I172 PolarHBondContact O-N 2.92Å
169W92.3Very high83.3Confident96 Ų9677.8 Ų77.836%0.36437%0.374SS..Hα-helixtrans-66-38.8176.6-74.7110.6000112.2L68 I78 V82 Y166 I171 I172 T173L68-W169 HydrophobicContact CD2-CH2 4.29Å; I78-W169 HydrophobicContact CG2-CH2 4.35Å; I78-W169 HydrophobicContact CG2-CZ2 3.97Å; V82-W169 HydrophobicContact CG2-CH2 4.46Å; V82-W169 HydrophobicContact CG2-CZ3 4.33Å; Y166-W169 PolarHBondContact O-N 3.35Å; Y166-W169 VanDerWaalsContact O-N 3.14Å; W169-I171 VanDerWaalsContact C-N 3.35Å; W169-I171 PolarHBondContact O-N 2.91Å; W169-I172 HydrophobicContact CE3-CD1 4.24Å; W169-I172 PolarHBondContact O-N 2.79Å; W169-T173 WeakPolarHBondContact O-CB 3.08Å; W169-T173 PolarHBondContact O-N 2.67Å; W169-T173 PolarHBondContact O-OG1 3.48Å
170I93Very high85.2Confident77 Ų7774.8 Ų74.840%0.39536%0.359SS..Hα-helixtrans-58-48.8171.7-60.2173.8000110.4Y166 T167 I172 T173 T174Y166-I170 HydrophobicContact CD1-CD1 3.73Å; Y166-I170 HydrophobicContact CD1-CG1 4.16Å; Y166-I170 HydrophobicContact CE1-CD1 3.51Å; Y166-I170 HydrophobicContact CE1-CG1 3.89Å; Y166-I170 WeakPolarHBondContact O-CG1 3.17Å; Y166-I170 PolarHBondContact O-N 3.26Å; Y166-I170 VanDerWaalsContact O-N 3.09Å; T167-I170 PolarHBondContact O-N 2.96Å; I170-I172 VanDerWaalsContact C-N 3.32Å; I170-I172 PolarHBondContact O-N 3.16Å; I170-T173 PolarHBondContact O-N 2.72Å; I170-T174 WeakPolarHBondContact O-CB 3.29Å; I170-T174 PolarHBondContact O-N 2.88Å; I170-T174 PolarHBondContact O-OG1 3.3Å
171I93.5Very high87Confident47 Ų4777.3 Ų77.324%0.24138%0.377CS..Hα-helixtrans-58.5-45.1179.6-69.6164.3000111Y79 I145 T167 V168 W169 T174 V175Y79-I171 HydrophobicContact CE1-CG2 4.42Å; I145-I171 HydrophobicContact CD1-CG2 4Å; I145-I171 HydrophobicContact CG1-CG2 4.39Å; I145-I171 HydrophobicContact CG2-CG2 3.85Å; T167-I171 HydrophobicContact CG2-CD1 4.13Å; T167-I171 VanDerWaalsContact O-CG1 3.29Å; T167-I171 WeakPolarHBondContact O-CG1 3.45Å; T167-I171 PolarHBondContact O-N 2.99Å; V168-I171 PolarHBondContact O-N 3.35Å; W169-I171 VanDerWaalsContact C-N 3.35Å; W169-I171 PolarHBondContact O-N 2.91Å; I171-T174 PolarHBondContact O-N 2.92Å; I171-V175 WeakPolarHBondContact O-CG2 3.33Å; I171-V175 PolarHBondContact O-N 3.02Å
172I95.1Very high88.6Confident10 Ų1070 Ų705%0.05135%0.346CS..Hα-helixtrans-62.4-46.7178.5-70159.6000110.9I78 Y79 V82 F138 V168 W169 I170 V175 F176I78-I172 HydrophobicContact CG2-CD1 3.64Å; Y79-I172 HydrophobicContact CD1-CD1 4.02Å; Y79-I172 HydrophobicContact CD1-CG1 3.95Å; Y79-I172 HydrophobicContact CE1-CD1 4.13Å; Y79-I172 HydrophobicContact CE1-CG1 3.86Å; V82-I172 HydrophobicContact CG1-CG2 4.05Å; V82-I172 HydrophobicContact CG2-CD1 3.97Å; V82-I172 HydrophobicContact CG2-CG2 4.31Å; F138-I172 HydrophobicContact CZ-CG2 4.48Å; V168-I172 HydrophobicContact CG1-CD1 3.75Å; V168-I172 WeakPolarHBondContact O-CD1 3.26Å; V168-I172 VanDerWaalsContact O-CG1 3.31Å; V168-I172 WeakPolarHBondContact O-CG1 3.4Å; V168-I172 PolarHBondContact O-N 2.92Å; W169-I172 HydrophobicContact CE3-CD1 4.24Å; W169-I172 PolarHBondContact O-N 2.79Å; I170-I172 VanDerWaalsContact C-N 3.32Å; I170-I172 PolarHBondContact O-N 3.16Å; I172-V175 PolarHBondContact O-N 2.73Å; I172-F176 WeakPolarHBondContact O-CB 3.16Å; I172-F176 PolarHBondContact O-N 2.94Å
173T95.9Very high90.3Very high76 Ų7661.2 Ų61.247%0.46631%0.308SS..Hα-helixtrans-62.3-44.1178.1-600000111.3W169 I170 V175 F176 I177W169-T173 WeakPolarHBondContact O-CB 3.08Å; W169-T173 PolarHBondContact O-N 2.67Å; W169-T173 PolarHBondContact O-OG1 3.48Å; I170-T173 PolarHBondContact O-N 2.72Å; T173-V175 VanDerWaalsContact C-N 3.32Å; T173-V175 PolarHBondContact O-N 2.84Å; T173-F176 WeakPolarHBondContact O-CB 3.12Å; T173-F176 PolarHBondContact O-N 3.46Å; T173-I177 HydrophobicContact CG2-CD1 4.09Å; T173-I177 WeakPolarHBondContact O-CG1 3.39Å; T173-I177 PolarHBondContact O-N 2.9Å
174T96.4Very high91.7Very high69 Ų6960.8 Ų60.842%0.42331%0.308SS..Hα-helixtrans-59.3-44.5175.5-61.20000111.2I170 I171 I177 I178I170-T174 WeakPolarHBondContact O-CB 3.29Å; I170-T174 PolarHBondContact O-N 2.88Å; I170-T174 PolarHBondContact O-OG1 3.3Å; I171-T174 PolarHBondContact O-N 2.92Å; T174-I177 PolarHBondContact O-N 3.01Å; T174-I178 HydrophobicContact CG2-CD1 4Å; T174-I178 VanDerWaalsContact O-CG1 3.3Å; T174-I178 WeakPolarHBondContact O-CG1 3.42Å; T174-I178 PolarHBondContact O-N 2.8Å
175V96.1Very high92.9Very high19 Ų1959.2 Ų59.212%0.11530%0.298CS..Hα-helixtrans-66.6-38.3176.9166.20000112.4F138 N141 I145 I171 I172 T173 I177 I178 S179F138-V175 HydrophobicContact CD2-CG1 4.44Å; N141-V175 HydrophobicContact CB-CG1 3.36Å; I145-V175 HydrophobicContact CD1-CB 3.62Å; I145-V175 HydrophobicContact CD1-CG1 3.85Å; I145-V175 HydrophobicContact CD1-CG2 3.16Å; I145-V175 HydrophobicContact CG1-CG2 3.68Å; I171-V175 WeakPolarHBondContact O-CG2 3.33Å; I171-V175 PolarHBondContact O-N 3.02Å; I172-V175 PolarHBondContact O-N 2.73Å; T173-V175 VanDerWaalsContact C-N 3.32Å; T173-V175 PolarHBondContact O-N 2.84Å; V175-I177 VanDerWaalsContact C-N 3.32Å; V175-I177 PolarHBondContact O-N 3.1Å; V175-I178 PolarHBondContact O-N 3.46Å; V175-S179 WeakPolarHBondContact O-CB 3.31Å; V175-S179 PolarHBondContact O-N 2.87Å; V175-S179 PolarHBondContact O-OG 2.86Å; V175-S179 VanDerWaalsContact O-OG 3.08Å
176F97Very high93.6Very high85 Ų8554.8 Ų54.837%0.37328%0.278SS..Hα-helixtrans-60.2-43.5174.5-176.9-109.4000111.5L134 F138 I172 T173 S179 I180L134-F176 HydrophobicContact CD1-CE2 4.27Å; L134-F176 HydrophobicContact CD2-CE2 4.34Å; L134-F176 HydrophobicContact CD2-CZ 4.45Å; F138-F176 HydrophobicContact CD2-CB 4.32Å; F138-F176 AromaticContact CD2-CD2 3.9Å; F138-F176 HydrophobicContact CD2-CD2 3.9Å; F138-F176 HydrophobicContact CE2-CB 3.84Å; F138-F176 AromaticContact CE2-CD2 3.84Å; F138-F176 HydrophobicContact CE2-CD2 3.84Å; F138-F176 HydrophobicContact CE2-CG 4.34Å; F138-F176 HydrophobicContact CG-CD2 4.32Å; F138-F176 HydrophobicContact CZ-CD2 4.22Å; I172-F176 WeakPolarHBondContact O-CB 3.16Å; I172-F176 PolarHBondContact O-N 2.94Å; T173-F176 WeakPolarHBondContact O-CB 3.12Å; T173-F176 PolarHBondContact O-N 3.46Å; F176-S179 WeakPolarHBondContact O-CB 3.46Å; F176-S179 PolarHBondContact O-N 3.17Å; F176-I180 HydrophobicContact CD1-CD1 3.99Å; F176-I180 HydrophobicContact CE1-CD1 3.6Å; F176-I180 HydrophobicContact CE1-CG1 4.42Å; F176-I180 HydrophobicContact CZ-CD1 4.05Å; F176-I180 HydrophobicContact CZ-CG1 4.49Å; F176-I180 WeakPolarHBondContact O-CG1 3.42Å; F176-I180 PolarHBondContact O-N 3.32Å
177I97.4Very high93.9Very high95 Ų9547.5 Ų47.549%0.48725%0.252SS..Hα-helixtrans-61.7-45.3174.3-65.9165.4000110.9T173 T174 V175 S179 I180 V181T173-I177 HydrophobicContact CG2-CD1 4.09Å; T173-I177 WeakPolarHBondContact O-CG1 3.39Å; T173-I177 PolarHBondContact O-N 2.9Å; T174-I177 PolarHBondContact O-N 3.01Å; V175-I177 VanDerWaalsContact C-N 3.32Å; V175-I177 PolarHBondContact O-N 3.1Å; I177-S179 VanDerWaalsContact C-N 3.3Å; I177-S179 PolarHBondContact O-N 3.45Å; I177-I180 WeakPolarHBondContact O-CB 3.22Å; I177-I180 PolarHBondContact O-N 3.34Å; I177-V181 WeakPolarHBondContact O-CG2 3.33Å; I177-V181 PolarHBondContact O-N 3.3Å
178I96.4Very high94.2Very high78 Ų7850.7 Ų50.740%0.427%0.267SS..Hα-helixtrans-59.3-42.7175.6-68.9166.2000110.6T174 V175 I180 V181 M182T174-I178 HydrophobicContact CG2-CD1 4Å; T174-I178 VanDerWaalsContact O-CG1 3.3Å; T174-I178 WeakPolarHBondContact O-CG1 3.42Å; T174-I178 PolarHBondContact O-N 2.8Å; V175-I178 PolarHBondContact O-N 3.46Å; I178-I180 VanDerWaalsContact C-N 3.33Å; I178-I180 PolarHBondContact O-N 3.47Å; I178-V181 PolarHBondContact O-N 2.85Å; I178-M182 HydrophobicContact CG2-CG 4.24Å; I178-M182 HydrophobicContact CG2-SD 3.81Å; I178-M182 VanDerWaalsContact O-CG 3.28Å; I178-M182 WeakPolarHBondContact O-CG 3.35Å; I178-M182 PolarHBondContact O-N 2.99Å
179S96.2Very high94.3Very high0 Ų055 Ų550%028%0.284CS..Hα-helixtrans-61.9-39176.9-66.10000112.2F138 N141 V175 F176 I177 M182 S183F138-S179 WeakPolarHBondContact CA-OG 3.33Å; N141-S179 PolarHBondContact ND2-OG 2.91Å; V175-S179 WeakPolarHBondContact O-CB 3.31Å; V175-S179 PolarHBondContact O-N 2.87Å; V175-S179 PolarHBondContact O-OG 2.86Å; V175-S179 VanDerWaalsContact O-OG 3.08Å; F176-S179 WeakPolarHBondContact O-CB 3.46Å; F176-S179 PolarHBondContact O-N 3.17Å; I177-S179 VanDerWaalsContact C-N 3.3Å; I177-S179 PolarHBondContact O-N 3.45Å; S179-M182 PolarHBondContact O-N 3.25Å; S179-S183 WeakPolarHBondContact O-CB 3.27Å; S179-S183 PolarHBondContact O-N 3.34Å; S179-S183 PolarHBondContact O-OG 3.39Å
180I96.3Very high94.2Very high52 Ų5250.5 Ų50.527%0.26727%0.267SS..Hα-helixtrans-60.1-52.7171.9-68.5169000109.8F130 L134 F176 I177 I178 M182 S183 L184F130-I180 HydrophobicContact CE2-CG2 4.39Å; F130-I180 HydrophobicContact CZ-CG2 4.3Å; L134-I180 HydrophobicContact CD1-CB 4.49Å; L134-I180 HydrophobicContact CD1-CG1 3.71Å; L134-I180 HydrophobicContact CD2-CG1 4.36Å; F176-I180 HydrophobicContact CD1-CD1 3.99Å; F176-I180 HydrophobicContact CE1-CD1 3.6Å; F176-I180 HydrophobicContact CE1-CG1 4.42Å; F176-I180 HydrophobicContact CZ-CD1 4.05Å; F176-I180 HydrophobicContact CZ-CG1 4.49Å; F176-I180 WeakPolarHBondContact O-CG1 3.42Å; F176-I180 PolarHBondContact O-N 3.32Å; I177-I180 WeakPolarHBondContact O-CB 3.22Å; I177-I180 PolarHBondContact O-N 3.34Å; I178-I180 VanDerWaalsContact C-N 3.33Å; I178-I180 PolarHBondContact O-N 3.47Å; I180-M182 VanDerWaalsContact C-N 3.29Å; I180-M182 PolarHBondContact O-N 3.28Å; I180-S183 WeakPolarHBondContact CA-OG 3.5Å; I180-S183 PolarHBondContact O-N 3.45Å; I180-S183 PolarHBondContact O-OG 3.25Å; I180-L184 HydrophobicContact CG2-CD1 4.42Å; I180-L184 HydrophobicContact CG2-CG 4.4Å; I180-L184 WeakPolarHBondContact O-CG 3.32Å; I180-L184 PolarHBondContact O-N 2.89Å
181V96.1Very high94.2Very high89 Ų8948.1 Ų48.154%0.53926%0.255SS..Hα-helixtrans-57.7-41.3-179.61750000111.8I177 I178 P185I177-V181 WeakPolarHBondContact O-CG2 3.33Å; I177-V181 PolarHBondContact O-N 3.3Å; I178-V181 PolarHBondContact O-N 2.85Å; V181-P185 WeakPolarHBondContact O-CD 3.45Å
182M93.9Very high93.9Very high36 Ų3647.9 Ų47.918%0.17725%0.254CS..Hα-helixtrans-68.4-31.4176.5-68.7175.870.800113.2I137 I178 S179 I180 Y213 L217I137-M182 HydrophobicContact CD1-CB 3.9Å; I137-M182 HydrophobicContact CG2-CB 4.11Å; I137-M182 HydrophobicContact CG2-CE 4.03Å; I137-M182 HydrophobicContact CG2-SD 3.85Å; I178-M182 HydrophobicContact CG2-CG 4.24Å; I178-M182 HydrophobicContact CG2-SD 3.81Å; I178-M182 VanDerWaalsContact O-CG 3.28Å; I178-M182 WeakPolarHBondContact O-CG 3.35Å; I178-M182 PolarHBondContact O-N 2.99Å; S179-M182 PolarHBondContact O-N 3.25Å; I180-M182 VanDerWaalsContact C-N 3.29Å; I180-M182 PolarHBondContact O-N 3.28Å; M182-Y213 PolarHBondContact O-OH 3.47Å; M182-L217 HydrophobicContact CE-CB 4.17Å; M182-L217 HydrophobicContact CE-CD1 4.07Å; M182-L217 HydrophobicContact CE-CD2 3.93Å; M182-L217 HydrophobicContact CE-CG 4.29Å
183S94.3Very high93.4Very high0 Ų049.2 Ų49.20%026%0.261CS..Hα-helixtrans-78.2-25.7178.968.20000113.7F130 S179 I180 I186 S187F130-S183 WeakPolarHBondContact CD2-OG 3.28Å; F130-S183 WeakPolarHBondContact CE2-OG 3.49Å; S179-S183 WeakPolarHBondContact O-CB 3.27Å; S179-S183 PolarHBondContact O-N 3.34Å; S179-S183 PolarHBondContact O-OG 3.39Å; I180-S183 WeakPolarHBondContact CA-OG 3.5Å; I180-S183 PolarHBondContact O-N 3.45Å; I180-S183 PolarHBondContact O-OG 3.25Å; S183-I186 PolarHBondContact O-N 3.05Å; S183-S187 PolarHBondContact O-N 3Å
184L93.2Very high92.6Very high72 Ų7251.3 Ų51.338%0.37727%0.268SS..Hα-helixtrans-58.3-48.5-175-78.6174000113.9F130 I180 I186 S187 I188F130-L184 HydrophobicContact CD2-CD2 4.49Å; F130-L184 HydrophobicContact CE2-CD2 4.06Å; I180-L184 HydrophobicContact CG2-CD1 4.42Å; I180-L184 HydrophobicContact CG2-CG 4.4Å; I180-L184 WeakPolarHBondContact O-CG 3.32Å; I180-L184 PolarHBondContact O-N 2.89Å; L184-I186 VanDerWaalsContact C-N 3.26Å; L184-I186 PolarHBondContact O-N 2.83Å; L184-S187 PolarHBondContact O-N 2.93Å; L184-S187 VanDerWaalsContact O-N 3.16Å; L184-I188 HydrophobicContact CB-CD1 4.27Å; L184-I188 WeakPolarHBondContact O-CB 3.12Å; L184-I188 VanDerWaalsContact O-CG1 3.27Å; L184-I188 WeakPolarHBondContact O-CG1 3.29Å; L184-I188 PolarHBondContact O-N 3.31Å
185P91.7Very high91.4Very high46 Ų4650.8 Ų50.830%0.29927%0.265SS..Hα-helixtrans-56.7-39.1179.4-26.534.3000113.1V181 Y189V181-P185 WeakPolarHBondContact O-CD 3.45Å; P185-Y189 WeakPolarHBondContact O-CD2 3.37Å; P185-Y189 PolarHBondContact O-N 2.87Å
186I90.8Very high90.1Very high0 Ų055.5 Ų55.50%029%0.294CS..Hα-helixtrans-65.5-45.6-179.9-53.4174.8000109.8V129 S133 S183 L184 S190 Y213 Q214 S218V129-I186 HydrophobicContact CG1-CB 4.47Å; V129-I186 HydrophobicContact CG1-CG2 3.52Å; S133-I186 WeakPolarHBondContact OG-CD1 3.26Å; S183-I186 PolarHBondContact O-N 3.05Å; L184-I186 VanDerWaalsContact C-N 3.26Å; L184-I186 PolarHBondContact O-N 2.83Å; I186-S190 WeakPolarHBondContact O-CB 3.25Å; I186-S190 PolarHBondContact O-N 2.86Å; I186-S190 PolarHBondContact O-OG 3.26Å; I186-Y213 HydrophobicContact CD1-CD1 3.8Å; I186-Y213 HydrophobicContact CD1-CE1 3.7Å; I186-Y213 HydrophobicContact CG1-CD1 3.75Å; I186-Y213 HydrophobicContact CG1-CE1 3.74Å; I186-Q214 HydrophobicContact CD1-CB 4.24Å; I186-Q214 HydrophobicContact CD1-CG 4.25Å; I186-S218 VanDerWaalsContact CD1-OG 3.3Å; I186-S218 WeakPolarHBondContact CD1-OG 3.42Å
187S91.6Very high88.9Confident16 Ų1658.2 Ų58.211%0.11231%0.313CS..Hα-helixtrans-68.3-44.5-179.7-179.10000113K126 S183 L184 Y189 S190K126-S187 PolarHBondContact O-OG 3.4Å; S183-S187 PolarHBondContact O-N 3Å; L184-S187 PolarHBondContact O-N 2.93Å; L184-S187 VanDerWaalsContact O-N 3.16Å; S187-Y189 VanDerWaalsContact C-N 3.3Å; S187-Y189 PolarHBondContact O-N 3.41Å; S187-S190 PolarHBondContact O-N 3.5Å
188I92Very high87.9Confident102 Ų10257.8 Ų57.852%0.52331%0.305SS..Hα-helixtrans-59.8-42.6-177.3-70166.5000111.2L184L184-I188 HydrophobicContact CB-CD1 4.27Å; L184-I188 WeakPolarHBondContact O-CB 3.12Å; L184-I188 VanDerWaalsContact O-CG1 3.27Å; L184-I188 WeakPolarHBondContact O-CG1 3.29Å; L184-I188 PolarHBondContact O-N 3.31Å
189Y91.8Very high87.2Confident91 Ų9155.8 Ų55.836%0.35730%0.295SS..THydrogen-bonded Turntrans-90.60-177.7-66.6-62.9000114.3P185 S187 Q203 K204 F205 L210P185-Y189 WeakPolarHBondContact O-CD2 3.37Å; P185-Y189 PolarHBondContact O-N 2.87Å; S187-Y189 VanDerWaalsContact C-N 3.3Å; S187-Y189 PolarHBondContact O-N 3.41Å; Y189-Q203 WeakPolarHBondContact O-CA 3.34Å; Y189-K204 PolarHBondContact O-N 3.27Å; Y189-F205 HydrophobicContact CD1-CB 4.12Å; Y189-F205 HydrophobicContact CD1-CD2 4.14Å; Y189-L210 VanDerWaalsContact CB-CD1 3.43Å; Y189-L210 HydrophobicContact CD2-CD1 4Å; Y189-L210 HydrophobicContact CG-CD1 3.98Å
190S90.5Very high86.6Confident1 Ų156.5 Ų56.51%0.00730%0.299CS..EExtended strand (participates in β ladder)trans-85.1135.7172-65.80000110.5K126 I186 S187 W202K126-S190 WeakPolarHBondContact CE-O 3.24Å; K126-S190 WeakPolarHBondContact CG-O 3.17Å; I186-S190 WeakPolarHBondContact O-CB 3.25Å; I186-S190 PolarHBondContact O-N 2.86Å; I186-S190 PolarHBondContact O-OG 3.26Å; S187-S190 PolarHBondContact O-N 3.5Å; S190-W202 WeakPolarHBondContact CA-O 3.39Å
191D91.3Very high86.2Confident26 Ų2654.9 Ų54.914%0.13929%0.292CS..EExtended strand (participates in β ladder)trans-149.7168.9177.1-151.7-15.9000109.9T122 I193 W202 K204T122-D191 WeakPolarHBondContact CB-OD1 3.23Å; T122-D191 WeakPolarHBondContact CG2-OD1 3.37Å; T122-D191 PolarHBondContact OG1-OD1 2.83Å; D191-I193 HydrophobicContact CB-CG2 4.49Å; D191-I193 PolarHBondContact O-N 3Å; D191-W202 PolarHBondContact N-O 2.79Å; D191-W202 PolarHBondContact O-N 3.43Å; D191-K204 HydrophobicContact CB-CB 4.16Å; D191-K204 HydrophobicContact CB-CD 4.09Å; D191-K204 IonicContact OD2-NZ 3.32Å
192L87.2Confident85.7Confident43 Ų4353.6 Ų53.623%0.22528%0.277CS..EExtended strand (participates in β ladder)trans-76.4111.8167.2-159.674.7000108L119 N199 I200L119-L192 HydrophobicContact CD2-CD1 3.72Å; L192-N199 HydrophobicContact CD1-CB 4Å; L192-N199 HydrophobicContact CD2-CB 3.98Å; L192-N199 HydrophobicContact CG-CB 3.91Å; L192-I200 WeakPolarHBondContact CA-O 3.47Å
193I85.8Confident85.2Confident38 Ų3852.1 Ų52.120%0.19527%0.27CS..EExtended strand (participates in β ladder)trans-115151.6178.165.7168.2000110.7D191 V195 N199 I200 W202 K204D191-I193 HydrophobicContact CB-CG2 4.49Å; D191-I193 PolarHBondContact O-N 3Å; I193-V195 HydrophobicContact CD1-CG2 3.97Å; I193-V195 HydrophobicContact CG1-CG2 4.16Å; I193-N199 WeakPolarHBondContact O-CA 3.4Å; I193-I200 HydrophobicContact CD1-CG2 4.37Å; I193-I200 HydrophobicContact CG1-CG2 3.73Å; I193-I200 PolarHBondContact N-O 3.46Å; I193-I200 PolarHBondContact O-N 2.96Å; I193-W202 HydrophobicContact CD1-CB 3.74Å; I193-W202 HydrophobicContact CD1-CG 4.23Å; I193-W202 HydrophobicContact CG1-CB 3.91Å; I193-K204 HydrophobicContact CG2-CB 4.05Å; I193-K204 HydrophobicContact CG2-CG 4.17Å
194L79.2Confident84.6Confident119 Ų11957.1 Ų57.162%0.62329%0.292SS*.EExtended strand (participates in β ladder)trans-88.8112.3174.4-80.7145.8000109.7R198L194-R198 CarbonylContact C-O 3.5Å; L194-R198 WeakPolarHBondContact CA-O 3.09Å
195V70.8Confident83.8Confident58 Ų5859 Ų5935%0.35230%0.297SS..EExtended strand (participates in β ladder)trans-113.1125.3169179.10000107.1I193 N197 R198 I200I193-V195 HydrophobicContact CD1-CG2 3.97Å; I193-V195 HydrophobicContact CG1-CG2 4.16Å; V195-N197 PolarHBondContact O-N 2.78Å; V195-N197 VanDerWaalsContact O-N 3.14Å; V195-R198 PolarHBondContact N-O 2.88Å; V195-R198 WeakPolarHBondContact O-CA 3.26Å; V195-R198 WeakPolarHBondContact O-CB 3.48Å; V195-R198 PolarHBondContact O-N 3.5Å; V195-I200 HydrophobicContact CB-CG2 4.16Å; V195-I200 HydrophobicContact CG2-CG2 3.61Å
196T68.5Low83.2Confident118 Ų11864.5 Ų64.572%0.72431%0.313SS*.THydrogen-bonded Turntrans49.141.5-17956.40000114.2R198T196-R198 PolarHBondContact O-N 3.25Å
197N71.1Confident82.4Confident143 Ų14365.8 Ų65.877%0.76532%0.321SS*.THydrogen-bonded Turntrans64.921.9-177.2-152.540.6000114.7V195V195-N197 PolarHBondContact O-N 2.78Å; V195-N197 VanDerWaalsContact O-N 3.14Å
198R77.3Confident81.9Confident86 Ų8669.3 Ų69.333%0.32534%0.338SS..EExtended strand (participates in β ladder)trans-127.4140.6177.9-67173.7179.4-96.8-1.6111.2S7 T8 D9 F10 L194 V195 T196S7-R198 PolarHBondContact OG-NH1 3.23Å; T8-R198 CarbonylContact O-C 3.45Å; T8-R198 VanDerWaalsContact O-CA 3.26Å; T8-R198 WeakPolarHBondContact O-CA 3.46Å; D9-R198 PolarHBondContact O-NH1 3.47Å; F10-R198 HydrophobicContact CB-CB 4.29Å; L194-R198 CarbonylContact C-O 3.5Å; L194-R198 WeakPolarHBondContact CA-O 3.09Å; V195-R198 PolarHBondContact N-O 2.88Å; V195-R198 WeakPolarHBondContact O-CA 3.26Å; V195-R198 WeakPolarHBondContact O-CB 3.48Å; V195-R198 PolarHBondContact O-N 3.5Å; T196-R198 PolarHBondContact O-N 3.25Å
199N81.1Confident81.6Confident35 Ų3571 Ų7119%0.18734%0.342CS..EExtended strand (participates in β ladder)trans-77.9124.3179.4-69.4-28.4000109.6T8 D9 F10 L192 I193T8-N199 WeakPolarHBondContact O-CB 3.1Å; T8-N199 PolarHBondContact O-N 3.49Å; T8-N199 PolarHBondContact O-ND2 2.98Å; D9-N199 PolarHBondContact OD1-ND2 2.76Å; F10-N199 WeakPolarHBondContact CB-O 3.39Å; F10-N199 PolarHBondContact N-O 2.9Å; L192-N199 HydrophobicContact CD1-CB 4Å; L192-N199 HydrophobicContact CD2-CB 3.98Å; L192-N199 HydrophobicContact CG-CB 3.91Å; I193-N199 WeakPolarHBondContact O-CA 3.4Å
200I84.4Confident81.2Confident16 Ų1666.9 Ų66.98%0.08233%0.326CS..EExtended strand (participates in β ladder)trans-128.7139.8170-170.9169.5000109F10 L192 I193 V195 W202F10-I200 HydrophobicContact CB-CB 3.84Å; F10-I200 HydrophobicContact CB-CD1 4.41Å; F10-I200 HydrophobicContact CB-CG1 4.27Å; F10-I200 HydrophobicContact CD1-CD1 3.93Å; F10-I200 HydrophobicContact CD2-CD1 4.38Å; F10-I200 HydrophobicContact CE1-CD1 4.3Å; F10-I200 HydrophobicContact CG-CB 4.25Å; F10-I200 HydrophobicContact CG-CD1 3.98Å; F10-I200 HydrophobicContact CG-CG1 4.38Å; L192-I200 WeakPolarHBondContact CA-O 3.47Å; I193-I200 HydrophobicContact CD1-CG2 4.37Å; I193-I200 HydrophobicContact CG1-CG2 3.73Å; I193-I200 PolarHBondContact N-O 3.46Å; I193-I200 PolarHBondContact O-N 2.96Å; V195-I200 HydrophobicContact CB-CG2 4.16Å; V195-I200 HydrophobicContact CG2-CG2 3.61Å; I200-W202 HydrophobicContact CD1-CE3 4.21Å; I200-W202 HydrophobicContact CG1-CB 4.42Å; I200-W202 HydrophobicContact CG2-CB 3.99Å; I200-W202 PolarHBondContact O-N 3.38Å
201C86.9Confident80.8Confident17 Ų1767.1 Ų67.112%0.11533%0.328CS..EExtended strand (participates in β ladder)trans-77.9105.2167.51760000108.1S118 L119 C125S118-C201 WeakPolarHBondContact O-CB 3.22Å; L119-C201 HydrophobicContact CD2-CB 4.21Å; C125-C201 WeakPolarHBondContact CA-SG 3.29Å; C125-C201 HydrophobicContact CB-CB 3.8Å; C125-C201 WeakPolarHBondContact CB-SG 3.43Å; C125-C201 VanDerWaalsContact SG-CA 3.5Å; C125-C201 WeakPolarHBondContact SG-CB 3.36Å; C125-C201 CovalentContact SG-SG 2.03Å; C125-C201 PolarHBondContact SG-SG 3.33Å
202W85.3Confident80.4Confident62 Ų6269.7 Ų69.724%0.23534%0.34CS..EExtended strand (participates in β ladder)trans-148.7171.4-173.7-160.9-101.2000111.6S190 D191 I193 I200 K204 V211S190-W202 WeakPolarHBondContact CA-O 3.39Å; D191-W202 PolarHBondContact N-O 2.79Å; D191-W202 PolarHBondContact O-N 3.43Å; I193-W202 HydrophobicContact CD1-CB 3.74Å; I193-W202 HydrophobicContact CD1-CG 4.23Å; I193-W202 HydrophobicContact CG1-CB 3.91Å; I200-W202 HydrophobicContact CD1-CE3 4.21Å; I200-W202 HydrophobicContact CG1-CB 4.42Å; I200-W202 HydrophobicContact CG2-CB 3.99Å; I200-W202 PolarHBondContact O-N 3.38Å; W202-K204 PolarHBondContact O-N 2.91Å; W202-V211 HydrophobicContact CZ2-CG2 3.73Å
203Q85.3Confident80.4Confident5 Ų569.8 Ų69.82%0.02334%0.338CS..EExtended strand (participates in β ladder)trans-71.8126176.8-56.781.822.900110.4Y189 T207 L210Y189-Q203 WeakPolarHBondContact O-CA 3.34Å; Q203-T207 VanDerWaalsContact O-CG2 3.31Å; Q203-T207 WeakPolarHBondContact O-CG2 3.38Å; Q203-L210 HydrophobicContact CB-CB 4.42Å; Q203-L210 HydrophobicContact CB-CD1 4.09Å; Q203-L210 HydrophobicContact CG-CB 3.92Å; Q203-L210 HydrophobicContact CG-CD1 4.03Å
204K80.2Confident80.5Confident106 Ų10668.3 Ų68.346%0.46133%0.33SS..SBendtrans-81.7-33.4-178.8-175.8175.1-179.2173.70112.9Y189 D191 I193 W202Y189-K204 PolarHBondContact O-N 3.27Å; D191-K204 HydrophobicContact CB-CB 4.16Å; D191-K204 HydrophobicContact CB-CD 4.09Å; D191-K204 IonicContact OD2-NZ 3.32Å; I193-K204 HydrophobicContact CG2-CB 4.05Å; I193-K204 HydrophobicContact CG2-CG 4.17Å; W202-K204 PolarHBondContact O-N 2.91Å
205F77.1Confident80.6Confident112 Ų11262.7 Ų62.749%0.49130%0.302SS..SBendtrans-128153.9-176.8-61.4-76.4000110.2Y189 T207 L210Y189-F205 HydrophobicContact CD1-CB 4.12Å; Y189-F205 HydrophobicContact CD1-CD2 4.14Å; F205-T207 PolarHBondContact O-N 3.29Å; F205-L210 VanDerWaalsContact O-CD1 3.31Å; F205-L210 WeakPolarHBondContact O-CD1 3.37Å
206Y78Confident81.3Confident161 Ų16162.8 Ų62.863%0.63130%0.3SS*.SBendtrans50.440.7177-53-76000113.6D208 F209 L210Y206-D208 VanDerWaalsContact C-N 3.35Å; Y206-D208 PolarHBondContact O-N 3.03Å; Y206-F209 PolarHBondContact O-N 3.25Å; Y206-L210 WeakPolarHBondContact O-CB 3.32Å; Y206-L210 PolarHBondContact O-N 2.7Å
207T75Confident82Confident26 Ų2658.9 Ų58.916%0.1627%0.274CS..Hα-helixtrans-48-53.2-173.844.70000112.1Q203 F205 F209 L210 V211 H291Q203-T207 VanDerWaalsContact O-CG2 3.31Å; Q203-T207 WeakPolarHBondContact O-CG2 3.38Å; F205-T207 PolarHBondContact O-N 3.29Å; T207-F209 PolarHBondContact O-N 3.26Å; T207-L210 PolarHBondContact O-N 3.15Å; T207-V211 VanDerWaalsContact O-CB 3.31Å; T207-V211 WeakPolarHBondContact O-CB 3.5Å; T207-V211 WeakPolarHBondContact O-CG2 2.95Å; T207-V211 PolarHBondContact O-N 3.43Å; T207-H291 PolarHBondContact OG1-CD2 2.91Å; T207-H291 PolarHBondContact OG1-NE2 3.25Å
208D80.5Confident82.5Confident91 Ų9152.1 Ų52.149%0.48724%0.238SC..Hα-helixtrans-60.1-49-177.6-66.9-21.9000112.4Y206 I212 H291Y206-D208 VanDerWaalsContact C-N 3.35Å; Y206-D208 PolarHBondContact O-N 3.03Å; D208-I212 WeakPolarHBondContact O-CD1 3.24Å; D208-I212 VanDerWaalsContact O-CG1 3.25Å; D208-I212 WeakPolarHBondContact O-CG1 3.39Å; D208-I212 PolarHBondContact O-N 3.4Å; D208-I212 VanDerWaalsContact O-N 3.09Å; D208-H291 IonicContact OD1-CD2 3.38Å; D208-H291 PolarHBondContact OD1-CD2 3.03Å; D208-H291 VanDerWaalsContact OD1-CD2 3.24Å
209F86.4Confident82.7Confident136 Ų13648.3 Ų48.360%0.59622%0.224SC*.Hα-helixtrans-65.1-46.5-179.6174.9-98.2000111.7Y206 T207 I212 Y213Y206-F209 PolarHBondContact O-N 3.25Å; T207-F209 PolarHBondContact O-N 3.26Å; F209-I212 PolarHBondContact O-N 2.84Å; F209-Y213 VanDerWaalsContact O-CB 3.29Å; F209-Y213 WeakPolarHBondContact O-CB 3.46Å; F209-Y213 PolarHBondContact O-N 3.44Å
210L84.1Confident82.7Confident5 Ų547.1 Ų47.13%0.02622%0.218CC..Hα-helixtrans-70.1-33.5-178.2-73.7177.3000112.5Y189 Q203 F205 Y206 T207 Y213 Q214Y189-L210 VanDerWaalsContact CB-CD1 3.43Å; Y189-L210 HydrophobicContact CD2-CD1 4Å; Y189-L210 HydrophobicContact CG-CD1 3.98Å; Q203-L210 HydrophobicContact CB-CB 4.42Å; Q203-L210 HydrophobicContact CB-CD1 4.09Å; Q203-L210 HydrophobicContact CG-CB 3.92Å; Q203-L210 HydrophobicContact CG-CD1 4.03Å; F205-L210 VanDerWaalsContact O-CD1 3.31Å; F205-L210 WeakPolarHBondContact O-CD1 3.37Å; Y206-L210 WeakPolarHBondContact O-CB 3.32Å; Y206-L210 PolarHBondContact O-N 2.7Å; T207-L210 PolarHBondContact O-N 3.15Å; L210-Y213 PolarHBondContact O-N 3.13Å; L210-Q214 WeakPolarHBondContact O-CB 3.22Å; L210-Q214 PolarHBondContact O-N 3.48Å
211V80.9Confident82.5Confident7 Ų746.4 Ų46.44%0.04221%0.214CC..Hα-helixtrans-66.2-43.5174174.60000110W202 T207 Q214 A215 Y284 I288W202-V211 HydrophobicContact CZ2-CG2 3.73Å; T207-V211 VanDerWaalsContact O-CB 3.31Å; T207-V211 WeakPolarHBondContact O-CB 3.5Å; T207-V211 WeakPolarHBondContact O-CG2 2.95Å; T207-V211 PolarHBondContact O-N 3.43Å; V211-Q214 PolarHBondContact O-N 2.85Å; V211-A215 VanDerWaalsContact O-CB 3.26Å; V211-A215 WeakPolarHBondContact O-CB 3.12Å; V211-A215 PolarHBondContact O-N 3.12Å; V211-Y284 HydrophobicContact CG1-CE1 4.27Å; V211-I288 HydrophobicContact CB-CG1 4.48Å; V211-I288 HydrophobicContact CG1-CD1 4.28Å; V211-I288 HydrophobicContact CG1-CG1 3.45Å; V211-I288 VanDerWaalsContact CG1-CG1 3.45Å
212I83.5Confident82.3Confident79 Ų7946.6 Ų46.641%0.40521%0.214SC..Hα-helixtrans-62.6-47.8174.4-67.4166.4000110.4D208 F209 Q214 A215 L216 I288D208-I212 WeakPolarHBondContact O-CD1 3.24Å; D208-I212 VanDerWaalsContact O-CG1 3.25Å; D208-I212 WeakPolarHBondContact O-CG1 3.39Å; D208-I212 PolarHBondContact O-N 3.4Å; D208-I212 VanDerWaalsContact O-N 3.09Å; F209-I212 PolarHBondContact O-N 2.84Å; I212-Q214 VanDerWaalsContact C-N 3.32Å; I212-Q214 PolarHBondContact O-N 3.42Å; I212-A215 WeakPolarHBondContact O-CB 3.41Å; I212-A215 PolarHBondContact O-N 3.02Å; I212-L216 HydrophobicContact CG2-CD1 3.69Å; I212-L216 HydrophobicContact CG2-CG 4.25Å; I212-L216 WeakPolarHBondContact O-CB 3.32Å; I212-L216 VanDerWaalsContact O-CG 3.26Å; I212-L216 WeakPolarHBondContact O-CG 3.48Å; I212-L216 PolarHBondContact O-N 3.38Å; I212-I288 HydrophobicContact CG1-CD1 4.03Å
213Y88Confident82.3Confident45 Ų4545.6 Ų45.618%0.17622%0.215CC..Hα-helixtrans-56.5-47.5176.8179.7-91.4000111.4M182 I186 F209 L210 L216 L217M182-Y213 PolarHBondContact O-OH 3.47Å; I186-Y213 HydrophobicContact CD1-CD1 3.8Å; I186-Y213 HydrophobicContact CD1-CE1 3.7Å; I186-Y213 HydrophobicContact CG1-CD1 3.75Å; I186-Y213 HydrophobicContact CG1-CE1 3.74Å; F209-Y213 VanDerWaalsContact O-CB 3.29Å; F209-Y213 WeakPolarHBondContact O-CB 3.46Å; F209-Y213 PolarHBondContact O-N 3.44Å; L210-Y213 PolarHBondContact O-N 3.13Å; Y213-L216 PolarHBondContact O-N 3.42Å; Y213-L217 HydrophobicContact CD2-CD1 3.66Å; Y213-L217 HydrophobicContact CE1-CD1 4.49Å; Y213-L217 HydrophobicContact CE2-CD1 3.25Å; Y213-L217 HydrophobicContact CG-CD1 4.43Å; Y213-L217 WeakPolarHBondContact O-CB 3.33Å; Y213-L217 PolarHBondContact O-N 3.33Å
214Q86.4Confident82.5Confident7 Ų745.7 Ų45.73%0.03322%0.215CC..Iπ-helixtrans-65.4-43.4179.3-173.7171.89.200111I186 L210 V211 I212 L216 S218 Y219 Y284I186-Q214 HydrophobicContact CD1-CB 4.24Å; I186-Q214 HydrophobicContact CD1-CG 4.25Å; L210-Q214 WeakPolarHBondContact O-CB 3.22Å; L210-Q214 PolarHBondContact O-N 3.48Å; V211-Q214 PolarHBondContact O-N 2.85Å; I212-Q214 VanDerWaalsContact C-N 3.32Å; I212-Q214 PolarHBondContact O-N 3.42Å; Q214-L216 VanDerWaalsContact C-N 3.33Å; Q214-L216 PolarHBondContact O-N 2.97Å; Q214-S218 CarbonylContact O-C 3.54Å; Q214-S218 WeakPolarHBondContact O-CA 3.46Å; Q214-S218 PolarHBondContact O-N 3.4Å; Q214-Y219 WeakPolarHBondContact O-CB 3.33Å; Q214-Y219 PolarHBondContact O-N 2.94Å; Q214-Y284 HydrophobicContact CB-CE1 4.44Å; Q214-Y284 HydrophobicContact CG-CE1 4.39Å; Q214-Y284 WeakPolarHBondContact CG-OH 3.37Å; Q214-Y284 PolarHBondContact OE1-OH 2.92Å
215A81.5Confident82.7Confident2 Ų240.8 Ų40.82%0.01719%0.194CC..Iπ-helixtrans-58.2-45.6176.800000112V211 I212 Y284 L285V211-A215 VanDerWaalsContact O-CB 3.26Å; V211-A215 WeakPolarHBondContact O-CB 3.12Å; V211-A215 PolarHBondContact O-N 3.12Å; I212-A215 WeakPolarHBondContact O-CB 3.41Å; I212-A215 PolarHBondContact O-N 3.02Å; A215-Y284 HydrophobicContact CB-CD1 3.45Å; A215-Y284 VanDerWaalsContact CB-CD1 3.45Å; A215-Y284 HydrophobicContact CB-CE1 3.72Å; A215-L285 HydrophobicContact CB-CD2 3.61Å; A215-L285 HydrophobicContact CB-CG 4.37Å
216L85Confident83.2Confident60 Ų6039.3 Ų39.331%0.31419%0.19SC..Iπ-helixtrans-76.7-43.9-173.9-70.3-179.5000112.8I212 Y213 Q214 G221 L222 T223I212-L216 HydrophobicContact CG2-CD1 3.69Å; I212-L216 HydrophobicContact CG2-CG 4.25Å; I212-L216 WeakPolarHBondContact O-CB 3.32Å; I212-L216 VanDerWaalsContact O-CG 3.26Å; I212-L216 WeakPolarHBondContact O-CG 3.48Å; I212-L216 PolarHBondContact O-N 3.38Å; Y213-L216 PolarHBondContact O-N 3.42Å; Q214-L216 VanDerWaalsContact C-N 3.33Å; Q214-L216 PolarHBondContact O-N 2.97Å; L216-G221 CarbonylContact O-C 3.55Å; L216-L222 HydrophobicContact CD2-CD2 3.94Å; L216-L222 PolarHBondContact O-N 3.07Å; L216-T223 PolarHBondContact O-N 3.47Å; L216-T223 PolarHBondContact O-OG1 3.04Å
217L84.7Confident83.8Confident36 Ų3634.3 Ų34.319%0.18817%0.174CC..Iπ-helixtrans-109.3-29.6-168.6-67.9169000114.3I137 M182 Y213 T223 Q224I137-L217 WeakPolarHBondContact CG1-O 3.24Å; M182-L217 HydrophobicContact CE-CB 4.17Å; M182-L217 HydrophobicContact CE-CD1 4.07Å; M182-L217 HydrophobicContact CE-CD2 3.93Å; M182-L217 HydrophobicContact CE-CG 4.29Å; Y213-L217 HydrophobicContact CD2-CD1 3.66Å; Y213-L217 HydrophobicContact CE1-CD1 4.49Å; Y213-L217 HydrophobicContact CE2-CD1 3.25Å; Y213-L217 HydrophobicContact CG-CD1 4.43Å; Y213-L217 WeakPolarHBondContact O-CB 3.33Å; Y213-L217 PolarHBondContact O-N 3.33Å; L217-T223 HydrophobicContact CD2-CG2 4.07Å; L217-Q224 PolarHBondContact O-NE2 2.94Å
218S81Confident84.4Confident0 Ų033.1 Ų33.10%017%0.167CC..Iπ-helixtrans-119.4-26.3-162.1177.10000115.8S133 C136 I186 Q214S133-S218 WeakPolarHBondContact CA-OG 3.28Å; S133-S218 WeakPolarHBondContact CB-OG 3.29Å; S133-S218 PolarHBondContact OG-OG 3.49Å; C136-S218 WeakPolarHBondContact CB-O 3.25Å; I186-S218 VanDerWaalsContact CD1-OG 3.3Å; I186-S218 WeakPolarHBondContact CD1-OG 3.42Å; Q214-S218 CarbonylContact O-C 3.54Å; Q214-S218 WeakPolarHBondContact O-CA 3.46Å; Q214-S218 PolarHBondContact O-N 3.4Å
219Y81.4Confident84.5Confident7 Ų730.7 Ų30.73%0.02715%0.153CC..Iπ-helixtrans-78.6-55.4-173.3-164.1-109.9000109.8C136 Q214 C280 Y284 L309 W313C136-Y219 PolarHBondContact SG-O 3.38Å; Q214-Y219 WeakPolarHBondContact O-CB 3.33Å; Q214-Y219 PolarHBondContact O-N 2.94Å; Y219-C280 WeakPolarHBondContact CE1-SG 3.19Å; Y219-Y284 HydrophobicContact CD1-CD1 4.29Å; Y219-Y284 AromaticContact CD1-CD2 3.48Å; Y219-Y284 HydrophobicContact CD1-CD2 3.48Å; Y219-Y284 VanDerWaalsContact CD1-CD2 3.48Å; Y219-Y284 HydrophobicContact CD1-CE2 4.14Å; Y219-Y284 AromaticContact CD1-CG 3.56Å; Y219-Y284 HydrophobicContact CD1-CG 3.56Å; Y219-Y284 AromaticContact CD2-CD2 3.71Å; Y219-Y284 HydrophobicContact CD2-CD2 3.71Å; Y219-Y284 AromaticContact CD2-CE2 3.48Å; Y219-Y284 HydrophobicContact CD2-CE2 3.48Å; Y219-Y284 VanDerWaalsContact CD2-CE2 3.48Å; Y219-Y284 HydrophobicContact CD2-CG 4.36Å; Y219-Y284 AromaticContact CD2-CZ 3.98Å; Y219-Y284 AromaticContact CE1-CD2 3.39Å; Y219-Y284 HydrophobicContact CE1-CD2 3.39Å; Y219-Y284 HydrophobicContact CE1-CE2 4.16Å; Y219-Y284 AromaticContact CE1-CG 3.84Å; Y219-Y284 HydrophobicContact CE1-CG 3.84Å; Y219-Y284 AromaticContact CE2-CD2 3.63Å; Y219-Y284 HydrophobicContact CE2-CD2 3.63Å; Y219-Y284 AromaticContact CE2-CE2 3.51Å; Y219-Y284 HydrophobicContact CE2-CE2 3.51Å; Y219-Y284 HydrophobicContact CG-CD1 4.22Å; Y219-Y284 AromaticContact CG-CD2 3.64Å; Y219-Y284 HydrophobicContact CG-CD2 3.64Å; Y219-Y284 HydrophobicContact CG-CE1 4.38Å; Y219-Y284 AromaticContact CG-CE2 3.81Å; Y219-Y284 HydrophobicContact CG-CE2 3.81Å; Y219-Y284 AromaticContact CG-CG 3.85Å; Y219-Y284 HydrophobicContact CG-CG 3.85Å; Y219-Y284 AromaticContact CZ-CD2 3.48Å; Y219-Y284 VanDerWaalsContact CZ-CD2 3.48Å; Y219-Y284 AromaticContact CZ-CE2 3.87Å; Y219-L309 HydrophobicContact CE1-CD2 3.71Å; Y219-W313 HydrophobicContact CD1-CZ2 4.31Å; Y219-W313 HydrophobicContact CE1-CZ2 4.03Å; Y219-W313 AromaticContact CE1-NE1 3.72Å; Y219-W313 HydrophobicContact CE2-CZ2 4.28Å; Y219-W313 AromaticContact CZ-NE1 3.44Å; Y219-W313 VanDerWaalsContact O-CH2 3.22Å; Y219-W313 WeakPolarHBondContact O-CH2 3.47Å; Y219-W313 WeakPolarHBondContact O-CZ2 3.35Å; Y219-W313 PolarHBondContact OH-NE1 3.27Å
220T80Confident84.6Confident10 Ų1029.8 Ų29.86%0.06115%0.152CC..SBendtrans-122.9-7.5173.153.20000112.5F225 C280 V281 I316T220-F225 WeakPolarHBondContact O-CD2 3.16Å; T220-F225 WeakPolarHBondContact O-CE2 3.05Å; T220-C280 HydrophobicContact CG2-CB 3.77Å; T220-V281 HydrophobicContact CG2-CG2 4.13Å; T220-V281 WeakPolarHBondContact OG1-CG2 3.43Å; T220-I316 HydrophobicContact CG2-CD1 4.18Å
221G80.8Confident84.7Confident0 Ų030.5 Ų30.50%016%0.156CC..  trans70.943.9-174.900000113.2L216 T223 Q224 F225L216-G221 CarbonylContact O-C 3.55Å; G221-T223 VanDerWaalsContact C-N 3.31Å; G221-T223 PolarHBondContact O-N 2.92Å; G221-Q224 WeakPolarHBondContact O-CB 3.4Å; G221-Q224 PolarHBondContact O-N 3.34Å; G221-Q224 VanDerWaalsContact O-N 3.13Å; G221-Q224 PolarHBondContact O-OE1 2.97Å; G221-F225 WeakPolarHBondContact O-CD2 3.46Å; G221-F225 PolarHBondContact O-N 3.19Å
222L83.2Confident84.7Confident21 Ų2130.3 Ų30.311%0.1116%0.155CC..Hα-helixtrans-52.5-48.1-179.217964.8000112L216 Q224 F225 L226 F274 V281L216-L222 HydrophobicContact CD2-CD2 3.94Å; L216-L222 PolarHBondContact O-N 3.07Å; L222-Q224 VanDerWaalsContact C-N 3.29Å; L222-Q224 PolarHBondContact O-N 3.27Å; L222-F225 PolarHBondContact O-N 3.13Å; L222-L226 HydrophobicContact CD1-CD1 4.19Å; L222-L226 HydrophobicContact CD1-CG 4.08Å; L222-L226 HydrophobicContact CD2-CD1 4.33Å; L222-L226 HydrophobicContact CG-CD1 3.9Å; L222-L226 HydrophobicContact CG-CG 4.21Å; L222-L226 WeakPolarHBondContact O-CB 3.3Å; L222-L226 WeakPolarHBondContact O-CG 3.39Å; L222-L226 PolarHBondContact O-N 3.35Å; L222-F274 HydrophobicContact CD1-CE2 4.12Å; L222-V281 HydrophobicContact CB-CG1 4.28Å; L222-V281 HydrophobicContact CB-CG2 4.21Å; L222-V281 HydrophobicContact CD1-CG1 3.91Å; L222-V281 HydrophobicContact CD1-CG2 4.02Å; L222-V281 HydrophobicContact CD2-CG1 3.58Å; L222-V281 HydrophobicContact CG-CG1 4.1Å
223T85.5Confident84.6Confident42 Ų4229.8 Ų29.826%0.25816%0.155SC..Hα-helixtrans-59.8-42.9-179.6-61.70000110.8L216 L217 G221 L226 I227L216-T223 PolarHBondContact O-N 3.47Å; L216-T223 PolarHBondContact O-OG1 3.04Å; L217-T223 HydrophobicContact CD2-CG2 4.07Å; G221-T223 VanDerWaalsContact C-N 3.31Å; G221-T223 PolarHBondContact O-N 2.92Å; T223-L226 PolarHBondContact O-N 3.24Å; T223-I227 HydrophobicContact CG2-CD1 3.87Å; T223-I227 VanDerWaalsContact O-CG1 3.25Å; T223-I227 WeakPolarHBondContact O-CG1 3.44Å; T223-I227 PolarHBondContact O-N 2.92Å
224Q89.4Confident84.4Confident6 Ų630.9 Ų30.93%0.02817%0.169CC..Hα-helixtrans-62.5-46176.5-63.489.5-31.900110.8L217 G221 L222 I227 V228L217-Q224 PolarHBondContact O-NE2 2.94Å; G221-Q224 WeakPolarHBondContact O-CB 3.4Å; G221-Q224 PolarHBondContact O-N 3.34Å; G221-Q224 VanDerWaalsContact O-N 3.13Å; G221-Q224 PolarHBondContact O-OE1 2.97Å; L222-Q224 VanDerWaalsContact C-N 3.29Å; L222-Q224 PolarHBondContact O-N 3.27Å; Q224-I227 PolarHBondContact O-N 3.21Å; Q224-V228 WeakPolarHBondContact O-CB 3.25Å; Q224-V228 WeakPolarHBondContact O-CG2 3.48Å; Q224-V228 PolarHBondContact O-N 3.47Å
225F85Confident84Confident4 Ų431 Ų312%0.01817%0.17CC..Hα-helixtrans-64.5-40.5177.4-78.4-61.9000113.4F143 T220 G221 L222 V228 I229 A273 F274 A277F143-F225 AromaticContact CD2-CE1 3.6Å; F143-F225 HydrophobicContact CD2-CE1 3.6Å; F143-F225 AromaticContact CD2-CZ 3.79Å; F143-F225 HydrophobicContact CD2-CZ 3.79Å; F143-F225 AromaticContact CE2-CE1 3.74Å; F143-F225 HydrophobicContact CE2-CE1 3.74Å; F143-F225 AromaticContact CE2-CZ 3.74Å; F143-F225 HydrophobicContact CE2-CZ 3.74Å; F143-F225 HydrophobicContact CG-CE1 4.08Å; F143-F225 HydrophobicContact CZ-CE1 4.32Å; T220-F225 WeakPolarHBondContact O-CD2 3.16Å; T220-F225 WeakPolarHBondContact O-CE2 3.05Å; G221-F225 WeakPolarHBondContact O-CD2 3.46Å; G221-F225 PolarHBondContact O-N 3.19Å; L222-F225 PolarHBondContact O-N 3.13Å; F225-V228 PolarHBondContact O-N 2.82Å; F225-I229 WeakPolarHBondContact O-CG1 3.28Å; F225-I229 PolarHBondContact O-N 3.31Å; F225-A273 HydrophobicContact CE1-CB 3.8Å; F225-A273 HydrophobicContact CZ-CB 4.13Å; F225-F274 HydrophobicContact CB-CD2 3.74Å; F225-F274 HydrophobicContact CB-CE2 4.46Å; F225-F274 HydrophobicContact CD1-CB 4.41Å; F225-F274 HydrophobicContact CG-CD2 4.4Å; F225-A277 HydrophobicContact CD2-CB 4.5Å; F225-A277 HydrophobicContact CE2-CB 4.23Å
226L87.3Confident83.8Confident80 Ų8034.4 Ų34.442%0.41919%0.187SC..Hα-helixtrans-61.7-46.1176.1-73.2175.2000111L222 T223 V228 I229 M230 F274L222-L226 HydrophobicContact CD1-CD1 4.19Å; L222-L226 HydrophobicContact CD1-CG 4.08Å; L222-L226 HydrophobicContact CD2-CD1 4.33Å; L222-L226 HydrophobicContact CG-CD1 3.9Å; L222-L226 HydrophobicContact CG-CG 4.21Å; L222-L226 WeakPolarHBondContact O-CB 3.3Å; L222-L226 WeakPolarHBondContact O-CG 3.39Å; L222-L226 PolarHBondContact O-N 3.35Å; T223-L226 PolarHBondContact O-N 3.24Å; L226-V228 VanDerWaalsContact C-N 3.33Å; L226-V228 PolarHBondContact O-N 2.73Å; L226-I229 PolarHBondContact O-N 2.93Å; L226-M230 WeakPolarHBondContact O-CG 3.43Å; L226-M230 PolarHBondContact O-N 3.32Å; L226-F274 HydrophobicContact CD2-CE2 4.05Å; L226-F274 HydrophobicContact CD2-CZ 4.18Å
227I89.9Confident83.7Confident57 Ų5734.9 Ų34.929%0.29219%0.193SC..Hα-helixtrans-62-43.3176-64.8165.1000110.6L144 T223 Q224 I229 M230 I231L144-I227 HydrophobicContact CD1-CB 3.83Å; L144-I227 HydrophobicContact CD1-CD1 4.41Å; L144-I227 HydrophobicContact CD1-CG2 3.52Å; T223-I227 HydrophobicContact CG2-CD1 3.87Å; T223-I227 VanDerWaalsContact O-CG1 3.25Å; T223-I227 WeakPolarHBondContact O-CG1 3.44Å; T223-I227 PolarHBondContact O-N 2.92Å; Q224-I227 PolarHBondContact O-N 3.21Å; I227-I229 PolarHBondContact O-N 2.88Å; I227-M230 HydrophobicContact CG1-CE 4.16Å; I227-M230 PolarHBondContact O-N 2.93Å; I227-I231 HydrophobicContact CG2-CD1 3.73Å; I227-I231 HydrophobicContact CG2-CG1 4.31Å; I227-I231 VanDerWaalsContact O-CG1 3.29Å; I227-I231 WeakPolarHBondContact O-CG1 3.35Å; I227-I231 PolarHBondContact O-N 3.41Å
228V87.4Confident83.5Confident0 Ų035.6 Ų35.60%020%0.201CC..Hα-helixtrans-59.9-44.5177.2167.60000111.5F143 L144 A147 Q224 F225 L226 I231 D232 H270F143-V228 HydrophobicContact CB-CG2 4.08Å; L144-V228 HydrophobicContact CB-CG2 4.43Å; L144-V228 HydrophobicContact CD1-CG2 4.27Å; A147-V228 HydrophobicContact CB-CG1 4.28Å; A147-V228 HydrophobicContact CB-CG2 4.14Å; Q224-V228 WeakPolarHBondContact O-CB 3.25Å; Q224-V228 WeakPolarHBondContact O-CG2 3.48Å; Q224-V228 PolarHBondContact O-N 3.47Å; F225-V228 PolarHBondContact O-N 2.82Å; L226-V228 VanDerWaalsContact C-N 3.33Å; L226-V228 PolarHBondContact O-N 2.73Å; V228-I231 PolarHBondContact O-N 2.6Å; V228-D232 VanDerWaalsContact O-CB 3.31Å; V228-D232 WeakPolarHBondContact O-CB 3.47Å; V228-D232 VanDerWaalsContact O-CG 3.28Å; V228-D232 PolarHBondContact O-N 3.47Å; V228-H270 HydrophobicContact CG1-CB 3.87Å; V228-H270 WeakPolarHBondContact CG1-ND1 3.26Å
229I83.6Confident83.1Confident40 Ų4036.8 Ų36.821%0.20521%0.208CC..Hα-helixtrans-65.1-42177-72.4170.4000111F225 L226 I227 I231 D232 T233 F274F225-I229 WeakPolarHBondContact O-CG1 3.28Å; F225-I229 PolarHBondContact O-N 3.31Å; L226-I229 PolarHBondContact O-N 2.93Å; I227-I229 PolarHBondContact O-N 2.88Å; I229-I231 VanDerWaalsContact C-N 3.34Å; I229-I231 PolarHBondContact O-N 2.72Å; I229-D232 PolarHBondContact O-N 3Å; I229-T233 HydrophobicContact CG2-CG2 4.04Å; I229-T233 WeakPolarHBondContact O-CB 2.97Å; I229-T233 VanDerWaalsContact O-CG2 3.24Å; I229-T233 WeakPolarHBondContact O-CG2 2.95Å; I229-T233 PolarHBondContact O-N 2.88Å; I229-T233 PolarHBondContact O-OG1 2.99Å; I229-F274 HydrophobicContact CD1-CB 3.62Å; I229-F274 HydrophobicContact CD1-CD1 3.25Å; I229-F274 HydrophobicContact CD1-CD2 3.58Å; I229-F274 HydrophobicContact CD1-CE1 3.63Å; I229-F274 HydrophobicContact CD1-CE2 3.91Å; I229-F274 HydrophobicContact CD1-CG 3.19Å; I229-F274 HydrophobicContact CD1-CZ 3.92Å
230M87.5Confident83Confident118 Ų11839.2 Ų39.258%0.58122%0.223SC*.Hα-helixtrans-60.9-43.7175.7-72.2-166.6-61.300111.7L226 I227 T233 S234L226-M230 WeakPolarHBondContact O-CG 3.43Å; L226-M230 PolarHBondContact O-N 3.32Å; I227-M230 HydrophobicContact CG1-CE 4.16Å; I227-M230 PolarHBondContact O-N 2.93Å; M230-T233 WeakPolarHBondContact CA-OG1 3.19Å; M230-T233 PolarHBondContact O-OG1 3.16Å; M230-T233 VanDerWaalsContact O-OG1 3.05Å; M230-S234 WeakPolarHBondContact O-CB 3.42Å; M230-S234 PolarHBondContact O-N 2.75Å
231I85.7Confident83.1Confident19 Ų1947.1 Ų47.110%0.09725%0.252CS..Hα-helixtrans-63.3-45.6176.2-67.8168000110.4A147 F148 L151 I227 V228 I229 F235A147-I231 HydrophobicContact CB-CB 4.2Å; A147-I231 HydrophobicContact CB-CD1 4.12Å; A147-I231 HydrophobicContact CB-CG2 3.89Å; F148-I231 HydrophobicContact CD1-CD1 4.21Å; F148-I231 HydrophobicContact CD2-CD1 4.22Å; F148-I231 HydrophobicContact CE1-CD1 3.89Å; F148-I231 HydrophobicContact CE2-CD1 3.91Å; F148-I231 HydrophobicContact CG-CD1 4.36Å; F148-I231 HydrophobicContact CZ-CD1 3.73Å; L151-I231 HydrophobicContact CB-CG2 4.37Å; I227-I231 HydrophobicContact CG2-CD1 3.73Å; I227-I231 HydrophobicContact CG2-CG1 4.31Å; I227-I231 VanDerWaalsContact O-CG1 3.29Å; I227-I231 WeakPolarHBondContact O-CG1 3.35Å; I227-I231 PolarHBondContact O-N 3.41Å; V228-I231 PolarHBondContact O-N 2.6Å; I229-I231 VanDerWaalsContact C-N 3.34Å; I229-I231 PolarHBondContact O-N 2.72Å; I231-F235 WeakPolarHBondContact O-CB 3.43Å; I231-F235 PolarHBondContact O-N 2.95Å
232D82Confident82.9Confident4 Ų453.3 Ų53.32%0.02128%0.275CS..Hα-helixtrans-71.4-36.1-175.4-77.3-0.8000113.4R150 V228 I229 F235 L236 L267 H270R150-D232 IonicContact CZ-OD1 3.71Å; R150-D232 VanDerWaalsContact CZ-OD1 3.26Å; R150-D232 IonicContact CZ-OD2 2.73Å; R150-D232 IonicContact NH1-OD1 3.26Å; R150-D232 PolarHBondContact NH1-OD1 3.31Å; R150-D232 IonicContact NH1-OD2 3.68Å; R150-D232 PolarHBondContact NH1-OD2 3.04Å; R150-D232 IonicContact NH2-OD1 3.72Å; R150-D232 PolarHBondContact NH2-OD1 2.72Å; R150-D232 IonicContact NH2-OD2 3.36Å; R150-D232 PolarHBondContact NH2-OD2 3.45Å; V228-D232 VanDerWaalsContact O-CB 3.31Å; V228-D232 WeakPolarHBondContact O-CB 3.47Å; V228-D232 VanDerWaalsContact O-CG 3.28Å; V228-D232 PolarHBondContact O-N 3.47Å; I229-D232 PolarHBondContact O-N 3Å; D232-F235 WeakPolarHBondContact O-CB 3.4Å; D232-F235 PolarHBondContact O-N 2.92Å; D232-L236 WeakPolarHBondContact O-CB 3.38Å; D232-L236 PolarHBondContact O-N 3.31Å; D232-L267 HydrophobicContact CB-CD1 3.72Å; D232-H270 IonicContact OD2-CE1 3.4Å; D232-H270 IonicContact OD2-CG 2.61Å; D232-H270 IonicContact OD2-ND1 3Å; D232-H270 PolarHBondContact OD2-ND1 3.27Å
233T81Confident82.3Confident67 Ų6754.4 Ų54.441%0.41129%0.285SS..Hα-helixtrans-69.8-46.517451.80000111.1I229 M230 F235 L236 V237I229-T233 HydrophobicContact CG2-CG2 4.04Å; I229-T233 WeakPolarHBondContact O-CB 2.97Å; I229-T233 VanDerWaalsContact O-CG2 3.24Å; I229-T233 WeakPolarHBondContact O-CG2 2.95Å; I229-T233 PolarHBondContact O-N 2.88Å; I229-T233 PolarHBondContact O-OG1 2.99Å; M230-T233 WeakPolarHBondContact CA-OG1 3.19Å; M230-T233 PolarHBondContact O-OG1 3.16Å; M230-T233 VanDerWaalsContact O-OG1 3.05Å; T233-F235 PolarHBondContact O-N 3.39Å; T233-L236 PolarHBondContact O-N 3Å; T233-V237 WeakPolarHBondContact O-CG2 3.17Å; T233-V237 PolarHBondContact O-N 3.5Å
234S83.9Confident82Confident68 Ų6862.4 Ų62.448%0.47631%0.31SS..Hα-helixtrans-56-41.6172.5178.80000111.5M230 S238M230-S234 WeakPolarHBondContact O-CB 3.42Å; M230-S234 PolarHBondContact O-N 2.75Å; S234-S238 WeakPolarHBondContact O-CB 3.44Å; S234-S238 PolarHBondContact O-N 2.63Å; S234-S238 PolarHBondContact O-OG 3.35Å
235F77.3Confident81.4Confident10 Ų1066.9 Ų66.94%0.04434%0.342CS..Hα-helixtrans-63.6-49175.1-178.6-95000112.5I154 I231 D232 T233 V237 S238 V239 T263I154-F235 HydrophobicContact CB-CE2 4.01Å; I154-F235 HydrophobicContact CD1-CD2 4.26Å; I154-F235 HydrophobicContact CD1-CE1 4.21Å; I154-F235 HydrophobicContact CD1-CE2 3.13Å; I154-F235 HydrophobicContact CD1-CZ 3.1Å; I154-F235 HydrophobicContact CG1-CE2 4.11Å; I154-F235 HydrophobicContact CG1-CZ 4.39Å; I154-F235 HydrophobicContact CG2-CE2 3.86Å; I154-F235 HydrophobicContact CG2-CZ 4.47Å; I231-F235 WeakPolarHBondContact O-CB 3.43Å; I231-F235 PolarHBondContact O-N 2.95Å; D232-F235 WeakPolarHBondContact O-CB 3.4Å; D232-F235 PolarHBondContact O-N 2.92Å; T233-F235 PolarHBondContact O-N 3.39Å; F235-V237 VanDerWaalsContact C-N 3.32Å; F235-V237 PolarHBondContact O-N 3.05Å; F235-S238 WeakPolarHBondContact O-CB 3.48Å; F235-S238 PolarHBondContact O-N 2.9Å; F235-S238 VanDerWaalsContact O-N 3.15Å; F235-V239 HydrophobicContact CD1-CG2 4.12Å; F235-V239 HydrophobicContact CE1-CB 4.46Å; F235-V239 HydrophobicContact CE1-CG2 3.32Å; F235-V239 HydrophobicContact CE2-CG2 3.81Å; F235-V239 HydrophobicContact CZ-CG2 3.13Å; F235-V239 PolarHBondContact O-N 3.16Å; F235-T263 HydrophobicContact CD1-CG2 3.34Å; F235-T263 HydrophobicContact CE1-CG2 3.11Å; F235-T263 WeakPolarHBondContact CE1-OG1 3.38Å; F235-T263 HydrophobicContact CZ-CG2 4.29Å
236L79.1Confident80.7Confident73 Ų7374.8 Ų74.838%0.38237%0.372SS..Hα-helixtrans-57.7-45.7178.5-175.373.3000111.2D232 T233 S238 V239 V240 L267D232-L236 WeakPolarHBondContact O-CB 3.38Å; D232-L236 PolarHBondContact O-N 3.31Å; T233-L236 PolarHBondContact O-N 3Å; L236-S238 VanDerWaalsContact C-N 3.33Å; L236-S238 PolarHBondContact O-N 3.38Å; L236-V239 PolarHBondContact O-N 2.81Å; L236-V240 VanDerWaalsContact O-CG2 3.29Å; L236-V240 WeakPolarHBondContact O-CG2 3.33Å; L236-V240 PolarHBondContact O-N 3.3Å; L236-L267 HydrophobicContact CD1-CD2 4.2Å; L236-L267 HydrophobicContact CD2-CD2 4.2Å
237V82.6Confident79.3Confident70 Ų7076.9 Ų76.942%0.42439%0.39SS..Hα-helixtrans-60.2-44.6176.8171.90000110.8T233 F235 V239 V240 R241T233-V237 WeakPolarHBondContact O-CG2 3.17Å; T233-V237 PolarHBondContact O-N 3.5Å; F235-V237 VanDerWaalsContact C-N 3.32Å; F235-V237 PolarHBondContact O-N 3.05Å; V237-V239 PolarHBondContact O-N 3.21Å; V237-V240 PolarHBondContact O-N 2.8Å; V237-R241 HydrophobicContact CG1-CG 4.42Å; V237-R241 WeakPolarHBondContact O-CB 3.33Å; V237-R241 WeakPolarHBondContact O-CG 3.08Å; V237-R241 PolarHBondContact O-N 3.07Å
238S79.1Confident77.7Confident51 Ų5179.2 Ų79.236%0.35740%0.4SS..Hα-helixtrans-62.5-42.3178.8-600000112S234 F235 L236 W242S234-S238 WeakPolarHBondContact O-CB 3.44Å; S234-S238 PolarHBondContact O-N 2.63Å; S234-S238 PolarHBondContact O-OG 3.35Å; F235-S238 WeakPolarHBondContact O-CB 3.48Å; F235-S238 PolarHBondContact O-N 2.9Å; F235-S238 VanDerWaalsContact O-N 3.15Å; L236-S238 VanDerWaalsContact C-N 3.33Å; L236-S238 PolarHBondContact O-N 3.38Å; S238-W242 VanDerWaalsContact O-CB 3.22Å; S238-W242 WeakPolarHBondContact O-CB 3.48Å; S238-W242 PolarHBondContact O-N 3.16Å
239V74.3Confident76.1Confident26 Ų2683.1 Ų83.116%0.15843%0.425CS..Hα-helixtrans-65.9-44.1175.7170.80000111.9F235 L236 V237 W242 S243F235-V239 HydrophobicContact CD1-CG2 4.12Å; F235-V239 HydrophobicContact CE1-CB 4.46Å; F235-V239 HydrophobicContact CE1-CG2 3.32Å; F235-V239 HydrophobicContact CE2-CG2 3.81Å; F235-V239 HydrophobicContact CZ-CG2 3.13Å; F235-V239 PolarHBondContact O-N 3.16Å; L236-V239 PolarHBondContact O-N 2.81Å; V237-V239 PolarHBondContact O-N 3.21Å; V239-W242 PolarHBondContact O-N 3.19Å; V239-S243 VanDerWaalsContact O-CB 3.26Å; V239-S243 WeakPolarHBondContact O-CB 3.39Å; V239-S243 PolarHBondContact O-N 3.35Å; V239-S243 PolarHBondContact O-OG 3.36Å
240V79.3Confident74.7Confident57 Ų5788.7 Ų88.735%0.34545%0.452SS..Hα-helixtrans-62.3-47.6178.4170.50000110.2L236 V237 S243 R244L236-V240 VanDerWaalsContact O-CG2 3.29Å; L236-V240 WeakPolarHBondContact O-CG2 3.33Å; L236-V240 PolarHBondContact O-N 3.3Å; V237-V240 PolarHBondContact O-N 2.8Å; V240-S243 PolarHBondContact O-N 2.79Å; V240-S243 PolarHBondContact O-OG 2.73Å; V240-R244 WeakPolarHBondContact O-CG 3.4Å; V240-R244 PolarHBondContact O-N 3.5Å; V240-R244 VanDerWaalsContact O-N 3.09Å
241R82.3Confident73.1Confident176 Ų17690.4 Ų90.466%0.66446%0.464SS*.Hα-helixtrans-59-51.5175.9-74.5-179.7179178.80.4111.5V237 S243 R244 S245V237-R241 HydrophobicContact CG1-CG 4.42Å; V237-R241 WeakPolarHBondContact O-CB 3.33Å; V237-R241 WeakPolarHBondContact O-CG 3.08Å; V237-R241 PolarHBondContact O-N 3.07Å; R241-S243 PolarHBondContact O-N 2.98Å; R241-R244 PolarHBondContact O-N 3.48Å; R241-R244 VanDerWaalsContact O-N 3.09Å; R241-S245 PolarHBondContact O-N 2.84Å; R241-S245 VanDerWaalsContact O-N 3.08Å; R241-S245 PolarHBondContact O-OG 2.99Å
242W74.6Confident71.5Confident130 Ų13092.1 Ų92.149%0.49248%0.475SS..Hα-helixtrans-58.2-36.6177.5-178.279.2000112.5S238 V239 K256S238-W242 VanDerWaalsContact O-CB 3.22Å; S238-W242 WeakPolarHBondContact O-CB 3.48Å; S238-W242 PolarHBondContact O-N 3.16Å; V239-W242 PolarHBondContact O-N 3.19Å; W242-K256 HydrophobicContact CH2-CD 4.38Å; W242-K256 HydrophobicContact CZ3-CD 3.84Å; W242-K256 HydrophobicContact CZ3-CG 4.14Å
243S71.6Confident69.9Low44 Ų4496.5 Ų96.531%0.30850%0.496SS..Hα-helixtrans-69-31.9178.180.30000113.7V239 V240 R241V239-S243 VanDerWaalsContact O-CB 3.26Å; V239-S243 WeakPolarHBondContact O-CB 3.39Å; V239-S243 PolarHBondContact O-N 3.35Å; V239-S243 PolarHBondContact O-OG 3.36Å; V240-S243 PolarHBondContact O-N 2.79Å; V240-S243 PolarHBondContact O-OG 2.73Å; R241-S243 PolarHBondContact O-N 2.98Å
244R80Confident68.4Low211 Ų21198.3 Ų98.380%0.79651%0.507SS*.Hα-helixtrans-79.3-31.3178.6-72-179.7179.4-177.3-0.1112.2V240 R241V240-R244 WeakPolarHBondContact O-CG 3.4Å; V240-R244 PolarHBondContact O-N 3.5Å; V240-R244 VanDerWaalsContact O-N 3.09Å; R241-R244 PolarHBondContact O-N 3.48Å; R241-R244 VanDerWaalsContact O-N 3.09Å
245S76.2Confident66.8Low100 Ų10098.5 Ų98.570%0.69951%0.508SS*.SBendtrans-84.3-4.6-173.3-58.90000115.8R241R241-S245 PolarHBondContact O-N 2.84Å; R241-S245 VanDerWaalsContact O-N 3.08Å; R241-S245 PolarHBondContact O-OG 2.99Å
246R69.6Low65.6Low169 Ų16999.2 Ų99.264%0.63851%0.512SS*.SBendtrans-125.2124.6178.8-92.1-170.1178.1-155.4-0112.9
247P58Low64.4Low124 Ų124103 Ų10381%0.80553%0.529SS*.PPolyproline II helixtrans-59.4133159.6-17.630.5000109.8P249P247-P249 WeakPolarHBondContact O-CD 3.3Å
248Q56.3Low63.2Low106 Ų106104.4 Ų104.450%0.49554%0.538SS..PPolyproline II helixtrans-84126.2-172.1-69.4-178.6700112.4
249P54.8Low62.3Low82 Ų82104.4 Ų104.453%0.53254%0.538SS..PPolyproline II helixtrans-81.613915427.5-27.8000111.1P247 D251 T252P247-P249 WeakPolarHBondContact O-CD 3.3Å; P249-D251 VanDerWaalsContact C-N 3.3Å; P249-D251 PolarHBondContact O-N 3.37Å; P249-D251 VanDerWaalsContact O-N 3.14Å; P249-T252 HydrophobicContact CG-CG2 4.17Å; P249-T252 PolarHBondContact O-N 3.26Å; P249-T252 PolarHBondContact O-OG1 2.99Å
250M54.1Low61.7Low157 Ų157105.5 Ų105.577%0.77354%0.543SS*.THydrogen-bonded Turntrans-48.4-41-172.7-94.3170.974.800114.4T252 Q253M250-T252 VanDerWaalsContact C-N 3.26Å; M250-T252 PolarHBondContact O-N 3.3Å; M250-Q253 WeakPolarHBondContact O-CB 3.47Å; M250-Q253 PolarHBondContact O-N 2.89Å; M250-Q253 VanDerWaalsContact O-N 3.16Å
251D52.5Low61.2Low154 Ų154104.1 Ų104.182%0.82454%0.54SS*.THydrogen-bonded Turntrans-69.9-18.2-176.1-71.5-29.1000114.6P249 Q253P249-D251 VanDerWaalsContact C-N 3.3Å; P249-D251 PolarHBondContact O-N 3.37Å; P249-D251 VanDerWaalsContact O-N 3.14Å; D251-Q253 VanDerWaalsContact C-N 3.34Å
252T53.6Low60.6Low55 Ų5599.8 Ų99.834%0.33752%0.524SS..Hα-helixtrans-82.1-11.3175.956.70000113.4P249 M250 S255 K256P249-T252 HydrophobicContact CG-CG2 4.17Å; P249-T252 PolarHBondContact O-N 3.26Å; P249-T252 PolarHBondContact O-OG1 2.99Å; M250-T252 VanDerWaalsContact C-N 3.26Å; M250-T252 PolarHBondContact O-N 3.3Å; T252-S255 PolarHBondContact O-OG 3.5Å; T252-K256 WeakPolarHBondContact O-CB 3.39Å; T252-K256 PolarHBondContact O-N 3.44Å; T252-K256 VanDerWaalsContact O-N 3.09Å
253Q47.8Very low60.3Low96 Ų9694.2 Ų94.245%0.44950%0.504SS..Hα-helixtrans-66.7-41.9-176.7-71.2-175.3-19.900112.4M250 D251 K256 M257M250-Q253 WeakPolarHBondContact O-CB 3.47Å; M250-Q253 PolarHBondContact O-N 2.89Å; M250-Q253 VanDerWaalsContact O-N 3.16Å; D251-Q253 VanDerWaalsContact C-N 3.34Å; Q253-K256 PolarHBondContact O-N 2.91Å; Q253-M257 VanDerWaalsContact O-CB 3.25Å; Q253-M257 WeakPolarHBondContact O-CB 3.35Å; Q253-M257 PolarHBondContact O-N 2.84Å
254T49Very low60.5Low105 Ų10595.9 Ų95.964%0.64451%0.509SS*.Hα-helixtrans-71.3-41.6-175-33.80000112.6T258T254-T258 WeakPolarHBondContact O-CG2 3.09Å; T254-T258 PolarHBondContact O-N 3.26Å; T254-T258 PolarHBondContact O-OG1 3.43Å
255S50.9Low60.4Low73 Ų7386.4 Ų86.451%0.5148%0.475SS..Hα-helixtrans-69.8-36.9175.562.70000111.9T252 T258 S259T252-S255 PolarHBondContact O-OG 3.5Å; S255-T258 PolarHBondContact O-OG1 3.34Å; S255-S259 WeakPolarHBondContact O-CB 3.45Å; S255-S259 PolarHBondContact O-N 2.96Å; S255-S259 VanDerWaalsContact O-N 3.13Å
256K52.4Low60.6Low25 Ų2582 Ų8211%0.10944%0.443CS..Hα-helixtrans-66.3-45.2174.2-172.8174-179.8-1790112W242 T252 Q253 T258 S259 N260W242-K256 HydrophobicContact CH2-CD 4.38Å; W242-K256 HydrophobicContact CZ3-CD 3.84Å; W242-K256 HydrophobicContact CZ3-CG 4.14Å; T252-K256 WeakPolarHBondContact O-CB 3.39Å; T252-K256 PolarHBondContact O-N 3.44Å; T252-K256 VanDerWaalsContact O-N 3.09Å; Q253-K256 PolarHBondContact O-N 2.91Å; K256-T258 PolarHBondContact O-N 3.37Å; K256-S259 PolarHBondContact O-N 3.29Å; K256-N260 VanDerWaalsContact O-CB 3.26Å; K256-N260 WeakPolarHBondContact O-CB 3.47Å; K256-N260 PolarHBondContact O-N 3.24Å; K256-N260 PolarHBondContact O-OD1 2.87Å
257M53.1Low61.2Low153 Ų15375.6 Ų75.675%0.75442%0.421SS*.Hα-helixtrans-64.2-39.8-179.4-171169177.300112.3Q253 G261Q253-M257 VanDerWaalsContact O-CB 3.25Å; Q253-M257 WeakPolarHBondContact O-CB 3.35Å; Q253-M257 PolarHBondContact O-N 2.84Å; M257-G261 PolarHBondContact O-N 2.99Å
258T57.5Low62.4Low98 Ų9871.5 Ų71.560%0.60140%0.398SS*.Hα-helixtrans-70.2-41.1177.250.80000113T254 S255 K256 R262T254-T258 WeakPolarHBondContact O-CG2 3.09Å; T254-T258 PolarHBondContact O-N 3.26Å; T254-T258 PolarHBondContact O-OG1 3.43Å; S255-T258 PolarHBondContact O-OG1 3.34Å; K256-T258 PolarHBondContact O-N 3.37Å; T258-R262 PolarHBondContact O-N 2.66Å
259S59.4Low63.9Low52 Ų5266.5 Ų66.536%0.36438%0.375SS..Hα-helixtrans-64.1-44.1173.8-173.80000112.2S255 K256 R262 T263S255-S259 WeakPolarHBondContact O-CB 3.45Å; S255-S259 PolarHBondContact O-N 2.96Å; S255-S259 VanDerWaalsContact O-N 3.13Å; K256-S259 PolarHBondContact O-N 3.29Å; S259-R262 PolarHBondContact O-N 3.46Å; S259-T263 PolarHBondContact O-N 3.5Å; S259-T263 PolarHBondContact O-OG1 3.26Å
260N62.9Low65.4Low49 Ų4962.7 Ų62.726%0.26235%0.349SS..Hα-helixtrans-62.1-45.5176.8-72.1-1.2000111.3K256 R262 T263 I264K256-N260 VanDerWaalsContact O-CB 3.26Å; K256-N260 WeakPolarHBondContact O-CB 3.47Å; K256-N260 PolarHBondContact O-N 3.24Å; K256-N260 PolarHBondContact O-OD1 2.87Å; N260-R262 PolarHBondContact O-N 3Å; N260-T263 PolarHBondContact O-N 3.18Å; N260-I264 VanDerWaalsContact O-CG1 3.25Å; N260-I264 WeakPolarHBondContact O-CG1 3.39Å; N260-I264 PolarHBondContact O-N 3.02Å
261G67.9Low67Low28 Ų2857.8 Ų57.829%0.28933%0.329SS..Hα-helixtrans-60.7-41.9178.800000113.4M257 T265M257-G261 PolarHBondContact O-N 2.99Å; G261-T265 WeakPolarHBondContact O-CB 3.35Å; G261-T265 PolarHBondContact O-N 3.02Å; G261-T265 VanDerWaalsContact O-N 3.07Å; G261-T265 PolarHBondContact O-OG1 3.17Å
262R69.5Low68.7Low85 Ų8554 Ų5432%0.32131%0.305SS..Hα-helixtrans-64.5-40.6175.4-179.1174.4167.2172.1-5.2111.9N74 Q76 T258 S259 N260 M266N74-R262 PolarHBondContact ND2-NH1 3.49Å; N74-R262 PolarHBondContact OD1-NH2 3.02Å; Q76-R262 VanDerWaalsContact OE1-CZ 3.28Å; T258-R262 PolarHBondContact O-N 2.66Å; S259-R262 PolarHBondContact O-N 3.46Å; N260-R262 PolarHBondContact O-N 3Å; R262-M266 PolarHBondContact O-N 3.49Å
263T69.7Low70.3Confident13 Ų1351.4 Ų51.48%0.0829%0.289CS..Hα-helixtrans-64-51.6176.2-560000111.3F235 S259 N260 T265 M266 L267F235-T263 HydrophobicContact CD1-CG2 3.34Å; F235-T263 HydrophobicContact CE1-CG2 3.11Å; F235-T263 WeakPolarHBondContact CE1-OG1 3.38Å; F235-T263 HydrophobicContact CZ-CG2 4.29Å; S259-T263 PolarHBondContact O-N 3.5Å; S259-T263 PolarHBondContact O-OG1 3.26Å; N260-T263 PolarHBondContact O-N 3.18Å; T263-T265 PolarHBondContact O-N 3.33Å; T263-M266 PolarHBondContact O-N 3.02Å; T263-M266 VanDerWaalsContact O-N 3.11Å; T263-L267 WeakPolarHBondContact O-CB 3.2Å; T263-L267 PolarHBondContact O-N 3.04Å
264I75.1Confident72.2Confident79 Ų7948.5 Ų48.541%0.40528%0.275SS..Hα-helixtrans-57.9-38.6-178.2-68.2164.1000110.3N260 A268N260-I264 VanDerWaalsContact O-CG1 3.25Å; N260-I264 WeakPolarHBondContact O-CG1 3.39Å; N260-I264 PolarHBondContact O-N 3.02Å; I264-A268 VanDerWaalsContact O-CB 3.24Å; I264-A268 WeakPolarHBondContact O-CB 3.34Å; I264-A268 PolarHBondContact O-N 3.26Å
265T78Confident74.2Confident12 Ų1248.2 Ų48.27%0.07427%0.269CS..Hα-helixtrans-62-47177-56.80000112.1G261 T263 A268 L269 L326 R330G261-T265 WeakPolarHBondContact O-CB 3.35Å; G261-T265 PolarHBondContact O-N 3.02Å; G261-T265 VanDerWaalsContact O-N 3.07Å; G261-T265 PolarHBondContact O-OG1 3.17Å; T263-T265 PolarHBondContact O-N 3.33Å; T265-A268 PolarHBondContact O-N 3.16Å; T265-L269 WeakPolarHBondContact O-CB 3.35Å; T265-L269 PolarHBondContact O-N 2.99Å; T265-L326 HydrophobicContact CG2-CD2 3.56Å; T265-R330 HydrophobicContact CG2-CB 3.59Å; T265-R330 HydrophobicContact CG2-CG 3.83Å; T265-R330 WeakPolarHBondContact OG1-CB 3.45Å; T265-R330 WeakPolarHBondContact OG1-CG 3.44Å
266M81.4Confident76Confident7 Ų745.3 Ų45.33%0.03425%0.249CC..Hα-helixtrans-70.5-40.4179.2-71.3-65.7-163.800112.1Q76 L80 M146 R262 T263 A268 L269 H270Q76-M266 HydrophobicContact CB-CE 4.23Å; Q76-M266 HydrophobicContact CG-CE 4.23Å; L80-M266 HydrophobicContact CD1-CE 3.82Å; L80-M266 HydrophobicContact CD2-CE 3.81Å; L80-M266 HydrophobicContact CD2-SD 4.1Å; L80-M266 HydrophobicContact CG-CE 3.83Å; M146-M266 HydrophobicContact SD-CE 4.16Å; M146-M266 HydrophobicContact SD-SD 4.41Å; R262-M266 PolarHBondContact O-N 3.49Å; T263-M266 PolarHBondContact O-N 3.02Å; T263-M266 VanDerWaalsContact O-N 3.11Å; M266-A268 VanDerWaalsContact C-N 3.34Å; M266-A268 PolarHBondContact O-N 3.42Å; M266-L269 WeakPolarHBondContact O-CB 3.33Å; M266-L269 PolarHBondContact O-N 3.4Å; M266-L269 HydrophobicContact SD-CD2 4.2Å; M266-H270 WeakPolarHBondContact O-CB 3.5Å; M266-H270 PolarHBondContact O-CD2 3.45Å; M266-H270 VanDerWaalsContact O-CD2 3.27Å; M266-H270 PolarHBondContact O-N 3.42Å
267L81.6Confident77.7Confident34 Ų3444.2 Ų44.218%0.17824%0.244CC..Hα-helixtrans-59.1-47.1173.1173.766.3000110.4D232 L236 T263 L269 H270 T271D232-L267 HydrophobicContact CB-CD1 3.72Å; L236-L267 HydrophobicContact CD1-CD2 4.2Å; L236-L267 HydrophobicContact CD2-CD2 4.2Å; T263-L267 WeakPolarHBondContact O-CB 3.2Å; T263-L267 PolarHBondContact O-N 3.04Å; L267-L269 VanDerWaalsContact C-N 3.33Å; L267-L269 PolarHBondContact O-N 3.34Å; L267-H270 PolarHBondContact O-N 2.9Å; L267-T271 WeakPolarHBondContact O-CB 2.97Å; L267-T271 PolarHBondContact O-N 2.98Å; L267-T271 PolarHBondContact O-OG1 2.82Å
268A83.7Confident79.3Confident39 Ų3939.4 Ų39.432%0.32222%0.221SC..Hα-helixtrans-60-43.4176.700000111.9I264 T265 M266 F272 L326I264-A268 VanDerWaalsContact O-CB 3.24Å; I264-A268 WeakPolarHBondContact O-CB 3.34Å; I264-A268 PolarHBondContact O-N 3.26Å; T265-A268 PolarHBondContact O-N 3.16Å; M266-A268 VanDerWaalsContact C-N 3.34Å; M266-A268 PolarHBondContact O-N 3.42Å; A268-F272 WeakPolarHBondContact O-CB 3.36Å; A268-F272 PolarHBondContact O-N 2.94Å; A268-L326 HydrophobicContact CB-CD1 4.44Å
269L87Confident80.7Confident1 Ų136.3 Ų36.31%0.00520%0.203CC..Hα-helixtrans-58.6-47.6175.1-175.177.8000111.3L80 L83 F143 T265 M266 L267 F272 A273 N323 L326 Y327L80-L269 HydrophobicContact CD2-CD2 3.96Å; L83-L269 HydrophobicContact CD2-CD2 4.38Å; F143-L269 HydrophobicContact CE1-CD2 4.13Å; F143-L269 HydrophobicContact CE1-CG 4.37Å; T265-L269 WeakPolarHBondContact O-CB 3.35Å; T265-L269 PolarHBondContact O-N 2.99Å; M266-L269 WeakPolarHBondContact O-CB 3.33Å; M266-L269 PolarHBondContact O-N 3.4Å; M266-L269 HydrophobicContact SD-CD2 4.2Å; L267-L269 VanDerWaalsContact C-N 3.33Å; L267-L269 PolarHBondContact O-N 3.34Å; L269-F272 PolarHBondContact O-N 3Å; L269-A273 VanDerWaalsContact O-CB 3.29Å; L269-A273 WeakPolarHBondContact O-CB 3.48Å; L269-A273 PolarHBondContact O-N 2.03Å; L269-N323 HydrophobicContact CD1-CB 4.42Å; L269-N323 WeakPolarHBondContact CD1-OD1 3.42Å; L269-L326 HydrophobicContact CD1-CD2 4.34Å; L269-Y327 HydrophobicContact CD1-CE1 4.25Å
270H86.8Confident82Confident1 Ų133.8 Ų33.81%0.00519%0.185CC..Hα-helixtrans-71.1-43.3-176.1-64.5176.7000112.3F143 R150 V228 D232 M266 L267 F272 A273 F274F143-H270 AromaticContact CD1-CD2 3.37Å; F143-H270 WeakPolarHBondContact CD1-CD2 3.5Å; F143-H270 AromaticContact CD1-NE2 3.44Å; F143-H270 WeakPolarHBondContact CD1-NE2 3.05Å; F143-H270 AromaticContact CE1-CD2 3.57Å; F143-H270 AromaticContact CE1-NE2 3.95Å; R150-H270 PolarHBondContact NH2-CE1 3.4Å; R150-H270 PolarHBondContact NH2-ND1 3.3Å; R150-H270 VanDerWaalsContact NH2-ND1 3.14Å; V228-H270 HydrophobicContact CG1-CB 3.87Å; V228-H270 WeakPolarHBondContact CG1-ND1 3.26Å; D232-H270 IonicContact OD2-CE1 3.4Å; D232-H270 IonicContact OD2-CG 2.61Å; D232-H270 IonicContact OD2-ND1 3Å; D232-H270 PolarHBondContact OD2-ND1 3.27Å; M266-H270 WeakPolarHBondContact O-CB 3.5Å; M266-H270 PolarHBondContact O-CD2 3.45Å; M266-H270 VanDerWaalsContact O-CD2 3.27Å; M266-H270 PolarHBondContact O-N 3.42Å; L267-H270 PolarHBondContact O-N 2.9Å; H270-F272 VanDerWaalsContact C-N 3.35Å; H270-A273 PolarHBondContact O-N 2.86Å; H270-F274 WeakPolarHBondContact O-CB 3.16Å; H270-F274 PolarHBondContact O-N 2.88Å
271T86.5Confident83Confident55 Ų5531.9 Ų31.934%0.33718%0.175SC..Hα-helixtrans-62.1-44.3174.6-57.80000110.6L267 F274 L275L267-T271 WeakPolarHBondContact O-CB 2.97Å; L267-T271 PolarHBondContact O-N 2.98Å; L267-T271 PolarHBondContact O-OG1 2.82Å; T271-F274 PolarHBondContact O-N 2.77Å; T271-L275 HydrophobicContact CG2-CD1 4.03Å; T271-L275 HydrophobicContact CG2-CG 4.39Å; T271-L275 WeakPolarHBondContact O-CB 3.5Å; T271-L275 VanDerWaalsContact O-CG 3.26Å; T271-L275 WeakPolarHBondContact O-CG 3.44Å; T271-L275 PolarHBondContact O-N 3.41Å
272F88.9Confident83.9Confident74 Ų7435 Ų3533%0.32518%0.184SC..Hα-helixtrans-65.2-45.4178.7-174.7-136000112A268 L269 H270 F274 L275 C276 Q319 L322A268-F272 WeakPolarHBondContact O-CB 3.36Å; A268-F272 PolarHBondContact O-N 2.94Å; L269-F272 PolarHBondContact O-N 3Å; H270-F272 VanDerWaalsContact C-N 3.35Å; F272-F274 VanDerWaalsContact C-N 3.33Å; F272-F274 PolarHBondContact O-N 2.86Å; F272-L275 PolarHBondContact O-N 3.45Å; F272-C276 VanDerWaalsContact CE2-SG 3.55Å; F272-C276 PolarHBondContact O-N 2.81Å; F272-C276 PolarHBondContact O-SG 3.28Å; F272-C276 VanDerWaalsContact O-SG 3.42Å; F272-Q319 HydrophobicContact CD1-CB 4.24Å; F272-Q319 HydrophobicContact CD1-CG 3.37Å; F272-Q319 HydrophobicContact CE1-CB 3.79Å; F272-Q319 HydrophobicContact CE1-CG 3.42Å; F272-Q319 VanDerWaalsContact CE1-CG 3.42Å; F272-Q319 HydrophobicContact CG-CG 4.02Å; F272-Q319 HydrophobicContact CZ-CB 4.09Å; F272-Q319 HydrophobicContact CZ-CG 4.11Å; F272-L322 HydrophobicContact CE1-CB 4.44Å; F272-L322 HydrophobicContact CE1-CD1 4.45Å; F272-L322 HydrophobicContact CZ-CD1 4.27Å
273A87.9Confident84.6Confident0 Ų031.2 Ų31.20%017%0.171CC..Hα-helixtrans-59.3-41.8175.300000112.5F143 F225 L269 H270 A277F143-A273 HydrophobicContact CE2-CB 4.46Å; F143-A273 HydrophobicContact CZ-CB 3.98Å; F225-A273 HydrophobicContact CE1-CB 3.8Å; F225-A273 HydrophobicContact CZ-CB 4.13Å; L269-A273 VanDerWaalsContact O-CB 3.29Å; L269-A273 WeakPolarHBondContact O-CB 3.48Å; L269-A273 PolarHBondContact O-N 2.03Å; H270-A273 PolarHBondContact O-N 2.86Å; A273-A277 WeakPolarHBondContact O-CB 3.36Å; A273-A277 PolarHBondContact O-N 3.18Å
274F87.9Confident85.3Confident36 Ų3631.2 Ų31.216%0.15817%0.17CC..Hα-helixtrans-64.3-48.4176.1173.2-108.7000112.5L222 F225 L226 I229 H270 T271 F272 C276 A277 L278L222-F274 HydrophobicContact CD1-CE2 4.12Å; F225-F274 HydrophobicContact CB-CD2 3.74Å; F225-F274 HydrophobicContact CB-CE2 4.46Å; F225-F274 HydrophobicContact CD1-CB 4.41Å; F225-F274 HydrophobicContact CG-CD2 4.4Å; L226-F274 HydrophobicContact CD2-CE2 4.05Å; L226-F274 HydrophobicContact CD2-CZ 4.18Å; I229-F274 HydrophobicContact CD1-CB 3.62Å; I229-F274 HydrophobicContact CD1-CD1 3.25Å; I229-F274 HydrophobicContact CD1-CD2 3.58Å; I229-F274 HydrophobicContact CD1-CE1 3.63Å; I229-F274 HydrophobicContact CD1-CE2 3.91Å; I229-F274 HydrophobicContact CD1-CG 3.19Å; I229-F274 HydrophobicContact CD1-CZ 3.92Å; H270-F274 WeakPolarHBondContact O-CB 3.16Å; H270-F274 PolarHBondContact O-N 2.88Å; T271-F274 PolarHBondContact O-N 2.77Å; F272-F274 VanDerWaalsContact C-N 3.33Å; F272-F274 PolarHBondContact O-N 2.86Å; F274-C276 VanDerWaalsContact C-N 3.27Å; F274-C276 PolarHBondContact O-N 3.2Å; F274-A277 PolarHBondContact O-N 3.26Å; F274-L278 HydrophobicContact CD1-CD1 4.22Å; F274-L278 HydrophobicContact CD1-CG 4.32Å; F274-L278 HydrophobicContact CE1-CD1 3.79Å; F274-L278 HydrophobicContact CE1-CD2 4.07Å; F274-L278 HydrophobicContact CE1-CG 4.02Å; F274-L278 HydrophobicContact CE2-CD2 3.89Å; F274-L278 HydrophobicContact CE2-CG 4.34Å; F274-L278 HydrophobicContact CZ-CD1 4.21Å; F274-L278 HydrophobicContact CZ-CD2 3.61Å; F274-L278 HydrophobicContact CZ-CG 4.05Å; F274-L278 WeakPolarHBondContact O-CG 3.49Å; F274-L278 PolarHBondContact O-N 3.45Å
275L89.3Confident85.6Confident98 Ų9830.5 Ų30.551%0.51317%0.167SC..Hα-helixtrans-59.1-40.2179.6-71.9173.8000111.7T271 F272 A277 L278 P279T271-L275 HydrophobicContact CG2-CD1 4.03Å; T271-L275 HydrophobicContact CG2-CG 4.39Å; T271-L275 WeakPolarHBondContact O-CB 3.5Å; T271-L275 VanDerWaalsContact O-CG 3.26Å; T271-L275 WeakPolarHBondContact O-CG 3.44Å; T271-L275 PolarHBondContact O-N 3.41Å; F272-L275 PolarHBondContact O-N 3.45Å; L275-A277 VanDerWaalsContact C-N 3.33Å; L275-L278 HydrophobicContact CD2-CD1 4.13Å; L275-L278 PolarHBondContact O-N 3.41Å; L275-P279 WeakPolarHBondContact O-CD 3.26Å
276C89.5Confident85.9Confident13 Ų1333.3 Ų33.39%0.08818%0.181CC..Hα-helixtrans-70.3-27.7175.7-69.10000113.3F272 F274 L315 Q319F272-C276 VanDerWaalsContact CE2-SG 3.55Å; F272-C276 PolarHBondContact O-N 2.81Å; F272-C276 PolarHBondContact O-SG 3.28Å; F272-C276 VanDerWaalsContact O-SG 3.42Å; F274-C276 VanDerWaalsContact C-N 3.27Å; F274-C276 PolarHBondContact O-N 3.2Å; C276-L315 HydrophobicContact CB-CB 4.12Å; C276-Q319 HydrophobicContact CB-CB 4Å; C276-Q319 HydrophobicContact CB-CG 4.43Å
277A87.6Confident85.7Confident2 Ų233.3 Ų33.32%0.01718%0.181CC..Hα-helixtrans-79.9-24.9177.100000113.7F225 A273 F274 L275 C280 V281 I316F225-A277 HydrophobicContact CD2-CB 4.5Å; F225-A277 HydrophobicContact CE2-CB 4.23Å; A273-A277 WeakPolarHBondContact O-CB 3.36Å; A273-A277 PolarHBondContact O-N 3.18Å; F274-A277 PolarHBondContact O-N 3.26Å; L275-A277 VanDerWaalsContact C-N 3.33Å; A277-C280 WeakPolarHBondContact O-CB 3.42Å; A277-C280 PolarHBondContact O-N 3.09Å; A277-V281 WeakPolarHBondContact O-CG2 3.44Å; A277-V281 PolarHBondContact O-N 3.19Å; A277-I316 HydrophobicContact CB-CD1 4.35Å; A277-I316 HydrophobicContact CB-CG1 4.45Å
278L86.6Confident85.3Confident51 Ų5133.8 Ų33.827%0.26718%0.184SC..Hα-helixtrans-54.5-48.1-175.3-81.7177.1000114.7F274 L275 C280 V281 I282F274-L278 HydrophobicContact CD1-CD1 4.22Å; F274-L278 HydrophobicContact CD1-CG 4.32Å; F274-L278 HydrophobicContact CE1-CD1 3.79Å; F274-L278 HydrophobicContact CE1-CD2 4.07Å; F274-L278 HydrophobicContact CE1-CG 4.02Å; F274-L278 HydrophobicContact CE2-CD2 3.89Å; F274-L278 HydrophobicContact CE2-CG 4.34Å; F274-L278 HydrophobicContact CZ-CD1 4.21Å; F274-L278 HydrophobicContact CZ-CD2 3.61Å; F274-L278 HydrophobicContact CZ-CG 4.05Å; F274-L278 WeakPolarHBondContact O-CG 3.49Å; F274-L278 PolarHBondContact O-N 3.45Å; L275-L278 HydrophobicContact CD2-CD1 4.13Å; L275-L278 PolarHBondContact O-N 3.41Å; L278-C280 PolarHBondContact O-N 3.04Å; L278-V281 WeakPolarHBondContact O-CB 3.31Å; L278-V281 PolarHBondContact O-N 3.02Å; L278-I282 WeakPolarHBondContact O-CG1 3.29Å; L278-I282 PolarHBondContact O-N 3.32Å
279P87.2Confident84.8Confident33 Ų3334 Ų3421%0.21418%0.181CC..Hα-helixtrans-58.4-40.9179.5-24.735.1000111.9L275 S283 L315L275-P279 WeakPolarHBondContact O-CD 3.26Å; P279-S283 WeakPolarHBondContact O-CB 3.32Å; P279-S283 PolarHBondContact O-N 3.36Å; P279-S283 VanDerWaalsContact O-N 3.09Å; P279-S283 PolarHBondContact O-OG 2.84Å; P279-L315 HydrophobicContact CG-CD1 4.04Å
280C87Confident83.8Confident0 Ų037.6 Ų37.60%020%0.197CC..Hα-helixtrans-64.8-43.6178.9-163.10000111.6Y219 T220 A277 L278 Y284 L309 W313 I316Y219-C280 WeakPolarHBondContact CE1-SG 3.19Å; T220-C280 HydrophobicContact CG2-CB 3.77Å; A277-C280 WeakPolarHBondContact O-CB 3.42Å; A277-C280 PolarHBondContact O-N 3.09Å; L278-C280 PolarHBondContact O-N 3.04Å; C280-Y284 VanDerWaalsContact O-CB 3.31Å; C280-Y284 WeakPolarHBondContact O-CB 3.44Å; C280-Y284 PolarHBondContact O-N 3.46Å; C280-L309 WeakPolarHBondContact O-CD2 3.29Å; C280-W313 PolarHBondContact SG-NE1 3.39Å; C280-I316 HydrophobicContact CB-CD1 4.35Å
281V84.2Confident82.5Confident8 Ų842 Ų425%0.04822%0.217CC..Hα-helixtrans-60.6-52.8176.6173.30000111.3T220 L222 A277 L278 S283 Y284 L285T220-V281 HydrophobicContact CG2-CG2 4.13Å; T220-V281 WeakPolarHBondContact OG1-CG2 3.43Å; L222-V281 HydrophobicContact CB-CG1 4.28Å; L222-V281 HydrophobicContact CB-CG2 4.21Å; L222-V281 HydrophobicContact CD1-CG1 3.91Å; L222-V281 HydrophobicContact CD1-CG2 4.02Å; L222-V281 HydrophobicContact CD2-CG1 3.58Å; L222-V281 HydrophobicContact CG-CG1 4.1Å; A277-V281 WeakPolarHBondContact O-CG2 3.44Å; A277-V281 PolarHBondContact O-N 3.19Å; L278-V281 WeakPolarHBondContact O-CB 3.31Å; L278-V281 PolarHBondContact O-N 3.02Å; V281-S283 VanDerWaalsContact C-N 3.31Å; V281-S283 PolarHBondContact O-N 2.69Å; V281-Y284 PolarHBondContact O-N 3.34Å; V281-L285 HydrophobicContact CG1-CD1 3.93Å; V281-L285 HydrophobicContact CG1-CG 4.42Å; V281-L285 WeakPolarHBondContact O-CG 3.26Å; V281-L285 PolarHBondContact O-N 2.95Å
282I85.8Confident81.3Confident94 Ų9446.9 Ų46.948%0.48223%0.229SC..Hα-helixtrans-60.5-46.8-174.6-67166.4000109L278 Y284 L285 L286L278-I282 WeakPolarHBondContact O-CG1 3.29Å; L278-I282 PolarHBondContact O-N 3.32Å; I282-Y284 VanDerWaalsContact C-N 3.34Å; I282-Y284 PolarHBondContact O-N 2.74Å; I282-L285 PolarHBondContact O-N 2.92Å; I282-L286 HydrophobicContact CG2-CD1 4.17Å; I282-L286 VanDerWaalsContact O-CG 3.29Å; I282-L286 WeakPolarHBondContact O-CG 3.27Å; I282-L286 PolarHBondContact O-N 3.43Å
283S85.7Confident79.6Confident6 Ų649.7 Ų49.74%0.04226%0.255CS..Hα-helixtrans-65.3-36178.1-590000113.1P279 V281 L286 S287 I305 F308P279-S283 WeakPolarHBondContact O-CB 3.32Å; P279-S283 PolarHBondContact O-N 3.36Å; P279-S283 VanDerWaalsContact O-N 3.09Å; P279-S283 PolarHBondContact O-OG 2.84Å; V281-S283 VanDerWaalsContact C-N 3.31Å; V281-S283 PolarHBondContact O-N 2.69Å; S283-L286 PolarHBondContact O-N 3.49Å; S283-S287 PolarHBondContact O-N 3.39Å; S283-S287 VanDerWaalsContact O-N 3.08Å; S283-I305 WeakPolarHBondContact O-CG2 3.22Å; S283-F308 WeakPolarHBondContact OG-CB 3.28Å
284Y83Confident78Confident12 Ų1255.2 Ų55.25%0.04729%0.289CS..Hα-helixtrans-68.9-40.1176.3-165-93.5000111.7V211 Q214 A215 Y219 C280 V281 I282 L286 S287 L309V211-Y284 HydrophobicContact CG1-CE1 4.27Å; Q214-Y284 HydrophobicContact CB-CE1 4.44Å; Q214-Y284 HydrophobicContact CG-CE1 4.39Å; Q214-Y284 WeakPolarHBondContact CG-OH 3.37Å; Q214-Y284 PolarHBondContact OE1-OH 2.92Å; A215-Y284 HydrophobicContact CB-CD1 3.45Å; A215-Y284 VanDerWaalsContact CB-CD1 3.45Å; A215-Y284 HydrophobicContact CB-CE1 3.72Å; Y219-Y284 HydrophobicContact CD1-CD1 4.29Å; Y219-Y284 AromaticContact CD1-CD2 3.48Å; Y219-Y284 HydrophobicContact CD1-CD2 3.48Å; Y219-Y284 VanDerWaalsContact CD1-CD2 3.48Å; Y219-Y284 HydrophobicContact CD1-CE2 4.14Å; Y219-Y284 AromaticContact CD1-CG 3.56Å; Y219-Y284 HydrophobicContact CD1-CG 3.56Å; Y219-Y284 AromaticContact CD2-CD2 3.71Å; Y219-Y284 HydrophobicContact CD2-CD2 3.71Å; Y219-Y284 AromaticContact CD2-CE2 3.48Å; Y219-Y284 HydrophobicContact CD2-CE2 3.48Å; Y219-Y284 VanDerWaalsContact CD2-CE2 3.48Å; Y219-Y284 HydrophobicContact CD2-CG 4.36Å; Y219-Y284 AromaticContact CD2-CZ 3.98Å; Y219-Y284 AromaticContact CE1-CD2 3.39Å; Y219-Y284 HydrophobicContact CE1-CD2 3.39Å; Y219-Y284 HydrophobicContact CE1-CE2 4.16Å; Y219-Y284 AromaticContact CE1-CG 3.84Å; Y219-Y284 HydrophobicContact CE1-CG 3.84Å; Y219-Y284 AromaticContact CE2-CD2 3.63Å; Y219-Y284 HydrophobicContact CE2-CD2 3.63Å; Y219-Y284 AromaticContact CE2-CE2 3.51Å; Y219-Y284 HydrophobicContact CE2-CE2 3.51Å; Y219-Y284 HydrophobicContact CG-CD1 4.22Å; Y219-Y284 AromaticContact CG-CD2 3.64Å; Y219-Y284 HydrophobicContact CG-CD2 3.64Å; Y219-Y284 HydrophobicContact CG-CE1 4.38Å; Y219-Y284 AromaticContact CG-CE2 3.81Å; Y219-Y284 HydrophobicContact CG-CE2 3.81Å; Y219-Y284 AromaticContact CG-CG 3.85Å; Y219-Y284 HydrophobicContact CG-CG 3.85Å; Y219-Y284 AromaticContact CZ-CD2 3.48Å; Y219-Y284 VanDerWaalsContact CZ-CD2 3.48Å; Y219-Y284 AromaticContact CZ-CE2 3.87Å; C280-Y284 VanDerWaalsContact O-CB 3.31Å; C280-Y284 WeakPolarHBondContact O-CB 3.44Å; C280-Y284 PolarHBondContact O-N 3.46Å; V281-Y284 PolarHBondContact O-N 3.34Å; I282-Y284 VanDerWaalsContact C-N 3.34Å; I282-Y284 PolarHBondContact O-N 2.74Å; Y284-L286 VanDerWaalsContact C-N 3.31Å; Y284-L286 PolarHBondContact O-N 3.42Å; Y284-S287 VanDerWaalsContact O-CB 3.31Å; Y284-S287 WeakPolarHBondContact O-CB 3.44Å; Y284-S287 PolarHBondContact O-N 2.85Å; Y284-S287 VanDerWaalsContact O-N 3.09Å; Y284-S287 PolarHBondContact O-OG 2.76Å; Y284-L309 HydrophobicContact CD2-CD2 4.24Å
285L82.4Confident76.5Confident65 Ų6559.4 Ų59.434%0.3431%0.308SS..Hα-helixtrans-63.8-37.9173.3-71.9173.3000111.8A215 V281 I282 S287 I288A215-L285 HydrophobicContact CB-CD2 3.61Å; A215-L285 HydrophobicContact CB-CG 4.37Å; V281-L285 HydrophobicContact CG1-CD1 3.93Å; V281-L285 HydrophobicContact CG1-CG 4.42Å; V281-L285 WeakPolarHBondContact O-CG 3.26Å; V281-L285 PolarHBondContact O-N 2.95Å; I282-L285 PolarHBondContact O-N 2.92Å; L285-S287 PolarHBondContact O-N 3.47Å; L285-I288 HydrophobicContact CD2-CD1 4.05Å; L285-I288 VanDerWaalsContact O-CB 3.3Å; L285-I288 WeakPolarHBondContact O-CB 3.44Å; L285-I288 WeakPolarHBondContact O-CD1 2.95Å; L285-I288 WeakPolarHBondContact O-CG1 3.44Å; L285-I288 PolarHBondContact O-N 3.06Å
286L83.9Confident75.1Confident71 Ų7164.9 Ų64.937%0.37233%0.328SS..Hα-helixtrans-63.9-28173.6-69.9173000112.2I282 S283 Y284 I288 T289 I305I282-L286 HydrophobicContact CG2-CD1 4.17Å; I282-L286 VanDerWaalsContact O-CG 3.29Å; I282-L286 WeakPolarHBondContact O-CG 3.27Å; I282-L286 PolarHBondContact O-N 3.43Å; S283-L286 PolarHBondContact O-N 3.49Å; Y284-L286 VanDerWaalsContact C-N 3.31Å; Y284-L286 PolarHBondContact O-N 3.42Å; L286-I288 PolarHBondContact O-N 3.47Å; L286-T289 WeakPolarHBondContact O-CB 3.49Å; L286-T289 WeakPolarHBondContact O-CG2 2.99Å; L286-T289 PolarHBondContact O-N 3.42Å; L286-T289 PolarHBondContact O-OG1 3.19Å; L286-I305 HydrophobicContact CB-CD1 3.92Å; L286-I305 HydrophobicContact CB-CG1 4.25Å
287S77.7Confident74Confident7 Ų766.8 Ų66.85%0.04934%0.337CS..G310 helixtrans-64.1-17.7175.681.80000114.1S283 Y284 L285 T289 F290S283-S287 PolarHBondContact O-N 3.39Å; S283-S287 VanDerWaalsContact O-N 3.08Å; Y284-S287 VanDerWaalsContact O-CB 3.31Å; Y284-S287 WeakPolarHBondContact O-CB 3.44Å; Y284-S287 PolarHBondContact O-N 2.85Å; Y284-S287 VanDerWaalsContact O-N 3.09Å; Y284-S287 PolarHBondContact O-OG 2.76Å; L285-S287 PolarHBondContact O-N 3.47Å; S287-T289 PolarHBondContact O-N 3.03Å; S287-F290 WeakPolarHBondContact O-CB 3.33Å; S287-F290 WeakPolarHBondContact O-CD2 3.27Å; S287-F290 VanDerWaalsContact O-CG 3.23Å; S287-F290 WeakPolarHBondContact O-CG 3.49Å; S287-F290 PolarHBondContact O-N 3.01Å
288I73Confident73.5Confident44 Ų4469.7 Ų69.723%0.22636%0.358CS..G310 helixtrans-58.2-31171.3-65.8165000110.8V211 I212 L285 L286 F290 H291V211-I288 HydrophobicContact CB-CG1 4.48Å; V211-I288 HydrophobicContact CG1-CD1 4.28Å; V211-I288 HydrophobicContact CG1-CG1 3.45Å; V211-I288 VanDerWaalsContact CG1-CG1 3.45Å; I212-I288 HydrophobicContact CG1-CD1 4.03Å; L285-I288 HydrophobicContact CD2-CD1 4.05Å; L285-I288 VanDerWaalsContact O-CB 3.3Å; L285-I288 WeakPolarHBondContact O-CB 3.44Å; L285-I288 WeakPolarHBondContact O-CD1 2.95Å; L285-I288 WeakPolarHBondContact O-CG1 3.44Å; L285-I288 PolarHBondContact O-N 3.06Å; L286-I288 PolarHBondContact O-N 3.47Å; I288-F290 PolarHBondContact O-N 3.48Å; I288-H291 PolarHBondContact O-N 3.34Å; I288-H291 VanDerWaalsContact O-N 3.15Å
289T72.4Confident72.9Confident44 Ų4473.8 Ų73.827%0.2738%0.375SS..G310 helixtrans-60.4-26.7177.663.90000112.4L286 S287 H291 R292 L297 Y301L286-T289 WeakPolarHBondContact O-CB 3.49Å; L286-T289 WeakPolarHBondContact O-CG2 2.99Å; L286-T289 PolarHBondContact O-N 3.42Å; L286-T289 PolarHBondContact O-OG1 3.19Å; S287-T289 PolarHBondContact O-N 3.03Å; T289-H291 PolarHBondContact O-N 2.93Å; T289-R292 PolarHBondContact O-N 3.29Å; T289-R292 VanDerWaalsContact O-N 3.14Å; T289-L297 WeakPolarHBondContact O-CD1 3.31Å; T289-Y301 WeakPolarHBondContact OG1-CE1 3.35Å
290F67Low72.4Confident76 Ų7675.7 Ų75.733%0.33338%0.381SS..G310 helixtrans-59.7-27.3177.7-59.4-21.3000113.6S287 I288 L297 Y301 V302 I305S287-F290 WeakPolarHBondContact O-CB 3.33Å; S287-F290 WeakPolarHBondContact O-CD2 3.27Å; S287-F290 VanDerWaalsContact O-CG 3.23Å; S287-F290 WeakPolarHBondContact O-CG 3.49Å; S287-F290 PolarHBondContact O-N 3.01Å; I288-F290 PolarHBondContact O-N 3.48Å; F290-L297 HydrophobicContact CD1-CD1 3.98Å; F290-L297 HydrophobicContact CD1-CD2 4.47Å; F290-Y301 HydrophobicContact CE1-CD1 4.09Å; F290-Y301 HydrophobicContact CE1-CE1 4.15Å; F290-V302 HydrophobicContact CD1-CG2 4.19Å; F290-V302 HydrophobicContact CE1-CB 4.15Å; F290-V302 HydrophobicContact CE1-CG1 4.29Å; F290-V302 HydrophobicContact CE1-CG2 3.66Å; F290-V302 HydrophobicContact CE2-CG1 4.32Å; F290-V302 HydrophobicContact CZ-CB 4.12Å; F290-V302 HydrophobicContact CZ-CG1 3.87Å; F290-V302 HydrophobicContact CZ-CG2 4.1Å; F290-I305 HydrophobicContact CE1-CD1 3.47Å; F290-I305 VanDerWaalsContact CE1-CD1 3.47Å; F290-I305 HydrophobicContact CE2-CD1 4.5Å; F290-I305 HydrophobicContact CE2-CG2 4.25Å; F290-I305 HydrophobicContact CZ-CB 3.92Å; F290-I305 HydrophobicContact CZ-CD1 3.46Å; F290-I305 VanDerWaalsContact CZ-CD1 3.46Å; F290-I305 HydrophobicContact CZ-CG1 4.28Å; F290-I305 HydrophobicContact CZ-CG2 3.89Å
291H59.2Low72.2Confident93 Ų9379 Ų7943%0.43139%0.394SS..G310 helixtrans-84.9-14.2-178.4-162.258.9000113.3T207 D208 I288 T289 P293T207-H291 PolarHBondContact OG1-CD2 2.91Å; T207-H291 PolarHBondContact OG1-NE2 3.25Å; D208-H291 IonicContact OD1-CD2 3.38Å; D208-H291 PolarHBondContact OD1-CD2 3.03Å; D208-H291 VanDerWaalsContact OD1-CD2 3.24Å; I288-H291 PolarHBondContact O-N 3.34Å; I288-H291 VanDerWaalsContact O-N 3.15Å; T289-H291 PolarHBondContact O-N 2.93Å; H291-P293 WeakPolarHBondContact O-CD 3.42Å
292R60.4Low72Confident158 Ų15880.8 Ų80.860%0.59641%0.405SS*.  trans-73.4114.4-179.4-71.7-163.4-170.1-1784.5109.9T289 T294 H295T289-R292 PolarHBondContact O-N 3.29Å; T289-R292 VanDerWaalsContact O-N 3.14Å; R292-T294 PolarHBondContact O-N 3.09Å; R292-H295 PolarHBondContact O-N 2.96Å
293P54.6Low71.7Confident133 Ų13378.2 Ų78.286%0.86439%0.389SS*.THydrogen-bonded Turntrans-63.6-17.6-178.8-919.9000113.1H291H291-P293 WeakPolarHBondContact O-CD 3.42Å
294T54.4Low71.6Confident115 Ų11582.7 Ų82.771%0.70641%0.408SS*.THydrogen-bonded Turntrans-81.6-15.3-171.749.40000114.3R292R292-T294 PolarHBondContact O-N 3.09Å
295H55.3Low71.8Confident124 Ų12482.3 Ų82.357%0.57441%0.407SS*.  trans-110114.7178.6-81.8-80.7000111.1R292 L297R292-H295 PolarHBondContact O-N 2.96Å; H295-L297 HydrophobicContact CB-CG 4.32Å; H295-L297 PolarHBondContact O-N 3.19Å
296K60.8Low71.8Confident214 Ų21480.6 Ų80.693%0.9340%0.398SS*.  trans-63.388.5156.1-75.6-177.4178.4178.80107.5
297L66.9Low72Confident53 Ų5378 Ų7828%0.27739%0.385SS..  trans-67.3135.4173.5-72.5139.4000108.7T289 F290 H295 Y301T289-L297 WeakPolarHBondContact O-CD1 3.31Å; F290-L297 HydrophobicContact CD1-CD1 3.98Å; F290-L297 HydrophobicContact CD1-CD2 4.47Å; H295-L297 HydrophobicContact CB-CG 4.32Å; H295-L297 PolarHBondContact O-N 3.19Å; L297-Y301 HydrophobicContact CD2-CD1 3.31Å; L297-Y301 HydrophobicContact CD2-CE1 3.45Å; L297-Y301 VanDerWaalsContact CD2-CE1 3.45Å; L297-Y301 HydrophobicContact CD2-CG 4.31Å
298S76.7Confident72.5Confident63 Ų6381.3 Ų81.344%0.44140%0.398SS..  trans-67.3143.1172.660.40000109.7E300 Y301 V302S298-E300 PolarHBondContact O-N 2.92Å; S298-Y301 WeakPolarHBondContact O-CB 3.29Å; S298-Y301 PolarHBondContact O-N 3.08Å; S298-Y301 WeakPolarHBondContact OG-CB 3.46Å; S298-Y301 PolarHBondContact OG-N 3.36Å; S298-V302 PolarHBondContact O-N 3.42Å
299E72.6Confident73.3Confident137 Ų13779.9 Ų79.964%0.6439%0.391SS*.Hα-helixtrans-56.3-33.7172.4-66-17618000111Y301 V302 R303E299-Y301 VanDerWaalsContact C-N 3.31Å; E299-Y301 PolarHBondContact O-N 3.15Å; E299-V302 PolarHBondContact O-N 2.97Å; E299-R303 WeakPolarHBondContact O-CG 3.31Å; E299-R303 PolarHBondContact O-N 3.44Å
300E77.5Confident74Confident72 Ų7277.8 Ų77.834%0.33638%0.378SS..Hα-helixtrans-56.3-44.2174.2-46.2-159.213900112.1S31 L34 S298 R303 F304S31-E300 WeakPolarHBondContact CB-OE1 3.42Å; S31-E300 PolarHBondContact OG-OE1 3.45Å; L34-E300 HydrophobicContact CD1-CG 3.68Å; L34-E300 HydrophobicContact CD2-CB 4.36Å; L34-E300 HydrophobicContact CD2-CG 4.15Å; L34-E300 HydrophobicContact CG-CB 4.39Å; L34-E300 HydrophobicContact CG-CG 3.75Å; S298-E300 PolarHBondContact O-N 2.92Å; E300-R303 PolarHBondContact O-N 3.18Å; E300-F304 VanDerWaalsContact O-CB 3.25Å; E300-F304 WeakPolarHBondContact O-CB 3.37Å; E300-F304 PolarHBondContact O-N 3.14Å
301Y82.2Confident75.1Confident70 Ų7076.8 Ų76.828%0.27538%0.375SS..Hα-helixtrans-67-40.2-179.9-178.1-100.2000112T289 F290 L297 S298 E299 F304 I305T289-Y301 WeakPolarHBondContact OG1-CE1 3.35Å; F290-Y301 HydrophobicContact CE1-CD1 4.09Å; F290-Y301 HydrophobicContact CE1-CE1 4.15Å; L297-Y301 HydrophobicContact CD2-CD1 3.31Å; L297-Y301 HydrophobicContact CD2-CE1 3.45Å; L297-Y301 VanDerWaalsContact CD2-CE1 3.45Å; L297-Y301 HydrophobicContact CD2-CG 4.31Å; S298-Y301 WeakPolarHBondContact O-CB 3.29Å; S298-Y301 PolarHBondContact O-N 3.08Å; S298-Y301 WeakPolarHBondContact OG-CB 3.46Å; S298-Y301 PolarHBondContact OG-N 3.36Å; E299-Y301 VanDerWaalsContact C-N 3.31Å; E299-Y301 PolarHBondContact O-N 3.15Å; Y301-F304 PolarHBondContact O-N 2.84Å; Y301-I305 HydrophobicContact CD1-CD1 3.74Å; Y301-I305 HydrophobicContact CE1-CD1 3.2Å; Y301-I305 HydrophobicContact CE1-CG1 4.29Å; Y301-I305 HydrophobicContact CE2-CD1 4.32Å; Y301-I305 WeakPolarHBondContact O-CG1 3.11Å; Y301-I305 PolarHBondContact O-N 3.09Å
302V80.2Confident76.6Confident45 Ų4572.3 Ų72.327%0.27336%0.355SS..Hα-helixtrans-62.7-46.1176.2-1800000110.7F290 S298 E299 I305 L306F290-V302 HydrophobicContact CD1-CG2 4.19Å; F290-V302 HydrophobicContact CE1-CB 4.15Å; F290-V302 HydrophobicContact CE1-CG1 4.29Å; F290-V302 HydrophobicContact CE1-CG2 3.66Å; F290-V302 HydrophobicContact CE2-CG1 4.32Å; F290-V302 HydrophobicContact CZ-CB 4.12Å; F290-V302 HydrophobicContact CZ-CG1 3.87Å; F290-V302 HydrophobicContact CZ-CG2 4.1Å; S298-V302 PolarHBondContact O-N 3.42Å; E299-V302 PolarHBondContact O-N 2.97Å; V302-I305 PolarHBondContact O-N 3.46Å; V302-L306 PolarHBondContact O-N 2.66Å
303R79.9Confident78.2Confident41 Ų4165 Ų6516%0.15533%0.327CS..Hα-helixtrans-67.7-35.7178.1-65-158.7-164.9-146.6-0.7112.7D15 D19 L34 I37 S38 E299 E300 L306 L307D15-R303 PolarHBondContact O-NH1 3.13Å; D19-R303 IonicContact OD1-CZ 3.56Å; D19-R303 IonicContact OD1-NE 3.94Å; D19-R303 IonicContact OD1-NH1 3.56Å; D19-R303 PolarHBondContact OD1-NH1 2.95Å; D19-R303 IonicContact OD1-NH2 3.79Å; D19-R303 PolarHBondContact OD1-NH2 2.89Å; D19-R303 IonicContact OD2-CZ 3.32Å; D19-R303 IonicContact OD2-NE 3.3Å; D19-R303 PolarHBondContact OD2-NE 3.38Å; D19-R303 IonicContact OD2-NH1 2.72Å; D19-R303 PolarHBondContact OD2-NH1 3.32Å; D19-R303 IonicContact OD2-NH2 2.67Å; D19-R303 PolarHBondContact OD2-NH2 3.48Å; L34-R303 HydrophobicContact CD2-CB 4.28Å; L34-R303 VanDerWaalsContact CD2-CD 3.43Å; L34-R303 HydrophobicContact CD2-CG 4.02Å; I37-R303 HydrophobicContact CG2-CB 4.13Å; S38-R303 PolarHBondContact OG-NH1 2.98Å; E299-R303 WeakPolarHBondContact O-CG 3.31Å; E299-R303 PolarHBondContact O-N 3.44Å; E300-R303 PolarHBondContact O-N 3.18Å; R303-L306 PolarHBondContact O-N 2.9Å; R303-L307 WeakPolarHBondContact O-CB 3.31Å; R303-L307 PolarHBondContact O-N 2.87Å
304F84.2Confident80Confident100 Ų10059.2 Ų59.244%0.43929%0.289SS..Hα-helixtrans-61.7-47.8174.2-170.5-93.7000111I37 E300 Y301 L306 L307 F308I37-F304 HydrophobicContact CD1-CD2 4.42Å; E300-F304 VanDerWaalsContact O-CB 3.25Å; E300-F304 WeakPolarHBondContact O-CB 3.37Å; E300-F304 PolarHBondContact O-N 3.14Å; Y301-F304 PolarHBondContact O-N 2.84Å; F304-L306 VanDerWaalsContact C-N 3.31Å; F304-L306 PolarHBondContact O-N 2.9Å; F304-L307 PolarHBondContact O-N 3.45Å; F304-F308 AromaticContact CD1-CD2 3.86Å; F304-F308 HydrophobicContact CD1-CD2 3.86Å; F304-F308 AromaticContact CD1-CE2 3.88Å; F304-F308 HydrophobicContact CD1-CE2 3.88Å; F304-F308 HydrophobicContact CD2-CD2 4.46Å; F304-F308 HydrophobicContact CD2-CE2 4.03Å; F304-F308 AromaticContact CE1-CD2 3.63Å; F304-F308 HydrophobicContact CE1-CD2 3.63Å; F304-F308 AromaticContact CE1-CE2 3.27Å; F304-F308 HydrophobicContact CE1-CE2 3.27Å; F304-F308 AromaticContact CE1-CZ 3.93Å; F304-F308 HydrophobicContact CE1-CZ 3.93Å; F304-F308 HydrophobicContact CE2-CD2 4.29Å; F304-F308 AromaticContact CE2-CE2 3.45Å; F304-F308 HydrophobicContact CE2-CE2 3.45Å; F304-F308 VanDerWaalsContact CE2-CE2 3.45Å; F304-F308 HydrophobicContact CE2-CZ 4.24Å; F304-F308 HydrophobicContact CG-CD2 4.29Å; F304-F308 HydrophobicContact CG-CE2 4.23Å; F304-F308 AromaticContact CZ-CD2 3.89Å; F304-F308 HydrophobicContact CZ-CD2 3.89Å; F304-F308 AromaticContact CZ-CE2 3.05Å; F304-F308 HydrophobicContact CZ-CE2 3.05Å; F304-F308 AromaticContact CZ-CZ 3.57Å; F304-F308 HydrophobicContact CZ-CZ 3.57Å; F304-F308 WeakPolarHBondContact O-CD2 3.43Å; F304-F308 PolarHBondContact O-N 2.59Å; F304-F308 VanDerWaalsContact O-N 3.07Å
305I86.3Confident81.9Confident3 Ų356.5 Ų56.52%0.01527%0.27CS..Hα-helixtrans-57.6-45.8174.2-75.1168.7000110.9S283 L286 F290 Y301 V302 L307 F308 L309S283-I305 WeakPolarHBondContact O-CG2 3.22Å; L286-I305 HydrophobicContact CB-CD1 3.92Å; L286-I305 HydrophobicContact CB-CG1 4.25Å; F290-I305 HydrophobicContact CE1-CD1 3.47Å; F290-I305 VanDerWaalsContact CE1-CD1 3.47Å; F290-I305 HydrophobicContact CE2-CD1 4.5Å; F290-I305 HydrophobicContact CE2-CG2 4.25Å; F290-I305 HydrophobicContact CZ-CB 3.92Å; F290-I305 HydrophobicContact CZ-CD1 3.46Å; F290-I305 VanDerWaalsContact CZ-CD1 3.46Å; F290-I305 HydrophobicContact CZ-CG1 4.28Å; F290-I305 HydrophobicContact CZ-CG2 3.89Å; Y301-I305 HydrophobicContact CD1-CD1 3.74Å; Y301-I305 HydrophobicContact CE1-CD1 3.2Å; Y301-I305 HydrophobicContact CE1-CG1 4.29Å; Y301-I305 HydrophobicContact CE2-CD1 4.32Å; Y301-I305 WeakPolarHBondContact O-CG1 3.11Å; Y301-I305 PolarHBondContact O-N 3.09Å; V302-I305 PolarHBondContact O-N 3.46Å; I305-L307 VanDerWaalsContact C-N 3.34Å; I305-L307 PolarHBondContact O-N 3.43Å; I305-F308 PolarHBondContact O-N 3.44Å; I305-L309 HydrophobicContact CG2-CD1 3.93Å; I305-L309 HydrophobicContact CG2-CG 4.32Å; I305-L309 WeakPolarHBondContact O-CG 3.26Å; I305-L309 PolarHBondContact O-N 2.86Å
306L83.5Confident83.7Confident30 Ų3050.9 Ų50.916%0.15724%0.244CC..Hα-helixtrans-59.9-43.9178.8-172.366.4000111.9L41 W99 F103 V302 R303 F304 F308 L309 N310L41-L306 HydrophobicContact CD2-CD2 3.94Å; L41-L306 HydrophobicContact CD2-CG 4.24Å; W99-L306 HydrophobicContact CH2-CD1 3.75Å; W99-L306 HydrophobicContact CZ3-CD1 3.71Å; F103-L306 HydrophobicContact CE1-CD2 3.75Å; F103-L306 HydrophobicContact CZ-CD1 4.19Å; F103-L306 HydrophobicContact CZ-CD2 3.8Å; F103-L306 HydrophobicContact CZ-CG 4.42Å; V302-L306 PolarHBondContact O-N 2.66Å; R303-L306 PolarHBondContact O-N 2.9Å; F304-L306 VanDerWaalsContact C-N 3.31Å; F304-L306 PolarHBondContact O-N 2.9Å; L306-F308 PolarHBondContact O-N 3.09Å; L306-L309 WeakPolarHBondContact O-CB 3.46Å; L306-L309 PolarHBondContact O-N 3.35Å; L306-N310 PolarHBondContact O-N 3.5Å; L306-N310 PolarHBondContact O-ND2 2.71Å
307L86.9Confident85.3Confident17 Ų1740.9 Ų40.99%0.08920%0.2CC..Hα-helixtrans-58.2-48.5176.3175.165.5000111.3I37 V40 L41 R303 F304 I305 L309 N310 I311I37-L307 HydrophobicContact CG2-CB 4.18Å; I37-L307 HydrophobicContact CG2-CD2 4.12Å; V40-L307 HydrophobicContact CG1-CD1 4.02Å; L41-L307 HydrophobicContact CB-CD1 4Å; L41-L307 HydrophobicContact CD1-CD1 4.44Å; R303-L307 WeakPolarHBondContact O-CB 3.31Å; R303-L307 PolarHBondContact O-N 2.87Å; F304-L307 PolarHBondContact O-N 3.45Å; I305-L307 VanDerWaalsContact C-N 3.34Å; I305-L307 PolarHBondContact O-N 3.43Å; L307-L309 PolarHBondContact O-N 2.98Å; L307-N310 WeakPolarHBondContact O-CB 3.25Å; L307-N310 PolarHBondContact O-N 3.32Å; L307-I311 HydrophobicContact CD1-CD1 4.03Å; L307-I311 HydrophobicContact CD1-CG1 4.32Å; L307-I311 HydrophobicContact CD2-CD1 4.48Å; L307-I311 HydrophobicContact CG-CD1 3.89Å; L307-I311 WeakPolarHBondContact O-CG1 3.31Å; L307-I311 PolarHBondContact O-N 3.33Å
308F88.6Confident86.7Confident75 Ų7541.5 Ų41.533%0.32920%0.204SC..Hα-helixtrans-68.2-34-179.7-83.7-101.6000113.2S283 F304 I305 L306 N310 I311 G312S283-F308 WeakPolarHBondContact OG-CB 3.28Å; F304-F308 AromaticContact CD1-CD2 3.86Å; F304-F308 HydrophobicContact CD1-CD2 3.86Å; F304-F308 AromaticContact CD1-CE2 3.88Å; F304-F308 HydrophobicContact CD1-CE2 3.88Å; F304-F308 HydrophobicContact CD2-CD2 4.46Å; F304-F308 HydrophobicContact CD2-CE2 4.03Å; F304-F308 AromaticContact CE1-CD2 3.63Å; F304-F308 HydrophobicContact CE1-CD2 3.63Å; F304-F308 AromaticContact CE1-CE2 3.27Å; F304-F308 HydrophobicContact CE1-CE2 3.27Å; F304-F308 AromaticContact CE1-CZ 3.93Å; F304-F308 HydrophobicContact CE1-CZ 3.93Å; F304-F308 HydrophobicContact CE2-CD2 4.29Å; F304-F308 AromaticContact CE2-CE2 3.45Å; F304-F308 HydrophobicContact CE2-CE2 3.45Å; F304-F308 VanDerWaalsContact CE2-CE2 3.45Å; F304-F308 HydrophobicContact CE2-CZ 4.24Å; F304-F308 HydrophobicContact CG-CD2 4.29Å; F304-F308 HydrophobicContact CG-CE2 4.23Å; F304-F308 AromaticContact CZ-CD2 3.89Å; F304-F308 HydrophobicContact CZ-CD2 3.89Å; F304-F308 AromaticContact CZ-CE2 3.05Å; F304-F308 HydrophobicContact CZ-CE2 3.05Å; F304-F308 AromaticContact CZ-CZ 3.57Å; F304-F308 HydrophobicContact CZ-CZ 3.57Å; F304-F308 WeakPolarHBondContact O-CD2 3.43Å; F304-F308 PolarHBondContact O-N 2.59Å; F304-F308 VanDerWaalsContact O-N 3.07Å; I305-F308 PolarHBondContact O-N 3.44Å; L306-F308 PolarHBondContact O-N 3.09Å; F308-N310 VanDerWaalsContact C-N 3.31Å; F308-N310 PolarHBondContact O-N 2.87Å; F308-I311 PolarHBondContact O-N 3.43Å; F308-G312 PolarHBondContact O-N 2.87Å
309L89.6Confident87.5Confident14 Ų1438.5 Ų38.57%0.07318%0.183CC..Hα-helixtrans-57.9-45.6170.7-74.5171.8000111W99 Y219 C280 Y284 I305 L306 L307 G312 W313W99-L309 HydrophobicContact CH2-CB 4.29Å; W99-L309 HydrophobicContact CZ2-CB 4.42Å; Y219-L309 HydrophobicContact CE1-CD2 3.71Å; C280-L309 WeakPolarHBondContact O-CD2 3.29Å; Y284-L309 HydrophobicContact CD2-CD2 4.24Å; I305-L309 HydrophobicContact CG2-CD1 3.93Å; I305-L309 HydrophobicContact CG2-CG 4.32Å; I305-L309 WeakPolarHBondContact O-CG 3.26Å; I305-L309 PolarHBondContact O-N 2.86Å; L306-L309 WeakPolarHBondContact O-CB 3.46Å; L306-L309 PolarHBondContact O-N 3.35Å; L307-L309 PolarHBondContact O-N 2.98Å; L309-G312 PolarHBondContact O-N 3.38Å; L309-W313 PolarHBondContact O-N 3.29Å
310N87.8Confident88.6Confident1 Ų132.1 Ų32.11%0.00515%0.153CC..Hα-helixtrans-65.5-45178.1-81.3-83.2000112.8L41 M45 W99 L306 L307 F308 G312 W313 N314L41-N310 HydrophobicContact CD1-CB 3.65Å; L41-N310 VanDerWaalsContact CD1-ND2 3.28Å; L41-N310 WeakPolarHBondContact CD1-ND2 3.33Å; M45-N310 HydrophobicContact SD-CB 4.28Å; M45-N310 PolarHBondContact SD-OD1 3.46Å; W99-N310 VanDerWaalsContact CD2-OD1 3.24Å; W99-N310 WeakPolarHBondContact CH2-ND2 3.5Å; W99-N310 VanDerWaalsContact CZ3-CG 3.42Å; W99-N310 WeakPolarHBondContact CZ3-ND2 3.19Å; W99-N310 WeakPolarHBondContact CZ3-OD1 3.46Å; L306-N310 PolarHBondContact O-N 3.5Å; L306-N310 PolarHBondContact O-ND2 2.71Å; L307-N310 WeakPolarHBondContact O-CB 3.25Å; L307-N310 PolarHBondContact O-N 3.32Å; F308-N310 VanDerWaalsContact C-N 3.31Å; F308-N310 PolarHBondContact O-N 2.87Å; N310-G312 VanDerWaalsContact C-N 3.28Å; N310-G312 PolarHBondContact O-N 2.94Å; N310-W313 PolarHBondContact O-N 3.12Å; N310-N314 PolarHBondContact O-N 3.38Å; N310-N314 PolarHBondContact O-ND2 3.37Å
311I89.3Confident89.4Confident54 Ų5429.3 Ų29.328%0.27714%0.141SC..Hα-helixtrans-58.8-45.4175.4-68.8169.6000109.5I44 L307 F308 W313 N314 L315I44-I311 HydrophobicContact CD1-CG1 4.2Å; L307-I311 HydrophobicContact CD1-CD1 4.03Å; L307-I311 HydrophobicContact CD1-CG1 4.32Å; L307-I311 HydrophobicContact CD2-CD1 4.48Å; L307-I311 HydrophobicContact CG-CD1 3.89Å; L307-I311 WeakPolarHBondContact O-CG1 3.31Å; L307-I311 PolarHBondContact O-N 3.33Å; F308-I311 PolarHBondContact O-N 3.43Å; I311-W313 PolarHBondContact O-N 3.23Å; I311-N314 PolarHBondContact O-N 2.99Å; I311-L315 HydrophobicContact CG2-CD1 4.11Å; I311-L315 HydrophobicContact CG2-CG 4.42Å; I311-L315 WeakPolarHBondContact O-CG 3.33Å; I311-L315 PolarHBondContact O-N 3.07Å
312G91.9Very high90Very high0 Ų029.4 Ų29.40%015%0.146CC..Hα-helixtrans-57.2-45.7176.300000113.1F308 L309 N310 L315 I316F308-G312 PolarHBondContact O-N 2.87Å; L309-G312 PolarHBondContact O-N 3.38Å; N310-G312 VanDerWaalsContact C-N 3.28Å; N310-G312 PolarHBondContact O-N 2.94Å; G312-L315 PolarHBondContact O-N 2.62Å; G312-I316 WeakPolarHBondContact O-CG1 3.33Å; G312-I316 PolarHBondContact O-N 2.7Å
313W92.5Very high90.5Very high3 Ų327.3 Ų27.31%0.01113%0.134CC..Hα-helixtrans-63.5-43.4175.5-79.9113.4000113I90 I94 W99 Y219 C280 L309 N310 I311 L315 I316 F317I90-W313 HydrophobicContact CG2-CZ3 3.8Å; I94-W313 HydrophobicContact CD1-CE3 4.22Å; I94-W313 HydrophobicContact CD1-CH2 3.23Å; I94-W313 HydrophobicContact CD1-CZ2 3.59Å; I94-W313 HydrophobicContact CD1-CZ3 3.58Å; I94-W313 HydrophobicContact CG2-CD2 3.67Å; I94-W313 HydrophobicContact CG2-CE3 3.91Å; I94-W313 HydrophobicContact CG2-CG 4.09Å; I94-W313 HydrophobicContact CG2-CH2 4.49Å; I94-W313 HydrophobicContact CG2-CZ2 4.26Å; I94-W313 HydrophobicContact CG2-CZ3 4.32Å; W99-W313 AromaticContact CE2-CD1 3.62Å; W99-W313 AromaticContact CZ2-CD1 3.61Å; W99-W313 AromaticContact CZ2-NE1 3.99Å; W99-W313 AromaticContact NE1-CD1 3.18Å; W99-W313 AromaticContact NE1-CG 3.57Å; W99-W313 AromaticContact NE1-NE1 3.69Å; Y219-W313 HydrophobicContact CD1-CZ2 4.31Å; Y219-W313 HydrophobicContact CE1-CZ2 4.03Å; Y219-W313 AromaticContact CE1-NE1 3.72Å; Y219-W313 HydrophobicContact CE2-CZ2 4.28Å; Y219-W313 AromaticContact CZ-NE1 3.44Å; Y219-W313 VanDerWaalsContact O-CH2 3.22Å; Y219-W313 WeakPolarHBondContact O-CH2 3.47Å; Y219-W313 WeakPolarHBondContact O-CZ2 3.35Å; Y219-W313 PolarHBondContact OH-NE1 3.27Å; C280-W313 PolarHBondContact SG-NE1 3.39Å; L309-W313 PolarHBondContact O-N 3.29Å; N310-W313 PolarHBondContact O-N 3.12Å; I311-W313 PolarHBondContact O-N 3.23Å; W313-L315 VanDerWaalsContact C-N 3.28Å; W313-L315 PolarHBondContact O-N 3.02Å; W313-I316 HydrophobicContact CD2-CD1 4.41Å; W313-I316 HydrophobicContact CE3-CB 4.42Å; W313-I316 HydrophobicContact CE3-CD1 3.84Å; W313-I316 HydrophobicContact CE3-CG2 4.48Å; W313-I316 HydrophobicContact CH2-CD1 4.49Å; W313-I316 HydrophobicContact CZ3-CD1 3.89Å; W313-I316 HydrophobicContact CZ3-CG2 4.42Å; W313-I316 WeakPolarHBondContact O-CB 3.32Å; W313-I316 PolarHBondContact O-N 3.13Å; W313-I316 VanDerWaalsContact O-N 3.12Å; W313-F317 HydrophobicContact CB-CE2 4.02Å; W313-F317 HydrophobicContact CB-CZ 4.38Å; W313-F317 HydrophobicContact CE3-CE1 4.24Å; W313-F317 HydrophobicContact CE3-CZ 4.03Å; W313-F317 WeakPolarHBondContact O-CD2 3.4Å; W313-F317 VanDerWaalsContact O-CG 3.29Å; W313-F317 WeakPolarHBondContact O-CG 3.36Å; W313-F317 PolarHBondContact O-N 3.03Å
314N93.4Very high91.2Very high12 Ų1226.7 Ų26.76%0.06413%0.133CC..Hα-helixtrans-61.3-37.7175.6-80.6-81.9000112M45 N310 I311 F317 L318M45-N314 PolarHBondContact SD-ND2 3.09Å; N310-N314 PolarHBondContact O-N 3.38Å; N310-N314 PolarHBondContact O-ND2 3.37Å; I311-N314 PolarHBondContact O-N 2.99Å; N314-F317 PolarHBondContact O-N 3.18Å; N314-L318 VanDerWaalsContact O-CB 3.28Å; N314-L318 WeakPolarHBondContact O-CB 3.5Å; N314-L318 PolarHBondContact O-N 3.2Å
315L94Very high91.5Very high58 Ų5825.1 Ų25.130%0.30413%0.131SC..Hα-helixtrans-65.5-38.3173.8-70.9173.3000112.3C276 P279 I311 G312 W313 L318 Q319C276-L315 HydrophobicContact CB-CB 4.12Å; P279-L315 HydrophobicContact CG-CD1 4.04Å; I311-L315 HydrophobicContact CG2-CD1 4.11Å; I311-L315 HydrophobicContact CG2-CG 4.42Å; I311-L315 WeakPolarHBondContact O-CG 3.33Å; I311-L315 PolarHBondContact O-N 3.07Å; G312-L315 PolarHBondContact O-N 2.62Å; W313-L315 VanDerWaalsContact C-N 3.28Å; W313-L315 PolarHBondContact O-N 3.02Å; L315-L318 PolarHBondContact O-N 3Å; L315-Q319 VanDerWaalsContact O-CB 3.25Å; L315-Q319 WeakPolarHBondContact O-CB 3.46Å; L315-Q319 PolarHBondContact O-N 2.63Å
316I93.3Very high91.7Very high6 Ų626.6 Ų26.63%0.03114%0.139CC..Hα-helixtrans-63.7-45.1175.3-68.7165.8000110.8T220 A277 C280 G312 W313 Q319 S320T220-I316 HydrophobicContact CG2-CD1 4.18Å; A277-I316 HydrophobicContact CB-CD1 4.35Å; A277-I316 HydrophobicContact CB-CG1 4.45Å; C280-I316 HydrophobicContact CB-CD1 4.35Å; G312-I316 WeakPolarHBondContact O-CG1 3.33Å; G312-I316 PolarHBondContact O-N 2.7Å; W313-I316 HydrophobicContact CD2-CD1 4.41Å; W313-I316 HydrophobicContact CE3-CB 4.42Å; W313-I316 HydrophobicContact CE3-CD1 3.84Å; W313-I316 HydrophobicContact CE3-CG2 4.48Å; W313-I316 HydrophobicContact CH2-CD1 4.49Å; W313-I316 HydrophobicContact CZ3-CD1 3.89Å; W313-I316 HydrophobicContact CZ3-CG2 4.42Å; W313-I316 WeakPolarHBondContact O-CB 3.32Å; W313-I316 PolarHBondContact O-N 3.13Å; W313-I316 VanDerWaalsContact O-N 3.12Å; I316-Q319 PolarHBondContact O-N 3.03Å; I316-S320 PolarHBondContact O-N 2.82Å
317F95Very high92Very high4 Ų425.3 Ų25.32%0.01813%0.132CC..Hα-helixtrans-65.8-42.8176.7-56.8-40.6000111.6F49 I52 D56 I90 V91 I94 W313 N314 Q319 S320 S321F49-F317 AromaticContact CD2-CD2 3.9Å; F49-F317 HydrophobicContact CD2-CD2 3.9Å; F49-F317 HydrophobicContact CD2-CE2 4.03Å; F49-F317 AromaticContact CE2-CD2 3.66Å; F49-F317 HydrophobicContact CE2-CD2 3.66Å; F49-F317 AromaticContact CE2-CE2 3.58Å; F49-F317 HydrophobicContact CE2-CE2 3.58Å; F49-F317 HydrophobicContact CE2-CZ 4.47Å; I52-F317 HydrophobicContact CG2-CB 3.63Å; D56-F317 VanDerWaalsContact OD1-O 3.05Å; I90-F317 HydrophobicContact CG2-CE1 3.93Å; V91-F317 HydrophobicContact CB-CD1 4.02Å; V91-F317 HydrophobicContact CB-CE1 4Å; V91-F317 HydrophobicContact CG2-CD1 4.03Å; V91-F317 HydrophobicContact CG2-CE1 4.19Å; V91-F317 HydrophobicContact CG2-CG 4.34Å; I94-F317 HydrophobicContact CB-CZ 4.27Å; I94-F317 HydrophobicContact CG2-CZ 4.16Å; W313-F317 HydrophobicContact CB-CE2 4.02Å; W313-F317 HydrophobicContact CB-CZ 4.38Å; W313-F317 HydrophobicContact CE3-CE1 4.24Å; W313-F317 HydrophobicContact CE3-CZ 4.03Å; W313-F317 WeakPolarHBondContact O-CD2 3.4Å; W313-F317 VanDerWaalsContact O-CG 3.29Å; W313-F317 WeakPolarHBondContact O-CG 3.36Å; W313-F317 PolarHBondContact O-N 3.03Å; N314-F317 PolarHBondContact O-N 3.18Å; F317-Q319 VanDerWaalsContact C-N 3.33Å; F317-Q319 PolarHBondContact O-N 3.38Å; F317-S320 PolarHBondContact O-N 3.18Å; F317-S321 WeakPolarHBondContact O-CB 3.23Å; F317-S321 PolarHBondContact O-N 2.05Å
318L94.9Very high92.1Very high66 Ų6626 Ų2635%0.34614%0.138SC..Hα-helixtrans-60.6-45.8175.4-178.262.4000110.8I52 N314 L315 S320 S321 L322I52-L318 HydrophobicContact CD1-CB 4.49Å; I52-L318 HydrophobicContact CG2-CB 4.21Å; N314-L318 VanDerWaalsContact O-CB 3.28Å; N314-L318 WeakPolarHBondContact O-CB 3.5Å; N314-L318 PolarHBondContact O-N 3.2Å; L315-L318 PolarHBondContact O-N 3Å; L318-S320 VanDerWaalsContact C-N 3.34Å; L318-S320 PolarHBondContact O-N 3.34Å; L318-S321 PolarHBondContact O-N 3.38Å; L318-S321 PolarHBondContact O-OG 3.38Å; L318-L322 HydrophobicContact CD1-CD1 4.2Å; L318-L322 HydrophobicContact CD1-CG 4.35Å; L318-L322 HydrophobicContact CG-CD1 4.05Å; L318-L322 VanDerWaalsContact O-CG 3.28Å; L318-L322 WeakPolarHBondContact O-CG 3.17Å; L318-L322 PolarHBondContact O-N 3.08Å
319Q94.4Very high92.1Very high1 Ų130 Ų301%0.00516%0.155CC..Hα-helixtrans-58.2-46.5176.5174.9-91.4-50.500111.9F272 C276 L315 I316 F317 L322 N323F272-Q319 HydrophobicContact CD1-CB 4.24Å; F272-Q319 HydrophobicContact CD1-CG 3.37Å; F272-Q319 HydrophobicContact CE1-CB 3.79Å; F272-Q319 HydrophobicContact CE1-CG 3.42Å; F272-Q319 VanDerWaalsContact CE1-CG 3.42Å; F272-Q319 HydrophobicContact CG-CG 4.02Å; F272-Q319 HydrophobicContact CZ-CB 4.09Å; F272-Q319 HydrophobicContact CZ-CG 4.11Å; C276-Q319 HydrophobicContact CB-CB 4Å; C276-Q319 HydrophobicContact CB-CG 4.43Å; L315-Q319 VanDerWaalsContact O-CB 3.25Å; L315-Q319 WeakPolarHBondContact O-CB 3.46Å; L315-Q319 PolarHBondContact O-N 2.63Å; I316-Q319 PolarHBondContact O-N 3.03Å; F317-Q319 VanDerWaalsContact C-N 3.33Å; F317-Q319 PolarHBondContact O-N 3.38Å; Q319-L322 PolarHBondContact O-N 3.41Å; Q319-N323 PolarHBondContact NE2-ND2 3.32Å; Q319-N323 PolarHBondContact NE2-OD1 3.02Å; Q319-N323 PolarHBondContact O-N 3.18Å; Q319-N323 PolarHBondContact O-OD1 2.86Å
320S94.6Very high91.9Very high2 Ų236 Ų361%0.01418%0.177CC..Hα-helixtrans-64.8-42.2179.7-179.20000111.5D56 N60 D87 I316 F317 L318 L322 N323D56-S320 WeakPolarHBondContact OD1-CB 3.44Å; D56-S320 PolarHBondContact OD1-OG 3.17Å; N60-S320 PolarHBondContact ND2-OG 3.03Å; N60-S320 PolarHBondContact OD1-OG 3.27Å; D87-S320 VanDerWaalsContact CB-OG 3.26Å; D87-S320 WeakPolarHBondContact CB-OG 3.36Å; D87-S320 WeakPolarHBondContact OD2-CB 3.45Å; D87-S320 PolarHBondContact OD2-OG 2.84Å; I316-S320 PolarHBondContact O-N 2.82Å; F317-S320 PolarHBondContact O-N 3.18Å; L318-S320 VanDerWaalsContact C-N 3.34Å; L318-S320 PolarHBondContact O-N 3.34Å; S320-L322 VanDerWaalsContact C-N 3.26Å; S320-L322 PolarHBondContact O-N 3.14Å; S320-N323 WeakPolarHBondContact O-CB 3.36Å; S320-N323 PolarHBondContact O-N 3.19Å; S320-N323 PolarHBondContact O-ND2 3.15Å
321S94.6Very high91.8Very high13 Ų1337.2 Ų37.29%0.09118%0.183CC..Hα-helixtrans-59-35.3174.578.40000113.8D56 S59 F317 L318 N323 I324D56-S321 PolarHBondContact OD1-N 3.24Å; D56-S321 VanDerWaalsContact OD1-N 3.13Å; S59-S321 WeakPolarHBondContact OG-CA 3.35Å; F317-S321 WeakPolarHBondContact O-CB 3.23Å; F317-S321 PolarHBondContact O-N 2.05Å; L318-S321 PolarHBondContact O-N 3.38Å; L318-S321 PolarHBondContact O-OG 3.38Å; S321-N323 VanDerWaalsContact C-N 3.3Å; S321-N323 PolarHBondContact O-N 3.47Å; S321-I324 WeakPolarHBondContact O-CG2 3.48Å
322L94.5Very high91.7Very high72 Ų7240.1 Ų40.138%0.37720%0.2SC..Hα-helixtrans-79.3-9.8179.5-68.9174.5000113.5F272 L318 Q319 S320 I324 V325 L326F272-L322 HydrophobicContact CE1-CB 4.44Å; F272-L322 HydrophobicContact CE1-CD1 4.45Å; F272-L322 HydrophobicContact CZ-CD1 4.27Å; L318-L322 HydrophobicContact CD1-CD1 4.2Å; L318-L322 HydrophobicContact CD1-CG 4.35Å; L318-L322 HydrophobicContact CG-CD1 4.05Å; L318-L322 VanDerWaalsContact O-CG 3.28Å; L318-L322 WeakPolarHBondContact O-CG 3.17Å; L318-L322 PolarHBondContact O-N 3.08Å; Q319-L322 PolarHBondContact O-N 3.41Å; S320-L322 VanDerWaalsContact C-N 3.26Å; S320-L322 PolarHBondContact O-N 3.14Å; L322-I324 PolarHBondContact O-N 2.84Å; L322-V325 HydrophobicContact CD2-CG2 4.38Å; L322-V325 WeakPolarHBondContact O-CB 3.3Å; L322-V325 PolarHBondContact O-N 2.75Å; L322-L326 PolarHBondContact O-N 3.43Å
323N92.2Very high91.4Very high1 Ų146.8 Ų46.81%0.00523%0.229CC..Hα-helixtrans-58.1-35.1177.4-72.6-20.9000112L269 Q319 S320 S321 V325 L326 Y327L269-N323 HydrophobicContact CD1-CB 4.42Å; L269-N323 WeakPolarHBondContact CD1-OD1 3.42Å; Q319-N323 PolarHBondContact NE2-ND2 3.32Å; Q319-N323 PolarHBondContact NE2-OD1 3.02Å; Q319-N323 PolarHBondContact O-N 3.18Å; Q319-N323 PolarHBondContact O-OD1 2.86Å; S320-N323 WeakPolarHBondContact O-CB 3.36Å; S320-N323 PolarHBondContact O-N 3.19Å; S320-N323 PolarHBondContact O-ND2 3.15Å; S321-N323 VanDerWaalsContact C-N 3.3Å; S321-N323 PolarHBondContact O-N 3.47Å; N323-V325 PolarHBondContact O-N 3.16Å; N323-L326 WeakPolarHBondContact O-CB 3.34Å; N323-L326 PolarHBondContact O-N 2.86Å; N323-Y327 HydrophobicContact CB-CD2 4.4Å; N323-Y327 HydrophobicContact CB-CE2 3.69Å; N323-Y327 WeakPolarHBondContact O-CD2 3.06Å; N323-Y327 PolarHBondContact O-N 3.12Å
324I93Very high91.3Very high29 Ų2946.7 Ų46.715%0.14923%0.228CC..Hα-helixtrans-58.6-37.5176.6-165.5168.7000112.3I62 V63 S321 L322 Y327 C328 F334I62-I324 HydrophobicContact CB-CD1 4.15Å; I62-I324 HydrophobicContact CD1-CD1 4.39Å; I62-I324 HydrophobicContact CG2-CD1 3.84Å; V63-I324 HydrophobicContact CG2-CB 3.91Å; V63-I324 HydrophobicContact CG2-CD1 4.32Å; V63-I324 HydrophobicContact CG2-CG1 3.99Å; S321-I324 WeakPolarHBondContact O-CG2 3.48Å; L322-I324 PolarHBondContact O-N 2.84Å; I324-Y327 PolarHBondContact O-N 3.42Å; I324-C328 WeakPolarHBondContact O-CB 3.39Å; I324-C328 PolarHBondContact O-N 2.96Å; I324-F334 HydrophobicContact CG1-CE1 3.95Å; I324-F334 HydrophobicContact CG1-CZ 3.91Å
325V92Very high91.2Very high66 Ų6650.4 Ų50.440%0.424%0.244SC..Hα-helixtrans-67.6-46.7178.2179.30000109.4L322 N323 Y327 C328 F329L322-V325 HydrophobicContact CD2-CG2 4.38Å; L322-V325 WeakPolarHBondContact O-CB 3.3Å; L322-V325 PolarHBondContact O-N 2.75Å; N323-V325 PolarHBondContact O-N 3.16Å; V325-Y327 VanDerWaalsContact C-N 3.33Å; V325-Y327 PolarHBondContact O-N 3.27Å; V325-C328 WeakPolarHBondContact O-CB 3.09Å; V325-C328 PolarHBondContact O-N 3.45Å; V325-F329 HydrophobicContact CG1-CD2 3.67Å; V325-F329 HydrophobicContact CG1-CE2 3.45Å; V325-F329 VanDerWaalsContact CG1-CE2 3.45Å; V325-F329 WeakPolarHBondContact O-CD2 3.41Å; V325-F329 PolarHBondContact O-N 3.24Å
326L88.7Confident91Very high35 Ų3555.2 Ų55.218%0.18326%0.262CS..Hα-helixtrans-59.2-43176.4-175.9146.1000111.6T265 A268 L269 L322 N323 F329 R330T265-L326 HydrophobicContact CG2-CD2 3.56Å; A268-L326 HydrophobicContact CB-CD1 4.44Å; L269-L326 HydrophobicContact CD1-CD2 4.34Å; L322-L326 PolarHBondContact O-N 3.43Å; N323-L326 WeakPolarHBondContact O-CB 3.34Å; N323-L326 PolarHBondContact O-N 2.86Å; L326-F329 PolarHBondContact O-N 2.93Å; L326-R330 VanDerWaalsContact O-CB 3.32Å; L326-R330 WeakPolarHBondContact O-CB 3.38Å; L326-R330 WeakPolarHBondContact O-CG 3.46Å; L326-R330 PolarHBondContact O-N 3.47Å
327Y90.5Very high90.9Very high3 Ų357 Ų571%0.01227%0.272CS..Hα-helixtrans-67-38.3176-56.8-32.8000112.6V63 F67 L80 L269 N323 I324 V325 F329 R330 I331V63-Y327 HydrophobicContact CG1-CD2 4.03Å; V63-Y327 HydrophobicContact CG1-CE2 3.67Å; V63-Y327 HydrophobicContact CG2-CD2 4.02Å; V63-Y327 HydrophobicContact CG2-CE2 4.18Å; F67-Y327 AromaticContact CE2-CD2 3.64Å; F67-Y327 HydrophobicContact CE2-CD2 3.64Å; F67-Y327 AromaticContact CE2-CE2 3.8Å; F67-Y327 HydrophobicContact CE2-CE2 3.8Å; F67-Y327 HydrophobicContact CE2-CG 4.06Å; F67-Y327 HydrophobicContact CZ-CD1 4.4Å; F67-Y327 HydrophobicContact CZ-CD2 4.07Å; F67-Y327 HydrophobicContact CZ-CG 4.01Å; L80-Y327 HydrophobicContact CD1-CE1 4.15Å; L80-Y327 HydrophobicContact CD2-CE1 4.09Å; L269-Y327 HydrophobicContact CD1-CE1 4.25Å; N323-Y327 HydrophobicContact CB-CD2 4.4Å; N323-Y327 HydrophobicContact CB-CE2 3.69Å; N323-Y327 WeakPolarHBondContact O-CD2 3.06Å; N323-Y327 PolarHBondContact O-N 3.12Å; I324-Y327 PolarHBondContact O-N 3.42Å; V325-Y327 VanDerWaalsContact C-N 3.33Å; V325-Y327 PolarHBondContact O-N 3.27Å; Y327-F329 PolarHBondContact O-N 3.31Å; Y327-R330 PolarHBondContact O-N 3.36Å; Y327-I331 HydrophobicContact CD1-CD1 4.08Å; Y327-I331 HydrophobicContact CG-CD1 4.46Å; Y327-I331 WeakPolarHBondContact O-CA 3.38Å; Y327-I331 WeakPolarHBondContact O-CB 3.38Å; Y327-I331 PolarHBondContact O-N 3.27Å
328C90.2Very high90.7Very high30 Ų3059.3 Ų59.320%0.20328%0.284CS..Hα-helixtrans-62.8-41.5176.5-169.50000112.1I324 V325I324-C328 WeakPolarHBondContact O-CB 3.39Å; I324-C328 PolarHBondContact O-N 2.96Å; V325-C328 WeakPolarHBondContact O-CB 3.09Å; V325-C328 PolarHBondContact O-N 3.45Å
329F88.4Confident90.5Very high159 Ų15959.2 Ų59.270%0.69728%0.283SS*.Hα-helixtrans-74-33.6178.1-77.6-62.9000113.7V325 L326 Y327V325-F329 HydrophobicContact CG1-CD2 3.67Å; V325-F329 HydrophobicContact CG1-CE2 3.45Å; V325-F329 VanDerWaalsContact CG1-CE2 3.45Å; V325-F329 WeakPolarHBondContact O-CD2 3.41Å; V325-F329 PolarHBondContact O-N 3.24Å; L326-F329 PolarHBondContact O-N 2.93Å; Y327-F329 PolarHBondContact O-N 3.31Å
330R84.2Confident90.1Very high142 Ų14265.2 Ų65.254%0.53631%0.309SS..Hα-helixtrans-100.7-24.2-170.8-65.8-65-166.3-178.62.4114.6T265 L326 Y327T265-R330 HydrophobicContact CG2-CB 3.59Å; T265-R330 HydrophobicContact CG2-CG 3.83Å; T265-R330 WeakPolarHBondContact OG1-CB 3.45Å; T265-R330 WeakPolarHBondContact OG1-CG 3.44Å; L326-R330 VanDerWaalsContact O-CB 3.32Å; L326-R330 WeakPolarHBondContact O-CB 3.38Å; L326-R330 WeakPolarHBondContact O-CG 3.46Å; L326-R330 PolarHBondContact O-N 3.47Å; Y327-R330 PolarHBondContact O-N 3.36Å
331I86.1Confident89.5Confident25 Ų2569.3 Ų69.313%0.12834%0.336CS..  trans-118.494.3-173.7-52.8172000109.6F67 F77 L80 Y327 K333 F334 K335F67-I331 HydrophobicContact CE1-CD1 4.21Å; F67-I331 HydrophobicContact CZ-CD1 3.88Å; F77-I331 HydrophobicContact CE1-CD1 4.03Å; F77-I331 HydrophobicContact CE1-CG2 4.12Å; F77-I331 HydrophobicContact CZ-CG2 3.9Å; L80-I331 HydrophobicContact CD1-CD1 4.43Å; Y327-I331 HydrophobicContact CD1-CD1 4.08Å; Y327-I331 HydrophobicContact CG-CD1 4.46Å; Y327-I331 WeakPolarHBondContact O-CA 3.38Å; Y327-I331 WeakPolarHBondContact O-CB 3.38Å; Y327-I331 PolarHBondContact O-N 3.27Å; I331-K333 HydrophobicContact CG2-CB 4.46Å; I331-K333 PolarHBondContact O-N 3.22Å; I331-K333 VanDerWaalsContact O-N 3.11Å; I331-F334 HydrophobicContact CB-CB 3.82Å; I331-F334 HydrophobicContact CG2-CB 3.78Å; I331-F334 WeakPolarHBondContact O-CA 3.4Å; I331-F334 VanDerWaalsContact O-CB 3.31Å; I331-F334 WeakPolarHBondContact O-CB 3.2Å; I331-F334 PolarHBondContact O-N 2.88Å; I331-K335 PolarHBondContact O-N 3.37Å
332N86.4Confident88.5Confident116 Ų11674.1 Ų74.162%0.6236%0.36SS*.Hα-helixtrans-54.6-34.9-179.5-74.2-18.1000113.8K336N332-K336 WeakPolarHBondContact O-CB 3.34Å; N332-K336 WeakPolarHBondContact O-CG 3.42Å; N332-K336 PolarHBondContact O-N 3.32Å
333K87.1Confident87.4Confident140 Ų14074 Ų7461%0.60936%0.362SS*.Hα-helixtrans-65.6-41.7176.2-68.4-172.6178.7-175.50112L71 I331 K336 I337L71-K333 HydrophobicContact CD1-CB 4.39Å; L71-K333 HydrophobicContact CD2-CB 4.06Å; L71-K333 HydrophobicContact CD2-CD 4.44Å; I331-K333 HydrophobicContact CG2-CB 4.46Å; I331-K333 PolarHBondContact O-N 3.22Å; I331-K333 VanDerWaalsContact O-N 3.11Å; K333-K336 PolarHBondContact O-N 3.3Å; K333-I337 WeakPolarHBondContact O-CG1 3.25Å; K333-I337 PolarHBondContact O-N 3.39Å
334F89.4Confident86.6Confident0 Ų078 Ų780%038%0.384CS..Hα-helixtrans-62.1-50.5176-177-88.4000110.3V63 I66 F67 L71 I324 I331 K336 I337 L338V63-F334 HydrophobicContact CG2-CE2 4.43Å; V63-F334 HydrophobicContact CG2-CZ 4.08Å; I66-F334 HydrophobicContact CB-CD2 4.08Å; I66-F334 HydrophobicContact CB-CE2 3.76Å; I66-F334 HydrophobicContact CD1-CD2 4.32Å; I66-F334 HydrophobicContact CD1-CE1 4.44Å; I66-F334 HydrophobicContact CD1-CE2 3.77Å; I66-F334 HydrophobicContact CD1-CZ 3.81Å; I66-F334 HydrophobicContact CG1-CE2 4.36Å; I66-F334 HydrophobicContact CG2-CD2 3.41Å; I66-F334 VanDerWaalsContact CG2-CD2 3.41Å; I66-F334 HydrophobicContact CG2-CE2 3.65Å; I66-F334 HydrophobicContact CG2-CG 4.29Å; F67-F334 HydrophobicContact CD1-CD2 4.34Å; F67-F334 HydrophobicContact CD2-CE2 4.46Å; F67-F334 AromaticContact CE1-CD2 3.74Å; F67-F334 HydrophobicContact CE1-CD2 3.74Å; F67-F334 HydrophobicContact CE1-CE2 4.44Å; F67-F334 HydrophobicContact CE2-CD2 4.08Å; F67-F334 HydrophobicContact CE2-CE2 4.03Å; F67-F334 AromaticContact CZ-CD2 3.59Å; F67-F334 HydrophobicContact CZ-CD2 3.59Å; F67-F334 HydrophobicContact CZ-CE2 4.01Å; F67-F334 HydrophobicContact CZ-CG 4.41Å; L71-F334 HydrophobicContact CD1-CB 4.39Å; I324-F334 HydrophobicContact CG1-CE1 3.95Å; I324-F334 HydrophobicContact CG1-CZ 3.91Å; I331-F334 HydrophobicContact CB-CB 3.82Å; I331-F334 HydrophobicContact CG2-CB 3.78Å; I331-F334 WeakPolarHBondContact O-CA 3.4Å; I331-F334 VanDerWaalsContact O-CB 3.31Å; I331-F334 WeakPolarHBondContact O-CB 3.2Å; I331-F334 PolarHBondContact O-N 2.88Å; F334-K336 PolarHBondContact O-N 2.8Å; F334-I337 PolarHBondContact O-N 3.42Å; F334-I337 VanDerWaalsContact O-N 3.16Å; F334-L338 HydrophobicContact CE1-CD2 4.06Å; F334-L338 WeakPolarHBondContact O-CB 3.43Å; F334-L338 PolarHBondContact O-N 2.96Å
335K91.1Very high85.3Confident90 Ų9084.4 Ų84.439%0.39141%0.407SS..Hα-helixtrans-55.1-46.4176.3-179.4175.1180177.50112.8I331 I337 L338 L339I331-K335 PolarHBondContact O-N 3.37Å; K335-I337 VanDerWaalsContact C-N 3.33Å; K335-I337 PolarHBondContact O-N 2.71Å; K335-L338 PolarHBondContact O-N 2.58Å; K335-L339 HydrophobicContact CD-CD1 4.39Å; K335-L339 HydrophobicContact CG-CD1 3.7Å; K335-L339 HydrophobicContact CG-CG 4.33Å; K335-L339 WeakPolarHBondContact O-CB 3.36Å; K335-L339 VanDerWaalsContact O-CG 3.32Å; K335-L339 WeakPolarHBondContact O-CG 3.47Å; K335-L339 PolarHBondContact O-N 2.88Å
336K90.8Very high83.8Confident160 Ų16090.2 Ų90.270%0.69642%0.422SS*.Hα-helixtrans-61-40.3179-77.6-179179.9-171.60112.4N332 K333 F334 K340N332-K336 WeakPolarHBondContact O-CB 3.34Å; N332-K336 WeakPolarHBondContact O-CG 3.42Å; N332-K336 PolarHBondContact O-N 3.32Å; K333-K336 PolarHBondContact O-N 3.3Å; F334-K336 PolarHBondContact O-N 2.8Å; K336-K340 WeakPolarHBondContact O-CB 3.44Å; K336-K340 PolarHBondContact O-N 2.87Å; K336-K340 VanDerWaalsContact O-N 3.13Å
337I90.4Very high82.8Confident44 Ų4493.2 Ų93.223%0.22644%0.438CS..Hα-helixtrans-70.7-46.5178.7-67.6163.3000110.3I66 Y70 L71 K333 F334 K335 L339 K340I66-I337 HydrophobicContact CD1-CG2 4.47Å; I66-I337 HydrophobicContact CG1-CG2 4.15Å; I66-I337 HydrophobicContact CG2-CB 4.43Å; I66-I337 HydrophobicContact CG2-CD1 4.41Å; I66-I337 HydrophobicContact CG2-CG2 4.18Å; Y70-I337 HydrophobicContact CD2-CG2 4.3Å; Y70-I337 HydrophobicContact CG-CG2 4.22Å; L71-I337 HydrophobicContact CD1-CD1 3.99Å; L71-I337 HydrophobicContact CD2-CD1 3.49Å; L71-I337 VanDerWaalsContact CD2-CD1 3.49Å; L71-I337 HydrophobicContact CG-CD1 3.57Å; K333-I337 WeakPolarHBondContact O-CG1 3.25Å; K333-I337 PolarHBondContact O-N 3.39Å; F334-I337 PolarHBondContact O-N 3.42Å; F334-I337 VanDerWaalsContact O-N 3.16Å; K335-I337 VanDerWaalsContact C-N 3.33Å; K335-I337 PolarHBondContact O-N 2.71Å; I337-L339 VanDerWaalsContact C-N 3.3Å; I337-L339 PolarHBondContact O-N 3Å; I337-K340 WeakPolarHBondContact O-CB 3.2Å; I337-K340 PolarHBondContact O-N 3.25Å
338L91.1Very high81.7Confident52 Ų52100.4 Ų100.427%0.27247%0.469SS..Hα-helixtrans-59.3-40.5179.4-173.667.3000112.3I62 I66 F334 K335 P341I62-L338 HydrophobicContact CG2-CD1 3.68Å; I66-L338 HydrophobicContact CD1-CB 4.14Å; I66-L338 HydrophobicContact CD1-CD1 3.86Å; F334-L338 HydrophobicContact CE1-CD2 4.06Å; F334-L338 WeakPolarHBondContact O-CB 3.43Å; F334-L338 PolarHBondContact O-N 2.96Å; K335-L338 PolarHBondContact O-N 2.58Å; L338-P341 WeakPolarHBondContact O-CD 3.35Å
339L90.4Very high80.7Confident63 Ų63102 Ų10233%0.3348%0.478SS..Hα-helixtrans-85.5-9.6-179.3-62.8178.3000113.9K335 I337 P341 L342 T343K335-L339 HydrophobicContact CD-CD1 4.39Å; K335-L339 HydrophobicContact CG-CD1 3.7Å; K335-L339 HydrophobicContact CG-CG 4.33Å; K335-L339 WeakPolarHBondContact O-CB 3.36Å; K335-L339 VanDerWaalsContact O-CG 3.32Å; K335-L339 WeakPolarHBondContact O-CG 3.47Å; K335-L339 PolarHBondContact O-N 2.88Å; I337-L339 VanDerWaalsContact C-N 3.3Å; I337-L339 PolarHBondContact O-N 3Å; L339-P341 VanDerWaalsContact C-CD 3.48Å; L339-L342 HydrophobicContact CD2-CD1 3.78Å; L339-L342 WeakPolarHBondContact O-CB 3.47Å; L339-L342 PolarHBondContact O-N 3.38Å; L339-T343 PolarHBondContact O-N 3.02Å; L339-T343 PolarHBondContact O-OG1 3.21Å
340K87.3Confident79.6Confident128 Ų12897.5 Ų97.556%0.55747%0.466SS*.Hα-helixtrans-54.3-42.9-177.2-172.3178.8179.9-176.40113.1K336 I337 L342 T343 N344K336-K340 WeakPolarHBondContact O-CB 3.44Å; K336-K340 PolarHBondContact O-N 2.87Å; K336-K340 VanDerWaalsContact O-N 3.13Å; I337-K340 WeakPolarHBondContact O-CB 3.2Å; I337-K340 PolarHBondContact O-N 3.25Å; K340-L342 PolarHBondContact O-N 3.31Å; K340-T343 WeakPolarHBondContact CA-OG1 3.4Å; K340-T343 PolarHBondContact O-N 3.26Å; K340-T343 PolarHBondContact O-OG1 3.44Å; K340-N344 WeakPolarHBondContact O-CB 3.22Å; K340-N344 VanDerWaalsContact O-CG 3.27Å; K340-N344 PolarHBondContact O-N 3.04Å
341P80.3Confident78.4Confident87 Ų8794.9 Ų94.957%0.56547%0.466SS*.Hα-helixtrans-61.5-41.7175-2335.3000112.9L338 L339 N344 Y345L338-P341 WeakPolarHBondContact O-CD 3.35Å; L339-P341 VanDerWaalsContact C-CD 3.48Å; P341-N344 PolarHBondContact O-N 3.14Å; P341-Y345 WeakPolarHBondContact O-CB 3.35Å; P341-Y345 PolarHBondContact O-N 2.87Å
342L74.2Confident77Confident115 Ų115101.4 Ų101.460%0.60249%0.494SS*.Hα-helixtrans-67.1-40.5179.4-67.5169.5000112L339 K340 Y345 R346L339-L342 HydrophobicContact CD2-CD1 3.78Å; L339-L342 WeakPolarHBondContact O-CB 3.47Å; L339-L342 PolarHBondContact O-N 3.38Å; K340-L342 PolarHBondContact O-N 3.31Å; L342-Y345 PolarHBondContact O-N 3.2Å; L342-R346 PolarHBondContact O-N 3.4Å
343T72.5Confident75.3Confident70 Ų7098.1 Ų98.143%0.42949%0.487SS..Hα-helixtrans-68.3-38.4175.5500000112.2L339 K340 Y345 R346 N347L339-T343 PolarHBondContact O-N 3.02Å; L339-T343 PolarHBondContact O-OG1 3.21Å; K340-T343 WeakPolarHBondContact CA-OG1 3.4Å; K340-T343 PolarHBondContact O-N 3.26Å; K340-T343 PolarHBondContact O-OG1 3.44Å; T343-Y345 VanDerWaalsContact C-N 3.34Å; T343-R346 PolarHBondContact O-N 3.13Å; T343-N347 VanDerWaalsContact O-CG 3.32Å; T343-N347 PolarHBondContact O-N 3.01Å
344N74.2Confident73.7Confident84 Ų84100 Ų10045%0.44950%0.496SS..Hα-helixtrans-65.7-38.7175.5-76.8-5.9000111.6K340 P341 N347 K348K340-N344 WeakPolarHBondContact O-CB 3.22Å; K340-N344 VanDerWaalsContact O-CG 3.27Å; K340-N344 PolarHBondContact O-N 3.04Å; P341-N344 PolarHBondContact O-N 3.14Å; N344-N347 PolarHBondContact O-N 3.06Å; N344-K348 PolarHBondContact O-N 3.46Å
345Y66Low71.8Confident163 Ų163110.6 Ų110.664%0.63954%0.536SS*.Hα-helixtrans-62.9-47.5173.9-174.3-100.7000111.5P341 L342 T343 N347 K348 T349P341-Y345 WeakPolarHBondContact O-CB 3.35Å; P341-Y345 PolarHBondContact O-N 2.87Å; L342-Y345 PolarHBondContact O-N 3.2Å; T343-Y345 VanDerWaalsContact C-N 3.34Å; Y345-N347 VanDerWaalsContact C-N 3.3Å; Y345-N347 PolarHBondContact O-N 3Å; Y345-K348 PolarHBondContact O-N 3.44Å; Y345-K348 VanDerWaalsContact O-N 3.12Å; Y345-T349 HydrophobicContact CD1-CG2 4.24Å; Y345-T349 HydrophobicContact CE1-CG2 3.8Å; Y345-T349 HydrophobicContact CE2-CG2 4.37Å; Y345-T349 PolarHBondContact O-N 3.42Å; Y345-T349 PolarHBondContact O-OG1 3.35Å
346R59.9Low69.8Low188 Ų188110.9 Ų110.971%0.70955%0.549SS*.Hα-helixtrans-60.8-35.9177.1-170.8176.8179.2177.20.1113.2L342 T343 T349 S350L342-R346 PolarHBondContact O-N 3.4Å; T343-R346 PolarHBondContact O-N 3.13Å; R346-T349 PolarHBondContact O-OG1 3.39Å; R346-T349 VanDerWaalsContact O-OG1 3.13Å; R346-S350 WeakPolarHBondContact O-CB 3.41Å; R346-S350 PolarHBondContact O-N 2.7Å; R346-S350 VanDerWaalsContact O-N 3.07Å; R346-S350 PolarHBondContact O-OG 3.31Å
347N69.2Low67.8Low99 Ų99113.5 Ų113.553%0.52957%0.568SS.*Hα-helixtrans-73.3-31.8176.1-71.6-9.8000112.6T343 N344 Y345 S350 T351T343-N347 VanDerWaalsContact O-CG 3.32Å; T343-N347 PolarHBondContact O-N 3.01Å; N344-N347 PolarHBondContact O-N 3.06Å; Y345-N347 VanDerWaalsContact C-N 3.3Å; Y345-N347 PolarHBondContact O-N 3Å; N347-S350 PolarHBondContact O-OG 2.84Å; N347-S350 VanDerWaalsContact O-OG 3.1Å; N347-T351 WeakPolarHBondContact O-CG2 3.36Å; N347-T351 PolarHBondContact O-N 3.42Å; N347-T351 PolarHBondContact O-OG1 3.43Å
348K67.6Low66.7Low154 Ų154117 Ų11767%0.6759%0.585SS**Hα-helixtrans-70.8-40.6172.7-80.1-174.1176-173.90112N344 Y345 T351 F352N344-K348 PolarHBondContact O-N 3.46Å; Y345-K348 PolarHBondContact O-N 3.44Å; Y345-K348 VanDerWaalsContact O-N 3.12Å; K348-T351 WeakPolarHBondContact CA-OG1 3.26Å; K348-T351 PolarHBondContact O-N 3.12Å; K348-T351 PolarHBondContact O-OG1 3.38Å; K348-F352 PolarHBondContact O-N 3.06Å
349T68.7Low65.4Low64 Ų64120.4 Ų120.439%0.39360%0.602SS.*Hα-helixtrans-71.2-34.917854.30000112.6Y345 R346 T351 F352 G353Y345-T349 HydrophobicContact CD1-CG2 4.24Å; Y345-T349 HydrophobicContact CE1-CG2 3.8Å; Y345-T349 HydrophobicContact CE2-CG2 4.37Å; Y345-T349 PolarHBondContact O-N 3.42Å; Y345-T349 PolarHBondContact O-OG1 3.35Å; R346-T349 PolarHBondContact O-OG1 3.39Å; R346-T349 VanDerWaalsContact O-OG1 3.13Å; T349-T351 VanDerWaalsContact C-N 3.34Å; T349-F352 PolarHBondContact O-N 3.31Å; T349-G353 PolarHBondContact O-N 3.06Å
350S65Low64Low63 Ų63123.6 Ų123.644%0.44162%0.617SS.*Hα-helixtrans-69.9-28.9174.266.50000113.7R346 N347R346-S350 WeakPolarHBondContact O-CB 3.41Å; R346-S350 PolarHBondContact O-N 2.7Å; R346-S350 VanDerWaalsContact O-N 3.07Å; R346-S350 PolarHBondContact O-OG 3.31Å; N347-S350 PolarHBondContact O-OG 2.84Å; N347-S350 VanDerWaalsContact O-OG 3.1Å
351T59.2Low62.6Low87 Ų87123.3 Ų123.353%0.53462%0.62SS.*Hα-helixtrans-78.2-31.5172.942.20000112.5N347 K348 T349N347-T351 WeakPolarHBondContact O-CG2 3.36Å; N347-T351 PolarHBondContact O-N 3.42Å; N347-T351 PolarHBondContact O-OG1 3.43Å; K348-T351 WeakPolarHBondContact CA-OG1 3.26Å; K348-T351 PolarHBondContact O-N 3.12Å; K348-T351 PolarHBondContact O-OG1 3.38Å; T349-T351 VanDerWaalsContact C-N 3.34Å
352F56.3Low61.5Low162 Ų162125.6 Ų125.671%0.71162%0.624SS**Hα-helixtrans-71.9-41.2172.9-123.6-88.5000112.5K348 T349 K354 R355K348-F352 PolarHBondContact O-N 3.06Å; T349-F352 PolarHBondContact O-N 3.31Å; F352-K354 PolarHBondContact O-N 3.43Å; F352-R355 PolarHBondContact O-N 3.19Å
353G51.2Low60.7Low47 Ų47126.3 Ų126.349%0.48563%0.625SS.*THydrogen-bonded Turntrans-66.3-14.7176.400000114.7T349T349-G353 PolarHBondContact O-N 3.06Å
354K52.2Low59.9Low181 Ų181130.3 Ų130.379%0.78764%0.639SS**THydrogen-bonded Turntrans-92.6-6.2172.4-81-171176-172.50114.3F352F352-K354 PolarHBondContact O-N 3.43Å
355R50.1Low58.7Low222 Ų222133.8 Ų133.884%0.83865%0.654SS**SBendtrans-103.23.1178.7-81.8-171.9178.2-176.6-0.8113.8F352F352-R355 PolarHBondContact O-N 3.19Å
356S48.7Very low58.1Low95 Ų95131.4 Ų131.466%0.66466%0.655SS**  trans-112.927-178.963.50000113.9
357I49.6Very low58Low215 Ų215126.3 Ų126.3100%1.10365%0.65SS**  trans-130.70163.3-52.5175.2000105.2

Retrieved 357 of 357 residues in 136.9 ms (Link to these results)

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