A0A087Y8D6_POEFO Loading...

Sphingosine-1-phosphate phosphatase 2

AlphaFold DB , UniProt , Accession A0A087Y8D6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 394 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
1M70.4Confident81.4Confident189 Ų189100.5 Ų100.593%0.93150%0.504SS*.  0-49.90-160-176.6-65.900111.8L4 M5M1-L4 PolarHBondContact O-N 2.71Å; M1-M5 HydrophobicContact CG-CE 4.19Å; M1-M5 PolarHBondContact O-N 2.93Å
2Q77.3Confident81.9Confident164 Ų16496.5 Ų96.577%0.76648%0.482SS*.Hα-helixtrans-61-42.1176.6-75.9174.2-21.900113.9L4 M5 A6Q2-L4 VanDerWaalsContact C-N 3.32Å; Q2-L4 PolarHBondContact O-N 3.05Å; Q2-M5 HydrophobicContact CG-CE 4.28Å; Q2-M5 PolarHBondContact O-N 3.47Å; Q2-A6 WeakPolarHBondContact O-CB 3.31Å; Q2-A6 PolarHBondContact O-N 3.47Å
3E81.1Confident82.4Confident170 Ų17091.2 Ų91.279%0.79446%0.457SS*.Hα-helixtrans-61.3-38.1176.8-66.9-178.3163.300113Y7E3-Y7 WeakPolarHBondContact O-CB 3.37Å; E3-Y7 PolarHBondContact O-N 3.08Å
4L81.9Confident82.8Confident106 Ų10684.7 Ų84.756%0.55542%0.424SS*.Hα-helixtrans-67.5-41.5176.5-179.365000111.5M1 Q2 Y7 L8M1-L4 PolarHBondContact O-N 2.71Å; Q2-L4 VanDerWaalsContact C-N 3.32Å; Q2-L4 PolarHBondContact O-N 3.05Å; L4-Y7 PolarHBondContact O-N 2.94Å; L4-L8 HydrophobicContact CD1-CD1 4.27Å; L4-L8 HydrophobicContact CD1-CG 4.32Å; L4-L8 HydrophobicContact CG-CD1 4.11Å; L4-L8 WeakPolarHBondContact O-CB 3.39Å; L4-L8 VanDerWaalsContact O-CG 3.29Å; L4-L8 WeakPolarHBondContact O-CG 3.34Å; L4-L8 PolarHBondContact O-N 3.49Å
5M80.6Confident83Confident83 Ų8379.5 Ų79.541%0.40940%0.399SS..Hα-helixtrans-65.6-43.2176.8-69.7-173.1-71.400111.4M1 Q2 Y7 L8 Q9M1-M5 HydrophobicContact CG-CE 4.19Å; M1-M5 PolarHBondContact O-N 2.93Å; Q2-M5 HydrophobicContact CG-CE 4.28Å; Q2-M5 PolarHBondContact O-N 3.47Å; M5-Y7 VanDerWaalsContact C-N 3.33Å; M5-Y7 PolarHBondContact O-N 3.26Å; M5-L8 PolarHBondContact O-N 3.34Å; M5-Q9 WeakPolarHBondContact O-CB 3.46Å; M5-Q9 PolarHBondContact O-N 3.03Å
6A81.1Confident83.4Confident65 Ų6582.8 Ų82.854%0.53741%0.405SS..Hα-helixtrans-61-42175.100000111.8Q2 Q9 D10Q2-A6 WeakPolarHBondContact O-CB 3.31Å; Q2-A6 PolarHBondContact O-N 3.47Å; A6-Q9 PolarHBondContact O-N 3.44Å; A6-D10 PolarHBondContact O-N 3.48Å
7Y85.3Confident83.8Confident129 Ų12980.6 Ų80.651%0.50639%0.393SS..Hα-helixtrans-62.6-48.3174.8177.2-103.2000112.1E3 L4 M5 Q9 D10 L13E3-Y7 WeakPolarHBondContact O-CB 3.37Å; E3-Y7 PolarHBondContact O-N 3.08Å; L4-Y7 PolarHBondContact O-N 2.94Å; M5-Y7 VanDerWaalsContact C-N 3.33Å; M5-Y7 PolarHBondContact O-N 3.26Å; Y7-Q9 PolarHBondContact O-N 2.89Å; Y7-D10 WeakPolarHBondContact O-CB 3.33Å; Y7-D10 PolarHBondContact O-N 3Å; Y7-D10 VanDerWaalsContact O-N 3.1Å; Y7-L13 HydrophobicContact CD1-CD1 4.1Å; Y7-L13 HydrophobicContact CE1-CD1 3.88Å; Y7-L13 HydrophobicContact CE1-CD2 4.29Å; Y7-L13 HydrophobicContact CE2-CD1 4.41Å; Y7-L13 HydrophobicContact CE2-CD2 4.01Å; Y7-L13 HydrophobicContact CG-CD1 4.47Å; Y7-L13 WeakPolarHBondContact O-CD1 3.49Å
8L83.1Confident84.1Confident41 Ų4176.4 Ų76.422%0.21537%0.373CS..Hα-helixtrans-68.7-23-178.5-69174.3000113.8L4 M5 V212 L213L4-L8 HydrophobicContact CD1-CD1 4.27Å; L4-L8 HydrophobicContact CD1-CG 4.32Å; L4-L8 HydrophobicContact CG-CD1 4.11Å; L4-L8 WeakPolarHBondContact O-CB 3.39Å; L4-L8 VanDerWaalsContact O-CG 3.29Å; L4-L8 WeakPolarHBondContact O-CG 3.34Å; L4-L8 PolarHBondContact O-N 3.49Å; M5-L8 PolarHBondContact O-N 3.34Å; L8-V212 HydrophobicContact CD2-CB 4.39Å; L8-V212 HydrophobicContact CD2-CG1 3.93Å; L8-V212 PolarHBondContact O-N 3.36Å; L8-L213 HydrophobicContact CB-CB 3.88Å; L8-L213 HydrophobicContact CB-CD1 4.22Å; L8-L213 HydrophobicContact CD1-CD1 4.19Å; L8-L213 PolarHBondContact O-N 2.89Å; L8-L213 VanDerWaalsContact O-N 3.14Å
9Q84.1Confident84.4Confident71 Ų7177.6 Ų77.633%0.33237%0.373SS..Hα-helixtrans-86.9-9.8175-163.5171.6-5.300112.6M5 A6 Y7 P11 L213M5-Q9 WeakPolarHBondContact O-CB 3.46Å; M5-Q9 PolarHBondContact O-N 3.03Å; A6-Q9 PolarHBondContact O-N 3.44Å; Y7-Q9 PolarHBondContact O-N 2.89Å; Q9-P11 WeakPolarHBondContact O-CD 3.48Å; Q9-L213 HydrophobicContact CB-CD2 4.24Å
10D86.2Confident84.6Confident62 Ų6284.8 Ų84.833%0.33240%0.396SS..  trans-60.8117.8-177.5-175.10.8000111.1A6 Y7 E12 L13A6-D10 PolarHBondContact O-N 3.48Å; Y7-D10 WeakPolarHBondContact O-CB 3.33Å; Y7-D10 PolarHBondContact O-N 3Å; Y7-D10 VanDerWaalsContact O-N 3.1Å; D10-E12 PolarHBondContact O-N 3.29Å; D10-E12 VanDerWaalsContact O-N 3.12Å; D10-E12 VanDerWaalsContact OD1-CB 3.32Å; D10-E12 WeakPolarHBondContact OD1-CB 3.41Å; D10-E12 PolarHBondContact OD1-N 3.17Å; D10-L13 HydrophobicContact CB-CG 4.43Å; D10-L13 WeakPolarHBondContact O-CB 3.28Å; D10-L13 PolarHBondContact O-N 3.49Å; D10-L13 VanDerWaalsContact O-N 3.1Å
11P84.7Confident84.8Confident26 Ų2681.1 Ų81.117%0.16938%0.38CS..Hα-helixtrans-60.2-21.6177.324.9-35.2000113.2Q9 L13 V14 A15 P141 P142 P145 V146Q9-P11 WeakPolarHBondContact O-CD 3.48Å; P11-L13 VanDerWaalsContact C-N 3.26Å; P11-L13 PolarHBondContact O-N 3.33Å; P11-V14 PolarHBondContact O-N 3.46Å; P11-A15 PolarHBondContact O-N 3.18Å; P11-P141 HydrophobicContact CB-CB 4.17Å; P11-P142 HydrophobicContact CB-CG 4.13Å; P11-P142 HydrophobicContact CG-CG 3.89Å; P11-P145 HydrophobicContact CB-CG 4.15Å; P11-P145 HydrophobicContact CG-CG 4.45Å; P11-V146 HydrophobicContact CB-CG2 3.92Å; P11-V146 WeakPolarHBondContact O-CG2 3.43Å
12E87.4Confident85.4Confident52 Ų5272.5 Ų72.524%0.24334%0.339CS..Hα-helixtrans-66.1-29.1177.4-172.860-166.300112.1D10 A15 R16 R19D10-E12 PolarHBondContact O-N 3.29Å; D10-E12 VanDerWaalsContact O-N 3.12Å; D10-E12 VanDerWaalsContact OD1-CB 3.32Å; D10-E12 WeakPolarHBondContact OD1-CB 3.41Å; D10-E12 PolarHBondContact OD1-N 3.17Å; E12-A15 PolarHBondContact O-N 3.43Å; E12-R16 HydrophobicContact CG-CG 4.44Å; E12-R16 WeakPolarHBondContact O-CB 3.48Å; E12-R16 WeakPolarHBondContact O-CG 3.45Å; E12-R16 PolarHBondContact O-N 3.22Å; E12-R16 IonicContact OE1-NE 3.66Å; E12-R19 IonicContact OE1-CZ 2.95Å; E12-R19 IonicContact OE1-NH1 2.66Å; E12-R19 IonicContact OE1-NH2 3.51Å; E12-R19 PolarHBondContact OE1-NH2 3.48Å; E12-R19 IonicContact OE2-NH2 3.15Å
13L87.9Confident85.9Confident28 Ų2864.8 Ų64.815%0.14730%0.303CS..Hα-helixtrans-63-43.9172.7-71.3-179.1000111.7Y7 D10 P11 R16 F17 V212Y7-L13 HydrophobicContact CD1-CD1 4.1Å; Y7-L13 HydrophobicContact CE1-CD1 3.88Å; Y7-L13 HydrophobicContact CE1-CD2 4.29Å; Y7-L13 HydrophobicContact CE2-CD1 4.41Å; Y7-L13 HydrophobicContact CE2-CD2 4.01Å; Y7-L13 HydrophobicContact CG-CD1 4.47Å; Y7-L13 WeakPolarHBondContact O-CD1 3.49Å; D10-L13 HydrophobicContact CB-CG 4.43Å; D10-L13 WeakPolarHBondContact O-CB 3.28Å; D10-L13 PolarHBondContact O-N 3.49Å; D10-L13 VanDerWaalsContact O-N 3.1Å; P11-L13 VanDerWaalsContact C-N 3.26Å; P11-L13 PolarHBondContact O-N 3.33Å; L13-R16 PolarHBondContact O-N 3.45Å; L13-F17 WeakPolarHBondContact O-CB 3.4Å; L13-F17 PolarHBondContact O-N 3.18Å; L13-V212 HydrophobicContact CB-CG2 4.24Å; L13-V212 HydrophobicContact CD1-CG2 4.34Å
14V87.8Confident86.1Confident0 Ų060.4 Ų60.40%028%0.28CS..Hα-helixtrans-66.2-44.5178.2-176.30000109.8P11 R16 F17 Q18 V146 L205P11-V14 PolarHBondContact O-N 3.46Å; V14-R16 PolarHBondContact O-N 2.96Å; V14-F17 WeakPolarHBondContact O-CB 3.33Å; V14-F17 PolarHBondContact O-N 2.95Å; V14-Q18 WeakPolarHBondContact O-CG 3.42Å; V14-Q18 PolarHBondContact O-N 3.01Å; V14-V146 HydrophobicContact CB-CG2 3.92Å; V14-V146 HydrophobicContact CG1-CG1 3.89Å; V14-V146 HydrophobicContact CG1-CG2 4.07Å; V14-L205 WeakPolarHBondContact CG1-O 3.49Å; V14-L205 HydrophobicContact CG2-CD2 4.46Å
15A86.1Confident85.8Confident6 Ų659.7 Ų59.75%0.0527%0.27CS..Hα-helixtrans-64.1-37.2176.700000112.7P11 E12 R19 P145 V146P11-A15 PolarHBondContact O-N 3.18Å; E12-A15 PolarHBondContact O-N 3.43Å; A15-R19 WeakPolarHBondContact O-CB 3.29Å; A15-R19 WeakPolarHBondContact O-CG 3.24Å; A15-R19 PolarHBondContact O-N 3.43Å; A15-R19 PolarHBondContact O-NE 3.23Å; A15-P145 HydrophobicContact CB-CB 4.22Å; A15-P145 HydrophobicContact CB-CG 4.32Å; A15-V146 HydrophobicContact CB-CG2 4.49Å
16R89.4Confident85.7Confident132 Ų13258.3 Ų58.350%0.49827%0.266SS..Hα-helixtrans-65.1-41.9172.5-75.5174.4-172.6-175.25.8111.6E12 L13 V14 R19 R20E12-R16 HydrophobicContact CG-CG 4.44Å; E12-R16 WeakPolarHBondContact O-CB 3.48Å; E12-R16 WeakPolarHBondContact O-CG 3.45Å; E12-R16 PolarHBondContact O-N 3.22Å; E12-R16 IonicContact OE1-NE 3.66Å; L13-R16 PolarHBondContact O-N 3.45Å; V14-R16 PolarHBondContact O-N 2.96Å; R16-R19 PolarHBondContact O-N 2.9Å; R16-R20 WeakPolarHBondContact O-CG 3.2Å; R16-R20 PolarHBondContact O-N 2.85Å
17F89.9Confident84.7Confident47 Ų4763.2 Ų63.221%0.20628%0.278CS..Hα-helixtrans-61.7-48.5175.2179.2-104.7000111.4L13 V14 R19 R20 C21 F87 L202 L205L13-F17 WeakPolarHBondContact O-CB 3.4Å; L13-F17 PolarHBondContact O-N 3.18Å; V14-F17 WeakPolarHBondContact O-CB 3.33Å; V14-F17 PolarHBondContact O-N 2.95Å; F17-R19 PolarHBondContact O-N 2.95Å; F17-R20 WeakPolarHBondContact O-CB 3.46Å; F17-R20 PolarHBondContact O-N 3.49Å; F17-R20 VanDerWaalsContact O-N 3.16Å; F17-C21 PolarHBondContact O-N 2.97Å; F17-C21 PolarHBondContact O-SG 3.39Å; F17-C21 VanDerWaalsContact O-SG 3.35Å; F17-F87 HydrophobicContact CZ-CE1 4.4Å; F17-F87 HydrophobicContact CZ-CE2 4.45Å; F17-F87 AromaticContact CZ-CZ 3.93Å; F17-F87 HydrophobicContact CZ-CZ 3.93Å; F17-L202 HydrophobicContact CE2-CD2 4.16Å; F17-L202 HydrophobicContact CZ-CB 4.16Å; F17-L202 HydrophobicContact CZ-CD2 4.03Å; F17-L205 HydrophobicContact CD1-CB 3.71Å; F17-L205 HydrophobicContact CE1-CB 3.86Å
18Q89.7Confident83.1Confident4 Ų459.8 Ų59.82%0.01928%0.282CS..Hα-helixtrans-55-48.2175.4-74.4-177.6-31.800112V14 R20 C21 G22 L23 V147 Y206V14-Q18 WeakPolarHBondContact O-CG 3.42Å; V14-Q18 PolarHBondContact O-N 3.01Å; Q18-R20 PolarHBondContact O-N 3.37Å; Q18-C21 CarbonylContact O-C 3.49Å; Q18-C21 WeakPolarHBondContact O-CA 3.32Å; Q18-C21 PolarHBondContact O-N 3.21Å; Q18-C21 VanDerWaalsContact O-N 3.1Å; Q18-G22 PolarHBondContact O-N 3.49Å; Q18-G22 VanDerWaalsContact O-N 3.15Å; Q18-L23 CarbonylContact C-O 3.59Å; Q18-L23 HydrophobicContact CB-CB 4.2Å; Q18-L23 HydrophobicContact CB-CD2 4.25Å; Q18-L23 HydrophobicContact CG-CD2 4.08Å; Q18-L23 PolarHBondContact O-N 3.09Å; Q18-V147 PolarHBondContact NE2-O 2.84Å; Q18-Y206 PolarHBondContact NE2-O 3.22Å
19R89Confident80.7Confident99 Ų9963.2 Ų63.237%0.37431%0.309SS..Hα-helixtrans-61.4-41.2177.3-75-179.3-71.3-161.2-0.7112.6E12 A15 R16 F17 C21 G22 L23 Y24E12-R19 IonicContact OE1-CZ 2.95Å; E12-R19 IonicContact OE1-NH1 2.66Å; E12-R19 IonicContact OE1-NH2 3.51Å; E12-R19 PolarHBondContact OE1-NH2 3.48Å; E12-R19 IonicContact OE2-NH2 3.15Å; A15-R19 WeakPolarHBondContact O-CB 3.29Å; A15-R19 WeakPolarHBondContact O-CG 3.24Å; A15-R19 PolarHBondContact O-N 3.43Å; A15-R19 PolarHBondContact O-NE 3.23Å; R16-R19 PolarHBondContact O-N 2.9Å; F17-R19 PolarHBondContact O-N 2.95Å; R19-C21 VanDerWaalsContact C-N 3.27Å; R19-C21 PolarHBondContact O-N 2.94Å; R19-G22 PolarHBondContact O-N 3.23Å; R19-L23 WeakPolarHBondContact CA-O 3.34Å; R19-L23 PolarHBondContact N-O 2.85Å; R19-Y24 HydrophobicContact CB-CD1 4.49Å; R19-Y24 HydrophobicContact CB-CE1 4.06Å; R19-Y24 HydrophobicContact CG-CD1 3.85Å; R19-Y24 HydrophobicContact CG-CE1 3.87Å; R19-Y24 PolarHBondContact O-OH 3.44Å
20R89.8Confident78.1Confident221 Ų22167 Ų6783%0.83433%0.332SS*.Hα-helixtrans-62.6-35.1174.4-76.6-177.7178.2-175.60.2112.4R16 F17 Q18 G22R16-R20 WeakPolarHBondContact O-CG 3.2Å; R16-R20 PolarHBondContact O-N 2.85Å; F17-R20 WeakPolarHBondContact O-CB 3.46Å; F17-R20 PolarHBondContact O-N 3.49Å; F17-R20 VanDerWaalsContact O-N 3.16Å; Q18-R20 PolarHBondContact O-N 3.37Å; R20-G22 PolarHBondContact O-N 3.12Å
21C87.1Confident75.6Confident9 Ų970.1 Ų70.16%0.06136%0.355CS..THydrogen-bonded Turntrans-80.85.9174.6-61.50000113.3F17 Q18 R19 L83 F87 Y206F17-C21 PolarHBondContact O-N 2.97Å; F17-C21 PolarHBondContact O-SG 3.39Å; F17-C21 VanDerWaalsContact O-SG 3.35Å; Q18-C21 CarbonylContact O-C 3.49Å; Q18-C21 WeakPolarHBondContact O-CA 3.32Å; Q18-C21 PolarHBondContact O-N 3.21Å; Q18-C21 VanDerWaalsContact O-N 3.1Å; R19-C21 VanDerWaalsContact C-N 3.27Å; R19-C21 PolarHBondContact O-N 2.94Å; C21-L83 HydrophobicContact CB-CD1 4.44Å; C21-F87 HydrophobicContact CB-CE2 4.08Å; C21-F87 VanDerWaalsContact SG-CE2 3.57Å; C21-Y206 HydrophobicContact CB-CD2 3.64Å; C21-Y206 HydrophobicContact CB-CE2 3.47Å; C21-Y206 VanDerWaalsContact CB-CE2 3.47Å
22G84.7Confident72.9Confident7 Ų771.4 Ų71.47%0.07237%0.373CS..THydrogen-bonded Turntrans81.218176.200000114.8Q18 R19 R20 V78 R79Q18-G22 PolarHBondContact O-N 3.49Å; Q18-G22 VanDerWaalsContact O-N 3.15Å; R19-G22 PolarHBondContact O-N 3.23Å; R20-G22 PolarHBondContact O-N 3.12Å; G22-V78 CarbonylContact O-C 3.42Å; G22-V78 WeakPolarHBondContact O-CA 3.47Å; G22-R79 PolarHBondContact O-N 3.24Å
23L87.1Confident70.3Confident2 Ų275.1 Ų75.11%0.0140%0.402CS..EExtended strand (participates in β ladder)trans-100.4117.6173.4-175.269000109.7Q18 R19 Y76 V78 V147 L149 Y206Q18-L23 CarbonylContact C-O 3.59Å; Q18-L23 HydrophobicContact CB-CB 4.2Å; Q18-L23 HydrophobicContact CB-CD2 4.25Å; Q18-L23 HydrophobicContact CG-CD2 4.08Å; Q18-L23 PolarHBondContact O-N 3.09Å; R19-L23 WeakPolarHBondContact CA-O 3.34Å; R19-L23 PolarHBondContact N-O 2.85Å; L23-Y76 HydrophobicContact CD1-CD2 3.61Å; L23-Y76 HydrophobicContact CD1-CE2 4.38Å; L23-Y76 HydrophobicContact CD1-CG 4.15Å; L23-V78 HydrophobicContact CD1-CG2 3.92Å; L23-V147 HydrophobicContact CD2-CB 4.14Å; L23-V147 HydrophobicContact CD2-CG1 4.26Å; L23-L149 HydrophobicContact CD2-CD1 4.05Å; L23-L149 HydrophobicContact CD2-CG 4.37Å; L23-Y206 HydrophobicContact CB-CE2 3.94Å; L23-Y206 HydrophobicContact CD2-CE1 4.42Å; L23-Y206 HydrophobicContact CD2-CE2 4.33Å
24Y84.3Confident67.7Low78 Ų7877.7 Ų77.731%0.30644%0.435SS..EExtended strand (participates in β ladder)trans-118.7142.4-179.9-63.4-93.9000110.1R19 Y76 E77 R79R19-Y24 HydrophobicContact CB-CD1 4.49Å; R19-Y24 HydrophobicContact CB-CE1 4.06Å; R19-Y24 HydrophobicContact CG-CD1 3.85Å; R19-Y24 HydrophobicContact CG-CE1 3.87Å; R19-Y24 PolarHBondContact O-OH 3.44Å; Y24-Y76 CarbonylContact O-C 3.5Å; Y24-Y76 VanDerWaalsContact O-CA 3.23Å; Y24-Y76 WeakPolarHBondContact O-CA 3.31Å; Y24-Y76 WeakPolarHBondContact O-CB 3.43Å; Y24-E77 PolarHBondContact N-O 3.33Å; Y24-E77 PolarHBondContact O-N 3.11Å; Y24-R79 HydrophobicContact CD2-CG 4.04Å; Y24-R79 HydrophobicContact CE2-CB 4.3Å; Y24-R79 HydrophobicContact CE2-CG 3.96Å
25R76.9Confident64.8Low91 Ų9189 Ų8934%0.34348%0.477SS..EExtended strand (participates in β ladder)trans-79.7129.6169.9-174.3176.9171.8139.9-3.6108.8E27 S143 P144 V147R25-E27 PolarHBondContact O-N 3.36Å; R25-S143 PolarHBondContact NH1-OG 3.28Å; R25-P144 VanDerWaalsContact NH1-CB 3.27Å; R25-V147 HydrophobicContact CB-CG2 3.69Å; R25-V147 HydrophobicContact CG-CG2 4.22Å
26V77.4Confident62Low55 Ų5594 Ų9433%0.33351%0.512SS..  trans-85.9108.9166.8-177.20000106.2G28 Q75 E77V26-G28 PolarHBondContact O-N 3.03Å; V26-G28 VanDerWaalsContact O-N 3.13Å; V26-Q75 HydrophobicContact CB-CB 3.82Å; V26-Q75 WeakPolarHBondContact CB-O 3.46Å; V26-Q75 HydrophobicContact CG1-CB 4.32Å; V26-Q75 HydrophobicContact CG2-CB 4.43Å; V26-Q75 PolarHBondContact N-O 3.4Å; V26-E77 HydrophobicContact CG2-CB 3.95Å
27E61.9Low58.9Low168 Ų16899.4 Ų99.479%0.78553%0.533SS*.  trans-64.7114.3168.9-76.1-179.2170.400108R25 S29R25-E27 PolarHBondContact O-N 3.36Å; E27-S29 PolarHBondContact O-N 2.9Å
28G50.8Low55.9Low57 Ų57103.1 Ų103.159%0.58856%0.561SS**  trans-54.7125170.300000108.3V26 N30V26-G28 PolarHBondContact O-N 3.03Å; V26-G28 VanDerWaalsContact O-N 3.13Å; G28-N30 PolarHBondContact O-N 3.45Å
29S32.2Very low53.2Low112 Ų112106.8 Ų106.878%0.78359%0.592SS**  trans-33.5120.6173.653.10000111.7E27E27-S29 PolarHBondContact O-N 2.9Å
30N30.8Very low50.2Low152 Ų152110 Ų11081%0.81362%0.617SS**  trans-42.2127.4163.2-96.1-19.4000109.1G28 G32G28-N30 PolarHBondContact O-N 3.45Å; N30-G32 PolarHBondContact O-N 3.36Å
31P31.8Very low47.1Very low126 Ų126103 Ų10382%0.81861%0.614SS**  trans-67.797.2157.225.3-20.9000105.6
32G29.3Very low44.2Very low53 Ų53107.2 Ų107.255%0.54665%0.649SS.*  trans-52.9151.4168.900000110.2N30 G34N30-G32 PolarHBondContact O-N 3.36Å; G32-G34 PolarHBondContact O-N 3.01Å
33P31.9Very low41.5Very low131 Ų131112.8 Ų112.885%0.85168%0.684SS**SBendtrans-60.7138.2-170.627-32.6000109.8R35P33-R35 PolarHBondContact O-N 3.43Å
34G34.6Very low38.7Very low81 Ų81120 Ų12084%0.83572%0.721SS**  trans-44.3130-17000000114.1G32G32-G34 PolarHBondContact O-N 3.01Å
35R26.6Very low36.1Very low238 Ų238123.2 Ų123.290%0.89875%0.749SS**  trans-131.4121.7154.3-94.3179.8174.2175.2-2109.2P33P33-R35 PolarHBondContact O-N 3.43Å
36S27.1Very low33.7Very low112 Ų112130 Ų13078%0.78378%0.775SS**  trans-30.6132.6170.431.50000114.6
37R24.5Very low31.2Very low245 Ų245136.4 Ų136.493%0.92580%0.801SS**  trans-57.5149158.9-74.7176.7165.8176.2-4.8109.9
38P27.2Very low29.5Very low124 Ų124137.8 Ų137.881%0.80580%0.804SS**  -120.8151.8122.229-18.3000111.4
39A31.2Very low28.4Very low82 Ų82141 Ų14168%0.67882%0.815SS**  trans-72.1140.417800000111.8
40N26.1Very low28.3Very low166 Ų166147.7 Ų147.789%0.88882%0.823SS**  trans153.6137.2131.9-81.1-15.2000112.3
41G25.7Very low28.3Very low75 Ų75144 Ų14477%0.77382%0.82SS**  trans108.1103.2142.100000119.6
42A25.8Very low28.3Very low96 Ų96146.4 Ų146.479%0.79382%0.821SS**  trans74.5141.6146.400000121.5
43P28.3Very low28.5Very low124 Ų124151 Ų15181%0.80583%0.831SS**  trans-88.9123.4-175.334.5-28.6000111.2
44I27.8Very low28.5Very low155 Ų155152.8 Ų152.880%0.79583%0.829SS**  trans-108.3116.2167.2-62.1177.2000107.8R46I44-R46 PolarHBondContact O-N 3.05Å; I44-R46 VanDerWaalsContact O-N 3.15Å
45T30Very low28.3Very low144 Ų144151.3 Ų151.388%0.88381%0.813SS**  trans-52.2109.1172.4-33.70000109.7
46R27Very low28.3Very low235 Ų235144.5 Ų144.589%0.88780%0.802SS**PPolyproline II helixtrans-103.4120.7170.2-94.8-176.6173.5177.3-1.4109.7I44I44-R46 PolarHBondContact O-N 3.05Å; I44-R46 VanDerWaalsContact O-N 3.15Å
47E25.5Very low28.5Very low189 Ų189149.4 Ų149.488%0.88380%0.804SS**PPolyproline II helixtrans-50.4134.6170.7-67.5175.813700111.3
48K24.5Very low28.8Very low196 Ų196143.7 Ų143.785%0.85279%0.792SS**PPolyproline II helixtrans-66.2128.8172.1-78.2176.9173.8177.90109.5R50K48-R50 PolarHBondContact O-N 3.39Å
49P28.7Very low29.1Very low125 Ų125147.7 Ų147.781%0.81279%0.791SS**PPolyproline II helixtrans-64.5125.2161.7-10.926.1000108.4
50R30.2Very low29.6Very low253 Ų253150.7 Ų150.796%0.95579%0.79SS**SBendtrans-57.3133174.1-81.8173.2166.1172.1-4.4110.6K48K48-R50 PolarHBondContact O-N 3.39Å
51G30.9Very low30.2Very low73 Ų73144.6 Ų144.675%0.75376%0.758SS**  trans104.539.3153.500000117.7L53G51-L53 PolarHBondContact O-N 3.25Å
52Q30.7Very low31.2Very low178 Ų178145.4 Ų145.483%0.83275%0.752SS**  trans-8185.9161.4-126.9176.9-13.500108.5E54Q52-E54 PolarHBondContact O-N 2.91Å
53L34.1Very low32.2Very low148 Ų148141 Ų14178%0.77572%0.715SS**  trans-82.992.7163.2-95.9147.7000106.7G51 G55G51-L53 PolarHBondContact O-N 3.25Å; L53-G55 PolarHBondContact O-N 3.02Å
54E31.7Very low33.3Very low170 Ų170136.5 Ų136.579%0.79469%0.687SS**  trans-53.5105.9159.1-74.3-174.9145.700107Q52 S56Q52-E54 PolarHBondContact O-N 2.91Å; E54-S56 PolarHBondContact O-N 3.44Å
55G30.7Very low34.6Very low49 Ų49130.1 Ų130.151%0.50565%0.654SS.*  trans-65.383.8175.300000109.5L53 W57L53-G55 PolarHBondContact O-N 3.02Å; G55-W57 PolarHBondContact O-N 3.39Å
56S27.9Very low35.5Very low96 Ų96127.7 Ų127.767%0.67163%0.629SS**  trans-70.364.3170.9172.20000110.2E54E54-S56 PolarHBondContact O-N 3.44Å
57W30.5Very low36.5Very low214 Ų214122.8 Ų122.881%0.81162%0.617SS**  trans-121.211170.3-65.2101.9000112.8G55 R59G55-W57 PolarHBondContact O-N 3.39Å; W57-R59 PolarHBondContact O-N 3.43Å
58D31.1Very low37.6Very low126 Ų126118.8 Ų118.867%0.67459%0.594SS**  trans-70.48.9167.2-80.5-25.6000112.5Q60 K73D58-Q60 PolarHBondContact O-N 2.9Å; D58-Q60 VanDerWaalsContact O-N 3.09Å; D58-K73 IonicContact OD2-NZ 2.7Å; D58-K73 PolarHBondContact OD2-NZ 3.13Å
59R32.9Very low38.4Very low208 Ų208117.9 Ų117.979%0.78559%0.593SS**  trans-75.5103.1170.5-102.7-174.4-167.71744.8109.9W57W57-R59 PolarHBondContact O-N 3.43Å
60Q41.1Very low38.8Very low144 Ų144119.9 Ų119.967%0.67360%0.597SS**  105.884.2115.6-153.3153.42.400115.3D58D58-Q60 PolarHBondContact O-N 2.9Å; D58-Q60 VanDerWaalsContact O-N 3.09Å
61D40.3Very low39.2Very low38 Ų38112.1 Ų112.120%0.20358%0.58CS.*  trans-135.790.1151.4-121.9-10.8000108.9N63 R152D61-N63 PolarHBondContact O-N 2.89Å; D61-R152 IonicContact OD2-CZ 2.64Å; D61-R152 IonicContact OD2-NH1 3.94Å; D61-R152 PolarHBondContact OD2-NH1 3.05Å; D61-R152 IonicContact OD2-NH2 3.91Å
62S45Very low40.1Very low92 Ų92118.5 Ų118.564%0.64359%0.587SS**THydrogen-bonded Turntrans-70.322.9179.6-51.40000113.5R338S62-R338 PolarHBondContact O-NH1 3.4Å; S62-R338 PolarHBondContact O-NH2 2.81Å
63N48.5Very low41.1Very low3 Ų3117.1 Ų117.12%0.01658%0.578CS.*THydrogen-bonded Turntrans-106.7-20.9-172.4-158.236.3000114.2D61 E96 R334 R338 Y373D61-N63 PolarHBondContact O-N 2.89Å; N63-E96 PolarHBondContact ND2-OE2 3.4Å; N63-R334 VanDerWaalsContact CB-NH2 3.32Å; N63-R334 PolarHBondContact ND2-NH2 3.49Å; N63-R338 PolarHBondContact OD1-NH1 2.79Å; N63-Y373 PolarHBondContact ND2-OH 3.01Å
64S51.3Low42.2Very low31 Ų31112.3 Ų112.322%0.21756%0.556CS.*  trans-77.7130.4173.151.50000110.6Y66S64-Y66 PolarHBondContact O-N 3.3Å
65N54.4Low44.1Very low21 Ų21110.1 Ų110.111%0.11255%0.546CS..  trans-83.66.8170.4-58.2-40.6000112.1Y267 R359 R360 E365N65-Y267 HydrophobicContact CB-CE1 4.23Å; N65-Y267 WeakPolarHBondContact CB-OH 3.42Å; N65-R359 PolarHBondContact ND2-O 2.73Å; N65-R359 WeakPolarHBondContact OD1-CD 3.22Å; N65-R359 PolarHBondContact OD1-NE 2.87Å; N65-R359 PolarHBondContact OD1-NH1 2.86Å; N65-R360 HydrophobicContact CB-CG 4.18Å; N65-R360 PolarHBondContact O-NE 3.34Å; N65-R360 PolarHBondContact O-NH2 2.88Å; N65-E365 PolarHBondContact ND2-OE1 2.89Å
66Y49.3Very low46.5Very low92 Ų92112.7 Ų112.736%0.36154%0.541SS..  trans-85.8128176.9-158.8-92.2000109.9S64 A155 Y267S64-Y66 PolarHBondContact O-N 3.3Å; Y66-A155 HydrophobicContact CE2-CB 3.83Å; Y66-Y267 HydrophobicContact CD2-CD1 4.19Å; Y66-Y267 HydrophobicContact CD2-CE1 4.44Å
67Q47.7Very low49.2Very low133 Ų133112.2 Ų112.262%0.62153%0.528SS*.  trans-118.6122.1179.1-164.2171.1-900107.5
68Y48.2Very low51.9Low104 Ų104103 Ų10341%0.40850%0.495SS..  trans-71144.8-176.8-174.7-104.9000111.5C71Y68-C71 WeakPolarHBondContact OH-CB 3.43Å; Y68-C71 PolarHBondContact OH-N 2.72Å; Y68-C71 PolarHBondContact OH-O 2.92Å
69Q41.6Very low54.5Low178 Ų178104.7 Ų104.783%0.83249%0.492SS*.  trans-104.6118.8172.3-162.3164.81.600107.7C71Q69-C71 PolarHBondContact O-N 2.91Å
70D36.2Very low57.2Low167 Ų16797.6 Ų97.689%0.89347%0.47SS*.  trans-50.1100.5-170.9-93.4-34.7000113
71C39.8Very low59.5Low90 Ų9097.9 Ų97.961%0.60847%0.465SS*.  trans-110.5130.8163.3-140.60000108.1Y68 Q69 K73Y68-C71 WeakPolarHBondContact OH-CB 3.43Å; Y68-C71 PolarHBondContact OH-N 2.72Å; Y68-C71 PolarHBondContact OH-O 2.92Å; Q69-C71 PolarHBondContact O-N 2.91Å; C71-K73 PolarHBondContact O-N 3.46Å; C71-K73 VanDerWaalsContact O-N 3.1Å
72K48.3Very low61.9Low207 Ų207103.2 Ų103.290%0.949%0.493SS*.  trans-44.9116.2-171.7-69.1175.5177.9176.50111.3
73K53.4Low64Low148 Ų148101.4 Ų101.464%0.64348%0.476SS*.PPolyproline II helixtrans-55.1125.1177.7-70.6-173.6175.4-170.20109D58 C71 Q75D58-K73 IonicContact OD2-NZ 2.7Å; D58-K73 PolarHBondContact OD2-NZ 3.13Å; C71-K73 PolarHBondContact O-N 3.46Å; C71-K73 VanDerWaalsContact O-N 3.1Å; K73-Q75 PolarHBondContact O-N 2.97Å
74P56.2Low65.9Low47 Ų47102.2 Ų102.231%0.30548%0.479SS..PPolyproline II helixtrans-62.5127.6176.224.2-31.1000108.9Y76P74-Y76 PolarHBondContact O-N 3.44Å
75Q72.3Confident67.8Low125 Ų125107.5 Ų107.558%0.58450%0.499SS*.PPolyproline II helixtrans-69.1131.7173-74.6178.5-15.300108.6V26 K73V26-Q75 HydrophobicContact CB-CB 3.82Å; V26-Q75 WeakPolarHBondContact CB-O 3.46Å; V26-Q75 HydrophobicContact CG1-CB 4.32Å; V26-Q75 HydrophobicContact CG2-CB 4.43Å; V26-Q75 PolarHBondContact N-O 3.4Å; K73-Q75 PolarHBondContact O-N 2.97Å
76Y80.4Confident69.6Low102 Ų102109.9 Ų109.940%0.451%0.511SS..EExtended strand (participates in β ladder)trans-130.3148.1177.861.7-92.4000109.9L23 Y24 P74 V78 V147 L149L23-Y76 HydrophobicContact CD1-CD2 3.61Å; L23-Y76 HydrophobicContact CD1-CE2 4.38Å; L23-Y76 HydrophobicContact CD1-CG 4.15Å; Y24-Y76 CarbonylContact O-C 3.5Å; Y24-Y76 VanDerWaalsContact O-CA 3.23Å; Y24-Y76 WeakPolarHBondContact O-CA 3.31Å; Y24-Y76 WeakPolarHBondContact O-CB 3.43Å; P74-Y76 PolarHBondContact O-N 3.44Å; Y76-V78 HydrophobicContact CD2-CG2 3.76Å; Y76-V78 HydrophobicContact CE2-CG2 3.75Å; Y76-V147 HydrophobicContact CD1-CG1 4.27Å; Y76-V147 HydrophobicContact CG-CG1 4.21Å; Y76-L149 HydrophobicContact CD1-CD2 4.21Å; Y76-L149 HydrophobicContact CD2-CD2 4.43Å; Y76-L149 HydrophobicContact CE1-CD2 3.94Å; Y76-L149 HydrophobicContact CE2-CD2 4.18Å; Y76-L149 HydrophobicContact CG-CD2 4.46Å
77E84.8Confident71.6Confident87 Ų87106.1 Ų106.141%0.40750%0.497SS..EExtended strand (participates in β ladder)trans-109.9127.9176.6-173.8-171.7143.200108.6Y24 V26 R79Y24-E77 PolarHBondContact N-O 3.33Å; Y24-E77 PolarHBondContact O-N 3.11Å; V26-E77 HydrophobicContact CG2-CB 3.95Å; E77-R79 IonicContact OE1-CZ 2.68Å; E77-R79 IonicContact OE1-NE 2.64Å; E77-R79 PolarHBondContact OE1-NE 2.78Å; E77-R79 VanDerWaalsContact OE1-NE 3.11Å; E77-R79 IonicContact OE1-NH2 3.98Å
78V88Confident73.5Confident19 Ų19103 Ų10312%0.11548%0.484CS..EExtended strand (participates in β ladder)trans-105.2114175.8-177.40000108.8G22 L23 Y76 W81 H84G22-V78 CarbonylContact O-C 3.42Å; G22-V78 WeakPolarHBondContact O-CA 3.47Å; L23-V78 HydrophobicContact CD1-CG2 3.92Å; Y76-V78 HydrophobicContact CD2-CG2 3.76Å; Y76-V78 HydrophobicContact CE2-CG2 3.75Å; V78-W81 HydrophobicContact CB-CZ2 4.22Å; V78-W81 HydrophobicContact CG1-CD2 4.07Å; V78-W81 HydrophobicContact CG1-CE3 4.34Å; V78-W81 HydrophobicContact CG1-CG 4.36Å; V78-W81 PolarHBondContact O-NE1 3.01Å; V78-H84 HydrophobicContact CG1-CB 3.62Å
79R85.9Confident75.5Confident163 Ų163104 Ų10462%0.61549%0.49SS*.SBendtrans-92-33.8175.1-68.1-167.6171-178.9-8.8113.2G22 Y24 E77G22-R79 PolarHBondContact O-N 3.24Å; Y24-R79 HydrophobicContact CD2-CG 4.04Å; Y24-R79 HydrophobicContact CE2-CB 4.3Å; Y24-R79 HydrophobicContact CE2-CG 3.96Å; E77-R79 IonicContact OE1-CZ 2.68Å; E77-R79 IonicContact OE1-NE 2.64Å; E77-R79 PolarHBondContact OE1-NE 2.78Å; E77-R79 VanDerWaalsContact OE1-NE 3.11Å; E77-R79 IonicContact OE1-NH2 3.98Å
80N89.5Confident77.8Confident59 Ų5995.5 Ų95.532%0.31645%0.451SS..  trans-112.795.3178.9-169.9-20000111.3L82 L83 H84N80-L82 PolarHBondContact OD1-N 2.9Å; N80-L83 VanDerWaalsContact ND2-CD1 3.33Å; N80-L83 WeakPolarHBondContact ND2-CD1 3.35Å; N80-L83 PolarHBondContact OD1-N 2.91Å; N80-H84 WeakPolarHBondContact O-CB 3.45Å; N80-H84 PolarHBondContact O-N 3.4Å; N80-H84 VanDerWaalsContact O-N 3.09Å
81W88.3Confident80.2Confident150 Ų15087.6 Ų87.657%0.56841%0.408SS*.Hα-helixtrans-69.7-30.7-177.1-76.796.6000114.2V78 H84 F85V78-W81 HydrophobicContact CB-CZ2 4.22Å; V78-W81 HydrophobicContact CG1-CD2 4.07Å; V78-W81 HydrophobicContact CG1-CE3 4.34Å; V78-W81 HydrophobicContact CG1-CG 4.36Å; V78-W81 PolarHBondContact O-NE1 3.01Å; W81-H84 PolarHBondContact O-N 3.39Å; W81-F85 WeakPolarHBondContact O-CB 3.34Å; W81-F85 PolarHBondContact O-N 3.42Å
82L91.2Very high82.4Confident149 Ų14984.6 Ų84.678%0.7839%0.393SS*.Hα-helixtrans-66.4-49.2179.5-70.2173.3000111.1N80 H84 F85 L86N80-L82 PolarHBondContact OD1-N 2.9Å; L82-H84 VanDerWaalsContact C-N 3.33Å; L82-F85 PolarHBondContact O-N 3.39Å; L82-L86 WeakPolarHBondContact O-CB 3.44Å; L82-L86 PolarHBondContact O-N 3.03Å
83L88.7Confident84.2Confident55 Ų5576.1 Ų76.129%0.28836%0.357SS..Hα-helixtrans-66.7-37.4176.1-70.2-179.1000111.7C21 N80 F85 L86 F87C21-L83 HydrophobicContact CB-CD1 4.44Å; N80-L83 VanDerWaalsContact ND2-CD1 3.33Å; N80-L83 WeakPolarHBondContact ND2-CD1 3.35Å; N80-L83 PolarHBondContact OD1-N 2.91Å; L83-F85 PolarHBondContact O-N 3.47Å; L83-L86 HydrophobicContact CD2-CD2 4.27Å; L83-L86 PolarHBondContact O-N 2.77Å; L83-F87 HydrophobicContact CB-CD2 4.29Å; L83-F87 HydrophobicContact CB-CE2 4.14Å; L83-F87 HydrophobicContact CD2-CE2 4.35Å; L83-F87 WeakPolarHBondContact O-CB 3.44Å; L83-F87 WeakPolarHBondContact O-CD2 3Å; L83-F87 PolarHBondContact O-N 3.47Å
84H89.1Confident85.5Confident20 Ų2069.2 Ų69.29%0.09333%0.329CS..Hα-helixtrans-58.1-49.6175.5-175.972.5000111.7V78 N80 W81 L82 L88 Y206V78-H84 HydrophobicContact CG1-CB 3.62Å; N80-H84 WeakPolarHBondContact O-CB 3.45Å; N80-H84 PolarHBondContact O-N 3.4Å; N80-H84 VanDerWaalsContact O-N 3.09Å; W81-H84 PolarHBondContact O-N 3.39Å; L82-H84 VanDerWaalsContact C-N 3.33Å; H84-L88 VanDerWaalsContact O-CB 3.3Å; H84-L88 WeakPolarHBondContact O-CB 3.4Å; H84-L88 PolarHBondContact O-N 3.17Å; H84-Y206 WeakPolarHBondContact CA-OH 3.31Å; H84-Y206 WeakPolarHBondContact CB-OH 3.39Å; H84-Y206 AromaticContact ND1-CE1 3.55Å; H84-Y206 AromaticContact ND1-CZ 3.6Å; H84-Y206 PolarHBondContact ND1-OH 2.95Å
85F89.8Confident86.8Confident142 Ų14270 Ų7062%0.62333%0.328SS*.Hα-helixtrans-65-42.7177.5-174.9-97.3000112W81 L82 L83 F87 L88 F89W81-F85 WeakPolarHBondContact O-CB 3.34Å; W81-F85 PolarHBondContact O-N 3.42Å; L82-F85 PolarHBondContact O-N 3.39Å; L83-F85 PolarHBondContact O-N 3.47Å; F85-F87 PolarHBondContact O-N 3Å; F85-L88 PolarHBondContact O-N 3.12Å; F85-F89 VanDerWaalsContact O-CB 3.25Å; F85-F89 WeakPolarHBondContact O-CB 3.49Å; F85-F89 PolarHBondContact O-N 2.92Å
86L92.3Very high87.2Confident71 Ų7165.6 Ų65.637%0.37231%0.307SS..Hα-helixtrans-58.8-48177.9-177.473000111.9L82 L83 S90 L199L82-L86 WeakPolarHBondContact O-CB 3.44Å; L82-L86 PolarHBondContact O-N 3.03Å; L83-L86 HydrophobicContact CD2-CD2 4.27Å; L83-L86 PolarHBondContact O-N 2.77Å; L86-S90 WeakPolarHBondContact O-CB 3.33Å; L86-S90 PolarHBondContact O-N 3.08Å; L86-L199 HydrophobicContact CD1-CD1 4.3Å; L86-L199 HydrophobicContact CD2-CD1 3.98Å; L86-L199 HydrophobicContact CG-CD1 4.04Å
87F91.2Very high87.3Confident13 Ų1364.1 Ų64.16%0.05731%0.309CS..Hα-helixtrans-71.6-35.7-180-71.8-54.1000112.5F17 C21 L83 F85 S90 A91 L202 S203 Y206F17-F87 HydrophobicContact CZ-CE1 4.4Å; F17-F87 HydrophobicContact CZ-CE2 4.45Å; F17-F87 AromaticContact CZ-CZ 3.93Å; F17-F87 HydrophobicContact CZ-CZ 3.93Å; C21-F87 HydrophobicContact CB-CE2 4.08Å; C21-F87 VanDerWaalsContact SG-CE2 3.57Å; L83-F87 HydrophobicContact CB-CD2 4.29Å; L83-F87 HydrophobicContact CB-CE2 4.14Å; L83-F87 HydrophobicContact CD2-CE2 4.35Å; L83-F87 WeakPolarHBondContact O-CB 3.44Å; L83-F87 WeakPolarHBondContact O-CD2 3Å; L83-F87 PolarHBondContact O-N 3.47Å; F85-F87 PolarHBondContact O-N 3Å; F87-S90 PolarHBondContact O-N 3.2Å; F87-A91 WeakPolarHBondContact O-CB 3.45Å; F87-A91 PolarHBondContact O-N 3.32Å; F87-L202 HydrophobicContact CE1-CB 3.8Å; F87-S203 VanDerWaalsContact O-CB 3.29Å; F87-S203 WeakPolarHBondContact O-CB 3.34Å; F87-Y206 HydrophobicContact CB-CD1 3.41Å; F87-Y206 VanDerWaalsContact CB-CD1 3.41Å; F87-Y206 HydrophobicContact CB-CD2 4.37Å; F87-Y206 HydrophobicContact CB-CE1 4.04Å; F87-Y206 HydrophobicContact CB-CG 3.6Å; F87-Y206 HydrophobicContact CD2-CD1 4.09Å; F87-Y206 AromaticContact CD2-CD2 3.47Å; F87-Y206 HydrophobicContact CD2-CD2 3.47Å; F87-Y206 VanDerWaalsContact CD2-CD2 3.47Å; F87-Y206 HydrophobicContact CD2-CE1 4.49Å; F87-Y206 AromaticContact CD2-CE2 3.95Å; F87-Y206 HydrophobicContact CD2-CE2 3.95Å; F87-Y206 AromaticContact CD2-CG 3.55Å; F87-Y206 HydrophobicContact CD2-CG 3.55Å; F87-Y206 HydrophobicContact CE2-CD2 4.04Å; F87-Y206 HydrophobicContact CE2-CG 4.41Å; F87-Y206 HydrophobicContact CG-CD1 4.05Å; F87-Y206 HydrophobicContact CG-CD2 4.12Å; F87-Y206 AromaticContact CG-CG 3.7Å; F87-Y206 HydrophobicContact CG-CG 3.7Å
88L89Confident87.3Confident68 Ų6862.8 Ų62.836%0.35630%0.302SS..Hα-helixtrans-66.6-43.2175.2-169.864.2000111.5H84 F85 S90 A91 G92H84-L88 VanDerWaalsContact O-CB 3.3Å; H84-L88 WeakPolarHBondContact O-CB 3.4Å; H84-L88 PolarHBondContact O-N 3.17Å; F85-L88 PolarHBondContact O-N 3.12Å; L88-S90 VanDerWaalsContact C-N 3.33Å; L88-S90 PolarHBondContact O-N 3.41Å; L88-A91 PolarHBondContact O-N 3.36Å; L88-G92 PolarHBondContact O-N 3.48Å
89F89.9Confident87.3Confident123 Ų12362.8 Ų62.854%0.53930%0.3SS..Hα-helixtrans-60.3-44.5172.9177.3-99.8000111.3F85 G92 L93F85-F89 VanDerWaalsContact O-CB 3.25Å; F85-F89 WeakPolarHBondContact O-CB 3.49Å; F85-F89 PolarHBondContact O-N 2.92Å; F89-G92 VanDerWaalsContact O-CA 3.22Å; F89-G92 WeakPolarHBondContact O-CA 3.41Å; F89-G92 PolarHBondContact O-N 2.69Å; F89-L93 HydrophobicContact CE1-CD1 4.4Å; F89-L93 HydrophobicContact CE1-CD2 4.05Å; F89-L93 HydrophobicContact CE1-CG 4.45Å; F89-L93 HydrophobicContact CZ-CD2 4.12Å; F89-L93 PolarHBondContact O-N 3.45Å
90S89.9Confident87.2Confident0 Ų056.1 Ų56.10%028%0.276CS..Hα-helixtrans-64-39177177.30000113.2L86 F87 L88 G92 L93 L199 V200 S203L86-S90 WeakPolarHBondContact O-CB 3.33Å; L86-S90 PolarHBondContact O-N 3.08Å; F87-S90 PolarHBondContact O-N 3.2Å; L88-S90 VanDerWaalsContact C-N 3.33Å; L88-S90 PolarHBondContact O-N 3.41Å; S90-G92 PolarHBondContact O-N 3.03Å; S90-L93 WeakPolarHBondContact O-CB 3.3Å; S90-L93 PolarHBondContact O-N 2.96Å; S90-L93 VanDerWaalsContact O-N 3.1Å; S90-L199 WeakPolarHBondContact OG-CG 3.27Å; S90-L199 PolarHBondContact OG-O 3.32Å; S90-V200 VanDerWaalsContact OG-CA 3.28Å; S90-V200 WeakPolarHBondContact OG-CA 3.31Å; S90-V200 PolarHBondContact OG-N 3.36Å; S90-S203 WeakPolarHBondContact OG-CB 3.48Å; S90-S203 PolarHBondContact OG-OG 3.1Å
91A87.1Confident87Confident1 Ų155.3 Ų55.31%0.00827%0.273CS..Hα-helixtrans-61.3-37.9171.600000110.6F87 L88 L93 G94 S203 T207F87-A91 WeakPolarHBondContact O-CB 3.45Å; F87-A91 PolarHBondContact O-N 3.32Å; L88-A91 PolarHBondContact O-N 3.36Å; A91-L93 PolarHBondContact O-N 2.94Å; A91-G94 PolarHBondContact O-N 3.35Å; A91-S203 WeakPolarHBondContact CA-OG 3.39Å; A91-S203 PolarHBondContact N-OG 3.39Å; A91-T207 HydrophobicContact CB-CG2 3.96Å
92G85.4Confident87.1Confident28 Ų2849.8 Ų49.829%0.28926%0.257SS..Hα-helixtrans-47-41.2167.700000114.8L88 F89 S90 G94 H95L88-G92 PolarHBondContact O-N 3.48Å; F89-G92 VanDerWaalsContact O-CA 3.22Å; F89-G92 WeakPolarHBondContact O-CA 3.41Å; F89-G92 PolarHBondContact O-N 2.69Å; S90-G92 PolarHBondContact O-N 3.03Å; G92-G94 PolarHBondContact O-N 3.45Å; G92-H95 PolarHBondContact O-N 3.3Å
93L85.6Confident87.1Confident28 Ų2843.1 Ų43.115%0.14722%0.223CC..THydrogen-bonded Turntrans-67.9-14.6-179.2-52.9176.1000113.3F89 S90 A91 F98 V200F89-L93 HydrophobicContact CE1-CD1 4.4Å; F89-L93 HydrophobicContact CE1-CD2 4.05Å; F89-L93 HydrophobicContact CE1-CG 4.45Å; F89-L93 HydrophobicContact CZ-CD2 4.12Å; F89-L93 PolarHBondContact O-N 3.45Å; S90-L93 WeakPolarHBondContact O-CB 3.3Å; S90-L93 PolarHBondContact O-N 2.96Å; S90-L93 VanDerWaalsContact O-N 3.1Å; A91-L93 PolarHBondContact O-N 2.94Å; L93-F98 HydrophobicContact CB-CD1 4.4Å; L93-F98 HydrophobicContact CB-CD2 4.4Å; L93-F98 HydrophobicContact CB-CE1 4.41Å; L93-F98 HydrophobicContact CB-CE2 4.44Å; L93-F98 HydrophobicContact CB-CG 4.37Å; L93-F98 HydrophobicContact CB-CZ 4.42Å; L93-F98 HydrophobicContact CD2-CD2 3.6Å; L93-F98 HydrophobicContact CD2-CE2 3.38Å; L93-F98 HydrophobicContact CD2-CG 4.37Å; L93-F98 HydrophobicContact CD2-CZ 3.99Å; L93-F98 HydrophobicContact CG-CE2 4.48Å; L93-F98 WeakPolarHBondContact O-CD1 3.22Å; L93-F98 WeakPolarHBondContact O-CG 3.38Å; L93-V200 HydrophobicContact CB-CG2 4.02Å; L93-V200 HydrophobicContact CD1-CG2 4.16Å
94G81.2Confident87.1Confident4 Ų440.9 Ų40.94%0.04121%0.211CC..THydrogen-bonded Turntrans-92.7-2176.300000114.7A91 G92 Y99 H163A91-G94 PolarHBondContact O-N 3.35Å; G92-G94 PolarHBondContact O-N 3.45Å; G94-Y99 WeakPolarHBondContact O-CE2 3.41Å; G94-Y99 PolarHBondContact O-OH 2.96Å; G94-H163 PolarHBondContact O-CD2 3.48Å; G94-H163 PolarHBondContact O-NE2 2.86Å
95H83.7Confident87.1Confident62 Ų6241.6 Ų41.629%0.28722%0.218SC..SBendtrans-89159.4-176.3-70.7-49.7000113.8G92 V97 F98 Y99G92-H95 PolarHBondContact O-N 3.3Å; H95-V97 PolarHBondContact O-N 3.37Å; H95-F98 WeakPolarHBondContact O-CB 3.4Å; H95-F98 PolarHBondContact O-N 3.43Å; H95-Y99 WeakPolarHBondContact O-CD2 3.38Å; H95-Y99 PolarHBondContact O-N 3.5Å
96E80.3Confident87.1Confident33 Ų3336 Ų3615%0.15420%0.195CC..Hα-helixtrans-51.5-40.8178.5-166.5-165149.700112.6N63 F98 Y99 I100 R334 Y373N63-E96 PolarHBondContact ND2-OE2 3.4Å; E96-F98 VanDerWaalsContact C-N 3.27Å; E96-F98 PolarHBondContact O-N 3.07Å; E96-Y99 PolarHBondContact O-N 3.32Å; E96-Y99 VanDerWaalsContact O-N 3.12Å; E96-I100 PolarHBondContact O-N 3.39Å; E96-R334 IonicContact OE1-CZ 3Å; E96-R334 IonicContact OE1-NE 3.46Å; E96-R334 IonicContact OE1-NH2 3.5Å; E96-R334 PolarHBondContact OE1-NH2 3.28Å; E96-R334 IonicContact OE2-NH2 2.9Å; E96-Y373 WeakPolarHBondContact OE1-CE1 3.47Å; E96-Y373 VanDerWaalsContact OE1-CZ 3.3Å; E96-Y373 PolarHBondContact OE1-OH 2.99Å
97V82.3Confident87Confident71 Ų7132.9 Ų32.943%0.4318%0.178SC..Hα-helixtrans-63.7-32.7179.9-177.40000112H95 I100 T101H95-V97 PolarHBondContact O-N 3.37Å; V97-I100 WeakPolarHBondContact O-CG2 3.49Å; V97-T101 WeakPolarHBondContact O-CG2 3.49Å; V97-T101 PolarHBondContact O-N 3.13Å; V97-T101 PolarHBondContact O-OG1 3.17Å
98F86.2Confident86.8Confident60 Ų6033.1 Ų33.126%0.26318%0.178SC..Hα-helixtrans-70.2-41.7173.9178.4-98.9000110.9L93 H95 E96 T101 C102L93-F98 HydrophobicContact CB-CD1 4.4Å; L93-F98 HydrophobicContact CB-CD2 4.4Å; L93-F98 HydrophobicContact CB-CE1 4.41Å; L93-F98 HydrophobicContact CB-CE2 4.44Å; L93-F98 HydrophobicContact CB-CG 4.37Å; L93-F98 HydrophobicContact CB-CZ 4.42Å; L93-F98 HydrophobicContact CD2-CD2 3.6Å; L93-F98 HydrophobicContact CD2-CE2 3.38Å; L93-F98 HydrophobicContact CD2-CG 4.37Å; L93-F98 HydrophobicContact CD2-CZ 3.99Å; L93-F98 HydrophobicContact CG-CE2 4.48Å; L93-F98 WeakPolarHBondContact O-CD1 3.22Å; L93-F98 WeakPolarHBondContact O-CG 3.38Å; H95-F98 WeakPolarHBondContact O-CB 3.4Å; H95-F98 PolarHBondContact O-N 3.43Å; E96-F98 VanDerWaalsContact C-N 3.27Å; E96-F98 PolarHBondContact O-N 3.07Å; F98-T101 PolarHBondContact O-N 3.25Å; F98-T101 PolarHBondContact O-OG1 3.48Å; F98-C102 HydrophobicContact CD1-CB 4.1Å; F98-C102 HydrophobicContact CD2-CB 4.14Å; F98-C102 HydrophobicContact CE1-CB 3.72Å; F98-C102 HydrophobicContact CE2-CB 3.73Å; F98-C102 HydrophobicContact CG-CB 4.33Å; F98-C102 HydrophobicContact CZ-CB 3.52Å; F98-C102 WeakPolarHBondContact CZ-SG 3.4Å; F98-C102 WeakPolarHBondContact O-CB 3.44Å; F98-C102 PolarHBondContact O-N 2.92Å
99Y86.6Confident86.7Confident18 Ų1832.8 Ų32.87%0.07118%0.177CC..Hα-helixtrans-66.5-41.2179.9-59.4-49000113G94 H95 E96 T101 L103 P104 W122 A166 I170G94-Y99 WeakPolarHBondContact O-CE2 3.41Å; G94-Y99 PolarHBondContact O-OH 2.96Å; H95-Y99 WeakPolarHBondContact O-CD2 3.38Å; H95-Y99 PolarHBondContact O-N 3.5Å; E96-Y99 PolarHBondContact O-N 3.32Å; E96-Y99 VanDerWaalsContact O-N 3.12Å; Y99-T101 PolarHBondContact O-N 3.42Å; Y99-L103 PolarHBondContact O-N 3.19Å; Y99-P104 WeakPolarHBondContact O-CD 3.46Å; Y99-W122 HydrophobicContact CD1-CZ2 4.4Å; Y99-W122 AromaticContact CD1-NE1 3.98Å; Y99-W122 AromaticContact CD2-CZ2 3.61Å; Y99-W122 HydrophobicContact CD2-CZ2 3.61Å; Y99-W122 AromaticContact CE1-NE1 3.85Å; Y99-W122 HydrophobicContact CE2-CZ2 4.22Å; Y99-W122 AromaticContact CE2-NE1 3.87Å; Y99-W122 AromaticContact CG-CZ2 3.73Å; Y99-W122 HydrophobicContact CG-CZ2 3.73Å; Y99-W122 AromaticContact CZ-NE1 3.79Å; Y99-A166 HydrophobicContact CE1-CB 4.47Å; Y99-A166 WeakPolarHBondContact OH-CB 3.33Å; Y99-I170 HydrophobicContact CD1-CD1 3.92Å; Y99-I170 HydrophobicContact CE1-CD1 3.55Å
100I84.3Confident86.5Confident24 Ų2430.9 Ų30.912%0.12317%0.172CC..Hα-helixtrans-69.2-13.6178-157.2173.6000113.1E96 V97 P104 V376E96-I100 PolarHBondContact O-N 3.39Å; V97-I100 WeakPolarHBondContact O-CG2 3.49Å; I100-P104 WeakPolarHBondContact O-CG 3.33Å; I100-V376 HydrophobicContact CD1-CG1 4.3Å; I100-V376 HydrophobicContact CG1-CG1 4.47Å
101T86.1Confident86.3Confident41 Ų4131 Ų3125%0.25217%0.173SC..Hα-helixtrans-105.5-52.1177.754.10000111.6V97 F98 Y99 C105 V327V97-T101 WeakPolarHBondContact O-CG2 3.49Å; V97-T101 PolarHBondContact O-N 3.13Å; V97-T101 PolarHBondContact O-OG1 3.17Å; F98-T101 PolarHBondContact O-N 3.25Å; F98-T101 PolarHBondContact O-OG1 3.48Å; Y99-T101 PolarHBondContact O-N 3.42Å; T101-C105 WeakPolarHBondContact O-CB 3.48Å; T101-C105 PolarHBondContact O-N 3.45Å; T101-C105 PolarHBondContact O-SG 3.2Å; T101-V327 HydrophobicContact CG2-CG1 4.19Å; T101-V327 HydrophobicContact CG2-CG2 3.92Å
102C88.9Confident86.4Confident34 Ų3431.6 Ų31.623%0.2318%0.177CC..Hα-helixtrans-67.2-46.9-174.2-174.50000113.4F98 C105 I106F98-C102 HydrophobicContact CD1-CB 4.1Å; F98-C102 HydrophobicContact CD2-CB 4.14Å; F98-C102 HydrophobicContact CE1-CB 3.72Å; F98-C102 HydrophobicContact CE2-CB 3.73Å; F98-C102 HydrophobicContact CG-CB 4.33Å; F98-C102 HydrophobicContact CZ-CB 3.52Å; F98-C102 WeakPolarHBondContact CZ-SG 3.4Å; F98-C102 WeakPolarHBondContact O-CB 3.44Å; F98-C102 PolarHBondContact O-N 2.92Å; C102-C105 WeakPolarHBondContact O-CB 3.33Å; C102-C105 PolarHBondContact O-N 3.26Å; C102-I106 WeakPolarHBondContact O-CG1 3.35Å; C102-I106 PolarHBondContact O-N 3.15Å
103L91.1Very high86.7Confident10 Ų1030.9 Ų30.95%0.05217%0.165CC..Hα-helixtrans-63.8-46.8-178.6-63.4173.4000111.6Y99 C105 I106 H107 C115 L118 V119 W122Y99-L103 PolarHBondContact O-N 3.19Å; L103-C105 VanDerWaalsContact C-N 3.33Å; L103-C105 PolarHBondContact O-N 3.34Å; L103-I106 WeakPolarHBondContact O-CB 3.13Å; L103-I106 PolarHBondContact O-N 3.21Å; L103-I106 VanDerWaalsContact O-N 3.14Å; L103-H107 PolarHBondContact O-N 3.36Å; L103-H107 VanDerWaalsContact O-N 3.07Å; L103-C115 PolarHBondContact O-SG 3.23Å; L103-L118 HydrophobicContact CD2-CB 4.17Å; L103-V119 HydrophobicContact CD1-CG2 4.34Å; L103-W122 HydrophobicContact CD1-CD2 4.21Å; L103-W122 HydrophobicContact CD1-CE3 4.02Å; L103-W122 HydrophobicContact CD1-CZ3 4.31Å
104P89.9Confident87Confident8 Ų829.6 Ų29.65%0.05216%0.159CC..Hα-helixtrans-59.7-38.5171.4-3141.7000114.3Y99 I100 I106 H107 W108 L330 N380Y99-P104 WeakPolarHBondContact O-CD 3.46Å; I100-P104 WeakPolarHBondContact O-CG 3.33Å; P104-I106 VanDerWaalsContact C-N 3.26Å; P104-I106 PolarHBondContact O-N 3.39Å; P104-H107 WeakPolarHBondContact O-CB 3.35Å; P104-H107 PolarHBondContact O-N 3.08Å; P104-H107 VanDerWaalsContact O-N 3.11Å; P104-W108 HydrophobicContact CB-CD2 4.24Å; P104-W108 HydrophobicContact CB-CE3 4.05Å; P104-W108 HydrophobicContact CB-CH2 3.36Å; P104-W108 HydrophobicContact CB-CZ2 3.61Å; P104-W108 HydrophobicContact CB-CZ3 3.62Å; P104-W108 HydrophobicContact CG-CH2 4.43Å; P104-W108 VanDerWaalsContact O-CD2 3.23Å; P104-W108 VanDerWaalsContact O-CG 3.28Å; P104-W108 PolarHBondContact O-N 2.87Å; P104-L330 HydrophobicContact CB-CD1 3.87Å; P104-L330 HydrophobicContact CG-CD1 3.53Å; P104-N380 VanDerWaalsContact CB-OD1 3.24Å; P104-N380 WeakPolarHBondContact CB-OD1 3.49Å
105C89Confident87.5Confident35 Ų3529.4 Ų29.424%0.23616%0.157CC..Hα-helixtrans-58.2-39.3174.5-74.90000112T101 C102 L103 N109 S323T101-C105 WeakPolarHBondContact O-CB 3.48Å; T101-C105 PolarHBondContact O-N 3.45Å; T101-C105 PolarHBondContact O-SG 3.2Å; C102-C105 WeakPolarHBondContact O-CB 3.33Å; C102-C105 PolarHBondContact O-N 3.26Å; L103-C105 VanDerWaalsContact C-N 3.33Å; L103-C105 PolarHBondContact O-N 3.34Å; C105-N109 VanDerWaalsContact O-CB 3.26Å; C105-N109 WeakPolarHBondContact O-CB 3.44Å; C105-N109 PolarHBondContact O-N 3.32Å; C105-N109 PolarHBondContact O-ND2 3.43Å; C105-S323 VanDerWaalsContact SG-CB 3.53Å; C105-S323 PolarHBondContact SG-OG 3.4Å
106I89.6Confident88Confident25 Ų2526.5 Ų26.513%0.12814%0.143CC..Hα-helixtrans-66.6-42.9175.4-64.5169000110.5C102 L103 P104 W108 L110 D111 C115 L118C102-I106 WeakPolarHBondContact O-CG1 3.35Å; C102-I106 PolarHBondContact O-N 3.15Å; L103-I106 WeakPolarHBondContact O-CB 3.13Å; L103-I106 PolarHBondContact O-N 3.21Å; L103-I106 VanDerWaalsContact O-N 3.14Å; P104-I106 VanDerWaalsContact C-N 3.26Å; P104-I106 PolarHBondContact O-N 3.39Å; I106-W108 PolarHBondContact O-N 3.48Å; I106-L110 HydrophobicContact CG2-CB 4.26Å; I106-L110 HydrophobicContact CG2-CD2 4.19Å; I106-L110 WeakPolarHBondContact O-CA 3.29Å; I106-L110 WeakPolarHBondContact O-CB 3.39Å; I106-L110 PolarHBondContact O-N 2.99Å; I106-D111 PolarHBondContact O-N 3.39Å; I106-D111 VanDerWaalsContact O-N 3.08Å; I106-C115 HydrophobicContact CG2-CB 4.2Å; I106-L118 HydrophobicContact CD1-CD1 3.77Å; I106-L118 HydrophobicContact CG2-CD1 4.11Å
107H89.4Confident88.7Confident4 Ų425.7 Ų25.72%0.01914%0.139CC..Hα-helixtrans-59.4-44.2176.7179.167.2000112.7L103 P104 C115 Y288 N380 N385L103-H107 PolarHBondContact O-N 3.36Å; L103-H107 VanDerWaalsContact O-N 3.07Å; P104-H107 WeakPolarHBondContact O-CB 3.35Å; P104-H107 PolarHBondContact O-N 3.08Å; P104-H107 VanDerWaalsContact O-N 3.11Å; H107-C115 HydrophobicContact CB-CB 3.69Å; H107-Y288 AromaticContact CE1-CE1 3.43Å; H107-Y288 VanDerWaalsContact CE1-CE1 3.43Å; H107-Y288 WeakPolarHBondContact CE1-CE1 3.35Å; H107-Y288 AromaticContact ND1-CE1 3.57Å; H107-Y288 AromaticContact ND1-CZ 3.85Å; H107-Y288 PolarHBondContact ND1-OH 3.49Å; H107-N380 PolarHBondContact NE2-O 3.37Å; H107-N385 PolarHBondContact NE2-ND2 2.95Å
108W88.4Confident89.3Confident18 Ų1822.4 Ų22.47%0.06812%0.119CC..Hα-helixtrans-85.1-29.5-174.2-59.5-35.6000114.9P104 I106 L330 N380 V384 N385 F388P104-W108 HydrophobicContact CB-CD2 4.24Å; P104-W108 HydrophobicContact CB-CE3 4.05Å; P104-W108 HydrophobicContact CB-CH2 3.36Å; P104-W108 HydrophobicContact CB-CZ2 3.61Å; P104-W108 HydrophobicContact CB-CZ3 3.62Å; P104-W108 HydrophobicContact CG-CH2 4.43Å; P104-W108 VanDerWaalsContact O-CD2 3.23Å; P104-W108 VanDerWaalsContact O-CG 3.28Å; P104-W108 PolarHBondContact O-N 2.87Å; I106-W108 PolarHBondContact O-N 3.48Å; W108-L330 HydrophobicContact CH2-CD1 3.66Å; W108-L330 HydrophobicContact CH2-CG 4.15Å; W108-L330 HydrophobicContact CZ2-CD1 4Å; W108-L330 HydrophobicContact CZ2-CG 4.36Å; W108-N380 VanDerWaalsContact CZ2-OD1 3.31Å; W108-N380 WeakPolarHBondContact CZ2-OD1 3.15Å; W108-N380 PolarHBondContact NE1-O 2.93Å; W108-V384 HydrophobicContact CD2-CG1 4.1Å; W108-V384 VanDerWaalsContact CE2-CG1 3.4Å; W108-V384 HydrophobicContact CH2-CG1 4.35Å; W108-V384 HydrophobicContact CZ2-CB 3.95Å; W108-V384 HydrophobicContact CZ2-CG1 3.56Å; W108-V384 HydrophobicContact CZ2-CG2 3.93Å; W108-N385 VanDerWaalsContact CD1-OD1 3.3Å; W108-F388 HydrophobicContact CB-CE2 3.75Å; W108-F388 HydrophobicContact CB-CZ 4.43Å; W108-F388 AromaticContact CD1-CE2 3.63Å; W108-F388 AromaticContact CD2-CE2 3.94Å; W108-F388 HydrophobicContact CD2-CE2 3.94Å; W108-F388 HydrophobicContact CD2-CZ 4.02Å; W108-F388 HydrophobicContact CE3-CZ 4.33Å; W108-F388 AromaticContact CG-CE2 3.5Å; W108-F388 HydrophobicContact CG-CE2 3.5Å; W108-F388 VanDerWaalsContact CG-CE2 3.5Å; W108-F388 HydrophobicContact CG-CZ 4.06Å
109N85.9Confident89.7Confident61 Ų6119.7 Ų19.733%0.32611%0.107SC..Hα-helixtrans-108.4-27.4-173-65.7-75.8000114.3C105 G319 S323C105-N109 VanDerWaalsContact O-CB 3.26Å; C105-N109 WeakPolarHBondContact O-CB 3.44Å; C105-N109 PolarHBondContact O-N 3.32Å; C105-N109 PolarHBondContact O-ND2 3.43Å; N109-G319 WeakPolarHBondContact OD1-CA 3.48Å; N109-G319 PolarHBondContact OD1-O 3.33Å; N109-S323 PolarHBondContact ND2-OG 2.72Å
110L84.9Confident90.1Very high83 Ų8319.9 Ų19.944%0.43511%0.109SC..THydrogen-bonded Turntrans-106.9-73-174.8-172.267.4000110.8I106 L114 L174I106-L110 HydrophobicContact CG2-CB 4.26Å; I106-L110 HydrophobicContact CG2-CD2 4.19Å; I106-L110 WeakPolarHBondContact O-CA 3.29Å; I106-L110 WeakPolarHBondContact O-CB 3.39Å; I106-L110 PolarHBondContact O-N 2.99Å; L110-L114 HydrophobicContact CD2-CD1 3.57Å; L110-L114 HydrophobicContact CG-CD1 3.95Å; L110-L174 HydrophobicContact CD2-CD1 4.29Å
111D87.4Confident90.7Very high4 Ų419.1 Ų19.12%0.02111%0.105CC..  trans-167.8125.8-177.2-163.5-18.2000111.5I106 F113 L114 C115 R181I106-D111 PolarHBondContact O-N 3.39Å; I106-D111 VanDerWaalsContact O-N 3.08Å; D111-F113 PolarHBondContact O-N 3.09Å; D111-F113 WeakPolarHBondContact OD1-CB 3.27Å; D111-F113 PolarHBondContact OD1-N 3.15Å; D111-L114 HydrophobicContact CB-CB 4.22Å; D111-L114 HydrophobicContact CB-CD1 3.95Å; D111-L114 HydrophobicContact CB-CG 3.92Å; D111-L114 PolarHBondContact O-N 2.91Å; D111-C115 PolarHBondContact O-N 3.27Å; D111-C115 VanDerWaalsContact O-N 3.14Å; D111-R181 VanDerWaalsContact CG-NH2 3.32Å; D111-R181 IonicContact OD1-CZ 2.83Å; D111-R181 IonicContact OD1-NH2 3.81Å; D111-R181 PolarHBondContact OD1-NH2 3.22Å; D111-R181 WeakPolarHBondContact OD2-CG 3.41Å; D111-R181 IonicContact OD2-CZ 3.11Å; D111-R181 IonicContact OD2-NE 2.75Å; D111-R181 PolarHBondContact OD2-NE 3.06Å; D111-R181 IonicContact OD2-NH2 3.74Å; D111-R181 PolarHBondContact OD2-NH2 3.41Å
112P88.8Confident91.2Very high13 Ų1317.8 Ų17.88%0.08410%0.096CC..Hα-helixtrans-54.7-34170.8-28.937000114.1C115 R116 Y288 F298 E299P112-C115 PolarHBondContact O-N 3.1Å; P112-R116 VanDerWaalsContact O-CB 3.31Å; P112-R116 WeakPolarHBondContact O-CB 3.41Å; P112-R116 PolarHBondContact O-N 3.01Å; P112-Y288 HydrophobicContact CB-CE1 4.32Å; P112-F298 HydrophobicContact CG-CB 4.31Å; P112-E299 HydrophobicContact CB-CG 4.49Å
113F90.6Very high91.5Very high12 Ų1216.4 Ų16.45%0.0539%0.086CC..Hα-helixtrans-62.9-46.3178.3172-94.7000112D111 R116 R117 R181D111-F113 PolarHBondContact O-N 3.09Å; D111-F113 WeakPolarHBondContact OD1-CB 3.27Å; D111-F113 PolarHBondContact OD1-N 3.15Å; F113-R116 PolarHBondContact O-N 2.9Å; F113-R117 PolarHBondContact O-N 2.96Å; F113-R181 HydrophobicContact CD1-CG 3.66Å; F113-R181 HydrophobicContact CE1-CG 3.94Å
114L92Very high91.7Very high1 Ų118.9 Ų18.91%0.00510%0.099CC..Hα-helixtrans-65.5-44.7178.2-63.5176.7000110.7L110 D111 R116 R117 L118 L174 S177 R181L110-L114 HydrophobicContact CD2-CD1 3.57Å; L110-L114 HydrophobicContact CG-CD1 3.95Å; D111-L114 HydrophobicContact CB-CB 4.22Å; D111-L114 HydrophobicContact CB-CD1 3.95Å; D111-L114 HydrophobicContact CB-CG 3.92Å; D111-L114 PolarHBondContact O-N 2.91Å; L114-R116 VanDerWaalsContact C-N 3.33Å; L114-R116 PolarHBondContact O-N 3.22Å; L114-R117 PolarHBondContact O-N 3.44Å; L114-L118 VanDerWaalsContact O-CG 3.23Å; L114-L118 WeakPolarHBondContact O-CG 3.47Å; L114-L118 PolarHBondContact O-N 3.31Å; L114-L174 HydrophobicContact CB-CD1 4.28Å; L114-L174 HydrophobicContact CD1-CD1 4.06Å; L114-S177 VanDerWaalsContact CD2-C 3.47Å; L114-S177 WeakPolarHBondContact CD2-O 3.35Å; L114-R181 HydrophobicContact CD2-CG 4.24Å; L114-R181 HydrophobicContact CG-CG 4.46Å
115C93Very high92Very high0 Ų018.5 Ų18.50%010%0.097CC..Hα-helixtrans-61.5-41.4178-175.40000112.3L103 I106 H107 D111 P112 R117 L118 V119L103-C115 PolarHBondContact O-SG 3.23Å; I106-C115 HydrophobicContact CG2-CB 4.2Å; H107-C115 HydrophobicContact CB-CB 3.69Å; D111-C115 PolarHBondContact O-N 3.27Å; D111-C115 VanDerWaalsContact O-N 3.14Å; P112-C115 PolarHBondContact O-N 3.1Å; C115-R117 PolarHBondContact O-N 3.38Å; C115-L118 WeakPolarHBondContact O-CB 3.49Å; C115-L118 PolarHBondContact O-N 2.67Å; C115-V119 WeakPolarHBondContact O-CG2 2.99Å; C115-V119 PolarHBondContact O-N 3.4Å
116R93.3Very high92.3Very high2 Ų217.4 Ų17.41%0.0089%0.088CC..Hα-helixtrans-58.9-48179.1179.9160.151.2113.63.3112P112 F113 L114 L118 V119 N120 D237 L241 Y288 E299P112-R116 VanDerWaalsContact O-CB 3.31Å; P112-R116 WeakPolarHBondContact O-CB 3.41Å; P112-R116 PolarHBondContact O-N 3.01Å; F113-R116 PolarHBondContact O-N 2.9Å; L114-R116 VanDerWaalsContact C-N 3.33Å; L114-R116 PolarHBondContact O-N 3.22Å; R116-L118 VanDerWaalsContact C-N 3.33Å; R116-L118 PolarHBondContact O-N 2.64Å; R116-V119 PolarHBondContact O-N 2.84Å; R116-N120 PolarHBondContact O-N 3.36Å; R116-N120 PolarHBondContact O-ND2 2.9Å; R116-D237 IonicContact CZ-OD1 3.81Å; R116-D237 IonicContact CZ-OD2 3.47Å; R116-D237 IonicContact NE-OD1 2.91Å; R116-D237 PolarHBondContact NE-OD1 3.41Å; R116-D237 PolarHBondContact NH1-O 3.36Å; R116-D237 VanDerWaalsContact NH1-O 3.11Å; R116-D237 IonicContact NH1-OD1 3.07Å; R116-D237 PolarHBondContact NH1-OD1 3.04Å; R116-D237 IonicContact NH1-OD2 3.7Å; R116-D237 PolarHBondContact NH1-OD2 3.24Å; R116-D237 VanDerWaalsContact NH2-CG 3.26Å; R116-D237 IonicContact NH2-OD1 2.95Å; R116-D237 PolarHBondContact NH2-OD1 2.93Å; R116-D237 VanDerWaalsContact NH2-OD1 3.11Å; R116-D237 IonicContact NH2-OD2 2.94Å; R116-D237 PolarHBondContact NH2-OD2 3.44Å; R116-L241 VanDerWaalsContact CZ-CD1 3.49Å; R116-L241 VanDerWaalsContact NH2-CD1 3.35Å; R116-Y288 HydrophobicContact CB-CD2 4.14Å; R116-Y288 HydrophobicContact CB-CE1 4.36Å; R116-Y288 HydrophobicContact CB-CE2 3.73Å; R116-Y288 HydrophobicContact CG-CD2 3.81Å; R116-Y288 HydrophobicContact CG-CE2 3.85Å; R116-Y288 HydrophobicContact CG-CG 4.39Å; R116-E299 IonicContact NH2-OE1 2.96Å
117R94.6Very high92.5Very high16 Ų1618.4 Ų18.46%0.069%0.091CC..Hα-helixtrans-61-41.4174.4-71-174.8172-168.2-3.1112.8F113 L114 C115 N120 M121 T173 S177 E234F113-R117 PolarHBondContact O-N 2.96Å; L114-R117 PolarHBondContact O-N 3.44Å; C115-R117 PolarHBondContact O-N 3.38Å; R117-N120 PolarHBondContact O-N 3.39Å; R117-M121 WeakPolarHBondContact O-CB 3.47Å; R117-M121 PolarHBondContact O-N 2.89Å; R117-T173 HydrophobicContact CB-CG2 4.14Å; R117-S177 VanDerWaalsContact CD-OG 3.25Å; R117-S177 WeakPolarHBondContact CD-OG 3.3Å; R117-E234 IonicContact CZ-OE1 2.86Å; R117-E234 IonicContact NH1-OE1 3.07Å; R117-E234 IonicContact NH2-OE1 3.49Å; R117-E234 PolarHBondContact NH2-OE1 2.95Å; R117-E234 IonicContact NH2-OE2 2.73Å; R117-E234 PolarHBondContact NH2-OE2 3.42Å
118L94.9Very high92.8Very high1 Ų120 Ų201%0.00510%0.101CC..Hα-helixtrans-61.9-46.9177.3-71.6171.2000112.2L103 I106 L114 C115 R116 N120 M121 W122 I170 T173 L174L103-L118 HydrophobicContact CD2-CB 4.17Å; I106-L118 HydrophobicContact CD1-CD1 3.77Å; I106-L118 HydrophobicContact CG2-CD1 4.11Å; L114-L118 VanDerWaalsContact O-CG 3.23Å; L114-L118 WeakPolarHBondContact O-CG 3.47Å; L114-L118 PolarHBondContact O-N 3.31Å; C115-L118 WeakPolarHBondContact O-CB 3.49Å; C115-L118 PolarHBondContact O-N 2.67Å; R116-L118 VanDerWaalsContact C-N 3.33Å; R116-L118 PolarHBondContact O-N 2.64Å; L118-N120 VanDerWaalsContact C-N 3.34Å; L118-N120 PolarHBondContact O-N 2.68Å; L118-M121 PolarHBondContact O-N 3.37Å; L118-W122 WeakPolarHBondContact O-CB 3.26Å; L118-W122 PolarHBondContact O-N 3.02Å; L118-I170 HydrophobicContact CD2-CB 4.41Å; L118-I170 HydrophobicContact CD2-CG2 4.1Å; L118-I170 WeakPolarHBondContact CD2-O 3.37Å; L118-T173 HydrophobicContact CD2-CG2 3.91Å; L118-T173 HydrophobicContact CG-CG2 4.47Å; L118-L174 HydrophobicContact CD1-CB 4.47Å; L118-L174 HydrophobicContact CD1-CD1 4.27Å; L118-L174 HydrophobicContact CD2-CB 4.01Å
119V95.1Very high93Very high3 Ų319.1 Ų19.12%0.01810%0.098CC..Hα-helixtrans-61.8-43.3178.21710000110.7L103 C115 R116 T123 C281 C284L103-V119 HydrophobicContact CD1-CG2 4.34Å; C115-V119 WeakPolarHBondContact O-CG2 2.99Å; C115-V119 PolarHBondContact O-N 3.4Å; R116-V119 PolarHBondContact O-N 2.84Å; V119-T123 VanDerWaalsContact O-CB 3.26Å; V119-T123 WeakPolarHBondContact O-CB 3.39Å; V119-T123 PolarHBondContact O-N 3.05Å; V119-T123 PolarHBondContact O-OG1 3.44Å; V119-C281 HydrophobicContact CG1-CB 4.33Å; V119-C284 HydrophobicContact CG1-CB 4.26Å
120N95.7Very high93.3Very high23 Ų2316.4 Ų16.412%0.1238%0.083CC..Hα-helixtrans-62.1-49.9178.4-68.6-21.1000111.7R116 R117 L118 T123 L124 F236 Q240R116-N120 PolarHBondContact O-N 3.36Å; R116-N120 PolarHBondContact O-ND2 2.9Å; R117-N120 PolarHBondContact O-N 3.39Å; L118-N120 VanDerWaalsContact C-N 3.34Å; L118-N120 PolarHBondContact O-N 2.68Å; N120-T123 PolarHBondContact O-N 3.06Å; N120-L124 PolarHBondContact O-N 3.1Å; N120-F236 HydrophobicContact CB-CE1 4.25Å; N120-F236 VanDerWaalsContact ND2-CE1 3.34Å; N120-F236 WeakPolarHBondContact ND2-CE1 3.36Å; N120-Q240 PolarHBondContact ND2-OE1 2.92Å; N120-Q240 PolarHBondContact OD1-OE1 3.45Å
121M96.4Very high93.6Very high7 Ų713.7 Ų13.73%0.0347%0.07CC..Hα-helixtrans-68.8-41.7-179.9-77-56.1-58.400112.9R117 L118 T123 L124 V125 T173 I226 T229 W233R117-M121 WeakPolarHBondContact O-CB 3.47Å; R117-M121 PolarHBondContact O-N 2.89Å; L118-M121 PolarHBondContact O-N 3.37Å; M121-T123 VanDerWaalsContact C-N 3.32Å; M121-T123 PolarHBondContact O-N 3.37Å; M121-L124 HydrophobicContact CE-CD2 4.5Å; M121-L124 PolarHBondContact O-N 3.23Å; M121-L124 HydrophobicContact SD-CD2 4.37Å; M121-V125 HydrophobicContact CE-CG2 4.23Å; M121-V125 WeakPolarHBondContact O-CB 3.43Å; M121-V125 VanDerWaalsContact O-CG2 3.24Å; M121-V125 WeakPolarHBondContact O-CG2 3.32Å; M121-V125 PolarHBondContact O-N 3.06Å; M121-T173 HydrophobicContact CB-CG2 4.11Å; M121-T173 HydrophobicContact CG-CG2 3.9Å; M121-I226 HydrophobicContact CE-CG1 3.79Å; M121-T229 WeakPolarHBondContact CE-OG1 3.42Å; M121-T229 PolarHBondContact SD-OG1 3.18Å; M121-W233 HydrophobicContact CE-CZ2 4.09Å; M121-W233 HydrophobicContact CG-CH2 4.49Å; M121-W233 HydrophobicContact CG-CZ2 3.66Å; M121-W233 HydrophobicContact SD-CZ2 3.78Å; M121-W233 PolarHBondContact SD-NE1 3.48Å
122W95.8Very high93.7Very high13 Ų1316 Ų165%0.0498%0.081CC..Hα-helixtrans-59.1-44.9174.7171.867.8000111.2Y99 L103 L118 V125 M126 I170 I277Y99-W122 HydrophobicContact CD1-CZ2 4.4Å; Y99-W122 AromaticContact CD1-NE1 3.98Å; Y99-W122 AromaticContact CD2-CZ2 3.61Å; Y99-W122 HydrophobicContact CD2-CZ2 3.61Å; Y99-W122 AromaticContact CE1-NE1 3.85Å; Y99-W122 HydrophobicContact CE2-CZ2 4.22Å; Y99-W122 AromaticContact CE2-NE1 3.87Å; Y99-W122 AromaticContact CG-CZ2 3.73Å; Y99-W122 HydrophobicContact CG-CZ2 3.73Å; Y99-W122 AromaticContact CZ-NE1 3.79Å; L103-W122 HydrophobicContact CD1-CD2 4.21Å; L103-W122 HydrophobicContact CD1-CE3 4.02Å; L103-W122 HydrophobicContact CD1-CZ3 4.31Å; L118-W122 WeakPolarHBondContact O-CB 3.26Å; L118-W122 PolarHBondContact O-N 3.02Å; W122-V125 PolarHBondContact O-N 3Å; W122-M126 HydrophobicContact CG-CG 4.37Å; W122-M126 VanDerWaalsContact O-CB 3.23Å; W122-M126 WeakPolarHBondContact O-CB 3.18Å; W122-M126 WeakPolarHBondContact O-CG 3.21Å; W122-M126 PolarHBondContact O-N 3Å; W122-I170 HydrophobicContact CB-CG1 4.34Å; W122-I170 HydrophobicContact CG-CD1 4.42Å; W122-I277 HydrophobicContact CD2-CG2 4.46Å; W122-I277 HydrophobicContact CE3-CG2 4.09Å; W122-I277 HydrophobicContact CH2-CB 4.17Å; W122-I277 HydrophobicContact CH2-CG1 3.71Å; W122-I277 HydrophobicContact CH2-CG2 3.92Å; W122-I277 HydrophobicContact CZ2-CD1 4.24Å; W122-I277 HydrophobicContact CZ2-CG1 3.81Å; W122-I277 HydrophobicContact CZ2-CG2 4.27Å; W122-I277 HydrophobicContact CZ3-CB 4.44Å; W122-I277 HydrophobicContact CZ3-CG1 4.45Å; W122-I277 HydrophobicContact CZ3-CG2 3.81Å
123T95.6Very high93.7Very high6 Ų615.5 Ų15.54%0.0378%0.077CC..Hα-helixtrans-62.3-48.5178.2-600000111.7V119 N120 M121 M126 Y127 I277 L278 C281V119-T123 VanDerWaalsContact O-CB 3.26Å; V119-T123 WeakPolarHBondContact O-CB 3.39Å; V119-T123 PolarHBondContact O-N 3.05Å; V119-T123 PolarHBondContact O-OG1 3.44Å; N120-T123 PolarHBondContact O-N 3.06Å; M121-T123 VanDerWaalsContact C-N 3.32Å; M121-T123 PolarHBondContact O-N 3.37Å; T123-M126 PolarHBondContact O-N 3.07Å; T123-Y127 VanDerWaalsContact O-CB 3.28Å; T123-Y127 WeakPolarHBondContact O-CB 3.37Å; T123-Y127 PolarHBondContact O-N 3.38Å; T123-I277 HydrophobicContact CG2-CG2 4.13Å; T123-L278 HydrophobicContact CG2-CD2 3.85Å; T123-C281 HydrophobicContact CG2-CB 3.65Å; T123-C281 VanDerWaalsContact OG1-CB 3.29Å; T123-C281 WeakPolarHBondContact OG1-CB 3.35Å
124L96.1Very high93.5Very high62 Ų6215.1 Ų15.133%0.3258%0.076SC..Hα-helixtrans-58.5-51.3178.2175.265.5000111.4N120 M121 M126 Y127 V128 T229N120-L124 PolarHBondContact O-N 3.1Å; M121-L124 HydrophobicContact CE-CD2 4.5Å; M121-L124 PolarHBondContact O-N 3.23Å; M121-L124 HydrophobicContact SD-CD2 4.37Å; L124-M126 PolarHBondContact O-N 2.93Å; L124-Y127 PolarHBondContact O-N 2.87Å; L124-V128 HydrophobicContact CD1-CG2 4.17Å; L124-V128 WeakPolarHBondContact O-CB 3.32Å; L124-V128 WeakPolarHBondContact O-CG2 3.43Å; L124-V128 PolarHBondContact O-N 3.26Å; L124-T229 HydrophobicContact CD2-CG2 3.6Å
125V96.3Very high93.2Very high0 Ų020.8 Ų20.80%011%0.106CC..Hα-helixtrans-65.4-41.5-176.4169.40000111.2M121 W122 G129 M165 A169 T222 L225M121-V125 HydrophobicContact CE-CG2 4.23Å; M121-V125 WeakPolarHBondContact O-CB 3.43Å; M121-V125 VanDerWaalsContact O-CG2 3.24Å; M121-V125 WeakPolarHBondContact O-CG2 3.32Å; M121-V125 PolarHBondContact O-N 3.06Å; W122-V125 PolarHBondContact O-N 3Å; V125-G129 PolarHBondContact O-N 2.88Å; V125-M165 HydrophobicContact CG1-CB 3.62Å; V125-M165 HydrophobicContact CG1-CE 3.99Å; V125-A169 HydrophobicContact CB-CB 4.11Å; V125-A169 HydrophobicContact CG1-CB 4.09Å; V125-A169 HydrophobicContact CG2-CB 3.9Å; V125-T222 HydrophobicContact CG1-CG2 4.12Å; V125-T222 HydrophobicContact CG2-CG2 4.16Å; V125-L225 HydrophobicContact CB-CD1 4.46Å; V125-L225 HydrophobicContact CG2-CB 4.35Å; V125-L225 HydrophobicContact CG2-CD1 3.89Å
126M94.1Very high92.9Very high12 Ų1224.8 Ų24.86%0.05913%0.126CC..Hα-helixtrans-67.6-42.5176.7-73.8-65.1-73.400112W122 T123 L124 G129 Q130 A166 I277W122-M126 HydrophobicContact CG-CG 4.37Å; W122-M126 VanDerWaalsContact O-CB 3.23Å; W122-M126 WeakPolarHBondContact O-CB 3.18Å; W122-M126 WeakPolarHBondContact O-CG 3.21Å; W122-M126 PolarHBondContact O-N 3Å; T123-M126 PolarHBondContact O-N 3.07Å; L124-M126 PolarHBondContact O-N 2.93Å; M126-G129 PolarHBondContact O-N 3.32Å; M126-Q130 WeakPolarHBondContact O-CB 3.42Å; M126-Q130 WeakPolarHBondContact O-CG 3.19Å; M126-Q130 PolarHBondContact O-N 3.14Å; M126-A166 HydrophobicContact CG-CB 4.41Å; M126-A166 HydrophobicContact SD-CB 3.8Å; M126-I277 HydrophobicContact CB-CD1 3.72Å; M126-I277 HydrophobicContact CB-CG2 4.21Å; M126-I277 HydrophobicContact CE-CD1 3.46Å; M126-I277 VanDerWaalsContact CE-CD1 3.46Å; M126-I277 HydrophobicContact CG-CD1 4Å
127Y94.5Very high92.5Very high46 Ų4629.1 Ų29.118%0.1815%0.146CC..Hα-helixtrans-60.4-51.9176.5179.9-98.9000111.1T123 L124 G129 Q130 V131 L257 Y261 T274 L278T123-Y127 VanDerWaalsContact O-CB 3.28Å; T123-Y127 WeakPolarHBondContact O-CB 3.37Å; T123-Y127 PolarHBondContact O-N 3.38Å; L124-Y127 PolarHBondContact O-N 2.87Å; Y127-G129 VanDerWaalsContact C-N 3.33Å; Y127-G129 PolarHBondContact O-N 3.39Å; Y127-Q130 PolarHBondContact O-N 2.85Å; Y127-V131 HydrophobicContact CD1-CG2 4.4Å; Y127-V131 HydrophobicContact CD2-CG2 4.5Å; Y127-V131 HydrophobicContact CE1-CG2 4Å; Y127-V131 HydrophobicContact CE2-CG2 4.11Å; Y127-V131 WeakPolarHBondContact O-CB 3.47Å; Y127-V131 WeakPolarHBondContact O-CG2 3.43Å; Y127-V131 PolarHBondContact O-N 3.43Å; Y127-L257 HydrophobicContact CE1-CD2 4.32Å; Y127-L257 HydrophobicContact CE2-CB 3.95Å; Y127-L257 WeakPolarHBondContact OH-CD2 3.24Å; Y127-Y261 HydrophobicContact CE2-CD2 4.26Å; Y127-T274 HydrophobicContact CD2-CG2 3.66Å; Y127-T274 HydrophobicContact CE2-CG2 4.18Å; Y127-L278 HydrophobicContact CD2-CD1 3.93Å; Y127-L278 HydrophobicContact CD2-CD2 4.06Å; Y127-L278 HydrophobicContact CD2-CG 4.38Å; Y127-L278 HydrophobicContact CE2-CD1 4.13Å
128V94.9Very high92Very high37 Ų3730.9 Ų30.922%0.22416%0.156CC..Hα-helixtrans-59.9-44.4177.4173.40000110.8L124 Q130 V131 M132 L225L124-V128 HydrophobicContact CD1-CG2 4.17Å; L124-V128 WeakPolarHBondContact O-CB 3.32Å; L124-V128 WeakPolarHBondContact O-CG2 3.43Å; L124-V128 PolarHBondContact O-N 3.26Å; V128-Q130 PolarHBondContact O-N 3.47Å; V128-V131 PolarHBondContact O-N 3.43Å; V128-M132 HydrophobicContact CG1-CG 4.22Å; V128-M132 HydrophobicContact CG1-SD 3.82Å; V128-M132 WeakPolarHBondContact O-CB 3.31Å; V128-M132 VanDerWaalsContact O-CG 3.22Å; V128-M132 WeakPolarHBondContact O-CG 3.49Å; V128-M132 PolarHBondContact O-N 3.28Å; V128-L225 HydrophobicContact CB-CD1 4.13Å; V128-L225 HydrophobicContact CG1-CD1 4.09Å; V128-L225 HydrophobicContact CG2-CD1 4.38Å
129G93.1Very high91.4Very high0 Ų035.2 Ų35.20%018%0.184CC..Hα-helixtrans-62.2-43.5179.500000113.6V125 M126 Y127 M132 K133V125-G129 PolarHBondContact O-N 2.88Å; M126-G129 PolarHBondContact O-N 3.32Å; Y127-G129 VanDerWaalsContact C-N 3.33Å; Y127-G129 PolarHBondContact O-N 3.39Å; G129-M132 PolarHBondContact O-N 3.32Å; G129-K133 WeakPolarHBondContact O-CG 3.45Å; G129-K133 PolarHBondContact O-N 3.4Å
130Q91.5Very high90.7Very high4 Ų436.1 Ų36.12%0.01919%0.187CC..Hα-helixtrans-69.2-42.8178.5-65.2-73.228.100111.4M126 Y127 V128 M132 K133 D134 T162 Y261 T274M126-Q130 WeakPolarHBondContact O-CB 3.42Å; M126-Q130 WeakPolarHBondContact O-CG 3.19Å; M126-Q130 PolarHBondContact O-N 3.14Å; Y127-Q130 PolarHBondContact O-N 2.85Å; V128-Q130 PolarHBondContact O-N 3.47Å; Q130-M132 PolarHBondContact O-N 3.04Å; Q130-K133 WeakPolarHBondContact O-CB 3.48Å; Q130-K133 PolarHBondContact O-N 3.24Å; Q130-D134 PolarHBondContact O-N 3.38Å; Q130-T162 HydrophobicContact CG-CG2 4.18Å; Q130-Y261 VanDerWaalsContact C-OH 3.28Å; Q130-Y261 HydrophobicContact CB-CE2 4.24Å; Q130-Y261 WeakPolarHBondContact CB-OH 3.28Å; Q130-Y261 PolarHBondContact O-OH 3.01Å; Q130-Y261 VanDerWaalsContact O-OH 3.13Å; Q130-T274 WeakPolarHBondContact CB-OG1 3.5Å; Q130-T274 WeakPolarHBondContact CG-OG1 3.32Å
131V91.3Very high90Very high26 Ų2635.4 Ų35.416%0.15818%0.183CC..Hα-helixtrans-60.7-45.4173.8171.80000110.7Y127 V128 K133 D134 L135 Y261Y127-V131 HydrophobicContact CD1-CG2 4.4Å; Y127-V131 HydrophobicContact CD2-CG2 4.5Å; Y127-V131 HydrophobicContact CE1-CG2 4Å; Y127-V131 HydrophobicContact CE2-CG2 4.11Å; Y127-V131 WeakPolarHBondContact O-CB 3.47Å; Y127-V131 WeakPolarHBondContact O-CG2 3.43Å; Y127-V131 PolarHBondContact O-N 3.43Å; V128-V131 PolarHBondContact O-N 3.43Å; V131-K133 VanDerWaalsContact C-N 3.33Å; V131-K133 PolarHBondContact O-N 2.86Å; V131-D134 PolarHBondContact O-N 2.89Å; V131-L135 HydrophobicContact CG1-CD1 3.74Å; V131-L135 HydrophobicContact CG1-CG 4.21Å; V131-L135 WeakPolarHBondContact O-CB 3.46Å; V131-L135 VanDerWaalsContact O-CG 3.26Å; V131-L135 WeakPolarHBondContact O-CG 3.46Å; V131-L135 PolarHBondContact O-N 3.04Å; V131-Y261 HydrophobicContact CG2-CD2 4.1Å; V131-Y261 HydrophobicContact CG2-CE2 3.75Å
132M90.6Very high89Confident53 Ų5338.5 Ų38.526%0.26120%0.204SC..Hα-helixtrans-61.7-38.6177.8-75.5-176.972.800112.7V128 G129 Q130 D134 L135 L136 P160 I221V128-M132 HydrophobicContact CG1-CG 4.22Å; V128-M132 HydrophobicContact CG1-SD 3.82Å; V128-M132 WeakPolarHBondContact O-CB 3.31Å; V128-M132 VanDerWaalsContact O-CG 3.22Å; V128-M132 WeakPolarHBondContact O-CG 3.49Å; V128-M132 PolarHBondContact O-N 3.28Å; G129-M132 PolarHBondContact O-N 3.32Å; Q130-M132 PolarHBondContact O-N 3.04Å; M132-D134 VanDerWaalsContact C-N 3.34Å; M132-D134 PolarHBondContact O-N 3.47Å; M132-L135 PolarHBondContact O-N 3.07Å; M132-L136 HydrophobicContact CE-CD1 4.27Å; M132-L136 VanDerWaalsContact O-CB 3.31Å; M132-L136 WeakPolarHBondContact O-CB 3.33Å; M132-L136 VanDerWaalsContact O-CG 3.24Å; M132-L136 WeakPolarHBondContact O-CG 2.93Å; M132-L136 PolarHBondContact O-N 3.04Å; M132-P160 HydrophobicContact CB-CG 4.17Å; M132-I221 HydrophobicContact CE-CD1 3.44Å; M132-I221 VanDerWaalsContact CE-CD1 3.44Å; M132-I221 HydrophobicContact CE-CG1 4.18Å; M132-I221 HydrophobicContact SD-CD1 3.84Å; M132-I221 HydrophobicContact SD-CG1 4.43Å; M132-I221 HydrophobicContact SD-CG2 4.1Å
133K88.5Confident87.9Confident1 Ų140.2 Ų40.20%0.00422%0.218CC..Hα-helixtrans-57-48.8174.4-82.9-178177.2175.30112.1G129 Q130 V131 L135 L136 K137 E156 L159 P160 T162G129-K133 WeakPolarHBondContact O-CG 3.45Å; G129-K133 PolarHBondContact O-N 3.4Å; Q130-K133 WeakPolarHBondContact O-CB 3.48Å; Q130-K133 PolarHBondContact O-N 3.24Å; V131-K133 VanDerWaalsContact C-N 3.33Å; V131-K133 PolarHBondContact O-N 2.86Å; K133-L135 VanDerWaalsContact C-N 3.29Å; K133-L135 PolarHBondContact O-N 3.35Å; K133-L136 PolarHBondContact O-N 3.43Å; K133-K137 PolarHBondContact O-N 3.04Å; K133-E156 IonicContact NZ-OE2 3.76Å; K133-L159 VanDerWaalsContact CA-O 3.3Å; K133-L159 WeakPolarHBondContact CA-O 3.28Å; K133-L159 WeakPolarHBondContact CG-O 3.34Å; K133-P160 WeakPolarHBondContact CE-O 3.36Å; K133-T162 HydrophobicContact CD-CG2 4.1Å; K133-T162 PolarHBondContact NZ-OG1 2.94Å
134D86.2Confident86.6Confident4 Ų444.1 Ų44.12%0.02124%0.244CC..Hα-helixtrans-76.5-20.4-174.4-66.6-14.4000112.2Q130 V131 M132 K137 Y261 L264 T270Q130-D134 PolarHBondContact O-N 3.38Å; V131-D134 PolarHBondContact O-N 2.89Å; M132-D134 VanDerWaalsContact C-N 3.34Å; M132-D134 PolarHBondContact O-N 3.47Å; D134-K137 WeakPolarHBondContact O-CE 3.47Å; D134-K137 WeakPolarHBondContact O-CG 3.36Å; D134-Y261 VanDerWaalsContact OD2-CE1 3.24Å; D134-Y261 WeakPolarHBondContact OD2-CE1 3.26Å; D134-Y261 VanDerWaalsContact OD2-CZ 3.28Å; D134-Y261 PolarHBondContact OD2-OH 3.29Å; D134-L264 HydrophobicContact CB-CD1 4.28Å; D134-L264 HydrophobicContact CB-CD2 4.27Å; D134-L264 HydrophobicContact CB-CG 4.47Å; D134-T270 PolarHBondContact OD2-OG1 2.97Å
135L86.9Confident85.6Confident121 Ų12143.6 Ų43.663%0.63424%0.244SC*.Hα-helixtrans-80.3-43.8170.2-69.4175.8000113V131 M132 K133V131-L135 HydrophobicContact CG1-CD1 3.74Å; V131-L135 HydrophobicContact CG1-CG 4.21Å; V131-L135 WeakPolarHBondContact O-CB 3.46Å; V131-L135 VanDerWaalsContact O-CG 3.26Å; V131-L135 WeakPolarHBondContact O-CG 3.46Å; V131-L135 PolarHBondContact O-N 3.04Å; M132-L135 PolarHBondContact O-N 3.07Å; K133-L135 VanDerWaalsContact C-N 3.29Å; K133-L135 PolarHBondContact O-N 3.35Å
136L86.2Confident84.8Confident83 Ų8343.6 Ų43.644%0.43524%0.244SC..Hα-helixtrans-80.3-27.3-175.2-66.6172.8000112.9M132 K133 L138 L159M132-L136 HydrophobicContact CE-CD1 4.27Å; M132-L136 VanDerWaalsContact O-CB 3.31Å; M132-L136 WeakPolarHBondContact O-CB 3.33Å; M132-L136 VanDerWaalsContact O-CG 3.24Å; M132-L136 WeakPolarHBondContact O-CG 2.93Å; M132-L136 PolarHBondContact O-N 3.04Å; K133-L136 PolarHBondContact O-N 3.43Å; L136-L138 PolarHBondContact O-N 3.36Å; L136-L159 HydrophobicContact CD1-CD2 3.86Å; L136-L159 HydrophobicContact CD1-CG 4.21Å
137K85.2Confident84.1Confident94 Ų9443.1 Ų43.141%0.40924%0.242SC..  trans50.531.1173.8-59-172.2176.5-179.30115.1K133 D134 Y157K133-K137 PolarHBondContact O-N 3.04Å; D134-K137 WeakPolarHBondContact O-CE 3.47Å; D134-K137 WeakPolarHBondContact O-CG 3.36Å; K137-Y157 VanDerWaalsContact CA-CE1 3.47Å; K137-Y157 HydrophobicContact CB-CD1 4.04Å; K137-Y157 HydrophobicContact CB-CE1 3.57Å; K137-Y157 HydrophobicContact CB-CE2 4.25Å; K137-Y157 HydrophobicContact CG-CD2 4.45Å; K137-Y157 HydrophobicContact CG-CE1 4.06Å; K137-Y157 HydrophobicContact CG-CE2 3.85Å; K137-Y157 WeakPolarHBondContact O-CD1 3.11Å; K137-Y157 WeakPolarHBondContact O-CE1 3.21Å
138L83.2Confident83.4Confident53 Ų5343 Ų4328%0.27724%0.242SC..PPolyproline II helixtrans-77.5133.8-179.6-69.7-174.6000111.6L136 G158 L159L136-L138 PolarHBondContact O-N 3.36Å; L138-G158 PolarHBondContact O-N 3.21Å; L138-L159 HydrophobicContact CB-CB 4.07Å; L138-L159 HydrophobicContact CD1-CB 3.86Å; L138-L159 HydrophobicContact CD1-CD2 3.29Å; L138-L159 HydrophobicContact CD1-CG 4.16Å; L138-L159 HydrophobicContact CG-CB 4.42Å; L138-L159 HydrophobicContact CG-CD2 4.36Å
139P81.5Confident82.5Confident92 Ų9243.1 Ų43.160%0.59724%0.241SC*.PPolyproline II helixtrans-70.9149.9-179.230.2-35000111.5
140R82.3Confident81.4Confident22 Ų2244.3 Ų44.38%0.08325%0.247CC..PPolyproline II helixtrans-65.6159170.4-71.9-174-174-97.36.2111.2V153 E156 M209 H210R140-V153 PolarHBondContact NE-O 2.83Å; R140-V153 PolarHBondContact NH2-O 3.35Å; R140-E156 PolarHBondContact NE-O 2.96Å; R140-E156 IonicContact NH2-OE2 2.9Å; R140-M209 WeakPolarHBondContact CD-O 3.4Å; R140-M209 PolarHBondContact NH1-O 2.79Å; R140-H210 PolarHBondContact NH1-CE1 3.03Å; R140-H210 VanDerWaalsContact NH1-CE1 3.25Å; R140-H210 PolarHBondContact NH1-NE2 2.88Å
141P80.3Confident79.9Confident7 Ų746.4 Ų46.45%0.04526%0.26CS..PPolyproline II helixtrans-56.6135.7177.922.2-33.8000111.8P11 V146 K148P11-P141 HydrophobicContact CB-CB 4.17Å; P141-V146 HydrophobicContact CB-CG2 4.26Å; P141-K148 WeakPolarHBondContact O-CE 3.38Å
142P75.8Confident78.2Confident73 Ų7348.6 Ų48.647%0.47427%0.265SS..PPolyproline II helixtrans-67.1147.4-178.426.8-35.7000112.2P11 P144 V146P11-P142 HydrophobicContact CB-CG 4.13Å; P11-P142 HydrophobicContact CG-CG 3.89Å; P142-P144 CarbonylContact C-O 3.43Å; P142-P144 CarbonylContact O-C 3.43Å; P142-V146 PolarHBondContact O-N 3.13Å
143S71.9Confident76.6Confident49 Ų4946.9 Ų46.934%0.34326%0.258SS..THydrogen-bonded Turntrans-120.1114.7168.8-174.30000107.9R25 V146R25-S143 PolarHBondContact NH1-OG 3.28Å; S143-V146 WeakPolarHBondContact CB-O 3.37Å; S143-V146 PolarHBondContact OG-O 2.88Å
144P68.1Low75.2Confident88 Ų8849.3 Ų49.357%0.57127%0.271SS*.THydrogen-bonded Turncis-71.31582.44.68.6000114.6R25 P142R25-P144 VanDerWaalsContact NH1-CB 3.27Å; P142-P144 CarbonylContact C-O 3.43Å; P142-P144 CarbonylContact O-C 3.43Å
145P76Confident73.8Confident50 Ų5050.5 Ų50.533%0.32528%0.282SS..THydrogen-bonded Turncis-91.2-14.510.334.2-35.8000116.1P11 A15P11-P145 HydrophobicContact CB-CG 4.15Å; P11-P145 HydrophobicContact CG-CG 4.45Å; A15-P145 HydrophobicContact CB-CB 4.22Å; A15-P145 HydrophobicContact CB-CG 4.32Å
146V78.5Confident73.1Confident0 Ų045.3 Ų45.30%025%0.254CS..SBendtrans-73.9143.2-173.7177.70000112P11 V14 A15 P141 P142 S143P11-V146 HydrophobicContact CB-CG2 3.92Å; P11-V146 WeakPolarHBondContact O-CG2 3.43Å; V14-V146 HydrophobicContact CB-CG2 3.92Å; V14-V146 HydrophobicContact CG1-CG1 3.89Å; V14-V146 HydrophobicContact CG1-CG2 4.07Å; A15-V146 HydrophobicContact CB-CG2 4.49Å; P141-V146 HydrophobicContact CB-CG2 4.26Å; P142-V146 PolarHBondContact O-N 3.13Å; S143-V146 WeakPolarHBondContact CB-O 3.37Å; S143-V146 PolarHBondContact OG-O 2.88Å
147V79.4Confident72.8Confident3 Ų343.2 Ų43.22%0.01824%0.241CC..PPolyproline II helixtrans-88.9120.3169.8179.10000109Q18 L23 R25 Y76 L149Q18-V147 PolarHBondContact NE2-O 2.84Å; L23-V147 HydrophobicContact CD2-CB 4.14Å; L23-V147 HydrophobicContact CD2-CG1 4.26Å; R25-V147 HydrophobicContact CB-CG2 3.69Å; R25-V147 HydrophobicContact CG-CG2 4.22Å; Y76-V147 HydrophobicContact CD1-CG1 4.27Å; Y76-V147 HydrophobicContact CG-CG1 4.21Å; V147-L149 HydrophobicContact CG1-CD2 4.13Å
148K80.5Confident72.4Confident43 Ų4338.7 Ų38.719%0.18722%0.221CC..PPolyproline II helixtrans-92.7116.5175.8-68.1-177.5167.8-165.80110.1P141 D154 M209P141-K148 WeakPolarHBondContact O-CE 3.38Å; K148-D154 VanDerWaalsContact CD-OD1 3.28Å; K148-D154 WeakPolarHBondContact CD-OD1 3.45Å; K148-D154 WeakPolarHBondContact CE-OD1 3.28Å; K148-D154 IonicContact NZ-OD1 3.79Å; K148-D154 PolarHBondContact NZ-OD1 2.72Å; K148-M209 HydrophobicContact CB-SD 4.47Å; K148-M209 HydrophobicContact CG-SD 4.49Å
149L75.9Confident72.5Confident39 Ų3937 Ų3720%0.20421%0.212CC..SBendtrans-91.2-22.2178.4-65179.1000112.6L23 Y76 V147 Y206 T207L23-L149 HydrophobicContact CD2-CD1 4.05Å; L23-L149 HydrophobicContact CD2-CG 4.37Å; Y76-L149 HydrophobicContact CD1-CD2 4.21Å; Y76-L149 HydrophobicContact CD2-CD2 4.43Å; Y76-L149 HydrophobicContact CE1-CD2 3.94Å; Y76-L149 HydrophobicContact CE2-CD2 4.18Å; Y76-L149 HydrophobicContact CG-CD2 4.46Å; V147-L149 HydrophobicContact CG1-CD2 4.13Å; L149-Y206 HydrophobicContact CD1-CD1 3.97Å; L149-Y206 HydrophobicContact CD1-CE1 3.7Å; L149-T207 HydrophobicContact CB-CG2 4.35Å; L149-T207 HydrophobicContact CD1-CG2 4.45Å; L149-T207 PolarHBondContact N-O 3.04Å
150E69.3Low72.9Confident25 Ų2532.6 Ų32.612%0.11718%0.184CC..  trans-115.8114.8178.2-70.9171.8-153.500110.4R204 M209E150-R204 IonicContact OE1-CZ 3.5Å; E150-R204 IonicContact OE1-NH1 3.98Å; E150-R204 PolarHBondContact OE1-NH1 3.16Å; E150-R204 IonicContact OE2-CZ 3.11Å; E150-R204 IonicContact OE2-NH1 3.84Å; E150-R204 PolarHBondContact OE2-NH1 3.47Å; E150-R204 IonicContact OE2-NH2 3.94Å; E150-R204 PolarHBondContact OE2-NH2 3Å; E150-M209 HydrophobicContact CB-CE 4.24Å; E150-M209 HydrophobicContact CB-CG 3.97Å; E150-M209 HydrophobicContact CB-SD 3.94Å; E150-M209 WeakPolarHBondContact O-CE 3.12Å
151T60.5Low73.4Confident49 Ų4931.6 Ų31.630%0.30118%0.18SC..  trans-96.2-12.6-179.653.80000113.6V153 D154T151-V153 VanDerWaalsContact C-N 3.3Å; T151-V153 PolarHBondContact O-N 3.46Å; T151-D154 PolarHBondContact O-N 3.21Å
152R56.3Low73.9Confident71 Ų7131.3 Ų31.327%0.26818%0.178SC..THydrogen-bonded Turntrans-60.5-35.7-175.3178178.9169.2-177.6-1.8113.5D61D61-R152 IonicContact OD2-CZ 2.64Å; D61-R152 IonicContact OD2-NH1 3.94Å; D61-R152 PolarHBondContact OD2-NH1 3.05Å; D61-R152 IonicContact OD2-NH2 3.91Å
153V56.5Low74.7Confident17 Ų1729.1 Ų29.110%0.10316%0.161CC..THydrogen-bonded Turntrans-110.818-172.4-61.20000113R140 T151 A155 E156 M209R140-V153 PolarHBondContact NE-O 2.83Å; R140-V153 PolarHBondContact NH2-O 3.35Å; T151-V153 VanDerWaalsContact C-N 3.3Å; T151-V153 PolarHBondContact O-N 3.46Å; V153-A155 PolarHBondContact O-N 3.14Å; V153-E156 HydrophobicContact CB-CG 4.19Å; V153-E156 WeakPolarHBondContact O-CB 3.35Å; V153-E156 PolarHBondContact O-N 3.39Å; V153-M209 HydrophobicContact CG2-CE 3.36Å
154D58.7Low75.8Confident52 Ų5226.8 Ų26.828%0.27815%0.145SC..THydrogen-bonded Turntrans-63.1-27.1178.8-93.7-27.9000113.5K148 T151 E156K148-D154 VanDerWaalsContact CD-OD1 3.28Å; K148-D154 WeakPolarHBondContact CD-OD1 3.45Å; K148-D154 WeakPolarHBondContact CE-OD1 3.28Å; K148-D154 IonicContact NZ-OD1 3.79Å; K148-D154 PolarHBondContact NZ-OD1 2.72Å; T151-D154 PolarHBondContact O-N 3.21Å; D154-E156 VanDerWaalsContact C-N 3.28Å
155A57.5Low77.1Confident30 Ų3022.6 Ų22.625%0.24812%0.118CC..THydrogen-bonded Turntrans-79.3-8176.100000113.6Y66 V153Y66-A155 HydrophobicContact CE2-CB 3.83Å; V153-A155 PolarHBondContact O-N 3.14Å
156E71.1Confident78Confident12 Ų1220.2 Ų20.26%0.05610%0.102CC..SBendtrans-92.7152.6179.1-56.6-177170.200112K133 R140 V153 D154 T269 T270K133-E156 IonicContact NZ-OE2 3.76Å; R140-E156 PolarHBondContact NE-O 2.96Å; R140-E156 IonicContact NH2-OE2 2.9Å; V153-E156 HydrophobicContact CB-CG 4.19Å; V153-E156 WeakPolarHBondContact O-CB 3.35Å; V153-E156 PolarHBondContact O-N 3.39Å; D154-E156 VanDerWaalsContact C-N 3.28Å; E156-T269 PolarHBondContact OE1-OG1 2.88Å; E156-T270 HydrophobicContact CB-CG2 4.32Å; E156-T270 HydrophobicContact CG-CG2 3.91Å
157Y79.6Confident78.8Confident38 Ų3820.7 Ų20.715%0.14911%0.107CC..  trans-66.8152.1175-59.7-67.3000113.4K137 L264K137-Y157 VanDerWaalsContact CA-CE1 3.47Å; K137-Y157 HydrophobicContact CB-CD1 4.04Å; K137-Y157 HydrophobicContact CB-CE1 3.57Å; K137-Y157 HydrophobicContact CB-CE2 4.25Å; K137-Y157 HydrophobicContact CG-CD2 4.45Å; K137-Y157 HydrophobicContact CG-CE1 4.06Å; K137-Y157 HydrophobicContact CG-CE2 3.85Å; K137-Y157 WeakPolarHBondContact O-CD1 3.11Å; K137-Y157 WeakPolarHBondContact O-CE1 3.21Å; Y157-L264 HydrophobicContact CE2-CD1 4.12Å; Y157-L264 HydrophobicContact CE2-CD2 3.95Å
158G77.9Confident79.6Confident0 Ų020.8 Ų20.80%011%0.107CC..  trans-84.2-44.8-172.400000114.9L138 P160 H210L138-G158 PolarHBondContact O-N 3.21Å; G158-P160 CarbonylContact O-C 3.57Å; G158-H210 PolarHBondContact O-CE1 3.35Å; G158-H210 PolarHBondContact O-ND1 2.79Å
159L85.8Confident80.4Confident17 Ų1718.7 Ų18.79%0.08910%0.098CC..SBendtrans-99.8131.8-173.1-176.875.7000111.4K133 L136 L138 D214 C217K133-L159 VanDerWaalsContact CA-O 3.3Å; K133-L159 WeakPolarHBondContact CA-O 3.28Å; K133-L159 WeakPolarHBondContact CG-O 3.34Å; L136-L159 HydrophobicContact CD1-CD2 3.86Å; L136-L159 HydrophobicContact CD1-CG 4.21Å; L138-L159 HydrophobicContact CB-CB 4.07Å; L138-L159 HydrophobicContact CD1-CB 3.86Å; L138-L159 HydrophobicContact CD1-CD2 3.29Å; L138-L159 HydrophobicContact CD1-CG 4.16Å; L138-L159 HydrophobicContact CG-CB 4.42Å; L138-L159 HydrophobicContact CG-CD2 4.36Å; L159-D214 HydrophobicContact CD1-CB 4.37Å; L159-C217 HydrophobicContact CD1-CB 3.55Å
160P89.9Confident81.3Confident0 Ų017.8 Ų17.80%09%0.093CC..SBendcis-82.2160.1-11.132.8-36.4000113.7M132 K133 G158 T162 M165 I221M132-P160 HydrophobicContact CB-CG 4.17Å; K133-P160 WeakPolarHBondContact CE-O 3.36Å; G158-P160 CarbonylContact O-C 3.57Å; P160-T162 PolarHBondContact O-N 3.28Å; P160-M165 HydrophobicContact CB-SD 3.81Å; P160-M165 HydrophobicContact CG-CE 4.39Å; P160-M165 HydrophobicContact CG-SD 3.57Å; P160-M165 VanDerWaalsContact CG-SD 3.57Å; P160-I221 HydrophobicContact CB-CD1 3.84Å; P160-I221 HydrophobicContact CG-CD1 4Å
161S91.6Very high82.5Confident0 Ų017.3 Ų17.30%09%0.092CC..  trans-70.299.8175.2177.40000111.7H163 A164 M165 D214S161-H163 VanDerWaalsContact C-N 3.25Å; S161-H163 PolarHBondContact O-N 3.04Å; S161-A164 PolarHBondContact O-N 3.25Å; S161-A164 PolarHBondContact OG-N 2.87Å; S161-M165 VanDerWaalsContact O-CG 3.26Å; S161-M165 WeakPolarHBondContact O-CG 3.19Å; S161-M165 PolarHBondContact O-N 3.32Å; S161-D214 WeakPolarHBondContact CB-O 3.33Å; S161-D214 PolarHBondContact N-O 2.74Å
162T91.8Very high84.3Confident2 Ų217.6 Ų17.61%0.0129%0.09CC..Hα-helixtrans-62-29.1-18049.40000113.6Q130 K133 P160 M165 A166Q130-T162 HydrophobicContact CG-CG2 4.18Å; K133-T162 HydrophobicContact CD-CG2 4.1Å; K133-T162 PolarHBondContact NZ-OG1 2.94Å; P160-T162 PolarHBondContact O-N 3.28Å; T162-M165 PolarHBondContact O-N 3.17Å; T162-A166 WeakPolarHBondContact O-CB 3.34Å; T162-A166 PolarHBondContact O-N 2.68Å
163H92.2Very high86.1Confident26 Ų2614.2 Ų14.212%0.128%0.077CC..Hα-helixtrans-69.7-42.9175.9-69.143.2000111.1G94 S161 M165 A166 A167 V200 R204G94-H163 PolarHBondContact O-CD2 3.48Å; G94-H163 PolarHBondContact O-NE2 2.86Å; S161-H163 VanDerWaalsContact C-N 3.25Å; S161-H163 PolarHBondContact O-N 3.04Å; H163-M165 VanDerWaalsContact C-N 3.32Å; H163-A166 PolarHBondContact O-N 3.1Å; H163-A167 WeakPolarHBondContact O-CB 3.4Å; H163-A167 PolarHBondContact O-N 3.5Å; H163-V200 HydrophobicContact CB-CG1 4.35Å; H163-R204 HydrophobicContact CB-CG 3.99Å
164A94.1Very high88Confident0 Ų015.9 Ų15.90%09%0.085CC..Hα-helixtrans-65.6-38.7174.600000111.2S161 T168 V215 I219S161-A164 PolarHBondContact O-N 3.25Å; S161-A164 PolarHBondContact OG-N 2.87Å; A164-T168 VanDerWaalsContact O-CB 3.3Å; A164-T168 WeakPolarHBondContact O-CB 3.21Å; A164-T168 PolarHBondContact O-N 2.9Å; A164-T168 PolarHBondContact O-OG1 3.07Å; A164-V215 HydrophobicContact CB-CG1 4.2Å; A164-I219 HydrophobicContact CB-CG1 4.48Å
165M96.2Very high89.7Confident0 Ų013.8 Ų13.80%07%0.074CC..Hα-helixtrans-60.7-53.1174.3-68.1176.684.100111.7V125 P160 S161 T162 H163 A167 T168 A169 G218 I221 T222V125-M165 HydrophobicContact CG1-CB 3.62Å; V125-M165 HydrophobicContact CG1-CE 3.99Å; P160-M165 HydrophobicContact CB-SD 3.81Å; P160-M165 HydrophobicContact CG-CE 4.39Å; P160-M165 HydrophobicContact CG-SD 3.57Å; P160-M165 VanDerWaalsContact CG-SD 3.57Å; S161-M165 VanDerWaalsContact O-CG 3.26Å; S161-M165 WeakPolarHBondContact O-CG 3.19Å; S161-M165 PolarHBondContact O-N 3.32Å; T162-M165 PolarHBondContact O-N 3.17Å; H163-M165 VanDerWaalsContact C-N 3.32Å; M165-A167 PolarHBondContact O-N 2.9Å; M165-T168 PolarHBondContact O-N 3.37Å; M165-A169 WeakPolarHBondContact O-CB 3.48Å; M165-A169 PolarHBondContact O-N 3.38Å; M165-G218 VanDerWaalsContact CG-O 3.31Å; M165-G218 WeakPolarHBondContact CG-O 3.16Å; M165-I221 HydrophobicContact CE-CB 4.13Å; M165-I221 HydrophobicContact CE-CG2 3.64Å; M165-T222 VanDerWaalsContact CA-OG1 3.22Å; M165-T222 WeakPolarHBondContact CA-OG1 3.48Å; M165-T222 WeakPolarHBondContact CB-OG1 3.42Å; M165-T222 WeakPolarHBondContact CG-OG1 3.47Å
166A94.9Very high91.5Very high0 Ų015.1 Ų15.10%08%0.076CC..Hα-helixtrans-62.6-44.1-179.500000112.8Y99 M126 T162 H163 T168 A169 I170Y99-A166 HydrophobicContact CE1-CB 4.47Å; Y99-A166 WeakPolarHBondContact OH-CB 3.33Å; M126-A166 HydrophobicContact CG-CB 4.41Å; M126-A166 HydrophobicContact SD-CB 3.8Å; T162-A166 WeakPolarHBondContact O-CB 3.34Å; T162-A166 PolarHBondContact O-N 2.68Å; H163-A166 PolarHBondContact O-N 3.1Å; A166-T168 VanDerWaalsContact C-N 3.34Å; A166-T168 PolarHBondContact O-N 2.9Å; A166-A169 PolarHBondContact O-N 2.66Å; A166-I170 WeakPolarHBondContact O-CB 3.04Å; A166-I170 VanDerWaalsContact O-CG1 3.25Å; A166-I170 WeakPolarHBondContact O-CG1 3.47Å; A166-I170 PolarHBondContact O-N 3.14Å
167A95.1Very high92.6Very high11 Ų1114.6 Ų14.69%0.0917%0.074CC..Hα-helixtrans-61.1-44.4177.500000111.4H163 M165 S171 V200H163-A167 WeakPolarHBondContact O-CB 3.4Å; H163-A167 PolarHBondContact O-N 3.5Å; M165-A167 PolarHBondContact O-N 2.9Å; A167-S171 VanDerWaalsContact O-CB 3.24Å; A167-S171 WeakPolarHBondContact O-CB 3.37Å; A167-S171 PolarHBondContact O-N 3.13Å; A167-S171 PolarHBondContact O-OG 3.31Å; A167-S171 VanDerWaalsContact O-OG 3.06Å; A167-V200 HydrophobicContact CB-CB 3.63Å; A167-V200 HydrophobicContact CB-CG1 3.77Å; A167-V200 HydrophobicContact CB-CG2 3.95Å
168T96.6Very high93.1Very high4 Ų413.3 Ų13.33%0.0257%0.071CC..Hα-helixtrans-63.4-44.5176.1-54.70000111.2A164 M165 A166 F172 S197 I219 T222A164-T168 VanDerWaalsContact O-CB 3.3Å; A164-T168 WeakPolarHBondContact O-CB 3.21Å; A164-T168 PolarHBondContact O-N 2.9Å; A164-T168 PolarHBondContact O-OG1 3.07Å; M165-T168 PolarHBondContact O-N 3.37Å; A166-T168 VanDerWaalsContact C-N 3.34Å; A166-T168 PolarHBondContact O-N 2.9Å; T168-F172 HydrophobicContact CG2-CD2 3.75Å; T168-F172 HydrophobicContact CG2-CE2 4.11Å; T168-F172 WeakPolarHBondContact O-CB 3.19Å; T168-F172 WeakPolarHBondContact O-CD2 2.96Å; T168-F172 PolarHBondContact O-N 2.94Å; T168-S197 PolarHBondContact OG1-OG 3.42Å; T168-I219 HydrophobicContact CG2-CG2 4.38Å; T168-T222 HydrophobicContact CG2-CG2 3.95Å
169A96.6Very high93.7Very high0 Ų016 Ų160%09%0.089CC..Hα-helixtrans-60.3-52.8178.600000111.3V125 M165 A166 T173 T222V125-A169 HydrophobicContact CB-CB 4.11Å; V125-A169 HydrophobicContact CG1-CB 4.09Å; V125-A169 HydrophobicContact CG2-CB 3.9Å; M165-A169 WeakPolarHBondContact O-CB 3.48Å; M165-A169 PolarHBondContact O-N 3.38Å; A166-A169 PolarHBondContact O-N 2.66Å; A169-T173 WeakPolarHBondContact O-CB 3.26Å; A169-T173 PolarHBondContact O-N 3.23Å; A169-T173 PolarHBondContact O-OG1 2.91Å; A169-T222 HydrophobicContact CB-CG2 3.76Å
170I94.9Very high93.8Very high20 Ų2017.9 Ų17.910%0.10310%0.103CC..Hα-helixtrans-62.8-48.6-178-65.7168.6000110.5Y99 L118 W122 A166 L174Y99-I170 HydrophobicContact CD1-CD1 3.92Å; Y99-I170 HydrophobicContact CE1-CD1 3.55Å; L118-I170 HydrophobicContact CD2-CB 4.41Å; L118-I170 HydrophobicContact CD2-CG2 4.1Å; L118-I170 WeakPolarHBondContact CD2-O 3.37Å; W122-I170 HydrophobicContact CB-CG1 4.34Å; W122-I170 HydrophobicContact CG-CD1 4.42Å; A166-I170 WeakPolarHBondContact O-CB 3.04Å; A166-I170 VanDerWaalsContact O-CG1 3.25Å; A166-I170 WeakPolarHBondContact O-CG1 3.47Å; A166-I170 PolarHBondContact O-N 3.14Å; I170-L174 VanDerWaalsContact O-CB 3.3Å; I170-L174 WeakPolarHBondContact O-CB 3.49Å; I170-L174 PolarHBondContact O-N 3.05Å; I170-L174 VanDerWaalsContact O-N 3.07Å
171S95.6Very high93.6Very high14 Ų1418.9 Ų18.910%0.09811%0.107CC..Hα-helixtrans-64.3-47.2-177.5-67.30000113A167 L175A167-S171 VanDerWaalsContact O-CB 3.24Å; A167-S171 WeakPolarHBondContact O-CB 3.37Å; A167-S171 PolarHBondContact O-N 3.13Å; A167-S171 PolarHBondContact O-OG 3.31Å; A167-S171 VanDerWaalsContact O-OG 3.06Å; S171-L175 WeakPolarHBondContact O-CB 3.43Å; S171-L175 PolarHBondContact O-N 2.83Å
172F96.7Very high93.4Very high56 Ų5620 Ų2025%0.24611%0.114CC..Hα-helixtrans-79.3-33.5-177.4-77.6-87.4000112.9T168 L174 L175 L176 L190 I226T168-F172 HydrophobicContact CG2-CD2 3.75Å; T168-F172 HydrophobicContact CG2-CE2 4.11Å; T168-F172 WeakPolarHBondContact O-CB 3.19Å; T168-F172 WeakPolarHBondContact O-CD2 2.96Å; T168-F172 PolarHBondContact O-N 2.94Å; F172-L174 VanDerWaalsContact C-N 3.31Å; F172-L174 PolarHBondContact O-N 3.06Å; F172-L175 HydrophobicContact CD1-CD2 4.11Å; F172-L175 HydrophobicContact CE1-CD2 4.35Å; F172-L175 PolarHBondContact O-N 3.05Å; F172-L176 WeakPolarHBondContact O-CB 3.48Å; F172-L176 VanDerWaalsContact O-CG 3.24Å; F172-L176 WeakPolarHBondContact O-CG 3.34Å; F172-L176 PolarHBondContact O-N 3.43Å; F172-L190 HydrophobicContact CE1-CD1 3.94Å; F172-I226 HydrophobicContact CB-CD1 3.84Å
173T96.1Very high93.1Very high0 Ų025 Ų250%014%0.137CC..Hα-helixtrans-64.2-37.6172.1-65.90000111.5R117 L118 M121 A169 S177 W233R117-T173 HydrophobicContact CB-CG2 4.14Å; L118-T173 HydrophobicContact CD2-CG2 3.91Å; L118-T173 HydrophobicContact CG-CG2 4.47Å; M121-T173 HydrophobicContact CB-CG2 4.11Å; M121-T173 HydrophobicContact CG-CG2 3.9Å; A169-T173 WeakPolarHBondContact O-CB 3.26Å; A169-T173 PolarHBondContact O-N 3.23Å; A169-T173 PolarHBondContact O-OG1 2.91Å; T173-S177 VanDerWaalsContact O-CB 3.24Å; T173-S177 WeakPolarHBondContact O-CB 3.34Å; T173-S177 PolarHBondContact O-N 3Å; T173-S177 PolarHBondContact O-OG 2.82Å; T173-W233 HydrophobicContact CG2-CH2 3.78Å; T173-W233 HydrophobicContact CG2-CZ2 4.29Å; T173-W233 HydrophobicContact CG2-CZ3 4.02Å
174L94.6Very high92.9Very high51 Ų5126.8 Ų26.827%0.26715%0.145SC..Hα-helixtrans-64.6-49173.5-177.360.2000110.8L110 L114 L118 I170 F172 L176 S177 A178L110-L174 HydrophobicContact CD2-CD1 4.29Å; L114-L174 HydrophobicContact CB-CD1 4.28Å; L114-L174 HydrophobicContact CD1-CD1 4.06Å; L118-L174 HydrophobicContact CD1-CB 4.47Å; L118-L174 HydrophobicContact CD1-CD1 4.27Å; L118-L174 HydrophobicContact CD2-CB 4.01Å; I170-L174 VanDerWaalsContact O-CB 3.3Å; I170-L174 WeakPolarHBondContact O-CB 3.49Å; I170-L174 PolarHBondContact O-N 3.05Å; I170-L174 VanDerWaalsContact O-N 3.07Å; F172-L174 VanDerWaalsContact C-N 3.31Å; F172-L174 PolarHBondContact O-N 3.06Å; L174-L176 VanDerWaalsContact C-N 3.3Å; L174-L176 PolarHBondContact O-N 3.18Å; L174-S177 PolarHBondContact O-N 3.07Å; L174-A178 WeakPolarHBondContact O-CB 3.4Å; L174-A178 PolarHBondContact O-N 3.03Å
175L95.4Very high92.7Very high9 Ų930 Ų305%0.04717%0.166CC..Hα-helixtrans-55.9-43.4178174.962.5000112.8S171 F172 P179 F184 F186 G189 L190 A193S171-L175 WeakPolarHBondContact O-CB 3.43Å; S171-L175 PolarHBondContact O-N 2.83Å; F172-L175 HydrophobicContact CD1-CD2 4.11Å; F172-L175 HydrophobicContact CE1-CD2 4.35Å; F172-L175 PolarHBondContact O-N 3.05Å; L175-P179 WeakPolarHBondContact O-CD 3.26Å; L175-F184 HydrophobicContact CD1-CE2 4.03Å; L175-F184 HydrophobicContact CD1-CZ 4.28Å; L175-F186 HydrophobicContact CD1-CD2 3.97Å; L175-F186 HydrophobicContact CD1-CE2 3.73Å; L175-F186 HydrophobicContact CD1-CZ 4.31Å; L175-F186 HydrophobicContact CD2-CE2 4.36Å; L175-F186 HydrophobicContact CD2-CZ 4.21Å; L175-F186 HydrophobicContact CG-CE2 3.84Å; L175-F186 HydrophobicContact CG-CZ 4.2Å; L175-G189 VanDerWaalsContact CD1-C 3.41Å; L175-L190 HydrophobicContact CD2-CB 4.12Å; L175-L190 HydrophobicContact CD2-CD1 3.74Å; L175-A193 HydrophobicContact CB-CB 4.23Å; L175-A193 HydrophobicContact CD2-CB 4.03Å
176L95.1Very high92.5Very high57 Ų5734.9 Ų34.930%0.29819%0.188SC..Hα-helixtrans-78.1-26.6-177.2-67.8174.3000112.8F172 L174 I226 Y230 W233F172-L176 WeakPolarHBondContact O-CB 3.48Å; F172-L176 VanDerWaalsContact O-CG 3.24Å; F172-L176 WeakPolarHBondContact O-CG 3.34Å; F172-L176 PolarHBondContact O-N 3.43Å; L174-L176 VanDerWaalsContact C-N 3.3Å; L174-L176 PolarHBondContact O-N 3.18Å; L176-I226 HydrophobicContact CD1-CG2 3.72Å; L176-Y230 HydrophobicContact CB-CE2 4.13Å; L176-Y230 HydrophobicContact CD1-CD2 4.22Å; L176-Y230 HydrophobicContact CD1-CE2 4.37Å; L176-W233 HydrophobicContact CB-CH2 4.39Å; L176-W233 HydrophobicContact CB-CZ3 4.07Å; L176-W233 HydrophobicContact CD1-CH2 4.23Å
177S93.4Very high92.5Very high1 Ų142.3 Ų42.31%0.00722%0.222CC..Hα-helixtrans-92.1-26.2-179.6-55.50000113.5L114 R117 T173 L174 P179 S180L114-S177 VanDerWaalsContact CD2-C 3.47Å; L114-S177 WeakPolarHBondContact CD2-O 3.35Å; R117-S177 VanDerWaalsContact CD-OG 3.25Å; R117-S177 WeakPolarHBondContact CD-OG 3.3Å; T173-S177 VanDerWaalsContact O-CB 3.24Å; T173-S177 WeakPolarHBondContact O-CB 3.34Å; T173-S177 PolarHBondContact O-N 3Å; T173-S177 PolarHBondContact O-OG 2.82Å; L174-S177 PolarHBondContact O-N 3.07Å; S177-P179 VanDerWaalsContact C-CD 3.42Å; S177-S180 PolarHBondContact O-OG 3.09Å
178A90.9Very high92.4Very high11 Ų1145.5 Ų45.59%0.09124%0.241CC..G310 helixtrans-62-35.7-177.300000115.1L174 S180 R181 V182 F184L174-A178 WeakPolarHBondContact O-CB 3.4Å; L174-A178 PolarHBondContact O-N 3.03Å; A178-S180 PolarHBondContact O-N 3.43Å; A178-S180 VanDerWaalsContact O-N 3.14Å; A178-R181 PolarHBondContact O-N 3.25Å; A178-V182 PolarHBondContact O-N 3.48Å; A178-F184 HydrophobicContact CB-CD1 4.35Å; A178-F184 HydrophobicContact CB-CE1 3.38Å; A178-F184 HydrophobicContact CB-CZ 3.79Å
179P90Very high92.2Very high58 Ų5845.9 Ų45.938%0.37725%0.246SC..G310 helixtrans-60.8-25.3-176-27.535.8000114.8L175 S177 R181 F184 F186L175-P179 WeakPolarHBondContact O-CD 3.26Å; S177-P179 VanDerWaalsContact C-CD 3.42Å; P179-R181 VanDerWaalsContact C-N 3.26Å; P179-R181 PolarHBondContact O-N 3.23Å; P179-F184 HydrophobicContact CG-CE1 4.09Å; P179-F184 HydrophobicContact CG-CZ 3.94Å; P179-F186 HydrophobicContact CG-CD2 4.42Å
180S87.3Confident92.2Very high56 Ų5649.5 Ų49.539%0.39227%0.265SS..G310 helixtrans-77.6-11.7176.462.80000113.4S177 A178S177-S180 PolarHBondContact O-OG 3.09Å; A178-S180 PolarHBondContact O-N 3.43Å; A178-S180 VanDerWaalsContact O-N 3.14Å
181R86.7Confident92.2Very high21 Ų2154 Ų548%0.07929%0.288CS..THydrogen-bonded Turntrans-123-37.7-172.5-53.3-61.9-76.4-140.9-11.8113.3D111 F113 L114 A178 P179 E299 P305 V306D111-R181 VanDerWaalsContact CG-NH2 3.32Å; D111-R181 IonicContact OD1-CZ 2.83Å; D111-R181 IonicContact OD1-NH2 3.81Å; D111-R181 PolarHBondContact OD1-NH2 3.22Å; D111-R181 WeakPolarHBondContact OD2-CG 3.41Å; D111-R181 IonicContact OD2-CZ 3.11Å; D111-R181 IonicContact OD2-NE 2.75Å; D111-R181 PolarHBondContact OD2-NE 3.06Å; D111-R181 IonicContact OD2-NH2 3.74Å; D111-R181 PolarHBondContact OD2-NH2 3.41Å; F113-R181 HydrophobicContact CD1-CG 3.66Å; F113-R181 HydrophobicContact CE1-CG 3.94Å; L114-R181 HydrophobicContact CD2-CG 4.24Å; L114-R181 HydrophobicContact CG-CG 4.46Å; A178-R181 PolarHBondContact O-N 3.25Å; P179-R181 VanDerWaalsContact C-N 3.26Å; P179-R181 PolarHBondContact O-N 3.23Å; R181-E299 IonicContact CZ-OE2 3.54Å; R181-E299 IonicContact NH1-OE2 3.33Å; R181-E299 PolarHBondContact NH1-OE2 3Å; R181-E299 IonicContact NH2-OE2 2.77Å; R181-E299 PolarHBondContact NH2-OE2 2.77Å; R181-P305 CarbonylContact O-C 3.59Å; R181-P305 WeakPolarHBondContact O-CA 3.32Å; R181-V306 PolarHBondContact O-N 3.48Å
182V86.5Confident92.2Very high24 Ų2457.6 Ų57.615%0.14531%0.305CS..EExtended strand (participates in β ladder)trans-129.3135.3-172.6-176.10000110.4A178 F184 V306 L308A178-V182 PolarHBondContact O-N 3.48Å; V182-F184 VanDerWaalsContact O-CD1 3.3Å; V182-F184 WeakPolarHBondContact O-CD1 3.24Å; V182-V306 WeakPolarHBondContact CA-O 3.38Å; V182-L308 HydrophobicContact CG1-CD1 4.38Å; V182-L308 HydrophobicContact CG1-CD2 4.19Å; V182-L308 HydrophobicContact CG1-CG 3.7Å
183Q85.7Confident92.2Very high107 Ų10755.1 Ų55.150%0.530%0.295SS..EExtended strand (participates in β ladder)trans-81.7118.4173.1-60.9-178.86.400110.1P305 V306 L308Q183-P305 HydrophobicContact CG-CB 3.79Å; Q183-P305 HydrophobicContact CG-CG 3.6Å; Q183-P305 PolarHBondContact NE2-O 3.38Å; Q183-V306 PolarHBondContact N-O 3.2Å; Q183-L308 WeakPolarHBondContact O-CD1 3.33Å
184F87.7Confident92.2Very high63 Ų6357.1 Ų57.128%0.27631%0.312SS..  trans-151.9161.6173.566.6-80.6000110.5L175 A178 P179 V182 F186 L308L175-F184 HydrophobicContact CD1-CE2 4.03Å; L175-F184 HydrophobicContact CD1-CZ 4.28Å; A178-F184 HydrophobicContact CB-CD1 4.35Å; A178-F184 HydrophobicContact CB-CE1 3.38Å; A178-F184 HydrophobicContact CB-CZ 3.79Å; P179-F184 HydrophobicContact CG-CE1 4.09Å; P179-F184 HydrophobicContact CG-CZ 3.94Å; V182-F184 VanDerWaalsContact O-CD1 3.3Å; V182-F184 WeakPolarHBondContact O-CD1 3.24Å; F184-F186 PolarHBondContact O-N 2.9Å; F184-L308 HydrophobicContact CB-CD1 3.74Å
185C91.3Very high92.2Very high67 Ų6758.1 Ų58.145%0.45332%0.32SS..  trans-70.6112.6172.7-179.50000109.8Q187 T188 G189C185-Q187 PolarHBondContact O-N 3.11Å; C185-T188 WeakPolarHBondContact O-CB 3.5Å; C185-T188 PolarHBondContact O-N 3.07Å; C185-G189 PolarHBondContact O-N 3.03Å; C185-G189 VanDerWaalsContact O-N 3.09Å
186F91.8Very high92.1Very high102 Ų10261.4 Ų61.445%0.44734%0.337SS..Hα-helixtrans-54.7-38-177.6-175.9-98000112.8L175 P179 F184 T188 G189 L190L175-F186 HydrophobicContact CD1-CD2 3.97Å; L175-F186 HydrophobicContact CD1-CE2 3.73Å; L175-F186 HydrophobicContact CD1-CZ 4.31Å; L175-F186 HydrophobicContact CD2-CE2 4.36Å; L175-F186 HydrophobicContact CD2-CZ 4.21Å; L175-F186 HydrophobicContact CG-CE2 3.84Å; L175-F186 HydrophobicContact CG-CZ 4.2Å; P179-F186 HydrophobicContact CG-CD2 4.42Å; F184-F186 PolarHBondContact O-N 2.9Å; F186-T188 VanDerWaalsContact C-N 3.32Å; F186-T188 PolarHBondContact O-N 3.08Å; F186-G189 PolarHBondContact O-N 3.32Å; F186-L190 WeakPolarHBondContact O-CB 3.38Å; F186-L190 PolarHBondContact O-N 3.14Å
187Q94.3Very high92.2Very high156 Ų15659 Ų5973%0.72933%0.326SS*.Hα-helixtrans-61.8-38.9177.1-64.6175.4-14.600112.3C185 L190 L191C185-Q187 PolarHBondContact O-N 3.11Å; Q187-L190 PolarHBondContact O-N 3.07Å; Q187-L191 PolarHBondContact O-N 3.13Å
188T92.4Very high92.2Very high78 Ų7861.6 Ų61.648%0.47934%0.344SS..Hα-helixtrans-67-43.2175-53.70000110.7C185 F186 L190 L191 I192C185-T188 WeakPolarHBondContact O-CB 3.5Å; C185-T188 PolarHBondContact O-N 3.07Å; F186-T188 VanDerWaalsContact C-N 3.32Å; F186-T188 PolarHBondContact O-N 3.08Å; T188-L190 VanDerWaalsContact C-N 3.33Å; T188-L190 PolarHBondContact O-N 3Å; T188-L191 PolarHBondContact O-N 2.77Å; T188-I192 HydrophobicContact CG2-CD1 4.14Å; T188-I192 WeakPolarHBondContact O-CG1 3.46Å; T188-I192 PolarHBondContact O-N 3.18Å
189G93.3Very high92.4Very high12 Ų1263.3 Ų63.312%0.12435%0.351CS..Hα-helixtrans-61.1-40.9174.800000112.8L175 C185 F186 I192 A193L175-G189 VanDerWaalsContact CD1-C 3.41Å; C185-G189 PolarHBondContact O-N 3.03Å; C185-G189 VanDerWaalsContact O-N 3.09Å; F186-G189 PolarHBondContact O-N 3.32Å; G189-I192 PolarHBondContact O-N 2.98Å; G189-A193 WeakPolarHBondContact O-CB 3.39Å; G189-A193 PolarHBondContact O-N 3.3Å
190L95.9Very high92.6Very high77 Ų7760.9 Ų60.940%0.40334%0.335SS..Hα-helixtrans-62.1-43.3176.2179.663.7000111.5F172 L175 F186 Q187 T188 A193 A194F172-L190 HydrophobicContact CE1-CD1 3.94Å; L175-L190 HydrophobicContact CD2-CB 4.12Å; L175-L190 HydrophobicContact CD2-CD1 3.74Å; F186-L190 WeakPolarHBondContact O-CB 3.38Å; F186-L190 PolarHBondContact O-N 3.14Å; Q187-L190 PolarHBondContact O-N 3.07Å; T188-L190 VanDerWaalsContact C-N 3.33Å; T188-L190 PolarHBondContact O-N 3Å; L190-A193 PolarHBondContact O-N 3.26Å; L190-A194 VanDerWaalsContact O-CB 3.27Å; L190-A194 WeakPolarHBondContact O-CB 3.45Å; L190-A194 PolarHBondContact O-N 3.03Å
191L96.4Very high92.9Very high114 Ų11458.4 Ų58.460%0.59732%0.318SS*.Hα-helixtrans-62.4-42.6175.6-172.7125.9000111.4Q187 T188 T195Q187-L191 PolarHBondContact O-N 3.13Å; T188-L191 PolarHBondContact O-N 2.77Å; L191-T195 WeakPolarHBondContact O-CB 3.45Å; L191-T195 WeakPolarHBondContact O-CG2 3.32Å; L191-T195 PolarHBondContact O-N 3.24Å; L191-T195 PolarHBondContact O-OG1 2.94Å
192I94.8Very high93.2Very high89 Ų8960.6 Ų60.646%0.45633%0.331SS..Hα-helixtrans-63.5-46.1175.6-66.6166.1000111T188 G189 A194 T195 L196T188-I192 HydrophobicContact CG2-CD1 4.14Å; T188-I192 WeakPolarHBondContact O-CG1 3.46Å; T188-I192 PolarHBondContact O-N 3.18Å; G189-I192 PolarHBondContact O-N 2.98Å; I192-A194 PolarHBondContact O-N 2.51Å; I192-T195 WeakPolarHBondContact CA-OG1 3.49Å; I192-T195 PolarHBondContact O-N 3.12Å; I192-T195 PolarHBondContact O-OG1 3Å; I192-L196 HydrophobicContact CG2-CD1 3.86Å; I192-L196 HydrophobicContact CG2-CG 4.35Å; I192-L196 WeakPolarHBondContact O-CB 3.37Å; I192-L196 WeakPolarHBondContact O-CG 3.31Å; I192-L196 PolarHBondContact O-N 3.34Å
193A95.7Very high93.5Very high4 Ų459.4 Ų59.43%0.03332%0.324CS..Hα-helixtrans-63.6-43.8179.800000112.1L175 G189 L190 S197L175-A193 HydrophobicContact CB-CB 4.23Å; L175-A193 HydrophobicContact CD2-CB 4.03Å; G189-A193 WeakPolarHBondContact O-CB 3.39Å; G189-A193 PolarHBondContact O-N 3.3Å; L190-A193 PolarHBondContact O-N 3.26Å; A193-S197 VanDerWaalsContact O-CB 3.31Å; A193-S197 WeakPolarHBondContact O-CB 3.32Å; A193-S197 PolarHBondContact O-N 3.24Å
194A96.3Very high93.8Very high43 Ų4354.4 Ų54.436%0.35530%0.3SS..Hα-helixtrans-66.4-39.9177.500000112.1L190 I192 S198L190-A194 VanDerWaalsContact O-CB 3.27Å; L190-A194 WeakPolarHBondContact O-CB 3.45Å; L190-A194 PolarHBondContact O-N 3.03Å; I192-A194 PolarHBondContact O-N 2.51Å; A194-S198 WeakPolarHBondContact O-CB 3.29Å; A194-S198 PolarHBondContact O-N 3.14Å; A194-S198 PolarHBondContact O-OG 2.83Å
195T95.5Very high93.9Very high71 Ų7152 Ų5244%0.43629%0.291SS..Hα-helixtrans-67.6-45.1177.449.50000111.8L191 I192 S198 L199L191-T195 WeakPolarHBondContact O-CB 3.45Å; L191-T195 WeakPolarHBondContact O-CG2 3.32Å; L191-T195 PolarHBondContact O-N 3.24Å; L191-T195 PolarHBondContact O-OG1 2.94Å; I192-T195 WeakPolarHBondContact CA-OG1 3.49Å; I192-T195 PolarHBondContact O-N 3.12Å; I192-T195 PolarHBondContact O-OG1 3Å; T195-S198 WeakPolarHBondContact CA-OG 3.34Å; T195-S198 PolarHBondContact O-N 2.91Å; T195-S198 PolarHBondContact O-OG 3.42Å; T195-L199 WeakPolarHBondContact O-CB 3.48Å; T195-L199 PolarHBondContact O-N 3.42Å
196L94Very high93.8Very high78 Ų7848.9 Ų48.941%0.40827%0.269SS..Hα-helixtrans-63.7-47.1176.9-69.8175.2000112.4I192 L199 V200I192-L196 HydrophobicContact CG2-CD1 3.86Å; I192-L196 HydrophobicContact CG2-CG 4.35Å; I192-L196 WeakPolarHBondContact O-CB 3.37Å; I192-L196 WeakPolarHBondContact O-CG 3.31Å; I192-L196 PolarHBondContact O-N 3.34Å; L196-L199 PolarHBondContact O-N 2.95Å; L196-V200 PolarHBondContact O-N 2.92Å
197S95.5Very high93.6Very high8 Ų844 Ų446%0.05625%0.248CC..Hα-helixtrans-62.1-44.9177.6167.90000111.7T168 A193 S201T168-S197 PolarHBondContact OG1-OG 3.42Å; A193-S197 VanDerWaalsContact O-CB 3.31Å; A193-S197 WeakPolarHBondContact O-CB 3.32Å; A193-S197 PolarHBondContact O-N 3.24Å; S197-S201 VanDerWaalsContact O-CB 3.23Å; S197-S201 WeakPolarHBondContact O-CB 3.43Å; S197-S201 PolarHBondContact O-N 3.07Å; S197-S201 PolarHBondContact O-OG 2.7Å
198S94.8Very high93Very high55 Ų5536.6 Ų36.639%0.38521%0.213SC..Hα-helixtrans-67.3-38.8178.159.60000112.4A194 T195 V200 S201 L202A194-S198 WeakPolarHBondContact O-CB 3.29Å; A194-S198 PolarHBondContact O-N 3.14Å; A194-S198 PolarHBondContact O-OG 2.83Å; T195-S198 WeakPolarHBondContact CA-OG 3.34Å; T195-S198 PolarHBondContact O-N 2.91Å; T195-S198 PolarHBondContact O-OG 3.42Å; S198-V200 PolarHBondContact O-N 3.47Å; S198-S201 PolarHBondContact O-N 2.86Å; S198-L202 WeakPolarHBondContact O-CB 3.47Å; S198-L202 VanDerWaalsContact O-CG 3.22Å; S198-L202 WeakPolarHBondContact O-CG 3.22Å; S198-L202 PolarHBondContact O-N 3.23Å
199L94.5Very high92.6Very high46 Ų4632.9 Ų32.924%0.24119%0.19CC..Hα-helixtrans-60.7-45.1179-166.671.6000111.5L86 S90 T195 L196 S203L86-L199 HydrophobicContact CD1-CD1 4.3Å; L86-L199 HydrophobicContact CD2-CD1 3.98Å; L86-L199 HydrophobicContact CG-CD1 4.04Å; S90-L199 WeakPolarHBondContact OG-CG 3.27Å; S90-L199 PolarHBondContact OG-O 3.32Å; T195-L199 WeakPolarHBondContact O-CB 3.48Å; T195-L199 PolarHBondContact O-N 3.42Å; L196-L199 PolarHBondContact O-N 2.95Å; L199-S203 PolarHBondContact O-N 3.49Å; L199-S203 VanDerWaalsContact O-N 3.12Å
200V93.8Very high92.4Very high7 Ų732.3 Ų32.34%0.04218%0.184CC..Hα-helixtrans-72-36.6177.3179.90000111.5S90 L93 H163 A167 L196 S198 S203 R204S90-V200 VanDerWaalsContact OG-CA 3.28Å; S90-V200 WeakPolarHBondContact OG-CA 3.31Å; S90-V200 PolarHBondContact OG-N 3.36Å; L93-V200 HydrophobicContact CB-CG2 4.02Å; L93-V200 HydrophobicContact CD1-CG2 4.16Å; H163-V200 HydrophobicContact CB-CG1 4.35Å; A167-V200 HydrophobicContact CB-CB 3.63Å; A167-V200 HydrophobicContact CB-CG1 3.77Å; A167-V200 HydrophobicContact CB-CG2 3.95Å; L196-V200 PolarHBondContact O-N 2.92Å; S198-V200 PolarHBondContact O-N 3.47Å; V200-S203 PolarHBondContact O-N 3.02Å; V200-S203 PolarHBondContact O-OG 3.13Å; V200-R204 PolarHBondContact O-N 3.32Å
201S94Very high92.1Very high5 Ų528.8 Ų28.84%0.03517%0.166CC..Hα-helixtrans-63.6-45176.6-650000112.2S197 S198 S203 R204S197-S201 VanDerWaalsContact O-CB 3.23Å; S197-S201 WeakPolarHBondContact O-CB 3.43Å; S197-S201 PolarHBondContact O-N 3.07Å; S197-S201 PolarHBondContact O-OG 2.7Å; S198-S201 PolarHBondContact O-N 2.86Å; S201-S203 VanDerWaalsContact C-N 3.34Å; S201-R204 PolarHBondContact O-N 3Å
202L93.6Very high91.9Very high66 Ų6625.5 Ų25.535%0.34615%0.151SC..Hα-helixtrans-69.9-30.2178.4-69174.5000112.4F17 F87 S198 R204 L205 Y206F17-L202 HydrophobicContact CE2-CD2 4.16Å; F17-L202 HydrophobicContact CZ-CB 4.16Å; F17-L202 HydrophobicContact CZ-CD2 4.03Å; F87-L202 HydrophobicContact CE1-CB 3.8Å; S198-L202 WeakPolarHBondContact O-CB 3.47Å; S198-L202 VanDerWaalsContact O-CG 3.22Å; S198-L202 WeakPolarHBondContact O-CG 3.22Å; S198-L202 PolarHBondContact O-N 3.23Å; L202-R204 VanDerWaalsContact C-N 3.27Å; L202-R204 PolarHBondContact O-N 3.11Å; L202-L205 HydrophobicContact CD2-CD1 4.16Å; L202-L205 WeakPolarHBondContact O-CB 3.08Å; L202-L205 PolarHBondContact O-N 2.75Å; L202-Y206 PolarHBondContact O-N 3.32Å
203S92.7Very high91.7Very high0 Ų022.1 Ų22.10%013%0.134CC..Hα-helixtrans-64-32.9176.772.10000112.2F87 S90 A91 L199 V200 S201 L205 Y206 T207F87-S203 VanDerWaalsContact O-CB 3.29Å; F87-S203 WeakPolarHBondContact O-CB 3.34Å; S90-S203 WeakPolarHBondContact OG-CB 3.48Å; S90-S203 PolarHBondContact OG-OG 3.1Å; A91-S203 WeakPolarHBondContact CA-OG 3.39Å; A91-S203 PolarHBondContact N-OG 3.39Å; L199-S203 PolarHBondContact O-N 3.49Å; L199-S203 VanDerWaalsContact O-N 3.12Å; V200-S203 PolarHBondContact O-N 3.02Å; V200-S203 PolarHBondContact O-OG 3.13Å; S201-S203 VanDerWaalsContact C-N 3.34Å; S203-L205 VanDerWaalsContact C-N 3.34Å; S203-L205 PolarHBondContact O-N 2.9Å; S203-Y206 WeakPolarHBondContact O-CB 3.28Å; S203-Y206 PolarHBondContact O-N 3.47Å; S203-T207 WeakPolarHBondContact O-CG2 2.89Å; S203-T207 PolarHBondContact O-N 3.28Å; S203-T207 PolarHBondContact O-OG1 2.99Å
204R91.8Very high91.5Very high1 Ų122 Ų220%0.00413%0.133CC..Hα-helixtrans-67-31.5174.6-58.7-46.3-66.9163.21.7114E150 H163 V200 S201 L202 T207 M209 H210 V215E150-R204 IonicContact OE1-CZ 3.5Å; E150-R204 IonicContact OE1-NH1 3.98Å; E150-R204 PolarHBondContact OE1-NH1 3.16Å; E150-R204 IonicContact OE2-CZ 3.11Å; E150-R204 IonicContact OE2-NH1 3.84Å; E150-R204 PolarHBondContact OE2-NH1 3.47Å; E150-R204 IonicContact OE2-NH2 3.94Å; E150-R204 PolarHBondContact OE2-NH2 3Å; H163-R204 HydrophobicContact CB-CG 3.99Å; V200-R204 PolarHBondContact O-N 3.32Å; S201-R204 PolarHBondContact O-N 3Å; L202-R204 VanDerWaalsContact C-N 3.27Å; L202-R204 PolarHBondContact O-N 3.11Å; R204-T207 PolarHBondContact O-OG1 3.49Å; R204-M209 VanDerWaalsContact NH2-CB 3.31Å; R204-M209 PolarHBondContact O-N 2.89Å; R204-H210 HydrophobicContact CB-CB 4.18Å; R204-H210 PolarHBondContact NE-CD2 3.21Å; R204-H210 PolarHBondContact O-N 2.94Å; R204-V215 HydrophobicContact CB-CG2 4.39Å
205L90.6Very high91.4Very high14 Ų1420.5 Ų20.57%0.07312%0.119CC..Hα-helixtrans-72.3-42.2171-57.1-179.9000110V14 F17 L202 S203 T207 G208 H210 S211 V212 V215V14-L205 WeakPolarHBondContact CG1-O 3.49Å; V14-L205 HydrophobicContact CG2-CD2 4.46Å; F17-L205 HydrophobicContact CD1-CB 3.71Å; F17-L205 HydrophobicContact CE1-CB 3.86Å; L202-L205 HydrophobicContact CD2-CD1 4.16Å; L202-L205 WeakPolarHBondContact O-CB 3.08Å; L202-L205 PolarHBondContact O-N 2.75Å; S203-L205 VanDerWaalsContact C-N 3.34Å; S203-L205 PolarHBondContact O-N 2.9Å; L205-T207 PolarHBondContact O-N 3.38Å; L205-G208 PolarHBondContact O-N 3.08Å; L205-G208 VanDerWaalsContact O-N 3.15Å; L205-H210 WeakPolarHBondContact CD2-O 3.4Å; L205-S211 WeakPolarHBondContact CD2-O 3.41Å; L205-V212 HydrophobicContact CD1-CG2 4.25Å; L205-V212 HydrophobicContact CD2-CG2 4.13Å; L205-V215 HydrophobicContact CD2-CG2 3.93Å; L205-V215 HydrophobicContact CG-CG2 4.32Å
206Y89Confident91.4Very high0 Ų019.3 Ų19.30%012%0.116CC..Hα-helixtrans-63.3-42179.2-173.6-98.4000112.6Q18 C21 L23 H84 F87 L149 L202 S203 G208Q18-Y206 PolarHBondContact NE2-O 3.22Å; C21-Y206 HydrophobicContact CB-CD2 3.64Å; C21-Y206 HydrophobicContact CB-CE2 3.47Å; C21-Y206 VanDerWaalsContact CB-CE2 3.47Å; L23-Y206 HydrophobicContact CB-CE2 3.94Å; L23-Y206 HydrophobicContact CD2-CE1 4.42Å; L23-Y206 HydrophobicContact CD2-CE2 4.33Å; H84-Y206 WeakPolarHBondContact CA-OH 3.31Å; H84-Y206 WeakPolarHBondContact CB-OH 3.39Å; H84-Y206 AromaticContact ND1-CE1 3.55Å; H84-Y206 AromaticContact ND1-CZ 3.6Å; H84-Y206 PolarHBondContact ND1-OH 2.95Å; F87-Y206 HydrophobicContact CB-CD1 3.41Å; F87-Y206 VanDerWaalsContact CB-CD1 3.41Å; F87-Y206 HydrophobicContact CB-CD2 4.37Å; F87-Y206 HydrophobicContact CB-CE1 4.04Å; F87-Y206 HydrophobicContact CB-CG 3.6Å; F87-Y206 HydrophobicContact CD2-CD1 4.09Å; F87-Y206 AromaticContact CD2-CD2 3.47Å; F87-Y206 HydrophobicContact CD2-CD2 3.47Å; F87-Y206 VanDerWaalsContact CD2-CD2 3.47Å; F87-Y206 HydrophobicContact CD2-CE1 4.49Å; F87-Y206 AromaticContact CD2-CE2 3.95Å; F87-Y206 HydrophobicContact CD2-CE2 3.95Å; F87-Y206 AromaticContact CD2-CG 3.55Å; F87-Y206 HydrophobicContact CD2-CG 3.55Å; F87-Y206 HydrophobicContact CE2-CD2 4.04Å; F87-Y206 HydrophobicContact CE2-CG 4.41Å; F87-Y206 HydrophobicContact CG-CD1 4.05Å; F87-Y206 HydrophobicContact CG-CD2 4.12Å; F87-Y206 AromaticContact CG-CG 3.7Å; F87-Y206 HydrophobicContact CG-CG 3.7Å; L149-Y206 HydrophobicContact CD1-CD1 3.97Å; L149-Y206 HydrophobicContact CD1-CE1 3.7Å; L202-Y206 PolarHBondContact O-N 3.32Å; S203-Y206 WeakPolarHBondContact O-CB 3.28Å; S203-Y206 PolarHBondContact O-N 3.47Å; Y206-G208 PolarHBondContact O-N 2.96Å
207T86.3Confident91.4Very high0 Ų017.3 Ų17.30%011%0.108CC..THydrogen-bonded Turntrans-74.3-5.9177.858.90000113.6A91 L149 S203 R204 L205 M209A91-T207 HydrophobicContact CB-CG2 3.96Å; L149-T207 HydrophobicContact CB-CG2 4.35Å; L149-T207 HydrophobicContact CD1-CG2 4.45Å; L149-T207 PolarHBondContact N-O 3.04Å; S203-T207 WeakPolarHBondContact O-CG2 2.89Å; S203-T207 PolarHBondContact O-N 3.28Å; S203-T207 PolarHBondContact O-OG1 2.99Å; R204-T207 PolarHBondContact O-OG1 3.49Å; L205-T207 PolarHBondContact O-N 3.38Å; T207-M209 VanDerWaalsContact C-N 3.27Å; T207-M209 PolarHBondContact O-N 3.24Å; T207-M209 WeakPolarHBondContact OG1-CG 3.19Å
208G83Confident91.3Very high0 Ų016.9 Ų16.90%011%0.105CC..THydrogen-bonded Turntrans73.918176.700000114L205 Y206L205-G208 PolarHBondContact O-N 3.08Å; L205-G208 VanDerWaalsContact O-N 3.15Å; Y206-G208 PolarHBondContact O-N 2.96Å
209M83.7Confident91.4Very high0 Ų017.1 Ų17.10%010%0.102CC..  trans-90.5-23.1-171.9-64.4-47.5-72.600113.4R140 K148 E150 V153 R204 T207R140-M209 WeakPolarHBondContact CD-O 3.4Å; R140-M209 PolarHBondContact NH1-O 2.79Å; K148-M209 HydrophobicContact CB-SD 4.47Å; K148-M209 HydrophobicContact CG-SD 4.49Å; E150-M209 HydrophobicContact CB-CE 4.24Å; E150-M209 HydrophobicContact CB-CG 3.97Å; E150-M209 HydrophobicContact CB-SD 3.94Å; E150-M209 WeakPolarHBondContact O-CE 3.12Å; V153-M209 HydrophobicContact CG2-CE 3.36Å; R204-M209 VanDerWaalsContact NH2-CB 3.31Å; R204-M209 PolarHBondContact O-N 2.89Å; T207-M209 VanDerWaalsContact C-N 3.27Å; T207-M209 PolarHBondContact O-N 3.24Å; T207-M209 WeakPolarHBondContact OG1-CG 3.19Å
210H88.5Confident91.5Very high0 Ų020.3 Ų20.30%012%0.118CC..SBendtrans-137.8150-174.9-72.5-77.4000111.2R140 G158 R204 L205 D214 V215R140-H210 PolarHBondContact NH1-CE1 3.03Å; R140-H210 VanDerWaalsContact NH1-CE1 3.25Å; R140-H210 PolarHBondContact NH1-NE2 2.88Å; G158-H210 PolarHBondContact O-CE1 3.35Å; G158-H210 PolarHBondContact O-ND1 2.79Å; R204-H210 HydrophobicContact CB-CB 4.18Å; R204-H210 PolarHBondContact NE-CD2 3.21Å; R204-H210 PolarHBondContact O-N 2.94Å; L205-H210 WeakPolarHBondContact CD2-O 3.4Å; H210-D214 WeakPolarHBondContact CA-OD2 3.44Å; H210-D214 HydrophobicContact CB-CB 3.9Å; H210-D214 IonicContact CG-OD2 2.79Å; H210-D214 IonicContact ND1-OD2 2.79Å; H210-D214 PolarHBondContact ND1-OD2 3.11Å; H210-V215 HydrophobicContact CB-CG2 4.26Å
211S90.1Very high91.6Very high3 Ų321.5 Ų21.52%0.02112%0.124CC..  trans-77.1168.6168.976.70000111.3L205 L213 D214 V215L205-S211 WeakPolarHBondContact CD2-O 3.41Å; S211-L213 VanDerWaalsContact C-N 3.26Å; S211-L213 PolarHBondContact O-N 3.24Å; S211-L213 PolarHBondContact OG-N 2.64Å; S211-D214 PolarHBondContact N-OD2 2.94Å; S211-D214 PolarHBondContact O-N 2.77Å; S211-D214 PolarHBondContact OG-N 2.86Å; S211-D214 VanDerWaalsContact OG-N 3.08Å; S211-D214 PolarHBondContact OG-OD1 3.39Å; S211-D214 PolarHBondContact OG-OD2 2.84Å; S211-V215 PolarHBondContact O-N 3.06Å
212V91.8Very high91.8Very high45 Ų4521.3 Ų21.327%0.27312%0.123SC..Hα-helixtrans-64.9-36.9174.2-177.20000110.3L8 L13 L205 D214 V215 A216L8-V212 HydrophobicContact CD2-CB 4.39Å; L8-V212 HydrophobicContact CD2-CG1 3.93Å; L8-V212 PolarHBondContact O-N 3.36Å; L13-V212 HydrophobicContact CB-CG2 4.24Å; L13-V212 HydrophobicContact CD1-CG2 4.34Å; L205-V212 HydrophobicContact CD1-CG2 4.25Å; L205-V212 HydrophobicContact CD2-CG2 4.13Å; V212-D214 VanDerWaalsContact C-N 3.34Å; V212-D214 PolarHBondContact O-N 2.97Å; V212-V215 PolarHBondContact O-N 3.08Å; V212-A216 WeakPolarHBondContact O-CB 3.47Å; V212-A216 PolarHBondContact O-N 3.14Å
213L90.9Very high92Very high19 Ų1920.5 Ų20.510%0.09913%0.126CC..Hα-helixtrans-59.2-44.4174.1-173.265.4000111.6L8 Q9 S211 V215 A216 C217L8-L213 HydrophobicContact CB-CB 3.88Å; L8-L213 HydrophobicContact CB-CD1 4.22Å; L8-L213 HydrophobicContact CD1-CD1 4.19Å; L8-L213 PolarHBondContact O-N 2.89Å; L8-L213 VanDerWaalsContact O-N 3.14Å; Q9-L213 HydrophobicContact CB-CD2 4.24Å; S211-L213 VanDerWaalsContact C-N 3.26Å; S211-L213 PolarHBondContact O-N 3.24Å; S211-L213 PolarHBondContact OG-N 2.64Å; L213-V215 VanDerWaalsContact C-N 3.28Å; L213-V215 PolarHBondContact O-N 3.32Å; L213-A216 PolarHBondContact O-N 2.92Å; L213-C217 WeakPolarHBondContact O-CB 3.35Å; L213-C217 PolarHBondContact O-N 2.76Å; L213-C217 PolarHBondContact O-SG 3.31Å
214D92.3Very high92.2Very high2 Ų223.8 Ų23.81%0.01115%0.146CC..Hα-helixtrans-58.2-42.1-179.3-59-11.6000112.5L159 S161 H210 S211 V212 G218L159-D214 HydrophobicContact CD1-CB 4.37Å; S161-D214 WeakPolarHBondContact CB-O 3.33Å; S161-D214 PolarHBondContact N-O 2.74Å; H210-D214 WeakPolarHBondContact CA-OD2 3.44Å; H210-D214 HydrophobicContact CB-CB 3.9Å; H210-D214 IonicContact CG-OD2 2.79Å; H210-D214 IonicContact ND1-OD2 2.79Å; H210-D214 PolarHBondContact ND1-OD2 3.11Å; S211-D214 PolarHBondContact N-OD2 2.94Å; S211-D214 PolarHBondContact O-N 2.77Å; S211-D214 PolarHBondContact OG-N 2.86Å; S211-D214 VanDerWaalsContact OG-N 3.08Å; S211-D214 PolarHBondContact OG-OD1 3.39Å; S211-D214 PolarHBondContact OG-OD2 2.84Å; V212-D214 VanDerWaalsContact C-N 3.34Å; V212-D214 PolarHBondContact O-N 2.97Å; D214-G218 PolarHBondContact O-N 3.13Å; D214-G218 VanDerWaalsContact O-N 3.13Å
215V93.6Very high92.5Very high11 Ų1125.1 Ų25.17%0.06715%0.152CC..Hα-helixtrans-71.6-48179.2172.80000110.8A164 R204 L205 H210 S211 V212 L213 C217 G218 I219A164-V215 HydrophobicContact CB-CG1 4.2Å; R204-V215 HydrophobicContact CB-CG2 4.39Å; L205-V215 HydrophobicContact CD2-CG2 3.93Å; L205-V215 HydrophobicContact CG-CG2 4.32Å; H210-V215 HydrophobicContact CB-CG2 4.26Å; S211-V215 PolarHBondContact O-N 3.06Å; V212-V215 PolarHBondContact O-N 3.08Å; L213-V215 VanDerWaalsContact C-N 3.28Å; L213-V215 PolarHBondContact O-N 3.32Å; V215-C217 PolarHBondContact O-N 2.87Å; V215-G218 PolarHBondContact O-N 3.05Å; V215-I219 HydrophobicContact CG1-CD1 3.99Å; V215-I219 WeakPolarHBondContact O-CG1 3.44Å; V215-I219 PolarHBondContact O-N 2.97Å
216A94.1Very high92.8Very high46 Ų4625.1 Ų25.138%0.3815%0.152SC..Hα-helixtrans-61.3-45.6-179.900000112V212 L213 G218 I219 L220V212-A216 WeakPolarHBondContact O-CB 3.47Å; V212-A216 PolarHBondContact O-N 3.14Å; L213-A216 PolarHBondContact O-N 2.92Å; A216-G218 PolarHBondContact O-N 2.95Å; A216-I219 PolarHBondContact O-N 2.85Å; A216-L220 WeakPolarHBondContact O-CB 3.23Å; A216-L220 PolarHBondContact O-N 3.35Å
217C94Very high93.2Very high35 Ų3531.5 Ų31.524%0.23619%0.186CC..Hα-helixtrans-62.7-41.4175-72.90000111.7L159 L213 V215 I219 L220 I221L159-C217 HydrophobicContact CD1-CB 3.55Å; L213-C217 WeakPolarHBondContact O-CB 3.35Å; L213-C217 PolarHBondContact O-N 2.76Å; L213-C217 PolarHBondContact O-SG 3.31Å; V215-C217 PolarHBondContact O-N 2.87Å; C217-I219 PolarHBondContact O-N 2.96Å; C217-L220 PolarHBondContact O-N 3.21Å; C217-I221 HydrophobicContact CB-CD1 4.47Å; C217-I221 WeakPolarHBondContact O-CB 3.45Å; C217-I221 VanDerWaalsContact O-CD1 3.3Å; C217-I221 WeakPolarHBondContact O-CD1 3.38Å; C217-I221 WeakPolarHBondContact O-CG1 3.44Å; C217-I221 PolarHBondContact O-N 3.19Å
218G95Very high93.7Very high0 Ų036.7 Ų36.70%021%0.213CC..Hα-helixtrans-58.9-47.117600000113M165 D214 V215 A216 T222M165-G218 VanDerWaalsContact CG-O 3.31Å; M165-G218 WeakPolarHBondContact CG-O 3.16Å; D214-G218 PolarHBondContact O-N 3.13Å; D214-G218 VanDerWaalsContact O-N 3.13Å; V215-G218 PolarHBondContact O-N 3.05Å; A216-G218 PolarHBondContact O-N 2.95Å; G218-T222 WeakPolarHBondContact O-CB 3.08Å; G218-T222 PolarHBondContact O-N 3.31Å; G218-T222 VanDerWaalsContact O-N 3.07Å; G218-T222 PolarHBondContact O-OG1 3.47Å
219I96.3Very high94.3Very high60 Ų6038.1 Ų38.131%0.30822%0.222SC..Hα-helixtrans-61.8-46.9176.4-65.2166.8000110.4A164 T168 V215 A216 C217 T222 A223A164-I219 HydrophobicContact CB-CG1 4.48Å; T168-I219 HydrophobicContact CG2-CG2 4.38Å; V215-I219 HydrophobicContact CG1-CD1 3.99Å; V215-I219 WeakPolarHBondContact O-CG1 3.44Å; V215-I219 PolarHBondContact O-N 2.97Å; A216-I219 PolarHBondContact O-N 2.85Å; C217-I219 PolarHBondContact O-N 2.96Å; I219-T222 PolarHBondContact O-N 3.45Å; I219-A223 WeakPolarHBondContact O-CB 3.25Å; I219-A223 PolarHBondContact O-N 3.37Å
220L96.4Very high94.9Very high112 Ų11243.9 Ų43.959%0.58624%0.244SC*.Hα-helixtrans-62.5-48.2-178.8-17962.6000112.3A216 C217 T222 A223 V224A216-L220 WeakPolarHBondContact O-CB 3.23Å; A216-L220 PolarHBondContact O-N 3.35Å; C217-L220 PolarHBondContact O-N 3.21Å; L220-T222 VanDerWaalsContact C-N 3.26Å; L220-T222 PolarHBondContact O-N 2.66Å; L220-A223 PolarHBondContact O-N 2.85Å; L220-V224 WeakPolarHBondContact O-CG2 3.42Å; L220-V224 PolarHBondContact O-N 3.44Å
221I96.4Very high95.3Very high33 Ų3347.9 Ų47.917%0.16927%0.27CS..Hα-helixtrans-58.7-43.2177.8-67.1158.6000109.8M132 P160 M165 C217 V224 L225M132-I221 HydrophobicContact CE-CD1 3.44Å; M132-I221 VanDerWaalsContact CE-CD1 3.44Å; M132-I221 HydrophobicContact CE-CG1 4.18Å; M132-I221 HydrophobicContact SD-CD1 3.84Å; M132-I221 HydrophobicContact SD-CG1 4.43Å; M132-I221 HydrophobicContact SD-CG2 4.1Å; P160-I221 HydrophobicContact CB-CD1 3.84Å; P160-I221 HydrophobicContact CG-CD1 4Å; M165-I221 HydrophobicContact CE-CB 4.13Å; M165-I221 HydrophobicContact CE-CG2 3.64Å; C217-I221 HydrophobicContact CB-CD1 4.47Å; C217-I221 WeakPolarHBondContact O-CB 3.45Å; C217-I221 VanDerWaalsContact O-CD1 3.3Å; C217-I221 WeakPolarHBondContact O-CD1 3.38Å; C217-I221 WeakPolarHBondContact O-CG1 3.44Å; C217-I221 PolarHBondContact O-N 3.19Å; I221-V224 PolarHBondContact O-N 2.89Å; I221-L225 HydrophobicContact CG2-CD1 4.02Å; I221-L225 HydrophobicContact CG2-CG 4.37Å; I221-L225 WeakPolarHBondContact O-CG 3.28Å; I221-L225 PolarHBondContact O-N 2.93Å
222T97.7Very high95.5Very high0 Ų054.1 Ų54.10%030%0.298CS..Hα-helixtrans-65.2-43179.1-55.30000112V125 M165 T168 A169 G218 I219 L220 V224 L225 I226V125-T222 HydrophobicContact CG1-CG2 4.12Å; V125-T222 HydrophobicContact CG2-CG2 4.16Å; M165-T222 VanDerWaalsContact CA-OG1 3.22Å; M165-T222 WeakPolarHBondContact CA-OG1 3.48Å; M165-T222 WeakPolarHBondContact CB-OG1 3.42Å; M165-T222 WeakPolarHBondContact CG-OG1 3.47Å; T168-T222 HydrophobicContact CG2-CG2 3.95Å; A169-T222 HydrophobicContact CB-CG2 3.76Å; G218-T222 WeakPolarHBondContact O-CB 3.08Å; G218-T222 PolarHBondContact O-N 3.31Å; G218-T222 VanDerWaalsContact O-N 3.07Å; G218-T222 PolarHBondContact O-OG1 3.47Å; I219-T222 PolarHBondContact O-N 3.45Å; L220-T222 VanDerWaalsContact C-N 3.26Å; L220-T222 PolarHBondContact O-N 2.66Å; T222-V224 VanDerWaalsContact C-N 3.31Å; T222-V224 PolarHBondContact O-N 2.59Å; T222-L225 PolarHBondContact O-N 2.82Å; T222-I226 HydrophobicContact CG2-CD1 4.08Å; T222-I226 HydrophobicContact CG2-CG1 4.48Å; T222-I226 WeakPolarHBondContact O-CG1 3.45Å; T222-I226 PolarHBondContact O-N 3.44Å
223A97.2Very high95.7Very high50 Ų5053 Ų5341%0.41329%0.288SS..Hα-helixtrans-60.2-42.4176.300000111.6I219 L220 I226 L227I219-A223 WeakPolarHBondContact O-CB 3.25Å; I219-A223 PolarHBondContact O-N 3.37Å; L220-A223 PolarHBondContact O-N 2.85Å; A223-I226 PolarHBondContact O-N 3.18Å; A223-L227 WeakPolarHBondContact O-CB 3.33Å; A223-L227 PolarHBondContact O-N 3.28Å
224V97.7Very high95.8Very high69 Ų6957.3 Ų57.342%0.41831%0.308SS..Hα-helixtrans-63.7-45.9174.8172.60000111.1L220 I221 T222 I226 L227 L228L220-V224 WeakPolarHBondContact O-CG2 3.42Å; L220-V224 PolarHBondContact O-N 3.44Å; I221-V224 PolarHBondContact O-N 2.89Å; T222-V224 VanDerWaalsContact C-N 3.31Å; T222-V224 PolarHBondContact O-N 2.59Å; V224-I226 PolarHBondContact O-N 3.03Å; V224-L227 PolarHBondContact O-N 3.24Å; V224-L228 HydrophobicContact CG1-CD1 3.78Å; V224-L228 HydrophobicContact CG1-CG 4.24Å; V224-L228 WeakPolarHBondContact O-CB 3.48Å; V224-L228 VanDerWaalsContact O-CG 3.27Å; V224-L228 WeakPolarHBondContact O-CG 3.28Å; V224-L228 PolarHBondContact O-N 3.04Å
225L97.6Very high95.9Very high28 Ų2861 Ų6115%0.14733%0.334CS..Hα-helixtrans-61.5-42.2177.6-72.6174.2000112.2V125 V128 I221 T222 T229V125-L225 HydrophobicContact CB-CD1 4.46Å; V125-L225 HydrophobicContact CG2-CB 4.35Å; V125-L225 HydrophobicContact CG2-CD1 3.89Å; V128-L225 HydrophobicContact CB-CD1 4.13Å; V128-L225 HydrophobicContact CG1-CD1 4.09Å; V128-L225 HydrophobicContact CG2-CD1 4.38Å; I221-L225 HydrophobicContact CG2-CD1 4.02Å; I221-L225 HydrophobicContact CG2-CG 4.37Å; I221-L225 WeakPolarHBondContact O-CG 3.28Å; I221-L225 PolarHBondContact O-N 2.93Å; T222-L225 PolarHBondContact O-N 2.82Å; L225-T229 WeakPolarHBondContact O-CB 3.26Å; L225-T229 VanDerWaalsContact O-CG2 3.32Å; L225-T229 WeakPolarHBondContact O-CG2 3.34Å; L225-T229 PolarHBondContact O-N 3.29Å; L225-T229 PolarHBondContact O-OG1 3.34Å
226I97.4Very high95.9Very high14 Ų1465.3 Ų65.37%0.07235%0.352CS..Hα-helixtrans-60.6-50.9173.9-70.2169000109.7M121 F172 L176 T222 A223 V224 L228 T229 Y230 W233M121-I226 HydrophobicContact CE-CG1 3.79Å; F172-I226 HydrophobicContact CB-CD1 3.84Å; L176-I226 HydrophobicContact CD1-CG2 3.72Å; T222-I226 HydrophobicContact CG2-CD1 4.08Å; T222-I226 HydrophobicContact CG2-CG1 4.48Å; T222-I226 WeakPolarHBondContact O-CG1 3.45Å; T222-I226 PolarHBondContact O-N 3.44Å; A223-I226 PolarHBondContact O-N 3.18Å; V224-I226 PolarHBondContact O-N 3.03Å; I226-L228 VanDerWaalsContact C-N 3.3Å; I226-L228 PolarHBondContact O-N 2.96Å; I226-T229 PolarHBondContact O-N 3.42Å; I226-T229 PolarHBondContact O-OG1 3.46Å; I226-Y230 WeakPolarHBondContact O-CB 3.47Å; I226-Y230 PolarHBondContact O-N 3.4Å; I226-W233 HydrophobicContact CG2-CH2 4.2Å; I226-W233 HydrophobicContact CG2-CZ2 4.12Å
227L96.8Very high95.8Very high134 Ų13463.7 Ų63.770%0.70234%0.337SS*.Hα-helixtrans-57.9-42.6-178.1-176.368.1000112.3A223 V224A223-L227 WeakPolarHBondContact O-CB 3.33Å; A223-L227 PolarHBondContact O-N 3.28Å; V224-L227 PolarHBondContact O-N 3.24Å
228L97.1Very high95.8Very high109 Ų10965.1 Ų65.157%0.57135%0.347SS*.Hα-helixtrans-71-36.1-180-69.3176.2000112.8V224 I226 F232V224-L228 HydrophobicContact CG1-CD1 3.78Å; V224-L228 HydrophobicContact CG1-CG 4.24Å; V224-L228 WeakPolarHBondContact O-CB 3.48Å; V224-L228 VanDerWaalsContact O-CG 3.27Å; V224-L228 WeakPolarHBondContact O-CG 3.28Å; V224-L228 PolarHBondContact O-N 3.04Å; I226-L228 VanDerWaalsContact C-N 3.3Å; I226-L228 PolarHBondContact O-N 2.96Å; L228-F232 VanDerWaalsContact O-CD2 3.31Å; L228-F232 WeakPolarHBondContact O-CD2 3.38Å; L228-F232 WeakPolarHBondContact O-CE2 3.23Å
229T96.3Very high95.7Very high30 Ų3069 Ų6918%0.18436%0.364CS..Hα-helixtrans-91.2-25.2-175.156.80000113.9M121 L124 L225 I226 P231 F232 W233M121-T229 WeakPolarHBondContact CE-OG1 3.42Å; M121-T229 PolarHBondContact SD-OG1 3.18Å; L124-T229 HydrophobicContact CD2-CG2 3.6Å; L225-T229 WeakPolarHBondContact O-CB 3.26Å; L225-T229 VanDerWaalsContact O-CG2 3.32Å; L225-T229 WeakPolarHBondContact O-CG2 3.34Å; L225-T229 PolarHBondContact O-N 3.29Å; L225-T229 PolarHBondContact O-OG1 3.34Å; I226-T229 PolarHBondContact O-N 3.42Å; I226-T229 PolarHBondContact O-OG1 3.46Å; T229-P231 VanDerWaalsContact C-CD 3.45Å; T229-F232 WeakPolarHBondContact O-CA 3.15Å; T229-F232 WeakPolarHBondContact O-CB 3.47Å; T229-F232 PolarHBondContact O-N 2.89Å; T229-W233 VanDerWaalsContact C-CD1 3.45Å; T229-W233 PolarHBondContact O-N 3.37Å; T229-W233 PolarHBondContact O-NE1 3.03Å; T229-W233 PolarHBondContact OG1-NE1 3.41Å; T229-W233 VanDerWaalsContact OG1-NE1 3.1Å
230Y95.8Very high95.6Very high121 Ų12166.2 Ų66.248%0.47535%0.35SS..G310 helixtrans-45-49.6-179.4-178.9-101.6000114.5L176 I226 F232 W233L176-Y230 HydrophobicContact CB-CE2 4.13Å; L176-Y230 HydrophobicContact CD1-CD2 4.22Å; L176-Y230 HydrophobicContact CD1-CE2 4.37Å; I226-Y230 WeakPolarHBondContact O-CB 3.47Å; I226-Y230 PolarHBondContact O-N 3.4Å; Y230-F232 PolarHBondContact O-N 2.98Å; Y230-F232 VanDerWaalsContact O-N 3.15Å; Y230-W233 HydrophobicContact CD2-CD2 4.32Å; Y230-W233 AromaticContact CD2-CE3 3.91Å; Y230-W233 HydrophobicContact CD2-CE3 3.91Å; Y230-W233 HydrophobicContact CD2-CH2 4.12Å; Y230-W233 AromaticContact CD2-CZ3 3.81Å; Y230-W233 HydrophobicContact CD2-CZ3 3.81Å; Y230-W233 HydrophobicContact CE2-CE3 4.37Å; Y230-W233 HydrophobicContact CE2-CZ3 4.24Å; Y230-W233 PolarHBondContact O-N 2.88Å
231P95.9Very high95.4Very high84 Ų8462.1 Ų62.155%0.54533%0.328SS..G310 helixtrans-65.4-18.6179.425.9-35.3000113.9T229T229-P231 VanDerWaalsContact C-CD 3.45Å
232F95.5Very high95.1Very high135 Ų13564.7 Ų64.759%0.59235%0.346SS*.G310 helixtrans-98.3-4.6-178.3-56-72.8000113.5L228 T229 Y230 E234 S235 F236L228-F232 VanDerWaalsContact O-CD2 3.31Å; L228-F232 WeakPolarHBondContact O-CD2 3.38Å; L228-F232 WeakPolarHBondContact O-CE2 3.23Å; T229-F232 WeakPolarHBondContact O-CA 3.15Å; T229-F232 WeakPolarHBondContact O-CB 3.47Å; T229-F232 PolarHBondContact O-N 2.89Å; Y230-F232 PolarHBondContact O-N 2.98Å; Y230-F232 VanDerWaalsContact O-N 3.15Å; F232-E234 PolarHBondContact O-N 2.7Å; F232-S235 PolarHBondContact O-N 2.95Å; F232-F236 WeakPolarHBondContact O-CB 3.24Å; F232-F236 PolarHBondContact O-N 3.46Å
233W95Very high94.9Very high21 Ų2165.8 Ų65.88%0.0835%0.353CS..Hα-helixtrans-59.2-44.9-175.6-731.5000112.3M121 T173 L176 I226 T229 Y230 F236 D237M121-W233 HydrophobicContact CE-CZ2 4.09Å; M121-W233 HydrophobicContact CG-CH2 4.49Å; M121-W233 HydrophobicContact CG-CZ2 3.66Å; M121-W233 HydrophobicContact SD-CZ2 3.78Å; M121-W233 PolarHBondContact SD-NE1 3.48Å; T173-W233 HydrophobicContact CG2-CH2 3.78Å; T173-W233 HydrophobicContact CG2-CZ2 4.29Å; T173-W233 HydrophobicContact CG2-CZ3 4.02Å; L176-W233 HydrophobicContact CB-CH2 4.39Å; L176-W233 HydrophobicContact CB-CZ3 4.07Å; L176-W233 HydrophobicContact CD1-CH2 4.23Å; I226-W233 HydrophobicContact CG2-CH2 4.2Å; I226-W233 HydrophobicContact CG2-CZ2 4.12Å; T229-W233 VanDerWaalsContact C-CD1 3.45Å; T229-W233 PolarHBondContact O-N 3.37Å; T229-W233 PolarHBondContact O-NE1 3.03Å; T229-W233 PolarHBondContact OG1-NE1 3.41Å; T229-W233 VanDerWaalsContact OG1-NE1 3.1Å; Y230-W233 HydrophobicContact CD2-CD2 4.32Å; Y230-W233 AromaticContact CD2-CE3 3.91Å; Y230-W233 HydrophobicContact CD2-CE3 3.91Å; Y230-W233 HydrophobicContact CD2-CH2 4.12Å; Y230-W233 AromaticContact CD2-CZ3 3.81Å; Y230-W233 HydrophobicContact CD2-CZ3 3.81Å; Y230-W233 HydrophobicContact CE2-CE3 4.37Å; Y230-W233 HydrophobicContact CE2-CZ3 4.24Å; Y230-W233 PolarHBondContact O-N 2.88Å; W233-F236 PolarHBondContact O-N 3.49Å; W233-D237 WeakPolarHBondContact O-CB 3.37Å; W233-D237 PolarHBondContact O-N 2.89Å
234E93.2Very high94.7Very high109 Ų10967.9 Ų67.951%0.50936%0.363SS..Hα-helixtrans-64.6-44.9178.1-64.1-63.5169.800112.6R117 F232 F236 D237 S238R117-E234 IonicContact CZ-OE1 2.86Å; R117-E234 IonicContact NH1-OE1 3.07Å; R117-E234 IonicContact NH2-OE1 3.49Å; R117-E234 PolarHBondContact NH2-OE1 2.95Å; R117-E234 IonicContact NH2-OE2 2.73Å; R117-E234 PolarHBondContact NH2-OE2 3.42Å; F232-E234 PolarHBondContact O-N 2.7Å; E234-F236 VanDerWaalsContact C-N 3.33Å; E234-F236 PolarHBondContact O-N 2.91Å; E234-D237 WeakPolarHBondContact O-CB 3.42Å; E234-D237 PolarHBondContact O-N 2.88Å; E234-S238 WeakPolarHBondContact O-CB 3.22Å; E234-S238 PolarHBondContact O-N 2.84Å
235S94.1Very high94.5Very high81 Ų8169.3 Ų69.357%0.56637%0.368SS*.Hα-helixtrans-63.1-42.1179.6-57.30000111.5F232 F239F232-S235 PolarHBondContact O-N 2.95Å; S235-F239 VanDerWaalsContact O-CB 3.31Å; S235-F239 WeakPolarHBondContact O-CB 3.45Å; S235-F239 PolarHBondContact O-N 2.98Å
236F94.1Very high94.3Very high101 Ų10168.2 Ų68.244%0.44336%0.362SS..Hα-helixtrans-65.7-42.7176-174-99.2000111.6N120 F232 W233 E234 F239 Q240N120-F236 HydrophobicContact CB-CE1 4.25Å; N120-F236 VanDerWaalsContact ND2-CE1 3.34Å; N120-F236 WeakPolarHBondContact ND2-CE1 3.36Å; F232-F236 WeakPolarHBondContact O-CB 3.24Å; F232-F236 PolarHBondContact O-N 3.46Å; W233-F236 PolarHBondContact O-N 3.49Å; E234-F236 VanDerWaalsContact C-N 3.33Å; E234-F236 PolarHBondContact O-N 2.91Å; F236-F239 PolarHBondContact O-N 3.49Å; F236-Q240 VanDerWaalsContact CE1-OE1 3.29Å; F236-Q240 VanDerWaalsContact O-CB 3.27Å; F236-Q240 WeakPolarHBondContact O-CB 3.35Å; F236-Q240 PolarHBondContact O-N 3.13Å
237D93.1Very high94.1Very high12 Ų1268.3 Ų68.36%0.06436%0.364CS..Hα-helixtrans-60.2-47.3178.2-164.484.4000111.7R116 W233 E234 Q240 L241R116-D237 IonicContact CZ-OD1 3.81Å; R116-D237 IonicContact CZ-OD2 3.47Å; R116-D237 IonicContact NE-OD1 2.91Å; R116-D237 PolarHBondContact NE-OD1 3.41Å; R116-D237 PolarHBondContact NH1-O 3.36Å; R116-D237 VanDerWaalsContact NH1-O 3.11Å; R116-D237 IonicContact NH1-OD1 3.07Å; R116-D237 PolarHBondContact NH1-OD1 3.04Å; R116-D237 IonicContact NH1-OD2 3.7Å; R116-D237 PolarHBondContact NH1-OD2 3.24Å; R116-D237 VanDerWaalsContact NH2-CG 3.26Å; R116-D237 IonicContact NH2-OD1 2.95Å; R116-D237 PolarHBondContact NH2-OD1 2.93Å; R116-D237 VanDerWaalsContact NH2-OD1 3.11Å; R116-D237 IonicContact NH2-OD2 2.94Å; R116-D237 PolarHBondContact NH2-OD2 3.44Å; W233-D237 WeakPolarHBondContact O-CB 3.37Å; W233-D237 PolarHBondContact O-N 2.89Å; E234-D237 WeakPolarHBondContact O-CB 3.42Å; E234-D237 PolarHBondContact O-N 2.88Å; D237-Q240 PolarHBondContact O-N 2.64Å; D237-L241 PolarHBondContact O-N 3.09Å
238S92.6Very high94Very high64 Ų6467.2 Ų67.245%0.44836%0.357SS..Hα-helixtrans-63.2-46.5175.7-179.90000111.9E234 Q240 L241 T242E234-S238 WeakPolarHBondContact O-CB 3.22Å; E234-S238 PolarHBondContact O-N 2.84Å; S238-Q240 VanDerWaalsContact C-N 3.3Å; S238-Q240 PolarHBondContact O-N 3.28Å; S238-L241 PolarHBondContact O-N 3.3Å; S238-T242 WeakPolarHBondContact O-CB 3.3Å; S238-T242 WeakPolarHBondContact O-CG2 3.41Å; S238-T242 PolarHBondContact O-N 3.29Å; S238-T242 PolarHBondContact O-OG1 3.21Å
239F93.7Very high93.9Very high81 Ų8165.1 Ų65.136%0.35535%0.346SS..Hα-helixtrans-57.5-45.3175.8172.4-97.3000111.6S235 F236 L241 S243 I249S235-F239 VanDerWaalsContact O-CB 3.31Å; S235-F239 WeakPolarHBondContact O-CB 3.45Å; S235-F239 PolarHBondContact O-N 2.98Å; F236-F239 PolarHBondContact O-N 3.49Å; F239-L241 VanDerWaalsContact C-N 3.28Å; F239-L241 PolarHBondContact O-N 3.41Å; F239-S243 WeakPolarHBondContact O-CB 3.47Å; F239-S243 PolarHBondContact O-N 2.56Å; F239-S243 VanDerWaalsContact O-N 3.17Å; F239-I249 HydrophobicContact CZ-CD1 3.75Å
240Q93.9Very high93.8Very high3 Ų364.4 Ų64.41%0.01434%0.343CS..Hα-helixtrans-61.1-35.7-177.9-175.7177.3-28.600112.4N120 F236 D237 S238 S246 S285N120-Q240 PolarHBondContact ND2-OE1 2.92Å; N120-Q240 PolarHBondContact OD1-OE1 3.45Å; F236-Q240 VanDerWaalsContact CE1-OE1 3.29Å; F236-Q240 VanDerWaalsContact O-CB 3.27Å; F236-Q240 WeakPolarHBondContact O-CB 3.35Å; F236-Q240 PolarHBondContact O-N 3.13Å; D237-Q240 PolarHBondContact O-N 2.64Å; S238-Q240 VanDerWaalsContact C-N 3.3Å; S238-Q240 PolarHBondContact O-N 3.28Å; Q240-S246 WeakPolarHBondContact CA-OG 3.18Å; Q240-S246 WeakPolarHBondContact O-CB 3.4Å; Q240-S246 PolarHBondContact O-OG 3.07Å; Q240-S285 PolarHBondContact NE2-OG 3.44Å
241L92.2Very high93.8Very high25 Ų2561.6 Ų61.613%0.13134%0.336CS..Hα-helixtrans-89.1-39.8-178.5-63.2180000114.5R116 D237 S238 F239 V292R116-L241 VanDerWaalsContact CZ-CD1 3.49Å; R116-L241 VanDerWaalsContact NH2-CD1 3.35Å; D237-L241 PolarHBondContact O-N 3.09Å; S238-L241 PolarHBondContact O-N 3.3Å; F239-L241 VanDerWaalsContact C-N 3.28Å; F239-L241 PolarHBondContact O-N 3.41Å; L241-V292 HydrophobicContact CB-CG2 4.17Å; L241-V292 HydrophobicContact CD1-CG2 4.18Å; L241-V292 HydrophobicContact CD2-CG2 3.8Å; L241-V292 HydrophobicContact CG-CG2 4.24Å
242T91.3Very high93.7Very high87 Ų8760.9 Ų60.953%0.53433%0.333SS..Hα-helixtrans-94.5-33.2-166.560.60000112.8S238S238-T242 WeakPolarHBondContact O-CB 3.3Å; S238-T242 WeakPolarHBondContact O-CG2 3.41Å; S238-T242 PolarHBondContact O-N 3.29Å; S238-T242 PolarHBondContact O-OG1 3.21Å
243S93.6Very high93.7Very high23 Ų2358.5 Ų58.516%0.16133%0.326CS..  trans-75128.7-173.8-179.30000111.3F239 L245 S246 W289F239-S243 WeakPolarHBondContact O-CB 3.47Å; F239-S243 PolarHBondContact O-N 2.56Å; F239-S243 VanDerWaalsContact O-N 3.17Å; S243-L245 PolarHBondContact O-N 2.95Å; S243-L245 PolarHBondContact OG-N 3.33Å; S243-S246 WeakPolarHBondContact O-CB 3.03Å; S243-S246 PolarHBondContact O-N 3.48Å; S243-S246 VanDerWaalsContact O-N 3.14Å; S243-W289 PolarHBondContact O-NE1 2.81Å
244P92.6Very high93.8Very high94 Ų9458.4 Ų58.461%0.6133%0.327SS*.THydrogen-bonded Turntrans-66-19.3175.128.1-34.9000112.8
245L93.8Very high93.8Very high100 Ų10056 Ų5652%0.52432%0.318SS..THydrogen-bonded Turntrans-83.4-15177.7-58.8178.9000112.9S243 I248 I249S243-L245 PolarHBondContact O-N 2.95Å; S243-L245 PolarHBondContact OG-N 3.33Å; L245-I248 PolarHBondContact O-N 3.22Å; L245-I249 HydrophobicContact CB-CD1 3.76Å; L245-I249 HydrophobicContact CB-CG1 4.43Å; L245-I249 WeakPolarHBondContact O-CB 3.25Å; L245-I249 WeakPolarHBondContact O-CG1 3.3Å; L245-I249 PolarHBondContact O-N 2.83Å
246S92.8Very high93.8Very high4 Ų458.2 Ų58.23%0.02832%0.317CS..Hα-helixtrans-48.7-53.9-179.3171.40000114Q240 S243 I248 I249 A250Q240-S246 WeakPolarHBondContact CA-OG 3.18Å; Q240-S246 WeakPolarHBondContact O-CB 3.4Å; Q240-S246 PolarHBondContact O-OG 3.07Å; S243-S246 WeakPolarHBondContact O-CB 3.03Å; S243-S246 PolarHBondContact O-N 3.48Å; S243-S246 VanDerWaalsContact O-N 3.14Å; S246-I248 VanDerWaalsContact C-N 3.35Å; S246-I248 PolarHBondContact O-N 2.98Å; S246-I249 PolarHBondContact O-N 3.25Å; S246-A250 VanDerWaalsContact O-CB 3.28Å; S246-A250 WeakPolarHBondContact O-CB 3.12Å; S246-A250 PolarHBondContact O-N 3.01Å
247P93.6Very high93.8Very high16 Ų1655.3 Ų55.310%0.10431%0.306CS..Hα-helixtrans-64.5-38-178.224.3-35.2000112.8L251 V286 W289P247-L251 WeakPolarHBondContact O-CB 3.19Å; P247-L251 WeakPolarHBondContact O-CG 3.36Å; P247-L251 PolarHBondContact O-N 3.1Å; P247-V286 HydrophobicContact CB-CB 4.34Å; P247-V286 HydrophobicContact CB-CG1 4.15Å; P247-V286 HydrophobicContact CB-CG2 3.79Å; P247-W289 HydrophobicContact CB-CE3 4.45Å; P247-W289 HydrophobicContact CG-CD2 3.9Å; P247-W289 HydrophobicContact CG-CE3 3.95Å; P247-W289 HydrophobicContact CG-CG 4.4Å; P247-W289 HydrophobicContact CG-CH2 4.44Å; P247-W289 HydrophobicContact CG-CZ2 4.39Å; P247-W289 HydrophobicContact CG-CZ3 4.23Å
248I94.7Very high93.7Very high111 Ų11154.8 Ų54.857%0.56930%0.303SS*.Hα-helixtrans-66.8-46.8179.1-62172000109.7L245 S246 S252L245-I248 PolarHBondContact O-N 3.22Å; S246-I248 VanDerWaalsContact C-N 3.35Å; S246-I248 PolarHBondContact O-N 2.98Å; I248-S252 VanDerWaalsContact O-CB 3.26Å; I248-S252 WeakPolarHBondContact O-CB 3.24Å; I248-S252 PolarHBondContact O-N 3.43Å; I248-S252 PolarHBondContact O-OG 2.9Å
249I94.4Very high93.6Very high66 Ų6656 Ų5634%0.33830%0.298SS..Hα-helixtrans-64.8-45.6179.2-69.7166.5000110F239 L245 S246 L251 S252 L253F239-I249 HydrophobicContact CZ-CD1 3.75Å; L245-I249 HydrophobicContact CB-CD1 3.76Å; L245-I249 HydrophobicContact CB-CG1 4.43Å; L245-I249 WeakPolarHBondContact O-CB 3.25Å; L245-I249 WeakPolarHBondContact O-CG1 3.3Å; L245-I249 PolarHBondContact O-N 2.83Å; S246-I249 PolarHBondContact O-N 3.25Å; I249-L251 PolarHBondContact O-N 3.1Å; I249-S252 PolarHBondContact O-N 2.84Å; I249-S252 PolarHBondContact O-OG 2.92Å; I249-L253 WeakPolarHBondContact O-CB 3.43Å; I249-L253 PolarHBondContact O-N 3.46Å
250A93.9Very high93.3Very high14 Ų1455.4 Ų55.412%0.11630%0.302CS..Hα-helixtrans-59.7-47.717900000111.9S246 L254S246-A250 VanDerWaalsContact O-CB 3.28Å; S246-A250 WeakPolarHBondContact O-CB 3.12Å; S246-A250 PolarHBondContact O-N 3.01Å; A250-L254 WeakPolarHBondContact O-CB 3.17Å; A250-L254 WeakPolarHBondContact O-CD1 3.36Å; A250-L254 WeakPolarHBondContact O-CG 3.47Å; A250-L254 PolarHBondContact O-N 3.25Å
251L95.5Very high93Very high63 Ų6355.4 Ų55.433%0.3330%0.302SS..Hα-helixtrans-66.8-50.8178.4-72.8167000112.1P247 I249 L255 A282 V286 F370 T374P247-L251 WeakPolarHBondContact O-CB 3.19Å; P247-L251 WeakPolarHBondContact O-CG 3.36Å; P247-L251 PolarHBondContact O-N 3.1Å; I249-L251 PolarHBondContact O-N 3.1Å; L251-L255 WeakPolarHBondContact O-CB 3.08Å; L251-L255 PolarHBondContact O-N 3.29Å; L251-A282 HydrophobicContact CD2-CB 3.98Å; L251-V286 HydrophobicContact CD1-CG2 3.85Å; L251-V286 HydrophobicContact CD2-CG2 4.25Å; L251-V286 HydrophobicContact CG-CG2 3.77Å; L251-F370 HydrophobicContact CD2-CE1 4.36Å; L251-T374 HydrophobicContact CD2-CG2 3.78Å
252S95.3Very high92.6Very high68 Ų6856.3 Ų56.348%0.47631%0.309SS..Hα-helixtrans-66.9-45.4-175.458.20000112.5I248 I249 F256I248-S252 VanDerWaalsContact O-CB 3.26Å; I248-S252 WeakPolarHBondContact O-CB 3.24Å; I248-S252 PolarHBondContact O-N 3.43Å; I248-S252 PolarHBondContact O-OG 2.9Å; I249-S252 PolarHBondContact O-N 2.84Å; I249-S252 PolarHBondContact O-OG 2.92Å; S252-F256 WeakPolarHBondContact O-CB 3.15Å; S252-F256 PolarHBondContact O-N 3.45Å
253L95.1Very high91.9Very high85 Ų8558.7 Ų58.745%0.44531%0.314SS..Hα-helixtrans-64.6-48.8179.7-179.862.9000111.4I249 L255 F256 L257I249-L253 WeakPolarHBondContact O-CB 3.43Å; I249-L253 PolarHBondContact O-N 3.46Å; L253-L255 VanDerWaalsContact C-N 3.33Å; L253-L255 PolarHBondContact O-N 3.33Å; L253-F256 WeakPolarHBondContact O-CB 3.39Å; L253-F256 PolarHBondContact O-N 3.07Å; L253-L257 HydrophobicContact CD1-CD1 4.35Å; L253-L257 HydrophobicContact CD1-CG 4.35Å; L253-L257 HydrophobicContact CG-CD1 4.16Å; L253-L257 VanDerWaalsContact O-CG 3.28Å; L253-L257 WeakPolarHBondContact O-CG 3.46Å; L253-L257 PolarHBondContact O-N 3.47Å
254L95.9Very high91.1Very high20 Ų2059.1 Ų59.111%0.10531%0.314CS..Hα-helixtrans-71-31.4-176.7-61.6174.9000111.8A250 L257 S258 L278 C281 A282 F370A250-L254 WeakPolarHBondContact O-CB 3.17Å; A250-L254 WeakPolarHBondContact O-CD1 3.36Å; A250-L254 WeakPolarHBondContact O-CG 3.47Å; A250-L254 PolarHBondContact O-N 3.25Å; L254-L257 HydrophobicContact CD2-CD1 4.38Å; L254-S258 WeakPolarHBondContact O-CB 3.32Å; L254-S258 PolarHBondContact O-N 3.45Å; L254-S258 PolarHBondContact O-OG 3.34Å; L254-L278 HydrophobicContact CB-CB 4.28Å; L254-L278 HydrophobicContact CD2-CD2 3.63Å; L254-C281 HydrophobicContact CD1-CB 3.97Å; L254-A282 HydrophobicContact CB-CB 4.3Å; L254-A282 HydrophobicContact CD1-CB 3.64Å; L254-F370 HydrophobicContact CB-CE2 4.15Å; L254-F370 HydrophobicContact CB-CZ 4.42Å
255L94.2Very high90.1Very high59 Ų5962.3 Ų62.331%0.30933%0.326SS..Hα-helixtrans-68-44.8170.3-175.159.7000111.1L251 L253 L257 S258 Y259 F370L251-L255 WeakPolarHBondContact O-CB 3.08Å; L251-L255 PolarHBondContact O-N 3.29Å; L253-L255 VanDerWaalsContact C-N 3.33Å; L253-L255 PolarHBondContact O-N 3.33Å; L255-L257 PolarHBondContact O-N 2.96Å; L255-S258 WeakPolarHBondContact O-CB 3.39Å; L255-S258 PolarHBondContact O-N 2.76Å; L255-S258 VanDerWaalsContact O-N 3.1Å; L255-Y259 HydrophobicContact CD1-CD2 3.9Å; L255-Y259 HydrophobicContact CD1-CE2 3.61Å; L255-Y259 HydrophobicContact CG-CD2 4.01Å; L255-Y259 HydrophobicContact CG-CE2 3.97Å; L255-Y259 WeakPolarHBondContact O-CD2 3.33Å; L255-Y259 PolarHBondContact O-N 3.47Å; L255-F370 HydrophobicContact CB-CE1 4Å; L255-F370 HydrophobicContact CB-CE2 4.07Å; L255-F370 HydrophobicContact CB-CZ 3.72Å; L255-F370 HydrophobicContact CD1-CB 4.23Å; L255-F370 HydrophobicContact CD1-CD1 3.7Å; L255-F370 HydrophobicContact CD1-CD2 4.01Å; L255-F370 HydrophobicContact CD1-CE1 3.98Å; L255-F370 HydrophobicContact CD1-CE2 4.28Å; L255-F370 HydrophobicContact CD1-CG 3.7Å; L255-F370 HydrophobicContact CD1-CZ 4.27Å; L255-F370 HydrophobicContact CG-CE1 4.43Å
256F94.5Very high89.1Confident126 Ų12661.5 Ų61.555%0.55332%0.32SS*.Hα-helixtrans-58.1-48.5176.3174.6-101.2000111.3S252 L253 S258 Y259 T260S252-F256 WeakPolarHBondContact O-CB 3.15Å; S252-F256 PolarHBondContact O-N 3.45Å; L253-F256 WeakPolarHBondContact O-CB 3.39Å; L253-F256 PolarHBondContact O-N 3.07Å; F256-S258 PolarHBondContact O-N 2.86Å; F256-Y259 PolarHBondContact O-N 3.26Å; F256-Y259 VanDerWaalsContact O-N 3.08Å; F256-T260 HydrophobicContact CD1-CG2 4.33Å; F256-T260 HydrophobicContact CD2-CG2 3.97Å; F256-T260 HydrophobicContact CE1-CG2 3.91Å; F256-T260 HydrophobicContact CE2-CG2 3.51Å; F256-T260 HydrophobicContact CG-CG2 4.37Å; F256-T260 HydrophobicContact CZ-CG2 3.49Å; F256-T260 VanDerWaalsContact CZ-CG2 3.49Å; F256-T260 PolarHBondContact O-N 2.94Å; F256-T260 PolarHBondContact O-OG1 3.47Å
257L93.3Very high88.2Confident40 Ų4063.5 Ų63.521%0.20933%0.327CS..Hα-helixtrans-60.8-32.9175.3-67.7173.5000112.5Y127 L253 L254 L255 T260 Y261 L278Y127-L257 HydrophobicContact CE1-CD2 4.32Å; Y127-L257 HydrophobicContact CE2-CB 3.95Å; Y127-L257 WeakPolarHBondContact OH-CD2 3.24Å; L253-L257 HydrophobicContact CD1-CD1 4.35Å; L253-L257 HydrophobicContact CD1-CG 4.35Å; L253-L257 HydrophobicContact CG-CD1 4.16Å; L253-L257 VanDerWaalsContact O-CG 3.28Å; L253-L257 WeakPolarHBondContact O-CG 3.46Å; L253-L257 PolarHBondContact O-N 3.47Å; L254-L257 HydrophobicContact CD2-CD1 4.38Å; L255-L257 PolarHBondContact O-N 2.96Å; L257-T260 WeakPolarHBondContact CA-OG1 3.49Å; L257-Y261 PolarHBondContact O-N 3.14Å; L257-Y261 VanDerWaalsContact O-N 3.13Å; L257-L278 HydrophobicContact CB-CD1 4.12Å
258S91.8Very high87.4Confident1 Ų163.2 Ų63.21%0.00733%0.325CS..Hα-helixtrans-67.5-35.7174.7-59.40000112.3L254 L255 F256 L278L254-S258 WeakPolarHBondContact O-CB 3.32Å; L254-S258 PolarHBondContact O-N 3.45Å; L254-S258 PolarHBondContact O-OG 3.34Å; L255-S258 WeakPolarHBondContact O-CB 3.39Å; L255-S258 PolarHBondContact O-N 2.76Å; L255-S258 VanDerWaalsContact O-N 3.1Å; F256-S258 PolarHBondContact O-N 2.86Å; S258-L278 VanDerWaalsContact OG-CD1 3.22Å; S258-L278 WeakPolarHBondContact OG-CD1 3.43Å
259Y88.9Confident86.6Confident89 Ų8958.1 Ų58.135%0.34930%0.299SS..Hα-helixtrans-82.6-33177.9-85.8-74.4000113.6L255 F256 Y261 K362 V366L255-Y259 HydrophobicContact CD1-CD2 3.9Å; L255-Y259 HydrophobicContact CD1-CE2 3.61Å; L255-Y259 HydrophobicContact CG-CD2 4.01Å; L255-Y259 HydrophobicContact CG-CE2 3.97Å; L255-Y259 WeakPolarHBondContact O-CD2 3.33Å; L255-Y259 PolarHBondContact O-N 3.47Å; F256-Y259 PolarHBondContact O-N 3.26Å; F256-Y259 VanDerWaalsContact O-N 3.08Å; Y259-Y261 VanDerWaalsContact C-N 3.27Å; Y259-K362 WeakPolarHBondContact O-CE 3.43Å; Y259-K362 PolarHBondContact O-NZ 3.48Å; Y259-V366 HydrophobicContact CD1-CG1 4.37Å; Y259-V366 HydrophobicContact CD2-CG1 4.23Å; Y259-V366 HydrophobicContact CE1-CB 4.4Å; Y259-V366 HydrophobicContact CE1-CG1 4.25Å; Y259-V366 HydrophobicContact CE2-CG1 4.12Å; Y259-V366 HydrophobicContact CG-CG1 4.36Å
260T88.9Confident86.1Confident70 Ų7055 Ų5543%0.42928%0.283SS..Hα-helixtrans-85.70.2177.655.60000113.4F256 L257F256-T260 HydrophobicContact CD1-CG2 4.33Å; F256-T260 HydrophobicContact CD2-CG2 3.97Å; F256-T260 HydrophobicContact CE1-CG2 3.91Å; F256-T260 HydrophobicContact CE2-CG2 3.51Å; F256-T260 HydrophobicContact CG-CG2 4.37Å; F256-T260 HydrophobicContact CZ-CG2 3.49Å; F256-T260 VanDerWaalsContact CZ-CG2 3.49Å; F256-T260 PolarHBondContact O-N 2.94Å; F256-T260 PolarHBondContact O-OG1 3.47Å; L257-T260 WeakPolarHBondContact CA-OG1 3.49Å
261Y87.3Confident85.7Confident3 Ų356 Ų561%0.01228%0.284CS..SBendtrans-52.7134.8173.7-168.9-89.1000111.2Y127 Q130 V131 D134 L257 Y259 E263 R271 T274Y127-Y261 HydrophobicContact CE2-CD2 4.26Å; Q130-Y261 VanDerWaalsContact C-OH 3.28Å; Q130-Y261 HydrophobicContact CB-CE2 4.24Å; Q130-Y261 WeakPolarHBondContact CB-OH 3.28Å; Q130-Y261 PolarHBondContact O-OH 3.01Å; Q130-Y261 VanDerWaalsContact O-OH 3.13Å; V131-Y261 HydrophobicContact CG2-CD2 4.1Å; V131-Y261 HydrophobicContact CG2-CE2 3.75Å; D134-Y261 VanDerWaalsContact OD2-CE1 3.24Å; D134-Y261 WeakPolarHBondContact OD2-CE1 3.26Å; D134-Y261 VanDerWaalsContact OD2-CZ 3.28Å; D134-Y261 PolarHBondContact OD2-OH 3.29Å; L257-Y261 PolarHBondContact O-N 3.14Å; L257-Y261 VanDerWaalsContact O-N 3.13Å; Y259-Y261 VanDerWaalsContact C-N 3.27Å; Y261-E263 PolarHBondContact O-N 3.21Å; Y261-R271 HydrophobicContact CD1-CB 4.03Å; Y261-R271 HydrophobicContact CD1-CG 4.14Å; Y261-R271 HydrophobicContact CE1-CB 4.21Å; Y261-T274 HydrophobicContact CD2-CG2 3.78Å; Y261-T274 HydrophobicContact CE2-CG2 3.8Å
262P83.6Confident85.2Confident44 Ų4453 Ų5329%0.28627%0.268SS..PPolyproline II helixtrans-52.6133.8-176.2-27.334.3000113.1
263E77.1Confident84.8Confident137 Ų13751.5 Ų51.564%0.6425%0.254SS*.PPolyproline II helixtrans-86.1134.8172.8-70-179.6-170.300110Y261 K362Y261-E263 PolarHBondContact O-N 3.21Å; E263-K362 WeakPolarHBondContact OE1-CD 3.27Å; E263-K362 WeakPolarHBondContact OE1-CE 3.5Å; E263-K362 IonicContact OE1-NZ 3.88Å; E263-K362 PolarHBondContact OE1-NZ 2.99Å
264L76.3Confident84.6Confident31 Ų3147.5 Ų47.516%0.16223%0.234CC..  trans-104.7150.7174.6-70.4168.8000109.5D134 Y157 H266 T268D134-L264 HydrophobicContact CB-CD1 4.28Å; D134-L264 HydrophobicContact CB-CD2 4.27Å; D134-L264 HydrophobicContact CB-CG 4.47Å; Y157-L264 HydrophobicContact CE2-CD1 4.12Å; Y157-L264 HydrophobicContact CE2-CD2 3.95Å; L264-H266 PolarHBondContact O-N 3.06Å; L264-H266 VanDerWaalsContact O-N 3.09Å; L264-T268 HydrophobicContact CD1-CG2 3.64Å
265D71.8Confident84.5Confident161 Ų16146.6 Ų46.686%0.86123%0.229SC*.SBendtrans-64.2-15.2179.3-54.1-51.7000113.2
266H73.1Confident84.4Confident83 Ų8344 Ų4438%0.38422%0.216SC..SBendtrans-130.1154.3178.262.3-78.2000110.9L264 T268L264-H266 PolarHBondContact O-N 3.06Å; L264-H266 VanDerWaalsContact O-N 3.09Å; H266-T268 VanDerWaalsContact NE2-CG2 3.33Å; H266-T268 WeakPolarHBondContact NE2-CG2 3.22Å; H266-T268 PolarHBondContact O-N 2.93Å
267Y73.6Confident84.4Confident47 Ų4738.6 Ų38.618%0.18419%0.192CC..  trans-70.8119.5177.8179.6-98.3000111.1N65 Y66 R360 E365N65-Y267 HydrophobicContact CB-CE1 4.23Å; N65-Y267 WeakPolarHBondContact CB-OH 3.42Å; Y66-Y267 HydrophobicContact CD2-CD1 4.19Å; Y66-Y267 HydrophobicContact CD2-CE1 4.44Å; Y267-R360 HydrophobicContact CD2-CB 3.92Å; Y267-R360 HydrophobicContact CD2-CG 4.07Å; Y267-R360 HydrophobicContact CE1-CG 4.45Å; Y267-R360 HydrophobicContact CE2-CB 3.92Å; Y267-R360 HydrophobicContact CE2-CG 3.91Å; Y267-R360 HydrophobicContact CG-CG 4.44Å; Y267-E365 PolarHBondContact OH-OE1 3.31Å
268T76.1Confident84.5Confident9 Ų936.8 Ų36.86%0.05518%0.183CC..  trans-116.6159.4169.560.20000110.6L264 H266 T270L264-T268 HydrophobicContact CD1-CG2 3.64Å; H266-T268 VanDerWaalsContact NE2-CG2 3.33Å; H266-T268 WeakPolarHBondContact NE2-CG2 3.22Å; H266-T268 PolarHBondContact O-N 2.93Å; T268-T270 VanDerWaalsContact C-N 3.28Å; T268-T270 PolarHBondContact OG1-OG1 3.47Å
269T78.8Confident84.7Confident4 Ų436.7 Ų36.73%0.02518%0.182CC..SBendtrans-75.8-16.8172.833.80000113.1E156 R271 G272 D273E156-T269 PolarHBondContact OE1-OG1 2.88Å; T269-R271 PolarHBondContact O-N 3.29Å; T269-G272 PolarHBondContact O-N 3.5Å; T269-G272 VanDerWaalsContact O-N 3.13Å; T269-D273 PolarHBondContact O-N 3.5Å
270T82.2Confident85Confident0 Ų033.7 Ų33.70%017%0.173CC..Hα-helixtrans-55.3-48.6-173.256.60000113D134 E156 T268 G272 D273 T274D134-T270 PolarHBondContact OD2-OG1 2.97Å; E156-T270 HydrophobicContact CB-CG2 4.32Å; E156-T270 HydrophobicContact CG-CG2 3.91Å; T268-T270 VanDerWaalsContact C-N 3.28Å; T268-T270 PolarHBondContact OG1-OG1 3.47Å; T270-G272 PolarHBondContact O-N 3.37Å; T270-D273 PolarHBondContact O-N 2.85Å; T270-T274 WeakPolarHBondContact O-CB 3.33Å; T270-T274 PolarHBondContact O-N 2.88Å; T270-T274 PolarHBondContact O-OG1 2.88Å
271R85.9Confident85.3Confident37 Ų3730.8 Ų30.814%0.1416%0.155CC..Hα-helixtrans-55.9-49.9177.7179.4-178.263.8-170.20.2111.9Y261 T269 D273 T274 T275 R360 E365 V366Y261-R271 HydrophobicContact CD1-CB 4.03Å; Y261-R271 HydrophobicContact CD1-CG 4.14Å; Y261-R271 HydrophobicContact CE1-CB 4.21Å; T269-R271 PolarHBondContact O-N 3.29Å; R271-D273 VanDerWaalsContact C-N 3.33Å; R271-D273 PolarHBondContact O-N 2.95Å; R271-T274 PolarHBondContact O-N 2.83Å; R271-T275 PolarHBondContact O-N 3.01Å; R271-T275 PolarHBondContact O-OG1 2.89Å; R271-R360 PolarHBondContact NH2-O 3.28Å; R271-E365 IonicContact CZ-OE2 2.76Å; R271-E365 IonicContact NE-OE2 3.93Å; R271-E365 PolarHBondContact NE-OE2 2.99Å; R271-E365 IonicContact NH2-OE2 3.57Å; R271-E365 PolarHBondContact NH2-OE2 3.39Å; R271-V366 HydrophobicContact CG-CG2 4.5Å
272G86Confident85.7Confident0 Ų030.6 Ų30.60%016%0.155CC..Hα-helixtrans-66.5-36.1-177.600000113T269 T270 T276 K369T269-G272 PolarHBondContact O-N 3.5Å; T269-G272 VanDerWaalsContact O-N 3.13Å; T270-G272 PolarHBondContact O-N 3.37Å; G272-T276 WeakPolarHBondContact O-CB 3.47Å; G272-T276 PolarHBondContact O-N 3.38Å; G272-T276 VanDerWaalsContact O-N 3.1Å; G272-T276 PolarHBondContact O-OG1 3.3Å; G272-K369 VanDerWaalsContact CA-NZ 3.31Å; G272-K369 WeakPolarHBondContact O-CD 3.41Å
273D87.3Confident86.3Confident35 Ų3528.5 Ų28.519%0.18714%0.141CC..Hα-helixtrans-69.8-40.8175.6-68.9-4.7000110.6T269 T270 R271 T276 I277T269-D273 PolarHBondContact O-N 3.5Å; T270-D273 PolarHBondContact O-N 2.85Å; R271-D273 VanDerWaalsContact C-N 3.33Å; R271-D273 PolarHBondContact O-N 2.95Å; D273-T276 VanDerWaalsContact O-CB 3.32Å; D273-T276 WeakPolarHBondContact O-CB 3.44Å; D273-T276 PolarHBondContact O-N 3.1Å; D273-I277 VanDerWaalsContact O-CG1 3.28Å; D273-I277 WeakPolarHBondContact O-CG1 3.13Å; D273-I277 PolarHBondContact O-N 3.25Å; D273-I277 VanDerWaalsContact O-N 3.08Å
274T91.1Very high87.1Confident2 Ų222.1 Ų22.11%0.01211%0.112CC..Hα-helixtrans-61.1-46.4173.7-58.90000111.7Y127 Q130 Y261 T270 R271 T276 I277 L278Y127-T274 HydrophobicContact CD2-CG2 3.66Å; Y127-T274 HydrophobicContact CE2-CG2 4.18Å; Q130-T274 WeakPolarHBondContact CB-OG1 3.5Å; Q130-T274 WeakPolarHBondContact CG-OG1 3.32Å; Y261-T274 HydrophobicContact CD2-CG2 3.78Å; Y261-T274 HydrophobicContact CE2-CG2 3.8Å; T270-T274 WeakPolarHBondContact O-CB 3.33Å; T270-T274 PolarHBondContact O-N 2.88Å; T270-T274 PolarHBondContact O-OG1 2.88Å; R271-T274 PolarHBondContact O-N 2.83Å; T274-T276 VanDerWaalsContact C-N 3.25Å; T274-T276 PolarHBondContact O-N 3.42Å; T274-I277 PolarHBondContact O-N 3.15Å; T274-L278 HydrophobicContact CG2-CD1 3.88Å; T274-L278 HydrophobicContact CG2-CG 4.27Å; T274-L278 VanDerWaalsContact O-CG 3.32Å; T274-L278 WeakPolarHBondContact O-CG 3.33Å; T274-L278 PolarHBondContact O-N 3.26Å
275T92.6Very high88Confident0 Ų020.9 Ų20.90%011%0.106CC..Hα-helixtrans-60.6-36.7176.4-53.20000112.3R271 G279 V366 K369 F370R271-T275 PolarHBondContact O-N 3.01Å; R271-T275 PolarHBondContact O-OG1 2.89Å; T275-G279 PolarHBondContact O-N 3.47Å; T275-V366 HydrophobicContact CG2-CG1 3.97Å; T275-V366 WeakPolarHBondContact CG2-O 3.37Å; T275-K369 HydrophobicContact CG2-CB 3.99Å; T275-F370 HydrophobicContact CG2-CB 3.81Å; T275-F370 HydrophobicContact CG2-CD2 4.33Å
276T93.1Very high89.1Confident6 Ų614.4 Ų14.44%0.0377%0.072CC..Hα-helixtrans-60.8-48.8176.3-650000110.8G272 D273 T274 G279 V280 Y373G272-T276 WeakPolarHBondContact O-CB 3.47Å; G272-T276 PolarHBondContact O-N 3.38Å; G272-T276 VanDerWaalsContact O-N 3.1Å; G272-T276 PolarHBondContact O-OG1 3.3Å; D273-T276 VanDerWaalsContact O-CB 3.32Å; D273-T276 WeakPolarHBondContact O-CB 3.44Å; D273-T276 PolarHBondContact O-N 3.1Å; T274-T276 VanDerWaalsContact C-N 3.25Å; T274-T276 PolarHBondContact O-N 3.42Å; T276-G279 PolarHBondContact O-N 3.24Å; T276-V280 WeakPolarHBondContact O-CG2 3.44Å; T276-V280 PolarHBondContact O-N 2.86Å; T276-Y373 HydrophobicContact CG2-CD1 3.62Å; T276-Y373 HydrophobicContact CG2-CD2 3.57Å; T276-Y373 HydrophobicContact CG2-CE1 3.4Å; T276-Y373 VanDerWaalsContact CG2-CE1 3.4Å; T276-Y373 HydrophobicContact CG2-CE2 3.42Å; T276-Y373 VanDerWaalsContact CG2-CE2 3.42Å; T276-Y373 HydrophobicContact CG2-CG 3.69Å; T276-Y373 WeakPolarHBondContact O-CB 3.47Å; T276-Y373 VanDerWaalsContact OG1-CE2 3.28Å; T276-Y373 WeakPolarHBondContact OG1-CE2 3.33Å
277I93.7Very high90.1Very high11 Ų1110.4 Ų10.46%0.0565%0.053CC..Hα-helixtrans-63.7-48.4-179.7-63.8166.8000111W122 T123 M126 D273 T274 G279 V280 C281W122-I277 HydrophobicContact CD2-CG2 4.46Å; W122-I277 HydrophobicContact CE3-CG2 4.09Å; W122-I277 HydrophobicContact CH2-CB 4.17Å; W122-I277 HydrophobicContact CH2-CG1 3.71Å; W122-I277 HydrophobicContact CH2-CG2 3.92Å; W122-I277 HydrophobicContact CZ2-CD1 4.24Å; W122-I277 HydrophobicContact CZ2-CG1 3.81Å; W122-I277 HydrophobicContact CZ2-CG2 4.27Å; W122-I277 HydrophobicContact CZ3-CB 4.44Å; W122-I277 HydrophobicContact CZ3-CG1 4.45Å; W122-I277 HydrophobicContact CZ3-CG2 3.81Å; T123-I277 HydrophobicContact CG2-CG2 4.13Å; M126-I277 HydrophobicContact CB-CD1 3.72Å; M126-I277 HydrophobicContact CB-CG2 4.21Å; M126-I277 HydrophobicContact CE-CD1 3.46Å; M126-I277 VanDerWaalsContact CE-CD1 3.46Å; M126-I277 HydrophobicContact CG-CD1 4Å; D273-I277 VanDerWaalsContact O-CG1 3.28Å; D273-I277 WeakPolarHBondContact O-CG1 3.13Å; D273-I277 PolarHBondContact O-N 3.25Å; D273-I277 VanDerWaalsContact O-N 3.08Å; T274-I277 PolarHBondContact O-N 3.15Å; I277-G279 VanDerWaalsContact C-N 3.33Å; I277-G279 PolarHBondContact O-N 3.27Å; I277-V280 PolarHBondContact O-N 3.4Å; I277-C281 PolarHBondContact O-N 3.39Å
278L95.6Very high91Very high2 Ų28.7 Ų8.71%0.015%0.046CC..Hα-helixtrans-61.3-40.9177.7-67175.5000111.8T123 Y127 L254 L257 S258 T274 C281 A282T123-L278 HydrophobicContact CG2-CD2 3.85Å; Y127-L278 HydrophobicContact CD2-CD1 3.93Å; Y127-L278 HydrophobicContact CD2-CD2 4.06Å; Y127-L278 HydrophobicContact CD2-CG 4.38Å; Y127-L278 HydrophobicContact CE2-CD1 4.13Å; L254-L278 HydrophobicContact CB-CB 4.28Å; L254-L278 HydrophobicContact CD2-CD2 3.63Å; L257-L278 HydrophobicContact CB-CD1 4.12Å; S258-L278 VanDerWaalsContact OG-CD1 3.22Å; S258-L278 WeakPolarHBondContact OG-CD1 3.43Å; T274-L278 HydrophobicContact CG2-CD1 3.88Å; T274-L278 HydrophobicContact CG2-CG 4.27Å; T274-L278 VanDerWaalsContact O-CG 3.32Å; T274-L278 WeakPolarHBondContact O-CG 3.33Å; T274-L278 PolarHBondContact O-N 3.26Å; L278-C281 PolarHBondContact O-N 3.19Å; L278-A282 WeakPolarHBondContact O-CB 3.3Å; L278-A282 PolarHBondContact O-N 3.42Å
279G95.3Very high91.8Very high0 Ų011 Ų110%05%0.054CC..Hα-helixtrans-61.3-46.6176.400000112.7T275 T276 I277 A282 G283 Y373 T374T275-G279 PolarHBondContact O-N 3.47Å; T276-G279 PolarHBondContact O-N 3.24Å; I277-G279 VanDerWaalsContact C-N 3.33Å; I277-G279 PolarHBondContact O-N 3.27Å; G279-A282 PolarHBondContact O-N 3.46Å; G279-G283 PolarHBondContact O-N 3.47Å; G279-Y373 CarbonylContact O-C 3.33Å; G279-T374 WeakPolarHBondContact O-CA 3.43Å; G279-T374 PolarHBondContact O-N 3.44Å; G279-T374 PolarHBondContact O-OG1 3.35Å; G279-T374 VanDerWaalsContact O-OG1 3.04Å
280V95Very high92.4Very high26 Ų2611.7 Ų11.716%0.1586%0.06CC..Hα-helixtrans-60.4-47.4175.91750000110.7T276 I277 A282 G283 C284 Y373T276-V280 WeakPolarHBondContact O-CG2 3.44Å; T276-V280 PolarHBondContact O-N 2.86Å; I277-V280 PolarHBondContact O-N 3.4Å; V280-A282 VanDerWaalsContact C-N 3.32Å; V280-A282 PolarHBondContact O-N 2.98Å; V280-G283 PolarHBondContact O-N 3.45Å; V280-C284 WeakPolarHBondContact O-CB 3.18Å; V280-C284 PolarHBondContact O-N 2.86Å; V280-C284 PolarHBondContact O-SG 3.5Å; V280-C284 VanDerWaalsContact O-SG 3.38Å; V280-Y373 WeakPolarHBondContact CA-O 3.38Å; V280-Y373 HydrophobicContact CG2-CD1 3.66Å; V280-Y373 HydrophobicContact CG2-CG 4.09Å
281C95.9Very high92.7Very high8 Ų812.1 Ų12.15%0.0546%0.062CC..Hα-helixtrans-58.5-44.9178.8-169.80000111.8V119 T123 L254 I277 L278 G283 C284 S285V119-C281 HydrophobicContact CG1-CB 4.33Å; T123-C281 HydrophobicContact CG2-CB 3.65Å; T123-C281 VanDerWaalsContact OG1-CB 3.29Å; T123-C281 WeakPolarHBondContact OG1-CB 3.35Å; L254-C281 HydrophobicContact CD1-CB 3.97Å; I277-C281 PolarHBondContact O-N 3.39Å; L278-C281 PolarHBondContact O-N 3.19Å; C281-G283 PolarHBondContact O-N 3.28Å; C281-C284 PolarHBondContact O-N 3.15Å; C281-S285 WeakPolarHBondContact O-CB 3.25Å; C281-S285 PolarHBondContact O-N 2.97Å; C281-S285 PolarHBondContact O-OG 2.99Å
282A96.6Very high92.8Very high0 Ų012.7 Ų12.70%07%0.07CC..Hα-helixtrans-60.8-46.4178.500000111.4L251 L254 L278 G279 V280 S285 V286 F370L251-A282 HydrophobicContact CD2-CB 3.98Å; L254-A282 HydrophobicContact CB-CB 4.3Å; L254-A282 HydrophobicContact CD1-CB 3.64Å; L278-A282 WeakPolarHBondContact O-CB 3.3Å; L278-A282 PolarHBondContact O-N 3.42Å; G279-A282 PolarHBondContact O-N 3.46Å; V280-A282 VanDerWaalsContact C-N 3.32Å; V280-A282 PolarHBondContact O-N 2.98Å; A282-S285 PolarHBondContact O-N 2.96Å; A282-V286 VanDerWaalsContact O-CG2 3.27Å; A282-V286 WeakPolarHBondContact O-CG2 3.29Å; A282-V286 PolarHBondContact O-N 2.68Å; A282-F370 HydrophobicContact CB-CE2 4.45Å; A282-F370 HydrophobicContact CB-CZ 3.94Å
283G95.6Very high92.9Very high0 Ų017.7 Ų17.70%09%0.093CC..Hα-helixtrans-63-45177.800000113G279 V280 C281 G287 T374 L378G279-G283 PolarHBondContact O-N 3.47Å; V280-G283 PolarHBondContact O-N 3.45Å; C281-G283 PolarHBondContact O-N 3.28Å; G283-G287 PolarHBondContact O-N 3.48Å; G283-T374 WeakPolarHBondContact CA-O 3.39Å; G283-L378 WeakPolarHBondContact O-CD2 3.39Å
284C94.3Very high92.7Very high3 Ų320.7 Ų20.72%0.0211%0.109CC..Hα-helixtrans-61-46.1175.6-73.40000111.1V119 V280 C281 G287 Y288V119-C284 HydrophobicContact CG1-CB 4.26Å; V280-C284 WeakPolarHBondContact O-CB 3.18Å; V280-C284 PolarHBondContact O-N 2.86Å; V280-C284 PolarHBondContact O-SG 3.5Å; V280-C284 VanDerWaalsContact O-SG 3.38Å; C281-C284 PolarHBondContact O-N 3.15Å; C284-G287 PolarHBondContact O-N 3.29Å; C284-G287 VanDerWaalsContact O-N 3.14Å; C284-Y288 HydrophobicContact CB-CD2 4.28Å; C284-Y288 HydrophobicContact CB-CE2 3.87Å; C284-Y288 WeakPolarHBondContact O-CD2 3.2Å; C284-Y288 PolarHBondContact O-N 2.93Å
285S94.8Very high91.9Very high5 Ų522.8 Ų22.84%0.03513%0.131CC..Hα-helixtrans-60.8-46.5-179.5-67.20000113Q240 C281 A282 G287 Y288 W289Q240-S285 PolarHBondContact NE2-OG 3.44Å; C281-S285 WeakPolarHBondContact O-CB 3.25Å; C281-S285 PolarHBondContact O-N 2.97Å; C281-S285 PolarHBondContact O-OG 2.99Å; A282-S285 PolarHBondContact O-N 2.96Å; S285-G287 VanDerWaalsContact C-N 3.3Å; S285-G287 PolarHBondContact O-N 2.85Å; S285-Y288 PolarHBondContact O-N 3.29Å; S285-W289 PolarHBondContact O-N 3.44Å; S285-W289 VanDerWaalsContact O-N 3.13Å
286V95.2Very high90.7Very high24 Ų2425.9 Ų25.915%0.14515%0.147CC..Hα-helixtrans-62.4-41.41741770000110.6P247 L251 A282 W289 A290 L378P247-V286 HydrophobicContact CB-CB 4.34Å; P247-V286 HydrophobicContact CB-CG1 4.15Å; P247-V286 HydrophobicContact CB-CG2 3.79Å; L251-V286 HydrophobicContact CD1-CG2 3.85Å; L251-V286 HydrophobicContact CD2-CG2 4.25Å; L251-V286 HydrophobicContact CG-CG2 3.77Å; A282-V286 VanDerWaalsContact O-CG2 3.27Å; A282-V286 WeakPolarHBondContact O-CG2 3.29Å; A282-V286 PolarHBondContact O-N 2.68Å; V286-W289 PolarHBondContact O-N 2.95Å; V286-A290 WeakPolarHBondContact O-CB 3.38Å; V286-A290 PolarHBondContact O-N 3.34Å; V286-L378 HydrophobicContact CB-CD2 3.89Å; V286-L378 HydrophobicContact CG1-CD2 3.73Å
287G92.9Very high89.5Confident0 Ų028.1 Ų28.10%016%0.161CC..Hα-helixtrans-64-42.3179.800000113.6G283 C284 S285 A290 N291G283-G287 PolarHBondContact O-N 3.48Å; C284-G287 PolarHBondContact O-N 3.29Å; C284-G287 VanDerWaalsContact O-N 3.14Å; S285-G287 VanDerWaalsContact C-N 3.3Å; S285-G287 PolarHBondContact O-N 2.85Å; G287-A290 PolarHBondContact O-N 3.37Å; G287-N291 VanDerWaalsContact O-CG 3.3Å; G287-N291 PolarHBondContact O-N 2.8Å; G287-N291 PolarHBondContact O-ND2 2.96Å
288Y92.1Very high88.3Confident10 Ų1030.2 Ų30.24%0.03917%0.17CC..Hα-helixtrans-64.9-44.3176-69.5-57.9000112.1H107 P112 R116 C284 S285 N291 V292H107-Y288 AromaticContact CE1-CE1 3.43Å; H107-Y288 VanDerWaalsContact CE1-CE1 3.43Å; H107-Y288 WeakPolarHBondContact CE1-CE1 3.35Å; H107-Y288 AromaticContact ND1-CE1 3.57Å; H107-Y288 AromaticContact ND1-CZ 3.85Å; H107-Y288 PolarHBondContact ND1-OH 3.49Å; P112-Y288 HydrophobicContact CB-CE1 4.32Å; R116-Y288 HydrophobicContact CB-CD2 4.14Å; R116-Y288 HydrophobicContact CB-CE1 4.36Å; R116-Y288 HydrophobicContact CB-CE2 3.73Å; R116-Y288 HydrophobicContact CG-CD2 3.81Å; R116-Y288 HydrophobicContact CG-CE2 3.85Å; R116-Y288 HydrophobicContact CG-CG 4.39Å; C284-Y288 HydrophobicContact CB-CD2 4.28Å; C284-Y288 HydrophobicContact CB-CE2 3.87Å; C284-Y288 WeakPolarHBondContact O-CD2 3.2Å; C284-Y288 PolarHBondContact O-N 2.93Å; S285-Y288 PolarHBondContact O-N 3.29Å; Y288-N291 PolarHBondContact O-N 3.37Å; Y288-V292 PolarHBondContact O-N 3.45Å
289W93.6Very high87.1Confident59 Ų5932.6 Ų32.622%0.22318%0.181CC..Hα-helixtrans-58.7-49.2174.2178.587.3000111.2S243 P247 S285 V286 N291 V292 Q293S243-W289 PolarHBondContact O-NE1 2.81Å; P247-W289 HydrophobicContact CB-CE3 4.45Å; P247-W289 HydrophobicContact CG-CD2 3.9Å; P247-W289 HydrophobicContact CG-CE3 3.95Å; P247-W289 HydrophobicContact CG-CG 4.4Å; P247-W289 HydrophobicContact CG-CH2 4.44Å; P247-W289 HydrophobicContact CG-CZ2 4.39Å; P247-W289 HydrophobicContact CG-CZ3 4.23Å; S285-W289 PolarHBondContact O-N 3.44Å; S285-W289 VanDerWaalsContact O-N 3.13Å; V286-W289 PolarHBondContact O-N 2.95Å; W289-N291 VanDerWaalsContact C-N 3.33Å; W289-N291 PolarHBondContact O-N 2.89Å; W289-V292 PolarHBondContact O-N 2.86Å; W289-V292 VanDerWaalsContact O-N 3.17Å; W289-Q293 HydrophobicContact CD2-CG 3.95Å; W289-Q293 HydrophobicContact CE3-CG 4.19Å; W289-Q293 HydrophobicContact CH2-CG 3.94Å; W289-Q293 HydrophobicContact CZ2-CG 3.68Å; W289-Q293 HydrophobicContact CZ3-CG 4.19Å; W289-Q293 WeakPolarHBondContact O-CG 3.46Å; W289-Q293 PolarHBondContact O-N 3.48Å; W289-Q293 VanDerWaalsContact O-N 3.09Å
290A91.4Very high85.6Confident17 Ų1735.4 Ų35.414%0.1420%0.199CC..Hα-helixtrans-60.8-40.4-179.800000112.5V286 G287 V292 Q293 L294 I382V286-A290 WeakPolarHBondContact O-CB 3.38Å; V286-A290 PolarHBondContact O-N 3.34Å; G287-A290 PolarHBondContact O-N 3.37Å; A290-V292 VanDerWaalsContact C-N 3.32Å; A290-V292 PolarHBondContact O-N 3.19Å; A290-Q293 PolarHBondContact O-N 2.97Å; A290-L294 WeakPolarHBondContact O-CB 3.34Å; A290-L294 WeakPolarHBondContact O-CD1 3.49Å; A290-L294 WeakPolarHBondContact O-CG 3.41Å; A290-L294 PolarHBondContact O-N 3.47Å; A290-I382 HydrophobicContact CB-CD1 3.99Å
291N88.9Confident84Confident10 Ų1044.1 Ų44.15%0.05323%0.229CC..Hα-helixtrans-61.1-39.8176.7-76.3-22000112.6G287 Y288 W289 L294 G295 D296 S381G287-N291 VanDerWaalsContact O-CG 3.3Å; G287-N291 PolarHBondContact O-N 2.8Å; G287-N291 PolarHBondContact O-ND2 2.96Å; Y288-N291 PolarHBondContact O-N 3.37Å; W289-N291 VanDerWaalsContact C-N 3.33Å; W289-N291 PolarHBondContact O-N 2.89Å; N291-L294 PolarHBondContact O-N 2.9Å; N291-G295 PolarHBondContact O-N 3.46Å; N291-D296 PolarHBondContact O-N 2.7Å; N291-S381 PolarHBondContact ND2-O 2.96Å
292V88.3Confident82.6Confident49 Ų4946.3 Ų46.330%0.29725%0.253SS..Hα-helixtrans-65.8-44.9176172.30000110.9L241 Y288 W289 A290 L294 G295 T297L241-V292 HydrophobicContact CB-CG2 4.17Å; L241-V292 HydrophobicContact CD1-CG2 4.18Å; L241-V292 HydrophobicContact CD2-CG2 3.8Å; L241-V292 HydrophobicContact CG-CG2 4.24Å; Y288-V292 PolarHBondContact O-N 3.45Å; W289-V292 PolarHBondContact O-N 2.86Å; W289-V292 VanDerWaalsContact O-N 3.17Å; A290-V292 VanDerWaalsContact C-N 3.32Å; A290-V292 PolarHBondContact O-N 3.19Å; V292-L294 VanDerWaalsContact C-N 3.29Å; V292-L294 PolarHBondContact O-N 3.18Å; V292-G295 PolarHBondContact O-N 2.77Å; V292-G295 VanDerWaalsContact O-N 3.13Å; V292-T297 HydrophobicContact CB-CG2 4.46Å; V292-T297 HydrophobicContact CG2-CG2 3.82Å
293Q87.7Confident81.3Confident105 Ų10552.2 Ų52.249%0.49129%0.291SS..Hα-helixtrans-66.1-31.2179.3-60.9-56.1-29.400113W289 A290 G295W289-Q293 HydrophobicContact CD2-CG 3.95Å; W289-Q293 HydrophobicContact CE3-CG 4.19Å; W289-Q293 HydrophobicContact CH2-CG 3.94Å; W289-Q293 HydrophobicContact CZ2-CG 3.68Å; W289-Q293 HydrophobicContact CZ3-CG 4.19Å; W289-Q293 WeakPolarHBondContact O-CG 3.46Å; W289-Q293 PolarHBondContact O-N 3.48Å; W289-Q293 VanDerWaalsContact O-N 3.09Å; A290-Q293 PolarHBondContact O-N 2.97Å; Q293-G295 VanDerWaalsContact C-N 3.3Å
294L84Confident80.5Confident98 Ų9855.7 Ų55.751%0.51331%0.309SS..THydrogen-bonded Turntrans-82-6.3176.7-66.7167.2000113A290 N291 V292 D296A290-L294 WeakPolarHBondContact O-CB 3.34Å; A290-L294 WeakPolarHBondContact O-CD1 3.49Å; A290-L294 WeakPolarHBondContact O-CG 3.41Å; A290-L294 PolarHBondContact O-N 3.47Å; N291-L294 PolarHBondContact O-N 2.9Å; V292-L294 VanDerWaalsContact C-N 3.29Å; V292-L294 PolarHBondContact O-N 3.18Å; L294-D296 PolarHBondContact O-N 3.36Å
295G74.1Confident79.8Confident46 Ų4657.8 Ų57.847%0.47432%0.323SS..THydrogen-bonded Turntrans76.51.8-178.500000115N291 V292 Q293 T297N291-G295 PolarHBondContact O-N 3.46Å; V292-G295 PolarHBondContact O-N 2.77Å; V292-G295 VanDerWaalsContact O-N 3.13Å; Q293-G295 VanDerWaalsContact C-N 3.3Å; G295-T297 VanDerWaalsContact C-N 3.34Å; G295-T297 PolarHBondContact O-N 3.44Å
296D67.6Low79.1Confident65 Ų6560.6 Ų60.635%0.34834%0.34SS..  trans-91.359.6-177.8-69-31.2000110.8N291 L294 F298 R386N291-D296 PolarHBondContact O-N 2.7Å; L294-D296 PolarHBondContact O-N 3.36Å; D296-F298 HydrophobicContact CB-CE2 4.06Å; D296-F298 VanDerWaalsContact O-CD2 3.22Å; D296-F298 WeakPolarHBondContact O-CD2 3.5Å; D296-F298 WeakPolarHBondContact O-CE2 3.28Å; D296-F298 PolarHBondContact O-N 3.25Å; D296-R386 IonicContact OD2-CZ 3.71Å; D296-R386 IonicContact OD2-NE 3.67Å; D296-R386 IonicContact OD2-NH2 2.88Å; D296-R386 PolarHBondContact OD2-NH2 3.19Å
297T66.2Low78.3Confident53 Ų5363.4 Ų63.433%0.32536%0.358SS..  trans-81.8107.4175.454.40000110.4V292 G295 E299V292-T297 HydrophobicContact CB-CG2 4.46Å; V292-T297 HydrophobicContact CG2-CG2 3.82Å; G295-T297 VanDerWaalsContact C-N 3.34Å; G295-T297 PolarHBondContact O-N 3.44Å; T297-E299 PolarHBondContact O-N 3.39Å
298F68.6Low77.3Confident55 Ų5568.6 Ų68.624%0.24139%0.386CS..  trans-75.822.9174.1-62.4-89.5000112.8P112 D296 N385 L394P112-F298 HydrophobicContact CG-CB 4.31Å; D296-F298 HydrophobicContact CB-CE2 4.06Å; D296-F298 VanDerWaalsContact O-CD2 3.22Å; D296-F298 WeakPolarHBondContact O-CD2 3.5Å; D296-F298 WeakPolarHBondContact O-CE2 3.28Å; D296-F298 PolarHBondContact O-N 3.25Å; F298-N385 HydrophobicContact CD1-CB 4.15Å; F298-N385 HydrophobicContact CD2-CB 3.63Å; F298-N385 HydrophobicContact CE1-CB 3.9Å; F298-N385 HydrophobicContact CE2-CB 3.38Å; F298-N385 HydrophobicContact CG-CB 4.03Å; F298-N385 HydrophobicContact CZ-CB 3.53Å; F298-L394 HydrophobicContact CD1-CD2 3.75Å; F298-L394 HydrophobicContact CE1-CD1 4.12Å; F298-L394 HydrophobicContact CE1-CD2 4Å
299E70.8Confident76.2Confident52 Ų5273 Ų7324%0.24342%0.416CS..SBendtrans-80143.9175.7-66.3-158.4-170.900110.2P112 R116 R181 T297 R301P112-E299 HydrophobicContact CB-CG 4.49Å; R116-E299 IonicContact NH2-OE1 2.96Å; R181-E299 IonicContact CZ-OE2 3.54Å; R181-E299 IonicContact NH1-OE2 3.33Å; R181-E299 PolarHBondContact NH1-OE2 3Å; R181-E299 IonicContact NH2-OE2 2.77Å; R181-E299 PolarHBondContact NH2-OE2 2.77Å; T297-E299 PolarHBondContact O-N 3.39Å; E299-R301 PolarHBondContact O-N 2.95Å; E299-R301 VanDerWaalsContact O-N 3.13Å
300P65.1Low75.4Confident59 Ų5975.7 Ų75.738%0.38344%0.439SS..  trans-54.4119.4176.7-22.831.8000111.4
301R60.9Low74.8Confident209 Ų20981.1 Ų81.179%0.78947%0.47SS*.  trans-88.3114.7175.1-63.6-178-177.8173.7-0.5109E299E299-R301 PolarHBondContact O-N 2.95Å; E299-R301 VanDerWaalsContact O-N 3.13Å
302G65.3Low74.7Confident53 Ų5383.8 Ų83.855%0.54649%0.486SS..SBendtrans155.9-176.3177.300000114.1L304G302-L304 PolarHBondContact O-N 2.9Å
303P70.4Confident74.5Confident125 Ų12585.7 Ų85.781%0.81251%0.508SS*.SBendtrans-67.1116.9173.928.3-32.1000109.6
304L79.2Confident74.4Confident72 Ų7285.6 Ų85.638%0.37751%0.51SS..SBendtrans-92147.5172.4-64.1169.2000109.1G302 V306G302-L304 PolarHBondContact O-N 2.9Å; L304-V306 HydrophobicContact CD2-CG2 3.94Å
305P78.8Confident74.3Confident48 Ų4883.5 Ų83.531%0.31250%0.503SS..SBendcis-82.2143-1.430.5-34000113.8R181 Q183R181-P305 CarbonylContact O-C 3.59Å; R181-P305 WeakPolarHBondContact O-CA 3.32Å; Q183-P305 HydrophobicContact CG-CB 3.79Å; Q183-P305 HydrophobicContact CG-CG 3.6Å; Q183-P305 PolarHBondContact NE2-O 3.38Å
306V79.8Confident74.8Confident64 Ų6485.2 Ų85.239%0.38850%0.504SS..EExtended strand (participates in β ladder)trans-80.6139179.6-169.20000110.3R181 V182 Q183 L304R181-V306 PolarHBondContact O-N 3.48Å; V182-V306 WeakPolarHBondContact CA-O 3.38Å; Q183-V306 PolarHBondContact N-O 3.2Å; L304-V306 HydrophobicContact CD2-CG2 3.94Å
307P79Confident75.7Confident82 Ų8285 Ų8553%0.53251%0.511SS..EExtended strand (participates in β ladder)trans-60.814417026.4-34.6000111P309P307-P309 WeakPolarHBondContact O-CD 3.46Å; P307-P309 VanDerWaalsContact O-N 3.12Å
308L71.9Confident76.6Confident109 Ų10988.6 Ų88.657%0.57152%0.519SS*.PPolyproline II helixtrans-52.9118.9174.5-94.2150.5000109.8V182 Q183 F184V182-L308 HydrophobicContact CG1-CD1 4.38Å; V182-L308 HydrophobicContact CG1-CD2 4.19Å; V182-L308 HydrophobicContact CG1-CG 3.7Å; Q183-L308 WeakPolarHBondContact O-CD1 3.33Å; F184-L308 HydrophobicContact CB-CD1 3.74Å
309P69.7Low77.4Confident104 Ų10486.4 Ų86.468%0.67551%0.512SS*.PPolyproline II helixtrans-63.1144.6-179.624.1-31.8000109.9P307 V311P307-P309 WeakPolarHBondContact O-CD 3.46Å; P307-P309 VanDerWaalsContact O-N 3.12Å; P309-V311 PolarHBondContact O-N 3.19Å
310T75.4Confident78.2Confident115 Ų11586.7 Ų86.771%0.70652%0.523SS*.PPolyproline II helixtrans-61.6129.4175.748.70000109.7T312T310-T312 VanDerWaalsContact C-N 3.34Å; T310-T312 PolarHBondContact O-N 3.48Å
311V79.5Confident79.2Confident130 Ų13085.1 Ų85.179%0.78852%0.517SS*.  trans-73.692.5178.4-175.70000107.7P309 V316P309-V311 PolarHBondContact O-N 3.19Å; V311-V316 HydrophobicContact CG1-CG2 3.5Å; V311-V316 VanDerWaalsContact CG1-CG2 3.5Å
312T85.6Confident80.5Confident66 Ų6676.8 Ų76.841%0.40549%0.486SS..  trans-94.7150.4174.160.60000109.4T310 L314 S315 V316T310-T312 VanDerWaalsContact C-N 3.34Å; T310-T312 PolarHBondContact O-N 3.48Å; T312-L314 PolarHBondContact O-N 3.48Å; T312-L314 VanDerWaalsContact O-N 3.14Å; T312-S315 PolarHBondContact N-OG 3.45Å; T312-S315 VanDerWaalsContact N-OG 3.14Å; T312-S315 PolarHBondContact O-N 3.06Å; T312-S315 VanDerWaalsContact O-N 3.07Å; T312-S315 PolarHBondContact O-OG 3.39Å; T312-S315 WeakPolarHBondContact OG1-CB 3.49Å; T312-S315 PolarHBondContact OG1-N 2.96Å; T312-S315 PolarHBondContact OG1-OG 2.98Å; T312-S315 VanDerWaalsContact OG1-OG 3.13Å; T312-V316 WeakPolarHBondContact O-CG2 3.42Å; T312-V316 PolarHBondContact O-N 3.47Å
313A85.7Confident81.6Confident90 Ų9075.2 Ų75.274%0.74447%0.467SS*.Hα-helixtrans-55.8-33.7177.200000112A317A313-A317 VanDerWaalsContact O-CB 3.26Å; A313-A317 WeakPolarHBondContact O-CB 3.36Å; A313-A317 PolarHBondContact O-N 3.47Å
314L85Confident82.6Confident103 Ų10375 Ų7554%0.53946%0.458SS..Hα-helixtrans-69.1-42.2176.5-176.462.6000112.8T312 V316 A317 R318T312-L314 PolarHBondContact O-N 3.48Å; T312-L314 VanDerWaalsContact O-N 3.14Å; L314-V316 VanDerWaalsContact C-N 3.34Å; L314-A317 PolarHBondContact O-N 3.33Å; L314-R318 HydrophobicContact CD1-CG 4.41Å; L314-R318 WeakPolarHBondContact O-CB 3.44Å; L314-R318 WeakPolarHBondContact O-CG 3.28Å; L314-R318 PolarHBondContact O-N 3.48Å
315S81.4Confident83.1Confident53 Ų5374.1 Ų74.137%0.37146%0.456SS..Hα-helixtrans-67.1-37.8177.5630000111.6T312 G319T312-S315 PolarHBondContact N-OG 3.45Å; T312-S315 VanDerWaalsContact N-OG 3.14Å; T312-S315 PolarHBondContact O-N 3.06Å; T312-S315 VanDerWaalsContact O-N 3.07Å; T312-S315 PolarHBondContact O-OG 3.39Å; T312-S315 WeakPolarHBondContact OG1-CB 3.49Å; T312-S315 PolarHBondContact OG1-N 2.96Å; T312-S315 PolarHBondContact OG1-OG 2.98Å; T312-S315 VanDerWaalsContact OG1-OG 3.13Å; S315-G319 PolarHBondContact O-N 3.07Å
316V85Confident83.6Confident82 Ų8271.9 Ų71.950%0.49744%0.441SS..Hα-helixtrans-64.7-45.7172.8176.80000111.3V311 T312 L314 G319 A320V311-V316 HydrophobicContact CG1-CG2 3.5Å; V311-V316 VanDerWaalsContact CG1-CG2 3.5Å; T312-V316 WeakPolarHBondContact O-CG2 3.42Å; T312-V316 PolarHBondContact O-N 3.47Å; L314-V316 VanDerWaalsContact C-N 3.34Å; V316-G319 PolarHBondContact O-N 2.92Å; V316-A320 WeakPolarHBondContact O-CB 3.15Å; V316-A320 PolarHBondContact O-N 2.73Å
317A86.5Confident84.1Confident60 Ų6070.5 Ų70.550%0.49643%0.432SS..Hα-helixtrans-63.4-43.6179.100000112.1A313 L314 A320 G321A313-A317 VanDerWaalsContact O-CB 3.26Å; A313-A317 WeakPolarHBondContact O-CB 3.36Å; A313-A317 PolarHBondContact O-N 3.47Å; L314-A317 PolarHBondContact O-N 3.33Å; A317-A320 PolarHBondContact O-N 3.05Å; A317-G321 PolarHBondContact O-N 3.25Å
318R84.6Confident84.7Confident130 Ų13071.1 Ų71.149%0.49144%0.435SS..Hα-helixtrans-61.6-45.1174.3-75.7-179.4178.91710.2111.4L314 G321 R322L314-R318 HydrophobicContact CD1-CG 4.41Å; L314-R318 WeakPolarHBondContact O-CB 3.44Å; L314-R318 WeakPolarHBondContact O-CG 3.28Å; L314-R318 PolarHBondContact O-N 3.48Å; R318-G321 PolarHBondContact O-N 2.91Å; R318-R322 WeakPolarHBondContact O-CG 3.24Å; R318-R322 PolarHBondContact O-N 2.98Å
319G85.8Confident85.6Confident8 Ų867.6 Ų67.68%0.08242%0.421CS..Hα-helixtrans-64.6-41.8178.500000113.1N109 S315 V316 G321 R322 S323N109-G319 WeakPolarHBondContact OD1-CA 3.48Å; N109-G319 PolarHBondContact OD1-O 3.33Å; S315-G319 PolarHBondContact O-N 3.07Å; V316-G319 PolarHBondContact O-N 2.92Å; G319-G321 VanDerWaalsContact C-N 3.32Å; G319-G321 PolarHBondContact O-N 3.08Å; G319-R322 PolarHBondContact O-N 3.44Å; G319-S323 WeakPolarHBondContact O-CB 3.26Å; G319-S323 PolarHBondContact O-N 3.03Å; G319-S323 PolarHBondContact O-OG 2.85Å; G319-S323 VanDerWaalsContact O-OG 3.07Å
320A87.4Confident86.7Confident59 Ų5962.7 Ų62.749%0.48839%0.389SS..Hα-helixtrans-61.3-40.5173.100000111.9V316 A317 S323 L324V316-A320 WeakPolarHBondContact O-CB 3.15Å; V316-A320 PolarHBondContact O-N 2.73Å; A317-A320 PolarHBondContact O-N 3.05Å; A320-S323 PolarHBondContact O-N 2.74Å; A320-L324 WeakPolarHBondContact O-CB 3.34Å; A320-L324 PolarHBondContact O-N 3Å
321G87.3Confident87.4Confident25 Ų2560 Ų6026%0.25837%0.372SS..Hα-helixtrans-60.8-47.3174.400000112.8A317 R318 G319 L324 V325A317-G321 PolarHBondContact O-N 3.25Å; R318-G321 PolarHBondContact O-N 2.91Å; G319-G321 VanDerWaalsContact C-N 3.32Å; G319-G321 PolarHBondContact O-N 3.08Å; G321-L324 PolarHBondContact O-N 3.5Å; G321-V325 WeakPolarHBondContact O-CG2 3.46Å; G321-V325 PolarHBondContact O-N 2.82Å
322R87.5Confident87.9Confident35 Ų3555.1 Ų55.113%0.13235%0.349CS..Hα-helixtrans-57-51.2174.2-69.9172.3-168.5153.50.5111.1R318 G319 L324 V325 G326 F388 L393 L394R318-R322 WeakPolarHBondContact O-CG 3.24Å; R318-R322 PolarHBondContact O-N 2.98Å; G319-R322 PolarHBondContact O-N 3.44Å; R322-L324 VanDerWaalsContact C-N 3.33Å; R322-L324 PolarHBondContact O-N 2.93Å; R322-V325 PolarHBondContact O-N 3.44Å; R322-G326 PolarHBondContact O-N 2.88Å; R322-F388 HydrophobicContact CB-CE1 3.97Å; R322-F388 HydrophobicContact CB-CE2 4Å; R322-F388 HydrophobicContact CB-CZ 3.64Å; R322-F388 HydrophobicContact CG-CD1 4.33Å; R322-F388 HydrophobicContact CG-CD2 4.37Å; R322-F388 HydrophobicContact CG-CE1 4.21Å; R322-F388 HydrophobicContact CG-CE2 4.23Å; R322-F388 HydrophobicContact CG-CG 4.42Å; R322-F388 HydrophobicContact CG-CZ 4.16Å; R322-F388 WeakPolarHBondContact O-CE1 3.15Å; R322-F388 WeakPolarHBondContact O-CZ 3Å; R322-L393 HydrophobicContact CG-CD2 4.2Å; R322-L393 PolarHBondContact NE-O 3.34Å; R322-L393 PolarHBondContact NH2-O 3.38Å; R322-L394 PolarHBondContact NH2-O 3.17Å; R322-L394 PolarHBondContact NH2-OXT 3.27Å
323S89.2Confident88.3Confident20 Ų2053.1 Ų53.114%0.1434%0.337CS..Hα-helixtrans-60.4-41.7-179.5-62.30000112.3C105 N109 G319 A320 V327C105-S323 VanDerWaalsContact SG-CB 3.53Å; C105-S323 PolarHBondContact SG-OG 3.4Å; N109-S323 PolarHBondContact ND2-OG 2.72Å; G319-S323 WeakPolarHBondContact O-CB 3.26Å; G319-S323 PolarHBondContact O-N 3.03Å; G319-S323 PolarHBondContact O-OG 2.85Å; G319-S323 VanDerWaalsContact O-OG 3.07Å; A320-S323 PolarHBondContact O-N 2.74Å; S323-V327 VanDerWaalsContact O-CB 3.32Å; S323-V327 WeakPolarHBondContact O-CB 3.3Å; S323-V327 WeakPolarHBondContact O-CG2 3.46Å; S323-V327 PolarHBondContact O-N 2.94Å
324L90Very high88.5Confident120 Ų12050 Ų5063%0.62831%0.306SS*.Hα-helixtrans-64.7-50.9178.6-177.264.2000111.7A320 G321 R322 G326 V327 V328A320-L324 WeakPolarHBondContact O-CB 3.34Å; A320-L324 PolarHBondContact O-N 3Å; G321-L324 PolarHBondContact O-N 3.5Å; R322-L324 VanDerWaalsContact C-N 3.33Å; R322-L324 PolarHBondContact O-N 2.93Å; L324-G326 VanDerWaalsContact C-N 3.32Å; L324-G326 PolarHBondContact O-N 3.36Å; L324-V327 PolarHBondContact O-N 2.77Å; L324-V328 VanDerWaalsContact O-CG2 3.31Å; L324-V328 WeakPolarHBondContact O-CG2 3.4Å; L324-V328 PolarHBondContact O-N 3.29Å
325V90Very high88.8Confident54 Ų5450.4 Ų50.433%0.32731%0.305SS..Hα-helixtrans-59.7-45.4179.2171.20000110.6G321 R322 V328 A329 V387 F388G321-V325 WeakPolarHBondContact O-CG2 3.46Å; G321-V325 PolarHBondContact O-N 2.82Å; R322-V325 PolarHBondContact O-N 3.44Å; V325-V328 PolarHBondContact O-N 3.07Å; V325-A329 PolarHBondContact O-N 3.25Å; V325-V387 HydrophobicContact CG1-CG1 4.15Å; V325-F388 HydrophobicContact CB-CE1 4.21Å; V325-F388 HydrophobicContact CG1-CE1 4.17Å
326G90.1Very high89.4Confident0 Ų052.9 Ų52.90%031%0.313CS..Hα-helixtrans-64.7-46178.900000112.7R322 L324 V328 A329 L330R322-G326 PolarHBondContact O-N 2.88Å; L324-G326 VanDerWaalsContact C-N 3.32Å; L324-G326 PolarHBondContact O-N 3.36Å; G326-V328 VanDerWaalsContact C-N 3.32Å; G326-V328 PolarHBondContact O-N 3.34Å; G326-A329 WeakPolarHBondContact O-CB 3.24Å; G326-A329 PolarHBondContact O-N 2.89Å; G326-A329 VanDerWaalsContact O-N 3.13Å; G326-L330 WeakPolarHBondContact O-CG 3.22Å; G326-L330 PolarHBondContact O-N 3.32Å
327V90.3Very high89.9Confident35 Ų3550.4 Ų50.421%0.21230%0.297CS..Hα-helixtrans-60.9-41.4177.4168.30000111.3T101 S323 L324 A329 L330 V331T101-V327 HydrophobicContact CG2-CG1 4.19Å; T101-V327 HydrophobicContact CG2-CG2 3.92Å; S323-V327 VanDerWaalsContact O-CB 3.32Å; S323-V327 WeakPolarHBondContact O-CB 3.3Å; S323-V327 WeakPolarHBondContact O-CG2 3.46Å; S323-V327 PolarHBondContact O-N 2.94Å; L324-V327 PolarHBondContact O-N 2.77Å; V327-A329 VanDerWaalsContact C-N 3.33Å; V327-A329 PolarHBondContact O-N 2.95Å; V327-L330 PolarHBondContact O-N 3.4Å; V327-V331 HydrophobicContact CG1-CG2 4.18Å; V327-V331 WeakPolarHBondContact O-CB 2.93Å; V327-V331 VanDerWaalsContact O-CG2 3.32Å; V327-V331 WeakPolarHBondContact O-CG2 3.45Å; V327-V331 PolarHBondContact O-N 2.81Å
328V90.9Very high90.1Very high96 Ų9649.4 Ų49.458%0.58228%0.281SS*.Hα-helixtrans-60.4-44175171.40000110.9L324 V325 G326 G332L324-V328 VanDerWaalsContact O-CG2 3.31Å; L324-V328 WeakPolarHBondContact O-CG2 3.4Å; L324-V328 PolarHBondContact O-N 3.29Å; V325-V328 PolarHBondContact O-N 3.07Å; G326-V328 VanDerWaalsContact C-N 3.32Å; G326-V328 PolarHBondContact O-N 3.34Å; V328-G332 PolarHBondContact O-N 3.02Å
329A91.3Very high90.4Very high34 Ų3450 Ų5028%0.28129%0.287SS..Hα-helixtrans-62.7-42.5176.700000112.5V325 G326 V327 T333 V384V325-A329 PolarHBondContact O-N 3.25Å; G326-A329 WeakPolarHBondContact O-CB 3.24Å; G326-A329 PolarHBondContact O-N 2.89Å; G326-A329 VanDerWaalsContact O-N 3.13Å; V327-A329 VanDerWaalsContact C-N 3.33Å; V327-A329 PolarHBondContact O-N 2.95Å; A329-T333 WeakPolarHBondContact O-CB 3.38Å; A329-T333 PolarHBondContact O-N 3.24Å; A329-T333 PolarHBondContact O-OG1 3.22Å; A329-V384 HydrophobicContact CB-CG2 4.01Å
330L91.7Very high90.7Very high2 Ų254.8 Ų54.81%0.0131%0.31CS..Hα-helixtrans-67.9-45.5178.9-64.1-177.6000112.3P104 W108 G326 V327 T333 R334 V376 V379 N380P104-L330 HydrophobicContact CB-CD1 3.87Å; P104-L330 HydrophobicContact CG-CD1 3.53Å; W108-L330 HydrophobicContact CH2-CD1 3.66Å; W108-L330 HydrophobicContact CH2-CG 4.15Å; W108-L330 HydrophobicContact CZ2-CD1 4Å; W108-L330 HydrophobicContact CZ2-CG 4.36Å; G326-L330 WeakPolarHBondContact O-CG 3.22Å; G326-L330 PolarHBondContact O-N 3.32Å; V327-L330 PolarHBondContact O-N 3.4Å; L330-T333 PolarHBondContact O-N 3.46Å; L330-R334 WeakPolarHBondContact O-CB 3.38Å; L330-R334 PolarHBondContact O-N 3.38Å; L330-V376 HydrophobicContact CB-CG1 4.4Å; L330-V376 HydrophobicContact CD2-CG1 4.02Å; L330-V376 WeakPolarHBondContact CD2-O 3.4Å; L330-V379 HydrophobicContact CD2-CB 4.34Å; L330-V379 HydrophobicContact CD2-CG1 3.94Å; L330-N380 HydrophobicContact CD1-CB 4.47Å; L330-N380 HydrophobicContact CD2-CB 3.75Å
331V90.4Very high90.8Very high57 Ų5752.7 Ų52.735%0.34529%0.292SS..Hα-helixtrans-65.3-42.5177.51740000110.5V327 R334 Q335V327-V331 HydrophobicContact CG1-CG2 4.18Å; V327-V331 WeakPolarHBondContact O-CB 2.93Å; V327-V331 VanDerWaalsContact O-CG2 3.32Å; V327-V331 WeakPolarHBondContact O-CG2 3.45Å; V327-V331 PolarHBondContact O-N 2.81Å; V331-R334 WeakPolarHBondContact O-CB 3.41Å; V331-R334 PolarHBondContact O-N 3.46Å; V331-Q335 WeakPolarHBondContact O-CG 3.33Å; V331-Q335 PolarHBondContact O-N 3.45Å
332G91.3Very high90.9Very high29 Ų2952.5 Ų52.530%0.29929%0.285SS..Hα-helixtrans-59.2-48.6174.700000112.2V328 R334 Q335 I336V328-G332 PolarHBondContact O-N 3.02Å; G332-R334 VanDerWaalsContact C-N 3.34Å; G332-R334 PolarHBondContact O-N 2.96Å; G332-Q335 PolarHBondContact O-N 3.46Å; G332-I336 VanDerWaalsContact O-CG1 3.32Å; G332-I336 WeakPolarHBondContact O-CG1 3.18Å; G332-I336 PolarHBondContact O-N 3.09Å
333T92.6Very high90.8Very high24 Ų2453.2 Ų53.215%0.14729%0.292CS..Hα-helixtrans-58.1-46.7176.3-58.30000111.1A329 L330 Q335 I336 V337 A375 V376 V379A329-T333 WeakPolarHBondContact O-CB 3.38Å; A329-T333 PolarHBondContact O-N 3.24Å; A329-T333 PolarHBondContact O-OG1 3.22Å; L330-T333 PolarHBondContact O-N 3.46Å; T333-Q335 VanDerWaalsContact C-N 3.34Å; T333-Q335 PolarHBondContact O-N 2.8Å; T333-I336 PolarHBondContact O-N 3.31Å; T333-V337 HydrophobicContact CG2-CG2 3.98Å; T333-V337 WeakPolarHBondContact O-CB 3.48Å; T333-V337 VanDerWaalsContact O-CG2 3.3Å; T333-V337 WeakPolarHBondContact O-CG2 3.31Å; T333-V337 PolarHBondContact O-N 2.88Å; T333-A375 HydrophobicContact CG2-CB 4.18Å; T333-V376 HydrophobicContact CG2-CG2 4.4Å; T333-V379 HydrophobicContact CG2-CB 4.43Å; T333-V379 HydrophobicContact CG2-CG2 3.84Å
334R91.1Very high90.9Very high25 Ų2555.1 Ų55.19%0.09431%0.308CS..Hα-helixtrans-56-47.8176.9-177.6-174.3-179.6-161.15.3111.4N63 E96 L330 V331 G332 R338 T372 Y373 V376N63-R334 VanDerWaalsContact CB-NH2 3.32Å; N63-R334 PolarHBondContact ND2-NH2 3.49Å; E96-R334 IonicContact OE1-CZ 3Å; E96-R334 IonicContact OE1-NE 3.46Å; E96-R334 IonicContact OE1-NH2 3.5Å; E96-R334 PolarHBondContact OE1-NH2 3.28Å; E96-R334 IonicContact OE2-NH2 2.9Å; L330-R334 WeakPolarHBondContact O-CB 3.38Å; L330-R334 PolarHBondContact O-N 3.38Å; V331-R334 WeakPolarHBondContact O-CB 3.41Å; V331-R334 PolarHBondContact O-N 3.46Å; G332-R334 VanDerWaalsContact C-N 3.34Å; G332-R334 PolarHBondContact O-N 2.96Å; R334-R338 WeakPolarHBondContact O-CB 3.41Å; R334-R338 PolarHBondContact O-N 3.01Å; R334-T372 HydrophobicContact CG-CG2 4.16Å; R334-Y373 PolarHBondContact NE-OH 2.92Å; R334-Y373 PolarHBondContact NH2-OH 2.88Å; R334-V376 HydrophobicContact CB-CG2 3.94Å
335Q91.5Very high90.8Very high110 Ų11050.7 Ų50.751%0.51429%0.285SS..Hα-helixtrans-66.2-44.1-178-66.1-64.6-300112.3V331 G332 T333 K339V331-Q335 WeakPolarHBondContact O-CG 3.33Å; V331-Q335 PolarHBondContact O-N 3.45Å; G332-Q335 PolarHBondContact O-N 3.46Å; T333-Q335 VanDerWaalsContact C-N 3.34Å; T333-Q335 PolarHBondContact O-N 2.8Å; Q335-K339 WeakPolarHBondContact O-CB 3.31Å; Q335-K339 PolarHBondContact O-N 2.77Å
336I94.1Very high90.6Very high106 Ų10649 Ų4954%0.54427%0.273SS..Hα-helixtrans-66.3-54.5-178.9-65.3166.2000110.2G332 T333 R338 K339 L340G332-I336 VanDerWaalsContact O-CG1 3.32Å; G332-I336 WeakPolarHBondContact O-CG1 3.18Å; G332-I336 PolarHBondContact O-N 3.09Å; T333-I336 PolarHBondContact O-N 3.31Å; I336-R338 PolarHBondContact O-N 3.18Å; I336-K339 PolarHBondContact O-N 3.26Å; I336-L340 HydrophobicContact CG2-CD1 3.77Å; I336-L340 HydrophobicContact CG2-CG 4.4Å; I336-L340 WeakPolarHBondContact O-CG 3.24Å; I336-L340 PolarHBondContact O-N 3.2Å
337V93.7Very high90.5Very high29 Ų2953.2 Ų53.218%0.17630%0.302CS..Hα-helixtrans-69.1-35.2-174.6-176.40000111.5T333 K339 L340 S341 V371 T372 A375T333-V337 HydrophobicContact CG2-CG2 3.98Å; T333-V337 WeakPolarHBondContact O-CB 3.48Å; T333-V337 VanDerWaalsContact O-CG2 3.3Å; T333-V337 WeakPolarHBondContact O-CG2 3.31Å; T333-V337 PolarHBondContact O-N 2.88Å; V337-K339 PolarHBondContact O-N 3.49Å; V337-L340 PolarHBondContact O-N 3.38Å; V337-S341 VanDerWaalsContact O-CB 3.24Å; V337-S341 WeakPolarHBondContact O-CB 3.49Å; V337-S341 PolarHBondContact O-N 3.12Å; V337-S341 PolarHBondContact O-OG 3.19Å; V337-V371 HydrophobicContact CG1-CG1 4.12Å; V337-T372 HydrophobicContact CB-CG2 4.48Å; V337-A375 HydrophobicContact CB-CB 4.38Å; V337-A375 HydrophobicContact CG1-CB 4.06Å; V337-A375 HydrophobicContact CG2-CB 3.9Å
338R90.8Very high90.4Very high39 Ų3961.1 Ų61.115%0.14733%0.328CS..Hα-helixtrans-61.3-44.9173.4179.7174.4157-174.9-13.5111.7S62 N63 R334 I336 S341 L342 T372S62-R338 PolarHBondContact O-NH1 3.4Å; S62-R338 PolarHBondContact O-NH2 2.81Å; N63-R338 PolarHBondContact OD1-NH1 2.79Å; R334-R338 WeakPolarHBondContact O-CB 3.41Å; R334-R338 PolarHBondContact O-N 3.01Å; I336-R338 PolarHBondContact O-N 3.18Å; R338-S341 PolarHBondContact O-OG 3.13Å; R338-S341 VanDerWaalsContact O-OG 3.09Å; R338-L342 HydrophobicContact CG-CD1 4.05Å; R338-L342 WeakPolarHBondContact O-CB 3.46Å; R338-L342 VanDerWaalsContact O-CG 3.29Å; R338-L342 WeakPolarHBondContact O-CG 3.3Å; R338-L342 PolarHBondContact O-N 2.85Å; R338-L342 VanDerWaalsContact O-N 3.12Å; R338-T372 WeakPolarHBondContact CA-OG1 3.47Å; R338-T372 HydrophobicContact CB-CG2 3.9Å; R338-T372 PolarHBondContact N-OG1 2.87Å
339K90.9Very high90.3Very high143 Ų14361.7 Ų61.762%0.62232%0.321SS*.Hα-helixtrans-64.3-50.2179-174.6-177.3177.1-173.50110.8Q335 I336 V337 S341 L342 D343Q335-K339 WeakPolarHBondContact O-CB 3.31Å; Q335-K339 PolarHBondContact O-N 2.77Å; I336-K339 PolarHBondContact O-N 3.26Å; V337-K339 PolarHBondContact O-N 3.49Å; K339-S341 PolarHBondContact O-N 3.41Å; K339-L342 PolarHBondContact O-N 2.97Å; K339-D343 WeakPolarHBondContact O-CB 3.41Å; K339-D343 PolarHBondContact O-N 3.15Å
340L92.9Very high89.8Confident109 Ų10967.2 Ų67.257%0.57135%0.345SS*.Hα-helixtrans-62.2-43.4-179.4-67.4175.6000112.3I336 V337 D343 A344I336-L340 HydrophobicContact CG2-CD1 3.77Å; I336-L340 HydrophobicContact CG2-CG 4.4Å; I336-L340 WeakPolarHBondContact O-CG 3.24Å; I336-L340 PolarHBondContact O-N 3.2Å; V337-L340 PolarHBondContact O-N 3.38Å; L340-D343 PolarHBondContact O-N 2.72Å; L340-A344 WeakPolarHBondContact O-CB 3.44Å; L340-A344 PolarHBondContact O-N 3.27Å
341S90.2Very high89.4Confident15 Ų1568 Ų6811%0.10535%0.35CS..Hα-helixtrans-65.3-41.7179610000112.3V337 R338 K339 L345 S368 T372V337-S341 VanDerWaalsContact O-CB 3.24Å; V337-S341 WeakPolarHBondContact O-CB 3.49Å; V337-S341 PolarHBondContact O-N 3.12Å; V337-S341 PolarHBondContact O-OG 3.19Å; R338-S341 PolarHBondContact O-OG 3.13Å; R338-S341 VanDerWaalsContact O-OG 3.09Å; K339-S341 PolarHBondContact O-N 3.41Å; S341-L345 WeakPolarHBondContact O-CB 3.27Å; S341-L345 WeakPolarHBondContact O-CD1 3.31Å; S341-L345 VanDerWaalsContact O-CG 3.31Å; S341-L345 WeakPolarHBondContact O-CG 3.37Å; S341-L345 PolarHBondContact O-N 3.49Å; S341-S368 PolarHBondContact OG-OG 2.87Å; S341-S368 VanDerWaalsContact OG-OG 3.05Å; S341-T372 PolarHBondContact OG-OG1 3.15Å
342L87.6Confident88.9Confident21 Ų2169.2 Ų69.211%0.1136%0.359CS..Hα-helixtrans-66.2-43.8175.7-73173.1000111.9R338 K339 A344 L345 Y346 R359 I364 S368R338-L342 HydrophobicContact CG-CD1 4.05Å; R338-L342 WeakPolarHBondContact O-CB 3.46Å; R338-L342 VanDerWaalsContact O-CG 3.29Å; R338-L342 WeakPolarHBondContact O-CG 3.3Å; R338-L342 PolarHBondContact O-N 2.85Å; R338-L342 VanDerWaalsContact O-N 3.12Å; K339-L342 PolarHBondContact O-N 2.97Å; L342-A344 VanDerWaalsContact C-N 3.33Å; L342-A344 PolarHBondContact O-N 2.77Å; L342-L345 PolarHBondContact O-N 3.02Å; L342-Y346 WeakPolarHBondContact O-CB 3.45Å; L342-Y346 WeakPolarHBondContact O-CD2 3.23Å; L342-Y346 PolarHBondContact O-N 2.9Å; L342-R359 HydrophobicContact CD2-CG 4.48Å; L342-I364 HydrophobicContact CD2-CG2 4.25Å; L342-S368 WeakPolarHBondContact CD2-OG 3.35Å; L342-S368 WeakPolarHBondContact CG-OG 3.49Å
343D87.2Confident88Confident50 Ų5074.3 Ų74.327%0.26737%0.373SS..Hα-helixtrans-61.7-42.4177.9-78.2-28.3000111.3K339 L340 S347 K353K339-D343 WeakPolarHBondContact O-CB 3.41Å; K339-D343 PolarHBondContact O-N 3.15Å; L340-D343 PolarHBondContact O-N 2.72Å; D343-S347 WeakPolarHBondContact O-CB 3.47Å; D343-S347 PolarHBondContact O-N 2.84Å; D343-K353 WeakPolarHBondContact OD1-CE 3.22Å; D343-K353 IonicContact OD1-NZ 2.71Å; D343-K353 PolarHBondContact OD1-NZ 3.19Å; D343-K353 IonicContact OD2-NZ 3.88Å
344A89.5Confident86.9Confident59 Ų5979.4 Ų79.449%0.48840%0.404SS..Hα-helixtrans-63.8-45.317600000112.3L340 L342 S347 W348L340-A344 WeakPolarHBondContact O-CB 3.44Å; L340-A344 PolarHBondContact O-N 3.27Å; L342-A344 VanDerWaalsContact C-N 3.33Å; L342-A344 PolarHBondContact O-N 2.77Å; A344-S347 PolarHBondContact O-N 2.89Å; A344-W348 WeakPolarHBondContact O-CB 3.11Å; A344-W348 PolarHBondContact O-N 2.85Å
345L88.3Confident86.1Confident27 Ų2780.5 Ų80.514%0.14141%0.412CS..Hα-helixtrans-68.5-38.7179.8-73.3164.7000112.4S341 L342 S347 W348 Y349 I364 P367S341-L345 WeakPolarHBondContact O-CB 3.27Å; S341-L345 WeakPolarHBondContact O-CD1 3.31Å; S341-L345 VanDerWaalsContact O-CG 3.31Å; S341-L345 WeakPolarHBondContact O-CG 3.37Å; S341-L345 PolarHBondContact O-N 3.49Å; L342-L345 PolarHBondContact O-N 3.02Å; L345-S347 VanDerWaalsContact C-N 3.32Å; L345-S347 PolarHBondContact O-N 3.36Å; L345-W348 PolarHBondContact O-N 3.27Å; L345-Y349 HydrophobicContact CD2-CD2 4.48Å; L345-Y349 HydrophobicContact CD2-CE2 4.07Å; L345-Y349 WeakPolarHBondContact O-CD2 3.5Å; L345-Y349 PolarHBondContact O-N 2.98Å; L345-I364 HydrophobicContact CB-CG2 4.34Å; L345-I364 HydrophobicContact CD1-CG2 4.41Å; L345-P367 HydrophobicContact CD1-CB 4.39Å; L345-P367 HydrophobicContact CD1-CG 4.05Å; L345-P367 HydrophobicContact CD2-CG 4.21Å
346Y87.3Confident85Confident20 Ų2081.8 Ų81.88%0.07842%0.416CS..Hα-helixtrans-65.2-37.3174.1-72.2-28.3000112.4L342 N350 V351 K353 A358 R359 I364L342-Y346 WeakPolarHBondContact O-CB 3.45Å; L342-Y346 WeakPolarHBondContact O-CD2 3.23Å; L342-Y346 PolarHBondContact O-N 2.9Å; Y346-N350 WeakPolarHBondContact O-CA 3.2Å; Y346-N350 PolarHBondContact O-N 3.28Å; Y346-N350 VanDerWaalsContact O-N 3.08Å; Y346-V351 HydrophobicContact CD1-CB 4.17Å; Y346-V351 HydrophobicContact CD1-CG1 4.33Å; Y346-V351 PolarHBondContact O-N 2.93Å; Y346-K353 HydrophobicContact CD2-CB 4.37Å; Y346-K353 HydrophobicContact CD2-CG 3.99Å; Y346-A358 HydrophobicContact CE1-CB 4.26Å; Y346-R359 WeakPolarHBondContact OH-CB 3.45Å; Y346-I364 HydrophobicContact CD1-CD1 4.21Å; Y346-I364 HydrophobicContact CE1-CD1 4.16Å; Y346-I364 HydrophobicContact CE1-CG2 4.16Å
347S86.5Confident84.1Confident87 Ų8781.7 Ų81.761%0.60842%0.417SS*.Hα-helixtrans-65.5-41.8172.1-168.50000111.8D343 A344 L345 N350D343-S347 WeakPolarHBondContact O-CB 3.47Å; D343-S347 PolarHBondContact O-N 2.84Å; A344-S347 PolarHBondContact O-N 2.89Å; L345-S347 VanDerWaalsContact C-N 3.32Å; L345-S347 PolarHBondContact O-N 3.36Å; S347-N350 PolarHBondContact O-N 3.04Å; S347-N350 PolarHBondContact O-OD1 3.45Å
348W89.6Confident83.3Confident202 Ų20280.3 Ų80.377%0.76541%0.408SS*.Hα-helixtrans-66.5-42-178.8-174.4-90.3000112.7A344 L345A344-W348 WeakPolarHBondContact O-CB 3.11Å; A344-W348 PolarHBondContact O-N 2.85Å; L345-W348 PolarHBondContact O-N 3.27Å
349Y86.9Confident82.6Confident108 Ų10881.1 Ų81.142%0.42441%0.411SS..THydrogen-bonded Turntrans-89.94.5179.8-73.1-76.2000113.9L345 V351 E363 I364L345-Y349 HydrophobicContact CD2-CD2 4.48Å; L345-Y349 HydrophobicContact CD2-CE2 4.07Å; L345-Y349 WeakPolarHBondContact O-CD2 3.5Å; L345-Y349 PolarHBondContact O-N 2.98Å; Y349-V351 WeakPolarHBondContact O-CG2 3.37Å; Y349-V351 PolarHBondContact O-N 3.43Å; Y349-E363 HydrophobicContact CE1-CB 4.48Å; Y349-E363 HydrophobicContact CE2-CB 4.4Å; Y349-I364 HydrophobicContact CD2-CD1 4.4Å; Y349-I364 HydrophobicContact CD2-CG1 4.04Å; Y349-I364 HydrophobicContact CE2-CG1 4.37Å
350N82.6Confident82.1Confident149 Ų14978 Ų7880%0.79740%0.395SS*.THydrogen-bonded Turntrans49.642.5-176.8-71.9-47.6000113.6Y346 S347Y346-N350 WeakPolarHBondContact O-CA 3.2Å; Y346-N350 PolarHBondContact O-N 3.28Å; Y346-N350 VanDerWaalsContact O-N 3.08Å; S347-N350 PolarHBondContact O-N 3.04Å; S347-N350 PolarHBondContact O-OD1 3.45Å
351V82.9Confident81.6Confident19 Ų1979 Ų7912%0.11539%0.392CS..  trans-100.7134.2-178.5178.50000110.4Y346 Y349 K353 D355 A358Y346-V351 HydrophobicContact CD1-CB 4.17Å; Y346-V351 HydrophobicContact CD1-CG1 4.33Å; Y346-V351 PolarHBondContact O-N 2.93Å; Y349-V351 WeakPolarHBondContact O-CG2 3.37Å; Y349-V351 PolarHBondContact O-N 3.43Å; V351-K353 PolarHBondContact O-N 2.83Å; V351-D355 HydrophobicContact CG1-CB 4.33Å; V351-A358 HydrophobicContact CB-CB 4.46Å; V351-A358 HydrophobicContact CG1-CB 3.33Å
352P78.9Confident81.3Confident82 Ų8280 Ų8053%0.53239%0.394SS..  trans-63.9132.9173.325.3-32000111.6T354 D355P352-T354 PolarHBondContact O-N 3.09Å; P352-D355 HydrophobicContact CG-CB 4.44Å; P352-D355 PolarHBondContact O-N 2.95Å
353K72.3Confident81.2Confident137 Ų13783.4 Ų83.460%0.59641%0.41SS*.THydrogen-bonded Turntrans-59.7-14.2-178.3-57.8-169-177.8-1670114.4D343 Y346 V351D343-K353 WeakPolarHBondContact OD1-CE 3.22Å; D343-K353 IonicContact OD1-NZ 2.71Å; D343-K353 PolarHBondContact OD1-NZ 3.19Å; D343-K353 IonicContact OD2-NZ 3.88Å; Y346-K353 HydrophobicContact CD2-CB 4.37Å; Y346-K353 HydrophobicContact CD2-CG 3.99Å; V351-K353 PolarHBondContact O-N 2.83Å
354T69.8Low81.2Confident130 Ų13081.1 Ų81.180%0.79840%0.398SS*.THydrogen-bonded Turntrans-82.8-15.3178.440.20000113.7P352 K356P352-T354 PolarHBondContact O-N 3.09Å; T354-K356 PolarHBondContact O-N 3.41Å
355D73.8Confident81.1Confident48 Ų4878.5 Ų78.526%0.25738%0.375SS..  trans-79.4100.6179.5-173.88000111.8V351 P352 N357 A358V351-D355 HydrophobicContact CG1-CB 4.33Å; P352-D355 HydrophobicContact CG-CB 4.44Å; P352-D355 PolarHBondContact O-N 2.95Å; D355-N357 PolarHBondContact O-N 3.17Å; D355-N357 WeakPolarHBondContact OD1-CB 3.5Å; D355-N357 PolarHBondContact OD1-N 3.22Å; D355-A358 HydrophobicContact CB-CB 4.14Å; D355-A358 PolarHBondContact O-N 2.61Å
356K70Confident81.2Confident138 Ų13877.2 Ų77.260%0.637%0.368SS*.THydrogen-bonded Turntrans-63.7-26.6175.9-67.7-177.3177.6179.60112.8T354 R359T354-K356 PolarHBondContact O-N 3.41Å; K356-R359 PolarHBondContact O-N 3.43Å
357N75.4Confident81.4Confident103 Ų10377.3 Ų77.355%0.55137%0.372SS*.THydrogen-bonded Turntrans-75.4-31.5-179.2-67.5-31.8000111.6D355 R359 R360D355-N357 PolarHBondContact O-N 3.17Å; D355-N357 WeakPolarHBondContact OD1-CB 3.5Å; D355-N357 PolarHBondContact OD1-N 3.22Å; N357-R359 PolarHBondContact O-N 2.96Å; N357-R360 WeakPolarHBondContact O-CB 3.2Å; N357-R360 PolarHBondContact O-N 3.35Å
358A75.4Confident81.6Confident0 Ų073.5 Ų73.50%035%0.345CS..G310 helixtrans-59.6-33.2174.300000112.9Y346 V351 D355 R360 R361 I364Y346-A358 HydrophobicContact CE1-CB 4.26Å; V351-A358 HydrophobicContact CB-CB 4.46Å; V351-A358 HydrophobicContact CG1-CB 3.33Å; D355-A358 HydrophobicContact CB-CB 4.14Å; D355-A358 PolarHBondContact O-N 2.61Å; A358-R360 PolarHBondContact O-N 3.47Å; A358-R361 VanDerWaalsContact O-CB 3.3Å; A358-R361 WeakPolarHBondContact O-CB 3.33Å; A358-R361 WeakPolarHBondContact O-CG 3.34Å; A358-R361 PolarHBondContact O-N 3.5Å; A358-R361 VanDerWaalsContact O-N 3.15Å; A358-I364 HydrophobicContact CB-CD1 4.35Å; A358-I364 WeakPolarHBondContact O-CD1 3.19Å
359R76.4Confident81.8Confident56 Ų5664.5 Ų64.521%0.21131%0.311CS..G310 helixtrans-67.8-17.5177.3-159.4169.5174.6-144.8-20.4114.1N65 L342 Y346 K356 N357N65-R359 PolarHBondContact ND2-O 2.73Å; N65-R359 WeakPolarHBondContact OD1-CD 3.22Å; N65-R359 PolarHBondContact OD1-NE 2.87Å; N65-R359 PolarHBondContact OD1-NH1 2.86Å; L342-R359 HydrophobicContact CD2-CG 4.48Å; Y346-R359 WeakPolarHBondContact OH-CB 3.45Å; K356-R359 PolarHBondContact O-N 3.43Å; N357-R359 PolarHBondContact O-N 2.96Å
360R79.8Confident82.1Confident77 Ų7759.9 Ų59.929%0.29129%0.293SS..G310 helixtrans-91.1-9.7176.7-61.6179.1177.7171.5-2.2112.7N65 Y267 R271 N357 A358N65-R360 HydrophobicContact CB-CG 4.18Å; N65-R360 PolarHBondContact O-NE 3.34Å; N65-R360 PolarHBondContact O-NH2 2.88Å; Y267-R360 HydrophobicContact CD2-CB 3.92Å; Y267-R360 HydrophobicContact CD2-CG 4.07Å; Y267-R360 HydrophobicContact CE1-CG 4.45Å; Y267-R360 HydrophobicContact CE2-CB 3.92Å; Y267-R360 HydrophobicContact CE2-CG 3.91Å; Y267-R360 HydrophobicContact CG-CG 4.44Å; R271-R360 PolarHBondContact NH2-O 3.28Å; N357-R360 WeakPolarHBondContact O-CB 3.2Å; N357-R360 PolarHBondContact O-N 3.35Å; A358-R360 PolarHBondContact O-N 3.47Å
361R83.4Confident82.7Confident130 Ų13056.5 Ų56.549%0.49128%0.277SS..SBendtrans-65.2136.9176.1-64.2-176.8-169.6-1626.7109.6A358 E363 I364 E365A358-R361 VanDerWaalsContact O-CB 3.3Å; A358-R361 WeakPolarHBondContact O-CB 3.33Å; A358-R361 WeakPolarHBondContact O-CG 3.34Å; A358-R361 PolarHBondContact O-N 3.5Å; A358-R361 VanDerWaalsContact O-N 3.15Å; R361-E363 WeakPolarHBondContact CB-OE2 3.33Å; R361-E363 PolarHBondContact O-N 3.37Å; R361-I364 PolarHBondContact O-N 2.99Å; R361-I364 VanDerWaalsContact O-N 3.1Å; R361-E365 WeakPolarHBondContact O-CB 3.47Å; R361-E365 PolarHBondContact O-N 3.21Å
362K83.8Confident83.3Confident36 Ų3655.7 Ų55.716%0.15727%0.273CS..Hα-helixtrans-58.8-39-175.1-178.3172.3170.8170.30111.3Y259 E263 I364 V366Y259-K362 WeakPolarHBondContact O-CE 3.43Å; Y259-K362 PolarHBondContact O-NZ 3.48Å; E263-K362 WeakPolarHBondContact OE1-CD 3.27Å; E263-K362 WeakPolarHBondContact OE1-CE 3.5Å; E263-K362 IonicContact OE1-NZ 3.88Å; E263-K362 PolarHBondContact OE1-NZ 2.99Å; K362-I364 PolarHBondContact O-N 3.38Å; K362-V366 HydrophobicContact CG-CG2 4.05Å; K362-V366 WeakPolarHBondContact O-CB 3.46Å; K362-V366 WeakPolarHBondContact O-CG2 3.48Å; K362-V366 PolarHBondContact O-N 3.49Å; K362-V366 VanDerWaalsContact O-N 3.16Å
363E85.1Confident84Confident94 Ų9452 Ų5244%0.43925%0.248SC..Hα-helixtrans-66.7-17.5-178.7-54.377.6-168.800113.3Y349 R361 P367Y349-E363 HydrophobicContact CE1-CB 4.48Å; Y349-E363 HydrophobicContact CE2-CB 4.4Å; R361-E363 WeakPolarHBondContact CB-OE2 3.33Å; R361-E363 PolarHBondContact O-N 3.37Å; E363-P367 WeakPolarHBondContact O-CD 3.31Å; E363-P367 WeakPolarHBondContact O-CG 3.23Å
364I86.5Confident85.1Confident2 Ų246.2 Ų46.21%0.0122%0.224CC..Hα-helixtrans-109.6-45.2179-61.6177000110.2L342 L345 Y346 Y349 A358 R361 K362 S368L342-I364 HydrophobicContact CD2-CG2 4.25Å; L345-I364 HydrophobicContact CB-CG2 4.34Å; L345-I364 HydrophobicContact CD1-CG2 4.41Å; Y346-I364 HydrophobicContact CD1-CD1 4.21Å; Y346-I364 HydrophobicContact CE1-CD1 4.16Å; Y346-I364 HydrophobicContact CE1-CG2 4.16Å; Y349-I364 HydrophobicContact CD2-CD1 4.4Å; Y349-I364 HydrophobicContact CD2-CG1 4.04Å; Y349-I364 HydrophobicContact CE2-CG1 4.37Å; A358-I364 HydrophobicContact CB-CD1 4.35Å; A358-I364 WeakPolarHBondContact O-CD1 3.19Å; R361-I364 PolarHBondContact O-N 2.99Å; R361-I364 VanDerWaalsContact O-N 3.1Å; K362-I364 PolarHBondContact O-N 3.38Å; I364-S368 WeakPolarHBondContact O-CB 3.38Å; I364-S368 PolarHBondContact O-N 2.88Å
365E87.8Confident86.3Confident4 Ų441.1 Ų41.12%0.01920%0.196CC..Hα-helixtrans-64.5-48.1-176.1-173.2173.3-15700112.3N65 Y267 R271 R361 K369N65-E365 PolarHBondContact ND2-OE1 2.89Å; Y267-E365 PolarHBondContact OH-OE1 3.31Å; R271-E365 IonicContact CZ-OE2 2.76Å; R271-E365 IonicContact NE-OE2 3.93Å; R271-E365 PolarHBondContact NE-OE2 2.99Å; R271-E365 IonicContact NH2-OE2 3.57Å; R271-E365 PolarHBondContact NH2-OE2 3.39Å; R361-E365 WeakPolarHBondContact O-CB 3.47Å; R361-E365 PolarHBondContact O-N 3.21Å; E365-K369 HydrophobicContact CG-CD 4.01Å; E365-K369 WeakPolarHBondContact O-CB 3.22Å; E365-K369 WeakPolarHBondContact O-CG 3.39Å; E365-K369 PolarHBondContact O-N 3.32Å; E365-K369 VanDerWaalsContact O-N 3.08Å; E365-K369 IonicContact OE1-NZ 3.67Å; E365-K369 PolarHBondContact OE1-NZ 3.13Å
366V90.3Very high87.3Confident0 Ų039.1 Ų39.10%019%0.185CC..Hα-helixtrans-65-57.6-175.61760000111.3Y259 R271 T275 K362 S368 K369 F370Y259-V366 HydrophobicContact CD1-CG1 4.37Å; Y259-V366 HydrophobicContact CD2-CG1 4.23Å; Y259-V366 HydrophobicContact CE1-CB 4.4Å; Y259-V366 HydrophobicContact CE1-CG1 4.25Å; Y259-V366 HydrophobicContact CE2-CG1 4.12Å; Y259-V366 HydrophobicContact CG-CG1 4.36Å; R271-V366 HydrophobicContact CG-CG2 4.5Å; T275-V366 HydrophobicContact CG2-CG1 3.97Å; T275-V366 WeakPolarHBondContact CG2-O 3.37Å; K362-V366 HydrophobicContact CG-CG2 4.05Å; K362-V366 WeakPolarHBondContact O-CB 3.46Å; K362-V366 WeakPolarHBondContact O-CG2 3.48Å; K362-V366 PolarHBondContact O-N 3.49Å; K362-V366 VanDerWaalsContact O-N 3.16Å; V366-S368 PolarHBondContact O-N 2.86Å; V366-K369 PolarHBondContact O-N 2.96Å; V366-F370 VanDerWaalsContact O-CB 3.28Å; V366-F370 WeakPolarHBondContact O-CB 3.35Å; V366-F370 PolarHBondContact O-N 2.97Å
367P92.3Very high88.4Confident22 Ų2232.6 Ų32.614%0.14316%0.157CC..Hα-helixtrans-65.4-37.2-177.822.8-31.2000112.9L345 E363 F370 V371L345-P367 HydrophobicContact CD1-CB 4.39Å; L345-P367 HydrophobicContact CD1-CG 4.05Å; L345-P367 HydrophobicContact CD2-CG 4.21Å; E363-P367 WeakPolarHBondContact O-CD 3.31Å; E363-P367 WeakPolarHBondContact O-CG 3.23Å; P367-F370 PolarHBondContact O-N 3.5Å; P367-V371 WeakPolarHBondContact O-CB 3.4Å; P367-V371 VanDerWaalsContact O-CG2 3.29Å; P367-V371 WeakPolarHBondContact O-CG2 3.3Å; P367-V371 PolarHBondContact O-N 3.11Å
368S91.7Very high89.2Confident6 Ų630.3 Ų30.34%0.04214%0.144CC..Hα-helixtrans-61.3-48176.9177.30000111.7S341 L342 I364 V366 T372S341-S368 PolarHBondContact OG-OG 2.87Å; S341-S368 VanDerWaalsContact OG-OG 3.05Å; L342-S368 WeakPolarHBondContact CD2-OG 3.35Å; L342-S368 WeakPolarHBondContact CG-OG 3.49Å; I364-S368 WeakPolarHBondContact O-CB 3.38Å; I364-S368 PolarHBondContact O-N 2.88Å; V366-S368 PolarHBondContact O-N 2.86Å; S368-T372 WeakPolarHBondContact O-CB 3.16Å; S368-T372 PolarHBondContact O-N 2.91Å; S368-T372 VanDerWaalsContact O-N 3.15Å; S368-T372 PolarHBondContact O-OG1 3.01Å
369K91.8Very high90Very high13 Ų1331.2 Ų31.26%0.05715%0.15CC..Hα-helixtrans-66.1-49177.9-73.5-175.5173.4176.20110.7G272 T275 E365 V366 V371 T372 Y373G272-K369 VanDerWaalsContact CA-NZ 3.31Å; G272-K369 WeakPolarHBondContact O-CD 3.41Å; T275-K369 HydrophobicContact CG2-CB 3.99Å; E365-K369 HydrophobicContact CG-CD 4.01Å; E365-K369 WeakPolarHBondContact O-CB 3.22Å; E365-K369 WeakPolarHBondContact O-CG 3.39Å; E365-K369 PolarHBondContact O-N 3.32Å; E365-K369 VanDerWaalsContact O-N 3.08Å; E365-K369 IonicContact OE1-NZ 3.67Å; E365-K369 PolarHBondContact OE1-NZ 3.13Å; V366-K369 PolarHBondContact O-N 2.96Å; K369-V371 PolarHBondContact O-N 3.37Å; K369-T372 PolarHBondContact O-N 3.48Å; K369-Y373 HydrophobicContact CB-CD2 4.39Å; K369-Y373 WeakPolarHBondContact O-CD2 3.39Å; K369-Y373 PolarHBondContact O-N 3.36Å
370F94.6Very high90.7Very high12 Ų1228.9 Ų28.95%0.05314%0.141CC..Hα-helixtrans-55.6-52.7-177.7-169-92.3000111.6L251 L254 L255 T275 A282 V366 P367 T372 Y373 T374L251-F370 HydrophobicContact CD2-CE1 4.36Å; L254-F370 HydrophobicContact CB-CE2 4.15Å; L254-F370 HydrophobicContact CB-CZ 4.42Å; L255-F370 HydrophobicContact CB-CE1 4Å; L255-F370 HydrophobicContact CB-CE2 4.07Å; L255-F370 HydrophobicContact CB-CZ 3.72Å; L255-F370 HydrophobicContact CD1-CB 4.23Å; L255-F370 HydrophobicContact CD1-CD1 3.7Å; L255-F370 HydrophobicContact CD1-CD2 4.01Å; L255-F370 HydrophobicContact CD1-CE1 3.98Å; L255-F370 HydrophobicContact CD1-CE2 4.28Å; L255-F370 HydrophobicContact CD1-CG 3.7Å; L255-F370 HydrophobicContact CD1-CZ 4.27Å; L255-F370 HydrophobicContact CG-CE1 4.43Å; T275-F370 HydrophobicContact CG2-CB 3.81Å; T275-F370 HydrophobicContact CG2-CD2 4.33Å; A282-F370 HydrophobicContact CB-CE2 4.45Å; A282-F370 HydrophobicContact CB-CZ 3.94Å; V366-F370 VanDerWaalsContact O-CB 3.28Å; V366-F370 WeakPolarHBondContact O-CB 3.35Å; V366-F370 PolarHBondContact O-N 2.97Å; P367-F370 PolarHBondContact O-N 3.5Å; F370-T372 PolarHBondContact O-N 3.37Å; F370-Y373 PolarHBondContact O-N 3.44Å; F370-T374 WeakPolarHBondContact O-CB 3.48Å; F370-T374 PolarHBondContact O-N 3.23Å; F370-T374 PolarHBondContact O-OG1 2.89Å
371V95.1Very high91.1Very high77 Ų7725.2 Ų25.247%0.46713%0.128SC..Hα-helixtrans-60.6-43.8179.3172.20000111.9V337 P367 K369 Y373 A375V337-V371 HydrophobicContact CG1-CG1 4.12Å; P367-V371 WeakPolarHBondContact O-CB 3.4Å; P367-V371 VanDerWaalsContact O-CG2 3.29Å; P367-V371 WeakPolarHBondContact O-CG2 3.3Å; P367-V371 PolarHBondContact O-N 3.11Å; K369-V371 PolarHBondContact O-N 3.37Å; V371-Y373 PolarHBondContact O-N 3.02Å; V371-A375 WeakPolarHBondContact O-CB 3.48Å; V371-A375 PolarHBondContact O-N 2.98Å
372T94.3Very high91.2Very high3 Ų320.8 Ų20.82%0.01811%0.113CC..Hα-helixtrans-58.4-49.1178.8-59.60000111.4R334 V337 R338 S341 S368 K369 F370 A375 V376R334-T372 HydrophobicContact CG-CG2 4.16Å; V337-T372 HydrophobicContact CB-CG2 4.48Å; R338-T372 WeakPolarHBondContact CA-OG1 3.47Å; R338-T372 HydrophobicContact CB-CG2 3.9Å; R338-T372 PolarHBondContact N-OG1 2.87Å; S341-T372 PolarHBondContact OG-OG1 3.15Å; S368-T372 WeakPolarHBondContact O-CB 3.16Å; S368-T372 PolarHBondContact O-N 2.91Å; S368-T372 VanDerWaalsContact O-N 3.15Å; S368-T372 PolarHBondContact O-OG1 3.01Å; K369-T372 PolarHBondContact O-N 3.48Å; F370-T372 PolarHBondContact O-N 3.37Å; T372-A375 WeakPolarHBondContact O-CB 3.36Å; T372-A375 PolarHBondContact O-N 3.41Å; T372-V376 WeakPolarHBondContact O-CG2 3.33Å; T372-V376 PolarHBondContact O-N 2.88Å; T372-V376 VanDerWaalsContact O-N 3.08Å
373Y94.4Very high91.2Very high5 Ų523.2 Ų23.22%0.0213%0.127CC..Hα-helixtrans-80.8-27.1-173.9-75.2-75.3000113.2N63 E96 T276 G279 V280 R334 K369 F370 V371 A375 V376 G377N63-Y373 PolarHBondContact ND2-OH 3.01Å; E96-Y373 WeakPolarHBondContact OE1-CE1 3.47Å; E96-Y373 VanDerWaalsContact OE1-CZ 3.3Å; E96-Y373 PolarHBondContact OE1-OH 2.99Å; T276-Y373 HydrophobicContact CG2-CD1 3.62Å; T276-Y373 HydrophobicContact CG2-CD2 3.57Å; T276-Y373 HydrophobicContact CG2-CE1 3.4Å; T276-Y373 VanDerWaalsContact CG2-CE1 3.4Å; T276-Y373 HydrophobicContact CG2-CE2 3.42Å; T276-Y373 VanDerWaalsContact CG2-CE2 3.42Å; T276-Y373 HydrophobicContact CG2-CG 3.69Å; T276-Y373 WeakPolarHBondContact O-CB 3.47Å; T276-Y373 VanDerWaalsContact OG1-CE2 3.28Å; T276-Y373 WeakPolarHBondContact OG1-CE2 3.33Å; G279-Y373 CarbonylContact O-C 3.33Å; V280-Y373 WeakPolarHBondContact CA-O 3.38Å; V280-Y373 HydrophobicContact CG2-CD1 3.66Å; V280-Y373 HydrophobicContact CG2-CG 4.09Å; R334-Y373 PolarHBondContact NE-OH 2.92Å; R334-Y373 PolarHBondContact NH2-OH 2.88Å; K369-Y373 HydrophobicContact CB-CD2 4.39Å; K369-Y373 WeakPolarHBondContact O-CD2 3.39Å; K369-Y373 PolarHBondContact O-N 3.36Å; F370-Y373 PolarHBondContact O-N 3.44Å; V371-Y373 PolarHBondContact O-N 3.02Å; Y373-A375 VanDerWaalsContact C-N 3.33Å; Y373-V376 PolarHBondContact O-N 3.25Å; Y373-G377 PolarHBondContact O-N 3.38Å
374T95.9Very high91.1Very high14 Ų1418.8 Ų18.89%0.08611%0.107CC..Hα-helixtrans-61.7-42.1165.8-61.40000111.3L251 G279 G283 F370 G377 L378L251-T374 HydrophobicContact CD2-CG2 3.78Å; G279-T374 WeakPolarHBondContact O-CA 3.43Å; G279-T374 PolarHBondContact O-N 3.44Å; G279-T374 PolarHBondContact O-OG1 3.35Å; G279-T374 VanDerWaalsContact O-OG1 3.04Å; G283-T374 WeakPolarHBondContact CA-O 3.39Å; F370-T374 WeakPolarHBondContact O-CB 3.48Å; F370-T374 PolarHBondContact O-N 3.23Å; F370-T374 PolarHBondContact O-OG1 2.89Å; T374-G377 PolarHBondContact O-N 3.1Å; T374-L378 HydrophobicContact CG2-CD1 4.29Å; T374-L378 WeakPolarHBondContact O-CG 3.46Å; T374-L378 PolarHBondContact O-N 2.99Å
375A95.1Very high90.8Very high24 Ų2419 Ų1920%0.19811%0.108CC..Hα-helixtrans-63.4-41.4174.300000112.3T333 V337 V371 T372 Y373 G377 L378 V379T333-A375 HydrophobicContact CG2-CB 4.18Å; V337-A375 HydrophobicContact CB-CB 4.38Å; V337-A375 HydrophobicContact CG1-CB 4.06Å; V337-A375 HydrophobicContact CG2-CB 3.9Å; V371-A375 WeakPolarHBondContact O-CB 3.48Å; V371-A375 PolarHBondContact O-N 2.98Å; T372-A375 WeakPolarHBondContact O-CB 3.36Å; T372-A375 PolarHBondContact O-N 3.41Å; Y373-A375 VanDerWaalsContact C-N 3.33Å; A375-G377 PolarHBondContact O-N 3.43Å; A375-L378 PolarHBondContact O-N 3.43Å; A375-V379 WeakPolarHBondContact O-CB 3.35Å; A375-V379 WeakPolarHBondContact O-CG2 3.48Å; A375-V379 PolarHBondContact O-N 3.21Å
376V94.3Very high90.4Very high5 Ų523.4 Ų23.43%0.0312%0.124CC..Hα-helixtrans-59.4-46174.3172.20000111.2I100 L330 T333 R334 T372 Y373 V379 N380I100-V376 HydrophobicContact CD1-CG1 4.3Å; I100-V376 HydrophobicContact CG1-CG1 4.47Å; L330-V376 HydrophobicContact CB-CG1 4.4Å; L330-V376 HydrophobicContact CD2-CG1 4.02Å; L330-V376 WeakPolarHBondContact CD2-O 3.4Å; T333-V376 HydrophobicContact CG2-CG2 4.4Å; R334-V376 HydrophobicContact CB-CG2 3.94Å; T372-V376 WeakPolarHBondContact O-CG2 3.33Å; T372-V376 PolarHBondContact O-N 2.88Å; T372-V376 VanDerWaalsContact O-N 3.08Å; Y373-V376 PolarHBondContact O-N 3.25Å; V376-V379 PolarHBondContact O-N 3.19Å; V376-N380 WeakPolarHBondContact O-CB 3.4Å; V376-N380 PolarHBondContact O-N 3.41Å
377G93.2Very high89.9Confident1 Ų125.6 Ų25.61%0.0114%0.138CC..Hα-helixtrans-62.6-41.717700000113.3Y373 T374 A375 N380 S381Y373-G377 PolarHBondContact O-N 3.38Å; T374-G377 PolarHBondContact O-N 3.1Å; A375-G377 PolarHBondContact O-N 3.43Å; G377-N380 WeakPolarHBondContact O-CB 3.42Å; G377-N380 PolarHBondContact O-N 3.14Å; G377-S381 PolarHBondContact O-N 2.86Å; G377-S381 VanDerWaalsContact O-N 3.07Å; G377-S381 PolarHBondContact O-OG 3.43Å
378L93.1Very high89.4Confident55 Ų5524.7 Ų24.729%0.28813%0.132SC..Hα-helixtrans-63.5-44.6175.6-76.2170.2000112.3G283 V286 T374 A375 S381 I382G283-L378 WeakPolarHBondContact O-CD2 3.39Å; V286-L378 HydrophobicContact CB-CD2 3.89Å; V286-L378 HydrophobicContact CG1-CD2 3.73Å; T374-L378 HydrophobicContact CG2-CD1 4.29Å; T374-L378 WeakPolarHBondContact O-CG 3.46Å; T374-L378 PolarHBondContact O-N 2.99Å; A375-L378 PolarHBondContact O-N 3.43Å; L378-S381 PolarHBondContact O-N 3.08Å; L378-I382 HydrophobicContact CD2-CD1 4.23Å; L378-I382 WeakPolarHBondContact O-CB 3.49Å; L378-I382 PolarHBondContact O-N 3.48Å
379V91.9Very high88.6Confident19 Ų1926.8 Ų26.812%0.11515%0.149CC..Iπ-helixtrans-63.4-42.8177.6165.20000110.9L330 T333 A375 V376 S381 L383 V384L330-V379 HydrophobicContact CD2-CB 4.34Å; L330-V379 HydrophobicContact CD2-CG1 3.94Å; T333-V379 HydrophobicContact CG2-CB 4.43Å; T333-V379 HydrophobicContact CG2-CG2 3.84Å; A375-V379 WeakPolarHBondContact O-CB 3.35Å; A375-V379 WeakPolarHBondContact O-CG2 3.48Å; A375-V379 PolarHBondContact O-N 3.21Å; V376-V379 PolarHBondContact O-N 3.19Å; V379-S381 PolarHBondContact O-N 3.38Å; V379-L383 HydrophobicContact CB-CB 4.41Å; V379-L383 HydrophobicContact CG1-CB 4.16Å; V379-L383 HydrophobicContact CG1-CD2 4.06Å; V379-L383 HydrophobicContact CG2-CB 4.41Å; V379-L383 HydrophobicContact CG2-CD2 4.08Å; V379-L383 PolarHBondContact O-N 3.43Å; V379-L383 VanDerWaalsContact O-N 3.12Å; V379-V384 HydrophobicContact CG1-CG2 3.98Å; V379-V384 WeakPolarHBondContact O-CG2 3.19Å; V379-V384 PolarHBondContact O-N 3.16Å
380N90.9Very high87.8Confident7 Ų733.3 Ų33.34%0.03718%0.184CC..Iπ-helixtrans-56.2-49.2175.3173.567.4000112.1P104 H107 W108 L330 V376 G377P104-N380 VanDerWaalsContact CB-OD1 3.24Å; P104-N380 WeakPolarHBondContact CB-OD1 3.49Å; H107-N380 PolarHBondContact NE2-O 3.37Å; W108-N380 VanDerWaalsContact CZ2-OD1 3.31Å; W108-N380 WeakPolarHBondContact CZ2-OD1 3.15Å; W108-N380 PolarHBondContact NE1-O 2.93Å; L330-N380 HydrophobicContact CD1-CB 4.47Å; L330-N380 HydrophobicContact CD2-CB 3.75Å; V376-N380 WeakPolarHBondContact O-CB 3.4Å; V376-N380 PolarHBondContact O-N 3.41Å; G377-N380 WeakPolarHBondContact O-CB 3.42Å; G377-N380 PolarHBondContact O-N 3.14Å
381S86.9Confident86.9Confident0 Ų037.5 Ų37.50%021%0.206CC..Iπ-helixtrans-78.3-37.3-173.5-64.70000113.4N291 G377 L378 V379 N385N291-S381 PolarHBondContact ND2-O 2.96Å; G377-S381 PolarHBondContact O-N 2.86Å; G377-S381 VanDerWaalsContact O-N 3.07Å; G377-S381 PolarHBondContact O-OG 3.43Å; L378-S381 PolarHBondContact O-N 3.08Å; V379-S381 PolarHBondContact O-N 3.38Å; S381-N385 PolarHBondContact O-ND2 3.29Å
382I86.8Confident85.8Confident37 Ų3737.1 Ų37.119%0.1922%0.217CC..Iπ-helixtrans-106.2-63.9-173.1-58.1167.9000111.6A290 L378 V384 N385 R386A290-I382 HydrophobicContact CB-CD1 3.99Å; L378-I382 HydrophobicContact CD2-CD1 4.23Å; L378-I382 WeakPolarHBondContact O-CB 3.49Å; L378-I382 PolarHBondContact O-N 3.48Å; I382-V384 PolarHBondContact O-N 2.68Å; I382-N385 PolarHBondContact O-N 2.82Å; I382-R386 PolarHBondContact O-N 3.1Å
383L83Confident84.6Confident87 Ų8738.6 Ų38.646%0.45523%0.225SC..Iπ-helixtrans-66.2-45.4-164.4-178.964.4000111.8V379 N385 R386 V387V379-L383 HydrophobicContact CB-CB 4.41Å; V379-L383 HydrophobicContact CG1-CB 4.16Å; V379-L383 HydrophobicContact CG1-CD2 4.06Å; V379-L383 HydrophobicContact CG2-CB 4.41Å; V379-L383 HydrophobicContact CG2-CD2 4.08Å; V379-L383 PolarHBondContact O-N 3.43Å; V379-L383 VanDerWaalsContact O-N 3.12Å; L383-N385 VanDerWaalsContact C-N 3.33Å; L383-N385 PolarHBondContact O-N 3.42Å; L383-R386 PolarHBondContact O-N 2.99Å; L383-V387 HydrophobicContact CD1-CG2 4.47Å; L383-V387 HydrophobicContact CG-CG2 4.46Å; L383-V387 WeakPolarHBondContact O-CG2 3.32Å; L383-V387 PolarHBondContact O-N 3.18Å
384V82.7Confident83Confident2 Ų244.7 Ų44.71%0.01226%0.257CS..Hα-helixtrans-64.2-40.8-176.8175.90000111.4W108 A329 V379 I382 R386 V387 F388W108-V384 HydrophobicContact CD2-CG1 4.1Å; W108-V384 VanDerWaalsContact CE2-CG1 3.4Å; W108-V384 HydrophobicContact CH2-CG1 4.35Å; W108-V384 HydrophobicContact CZ2-CB 3.95Å; W108-V384 HydrophobicContact CZ2-CG1 3.56Å; W108-V384 HydrophobicContact CZ2-CG2 3.93Å; A329-V384 HydrophobicContact CB-CG2 4.01Å; V379-V384 HydrophobicContact CG1-CG2 3.98Å; V379-V384 WeakPolarHBondContact O-CG2 3.19Å; V379-V384 PolarHBondContact O-N 3.16Å; I382-V384 PolarHBondContact O-N 2.68Å; V384-R386 VanDerWaalsContact C-N 3.32Å; V384-R386 PolarHBondContact O-N 2.94Å; V384-V387 WeakPolarHBondContact O-CB 3.32Å; V384-V387 PolarHBondContact O-N 3.1Å; V384-F388 HydrophobicContact CG1-CD1 4.45Å; V384-F388 HydrophobicContact CG1-CD2 4.22Å; V384-F388 HydrophobicContact CG1-CE1 3.74Å; V384-F388 HydrophobicContact CG1-CE2 3.48Å; V384-F388 VanDerWaalsContact CG1-CE2 3.48Å; V384-F388 HydrophobicContact CG1-CZ 3.2Å; V384-F388 WeakPolarHBondContact O-CG 3.45Å; V384-F388 PolarHBondContact O-N 3.39Å
385N80.5Confident82.4Confident5 Ų546.3 Ų46.33%0.02727%0.266CS..Hα-helixtrans-62.7-39.1177.2-72.8-15.2000112.3H107 W108 F298 S381 I382 L383 F388 A389H107-N385 PolarHBondContact NE2-ND2 2.95Å; W108-N385 VanDerWaalsContact CD1-OD1 3.3Å; F298-N385 HydrophobicContact CD1-CB 4.15Å; F298-N385 HydrophobicContact CD2-CB 3.63Å; F298-N385 HydrophobicContact CE1-CB 3.9Å; F298-N385 HydrophobicContact CE2-CB 3.38Å; F298-N385 HydrophobicContact CG-CB 4.03Å; F298-N385 HydrophobicContact CZ-CB 3.53Å; S381-N385 PolarHBondContact O-ND2 3.29Å; I382-N385 PolarHBondContact O-N 2.82Å; L383-N385 VanDerWaalsContact C-N 3.33Å; L383-N385 PolarHBondContact O-N 3.42Å; N385-F388 PolarHBondContact O-N 3Å; N385-A389 PolarHBondContact O-N 3.32Å; N385-A389 VanDerWaalsContact O-N 3.11Å
386R80.3Confident81.7Confident97 Ų9747.4 Ų47.437%0.36627%0.269SS..Hα-helixtrans-66.6-39.2174.1-70.3-179.9170.4-159.7-11.5112.4D296 I382 L383 V384 F388 A389 L390D296-R386 IonicContact OD2-CZ 3.71Å; D296-R386 IonicContact OD2-NE 3.67Å; D296-R386 IonicContact OD2-NH2 2.88Å; D296-R386 PolarHBondContact OD2-NH2 3.19Å; I382-R386 PolarHBondContact O-N 3.1Å; L383-R386 PolarHBondContact O-N 2.99Å; V384-R386 VanDerWaalsContact C-N 3.32Å; V384-R386 PolarHBondContact O-N 2.94Å; R386-F388 VanDerWaalsContact C-N 3.3Å; R386-F388 PolarHBondContact O-N 2.97Å; R386-A389 WeakPolarHBondContact O-CB 3.29Å; R386-A389 PolarHBondContact O-N 3.12Å; R386-L390 VanDerWaalsContact O-CG 3.31Å; R386-L390 WeakPolarHBondContact O-CG 3.46Å; R386-L390 PolarHBondContact O-N 2.94Å
387V80Confident81Confident46 Ų4649.8 Ų49.828%0.27928%0.283SS..Hα-helixtrans-61.7-39.8174.5170.50000110.8V325 L383 V384 L390 I391V325-V387 HydrophobicContact CG1-CG1 4.15Å; L383-V387 HydrophobicContact CD1-CG2 4.47Å; L383-V387 HydrophobicContact CG-CG2 4.46Å; L383-V387 WeakPolarHBondContact O-CG2 3.32Å; L383-V387 PolarHBondContact O-N 3.18Å; V384-V387 WeakPolarHBondContact O-CB 3.32Å; V384-V387 PolarHBondContact O-N 3.1Å; V387-L390 PolarHBondContact O-N 3.31Å; V387-I391 HydrophobicContact CG1-CD1 3.5Å; V387-I391 HydrophobicContact CG1-CG1 4.34Å; V387-I391 WeakPolarHBondContact O-CB 3.49Å; V387-I391 VanDerWaalsContact O-CG1 3.28Å; V387-I391 WeakPolarHBondContact O-CG1 3.35Å; V387-I391 PolarHBondContact O-N 3.46Å
388F81.3Confident80.3Confident3 Ų352.6 Ų52.61%0.01330%0.299CS..Hα-helixtrans-64.6-39.7174.4-61.3-25.5000113W108 R322 V325 V384 N385 R386 I391 G392 L393 L394W108-F388 HydrophobicContact CB-CE2 3.75Å; W108-F388 HydrophobicContact CB-CZ 4.43Å; W108-F388 AromaticContact CD1-CE2 3.63Å; W108-F388 AromaticContact CD2-CE2 3.94Å; W108-F388 HydrophobicContact CD2-CE2 3.94Å; W108-F388 HydrophobicContact CD2-CZ 4.02Å; W108-F388 HydrophobicContact CE3-CZ 4.33Å; W108-F388 AromaticContact CG-CE2 3.5Å; W108-F388 HydrophobicContact CG-CE2 3.5Å; W108-F388 VanDerWaalsContact CG-CE2 3.5Å; W108-F388 HydrophobicContact CG-CZ 4.06Å; R322-F388 HydrophobicContact CB-CE1 3.97Å; R322-F388 HydrophobicContact CB-CE2 4Å; R322-F388 HydrophobicContact CB-CZ 3.64Å; R322-F388 HydrophobicContact CG-CD1 4.33Å; R322-F388 HydrophobicContact CG-CD2 4.37Å; R322-F388 HydrophobicContact CG-CE1 4.21Å; R322-F388 HydrophobicContact CG-CE2 4.23Å; R322-F388 HydrophobicContact CG-CG 4.42Å; R322-F388 HydrophobicContact CG-CZ 4.16Å; R322-F388 WeakPolarHBondContact O-CE1 3.15Å; R322-F388 WeakPolarHBondContact O-CZ 3Å; V325-F388 HydrophobicContact CB-CE1 4.21Å; V325-F388 HydrophobicContact CG1-CE1 4.17Å; V384-F388 HydrophobicContact CG1-CD1 4.45Å; V384-F388 HydrophobicContact CG1-CD2 4.22Å; V384-F388 HydrophobicContact CG1-CE1 3.74Å; V384-F388 HydrophobicContact CG1-CE2 3.48Å; V384-F388 VanDerWaalsContact CG1-CE2 3.48Å; V384-F388 HydrophobicContact CG1-CZ 3.2Å; V384-F388 WeakPolarHBondContact O-CG 3.45Å; V384-F388 PolarHBondContact O-N 3.39Å; N385-F388 PolarHBondContact O-N 3Å; R386-F388 VanDerWaalsContact C-N 3.3Å; R386-F388 PolarHBondContact O-N 2.97Å; F388-I391 PolarHBondContact O-N 3.46Å; F388-G392 PolarHBondContact O-N 2.92Å; F388-G392 VanDerWaalsContact O-N 3.17Å; F388-L393 HydrophobicContact CB-CB 4.27Å; F388-L393 HydrophobicContact CD1-CB 4.48Å; F388-L393 PolarHBondContact O-N 3.23Å; F388-L394 HydrophobicContact CB-CG 4.44Å
389A74.2Confident79.5Confident50 Ų5052.5 Ų52.541%0.41330%0.299SS..Hα-helixtrans-60.9-45.2174.300000111.7N385 R386 I391 G392 L394N385-A389 PolarHBondContact O-N 3.32Å; N385-A389 VanDerWaalsContact O-N 3.11Å; R386-A389 WeakPolarHBondContact O-CB 3.29Å; R386-A389 PolarHBondContact O-N 3.12Å; A389-I391 PolarHBondContact O-N 3.4Å; A389-G392 PolarHBondContact O-N 3.17Å; A389-L394 HydrophobicContact CB-CD1 3.67Å
390L74.9Confident78.7Confident150 Ų15054.7 Ų54.779%0.78531%0.312SS*.Hα-helixtrans-66.3-36-179.7-70.3171000113.2R386 V387 G392R386-L390 VanDerWaalsContact O-CG 3.31Å; R386-L390 WeakPolarHBondContact O-CG 3.46Å; R386-L390 PolarHBondContact O-N 2.94Å; V387-L390 PolarHBondContact O-N 3.31Å; L390-G392 VanDerWaalsContact C-N 3.28Å
391I77.3Confident77.8Confident101 Ų10158.1 Ų58.152%0.51833%0.331SS..Hα-helixtrans-85.2-3.6-179-59.5171.2000111.5V387 F388 A389 L393V387-I391 HydrophobicContact CG1-CD1 3.5Å; V387-I391 HydrophobicContact CG1-CG1 4.34Å; V387-I391 WeakPolarHBondContact O-CB 3.49Å; V387-I391 VanDerWaalsContact O-CG1 3.28Å; V387-I391 WeakPolarHBondContact O-CG1 3.35Å; V387-I391 PolarHBondContact O-N 3.46Å; F388-I391 PolarHBondContact O-N 3.46Å; A389-I391 PolarHBondContact O-N 3.4Å; I391-L393 VanDerWaalsContact C-N 3.27Å; I391-L393 HydrophobicContact CB-CD1 4.17Å; I391-L393 HydrophobicContact CG2-CD1 3.63Å; I391-L393 HydrophobicContact CG2-CG 4.19Å; I391-L393 PolarHBondContact O-N 2.92Å
392G71.6Confident77.1Confident68 Ų6862.6 Ų62.670%0.70136%0.357SS*.THydrogen-bonded Turntrans69.428.2-177.300000112.8F388 A389 L390F388-G392 PolarHBondContact O-N 2.92Å; F388-G392 VanDerWaalsContact O-N 3.17Å; A389-G392 PolarHBondContact O-N 3.17Å; L390-G392 VanDerWaalsContact C-N 3.28Å
393L67.8Low76.3Confident35 Ų3564.8 Ų64.818%0.18337%0.371CS..  trans-93.32.3-176.8-100.6160.6000112.7R322 F388 I391R322-L393 HydrophobicContact CG-CD2 4.2Å; R322-L393 PolarHBondContact NE-O 3.34Å; R322-L393 PolarHBondContact NH2-O 3.38Å; F388-L393 HydrophobicContact CB-CB 4.27Å; F388-L393 HydrophobicContact CD1-CB 4.48Å; F388-L393 PolarHBondContact O-N 3.23Å; I391-L393 VanDerWaalsContact C-N 3.27Å; I391-L393 HydrophobicContact CB-CD1 4.17Å; I391-L393 HydrophobicContact CG2-CD1 3.63Å; I391-L393 HydrophobicContact CG2-CG 4.19Å; I391-L393 PolarHBondContact O-N 2.92Å
394L62.4Low75.7Confident133 Ų13362.7 Ų62.770%0.69636%0.363SS*.  trans-68.80-178.8-81.6165.4000114.7F298 R322 F388 A389F298-L394 HydrophobicContact CD1-CD2 3.75Å; F298-L394 HydrophobicContact CE1-CD1 4.12Å; F298-L394 HydrophobicContact CE1-CD2 4Å; R322-L394 PolarHBondContact NH2-O 3.17Å; R322-L394 PolarHBondContact NH2-OXT 3.27Å; F388-L394 HydrophobicContact CB-CG 4.44Å; A389-L394 HydrophobicContact CB-CD1 3.67Å

Retrieved 394 of 394 residues in 637.1 ms (Link to these results)