A0A5K4FA61_SCHMA Loading...

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AlphaFold DB , UniProt , Accession A0A5K4FA61, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,547 aa.

>A0A5K4FA61_SCHMA|A0A5K4FA61
MDDVLEQLENAATAQLLSVKSEDRKRAEEKILQFRSCSEPYEICTAILTRSNNDCLLYEAGRCLSHAVVREWNSVFASSFESVDDCKALQLLTFILEWSQSRGFECGPAARQRILSAAGALVKRASAAHAEKVAAAWRSTKIDGNVSHTPSLVFQILATPPDDPGPPCWLLIKLIEHIEELIQPLTQSDLSGINNDQEPILKRGLLGLFILSALLDEFSYSEDSAQLNMPLEAHVFLRARFQDYELVRLFKNLLCLANQLLVCWSSLDCSALSQGQSEVVFRVISCLDMITGWDFLPRELIRFHVSLLRRSDEEARFRPSAKWNDTIGSDAFPRTSLLFIKLHTWVRVSDLLGARTLSCLVRFSSMSGPLIYPNSSSACINNNSSYHNGISSSYYNEIQSLGSPCTMHYLILIENLNCWLGKEIPMKDSIKLSFESLTDQMPAICSEISNRIADSRLIPSLTLENLLPYELSILSEFIFNLMLNSSRAWEPVERVLSLPKVSSQESLSSEICQSLFHIGLISLWVMDKFFAVLSSLLIQCIRVQTECSTEDDNGQLAHEAVERLFNCWSDLLDLIPSSLSEQARSQKNHNLTAIDSTDDDNSPLPLTTGQVQNSDQLAQKMKKLLGLLRNSNSSRQSQLFQFYLASKMAQPVGLRRTCSHDNNEEIDLELNEDDMTSSEDSLFAVGSCGLSTPEESITTLVRLLNERVTQLIQLQNCESLKSIDLFEDIHWLLLISGHFLVSGPASLTSVLRMGSPWDTQFSIPHQILYLGSDNTVDVVNSRRLIFMSIAQCPDMNSRWPPDNLPYTHIPSLIILLCSLFRLLWLQVAYGIGSAQLVTDNFWLMTRLAATYFCHNVVDRDTLMSNISRSPIMTILQADSDRPLPAHQGVFLSNKTYNGENQILEKKENPLPESCDNINRVCIQGLLMCVRLALNKWSHEPQALSSLTRLLNVLSMHSPNSSSDLACSAWYDICTIVAGPQASEHTWPNLSTDSLIPLVEACLCGSWSIDKKNLSSSALVQQQHHSNEEVSDSLLLQLIREIREQVLRILNVLTNDASFSSLQDSTTISMLVNCTAVLRGVARAIGSIASNSNSSTDLVSLVWNGLLGPFLSHSANYLVLKCHNYSEALQSLFSLFSDVAESCLIYLVSLPSSLSELSSVSLLNNDSTVVQSSLEINKANRNDCVTPCASGPFLNWTVVLCKHYTKNTQGKLNFEATAEDDQIQELQLLLNLLNRVLYHEFELRLSGAVFLSQVDNELVIQPDSINSQDSTFSAIPTVDAAVIGLGHLLPLITESNLTIPELCQAFYSLASYACELRPQGLIRLTDNQLSSFGRLLRFGIFGVEFNQSNHIKSSSTSRSSSCSAGCVDNSVIQQCLDIIISLTDHFLEIRSRSRSRHVEELQNAIRLINVIGLNTQFLSDLFTLLTKESYSVNLEASFSSALLNLIHLSPEAYSNLVYQWINNCEDPIIQTRLSDAFKHLGNYCNNNNDNNNTDTIQSDQQLIKDQTIQNNLYIKCFNENKPTRSTRSDFQHYFHLFVTEMRSFICFG
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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
1M75.8Confident86.2Confident122 Ų12271.8 Ų71.860%0.60137%0.369SS*.  0-49.60-152.9-100.5-90.100109.6D3 V4 L5 A46 R50M1-D3 PolarHBondContact O-N 3.39Å; M1-V4 WeakPolarHBondContact O-CB 3.38Å; M1-V4 PolarHBondContact O-N 3.06Å; M1-V4 VanDerWaalsContact O-N 3.08Å; M1-L5 PolarHBondContact O-N 3.42Å; M1-L5 HydrophobicContact SD-CD1 3.62Å; M1-A46 HydrophobicContact CE-CB 3.3Å; M1-A46 HydrophobicContact SD-CB 3.49Å; M1-A46 WeakPolarHBondContact SD-CB 3.17Å; M1-R50 PolarHBondContact SD-NH1 3.31Å
2D78.3Confident86.3Confident91 Ų9165.9 Ų65.949%0.48734%0.339SS..Hα-helixtrans-54.1-50.4175.7-62.612.5000113.4V4 L5 E6 R50D2-V4 VanDerWaalsContact C-N 3.26Å; D2-V4 PolarHBondContact O-N 2.77Å; D2-L5 WeakPolarHBondContact O-CB 3.09Å; D2-L5 PolarHBondContact O-N 3.45Å; D2-L5 VanDerWaalsContact O-N 3.14Å; D2-E6 PolarHBondContact O-N 3.09Å; D2-R50 IonicContact OD1-CZ 2.72Å; D2-R50 IonicContact OD1-NH1 3.58Å; D2-R50 PolarHBondContact OD1-NH1 3.05Å; D2-R50 IonicContact OD1-NH2 3.74Å; D2-R50 PolarHBondContact OD1-NH2 2.97Å; D2-R50 IonicContact OD2-NH2 2.59Å; D2-R50 PolarHBondContact OD2-NH2 2.87Å
3D83.7Confident86.3Confident116 Ų11664.3 Ų64.362%0.6234%0.335SS*.Hα-helixtrans-59.9-33.9176.7-64-7000113.5M1 Q7M1-D3 PolarHBondContact O-N 3.39Å; D3-Q7 WeakPolarHBondContact O-CB 3.31Å; D3-Q7 WeakPolarHBondContact O-CG 3.38Å; D3-Q7 PolarHBondContact O-N 2.86Å; D3-Q7 VanDerWaalsContact O-N 3.1Å
4V84.6Confident86.3Confident72 Ų7261.9 Ų61.944%0.43633%0.328SS..Hα-helixtrans-71.6-41.5179.1177.90000109.7M1 D2 Q7 L8M1-V4 WeakPolarHBondContact O-CB 3.38Å; M1-V4 PolarHBondContact O-N 3.06Å; M1-V4 VanDerWaalsContact O-N 3.08Å; D2-V4 VanDerWaalsContact C-N 3.26Å; D2-V4 PolarHBondContact O-N 2.77Å; V4-Q7 PolarHBondContact O-N 2.94Å; V4-L8 HydrophobicContact CG1-CD1 4.02Å; V4-L8 HydrophobicContact CG1-CG 4.47Å; V4-L8 WeakPolarHBondContact O-CB 3.3Å; V4-L8 VanDerWaalsContact O-CG 3.32Å; V4-L8 WeakPolarHBondContact O-CG 3.27Å; V4-L8 PolarHBondContact O-N 3.29Å
5L87.6Confident86.1Confident17 Ų1761.3 Ų61.39%0.08932%0.323CS..Hα-helixtrans-64.1-47.2178.8-132.5135.4000110.7M1 D2 Q7 L8 E9 A46 I47M1-L5 PolarHBondContact O-N 3.42Å; M1-L5 HydrophobicContact SD-CD1 3.62Å; D2-L5 WeakPolarHBondContact O-CB 3.09Å; D2-L5 PolarHBondContact O-N 3.45Å; D2-L5 VanDerWaalsContact O-N 3.14Å; L5-Q7 VanDerWaalsContact C-N 3.32Å; L5-Q7 PolarHBondContact O-N 3.16Å; L5-L8 PolarHBondContact O-N 3.12Å; L5-E9 HydrophobicContact CD2-CG 4.5Å; L5-E9 WeakPolarHBondContact O-CG 3.45Å; L5-E9 PolarHBondContact O-N 2.79Å; L5-A46 HydrophobicContact CD1-CB 4.39Å; L5-I47 HydrophobicContact CD1-CG1 4.35Å; L5-I47 HydrophobicContact CG-CG1 4.26Å
6E88Confident85.6Confident116 Ų11665.4 Ų65.454%0.54235%0.345SS..Hα-helixtrans-61.3-40.6176.4-171.6-179.2179.100111.6D2 E9 N10D2-E6 PolarHBondContact O-N 3.09Å; E6-E9 PolarHBondContact O-N 2.69Å; E6-N10 WeakPolarHBondContact O-CB 3.49Å; E6-N10 PolarHBondContact O-N 3.35Å; E6-N10 PolarHBondContact O-ND2 3.1Å
7Q89.3Confident85.3Confident93 Ų9369.8 Ų69.844%0.43537%0.368SS..Hα-helixtrans-64.8-39.3175.9-75.917736.500113D3 V4 L5 A11D3-Q7 WeakPolarHBondContact O-CB 3.31Å; D3-Q7 WeakPolarHBondContact O-CG 3.38Å; D3-Q7 PolarHBondContact O-N 2.86Å; D3-Q7 VanDerWaalsContact O-N 3.1Å; V4-Q7 PolarHBondContact O-N 2.94Å; L5-Q7 VanDerWaalsContact C-N 3.32Å; L5-Q7 PolarHBondContact O-N 3.16Å; Q7-A11 WeakPolarHBondContact O-CB 3.08Å; Q7-A11 PolarHBondContact O-N 3.37Å
8L90.7Very high85Confident10 Ų1067.3 Ų67.35%0.05236%0.357CS..Hα-helixtrans-72.3-37.5177.4-71.5172.9000111.8V4 L5 N10 A11 A12 F34 I47 L56V4-L8 HydrophobicContact CG1-CD1 4.02Å; V4-L8 HydrophobicContact CG1-CG 4.47Å; V4-L8 WeakPolarHBondContact O-CB 3.3Å; V4-L8 VanDerWaalsContact O-CG 3.32Å; V4-L8 WeakPolarHBondContact O-CG 3.27Å; V4-L8 PolarHBondContact O-N 3.29Å; L5-L8 PolarHBondContact O-N 3.12Å; L8-N10 VanDerWaalsContact C-N 3.35Å; L8-A11 PolarHBondContact O-N 3.28Å; L8-A12 WeakPolarHBondContact O-CB 3.49Å; L8-A12 PolarHBondContact O-N 3.11Å; L8-F34 HydrophobicContact CD1-CD2 4.08Å; L8-F34 HydrophobicContact CD1-CG 4.3Å; L8-F34 HydrophobicContact CD2-CB 3.75Å; L8-F34 HydrophobicContact CD2-CG 4.14Å; L8-I47 HydrophobicContact CD1-CD1 4.14Å; L8-L56 HydrophobicContact CB-CD1 3.76Å; L8-L56 HydrophobicContact CB-CD2 4.1Å
9E90.9Very high84.5Confident54 Ų5471.2 Ų71.225%0.25238%0.383SS..Hα-helixtrans-62.5-43.8174.3-74.8-176.9165.300111.4L5 E6 T13 S51 N53 L56L5-E9 HydrophobicContact CD2-CG 4.5Å; L5-E9 WeakPolarHBondContact O-CG 3.45Å; L5-E9 PolarHBondContact O-N 2.79Å; E6-E9 PolarHBondContact O-N 2.69Å; E9-T13 PolarHBondContact O-N 3.34Å; E9-T13 PolarHBondContact O-OG1 3.44Å; E9-S51 VanDerWaalsContact OE1-CB 3.29Å; E9-S51 WeakPolarHBondContact OE1-CB 3.48Å; E9-S51 PolarHBondContact OE1-OG 3.06Å; E9-N53 HydrophobicContact CG-CB 4.2Å; E9-N53 PolarHBondContact O-ND2 3.47Å; E9-L56 HydrophobicContact CB-CD2 4.36Å; E9-L56 HydrophobicContact CG-CD2 3.41Å; E9-L56 VanDerWaalsContact CG-CD2 3.41Å
10N89.2Confident84.4Confident92 Ų9274.9 Ų74.949%0.49240%0.395SS..Hα-helixtrans-65.3-38.6174.9-73.2-32.9000111.9E6 L8 T13 A14E6-N10 WeakPolarHBondContact O-CB 3.49Å; E6-N10 PolarHBondContact O-N 3.35Å; E6-N10 PolarHBondContact O-ND2 3.1Å; L8-N10 VanDerWaalsContact C-N 3.35Å; N10-T13 WeakPolarHBondContact CA-OG1 3.43Å; N10-T13 PolarHBondContact O-OG1 3.15Å; N10-T13 VanDerWaalsContact O-OG1 3.11Å; N10-A14 WeakPolarHBondContact O-CB 3.18Å; N10-A14 PolarHBondContact O-N 3.23Å
11A89.8Confident84.3Confident7 Ų774.5 Ų74.56%0.05840%0.399CS..Hα-helixtrans-66.7-49.7175.500000111.6Q7 L8 T13 A14 Q15 A27 K30 I31Q7-A11 WeakPolarHBondContact O-CB 3.08Å; Q7-A11 PolarHBondContact O-N 3.37Å; L8-A11 PolarHBondContact O-N 3.28Å; A11-T13 VanDerWaalsContact C-N 3.31Å; A11-T13 PolarHBondContact O-N 3.11Å; A11-A14 PolarHBondContact O-N 3.35Å; A11-Q15 PolarHBondContact O-N 3.1Å; A11-A27 HydrophobicContact CB-CB 4.35Å; A11-A27 WeakPolarHBondContact O-CB 3.49Å; A11-K30 HydrophobicContact CB-CB 4.36Å; A11-I31 HydrophobicContact CB-CD1 4.38Å; A11-I31 HydrophobicContact CB-CG1 4.22Å
12A87.5Confident84.7Confident1 Ų175.3 Ų75.31%0.00840%0.401CS..Hα-helixtrans-59.9-40.6-179.300000112.1L8 I31 C55 L56L8-A12 WeakPolarHBondContact O-CB 3.49Å; L8-A12 PolarHBondContact O-N 3.11Å; A12-I31 HydrophobicContact CB-CD1 3.94Å; A12-C55 HydrophobicContact CB-CB 3.95Å; A12-L56 HydrophobicContact CB-CB 4.02Å; A12-L56 HydrophobicContact CB-CD1 4.44Å
13T87Confident84.9Confident45 Ų4573.7 Ų73.728%0.27639%0.392SS..Hα-helixtrans-70.4-41.9175.244.50000112.5E9 N10 A11 Q15 L16 L17 N53E9-T13 PolarHBondContact O-N 3.34Å; E9-T13 PolarHBondContact O-OG1 3.44Å; N10-T13 WeakPolarHBondContact CA-OG1 3.43Å; N10-T13 PolarHBondContact O-OG1 3.15Å; N10-T13 VanDerWaalsContact O-OG1 3.11Å; A11-T13 VanDerWaalsContact C-N 3.31Å; A11-T13 PolarHBondContact O-N 3.11Å; T13-Q15 VanDerWaalsContact C-N 3.28Å; T13-Q15 PolarHBondContact O-N 3.5Å; T13-L16 PolarHBondContact O-N 3.39Å; T13-L17 WeakPolarHBondContact O-CB 3.5Å; T13-L17 PolarHBondContact O-N 3.45Å; T13-N53 VanDerWaalsContact CG2-ND2 3.27Å; T13-N53 WeakPolarHBondContact CG2-ND2 3.14Å
14A86.2Confident84.9Confident30 Ų3073.5 Ų73.525%0.24838%0.383CS..Hα-helixtrans-64.6-31.4177.200000112.8N10 A11 L16 S18 A27N10-A14 WeakPolarHBondContact O-CB 3.18Å; N10-A14 PolarHBondContact O-N 3.23Å; A11-A14 PolarHBondContact O-N 3.35Å; A14-L16 VanDerWaalsContact C-N 3.3Å; A14-L16 PolarHBondContact O-N 3.06Å; A14-S18 WeakPolarHBondContact O-CB 3.38Å; A14-S18 PolarHBondContact O-N 3.34Å; A14-A27 HydrophobicContact CB-CB 3.9Å
15Q83.1Confident84.7Confident53 Ų5376.1 Ų76.125%0.24839%0.388CS..Hα-helixtrans-61.7-38.7177.1-169.2176.6500112A11 T13 R24 A27A11-Q15 PolarHBondContact O-N 3.1Å; T13-Q15 VanDerWaalsContact C-N 3.28Å; T13-Q15 PolarHBondContact O-N 3.5Å; Q15-R24 WeakPolarHBondContact O-CD 3.46Å; Q15-R24 WeakPolarHBondContact O-CG 3.32Å; Q15-A27 HydrophobicContact CB-CB 4.27Å
16L77.6Confident84.6Confident128 Ų12882.1 Ų82.167%0.6741%0.41SS*.Hα-helixtrans-87.7-37.8179.1-97.3148000113.6T13 A14 C55T13-L16 PolarHBondContact O-N 3.39Å; A14-L16 VanDerWaalsContact C-N 3.3Å; A14-L16 PolarHBondContact O-N 3.06Å; L16-C55 HydrophobicContact CD1-CB 4.15Å; L16-C55 WeakPolarHBondContact CD1-SG 3.45Å
17L80.4Confident84.5Confident140 Ų14076.9 Ų76.973%0.73339%0.387SS*.Hα-helixtrans-104.2-12.2-167.3-62.5171.4000114.4T13 V19T13-L17 WeakPolarHBondContact O-CB 3.5Å; T13-L17 PolarHBondContact O-N 3.45Å; L17-V19 PolarHBondContact O-N 2.71Å
18S79.9Confident84.3Confident25 Ų2576.8 Ų76.818%0.17539%0.386CS..  trans-77122-176.2-176.70000112.9A14 K20 D23 R24A14-S18 WeakPolarHBondContact O-CB 3.38Å; A14-S18 PolarHBondContact O-N 3.34Å; S18-K20 VanDerWaalsContact C-N 3.31Å; S18-K20 PolarHBondContact OG-N 3.49Å; S18-K20 PolarHBondContact OG-O 2.95Å; S18-D23 WeakPolarHBondContact OG-CB 3.43Å; S18-R24 PolarHBondContact O-NE 3.1Å; S18-R24 VanDerWaalsContact O-NE 3.08Å
19V76.4Confident84Confident140 Ų14082 Ų8285%0.84841%0.41SS*.SBendtrans-68.3-31.7172.9-173.70000111.2L17L17-V19 PolarHBondContact O-N 2.71Å
20K82.7Confident83.8Confident145 Ų14583 Ų8363%0.6341%0.414SS*.SBendtrans-83.3123.7-177.6-68.5-178.2-178.71770111.3S18 E22 D23 R24S18-K20 VanDerWaalsContact C-N 3.31Å; S18-K20 PolarHBondContact OG-N 3.49Å; S18-K20 PolarHBondContact OG-O 2.95Å; K20-E22 VanDerWaalsContact C-N 3.32Å; K20-E22 PolarHBondContact O-N 2.9Å; K20-D23 HydrophobicContact CB-CB 4.35Å; K20-D23 WeakPolarHBondContact CD-OD2 3.25Å; K20-D23 PolarHBondContact O-N 2.75Å; K20-R24 PolarHBondContact O-N 3.14Å; K20-R24 VanDerWaalsContact O-N 3.1Å
21S82Confident83.7Confident68 Ų6878.7 Ų78.748%0.47639%0.391SS..Hα-helixtrans-56.8-39.7178.9169.90000113.4D23 R24 K25S21-D23 PolarHBondContact O-N 3.32Å; S21-R24 PolarHBondContact O-N 3.39Å; S21-K25 PolarHBondContact O-N 3.3Å
22E83.4Confident83.3Confident139 Ų13981.6 Ų81.665%0.6541%0.405SS*.Hα-helixtrans-63.3-41.1179.4-68.6-175.5178.900112.8K20 K25 R26K20-E22 VanDerWaalsContact C-N 3.32Å; K20-E22 PolarHBondContact O-N 2.9Å; E22-K25 PolarHBondContact O-N 3.03Å; E22-R26 PolarHBondContact O-N 3.21Å; E22-R26 IonicContact OE2-NH2 3.09Å
23D82.8Confident83.1Confident56 Ų5687.1 Ų87.130%0.29943%0.43SS..Hα-helixtrans-72.9-35.5-179.8-64.7-31.2000110.7S18 K20 S21 R26 A27S18-D23 WeakPolarHBondContact OG-CB 3.43Å; K20-D23 HydrophobicContact CB-CB 4.35Å; K20-D23 WeakPolarHBondContact CD-OD2 3.25Å; K20-D23 PolarHBondContact O-N 2.75Å; S21-D23 PolarHBondContact O-N 3.32Å; D23-R26 IonicContact OD1-NH1 3.53Å; D23-R26 PolarHBondContact OD1-NH1 2.71Å; D23-A27 VanDerWaalsContact O-CB 3.24Å; D23-A27 WeakPolarHBondContact O-CB 3.25Å; D23-A27 PolarHBondContact O-N 3.23Å
24R83.8Confident83Confident113 Ų11385.3 Ų85.343%0.42642%0.419SS..Hα-helixtrans-60.3-46.1169.3-107.3-172.1-63.3145.52.9112Q15 S18 K20 S21 A27 E28Q15-R24 WeakPolarHBondContact O-CD 3.46Å; Q15-R24 WeakPolarHBondContact O-CG 3.32Å; S18-R24 PolarHBondContact O-NE 3.1Å; S18-R24 VanDerWaalsContact O-NE 3.08Å; K20-R24 PolarHBondContact O-N 3.14Å; K20-R24 VanDerWaalsContact O-N 3.1Å; S21-R24 PolarHBondContact O-N 3.39Å; R24-A27 WeakPolarHBondContact O-CB 3.37Å; R24-A27 PolarHBondContact O-N 3.3Å; R24-E28 WeakPolarHBondContact O-CB 3.47Å; R24-E28 PolarHBondContact O-N 3.19Å
25K81.4Confident82.7Confident126 Ų12685.7 Ų85.755%0.54841%0.414SS..Hα-helixtrans-62.4-48.1177.4-85.5-168.7173.4-168.80112.3S21 E22 A27 E28 E29S21-K25 PolarHBondContact O-N 3.3Å; E22-K25 PolarHBondContact O-N 3.03Å; K25-A27 VanDerWaalsContact C-N 3.27Å; K25-A27 PolarHBondContact O-N 2.96Å; K25-E28 PolarHBondContact O-N 2.97Å; K25-E29 VanDerWaalsContact O-CB 3.28Å; K25-E29 WeakPolarHBondContact O-CB 3.32Å; K25-E29 PolarHBondContact O-N 3.19Å
26R83.6Confident82.4Confident144 Ų14485.5 Ų85.554%0.54342%0.418SS..Hα-helixtrans-60.9-38.8176.8-77.2-164.6-144.6104.910.7112E22 D23 K30E22-R26 PolarHBondContact O-N 3.21Å; E22-R26 IonicContact OE2-NH2 3.09Å; D23-R26 IonicContact OD1-NH1 3.53Å; D23-R26 PolarHBondContact OD1-NH1 2.71Å; R26-K30 WeakPolarHBondContact O-CB 3.33Å; R26-K30 PolarHBondContact O-N 2.87Å; R26-K30 VanDerWaalsContact O-N 3.16Å
27A86.6Confident82.5Confident6 Ų681.9 Ų81.95%0.0540%0.403CS..Hα-helixtrans-63.7-49176.200000111.6A11 A14 Q15 D23 R24 K25 K30 I31A11-A27 HydrophobicContact CB-CB 4.35Å; A11-A27 WeakPolarHBondContact O-CB 3.49Å; A14-A27 HydrophobicContact CB-CB 3.9Å; Q15-A27 HydrophobicContact CB-CB 4.27Å; D23-A27 VanDerWaalsContact O-CB 3.24Å; D23-A27 WeakPolarHBondContact O-CB 3.25Å; D23-A27 PolarHBondContact O-N 3.23Å; R24-A27 WeakPolarHBondContact O-CB 3.37Å; R24-A27 PolarHBondContact O-N 3.3Å; K25-A27 VanDerWaalsContact C-N 3.27Å; K25-A27 PolarHBondContact O-N 2.96Å; A27-K30 PolarHBondContact O-N 2.85Å; A27-I31 VanDerWaalsContact O-CG1 3.31Å; A27-I31 WeakPolarHBondContact O-CG1 3.41Å; A27-I31 PolarHBondContact O-N 2.8Å
28E85.2Confident82.4Confident90 Ų9078.5 Ų78.542%0.42139%0.391SS..Hα-helixtrans-60.6-46.6177.4-179.3173.5-158.900112.2R24 K25 K30 I31 L32R24-E28 WeakPolarHBondContact O-CB 3.47Å; R24-E28 PolarHBondContact O-N 3.19Å; K25-E28 PolarHBondContact O-N 2.97Å; E28-K30 PolarHBondContact O-N 2.95Å; E28-I31 CarbonylContact O-C 3.25Å; E28-I31 PolarHBondContact O-N 3.46Å; E28-I31 VanDerWaalsContact O-N 3.09Å; E28-L32 HydrophobicContact CG-CD1 4.04Å; E28-L32 HydrophobicContact CG-CG 4.42Å; E28-L32 WeakPolarHBondContact O-CB 3.48Å; E28-L32 WeakPolarHBondContact O-CG 3.49Å; E28-L32 PolarHBondContact O-N 2.64Å
29E84.8Confident82.6Confident119 Ų11983 Ų8356%0.55641%0.41SS*.Hα-helixtrans-58.5-38.1177.6-163.7173.1-149.900111.2K25 L32 Q33K25-E29 VanDerWaalsContact O-CB 3.28Å; K25-E29 WeakPolarHBondContact O-CB 3.32Å; K25-E29 PolarHBondContact O-N 3.19Å; E29-L32 PolarHBondContact O-N 3.19Å; E29-Q33 WeakPolarHBondContact O-CB 3.48Å; E29-Q33 WeakPolarHBondContact O-CG 3.47Å; E29-Q33 PolarHBondContact O-N 3.16Å
30K85.6Confident83.1Confident76 Ų7676.4 Ų76.433%0.3337%0.37SS..Hα-helixtrans-71.7-36.6176.5-155.6162.4-173.4173.20112.9A11 R26 A27 E28 F34A11-K30 HydrophobicContact CB-CB 4.36Å; R26-K30 WeakPolarHBondContact O-CB 3.33Å; R26-K30 PolarHBondContact O-N 2.87Å; R26-K30 VanDerWaalsContact O-N 3.16Å; A27-K30 PolarHBondContact O-N 2.85Å; E28-K30 PolarHBondContact O-N 2.95Å; K30-F34 PolarHBondContact O-N 3.39Å
31I87.2Confident83.5Confident2 Ų270.9 Ų70.91%0.0135%0.345CS..Hα-helixtrans-67.2-41.1173-66.8-81.6000110.5A11 A12 A27 E28 F34 R35 E59A11-I31 HydrophobicContact CB-CD1 4.38Å; A11-I31 HydrophobicContact CB-CG1 4.22Å; A12-I31 HydrophobicContact CB-CD1 3.94Å; A27-I31 VanDerWaalsContact O-CG1 3.31Å; A27-I31 WeakPolarHBondContact O-CG1 3.41Å; A27-I31 PolarHBondContact O-N 2.8Å; E28-I31 CarbonylContact O-C 3.25Å; E28-I31 PolarHBondContact O-N 3.46Å; E28-I31 VanDerWaalsContact O-N 3.09Å; I31-F34 WeakPolarHBondContact O-CB 3.35Å; I31-F34 PolarHBondContact O-N 3.33Å; I31-R35 WeakPolarHBondContact O-CG 3.44Å; I31-R35 PolarHBondContact O-N 3.33Å; I31-E59 HydrophobicContact CD1-CG 4.31Å; I31-E59 HydrophobicContact CG2-CB 4.41Å; I31-E59 HydrophobicContact CG2-CG 3.95Å
32L82.4Confident83.8Confident67 Ų6775.6 Ų75.635%0.35136%0.359SS..Hα-helixtrans-65.4-40.8175.8-72.5171000111.9E28 E29 F34 R35 S36E28-L32 HydrophobicContact CG-CD1 4.04Å; E28-L32 HydrophobicContact CG-CG 4.42Å; E28-L32 WeakPolarHBondContact O-CB 3.48Å; E28-L32 WeakPolarHBondContact O-CG 3.49Å; E28-L32 PolarHBondContact O-N 2.64Å; E29-L32 PolarHBondContact O-N 3.19Å; L32-F34 VanDerWaalsContact C-N 3.33Å; L32-F34 PolarHBondContact O-N 3.41Å; L32-R35 PolarHBondContact O-N 3.39Å; L32-S36 PolarHBondContact O-N 2.97Å; L32-S36 PolarHBondContact O-OG 3.44Å
33Q82.7Confident84.2Confident117 Ų11772 Ų7255%0.54734%0.344SS..Hα-helixtrans-58-45.3170.6-79176.23.200111.5E29 R35 S36 C37E29-Q33 WeakPolarHBondContact O-CB 3.48Å; E29-Q33 WeakPolarHBondContact O-CG 3.47Å; E29-Q33 PolarHBondContact O-N 3.16Å; Q33-R35 VanDerWaalsContact C-N 3.34Å; Q33-R35 PolarHBondContact O-N 3.25Å; Q33-S36 WeakPolarHBondContact CA-OG 3.42Å; Q33-S36 PolarHBondContact O-N 3.4Å; Q33-S36 PolarHBondContact O-OG 3.48Å; Q33-C37 PolarHBondContact O-N 2.94Å; Q33-C37 PolarHBondContact O-SG 3.07Å
34F85.6Confident84.6Confident7 Ų769.3 Ų69.33%0.03133%0.33CS..Hα-helixtrans-60.3-42.1174.4159.5-110.4000112.7L8 K30 I31 L32 S36 C37 I43 I47 C63L8-F34 HydrophobicContact CD1-CD2 4.08Å; L8-F34 HydrophobicContact CD1-CG 4.3Å; L8-F34 HydrophobicContact CD2-CB 3.75Å; L8-F34 HydrophobicContact CD2-CG 4.14Å; K30-F34 PolarHBondContact O-N 3.39Å; I31-F34 WeakPolarHBondContact O-CB 3.35Å; I31-F34 PolarHBondContact O-N 3.33Å; L32-F34 VanDerWaalsContact C-N 3.33Å; L32-F34 PolarHBondContact O-N 3.41Å; F34-S36 VanDerWaalsContact C-N 3.28Å; F34-S36 PolarHBondContact O-N 3.42Å; F34-C37 WeakPolarHBondContact O-CB 3.49Å; F34-C37 PolarHBondContact O-N 3.12Å; F34-I43 HydrophobicContact CD2-CG2 4.27Å; F34-I43 HydrophobicContact CE2-CG2 3.81Å; F34-I47 HydrophobicContact CE2-CD1 3.92Å; F34-I47 HydrophobicContact CZ-CD1 3.83Å; F34-C63 HydrophobicContact CD1-CB 4.4Å; F34-C63 HydrophobicContact CE1-CB 3.57Å; F34-C63 HydrophobicContact CZ-CB 3.68Å
35R80.1Confident85Confident38 Ų3865.8 Ų65.814%0.14332%0.321CS..Hα-helixtrans-68.9-25.8178.9-73.317965.3-156.6-6113.4I31 L32 Q33 E59 R62 C63 H66I31-R35 WeakPolarHBondContact O-CG 3.44Å; I31-R35 PolarHBondContact O-N 3.33Å; L32-R35 PolarHBondContact O-N 3.39Å; Q33-R35 VanDerWaalsContact C-N 3.34Å; Q33-R35 PolarHBondContact O-N 3.25Å; R35-E59 WeakPolarHBondContact CD-OE2 3.44Å; R35-R62 VanDerWaalsContact NH1-CZ 3.32Å; R35-C63 HydrophobicContact CG-CB 4.15Å; R35-H66 PolarHBondContact NH2-CE1 3.5Å; R35-H66 PolarHBondContact NH2-ND1 2.85Å
36S75.4Confident85.4Confident49 Ų4960.1 Ų60.134%0.34330%0.297SS..Hα-helixtrans-87.9-22.2178.946.50000113.3L32 Q33 F34 S38 R70L32-S36 PolarHBondContact O-N 2.97Å; L32-S36 PolarHBondContact O-OG 3.44Å; Q33-S36 WeakPolarHBondContact CA-OG 3.42Å; Q33-S36 PolarHBondContact O-N 3.4Å; Q33-S36 PolarHBondContact O-OG 3.48Å; F34-S36 VanDerWaalsContact C-N 3.28Å; F34-S36 PolarHBondContact O-N 3.42Å; S36-S38 PolarHBondContact O-N 3.11Å; S36-R70 PolarHBondContact O-NH1 3.39Å; S36-R70 PolarHBondContact O-NH2 3.11Å
37C80.1Confident85.8Confident53 Ų5353.2 Ų53.236%0.35827%0.271SS..  trans-43.1135.4177.5-79.30000114.1Q33 F34 P40 R70Q33-C37 PolarHBondContact O-N 2.94Å; Q33-C37 PolarHBondContact O-SG 3.07Å; F34-C37 WeakPolarHBondContact O-CB 3.49Å; F34-C37 PolarHBondContact O-N 3.12Å; C37-P40 WeakPolarHBondContact O-CD 3.43Å; C37-R70 PolarHBondContact O-NH2 3.35Å
38S77.8Confident86.1Confident69 Ų6953 Ų5348%0.48327%0.269SS..SBendtrans-70.3139.1173.8610000111.9S36 E71S36-S38 PolarHBondContact O-N 3.11Å; S38-E71 WeakPolarHBondContact CA-OE1 3.43Å
39E84Confident86.3Confident120 Ų12052.2 Ų52.256%0.56127%0.271SS*.SBendtrans48.454.9179.8-59.8-170.1164.500114.1Y41 E71 V75E39-Y41 HydrophobicContact CB-CD2 4.24Å; E39-Y41 HydrophobicContact CB-CE2 4.33Å; E39-Y41 PolarHBondContact O-N 3.32Å; E39-E71 WeakPolarHBondContact CA-OE2 3.38Å; E39-E71 PolarHBondContact N-OE1 3.25Å; E39-E71 PolarHBondContact N-OE2 3.23Å; E39-V75 HydrophobicContact CG-CG2 3.98Å
40P88.4Confident86.6Confident1 Ų152.3 Ų52.31%0.00627%0.266CS..THydrogen-bonded Turntrans-72.65.3-172.631.9-35.4000114.1C37 E42 I43 C44 A67C37-P40 WeakPolarHBondContact O-CD 3.43Å; P40-E42 PolarHBondContact O-N 3.22Å; P40-I43 PolarHBondContact O-N 2.97Å; P40-I43 VanDerWaalsContact O-N 3.15Å; P40-C44 WeakPolarHBondContact O-CB 3.37Å; P40-C44 PolarHBondContact O-N 3.12Å; P40-C44 PolarHBondContact O-SG 3.48Å; P40-C44 VanDerWaalsContact O-SG 3.37Å; P40-A67 HydrophobicContact CG-CB 3.49Å; P40-A67 VanDerWaalsContact CG-CB 3.49Å
41Y90.9Very high86.8Confident28 Ų2848.7 Ų48.711%0.1125%0.25CS..Hα-helixtrans-61.8-41.6-169.6-49.4-68.4000113.5E39 I43 T45 L64 A67 V68 E71 V75 F76 L91E39-Y41 HydrophobicContact CB-CD2 4.24Å; E39-Y41 HydrophobicContact CB-CE2 4.33Å; E39-Y41 PolarHBondContact O-N 3.32Å; Y41-I43 VanDerWaalsContact C-N 3.35Å; Y41-T45 WeakPolarHBondContact O-CB 3.42Å; Y41-T45 WeakPolarHBondContact O-CG2 3.42Å; Y41-T45 PolarHBondContact O-N 3.04Å; Y41-T45 PolarHBondContact O-OG1 3.46Å; Y41-L64 HydrophobicContact CD1-CD2 3.99Å; Y41-A67 HydrophobicContact CE1-CB 4.24Å; Y41-A67 PolarHBondContact OH-O 3.32Å; Y41-V68 HydrophobicContact CE1-CG1 3.96Å; Y41-E71 PolarHBondContact OH-OE2 2.87Å; Y41-V75 HydrophobicContact CE2-CB 4.42Å; Y41-V75 HydrophobicContact CE2-CG1 3.96Å; Y41-V75 HydrophobicContact CE2-CG2 4.12Å; Y41-F76 HydrophobicContact CD1-CZ 4.31Å; Y41-F76 HydrophobicContact CE1-CE2 4.02Å; Y41-F76 AromaticContact CE1-CZ 3.69Å; Y41-F76 HydrophobicContact CE1-CZ 3.69Å; Y41-F76 HydrophobicContact CE2-CE2 4.43Å; Y41-F76 HydrophobicContact CE2-CZ 4.16Å; Y41-F76 AromaticContact CZ-CE2 3.66Å; Y41-F76 AromaticContact CZ-CZ 3.59Å; Y41-F76 VanDerWaalsContact OH-CE2 3.25Å; Y41-F76 WeakPolarHBondContact OH-CE2 3.34Å; Y41-L91 HydrophobicContact CD1-CD2 3.93Å; Y41-L91 HydrophobicContact CE1-CD2 4.2Å
42E88.9Confident86.8Confident167 Ų16754.5 Ų54.578%0.7828%0.281SS*.Hα-helixtrans-66.2-38.1176.2-69.6-169.7172.300112.1P40 T45 A46P40-E42 PolarHBondContact O-N 3.22Å; E42-T45 WeakPolarHBondContact CA-OG1 3.26Å; E42-T45 PolarHBondContact O-OG1 3.28Å; E42-A46 WeakPolarHBondContact O-CB 3.45Å; E42-A46 PolarHBondContact O-N 2.92Å
43I90Very high87.2Confident63 Ų6352.6 Ų52.632%0.32327%0.271SS..Hα-helixtrans-69.5-45.9178.2-62.3174.7000109.7F34 P40 Y41 A46 I47F34-I43 HydrophobicContact CD2-CG2 4.27Å; F34-I43 HydrophobicContact CE2-CG2 3.81Å; P40-I43 PolarHBondContact O-N 2.97Å; P40-I43 VanDerWaalsContact O-N 3.15Å; Y41-I43 VanDerWaalsContact C-N 3.35Å; I43-A46 WeakPolarHBondContact O-CB 3.33Å; I43-A46 PolarHBondContact O-N 3.48Å; I43-I47 HydrophobicContact CG2-CD1 3.87Å; I43-I47 HydrophobicContact CG2-CG1 4.45Å; I43-I47 VanDerWaalsContact O-CG1 3.29Å; I43-I47 WeakPolarHBondContact O-CG1 3.47Å; I43-I47 PolarHBondContact O-N 3.26Å
44C92.6Very high87.6Confident0 Ų050.3 Ų50.30%026%0.263CS..Hα-helixtrans-63.2-43.1177.9-71.50000112.1P40 A46 I47 L48 L64P40-C44 WeakPolarHBondContact O-CB 3.37Å; P40-C44 PolarHBondContact O-N 3.12Å; P40-C44 PolarHBondContact O-SG 3.48Å; P40-C44 VanDerWaalsContact O-SG 3.37Å; C44-A46 VanDerWaalsContact C-N 3.3Å; C44-A46 PolarHBondContact O-N 3.11Å; C44-I47 PolarHBondContact O-N 2.97Å; C44-L48 WeakPolarHBondContact O-CB 3.23Å; C44-L48 VanDerWaalsContact O-CG 3.23Å; C44-L48 WeakPolarHBondContact O-CG 3.36Å; C44-L48 PolarHBondContact O-N 3.45Å; C44-L64 HydrophobicContact CB-CD1 3.97Å; C44-L64 HydrophobicContact CB-CD2 3.62Å; C44-L64 HydrophobicContact CB-CG 3.68Å
45T91.4Very high87.8Confident39 Ų3951.8 Ų51.824%0.23927%0.274CS..Hα-helixtrans-63.3-37.4176.1530000111.6Y41 E42 T49 F94Y41-T45 WeakPolarHBondContact O-CB 3.42Å; Y41-T45 WeakPolarHBondContact O-CG2 3.42Å; Y41-T45 PolarHBondContact O-N 3.04Å; Y41-T45 PolarHBondContact O-OG1 3.46Å; E42-T45 WeakPolarHBondContact CA-OG1 3.26Å; E42-T45 PolarHBondContact O-OG1 3.28Å; T45-T49 WeakPolarHBondContact O-CB 3.48Å; T45-T49 WeakPolarHBondContact O-CG2 3.39Å; T45-T49 PolarHBondContact O-N 3.24Å; T45-T49 PolarHBondContact O-OG1 3.21Å; T45-F94 HydrophobicContact CG2-CD1 3.85Å; T45-F94 HydrophobicContact CG2-CD2 4.5Å; T45-F94 HydrophobicContact CG2-CE1 3.58Å; T45-F94 HydrophobicContact CG2-CE2 4.26Å; T45-F94 HydrophobicContact CG2-CG 4.3Å; T45-F94 HydrophobicContact CG2-CZ 3.8Å
46A90.4Very high88.4Confident7 Ų750 Ų506%0.05827%0.267CS..Hα-helixtrans-65.7-42.1172.400000113.3M1 L5 E42 I43 C44 T49 R50M1-A46 HydrophobicContact CE-CB 3.3Å; M1-A46 HydrophobicContact SD-CB 3.49Å; M1-A46 WeakPolarHBondContact SD-CB 3.17Å; L5-A46 HydrophobicContact CD1-CB 4.39Å; E42-A46 WeakPolarHBondContact O-CB 3.45Å; E42-A46 PolarHBondContact O-N 2.92Å; I43-A46 WeakPolarHBondContact O-CB 3.33Å; I43-A46 PolarHBondContact O-N 3.48Å; C44-A46 VanDerWaalsContact C-N 3.3Å; C44-A46 PolarHBondContact O-N 3.11Å; A46-T49 WeakPolarHBondContact CA-OG1 3.35Å; A46-T49 PolarHBondContact O-N 3.15Å; A46-T49 PolarHBondContact O-OG1 2.91Å; A46-T49 VanDerWaalsContact O-OG1 3.1Å; A46-R50 VanDerWaalsContact O-CB 3.29Å; A46-R50 WeakPolarHBondContact O-CB 3.25Å; A46-R50 WeakPolarHBondContact O-CG 3.39Å; A46-R50 PolarHBondContact O-N 3.14Å
47I92.7Very high89.2Confident0 Ų047.9 Ų47.90%025%0.252CS..Hα-helixtrans-61.5-48.4175.8-70.5166.2000110.1L5 L8 F34 I43 C44 T49 R50 S51 L56 L57 A60L5-I47 HydrophobicContact CD1-CG1 4.35Å; L5-I47 HydrophobicContact CG-CG1 4.26Å; L8-I47 HydrophobicContact CD1-CD1 4.14Å; F34-I47 HydrophobicContact CE2-CD1 3.92Å; F34-I47 HydrophobicContact CZ-CD1 3.83Å; I43-I47 HydrophobicContact CG2-CD1 3.87Å; I43-I47 HydrophobicContact CG2-CG1 4.45Å; I43-I47 VanDerWaalsContact O-CG1 3.29Å; I43-I47 WeakPolarHBondContact O-CG1 3.47Å; I43-I47 PolarHBondContact O-N 3.26Å; C44-I47 PolarHBondContact O-N 2.97Å; I47-T49 VanDerWaalsContact C-N 3.29Å; I47-T49 PolarHBondContact O-N 3.32Å; I47-R50 PolarHBondContact O-N 2.75Å; I47-S51 VanDerWaalsContact O-CB 3.24Å; I47-S51 WeakPolarHBondContact O-CB 3.48Å; I47-S51 PolarHBondContact O-N 3.37Å; I47-L56 HydrophobicContact CD1-CD1 4.32Å; I47-L56 HydrophobicContact CD1-CG 4.49Å; I47-L56 HydrophobicContact CG1-CD2 4.32Å; I47-L56 HydrophobicContact CG2-CD2 3.94Å; I47-L56 HydrophobicContact CG2-CG 3.76Å; I47-L57 HydrophobicContact CG2-CD2 4.36Å; I47-A60 HydrophobicContact CB-CB 4.39Å; I47-A60 HydrophobicContact CD1-CB 4.48Å; I47-A60 HydrophobicContact CG2-CB 3.82Å
48L91.6Very high89.8Confident0 Ų049.4 Ų49.40%025%0.251CS..Hα-helixtrans-62.5-35.3-179-70.7169.7000112.7C44 L57 L64 F94 W98 R102 I114C44-L48 WeakPolarHBondContact O-CB 3.23Å; C44-L48 VanDerWaalsContact O-CG 3.23Å; C44-L48 WeakPolarHBondContact O-CG 3.36Å; C44-L48 PolarHBondContact O-N 3.45Å; L48-L57 HydrophobicContact CD2-CD2 3.99Å; L48-L64 HydrophobicContact CD1-CD1 3.85Å; L48-F94 HydrophobicContact CB-CE1 4.31Å; L48-F94 HydrophobicContact CB-CZ 4.37Å; L48-F94 HydrophobicContact CD1-CE1 3.82Å; L48-W98 HydrophobicContact CD2-CD2 4.46Å; L48-W98 HydrophobicContact CD2-CZ2 4.14Å; L48-W98 PolarHBondContact O-NE1 3.18Å; L48-R102 PolarHBondContact O-NH1 3.07Å; L48-I114 HydrophobicContact CD2-CD1 3.36Å; L48-I114 HydrophobicContact CD2-CG1 3.83Å; L48-I114 HydrophobicContact CD2-CG2 4.02Å
49T90Very high90.4Very high74 Ų7447 Ų4745%0.45423%0.232SC..Hα-helixtrans-81.7-31.318048.40000113.5T45 A46 I47 F94 R102T45-T49 WeakPolarHBondContact O-CB 3.48Å; T45-T49 WeakPolarHBondContact O-CG2 3.39Å; T45-T49 PolarHBondContact O-N 3.24Å; T45-T49 PolarHBondContact O-OG1 3.21Å; A46-T49 WeakPolarHBondContact CA-OG1 3.35Å; A46-T49 PolarHBondContact O-N 3.15Å; A46-T49 PolarHBondContact O-OG1 2.91Å; A46-T49 VanDerWaalsContact O-OG1 3.1Å; I47-T49 VanDerWaalsContact C-N 3.29Å; I47-T49 PolarHBondContact O-N 3.32Å; T49-F94 HydrophobicContact CG2-CE2 4Å; T49-F94 HydrophobicContact CG2-CZ 3.92Å; T49-R102 PolarHBondContact O-NH1 2.93Å
50R90.3Very high90.9Very high122 Ų12241.2 Ų41.246%0.4621%0.205SC..Hα-helixtrans-112.1-29.5-167.9-58.817869.6-175.42.5115M1 D2 A46 I47M1-R50 PolarHBondContact SD-NH1 3.31Å; D2-R50 IonicContact OD1-CZ 2.72Å; D2-R50 IonicContact OD1-NH1 3.58Å; D2-R50 PolarHBondContact OD1-NH1 3.05Å; D2-R50 IonicContact OD1-NH2 3.74Å; D2-R50 PolarHBondContact OD1-NH2 2.97Å; D2-R50 IonicContact OD2-NH2 2.59Å; D2-R50 PolarHBondContact OD2-NH2 2.87Å; A46-R50 VanDerWaalsContact O-CB 3.29Å; A46-R50 WeakPolarHBondContact O-CB 3.25Å; A46-R50 WeakPolarHBondContact O-CG 3.39Å; A46-R50 PolarHBondContact O-N 3.14Å; I47-R50 PolarHBondContact O-N 2.75Å
51S89.7Confident91Very high0 Ų041.2 Ų41.20%021%0.205CC..  trans-85.1147.7-176.8-168.10000111.8E9 I47 N53 R102E9-S51 VanDerWaalsContact OE1-CB 3.29Å; E9-S51 WeakPolarHBondContact OE1-CB 3.48Å; E9-S51 PolarHBondContact OE1-OG 3.06Å; I47-S51 VanDerWaalsContact O-CB 3.24Å; I47-S51 WeakPolarHBondContact O-CB 3.48Å; I47-S51 PolarHBondContact O-N 3.37Å; S51-N53 PolarHBondContact OG-N 3.45Å; S51-R102 PolarHBondContact O-NH1 3.42Å
52N88.6Confident90.9Very high123 Ų12343.9 Ų43.966%0.65822%0.215SC*.  trans-114.47.2169.7-67-13.2000111.9D54 R102N52-D54 PolarHBondContact O-N 3.19Å; N52-R102 PolarHBondContact OD1-NH2 3Å
53N90.4Very high91Very high27 Ų2736 Ų3614%0.14418%0.177CC..  trans-86.3106.4-177.6-177.6-23.3000109.9E9 T13 S51 C55 L56 L57E9-N53 HydrophobicContact CG-CB 4.2Å; E9-N53 PolarHBondContact O-ND2 3.47Å; T13-N53 VanDerWaalsContact CG2-ND2 3.27Å; T13-N53 WeakPolarHBondContact CG2-ND2 3.14Å; S51-N53 PolarHBondContact OG-N 3.45Å; N53-C55 PolarHBondContact O-N 3.39Å; N53-C55 VanDerWaalsContact O-N 3.15Å; N53-C55 WeakPolarHBondContact OD1-CB 3.34Å; N53-C55 PolarHBondContact OD1-N 3.1Å; N53-C55 VanDerWaalsContact OD1-N 3.09Å; N53-L56 HydrophobicContact CB-CB 4.14Å; N53-L56 PolarHBondContact O-N 3.17Å; N53-L56 PolarHBondContact OD1-N 2.93Å; N53-L57 WeakPolarHBondContact O-CG 3.33Å; N53-L57 PolarHBondContact O-N 3.43Å
54D90Very high91.1Very high69 Ų6933 Ų3337%0.36916%0.162SC..Hα-helixtrans-55-33.5-178-78.2-22.7000113.6N52 L57 Y58 G107 A110N52-D54 PolarHBondContact O-N 3.19Å; D54-L57 PolarHBondContact O-N 2.81Å; D54-Y58 WeakPolarHBondContact O-CB 3.27Å; D54-Y58 PolarHBondContact O-N 3.26Å; D54-G107 VanDerWaalsContact CG-N 3.33Å; D54-G107 PolarHBondContact OD1-N 2.92Å; D54-G107 PolarHBondContact OD2-N 3.36Å; D54-A110 HydrophobicContact CB-CB 4.46Å; D54-A110 WeakPolarHBondContact O-CB 3.43Å
55C90.1Very high90.8Very high38 Ų3833.3 Ų33.326%0.25716%0.164SC..Hα-helixtrans-68.3-43.2178.7-56.50000110.8A12 L16 N53 Y58 E59A12-C55 HydrophobicContact CB-CB 3.95Å; L16-C55 HydrophobicContact CD1-CB 4.15Å; L16-C55 WeakPolarHBondContact CD1-SG 3.45Å; N53-C55 PolarHBondContact O-N 3.39Å; N53-C55 VanDerWaalsContact O-N 3.15Å; N53-C55 WeakPolarHBondContact OD1-CB 3.34Å; N53-C55 PolarHBondContact OD1-N 3.1Å; N53-C55 VanDerWaalsContact OD1-N 3.09Å; C55-Y58 PolarHBondContact O-N 3.21Å; C55-E59 PolarHBondContact O-N 3.02Å
56L92.7Very high90.5Very high0 Ų035.3 Ų35.30%017%0.171CC..Hα-helixtrans-70.1-37.7177.2-176.960.7000111.5L8 E9 A12 I47 N53 Y58 E59 A60L8-L56 HydrophobicContact CB-CD1 3.76Å; L8-L56 HydrophobicContact CB-CD2 4.1Å; E9-L56 HydrophobicContact CB-CD2 4.36Å; E9-L56 HydrophobicContact CG-CD2 3.41Å; E9-L56 VanDerWaalsContact CG-CD2 3.41Å; A12-L56 HydrophobicContact CB-CB 4.02Å; A12-L56 HydrophobicContact CB-CD1 4.44Å; I47-L56 HydrophobicContact CD1-CD1 4.32Å; I47-L56 HydrophobicContact CD1-CG 4.49Å; I47-L56 HydrophobicContact CG1-CD2 4.32Å; I47-L56 HydrophobicContact CG2-CD2 3.94Å; I47-L56 HydrophobicContact CG2-CG 3.76Å; N53-L56 HydrophobicContact CB-CB 4.14Å; N53-L56 PolarHBondContact O-N 3.17Å; N53-L56 PolarHBondContact OD1-N 2.93Å; L56-Y58 VanDerWaalsContact C-N 3.33Å; L56-E59 PolarHBondContact O-N 3.15Å; L56-A60 WeakPolarHBondContact O-CB 3.47Å; L56-A60 PolarHBondContact O-N 3.39Å
57L93.4Very high90.2Very high5 Ų535 Ų353%0.02617%0.169CC..Hα-helixtrans-61.4-42.3173.9-70.8175000111.4I47 L48 N53 D54 A60 G61 C106 A110 I114I47-L57 HydrophobicContact CG2-CD2 4.36Å; L48-L57 HydrophobicContact CD2-CD2 3.99Å; N53-L57 WeakPolarHBondContact O-CG 3.33Å; N53-L57 PolarHBondContact O-N 3.43Å; D54-L57 PolarHBondContact O-N 2.81Å; L57-A60 PolarHBondContact O-N 3.4Å; L57-G61 PolarHBondContact O-N 3.23Å; L57-C106 HydrophobicContact CD1-CB 3.97Å; L57-A110 HydrophobicContact CB-CB 3.98Å; L57-I114 HydrophobicContact CB-CD1 4.1Å
58Y92Very high89.9Confident85 Ų8535.1 Ų35.133%0.33317%0.169SC..Hα-helixtrans-60-49.1174-178.9-88.9000111.8D54 C55 L56 A60 G61 R62 A109 R113D54-Y58 WeakPolarHBondContact O-CB 3.27Å; D54-Y58 PolarHBondContact O-N 3.26Å; C55-Y58 PolarHBondContact O-N 3.21Å; L56-Y58 VanDerWaalsContact C-N 3.33Å; Y58-A60 VanDerWaalsContact C-N 3.32Å; Y58-A60 PolarHBondContact O-N 3.26Å; Y58-G61 PolarHBondContact O-N 3.12Å; Y58-R62 PolarHBondContact O-N 3.4Å; Y58-A109 HydrophobicContact CD2-CB 4.37Å; Y58-R113 HydrophobicContact CD2-CB 3.66Å; Y58-R113 HydrophobicContact CD2-CG 4.06Å; Y58-R113 HydrophobicContact CE2-CB 3.74Å; Y58-R113 HydrophobicContact CE2-CG 3.9Å; Y58-R113 HydrophobicContact CG-CB 4.39Å; Y58-R113 HydrophobicContact CG-CG 4.48Å
59E90.9Very high89.4Confident18 Ų1836.3 Ų36.38%0.08418%0.176CC..Hα-helixtrans-66.9-32178.1-70.6-60.8159.800112.7I31 R35 C55 L56 R62 C63I31-E59 HydrophobicContact CD1-CG 4.31Å; I31-E59 HydrophobicContact CG2-CB 4.41Å; I31-E59 HydrophobicContact CG2-CG 3.95Å; R35-E59 WeakPolarHBondContact CD-OE2 3.44Å; C55-E59 PolarHBondContact O-N 3.02Å; L56-E59 PolarHBondContact O-N 3.15Å; E59-R62 PolarHBondContact O-N 3.15Å; E59-C63 VanDerWaalsContact O-CB 3.3Å; E59-C63 WeakPolarHBondContact O-CB 3.28Å; E59-C63 PolarHBondContact O-N 3.43Å
60A93.2Very high88.8Confident0 Ų035 Ų350%016%0.163CC..Hα-helixtrans-65.6-42172.600000112.1I47 L56 L57 Y58 R62 C63 L64I47-A60 HydrophobicContact CB-CB 4.39Å; I47-A60 HydrophobicContact CD1-CB 4.48Å; I47-A60 HydrophobicContact CG2-CB 3.82Å; L56-A60 WeakPolarHBondContact O-CB 3.47Å; L56-A60 PolarHBondContact O-N 3.39Å; L57-A60 PolarHBondContact O-N 3.4Å; Y58-A60 VanDerWaalsContact C-N 3.32Å; Y58-A60 PolarHBondContact O-N 3.26Å; A60-R62 VanDerWaalsContact C-N 3.33Å; A60-C63 PolarHBondContact O-N 3.17Å; A60-L64 WeakPolarHBondContact O-CB 3.41Å; A60-L64 WeakPolarHBondContact O-CG 3.42Å; A60-L64 PolarHBondContact O-N 2.77Å
61G91.6Very high88.4Confident0 Ų029.7 Ų29.70%014%0.144CC..Hα-helixtrans-62.3-39.9172.200000112.4L57 Y58 L64 S65L57-G61 PolarHBondContact O-N 3.23Å; Y58-G61 PolarHBondContact O-N 3.12Å; G61-L64 PolarHBondContact O-N 3.28Å; G61-S65 PolarHBondContact O-N 3.09Å; G61-S65 PolarHBondContact O-OG 3.25Å
62R88.7Confident88.1Confident85 Ų8530 Ų3032%0.32115%0.145SC..Hα-helixtrans-66.7-39.3175.1-166.2175.3-173.5-175.11.3112.7R35 Y58 E59 A60 S65 H66 R113R35-R62 VanDerWaalsContact NH1-CZ 3.32Å; Y58-R62 PolarHBondContact O-N 3.4Å; E59-R62 PolarHBondContact O-N 3.15Å; A60-R62 VanDerWaalsContact C-N 3.33Å; R62-S65 WeakPolarHBondContact CA-OG 3.28Å; R62-S65 PolarHBondContact O-OG 3.32Å; R62-H66 PolarHBondContact O-CD2 3.42Å; R62-H66 PolarHBondContact O-N 3.35Å; R62-R113 HydrophobicContact CB-CG 4.27Å
63C90.6Very high87.7Confident0 Ų028.8 Ų28.80%014%0.138CC..Hα-helixtrans-63.3-49.1174.3-1770000110.7F34 R35 E59 A60 S65 H66 A67F34-C63 HydrophobicContact CD1-CB 4.4Å; F34-C63 HydrophobicContact CE1-CB 3.57Å; F34-C63 HydrophobicContact CZ-CB 3.68Å; R35-C63 HydrophobicContact CG-CB 4.15Å; E59-C63 VanDerWaalsContact O-CB 3.3Å; E59-C63 WeakPolarHBondContact O-CB 3.28Å; E59-C63 PolarHBondContact O-N 3.43Å; A60-C63 PolarHBondContact O-N 3.17Å; C63-S65 PolarHBondContact O-N 3.39Å; C63-H66 PolarHBondContact O-N 2.86Å; C63-A67 VanDerWaalsContact O-CB 3.26Å; C63-A67 WeakPolarHBondContact O-CB 3.45Å; C63-A67 PolarHBondContact O-N 3.34Å
64L91.4Very high87.1Confident1 Ų131 Ų311%0.00516%0.156CC..Hα-helixtrans-58.6-49.3178.7-77.6171.9000112.4Y41 C44 L48 A60 G61 H66 A67 V68 A117Y41-L64 HydrophobicContact CD1-CD2 3.99Å; C44-L64 HydrophobicContact CB-CD1 3.97Å; C44-L64 HydrophobicContact CB-CD2 3.62Å; C44-L64 HydrophobicContact CB-CG 3.68Å; L48-L64 HydrophobicContact CD1-CD1 3.85Å; A60-L64 WeakPolarHBondContact O-CB 3.41Å; A60-L64 WeakPolarHBondContact O-CG 3.42Å; A60-L64 PolarHBondContact O-N 2.77Å; G61-L64 PolarHBondContact O-N 3.28Å; L64-H66 VanDerWaalsContact C-N 3.28Å; L64-H66 PolarHBondContact O-N 3.34Å; L64-A67 PolarHBondContact O-N 3.07Å; L64-V68 WeakPolarHBondContact O-CG1 3.5Å; L64-V68 VanDerWaalsContact O-CG2 3.31Å; L64-V68 WeakPolarHBondContact O-CG2 3.29Å; L64-V68 PolarHBondContact O-N 3.29Å; L64-A117 HydrophobicContact CB-CB 3.63Å
65S87.9Confident86.7Confident6 Ų628 Ų284%0.04214%0.14CC..Hα-helixtrans-57.3-39.1179.444.10000112.8G61 R62 C63 V68 V69G61-S65 PolarHBondContact O-N 3.09Å; G61-S65 PolarHBondContact O-OG 3.25Å; R62-S65 WeakPolarHBondContact CA-OG 3.28Å; R62-S65 PolarHBondContact O-OG 3.32Å; C63-S65 PolarHBondContact O-N 3.39Å; S65-V68 WeakPolarHBondContact O-CG2 3.49Å; S65-V69 WeakPolarHBondContact O-CG2 3.33Å
66H83.4Confident86.5Confident82 Ų8226.4 Ų26.438%0.3813%0.129SC..Hα-helixtrans-75.2-44.3177-72.6-140.5000111.8R35 R62 C63 L64 V68 V69 R70R35-H66 PolarHBondContact NH2-CE1 3.5Å; R35-H66 PolarHBondContact NH2-ND1 2.85Å; R62-H66 PolarHBondContact O-CD2 3.42Å; R62-H66 PolarHBondContact O-N 3.35Å; C63-H66 PolarHBondContact O-N 2.86Å; L64-H66 VanDerWaalsContact C-N 3.28Å; L64-H66 PolarHBondContact O-N 3.34Å; H66-V68 PolarHBondContact O-N 2.89Å; H66-V69 PolarHBondContact O-N 2.73Å; H66-R70 WeakPolarHBondContact O-CB 3.48Å; H66-R70 PolarHBondContact O-N 3.41Å
67A84.6Confident86Confident1 Ų128.2 Ų28.21%0.00814%0.143CC..Hα-helixtrans-64.6-39.5-176.600000112.6P40 Y41 C63 L64 V69 R70 E71P40-A67 HydrophobicContact CG-CB 3.49Å; P40-A67 VanDerWaalsContact CG-CB 3.49Å; Y41-A67 HydrophobicContact CE1-CB 4.24Å; Y41-A67 PolarHBondContact OH-O 3.32Å; C63-A67 VanDerWaalsContact O-CB 3.26Å; C63-A67 WeakPolarHBondContact O-CB 3.45Å; C63-A67 PolarHBondContact O-N 3.34Å; L64-A67 PolarHBondContact O-N 3.07Å; A67-V69 VanDerWaalsContact C-N 3.27Å; A67-V69 PolarHBondContact O-N 3.24Å; A67-R70 PolarHBondContact O-N 3.22Å; A67-E71 WeakPolarHBondContact O-CB 3.36Å; A67-E71 PolarHBondContact O-N 3.29Å
68V86.4Confident85.4Confident2 Ų232.8 Ų32.81%0.01218%0.176CC..Hα-helixtrans-65-31.1178.8-64.60000113.1Y41 L64 S65 H66 F76 L91 A120 L121Y41-V68 HydrophobicContact CE1-CG1 3.96Å; L64-V68 WeakPolarHBondContact O-CG1 3.5Å; L64-V68 VanDerWaalsContact O-CG2 3.31Å; L64-V68 WeakPolarHBondContact O-CG2 3.29Å; L64-V68 PolarHBondContact O-N 3.29Å; S65-V68 WeakPolarHBondContact O-CG2 3.49Å; H66-V68 PolarHBondContact O-N 2.89Å; V68-F76 HydrophobicContact CB-CE2 4.33Å; V68-F76 HydrophobicContact CG1-CE2 4.17Å; V68-F76 HydrophobicContact CG1-CZ 4.33Å; V68-L91 HydrophobicContact CG1-CD2 3.79Å; V68-A120 HydrophobicContact CG2-CB 4.13Å; V68-L121 HydrophobicContact CB-CB 4.32Å; V68-L121 HydrophobicContact CB-CD1 3.81Å; V68-L121 HydrophobicContact CG1-CB 4.34Å; V68-L121 HydrophobicContact CG1-CD1 3.78Å; V68-L121 HydrophobicContact CG2-CB 4.14Å
69V81.3Confident85Confident25 Ų2529.3 Ų29.315%0.15216%0.164CC..Hα-helixtrans-75.9-49.9176175.70000110.2S65 H66 A67 R124 Q226 L227S65-V69 WeakPolarHBondContact O-CG2 3.33Å; H66-V69 PolarHBondContact O-N 2.73Å; A67-V69 VanDerWaalsContact C-N 3.27Å; A67-V69 PolarHBondContact O-N 3.24Å; V69-R124 HydrophobicContact CG2-CB 4.39Å; V69-Q226 WeakPolarHBondContact CG1-O 3.42Å; V69-L227 HydrophobicContact CG1-CD2 4Å; V69-L227 HydrophobicContact CG2-CD2 4.01Å
70R77.3Confident84.6Confident46 Ų4629.3 Ų29.317%0.17416%0.164CC..Hα-helixtrans-60.1-48.1-177.5177.3-176.966.9-174.26.6113.4S36 C37 H66 A67 C1545S36-R70 PolarHBondContact O-NH1 3.39Å; S36-R70 PolarHBondContact O-NH2 3.11Å; C37-R70 PolarHBondContact O-NH2 3.35Å; H66-R70 WeakPolarHBondContact O-CB 3.48Å; H66-R70 PolarHBondContact O-N 3.41Å; A67-R70 PolarHBondContact O-N 3.22Å; R70-C1545 WeakPolarHBondContact CD-SG 3.46Å; R70-C1545 HydrophobicContact CG-CB 4.33Å
71E81.6Confident83.7Confident11 Ų1136.5 Ų36.55%0.05120%0.198CC..THydrogen-bonded Turntrans-100.419.1-170.5-63.8176.2-16800112.5S38 E39 Y41 A67 N73 S74 V75S38-E71 WeakPolarHBondContact CA-OE1 3.43Å; E39-E71 WeakPolarHBondContact CA-OE2 3.38Å; E39-E71 PolarHBondContact N-OE1 3.25Å; E39-E71 PolarHBondContact N-OE2 3.23Å; Y41-E71 PolarHBondContact OH-OE2 2.87Å; A67-E71 WeakPolarHBondContact O-CB 3.36Å; A67-E71 PolarHBondContact O-N 3.29Å; E71-N73 PolarHBondContact O-N 3.36Å; E71-S74 PolarHBondContact O-N 3.44Å; E71-S74 PolarHBondContact O-OG 3.16Å; E71-S74 VanDerWaalsContact O-OG 3.05Å; E71-V75 HydrophobicContact CB-CG2 3.96Å; E71-V75 WeakPolarHBondContact O-CB 3.23Å; E71-V75 PolarHBondContact O-N 2.99Å
72W84.2Confident83Confident5 Ų539 Ų392%0.01922%0.215CC..Iπ-helixtrans-54.4-50.2-177.7-176.9-97.9000113.2F76 A77 F80 A88 L121 R124 A125 A128W72-F76 HydrophobicContact CD2-CB 4.16Å; W72-F76 HydrophobicContact CE3-CB 3.86Å; W72-F76 AromaticContact CE3-CD2 3.9Å; W72-F76 HydrophobicContact CE3-CD2 3.9Å; W72-F76 HydrophobicContact CE3-CG 4.16Å; W72-F76 HydrophobicContact CH2-CB 4.23Å; W72-F76 HydrophobicContact CZ3-CB 3.92Å; W72-F76 HydrophobicContact CZ3-CD2 4.31Å; W72-F76 HydrophobicContact CZ3-CG 4.22Å; W72-F76 PolarHBondContact O-N 3.36Å; W72-A77 PolarHBondContact O-N 2.94Å; W72-F80 HydrophobicContact CH2-CD2 4.01Å; W72-F80 HydrophobicContact CH2-CE2 4.13Å; W72-F80 HydrophobicContact CZ2-CD2 4.08Å; W72-F80 HydrophobicContact CZ2-CE2 4.33Å; W72-F80 HydrophobicContact CZ2-CG 4.29Å; W72-A88 HydrophobicContact CH2-CB 4.27Å; W72-A88 HydrophobicContact CZ3-CB 4.29Å; W72-L121 HydrophobicContact CE3-CD1 4.47Å; W72-L121 HydrophobicContact CZ3-CD1 3.86Å; W72-R124 HydrophobicContact CB-CG 3.76Å; W72-R124 HydrophobicContact CD2-CB 4.46Å; W72-R124 HydrophobicContact CD2-CG 3.52Å; W72-R124 HydrophobicContact CE3-CB 4.12Å; W72-R124 HydrophobicContact CE3-CG 3.6Å; W72-R124 HydrophobicContact CG-CG 3.57Å; W72-R124 HydrophobicContact CZ3-CG 4.46Å; W72-A125 HydrophobicContact CH2-CB 3.34Å; W72-A125 HydrophobicContact CZ2-CB 3.92Å; W72-A125 HydrophobicContact CZ3-CB 4.03Å; W72-A128 HydrophobicContact CZ2-CB 4.24Å; W72-A128 VanDerWaalsContact NE1-CB 3.25Å
73N79.7Confident82.2Confident99 Ų9938.8 Ų38.853%0.52922%0.223SC..Iπ-helixtrans-71.4-32.6-175.7-68.6-19.4000112.8E71E71-N73 PolarHBondContact O-N 3.36Å
74S77.5Confident81.4Confident73 Ų7345.9 Ų45.951%0.5126%0.261SS..Iπ-helixtrans-80.1-42.4-178.847.60000112.5E71E71-S74 PolarHBondContact O-N 3.44Å; E71-S74 PolarHBondContact O-OG 3.16Å; E71-S74 VanDerWaalsContact O-OG 3.05Å
75V82.1Confident80.7Confident7 Ų751.3 Ų51.34%0.04229%0.29CS..Iπ-helixtrans-100.5-46.1-168.8179.40000112.3E39 Y41 E71 K87E39-V75 HydrophobicContact CG-CG2 3.98Å; Y41-V75 HydrophobicContact CE2-CB 4.42Å; Y41-V75 HydrophobicContact CE2-CG1 3.96Å; Y41-V75 HydrophobicContact CE2-CG2 4.12Å; E71-V75 HydrophobicContact CB-CG2 3.96Å; E71-V75 WeakPolarHBondContact O-CB 3.23Å; E71-V75 PolarHBondContact O-N 2.99Å; V75-K87 HydrophobicContact CG1-CD 4.25Å
76F86.5Confident80.7Confident4 Ų451 Ų512%0.01829%0.288CS..Iπ-helixtrans-100.1-38.4-166.4-60.9-65.5000113.4Y41 V68 W72 S78 S79 F80 K87 A88 L91 L121Y41-F76 HydrophobicContact CD1-CZ 4.31Å; Y41-F76 HydrophobicContact CE1-CE2 4.02Å; Y41-F76 AromaticContact CE1-CZ 3.69Å; Y41-F76 HydrophobicContact CE1-CZ 3.69Å; Y41-F76 HydrophobicContact CE2-CE2 4.43Å; Y41-F76 HydrophobicContact CE2-CZ 4.16Å; Y41-F76 AromaticContact CZ-CE2 3.66Å; Y41-F76 AromaticContact CZ-CZ 3.59Å; Y41-F76 VanDerWaalsContact OH-CE2 3.25Å; Y41-F76 WeakPolarHBondContact OH-CE2 3.34Å; V68-F76 HydrophobicContact CB-CE2 4.33Å; V68-F76 HydrophobicContact CG1-CE2 4.17Å; V68-F76 HydrophobicContact CG1-CZ 4.33Å; W72-F76 HydrophobicContact CD2-CB 4.16Å; W72-F76 HydrophobicContact CE3-CB 3.86Å; W72-F76 AromaticContact CE3-CD2 3.9Å; W72-F76 HydrophobicContact CE3-CD2 3.9Å; W72-F76 HydrophobicContact CE3-CG 4.16Å; W72-F76 HydrophobicContact CH2-CB 4.23Å; W72-F76 HydrophobicContact CZ3-CB 3.92Å; W72-F76 HydrophobicContact CZ3-CD2 4.31Å; W72-F76 HydrophobicContact CZ3-CG 4.22Å; W72-F76 PolarHBondContact O-N 3.36Å; F76-S78 VanDerWaalsContact C-N 3.31Å; F76-S78 PolarHBondContact O-N 3.48Å; F76-S79 PolarHBondContact O-N 3.19Å; F76-S79 VanDerWaalsContact O-N 3.1Å; F76-S79 PolarHBondContact O-OG 2.97Å; F76-F80 PolarHBondContact O-N 3.46Å; F76-K87 HydrophobicContact CD1-CB 3.86Å; F76-K87 HydrophobicContact CE1-CB 4.13Å; F76-A88 HydrophobicContact CB-CB 4.42Å; F76-A88 HydrophobicContact CD1-CB 3.85Å; F76-A88 HydrophobicContact CE1-CB 4.5Å; F76-A88 HydrophobicContact CG-CB 4.31Å; F76-L91 HydrophobicContact CE1-CD2 4.46Å; F76-L91 HydrophobicContact CZ-CD2 4.04Å; F76-L121 HydrophobicContact CE2-CD1 4.42Å; F76-L121 HydrophobicContact CZ-CD1 4.48Å
77A82.1Confident81Confident37 Ų3751.8 Ų51.831%0.30629%0.29SS..THydrogen-bonded Turntrans-57.9-37.3-170.300000114.2W72 S79 F80W72-A77 PolarHBondContact O-N 2.94Å; A77-S79 VanDerWaalsContact C-N 3.3Å; A77-S79 PolarHBondContact O-N 2.88Å; A77-F80 PolarHBondContact O-N 2.93Å
78S80.9Confident81.3Confident102 Ų10251.8 Ų51.871%0.71329%0.29SS*.THydrogen-bonded Turntrans-66.6-30-179.664.70000113.7F76F76-S78 VanDerWaalsContact C-N 3.31Å; F76-S78 PolarHBondContact O-N 3.48Å
79S82.6Confident81.5Confident11 Ų1152.7 Ų52.78%0.07729%0.294CS..THydrogen-bonded Turntrans-96.8-10.8-177.268.10000113.7F76 A77 E81 S82 D85 K87F76-S79 PolarHBondContact O-N 3.19Å; F76-S79 VanDerWaalsContact O-N 3.1Å; F76-S79 PolarHBondContact O-OG 2.97Å; A77-S79 VanDerWaalsContact C-N 3.3Å; A77-S79 PolarHBondContact O-N 2.88Å; S79-E81 VanDerWaalsContact C-N 3.27Å; S79-E81 PolarHBondContact O-N 3.4Å; S79-S82 PolarHBondContact O-N 3.36Å; S79-S82 VanDerWaalsContact O-O 3.13Å; S79-S82 PolarHBondContact O-OG 3.34Å; S79-D85 WeakPolarHBondContact CB-O 3.44Å; S79-K87 PolarHBondContact OG-N 3.39Å
80F82.3Confident82Confident18 Ų1856.9 Ų56.98%0.07931%0.313CS..THydrogen-bonded Turntrans-68.9-22.8-169.3-171.4-107.2000113.9W72 F76 A77 A125 W169 L170W72-F80 HydrophobicContact CH2-CD2 4.01Å; W72-F80 HydrophobicContact CH2-CE2 4.13Å; W72-F80 HydrophobicContact CZ2-CD2 4.08Å; W72-F80 HydrophobicContact CZ2-CE2 4.33Å; W72-F80 HydrophobicContact CZ2-CG 4.29Å; F76-F80 PolarHBondContact O-N 3.46Å; A77-F80 PolarHBondContact O-N 2.93Å; F80-A125 HydrophobicContact CE2-CB 3.91Å; F80-A125 HydrophobicContact CZ-CB 4.04Å; F80-W169 HydrophobicContact CD2-CZ2 4.18Å; F80-W169 AromaticContact CE1-NE1 3.74Å; F80-W169 AromaticContact CE2-CE2 3.96Å; F80-W169 AromaticContact CE2-CZ2 3.91Å; F80-W169 HydrophobicContact CE2-CZ2 3.91Å; F80-W169 AromaticContact CE2-NE1 3.78Å; F80-W169 HydrophobicContact CZ-CZ2 4.44Å; F80-W169 AromaticContact CZ-NE1 3.42Å; F80-L170 HydrophobicContact CE2-CB 4.3Å; F80-L170 HydrophobicContact CE2-CD2 4.38Å
81E75.2Confident82.8Confident152 Ų15255.5 Ų55.571%0.7131%0.308SS*.THydrogen-bonded Turntrans-79.8-24.8179.9-61.4-170.1164.400113.1S79 K132S79-E81 VanDerWaalsContact C-N 3.27Å; S79-E81 PolarHBondContact O-N 3.4Å; E81-K132 IonicContact OE1-NZ 2.75Å; E81-K132 PolarHBondContact OE1-NZ 3.01Å
82S76Confident83.4Confident52 Ų5255.1 Ų55.136%0.36431%0.307SS..  trans-100.1109.9176.854.70000110.7S79 D84 D85 C86S79-S82 PolarHBondContact O-N 3.36Å; S79-S82 VanDerWaalsContact O-O 3.13Å; S79-S82 PolarHBondContact O-OG 3.34Å; S82-D84 VanDerWaalsContact C-N 3.29Å; S82-D84 PolarHBondContact O-N 3.47Å; S82-D85 PolarHBondContact O-N 3.07Å; S82-C86 WeakPolarHBondContact O-CB 3.47Å; S82-C86 PolarHBondContact O-N 3.49Å
83V73.7Confident83.8Confident80 Ų8057.4 Ų57.449%0.48532%0.321SS..SBendtrans-58.8-38.7-175.7179.80000112.7
84D73.3Confident84.5Confident150 Ų15055.2 Ų55.280%0.80231%0.307SS*.THydrogen-bonded Turntrans-72.5-31.4-173.7-63.9-32.5000113.3S82S82-D84 VanDerWaalsContact C-N 3.29Å; S82-D84 PolarHBondContact O-N 3.47Å
85D77Confident85.3Confident114 Ų11451.8 Ų51.861%0.6128%0.283SS*.THydrogen-bonded Turntrans-108.313.5-176.8-69-32.1000113.2S79 S82 K87S79-D85 WeakPolarHBondContact CB-O 3.44Å; S82-D85 PolarHBondContact O-N 3.07Å; D85-K87 PolarHBondContact O-N 3.18Å; D85-K87 VanDerWaalsContact O-N 3.12Å
86C87.1Confident85.8Confident1 Ų152.2 Ų52.21%0.00729%0.285CS..  trans-69.9109.7-174.7-179.70000111.8S82 A88 L89 Q90 W169S82-C86 WeakPolarHBondContact O-CB 3.47Å; S82-C86 PolarHBondContact O-N 3.49Å; C86-A88 VanDerWaalsContact C-N 3.28Å; C86-A88 PolarHBondContact O-N 3.16Å; C86-L89 HydrophobicContact CB-CB 3.95Å; C86-L89 WeakPolarHBondContact O-CB 3.44Å; C86-L89 PolarHBondContact O-N 2.69Å; C86-L89 VanDerWaalsContact O-N 3.12Å; C86-L89 PolarHBondContact SG-N 3.33Å; C86-Q90 PolarHBondContact O-N 3.31Å; C86-Q90 VanDerWaalsContact O-N 3.11Å; C86-W169 HydrophobicContact CB-CH2 4.14Å; C86-W169 HydrophobicContact CB-CZ2 4.32Å
87K89.3Confident86Confident98 Ų9857.6 Ų57.643%0.42631%0.31SS..Hα-helixtrans-61.2-35.2177.8-69.2-176.6-178.8178.60112.9V75 F76 S79 D85 L89 Q90 L91V75-K87 HydrophobicContact CG1-CD 4.25Å; F76-K87 HydrophobicContact CD1-CB 3.86Å; F76-K87 HydrophobicContact CE1-CB 4.13Å; S79-K87 PolarHBondContact OG-N 3.39Å; D85-K87 PolarHBondContact O-N 3.18Å; D85-K87 VanDerWaalsContact O-N 3.12Å; K87-L89 VanDerWaalsContact C-N 3.3Å; K87-L89 PolarHBondContact O-N 2.97Å; K87-Q90 PolarHBondContact O-N 3.3Å; K87-L91 PolarHBondContact O-N 3.25Å
88A90.4Very high86.6Confident0 Ų056.3 Ų56.30%030%0.298CS..Hα-helixtrans-64.7-38.3177.400000111W72 F76 C86 L92 L121 L170W72-A88 HydrophobicContact CH2-CB 4.27Å; W72-A88 HydrophobicContact CZ3-CB 4.29Å; F76-A88 HydrophobicContact CB-CB 4.42Å; F76-A88 HydrophobicContact CD1-CB 3.85Å; F76-A88 HydrophobicContact CE1-CB 4.5Å; F76-A88 HydrophobicContact CG-CB 4.31Å; C86-A88 VanDerWaalsContact C-N 3.28Å; C86-A88 PolarHBondContact O-N 3.16Å; A88-L92 WeakPolarHBondContact O-CB 3.45Å; A88-L92 PolarHBondContact O-N 3.3Å; A88-L121 HydrophobicContact CB-CD1 4.15Å; A88-L121 WeakPolarHBondContact O-CD2 3.24Å; A88-L170 HydrophobicContact CB-CD2 4.2Å
89L91.8Very high87Confident21 Ų2151.5 Ų51.511%0.1126%0.264CS..Hα-helixtrans-66.3-42.4174.9178.162.5000111.4C86 K87 L91 L92 T93 W169 L170 K173C86-L89 HydrophobicContact CB-CB 3.95Å; C86-L89 WeakPolarHBondContact O-CB 3.44Å; C86-L89 PolarHBondContact O-N 2.69Å; C86-L89 VanDerWaalsContact O-N 3.12Å; C86-L89 PolarHBondContact SG-N 3.33Å; K87-L89 VanDerWaalsContact C-N 3.3Å; K87-L89 PolarHBondContact O-N 2.97Å; L89-L91 PolarHBondContact O-N 2.96Å; L89-L92 PolarHBondContact O-N 2.93Å; L89-T93 WeakPolarHBondContact O-CB 3.28Å; L89-T93 PolarHBondContact O-N 3.5Å; L89-T93 PolarHBondContact O-OG1 3.07Å; L89-W169 HydrophobicContact CB-CH2 4.07Å; L89-W169 HydrophobicContact CD1-CZ3 4.36Å; L89-W169 HydrophobicContact CD2-CH2 4.26Å; L89-W169 HydrophobicContact CD2-CZ3 4.24Å; L89-L170 HydrophobicContact CB-CD1 4.27Å; L89-L170 HydrophobicContact CD1-CD1 3.99Å; L89-K173 HydrophobicContact CD1-CD 3.74Å
90Q92Very high87.3Confident114 Ų11455.8 Ų55.853%0.53328%0.283SS..Hα-helixtrans-59.7-45.1177.6-66.9171.81.500111.9C86 K87 T93 F94C86-Q90 PolarHBondContact O-N 3.31Å; C86-Q90 VanDerWaalsContact O-N 3.11Å; K87-Q90 PolarHBondContact O-N 3.3Å; Q90-T93 PolarHBondContact O-N 3.4Å; Q90-F94 WeakPolarHBondContact O-CB 3.43Å; Q90-F94 PolarHBondContact O-N 2.95Å
91L93.4Very high87.5Confident16 Ų1658.8 Ų58.88%0.08431%0.306CS..Hα-helixtrans-65.5-42.9176.9-178.262.1000111.9Y41 V68 F76 K87 L89 F94 I95 L121Y41-L91 HydrophobicContact CD1-CD2 3.93Å; Y41-L91 HydrophobicContact CE1-CD2 4.2Å; V68-L91 HydrophobicContact CG1-CD2 3.79Å; F76-L91 HydrophobicContact CE1-CD2 4.46Å; F76-L91 HydrophobicContact CZ-CD2 4.04Å; K87-L91 PolarHBondContact O-N 3.25Å; L89-L91 PolarHBondContact O-N 2.96Å; L91-F94 PolarHBondContact O-N 2.93Å; L91-I95 HydrophobicContact CD1-CD1 4.36Å; L91-I95 HydrophobicContact CD1-CG1 4.49Å; L91-I95 HydrophobicContact CG-CD1 4.17Å; L91-I95 WeakPolarHBondContact O-CG1 3.45Å; L91-I95 PolarHBondContact O-N 2.97Å; L91-L121 HydrophobicContact CB-CD2 4.37Å; L91-L121 HydrophobicContact CD2-CD2 4.27Å; L91-L121 HydrophobicContact CG-CD2 4.38Å
92L93.9Very high87.9Confident3 Ų354 Ų542%0.01628%0.282CS..Hα-helixtrans-59.5-48.7176-177.963.1000110.9A88 L89 F94 I95 L96 A118 L121 V122 L170 L174A88-L92 WeakPolarHBondContact O-CB 3.45Å; A88-L92 PolarHBondContact O-N 3.3Å; L89-L92 PolarHBondContact O-N 2.93Å; L92-F94 VanDerWaalsContact C-N 3.31Å; L92-F94 PolarHBondContact O-N 3.23Å; L92-I95 PolarHBondContact O-N 2.74Å; L92-L96 HydrophobicContact CD1-CD1 4.25Å; L92-L96 HydrophobicContact CD1-CG 4.36Å; L92-L96 HydrophobicContact CG-CD1 3.99Å; L92-L96 HydrophobicContact CG-CG 4.48Å; L92-L96 VanDerWaalsContact O-CG 3.26Å; L92-L96 WeakPolarHBondContact O-CG 3.26Å; L92-L96 PolarHBondContact O-N 3.45Å; L92-A118 HydrophobicContact CD1-CB 3.74Å; L92-L121 HydrophobicContact CB-CD2 4.07Å; L92-V122 HydrophobicContact CD1-CG2 4.27Å; L92-V122 HydrophobicContact CD2-CG2 4.13Å; L92-L170 HydrophobicContact CD2-CD1 3.71Å; L92-L170 HydrophobicContact CD2-CG 4.02Å; L92-L174 HydrophobicContact CD1-CD1 4.31Å
93T92.9Very high88.1Confident53 Ų5351.6 Ų51.633%0.32526%0.264SS..Hα-helixtrans-59.1-42.6177.7-620000111.2L89 Q90 L96 E97L89-T93 WeakPolarHBondContact O-CB 3.28Å; L89-T93 PolarHBondContact O-N 3.5Å; L89-T93 PolarHBondContact O-OG1 3.07Å; Q90-T93 PolarHBondContact O-N 3.4Å; T93-L96 PolarHBondContact O-N 3.28Å; T93-E97 HydrophobicContact CG2-CG 4.28Å; T93-E97 WeakPolarHBondContact CG2-OE1 3.34Å; T93-E97 WeakPolarHBondContact O-CB 3.37Å; T93-E97 WeakPolarHBondContact O-CG 3.37Å; T93-E97 PolarHBondContact O-N 3.25Å
94F94.4Very high88.6Confident53 Ų5351.6 Ų51.623%0.23226%0.258CS..Hα-helixtrans-59.9-47.7175.2172.9-90.9000112.7T45 L48 T49 Q90 L91 L92 L96 E97 W98T45-F94 HydrophobicContact CG2-CD1 3.85Å; T45-F94 HydrophobicContact CG2-CD2 4.5Å; T45-F94 HydrophobicContact CG2-CE1 3.58Å; T45-F94 HydrophobicContact CG2-CE2 4.26Å; T45-F94 HydrophobicContact CG2-CG 4.3Å; T45-F94 HydrophobicContact CG2-CZ 3.8Å; L48-F94 HydrophobicContact CB-CE1 4.31Å; L48-F94 HydrophobicContact CB-CZ 4.37Å; L48-F94 HydrophobicContact CD1-CE1 3.82Å; T49-F94 HydrophobicContact CG2-CE2 4Å; T49-F94 HydrophobicContact CG2-CZ 3.92Å; Q90-F94 WeakPolarHBondContact O-CB 3.43Å; Q90-F94 PolarHBondContact O-N 2.95Å; L91-F94 PolarHBondContact O-N 2.93Å; L92-F94 VanDerWaalsContact C-N 3.31Å; L92-F94 PolarHBondContact O-N 3.23Å; F94-L96 VanDerWaalsContact C-N 3.28Å; F94-L96 PolarHBondContact O-N 3.23Å; F94-E97 PolarHBondContact O-N 2.95Å; F94-W98 VanDerWaalsContact O-CB 3.3Å; F94-W98 WeakPolarHBondContact O-CB 3.47Å; F94-W98 PolarHBondContact O-N 2.73Å
95I93.9Very high89.2Confident1 Ų150.9 Ų50.91%0.00525%0.25CC..Hα-helixtrans-62.3-40179.4-65.5168.9000110.4L91 L92 S99 I114 A117 A118L91-I95 HydrophobicContact CD1-CD1 4.36Å; L91-I95 HydrophobicContact CD1-CG1 4.49Å; L91-I95 HydrophobicContact CG-CD1 4.17Å; L91-I95 WeakPolarHBondContact O-CG1 3.45Å; L91-I95 PolarHBondContact O-N 2.97Å; L92-I95 PolarHBondContact O-N 2.74Å; I95-S99 WeakPolarHBondContact O-CB 3.48Å; I95-S99 PolarHBondContact O-N 2.8Å; I95-I114 HydrophobicContact CG2-CG2 4.14Å; I95-A117 HydrophobicContact CD1-CB 4.47Å; I95-A118 HydrophobicContact CG2-CB 4.09Å
96L92.4Very high89.6Confident16 Ų1646.1 Ų46.18%0.08423%0.225CC..Hα-helixtrans-68.1-44.6178.5-66.4175.4000112.1L92 T93 F94 W98 S99 Q100 L174 I210L92-L96 HydrophobicContact CD1-CD1 4.25Å; L92-L96 HydrophobicContact CD1-CG 4.36Å; L92-L96 HydrophobicContact CG-CD1 3.99Å; L92-L96 HydrophobicContact CG-CG 4.48Å; L92-L96 VanDerWaalsContact O-CG 3.26Å; L92-L96 WeakPolarHBondContact O-CG 3.26Å; L92-L96 PolarHBondContact O-N 3.45Å; T93-L96 PolarHBondContact O-N 3.28Å; F94-L96 VanDerWaalsContact C-N 3.28Å; F94-L96 PolarHBondContact O-N 3.23Å; L96-W98 VanDerWaalsContact C-N 3.35Å; L96-W98 PolarHBondContact O-N 3.21Å; L96-S99 PolarHBondContact O-N 3.13Å; L96-S99 VanDerWaalsContact O-N 3.17Å; L96-S99 PolarHBondContact O-OG 3.01Å; L96-Q100 WeakPolarHBondContact O-CG 3.38Å; L96-Q100 PolarHBondContact O-N 3.26Å; L96-L174 HydrophobicContact CD1-CD1 4.18Å; L96-L174 HydrophobicContact CD2-CD1 4.04Å; L96-I210 HydrophobicContact CD2-CD1 3.82Å; L96-I210 HydrophobicContact CD2-CG1 4.44Å
97E92.4Very high89.7Confident117 Ų11746.8 Ų46.855%0.54723%0.232SC..Hα-helixtrans-63.3-39.9175.2-74.4177-179.500112.3T93 F94 S99 Q100 S101T93-E97 HydrophobicContact CG2-CG 4.28Å; T93-E97 WeakPolarHBondContact CG2-OE1 3.34Å; T93-E97 WeakPolarHBondContact O-CB 3.37Å; T93-E97 WeakPolarHBondContact O-CG 3.37Å; T93-E97 PolarHBondContact O-N 3.25Å; F94-E97 PolarHBondContact O-N 2.95Å; E97-S99 VanDerWaalsContact C-N 3.33Å; E97-Q100 PolarHBondContact O-N 3.37Å; E97-S101 PolarHBondContact O-N 2.78Å; E97-S101 VanDerWaalsContact O-N 3.13Å; E97-S101 PolarHBondContact O-OG 3.23Å
98W93.1Very high89.6Confident11 Ų1146.1 Ų46.14%0.04224%0.238CC..Hα-helixtrans-60.5-44.4171.9176.788.5000111.1L48 F94 L96 Q100 S101 R102 G103 I114L48-W98 HydrophobicContact CD2-CD2 4.46Å; L48-W98 HydrophobicContact CD2-CZ2 4.14Å; L48-W98 PolarHBondContact O-NE1 3.18Å; F94-W98 VanDerWaalsContact O-CB 3.3Å; F94-W98 WeakPolarHBondContact O-CB 3.47Å; F94-W98 PolarHBondContact O-N 2.73Å; L96-W98 VanDerWaalsContact C-N 3.35Å; L96-W98 PolarHBondContact O-N 3.21Å; W98-Q100 VanDerWaalsContact C-N 3.29Å; W98-Q100 PolarHBondContact O-N 3.26Å; W98-S101 PolarHBondContact O-N 2.93Å; W98-S101 PolarHBondContact O-OG 3.04Å; W98-R102 HydrophobicContact CZ2-CB 4.49Å; W98-R102 PolarHBondContact O-N 2.9Å; W98-G103 PolarHBondContact O-N 3.48Å; W98-I114 HydrophobicContact CE3-CG2 3.89Å; W98-I114 HydrophobicContact CH2-CB 4.44Å; W98-I114 HydrophobicContact CH2-CD1 3.35Å; W98-I114 HydrophobicContact CH2-CG1 4.48Å; W98-I114 HydrophobicContact CH2-CG2 4.3Å; W98-I114 HydrophobicContact CZ2-CD1 3.83Å; W98-I114 HydrophobicContact CZ3-CB 4.1Å; W98-I114 HydrophobicContact CZ3-CD1 3.87Å; W98-I114 HydrophobicContact CZ3-CG2 3.67Å
99S90.3Very high89.6Confident1 Ų149.1 Ų49.11%0.00726%0.263CS..Hα-helixtrans-63.3-35-179.680.80000112.7I95 L96 E97 G103I95-S99 WeakPolarHBondContact O-CB 3.48Å; I95-S99 PolarHBondContact O-N 2.8Å; L96-S99 PolarHBondContact O-N 3.13Å; L96-S99 VanDerWaalsContact O-N 3.17Å; L96-S99 PolarHBondContact O-OG 3.01Å; E97-S99 VanDerWaalsContact C-N 3.33Å; S99-G103 VanDerWaalsContact O-CA 3.31Å; S99-G103 WeakPolarHBondContact O-CA 3.46Å; S99-G103 PolarHBondContact O-N 3.38Å; S99-G103 VanDerWaalsContact O-N 3.15Å
100Q88.2Confident89.5Confident101 Ų10148.2 Ų48.247%0.47226%0.258SS..Hα-helixtrans-72.1-34.9177.2-72.117914.900112.9L96 E97 W98 H177 L206L96-Q100 WeakPolarHBondContact O-CG 3.38Å; L96-Q100 PolarHBondContact O-N 3.26Å; E97-Q100 PolarHBondContact O-N 3.37Å; W98-Q100 VanDerWaalsContact C-N 3.29Å; W98-Q100 PolarHBondContact O-N 3.26Å; Q100-H177 PolarHBondContact NE2-CE1 3.5Å; Q100-H177 VanDerWaalsContact NE2-CE1 3.26Å; Q100-H177 PolarHBondContact NE2-NE2 2.76Å; Q100-L206 HydrophobicContact CB-CD2 4.17Å; Q100-L206 HydrophobicContact CG-CD2 3.45Å; Q100-L206 VanDerWaalsContact CG-CD2 3.45Å
101S86.7Confident89.6Confident81 Ų8143.7 Ų43.757%0.56624%0.236SC*.Hα-helixtrans-88.4-48.2-175.953.10000113.1E97 W98E97-S101 PolarHBondContact O-N 2.78Å; E97-S101 VanDerWaalsContact O-N 3.13Å; E97-S101 PolarHBondContact O-OG 3.23Å; W98-S101 PolarHBondContact O-N 2.93Å; W98-S101 PolarHBondContact O-OG 3.04Å
102R84.3Confident89.5Confident52 Ų5244.6 Ų44.620%0.19624%0.24CC..Hα-helixtrans-118.3-6.6-171.4-57.5-162.773.2-157.1-1.3114.6L48 T49 S51 N52 W98 F104 E105L48-R102 PolarHBondContact O-NH1 3.07Å; T49-R102 PolarHBondContact O-NH1 2.93Å; S51-R102 PolarHBondContact O-NH1 3.42Å; N52-R102 PolarHBondContact OD1-NH2 3Å; W98-R102 HydrophobicContact CZ2-CB 4.49Å; W98-R102 PolarHBondContact O-N 2.9Å; R102-F104 PolarHBondContact O-N 3.2Å; R102-F104 VanDerWaalsContact O-N 3.1Å; R102-E105 IonicContact CZ-OE2 2.87Å; R102-E105 IonicContact NE-OE2 3.32Å; R102-E105 PolarHBondContact NE-OE2 3.11Å; R102-E105 VanDerWaalsContact NE-OE2 3.1Å; R102-E105 IonicContact NH2-OE2 3.48Å; R102-E105 PolarHBondContact NH2-OE2 3.23Å; R102-E105 WeakPolarHBondContact O-CB 3.38Å; R102-E105 PolarHBondContact O-N 3.11Å
103G79Confident89.3Confident0 Ų047 Ų470%025%0.249CC..THydrogen-bonded Turntrans-59.1-28.4-173.900000114.5W98 S99 C106 R111W98-G103 PolarHBondContact O-N 3.48Å; S99-G103 VanDerWaalsContact O-CA 3.31Å; S99-G103 WeakPolarHBondContact O-CA 3.46Å; S99-G103 PolarHBondContact O-N 3.38Å; S99-G103 VanDerWaalsContact O-N 3.15Å; G103-C106 PolarHBondContact O-SG 3.42Å; G103-R111 WeakPolarHBondContact O-CD 3.48Å; G103-R111 PolarHBondContact O-NH1 3.47Å
104F84.7Confident89.4Confident81 Ų8144.5 Ų44.536%0.35523%0.234SC..THydrogen-bonded Turntrans-84.7-11.2176.2-69.2-83000114.2R102 K202 L205 L206 F209R102-F104 PolarHBondContact O-N 3.2Å; R102-F104 VanDerWaalsContact O-N 3.1Å; F104-K202 HydrophobicContact CE1-CG 4.31Å; F104-K202 HydrophobicContact CE2-CB 4.17Å; F104-K202 HydrophobicContact CZ-CB 4Å; F104-K202 HydrophobicContact CZ-CG 4.25Å; F104-K202 VanDerWaalsContact CZ-O 3.25Å; F104-K202 WeakPolarHBondContact CZ-O 3.2Å; F104-L205 HydrophobicContact CE1-CB 4.43Å; F104-L205 HydrophobicContact CZ-CB 4.28Å; F104-L206 HydrophobicContact CE2-CB 4.32Å; F104-L206 HydrophobicContact CZ-CB 4.33Å; F104-F209 AromaticContact CE1-CE2 3.82Å; F104-F209 HydrophobicContact CE1-CE2 3.82Å; F104-F209 HydrophobicContact CZ-CE2 4.12Å
105E85.1Confident89.4Confident135 Ų13542.1 Ų42.163%0.63122%0.223SC*.THydrogen-bonded Turntrans-84.1-23.6179.1-57.9-178.3163.100112.5R102R102-E105 IonicContact CZ-OE2 2.87Å; R102-E105 IonicContact NE-OE2 3.32Å; R102-E105 PolarHBondContact NE-OE2 3.11Å; R102-E105 VanDerWaalsContact NE-OE2 3.1Å; R102-E105 IonicContact NH2-OE2 3.48Å; R102-E105 PolarHBondContact NH2-OE2 3.23Å; R102-E105 WeakPolarHBondContact O-CB 3.38Å; R102-E105 PolarHBondContact O-N 3.11Å
106C86.7Confident89.2Confident13 Ų1342.4 Ų42.49%0.08823%0.225CC..SBendtrans-93.6158.1-178.668.60000113.1L57 G103L57-C106 HydrophobicContact CD1-CB 3.97Å; G103-C106 PolarHBondContact O-SG 3.42Å
107G88Confident89.2Confident15 Ų1541.7 Ų41.716%0.15522%0.222CC..  trans-58.8148.2174.800000113D54 A109 A110 R111D54-G107 VanDerWaalsContact CG-N 3.33Å; D54-G107 PolarHBondContact OD1-N 2.92Å; D54-G107 PolarHBondContact OD2-N 3.36Å; G107-A109 VanDerWaalsContact C-N 3.29Å; G107-A109 PolarHBondContact O-N 3.36Å; G107-A110 PolarHBondContact O-N 2.87Å; G107-A110 VanDerWaalsContact O-N 3.15Å; G107-R111 PolarHBondContact O-N 3.48Å
108P88.3Confident89.2Confident85 Ų8536.1 Ų36.155%0.55220%0.196SC*.Hα-helixtrans-61.3-33.7-173.820.8-30.8000113.6Q112P108-Q112 WeakPolarHBondContact O-CB 3.29Å; P108-Q112 PolarHBondContact O-N 3.12Å
109A89.5Confident89.1Confident63 Ų6335.7 Ų35.752%0.52120%0.195SC..Hα-helixtrans-67-44.9176.100000112Y58 G107 Q112 R113Y58-A109 HydrophobicContact CD2-CB 4.37Å; G107-A109 VanDerWaalsContact C-N 3.29Å; G107-A109 PolarHBondContact O-N 3.36Å; A109-Q112 PolarHBondContact O-N 3.33Å; A109-R113 PolarHBondContact O-N 3.39Å
110A91Very high89Confident2 Ų235.9 Ų35.92%0.01720%0.196CC..Hα-helixtrans-63.1-46.4176.500000110.8D54 L57 G107 Q112 R113 I114D54-A110 HydrophobicContact CB-CB 4.46Å; D54-A110 WeakPolarHBondContact O-CB 3.43Å; L57-A110 HydrophobicContact CB-CB 3.98Å; G107-A110 PolarHBondContact O-N 2.87Å; G107-A110 VanDerWaalsContact O-N 3.15Å; A110-Q112 PolarHBondContact O-N 2.75Å; A110-R113 PolarHBondContact O-N 2.86Å; A110-I114 WeakPolarHBondContact O-CD1 3.18Å; A110-I114 VanDerWaalsContact O-CG1 3.31Å; A110-I114 WeakPolarHBondContact O-CG1 3.46Å; A110-I114 PolarHBondContact O-N 3.35Å
111R93.3Very high89.2Confident18 Ų1831 Ų317%0.06817%0.174CC..Hα-helixtrans-53-54.7173.9-180172.560.6-138.58.4111.6G103 G107 R113 I114 L115 E278G103-R111 WeakPolarHBondContact O-CD 3.48Å; G103-R111 PolarHBondContact O-NH1 3.47Å; G107-R111 PolarHBondContact O-N 3.48Å; R111-R113 VanDerWaalsContact C-N 3.27Å; R111-R113 PolarHBondContact O-N 3.4Å; R111-I114 PolarHBondContact O-N 3.07Å; R111-L115 HydrophobicContact CG-CD1 3.93Å; R111-L115 HydrophobicContact CG-CG 4.39Å; R111-L115 WeakPolarHBondContact O-CG 3.47Å; R111-L115 PolarHBondContact O-N 2.95Å; R111-E278 IonicContact NH2-OE1 3.4Å
112Q91.2Very high89.5Confident35 Ų3527.2 Ų27.216%0.16415%0.147CC..Hα-helixtrans-61.1-39.3-176.7-169.866.48.100111.1P108 A109 A110 L115 S116 S212 A213 D216P108-Q112 WeakPolarHBondContact O-CB 3.29Å; P108-Q112 PolarHBondContact O-N 3.12Å; A109-Q112 PolarHBondContact O-N 3.33Å; A110-Q112 PolarHBondContact O-N 2.75Å; Q112-L115 PolarHBondContact O-N 3.32Å; Q112-S116 VanDerWaalsContact O-CB 3.3Å; Q112-S116 WeakPolarHBondContact O-CB 3.39Å; Q112-S116 PolarHBondContact O-N 2.91Å; Q112-S212 PolarHBondContact NE2-OG 3.18Å; Q112-A213 VanDerWaalsContact NE2-CA 3.31Å; Q112-D216 PolarHBondContact NE2-OD2 2.89Å
113R91Very high89.7Confident55 Ų5525 Ų2521%0.20814%0.138CC..Hα-helixtrans-69.8-36179.8-161.465.5-174.7146.6-5.6113.3Y58 R62 A109 A110 R111 S116 A117 E217Y58-R113 HydrophobicContact CD2-CB 3.66Å; Y58-R113 HydrophobicContact CD2-CG 4.06Å; Y58-R113 HydrophobicContact CE2-CB 3.74Å; Y58-R113 HydrophobicContact CE2-CG 3.9Å; Y58-R113 HydrophobicContact CG-CB 4.39Å; Y58-R113 HydrophobicContact CG-CG 4.48Å; R62-R113 HydrophobicContact CB-CG 4.27Å; A109-R113 PolarHBondContact O-N 3.39Å; A110-R113 PolarHBondContact O-N 2.86Å; R111-R113 VanDerWaalsContact C-N 3.27Å; R111-R113 PolarHBondContact O-N 3.4Å; R113-S116 PolarHBondContact NH1-OG 3.05Å; R113-S116 WeakPolarHBondContact O-CB 3.49Å; R113-S116 PolarHBondContact O-N 3.46Å; R113-A117 PolarHBondContact O-N 3.1Å; R113-E217 IonicContact NH1-OE1 3.06Å
114I94.1Very high90.1Very high0 Ų025.2 Ų25.20%014%0.139CC..Hα-helixtrans-68.5-41.9174.3-65.6161.4000110.7L48 L57 I95 W98 A110 R111 S116 A117L48-I114 HydrophobicContact CD2-CD1 3.36Å; L48-I114 HydrophobicContact CD2-CG1 3.83Å; L48-I114 HydrophobicContact CD2-CG2 4.02Å; L57-I114 HydrophobicContact CB-CD1 4.1Å; I95-I114 HydrophobicContact CG2-CG2 4.14Å; W98-I114 HydrophobicContact CE3-CG2 3.89Å; W98-I114 HydrophobicContact CH2-CB 4.44Å; W98-I114 HydrophobicContact CH2-CD1 3.35Å; W98-I114 HydrophobicContact CH2-CG1 4.48Å; W98-I114 HydrophobicContact CH2-CG2 4.3Å; W98-I114 HydrophobicContact CZ2-CD1 3.83Å; W98-I114 HydrophobicContact CZ3-CB 4.1Å; W98-I114 HydrophobicContact CZ3-CD1 3.87Å; W98-I114 HydrophobicContact CZ3-CG2 3.67Å; A110-I114 WeakPolarHBondContact O-CD1 3.18Å; A110-I114 VanDerWaalsContact O-CG1 3.31Å; A110-I114 WeakPolarHBondContact O-CG1 3.46Å; A110-I114 PolarHBondContact O-N 3.35Å; R111-I114 PolarHBondContact O-N 3.07Å; I114-S116 VanDerWaalsContact C-N 3.32Å; I114-S116 PolarHBondContact O-N 2.91Å; I114-A117 VanDerWaalsContact O-CB 3.27Å; I114-A117 WeakPolarHBondContact O-CB 3.32Å; I114-A117 PolarHBondContact O-N 3.19Å; I114-A117 VanDerWaalsContact O-N 3.12Å
115L93.9Very high90.4Very high3 Ų321.3 Ų21.32%0.01612%0.122CC..Hα-helixtrans-66-34.6175-67.2179.4000112.3R111 Q112 A117 A118 G119 F209 I210 A213R111-L115 HydrophobicContact CG-CD1 3.93Å; R111-L115 HydrophobicContact CG-CG 4.39Å; R111-L115 WeakPolarHBondContact O-CG 3.47Å; R111-L115 PolarHBondContact O-N 2.95Å; Q112-L115 PolarHBondContact O-N 3.32Å; L115-A117 PolarHBondContact O-N 3.34Å; L115-A118 WeakPolarHBondContact O-CB 3.3Å; L115-A118 PolarHBondContact O-N 2.77Å; L115-G119 PolarHBondContact O-N 3.37Å; L115-G119 VanDerWaalsContact O-N 3.13Å; L115-F209 HydrophobicContact CD1-CB 3.59Å; L115-I210 HydrophobicContact CD1-CG1 4.22Å; L115-I210 HydrophobicContact CD2-CG1 3.89Å; L115-A213 HydrophobicContact CB-CB 3.69Å
116S90.8Very high90.7Very high6 Ų615.2 Ų15.24%0.0429%0.094CC..Hα-helixtrans-59.7-30.7171.6141.90000111.7Q112 R113 I114 A118 G119 A120 E217Q112-S116 VanDerWaalsContact O-CB 3.3Å; Q112-S116 WeakPolarHBondContact O-CB 3.39Å; Q112-S116 PolarHBondContact O-N 2.91Å; R113-S116 PolarHBondContact NH1-OG 3.05Å; R113-S116 WeakPolarHBondContact O-CB 3.49Å; R113-S116 PolarHBondContact O-N 3.46Å; I114-S116 VanDerWaalsContact C-N 3.32Å; I114-S116 PolarHBondContact O-N 2.91Å; S116-A118 VanDerWaalsContact C-N 3.34Å; S116-A118 PolarHBondContact O-N 2.9Å; S116-G119 PolarHBondContact O-N 3.16Å; S116-A120 WeakPolarHBondContact O-CB 3.34Å; S116-A120 PolarHBondContact O-N 2.91Å; S116-E217 VanDerWaalsContact CB-OE1 3.29Å; S116-E217 WeakPolarHBondContact CB-OE1 3.02Å; S116-E217 PolarHBondContact OG-OE1 2.94Å
117A91.9Very high90.7Very high1 Ų114.6 Ų14.61%0.0089%0.09CC..Hα-helixtrans-65-34.7171.500000113.5L64 I95 R113 I114 L115 L121L64-A117 HydrophobicContact CB-CB 3.63Å; I95-A117 HydrophobicContact CD1-CB 4.47Å; R113-A117 PolarHBondContact O-N 3.1Å; I114-A117 VanDerWaalsContact O-CB 3.27Å; I114-A117 WeakPolarHBondContact O-CB 3.32Å; I114-A117 PolarHBondContact O-N 3.19Å; I114-A117 VanDerWaalsContact O-N 3.12Å; L115-A117 PolarHBondContact O-N 3.34Å; A117-L121 WeakPolarHBondContact O-CB 3.48Å; A117-L121 PolarHBondContact O-N 2.87Å
118A92.9Very high90.6Very high1 Ų114.5 Ų14.51%0.0089%0.088CC..Hα-helixtrans-66.9-40.8171.700000111.3L92 I95 L115 S116 L121 V122L92-A118 HydrophobicContact CD1-CB 3.74Å; I95-A118 HydrophobicContact CG2-CB 4.09Å; L115-A118 WeakPolarHBondContact O-CB 3.3Å; L115-A118 PolarHBondContact O-N 2.77Å; S116-A118 VanDerWaalsContact C-N 3.34Å; S116-A118 PolarHBondContact O-N 2.9Å; A118-L121 PolarHBondContact O-N 3.08Å; A118-V122 WeakPolarHBondContact O-CG2 3.47Å; A118-V122 PolarHBondContact O-N 2.88Å; A118-V122 VanDerWaalsContact O-N 3.11Å
119G90.8Very high90.6Very high2 Ų212.7 Ų12.72%0.0217%0.072CC..Hα-helixtrans-60.6-47.9173.300000112.5L115 S116 L121 V122 K123L115-G119 PolarHBondContact O-N 3.37Å; L115-G119 VanDerWaalsContact O-N 3.13Å; S116-G119 PolarHBondContact O-N 3.16Å; G119-L121 PolarHBondContact O-N 3.37Å; G119-V122 PolarHBondContact O-N 3.3Å; G119-K123 VanDerWaalsContact O-CB 3.29Å; G119-K123 WeakPolarHBondContact O-CB 3.16Å; G119-K123 PolarHBondContact O-N 3.04Å
120A88.6Confident90.6Very high4 Ų410 Ų103%0.0335%0.05CC..Hα-helixtrans-60.2-43.3177.400000112.4V68 S116 K123 R124V68-A120 HydrophobicContact CG2-CB 4.13Å; S116-A120 WeakPolarHBondContact O-CB 3.34Å; S116-A120 PolarHBondContact O-N 2.91Å; A120-K123 PolarHBondContact O-N 3.42Å; A120-R124 WeakPolarHBondContact O-CB 3.22Å; A120-R124 PolarHBondContact O-N 2.91Å
121L91.8Very high90.3Very high0 Ų012.3 Ų12.30%06%0.061CC..Hα-helixtrans-60.1-47.5176.6178.567.8000111.5V68 W72 F76 A88 L91 L92 A117 A118 G119 R124 A125V68-L121 HydrophobicContact CB-CB 4.32Å; V68-L121 HydrophobicContact CB-CD1 3.81Å; V68-L121 HydrophobicContact CG1-CB 4.34Å; V68-L121 HydrophobicContact CG1-CD1 3.78Å; V68-L121 HydrophobicContact CG2-CB 4.14Å; W72-L121 HydrophobicContact CE3-CD1 4.47Å; W72-L121 HydrophobicContact CZ3-CD1 3.86Å; F76-L121 HydrophobicContact CE2-CD1 4.42Å; F76-L121 HydrophobicContact CZ-CD1 4.48Å; A88-L121 HydrophobicContact CB-CD1 4.15Å; A88-L121 WeakPolarHBondContact O-CD2 3.24Å; L91-L121 HydrophobicContact CB-CD2 4.37Å; L91-L121 HydrophobicContact CD2-CD2 4.27Å; L91-L121 HydrophobicContact CG-CD2 4.38Å; L92-L121 HydrophobicContact CB-CD2 4.07Å; A117-L121 WeakPolarHBondContact O-CB 3.48Å; A117-L121 PolarHBondContact O-N 2.87Å; A118-L121 PolarHBondContact O-N 3.08Å; G119-L121 PolarHBondContact O-N 3.37Å; L121-R124 PolarHBondContact O-N 2.83Å; L121-A125 WeakPolarHBondContact O-CB 3.5Å; L121-A125 PolarHBondContact O-N 3.31Å
122V92.6Very high90Very high0 Ų016.9 Ų16.90%08%0.081CC..Hα-helixtrans-69.8-37.8179.4170.80000111.7L92 A118 G119 A125 S126 L170 L171 L174L92-V122 HydrophobicContact CD1-CG2 4.27Å; L92-V122 HydrophobicContact CD2-CG2 4.13Å; A118-V122 WeakPolarHBondContact O-CG2 3.47Å; A118-V122 PolarHBondContact O-N 2.88Å; A118-V122 VanDerWaalsContact O-N 3.11Å; G119-V122 PolarHBondContact O-N 3.3Å; V122-A125 PolarHBondContact O-N 3.47Å; V122-S126 WeakPolarHBondContact O-CB 3.47Å; V122-S126 PolarHBondContact O-N 2.9Å; V122-S126 PolarHBondContact O-OG 3.31Å; V122-L170 HydrophobicContact CG2-CD2 4.18Å; V122-L170 HydrophobicContact CG2-CG 4.15Å; V122-L171 HydrophobicContact CG1-CB 3.52Å; V122-L171 HydrophobicContact CG1-CD1 3.47Å; V122-L171 VanDerWaalsContact CG1-CD1 3.47Å; V122-L171 HydrophobicContact CG1-CG 4.07Å; V122-L174 HydrophobicContact CB-CD2 4.33Å; V122-L174 HydrophobicContact CG1-CD2 4.46Å; V122-L174 HydrophobicContact CG2-CB 4.39Å; V122-L174 HydrophobicContact CG2-CD2 3.88Å
123K89.7Confident89.9Confident5 Ų516.6 Ų16.62%0.0228%0.082CC..Hα-helixtrans-60.7-46.4173.8-170.7179.2-171.9-178.70110.4G119 A120 S126 A127 E217 F218 D223 L227 L237G119-K123 VanDerWaalsContact O-CB 3.29Å; G119-K123 WeakPolarHBondContact O-CB 3.16Å; G119-K123 PolarHBondContact O-N 3.04Å; A120-K123 PolarHBondContact O-N 3.42Å; K123-S126 PolarHBondContact O-N 3.28Å; K123-A127 VanDerWaalsContact O-CB 3.28Å; K123-A127 WeakPolarHBondContact O-CB 3.24Å; K123-A127 PolarHBondContact O-N 3.11Å; K123-E217 WeakPolarHBondContact CD-O 3.34Å; K123-E217 WeakPolarHBondContact CE-O 3.37Å; K123-E217 PolarHBondContact NZ-O 2.99Å; K123-F218 HydrophobicContact CB-CD2 4.34Å; K123-F218 HydrophobicContact CB-CE2 3.73Å; K123-F218 HydrophobicContact CB-CZ 3.91Å; K123-F218 HydrophobicContact CG-CD2 4.38Å; K123-F218 HydrophobicContact CG-CE1 4.21Å; K123-F218 HydrophobicContact CG-CE2 4.06Å; K123-F218 HydrophobicContact CG-CZ 3.98Å; K123-D223 IonicContact NZ-OD2 2.77Å; K123-D223 PolarHBondContact NZ-OD2 3.24Å; K123-L227 HydrophobicContact CD-CD1 4.18Å; K123-L227 HydrophobicContact CG-CD1 4.21Å; K123-L237 HydrophobicContact CG-CD2 4.46Å
124R87.2Confident89.4Confident5 Ų514 Ų142%0.0197%0.072CC..Hα-helixtrans-65.5-39.7176.7-176.362.5-169.7120.5-5.3112.7V69 W72 A120 L121 S126 A127 A128 E131 L227V69-R124 HydrophobicContact CG2-CB 4.39Å; W72-R124 HydrophobicContact CB-CG 3.76Å; W72-R124 HydrophobicContact CD2-CB 4.46Å; W72-R124 HydrophobicContact CD2-CG 3.52Å; W72-R124 HydrophobicContact CE3-CB 4.12Å; W72-R124 HydrophobicContact CE3-CG 3.6Å; W72-R124 HydrophobicContact CG-CG 3.57Å; W72-R124 HydrophobicContact CZ3-CG 4.46Å; A120-R124 WeakPolarHBondContact O-CB 3.22Å; A120-R124 PolarHBondContact O-N 2.91Å; L121-R124 PolarHBondContact O-N 2.83Å; R124-S126 VanDerWaalsContact C-N 3.32Å; R124-S126 PolarHBondContact O-N 3.28Å; R124-A127 VanDerWaalsContact O-CB 3.28Å; R124-A127 WeakPolarHBondContact O-CB 3.32Å; R124-A127 PolarHBondContact O-N 3.47Å; R124-A128 PolarHBondContact O-N 3.48Å; R124-E131 IonicContact CZ-OE1 3.79Å; R124-E131 IonicContact NH1-OE1 3.01Å; R124-E131 PolarHBondContact NH1-OE1 3.41Å; R124-E131 IonicContact NH2-OE1 2.67Å; R124-E131 PolarHBondContact NH2-OE1 2.98Å; R124-L227 HydrophobicContact CB-CD2 4.27Å
125A90.3Very high88.8Confident0 Ų016.4 Ų16.40%09%0.091CC..Hα-helixtrans-60.2-43.7173.700000112.1W72 F80 L121 V122 A128 H129 L170W72-A125 HydrophobicContact CH2-CB 3.34Å; W72-A125 HydrophobicContact CZ2-CB 3.92Å; W72-A125 HydrophobicContact CZ3-CB 4.03Å; F80-A125 HydrophobicContact CE2-CB 3.91Å; F80-A125 HydrophobicContact CZ-CB 4.04Å; L121-A125 WeakPolarHBondContact O-CB 3.5Å; L121-A125 PolarHBondContact O-N 3.31Å; V122-A125 PolarHBondContact O-N 3.47Å; A125-A128 PolarHBondContact O-N 3.12Å; A125-H129 PolarHBondContact O-N 3.32Å; A125-L170 HydrophobicContact CB-CB 4.46Å; A125-L170 HydrophobicContact CB-CD2 3.8Å
126S90.9Very high88.4Confident6 Ų618.7 Ų18.74%0.04211%0.111CC..Hα-helixtrans-67.1-39.1177.7-53.90000111.7V122 K123 R124 H129 A130 C168V122-S126 WeakPolarHBondContact O-CB 3.47Å; V122-S126 PolarHBondContact O-N 2.9Å; V122-S126 PolarHBondContact O-OG 3.31Å; K123-S126 PolarHBondContact O-N 3.28Å; R124-S126 VanDerWaalsContact C-N 3.32Å; R124-S126 PolarHBondContact O-N 3.28Å; S126-H129 WeakPolarHBondContact O-CB 3.42Å; S126-H129 PolarHBondContact O-N 3.03Å; S126-A130 WeakPolarHBondContact O-CB 3.3Å; S126-A130 PolarHBondContact O-N 3.12Å; S126-C168 WeakPolarHBondContact OG-CB 3.15Å
127A86.7Confident88Confident0 Ų020.9 Ų20.90%012%0.119CC..Hα-helixtrans-56.8-52.2171.100000112.2K123 R124 H129 A130 E131 M229 L237K123-A127 VanDerWaalsContact O-CB 3.28Å; K123-A127 WeakPolarHBondContact O-CB 3.24Å; K123-A127 PolarHBondContact O-N 3.11Å; R124-A127 VanDerWaalsContact O-CB 3.28Å; R124-A127 WeakPolarHBondContact O-CB 3.32Å; R124-A127 PolarHBondContact O-N 3.47Å; A127-H129 VanDerWaalsContact C-N 3.25Å; A127-H129 PolarHBondContact O-N 3.48Å; A127-A130 CarbonylContact O-C 3.6Å; A127-A130 WeakPolarHBondContact O-CB 3.47Å; A127-A130 PolarHBondContact O-N 3.25Å; A127-A130 VanDerWaalsContact O-N 3.08Å; A127-E131 WeakPolarHBondContact O-CG 3.45Å; A127-E131 PolarHBondContact O-N 3.21Å; A127-M229 WeakPolarHBondContact CA-SD 3.06Å; A127-M229 HydrophobicContact CB-CE 3.49Å; A127-M229 VanDerWaalsContact CB-CE 3.49Å; A127-M229 HydrophobicContact CB-CG 4.09Å; A127-M229 HydrophobicContact CB-SD 3.15Å; A127-M229 WeakPolarHBondContact CB-SD 3.48Å; A127-L237 HydrophobicContact CB-CD2 4.07Å
128A86.3Confident87Confident14 Ų1425.1 Ų25.112%0.11613%0.134CC..Hα-helixtrans-62.9-32.9178.100000112.6W72 R124 A125 K132W72-A128 HydrophobicContact CZ2-CB 4.24Å; W72-A128 VanDerWaalsContact NE1-CB 3.25Å; R124-A128 PolarHBondContact O-N 3.48Å; A125-A128 PolarHBondContact O-N 3.12Å; A128-K132 PolarHBondContact O-N 3.41Å
129H89.4Confident86.1Confident47 Ų4729.4 Ų29.422%0.21816%0.164CC..Hα-helixtrans-66.5-45.7171.6-167.366.2000111.7A125 S126 A127 E131 K132 V133 P166 C168A125-H129 PolarHBondContact O-N 3.32Å; S126-H129 WeakPolarHBondContact O-CB 3.42Å; S126-H129 PolarHBondContact O-N 3.03Å; A127-H129 VanDerWaalsContact C-N 3.25Å; A127-H129 PolarHBondContact O-N 3.48Å; H129-E131 VanDerWaalsContact C-N 3.3Å; H129-E131 PolarHBondContact O-N 2.96Å; H129-K132 WeakPolarHBondContact O-CB 3.4Å; H129-K132 PolarHBondContact O-N 3.35Å; H129-K132 VanDerWaalsContact O-N 3.15Å; H129-V133 WeakPolarHBondContact O-CG2 3.37Å; H129-V133 PolarHBondContact O-N 2.57Å; H129-V133 VanDerWaalsContact O-N 3.15Å; H129-P166 PolarHBondContact CD2-O 2.87Å; H129-P166 PolarHBondContact NE2-O 2.87Å; H129-C168 HydrophobicContact CB-CB 4.34Å
130A87.9Confident85.1Confident7 Ų733.2 Ų33.26%0.05819%0.187CC..Hα-helixtrans-63-33.7177.100000112.6S126 A127 V133 A134 A233 F236 L237S126-A130 WeakPolarHBondContact O-CB 3.3Å; S126-A130 PolarHBondContact O-N 3.12Å; A127-A130 CarbonylContact O-C 3.6Å; A127-A130 WeakPolarHBondContact O-CB 3.47Å; A127-A130 PolarHBondContact O-N 3.25Å; A127-A130 VanDerWaalsContact O-N 3.08Å; A130-V133 PolarHBondContact O-N 3.21Å; A130-A134 WeakPolarHBondContact O-CB 3.4Å; A130-A134 PolarHBondContact O-N 3.12Å; A130-A233 WeakPolarHBondContact CB-O 3.25Å; A130-F236 HydrophobicContact CB-CB 4.18Å; A130-L237 HydrophobicContact CB-CB 3.93Å
131E85.7Confident83.5Confident50 Ų5042 Ų4223%0.23422%0.224CC..Hα-helixtrans-58.5-45.8171.5-74.1170.6-14400111.9R124 A127 H129 V133 A134 A135 M229 A233R124-E131 IonicContact CZ-OE1 3.79Å; R124-E131 IonicContact NH1-OE1 3.01Å; R124-E131 PolarHBondContact NH1-OE1 3.41Å; R124-E131 IonicContact NH2-OE1 2.67Å; R124-E131 PolarHBondContact NH2-OE1 2.98Å; A127-E131 WeakPolarHBondContact O-CG 3.45Å; A127-E131 PolarHBondContact O-N 3.21Å; H129-E131 VanDerWaalsContact C-N 3.3Å; H129-E131 PolarHBondContact O-N 2.96Å; E131-V133 VanDerWaalsContact C-N 3.32Å; E131-V133 PolarHBondContact O-N 2.91Å; E131-A134 PolarHBondContact O-N 2.97Å; E131-A135 VanDerWaalsContact O-CB 3.27Å; E131-A135 WeakPolarHBondContact O-CB 3.45Å; E131-A135 PolarHBondContact O-N 3.14Å; E131-M229 HydrophobicContact CG-CG 4.25Å; E131-M229 HydrophobicContact CG-SD 4.22Å; E131-M229 WeakPolarHBondContact OE1-CG 3.22Å; E131-A233 HydrophobicContact CB-CB 4.19Å; E131-A233 HydrophobicContact CG-CB 3.6Å
132K87.3Confident81.9Confident114 Ų11448.6 Ų48.650%0.49626%0.258SS..Hα-helixtrans-61.7-41.1176.3-67.8-175.5179.9-174.70111.3E81 A128 H129 A136E81-K132 IonicContact OE1-NZ 2.75Å; E81-K132 PolarHBondContact OE1-NZ 3.01Å; A128-K132 PolarHBondContact O-N 3.41Å; H129-K132 WeakPolarHBondContact O-CB 3.4Å; H129-K132 PolarHBondContact O-N 3.35Å; H129-K132 VanDerWaalsContact O-N 3.15Å; K132-A136 PolarHBondContact O-N 2.93Å
133V87.8Confident79.3Confident29 Ų2956.8 Ų56.818%0.17630%0.302CS..Hα-helixtrans-67.4-46.7178.2-179.60000111.4H129 A130 E131 A135 A136 W137 F236H129-V133 WeakPolarHBondContact O-CG2 3.37Å; H129-V133 PolarHBondContact O-N 2.57Å; H129-V133 VanDerWaalsContact O-N 3.15Å; A130-V133 PolarHBondContact O-N 3.21Å; E131-V133 VanDerWaalsContact C-N 3.32Å; E131-V133 PolarHBondContact O-N 2.91Å; V133-A135 VanDerWaalsContact C-N 3.32Å; V133-A135 PolarHBondContact O-N 3.14Å; V133-A136 WeakPolarHBondContact O-CB 3.4Å; V133-A136 PolarHBondContact O-N 3.34Å; V133-W137 PolarHBondContact O-N 2.97Å; V133-F236 HydrophobicContact CB-CD1 4.47Å; V133-F236 HydrophobicContact CG1-CD1 3.77Å; V133-F236 HydrophobicContact CG1-CE1 3.85Å
134A81.6Confident77.3Confident0 Ų058.9 Ų58.90%033%0.326CS..Hα-helixtrans-64.1-37.1177.800000111.8A130 E131 W137 R138 E232 A233 F236A130-A134 WeakPolarHBondContact O-CB 3.4Å; A130-A134 PolarHBondContact O-N 3.12Å; E131-A134 PolarHBondContact O-N 2.97Å; A134-W137 PolarHBondContact O-N 3.42Å; A134-R138 WeakPolarHBondContact O-CG 3.21Å; A134-R138 PolarHBondContact O-N 3.2Å; A134-E232 HydrophobicContact CB-CB 4.46Å; A134-A233 HydrophobicContact CB-CB 4.25Å; A134-F236 HydrophobicContact CB-CD2 4.08Å; A134-F236 HydrophobicContact CB-CE2 4.36Å; A134-F236 HydrophobicContact CB-CG 4.38Å
135A81.6Confident75Confident50 Ų5067.1 Ų67.141%0.41337%0.37SS..Hα-helixtrans-63.9-43.4173.200000111.9E131 V133 W137 R138 S139E131-A135 VanDerWaalsContact O-CB 3.27Å; E131-A135 WeakPolarHBondContact O-CB 3.45Å; E131-A135 PolarHBondContact O-N 3.14Å; V133-A135 VanDerWaalsContact C-N 3.32Å; V133-A135 PolarHBondContact O-N 3.14Å; A135-W137 VanDerWaalsContact C-N 3.35Å; A135-W137 PolarHBondContact O-N 3.36Å; A135-R138 PolarHBondContact O-N 3.5Å; A135-S139 PolarHBondContact O-N 3.05Å; A135-S139 VanDerWaalsContact O-N 3.15Å
136A84.6Confident72.6Confident52 Ų5273.1 Ų73.143%0.4341%0.406SS..Hα-helixtrans-61-43.9174.300000111.5K132 V133 R138 S139 T140K132-A136 PolarHBondContact O-N 2.93Å; V133-A136 WeakPolarHBondContact O-CB 3.4Å; V133-A136 PolarHBondContact O-N 3.34Å; A136-R138 PolarHBondContact O-N 3Å; A136-S139 PolarHBondContact O-N 3.29Å; A136-S139 PolarHBondContact O-OG 3.45Å; A136-T140 PolarHBondContact O-N 3.47Å; A136-T140 VanDerWaalsContact O-N 3.12Å
137W82.2Confident70Confident52 Ų5277.4 Ų77.420%0.19744%0.436CS..Hα-helixtrans-60-43.6175.5176.184.6000112.7V133 A134 A135 S139 T140 Q155 L157 F236V133-W137 PolarHBondContact O-N 2.97Å; A134-W137 PolarHBondContact O-N 3.42Å; A135-W137 VanDerWaalsContact C-N 3.35Å; A135-W137 PolarHBondContact O-N 3.36Å; W137-S139 PolarHBondContact O-N 2.91Å; W137-T140 PolarHBondContact O-N 2.98Å; W137-T140 PolarHBondContact O-OG1 3.45Å; W137-Q155 HydrophobicContact CH2-CB 3.86Å; W137-Q155 HydrophobicContact CH2-CG 3.79Å; W137-Q155 WeakPolarHBondContact CH2-O 3.35Å; W137-Q155 HydrophobicContact CZ2-CB 4.11Å; W137-Q155 HydrophobicContact CZ2-CG 3.53Å; W137-Q155 HydrophobicContact CZ3-CB 4.37Å; W137-Q155 PolarHBondContact O-OE1 2.65Å; W137-L157 HydrophobicContact CH2-CB 3.96Å; W137-L157 HydrophobicContact CH2-CD1 4.02Å; W137-L157 HydrophobicContact CZ2-CD1 3.96Å; W137-L157 HydrophobicContact CZ3-CB 4.37Å; W137-F236 HydrophobicContact CB-CZ 3.95Å; W137-F236 HydrophobicContact CD2-CE2 4.38Å; W137-F236 HydrophobicContact CD2-CZ 4.13Å; W137-F236 HydrophobicContact CG-CE2 4.45Å; W137-F236 AromaticContact CG-CZ 3.77Å; W137-F236 HydrophobicContact CG-CZ 3.77Å
138R71.5Confident67.6Low90 Ų9085.4 Ų85.434%0.3447%0.473SS..Hα-helixtrans-62.2-28.9174.5-69.8-169.1-158.793.4-14.5112.7A134 A135 A136 E232A134-R138 WeakPolarHBondContact O-CG 3.21Å; A134-R138 PolarHBondContact O-N 3.2Å; A135-R138 PolarHBondContact O-N 3.5Å; A136-R138 PolarHBondContact O-N 3Å; R138-E232 IonicContact CZ-OE1 3.32Å; R138-E232 IonicContact CZ-OE2 3.75Å; R138-E232 IonicContact NE-OE1 3.81Å; R138-E232 PolarHBondContact NE-OE1 3.35Å; R138-E232 IonicContact NH2-OE1 3.23Å; R138-E232 PolarHBondContact NH2-OE1 3.33Å; R138-E232 IonicContact NH2-OE2 2.71Å; R138-E232 PolarHBondContact NH2-OE2 2.95Å
139S74Confident65.1Low90 Ų9090.8 Ų90.863%0.62951%0.505SS*.Hα-helixtrans-84.8-16.8-178.376.20000114.3A135 A136 W137 K141A135-S139 PolarHBondContact O-N 3.05Å; A135-S139 VanDerWaalsContact O-N 3.15Å; A136-S139 PolarHBondContact O-N 3.29Å; A136-S139 PolarHBondContact O-OG 3.45Å; W137-S139 PolarHBondContact O-N 2.91Å; S139-K141 PolarHBondContact O-N 3.22Å; S139-K141 VanDerWaalsContact O-N 3.16Å
140T69.2Low62.7Low83 Ų8394.9 Ų94.951%0.50954%0.536SS..  trans-70.1111179.739.60000111.2A136 W137A136-T140 PolarHBondContact O-N 3.47Å; A136-T140 VanDerWaalsContact O-N 3.12Å; W137-T140 PolarHBondContact O-N 2.98Å; W137-T140 PolarHBondContact O-OG1 3.45Å
141K56.2Low60.2Low187 Ų18798.7 Ų98.781%0.81356%0.562SS**  trans-68.7131.5169.4-73.4-177177.7178.90108.9S139 D143S139-K141 PolarHBondContact O-N 3.22Å; S139-K141 VanDerWaalsContact O-N 3.16Å; K141-D143 PolarHBondContact O-N 2.83Å
142I56.4Low58.2Low140 Ų140102.9 Ų102.972%0.71859%0.585SS**  trans-64.6101.9172.7-59.6172.1000107.4G144I142-G144 PolarHBondContact O-N 3.28Å
143D39.9Very low56.1Low171 Ų171103 Ų10391%0.91460%0.595SS**  trans-70.480.2169.3-85.6-23.3000108.7K141K141-D143 PolarHBondContact O-N 2.83Å
144G46.3Very low54.3Low50 Ų50108.1 Ų108.152%0.51562%0.615SS.*  trans-115.910917700000110.8I142 V146I142-G144 PolarHBondContact O-N 3.28Å; G144-V146 PolarHBondContact O-N 2.69Å
145N38.6Very low53.2Low177 Ų177111.8 Ų111.895%0.94763%0.633SS**  trans-61.468.7167.8-84.6-32000112.2
146V40.5Very low52.3Low127 Ų127115.5 Ų115.577%0.7764%0.644SS**  trans-132.899.3165.8-174.70000107.5G144 H148G144-V146 PolarHBondContact O-N 2.69Å; V146-H148 PolarHBondContact O-N 2.98Å
147S35.7Very low51.5Low96 Ų96114.1 Ų114.167%0.67163%0.629SS**  trans-58.3108.9165.550.90000108.5
148H36.5Very low50.8Low167 Ų167113.7 Ų113.777%0.77364%0.637SS**SBendtrans160.9130.7134.7-76.5-54000110.1V146V146-H148 PolarHBondContact O-N 2.98Å
149T35.2Very low50.8Low127 Ų127113 Ų11378%0.77964%0.643SS**  trans65.4109.5175.654.40000118S151T149-S151 VanDerWaalsContact C-N 3.34Å; T149-S151 PolarHBondContact O-N 3.4Å; T149-S151 VanDerWaalsContact O-N 3.09Å
150P37.1Very low50.9Low134 Ų134110.2 Ų110.287%0.8762%0.622SS**  trans-83.980171.435.3-28.8000108.7L152P150-L152 PolarHBondContact O-N 2.86Å
151S37.4Very low51.5Low87 Ų87107 Ų10761%0.60860%0.603SS**  trans-78.4110.1154.555.80000106.8T149 V153T149-S151 VanDerWaalsContact C-N 3.34Å; T149-S151 PolarHBondContact O-N 3.4Å; T149-S151 VanDerWaalsContact O-N 3.09Å; S151-V153 PolarHBondContact O-N 3.13Å
152L42.3Very low52.5Low137 Ų137105.5 Ų105.572%0.71760%0.604SS**  trans-60.582.8166.6-84.5152.4000108.4P150 F154P150-L152 PolarHBondContact O-N 2.86Å; L152-F154 PolarHBondContact O-N 2.95Å
153V43.3Very low53.9Low117 Ų117104.2 Ų104.271%0.70960%0.598SS**  trans-85.4107171.2-178.50000106S151 Q155S151-V153 PolarHBondContact O-N 3.13Å; V153-Q155 PolarHBondContact O-N 3.16Å
154F50.4Low56Low137 Ų13796.2 Ų96.260%0.60156%0.556SS**  trans-54.7134.1170.3-71.8-82.6000109.3L152 I156L152-F154 PolarHBondContact O-N 2.95Å; F154-I156 PolarHBondContact O-N 2.85Å; F154-I156 VanDerWaalsContact O-N 3.14Å
155Q58.4Low58Low77 Ų7794.4 Ų94.436%0.3654%0.537SS..  trans-70.7109.5-179.6-149.9174.22.300108.5W137 V153W137-Q155 HydrophobicContact CH2-CB 3.86Å; W137-Q155 HydrophobicContact CH2-CG 3.79Å; W137-Q155 WeakPolarHBondContact CH2-O 3.35Å; W137-Q155 HydrophobicContact CZ2-CB 4.11Å; W137-Q155 HydrophobicContact CZ2-CG 3.53Å; W137-Q155 HydrophobicContact CZ3-CB 4.37Å; W137-Q155 PolarHBondContact O-OE1 2.65Å; V153-Q155 PolarHBondContact O-N 3.16Å
156I62.1Low60.5Low127 Ų12789.8 Ų89.865%0.65152%0.517SS*.  trans-91.2126.8178.3-61.5171.2000108.2F154 A158 I301F154-I156 PolarHBondContact O-N 2.85Å; F154-I156 VanDerWaalsContact O-N 3.14Å; I156-A158 VanDerWaalsContact C-N 3.32Å; I156-A158 PolarHBondContact O-N 2.84Å; I156-I301 HydrophobicContact CG2-CD1 3.98Å
157L68.4Low62.7Low23 Ų2386 Ų8612%0.1250%0.495CS..  trans-74.285.9174.9-166.571.7000109.5W137 T159 E232 V235 F236 L300W137-L157 HydrophobicContact CH2-CB 3.96Å; W137-L157 HydrophobicContact CH2-CD1 4.02Å; W137-L157 HydrophobicContact CZ2-CD1 3.96Å; W137-L157 HydrophobicContact CZ3-CB 4.37Å; L157-T159 WeakPolarHBondContact CD1-O 3.08Å; L157-E232 HydrophobicContact CB-CG 4.17Å; L157-E232 HydrophobicContact CD2-CB 4Å; L157-E232 HydrophobicContact CD2-CG 4.17Å; L157-V235 HydrophobicContact CD2-CB 3.77Å; L157-V235 HydrophobicContact CD2-CG1 3.67Å; L157-V235 HydrophobicContact CD2-CG2 4.27Å; L157-F236 HydrophobicContact CD1-CE2 4.07Å; L157-F236 HydrophobicContact CD2-CD2 4.32Å; L157-F236 HydrophobicContact CD2-CE2 4.21Å; L157-L300 HydrophobicContact CD2-CD1 4.15Å; L157-L300 HydrophobicContact CG-CD1 3.98Å
158A66.8Low65.4Low43 Ų4381.8 Ų81.836%0.35547%0.466SS..  trans-84.7-24.918000000113.1I156 L300 I301I156-A158 VanDerWaalsContact C-N 3.32Å; I156-A158 PolarHBondContact O-N 2.84Å; A158-L300 PolarHBondContact O-N 3.13Å; A158-I301 HydrophobicContact CB-CD1 3.85Å
159T71.4Confident68.1Low76 Ų7677.4 Ų77.447%0.46644%0.442SS..SBendtrans-132.8155.9179.163.10000109.6L157 R298L157-T159 WeakPolarHBondContact CD1-O 3.08Å; T159-R298 WeakPolarHBondContact CA-O 3.47Å; T159-R298 WeakPolarHBondContact CB-O 3.25Å; T159-R298 VanDerWaalsContact CG2-O 3.26Å; T159-R298 WeakPolarHBondContact CG2-O 3.4Å
160P76.9Confident70.8Confident31 Ų3171.3 Ų71.320%0.20141%0.405CS..  trans-54145.2170.5-23.133.3000111.2L296 P297 R298P160-L296 HydrophobicContact CG-CB 4.16Å; P160-P297 WeakPolarHBondContact CD-O 3.38Å; P160-P297 VanDerWaalsContact CG-O 3.3Å; P160-P297 WeakPolarHBondContact CG-O 3.31Å; P160-R298 WeakPolarHBondContact CD-O 3.44Å
161P82.3Confident73.5Confident16 Ų1665.2 Ų65.210%0.10437%0.365CS..  trans-70.5133.7179.329-34.5000111.2D163 P164 F236 A239P161-D163 VanDerWaalsContact C-N 3.27Å; P161-D163 PolarHBondContact O-N 2.99Å; P161-P164 HydrophobicContact CG-CB 4.07Å; P161-F236 HydrophobicContact CB-CD1 4.36Å; P161-F236 HydrophobicContact CB-CE1 3.8Å; P161-F236 HydrophobicContact CB-CE2 4.17Å; P161-F236 HydrophobicContact CB-CZ 3.71Å; P161-F236 HydrophobicContact CG-CD1 3.82Å; P161-F236 HydrophobicContact CG-CD2 3.93Å; P161-F236 HydrophobicContact CG-CE1 3.76Å; P161-F236 HydrophobicContact CG-CE2 3.92Å; P161-F236 HydrophobicContact CG-CG 3.91Å; P161-F236 HydrophobicContact CG-CZ 3.83Å; P161-A239 HydrophobicContact CG-CB 4.25Å
162D77.6Confident76.2Confident156 Ų15662.5 Ų62.583%0.83434%0.343SS*.SBendtrans-65.6-29.6177.8-70.3-37.3000113
163D84.2Confident78.7Confident112 Ų11260.3 Ų60.360%0.59933%0.328SS*.  trans-126.695.7171-171.4-2.3000109.3P161 G165P161-D163 VanDerWaalsContact C-N 3.27Å; P161-D163 PolarHBondContact O-N 2.99Å; D163-G165 PolarHBondContact O-N 3.39Å; D163-G165 PolarHBondContact OD1-N 3.05Å; D163-G165 VanDerWaalsContact OD1-N 3.09Å
164P85.4Confident81.1Confident4 Ų454.8 Ų54.83%0.02630%0.295CS..  trans-74.85-18030.6-34.7000113.3P161 F236 A239 R240 Y244P161-P164 HydrophobicContact CG-CB 4.07Å; P164-F236 HydrophobicContact CB-CD1 4.26Å; P164-A239 HydrophobicContact CB-CB 4.12Å; P164-A239 HydrophobicContact CG-CB 4.41Å; P164-R240 HydrophobicContact CB-CB 3.92Å; P164-R240 HydrophobicContact CG-CB 3.87Å; P164-Y244 HydrophobicContact CG-CE2 4.17Å
165G87.3Confident83.3Confident12 Ų1248.3 Ų48.312%0.12427%0.266CS..  trans93.9-175176.100000114.4D163 R240D163-G165 PolarHBondContact O-N 3.39Å; D163-G165 PolarHBondContact OD1-N 3.05Å; D163-G165 VanDerWaalsContact OD1-N 3.09Å; G165-R240 WeakPolarHBondContact O-CD 3.43Å; G165-R240 PolarHBondContact O-NH1 3.37Å
166P90.3Very high85Confident79 Ų7948.8 Ų48.851%0.51327%0.268SS..SBendtrans-70.7156.9-17728.2-32.6000112.8H129H129-P166 PolarHBondContact CD2-O 2.87Å; H129-P166 PolarHBondContact NE2-O 2.87Å
167P88.2Confident86.6Confident49 Ų4944.3 Ų44.332%0.31825%0.245SC..PPolyproline II helixtrans-72148.6179.329.4-33.6000112.3W169 I172 E245P167-W169 PolarHBondContact O-N 3.47Å; P167-I172 HydrophobicContact CB-CD1 3.78Å; P167-I172 HydrophobicContact CB-CG1 3.67Å; P167-I172 HydrophobicContact CG-CD1 4.28Å; P167-I172 HydrophobicContact CG-CG1 4Å; P167-E245 WeakPolarHBondContact CB-OE1 3.45Å
168C92.1Very high87.9Confident7 Ų743.3 Ų43.35%0.04724%0.239CC..PPolyproline II helixtrans-64.9120.3167.2179.70000109.9S126 H129 L170 L171 I172S126-C168 WeakPolarHBondContact OG-CB 3.15Å; H129-C168 HydrophobicContact CB-CB 4.34Å; C168-L170 PolarHBondContact O-N 3.36Å; C168-L171 HydrophobicContact CB-CB 4.18Å; C168-L171 WeakPolarHBondContact O-CB 3.5Å; C168-L171 PolarHBondContact O-N 3.29Å; C168-L171 VanDerWaalsContact O-N 3.12Å; C168-I172 PolarHBondContact O-N 3.4Å; C168-I172 VanDerWaalsContact O-N 3.14Å
169W92.3Very high89.2Confident74 Ų7443.7 Ų43.728%0.2823%0.234SC..Hα-helixtrans-59.6-32.8-176.668.3-94.8000113F80 C86 L89 P167 I172 K173F80-W169 HydrophobicContact CD2-CZ2 4.18Å; F80-W169 AromaticContact CE1-NE1 3.74Å; F80-W169 AromaticContact CE2-CE2 3.96Å; F80-W169 AromaticContact CE2-CZ2 3.91Å; F80-W169 HydrophobicContact CE2-CZ2 3.91Å; F80-W169 AromaticContact CE2-NE1 3.78Å; F80-W169 HydrophobicContact CZ-CZ2 4.44Å; F80-W169 AromaticContact CZ-NE1 3.42Å; C86-W169 HydrophobicContact CB-CH2 4.14Å; C86-W169 HydrophobicContact CB-CZ2 4.32Å; L89-W169 HydrophobicContact CB-CH2 4.07Å; L89-W169 HydrophobicContact CD1-CZ3 4.36Å; L89-W169 HydrophobicContact CD2-CH2 4.26Å; L89-W169 HydrophobicContact CD2-CZ3 4.24Å; P167-W169 PolarHBondContact O-N 3.47Å; W169-I172 PolarHBondContact O-N 3.31Å; W169-K173 HydrophobicContact CZ3-CD 4.42Å; W169-K173 WeakPolarHBondContact O-CB 3.44Å; W169-K173 PolarHBondContact O-N 3.41Å
170L92.8Very high90.2Very high0 Ų045 Ų450%024%0.235CC..Hα-helixtrans-69.4-37.6179.3-16870000111.6F80 A88 L89 L92 V122 A125 C168 K173 L174F80-L170 HydrophobicContact CE2-CB 4.3Å; F80-L170 HydrophobicContact CE2-CD2 4.38Å; A88-L170 HydrophobicContact CB-CD2 4.2Å; L89-L170 HydrophobicContact CB-CD1 4.27Å; L89-L170 HydrophobicContact CD1-CD1 3.99Å; L92-L170 HydrophobicContact CD2-CD1 3.71Å; L92-L170 HydrophobicContact CD2-CG 4.02Å; V122-L170 HydrophobicContact CG2-CD2 4.18Å; V122-L170 HydrophobicContact CG2-CG 4.15Å; A125-L170 HydrophobicContact CB-CB 4.46Å; A125-L170 HydrophobicContact CB-CD2 3.8Å; C168-L170 PolarHBondContact O-N 3.36Å; L170-K173 PolarHBondContact O-N 3.12Å; L170-L174 PolarHBondContact O-N 2.84Å; L170-L174 VanDerWaalsContact O-N 3.12Å
171L94.2Very high90.9Very high5 Ų543.7 Ų43.73%0.02623%0.226CC..Hα-helixtrans-64.6-45.2173.7173.662.8000111.3V122 C168 K173 L174 I175 L214 F218 F241 E245V122-L171 HydrophobicContact CG1-CB 3.52Å; V122-L171 HydrophobicContact CG1-CD1 3.47Å; V122-L171 VanDerWaalsContact CG1-CD1 3.47Å; V122-L171 HydrophobicContact CG1-CG 4.07Å; C168-L171 HydrophobicContact CB-CB 4.18Å; C168-L171 WeakPolarHBondContact O-CB 3.5Å; C168-L171 PolarHBondContact O-N 3.29Å; C168-L171 VanDerWaalsContact O-N 3.12Å; L171-K173 VanDerWaalsContact C-N 3.3Å; L171-K173 PolarHBondContact O-N 2.9Å; L171-L174 PolarHBondContact O-N 3.44Å; L171-I175 HydrophobicContact CD1-CD1 4Å; L171-I175 HydrophobicContact CD1-CG1 4.28Å; L171-I175 HydrophobicContact CG-CD1 3.96Å; L171-I175 WeakPolarHBondContact O-CG1 3.43Å; L171-I175 PolarHBondContact O-N 2.87Å; L171-L214 HydrophobicContact CD1-CD1 4.15Å; L171-L214 HydrophobicContact CD1-CD2 4.36Å; L171-F218 HydrophobicContact CD1-CZ 4.37Å; L171-F218 HydrophobicContact CD2-CZ 4.47Å; L171-F241 HydrophobicContact CD1-CE2 4.4Å; L171-F241 HydrophobicContact CD2-CD2 4Å; L171-F241 HydrophobicContact CD2-CE2 4.42Å; L171-E245 HydrophobicContact CD2-CB 4.49Å; L171-E245 HydrophobicContact CD2-CG 3.97Å
172I94.4Very high91.4Very high30 Ų3043.9 Ų43.915%0.15423%0.226CC..Hα-helixtrans-60.9-42.4177.3-62-56.7000111P167 C168 W169 L174 I175 E176 E245P167-I172 HydrophobicContact CB-CD1 3.78Å; P167-I172 HydrophobicContact CB-CG1 3.67Å; P167-I172 HydrophobicContact CG-CD1 4.28Å; P167-I172 HydrophobicContact CG-CG1 4Å; C168-I172 PolarHBondContact O-N 3.4Å; C168-I172 VanDerWaalsContact O-N 3.14Å; W169-I172 PolarHBondContact O-N 3.31Å; I172-L174 VanDerWaalsContact C-N 3.31Å; I172-L174 PolarHBondContact O-N 3.23Å; I172-I175 PolarHBondContact O-N 3Å; I172-I175 VanDerWaalsContact O-N 3.15Å; I172-E176 HydrophobicContact CG2-CG 4.26Å; I172-E176 WeakPolarHBondContact O-CG 3.47Å; I172-E176 PolarHBondContact O-N 2.91Å; I172-E245 HydrophobicContact CD1-CG 4.02Å
173K93.2Very high91.9Very high91 Ų9140.9 Ų40.940%0.39621%0.207SC..Hα-helixtrans-61.9-37.6177.5-167.2168.9-178.2174.20112.7L89 W169 L170 L171 H177L89-K173 HydrophobicContact CD1-CD 3.74Å; W169-K173 HydrophobicContact CZ3-CD 4.42Å; W169-K173 WeakPolarHBondContact O-CB 3.44Å; W169-K173 PolarHBondContact O-N 3.41Å; L170-K173 PolarHBondContact O-N 3.12Å; L171-K173 VanDerWaalsContact C-N 3.3Å; L171-K173 PolarHBondContact O-N 2.9Å; K173-H177 PolarHBondContact O-N 3.24Å; K173-H177 VanDerWaalsContact O-N 3.09Å
174L94.8Very high91.9Very high2 Ų237.2 Ų37.21%0.0119%0.189CC..Hα-helixtrans-67-43.2173.4-177.962.4000111.5L92 L96 V122 L170 L171 I172 H177 I178 I210 L214L92-L174 HydrophobicContact CD1-CD1 4.31Å; L96-L174 HydrophobicContact CD1-CD1 4.18Å; L96-L174 HydrophobicContact CD2-CD1 4.04Å; V122-L174 HydrophobicContact CB-CD2 4.33Å; V122-L174 HydrophobicContact CG1-CD2 4.46Å; V122-L174 HydrophobicContact CG2-CB 4.39Å; V122-L174 HydrophobicContact CG2-CD2 3.88Å; L170-L174 PolarHBondContact O-N 2.84Å; L170-L174 VanDerWaalsContact O-N 3.12Å; L171-L174 PolarHBondContact O-N 3.44Å; I172-L174 VanDerWaalsContact C-N 3.31Å; I172-L174 PolarHBondContact O-N 3.23Å; L174-H177 WeakPolarHBondContact O-CB 3.46Å; L174-H177 PolarHBondContact O-N 2.97Å; L174-I178 HydrophobicContact CG-CD1 4.22Å; L174-I178 WeakPolarHBondContact O-CG1 3.37Å; L174-I178 PolarHBondContact O-N 3.24Å; L174-I210 HydrophobicContact CD1-CG2 3.84Å; L174-I210 HydrophobicContact CG-CG2 4.47Å; L174-L214 HydrophobicContact CD2-CD1 3.95Å
175I95.7Very high91.9Very high0 Ų037 Ų370%019%0.188CC..Hα-helixtrans-61.8-44.7177.3-68.6169.8000111L171 I172 H177 I178 E179 L214 E245 L249L171-I175 HydrophobicContact CD1-CD1 4Å; L171-I175 HydrophobicContact CD1-CG1 4.28Å; L171-I175 HydrophobicContact CG-CD1 3.96Å; L171-I175 WeakPolarHBondContact O-CG1 3.43Å; L171-I175 PolarHBondContact O-N 2.87Å; I172-I175 PolarHBondContact O-N 3Å; I172-I175 VanDerWaalsContact O-N 3.15Å; I175-H177 VanDerWaalsContact C-N 3.29Å; I175-H177 PolarHBondContact O-N 2.63Å; I175-I178 WeakPolarHBondContact O-CB 3.28Å; I175-I178 PolarHBondContact O-N 3.42Å; I175-E179 HydrophobicContact CG2-CG 4.5Å; I175-E179 WeakPolarHBondContact O-CG 3.36Å; I175-E179 PolarHBondContact O-N 2.93Å; I175-L214 HydrophobicContact CG1-CD2 4.4Å; I175-E245 HydrophobicContact CD1-CB 3.76Å; I175-E245 HydrophobicContact CD1-CG 3.8Å; I175-L249 HydrophobicContact CG1-CD2 4.37Å; I175-L249 HydrophobicContact CG2-CD2 4Å
176E95.2Very high91.5Very high87 Ų8738.8 Ų38.841%0.40720%0.196SC..Hα-helixtrans-59.7-41.2175.6-73.3172.7172.300111.2I172 E179 E180I172-E176 HydrophobicContact CG2-CG 4.26Å; I172-E176 WeakPolarHBondContact O-CG 3.47Å; I172-E176 PolarHBondContact O-N 2.91Å; E176-E179 WeakPolarHBondContact O-CB 3.38Å; E176-E179 PolarHBondContact O-N 2.87Å; E176-E180 WeakPolarHBondContact O-CG 3.4Å; E176-E180 PolarHBondContact O-N 3.49Å
177H94.7Very high90.8Very high34 Ų3441.7 Ų41.716%0.15720%0.203CC..Hα-helixtrans-64-41.6175.1-168.159.5000112.9Q100 K173 L174 I175 E179 E180 L181Q100-H177 PolarHBondContact NE2-CE1 3.5Å; Q100-H177 VanDerWaalsContact NE2-CE1 3.26Å; Q100-H177 PolarHBondContact NE2-NE2 2.76Å; K173-H177 PolarHBondContact O-N 3.24Å; K173-H177 VanDerWaalsContact O-N 3.09Å; L174-H177 WeakPolarHBondContact O-CB 3.46Å; L174-H177 PolarHBondContact O-N 2.97Å; I175-H177 VanDerWaalsContact C-N 3.29Å; I175-H177 PolarHBondContact O-N 2.63Å; H177-E179 VanDerWaalsContact C-N 3.31Å; H177-E179 PolarHBondContact O-N 3.35Å; H177-E180 IonicContact ND1-OE2 3.34Å; H177-E180 PolarHBondContact O-N 2.95Å; H177-L181 WeakPolarHBondContact O-CG 3.39Å; H177-L181 PolarHBondContact O-N 3.14Å
178I95Very high89.8Confident2 Ų240.8 Ų40.81%0.0120%0.198CC..Hα-helixtrans-59.7-45.1174.1-67.9165000110L174 I175 L181 I182 I210 L211 L214L174-I178 HydrophobicContact CG-CD1 4.22Å; L174-I178 WeakPolarHBondContact O-CG1 3.37Å; L174-I178 PolarHBondContact O-N 3.24Å; I175-I178 WeakPolarHBondContact O-CB 3.28Å; I175-I178 PolarHBondContact O-N 3.42Å; I178-L181 PolarHBondContact O-N 2.67Å; I178-I182 HydrophobicContact CG2-CD1 3.66Å; I178-I182 HydrophobicContact CG2-CG1 4.46Å; I178-I182 WeakPolarHBondContact O-CG1 3.37Å; I178-I182 PolarHBondContact O-N 3.09Å; I178-I210 HydrophobicContact CD1-CG2 3.85Å; I178-I210 HydrophobicContact CG1-CB 4.15Å; I178-I210 HydrophobicContact CG1-CG2 3.69Å; I178-L211 HydrophobicContact CD1-CB 4.49Å; I178-L211 HydrophobicContact CG2-CB 4.07Å; I178-L214 HydrophobicContact CD1-CD2 4.04Å
179E94.1Very high88.6Confident50 Ų5047.4 Ų47.423%0.23423%0.233CC..Hα-helixtrans-61.8-44.6177.9-72.1176.3170.600112I175 E176 H177 L181 I182 Q183 R248 N252I175-E179 HydrophobicContact CG2-CG 4.5Å; I175-E179 WeakPolarHBondContact O-CG 3.36Å; I175-E179 PolarHBondContact O-N 2.93Å; E176-E179 WeakPolarHBondContact O-CB 3.38Å; E176-E179 PolarHBondContact O-N 2.87Å; H177-E179 VanDerWaalsContact C-N 3.31Å; H177-E179 PolarHBondContact O-N 3.35Å; E179-L181 VanDerWaalsContact C-N 3.27Å; E179-L181 PolarHBondContact O-N 3.41Å; E179-I182 PolarHBondContact O-N 2.98Å; E179-Q183 VanDerWaalsContact O-CB 3.29Å; E179-Q183 WeakPolarHBondContact O-CB 3.49Å; E179-Q183 PolarHBondContact O-N 3Å; E179-R248 VanDerWaalsContact CD-NH2 3.31Å; E179-R248 IonicContact OE1-CZ 2.77Å; E179-R248 IonicContact OE1-NE 3.66Å; E179-R248 PolarHBondContact OE1-NE 3.39Å; E179-R248 IonicContact OE1-NH2 2.91Å; E179-R248 PolarHBondContact OE1-NH2 2.86Å; E179-R248 IonicContact OE2-CZ 3.39Å; E179-R248 IonicContact OE2-NE 3.4Å; E179-R248 IonicContact OE2-NH2 2.97Å; E179-R248 PolarHBondContact OE2-NH2 2.84Å; E179-N252 WeakPolarHBondContact CG-ND2 3.39Å; E179-N252 PolarHBondContact OE1-ND2 3.01Å
180E93.4Very high87.5Confident105 Ų10544 Ų4449%0.49122%0.22SC..Hα-helixtrans-61.4-33.3175.9-74.6176.5177.300113.2E176 H177E176-E180 WeakPolarHBondContact O-CG 3.4Å; E176-E180 PolarHBondContact O-N 3.49Å; H177-E180 IonicContact ND1-OE2 3.34Å; H177-E180 PolarHBondContact O-N 2.95Å
181L92.2Very high86Confident3 Ų348.4 Ų48.42%0.01625%0.251CS..Hα-helixtrans-75.7-35.3177-71.2175.6000112.2H177 I178 E179 P184 R203 G204 L206 I210H177-L181 WeakPolarHBondContact O-CG 3.39Å; H177-L181 PolarHBondContact O-N 3.14Å; I178-L181 PolarHBondContact O-N 2.67Å; E179-L181 VanDerWaalsContact C-N 3.27Å; E179-L181 PolarHBondContact O-N 3.41Å; L181-P184 WeakPolarHBondContact O-CD 3.22Å; L181-R203 HydrophobicContact CD2-CG 3.69Å; L181-G204 WeakPolarHBondContact O-CA 3.06Å; L181-L206 HydrophobicContact CD1-CD2 4.29Å; L181-L206 HydrophobicContact CD1-CG 4.27Å; L181-I210 HydrophobicContact CD1-CD1 3.71Å
182I91.5Very high84.4Confident19 Ų1949.8 Ų49.810%0.09727%0.267CS..Hα-helixtrans-83.7-29.7-179.2-66.9174.3000112I178 E179 P184 L185 T186 L208 L211 L256I178-I182 HydrophobicContact CG2-CD1 3.66Å; I178-I182 HydrophobicContact CG2-CG1 4.46Å; I178-I182 WeakPolarHBondContact O-CG1 3.37Å; I178-I182 PolarHBondContact O-N 3.09Å; E179-I182 PolarHBondContact O-N 2.98Å; I182-P184 VanDerWaalsContact C-N 3.31Å; I182-P184 VanDerWaalsContact O-N 3.1Å; I182-L185 WeakPolarHBondContact O-CB 3.13Å; I182-L185 PolarHBondContact O-N 3.46Å; I182-T186 HydrophobicContact CG2-CG2 4.47Å; I182-L208 HydrophobicContact CD1-CD2 3.98Å; I182-L208 HydrophobicContact CD1-CG 4.4Å; I182-L211 HydrophobicContact CD1-CD2 4.4Å; I182-L256 HydrophobicContact CG2-CD1 4.19Å; I182-L256 HydrophobicContact CG2-CD2 3.8Å; I182-L256 HydrophobicContact CG2-CG 4.48Å
183Q89.2Confident82.4Confident93 Ų9355.3 Ų55.344%0.43530%0.295SS..Hα-helixtrans-47.1-42.4-175.5-175179.124.600114.6E179 L185 T186 Q187E179-Q183 VanDerWaalsContact O-CB 3.29Å; E179-Q183 WeakPolarHBondContact O-CB 3.49Å; E179-Q183 PolarHBondContact O-N 3Å; Q183-L185 VanDerWaalsContact C-N 3.26Å; Q183-L185 PolarHBondContact O-N 3.43Å; Q183-T186 PolarHBondContact O-N 3.4Å; Q183-T186 PolarHBondContact O-OG1 3.16Å; Q183-Q187 HydrophobicContact CG-CG 4.45Å; Q183-Q187 VanDerWaalsContact NE2-NE2 3.15Å; Q183-Q187 PolarHBondContact O-N 3.01Å
184P84.6Confident80.6Confident36 Ų3656.6 Ų56.623%0.23431%0.306CS..Hα-helixtrans-54.8-39.2176.8-27.236.9000113.6L181 I182 T186 Q187 S188 I200L181-P184 WeakPolarHBondContact O-CD 3.22Å; I182-P184 VanDerWaalsContact C-N 3.31Å; I182-P184 VanDerWaalsContact O-N 3.1Å; P184-T186 PolarHBondContact O-N 2.94Å; P184-Q187 PolarHBondContact O-N 3.37Å; P184-S188 WeakPolarHBondContact O-CB 3.3Å; P184-S188 PolarHBondContact O-N 3.41Å; P184-S188 VanDerWaalsContact O-N 3.16Å; P184-S188 PolarHBondContact O-OG 3.39Å; P184-I200 HydrophobicContact CB-CG2 3.89Å
185L84Confident78.8Confident0 Ų063.7 Ų63.70%034%0.344CS..Hα-helixtrans-65.5-26.3178-66174.9000112.8I182 Q183 L190 I200 L201 L256 V279I182-L185 WeakPolarHBondContact O-CB 3.13Å; I182-L185 PolarHBondContact O-N 3.46Å; Q183-L185 VanDerWaalsContact C-N 3.26Å; Q183-L185 PolarHBondContact O-N 3.43Å; L185-L190 HydrophobicContact CD2-CD1 4.33Å; L185-I200 HydrophobicContact CD2-CG2 4.18Å; L185-L201 HydrophobicContact CD2-CD2 4.15Å; L185-L256 HydrophobicContact CB-CD1 3.65Å; L185-L256 HydrophobicContact CD1-CD1 4.27Å; L185-V279 HydrophobicContact CD1-CG1 4.25Å
186T79.4Confident77.2Confident49 Ų4970.2 Ų70.230%0.30138%0.379SS..Hα-helixtrans-83.5-24.4-178.9640000113.5I182 Q183 P184 L256I182-T186 HydrophobicContact CG2-CG2 4.47Å; Q183-T186 PolarHBondContact O-N 3.4Å; Q183-T186 PolarHBondContact O-OG1 3.16Å; P184-T186 PolarHBondContact O-N 2.94Å; T186-L256 HydrophobicContact CG2-CB 4.45Å; T186-L256 HydrophobicContact CG2-CD1 3.94Å
187Q75.5Confident76.2Confident139 Ų13967.2 Ų67.265%0.6537%0.365SS*.Hα-helixtrans-108.7-21.8-170.8-65.1-176.9-8.700114.2Q183 P184Q183-Q187 HydrophobicContact CG-CG 4.45Å; Q183-Q187 VanDerWaalsContact NE2-NE2 3.15Å; Q183-Q187 PolarHBondContact O-N 3.01Å; P184-Q187 PolarHBondContact O-N 3.37Å
188S67.4Low75.4Confident30 Ų3070.9 Ų70.921%0.2138%0.382CS..SBendtrans-83.4140.4-176.959.80000112.9P184 L190P184-S188 WeakPolarHBondContact O-CB 3.3Å; P184-S188 PolarHBondContact O-N 3.41Å; P184-S188 VanDerWaalsContact O-N 3.16Å; P184-S188 PolarHBondContact O-OG 3.39Å; S188-L190 PolarHBondContact O-N 3.21Å; S188-L190 WeakPolarHBondContact OG-CG 3.27Å
189D66.1Low74.9Confident147 Ų14774.8 Ų74.879%0.78641%0.408SS*.  trans-68.593.9167-77.8-26.9000109.9S191D189-S191 PolarHBondContact O-N 2.97Å
190L69.4Low74.5Confident3 Ų374.9 Ų74.92%0.01641%0.409CS..  trans-82.39-176.6-70.4166.2000114L185 S188 G192 Q197 L260 C263 W264L185-L190 HydrophobicContact CD2-CD1 4.33Å; S188-L190 PolarHBondContact O-N 3.21Å; S188-L190 WeakPolarHBondContact OG-CG 3.27Å; L190-G192 VanDerWaalsContact C-N 3.3Å; L190-G192 PolarHBondContact O-N 3.4Å; L190-Q197 PolarHBondContact O-NE2 2.94Å; L190-L260 HydrophobicContact CD1-CD2 4.17Å; L190-C263 HydrophobicContact CB-CB 4.02Å; L190-W264 HydrophobicContact CD1-CZ2 4.23Å
191S62.8Low74.2Confident91 Ų9170.4 Ų70.464%0.63639%0.389SS*.  trans-75.3-7.1-169.661.30000115.5D189D189-S191 PolarHBondContact O-N 2.97Å
192G59.5Low74Confident35 Ų3574.5 Ų74.536%0.36141%0.406SS..SBendtrans-103.2138-177.700000114.6L190 N194 Q197L190-G192 VanDerWaalsContact C-N 3.3Å; L190-G192 PolarHBondContact O-N 3.4Å; G192-N194 VanDerWaalsContact C-N 3.26Å; G192-N194 PolarHBondContact O-N 3Å; G192-N194 VanDerWaalsContact O-N 3.09Å; G192-Q197 PolarHBondContact O-NE2 3.43Å
193I52.8Low73.9Confident145 Ų14579.7 Ų79.774%0.74443%0.425SS*.  trans-84.647.7-179-45.4173.1000111.8
194N56.2Low74Confident118 Ų11875.3 Ų75.363%0.63140%0.404SS*.  trans-109.4141-179.2-73-7.6000111.7G192 D196 Q197G192-N194 VanDerWaalsContact C-N 3.26Å; G192-N194 PolarHBondContact O-N 3Å; G192-N194 VanDerWaalsContact O-N 3.09Å; N194-D196 PolarHBondContact O-N 3.4Å; N194-Q197 PolarHBondContact O-N 3.37Å
195N56.3Low74.3Confident152 Ų15273.9 Ų73.981%0.81340%0.395SS*.G310 helixtrans-55-11.6-178.6-68.3-20.7000114.9Q197 E198N195-Q197 PolarHBondContact O-N 2.95Å; N195-E198 PolarHBondContact O-N 2.88Å
196D61.7Low74.7Confident136 Ų13674.1 Ų74.173%0.72740%0.396SS*.G310 helixtrans-69.5-8.3178.3-60.5-32.7000113.8N194N194-D196 PolarHBondContact O-N 3.4Å
197Q73.8Confident75.4Confident25 Ų2571.8 Ų71.812%0.11738%0.382CS..G310 helixtrans-85.7-16.1179.3-66.6-175.5-1200114.5L190 G192 N194 N195 P199 I200 L201L190-Q197 PolarHBondContact O-NE2 2.94Å; G192-Q197 PolarHBondContact O-NE2 3.43Å; N194-Q197 PolarHBondContact O-N 3.37Å; N195-Q197 PolarHBondContact O-N 2.95Å; Q197-P199 VanDerWaalsContact C-CD 3.47Å; Q197-I200 WeakPolarHBondContact O-CB 3.26Å; Q197-I200 PolarHBondContact O-N 3.38Å; Q197-I200 VanDerWaalsContact O-N 3.07Å; Q197-L201 HydrophobicContact CB-CD1 4.36Å; Q197-L201 WeakPolarHBondContact O-CG 3.47Å; Q197-L201 PolarHBondContact O-N 2.74Å
198E78.8Confident76.3Confident110 Ų11065.2 Ų65.251%0.51435%0.351SS..Hα-helixtrans-52.3-44.7-177.7-163-173.3163.400114.5N195 I200 L201 K202N195-E198 PolarHBondContact O-N 2.88Å; E198-I200 VanDerWaalsContact C-N 3.33Å; E198-I200 PolarHBondContact O-N 2.79Å; E198-L201 PolarHBondContact O-N 3.11Å; E198-K202 HydrophobicContact CG-CD 4.45Å; E198-K202 WeakPolarHBondContact O-CB 3.41Å; E198-K202 WeakPolarHBondContact O-CG 3.41Å; E198-K202 PolarHBondContact O-N 2.98Å; E198-K202 WeakPolarHBondContact OE1-CE 3.33Å; E198-K202 IonicContact OE1-NZ 4Å; E198-K202 PolarHBondContact OE1-NZ 3.3Å
199P83.7Confident77.6Confident85 Ų8563.8 Ų63.855%0.55234%0.341SS*.Hα-helixtrans-67.8-33.1178.526.3-34.9000112.9Q197 R203Q197-P199 VanDerWaalsContact C-CD 3.47Å; P199-R203 WeakPolarHBondContact O-CB 3.43Å; P199-R203 PolarHBondContact O-N 2.99Å
200I85.7Confident78.9Confident51 Ų5157 Ų5726%0.26230%0.304SS..Hα-helixtrans-68-46.8177.6-59.8174.7000109.3P184 L185 Q197 E198 R203 G204P184-I200 HydrophobicContact CB-CG2 3.89Å; L185-I200 HydrophobicContact CD2-CG2 4.18Å; Q197-I200 WeakPolarHBondContact O-CB 3.26Å; Q197-I200 PolarHBondContact O-N 3.38Å; Q197-I200 VanDerWaalsContact O-N 3.07Å; E198-I200 VanDerWaalsContact C-N 3.33Å; E198-I200 PolarHBondContact O-N 2.79Å; I200-R203 PolarHBondContact O-N 3.3Å; I200-G204 PolarHBondContact O-N 3.4Å
201L86.8Confident80.2Confident12 Ų1257 Ų576%0.06330%0.304CS..Hα-helixtrans-61.7-45.9177.1-69.1170.5000111.5L185 Q197 E198 R203 G204 L205 W264 Q276 V279L185-L201 HydrophobicContact CD2-CD2 4.15Å; Q197-L201 HydrophobicContact CB-CD1 4.36Å; Q197-L201 WeakPolarHBondContact O-CG 3.47Å; Q197-L201 PolarHBondContact O-N 2.74Å; E198-L201 PolarHBondContact O-N 3.11Å; L201-R203 PolarHBondContact O-N 3.29Å; L201-G204 PolarHBondContact O-N 3.46Å; L201-L205 VanDerWaalsContact O-CB 3.3Å; L201-L205 WeakPolarHBondContact O-CB 3.23Å; L201-L205 VanDerWaalsContact O-CG 3.29Å; L201-L205 WeakPolarHBondContact O-CG 3.31Å; L201-L205 PolarHBondContact O-N 2.68Å; L201-W264 HydrophobicContact CD2-CH2 4.39Å; L201-W264 HydrophobicContact CD2-CZ2 4.43Å; L201-Q276 HydrophobicContact CD1-CG 3.96Å; L201-Q276 HydrophobicContact CD2-CG 4.19Å; L201-V279 HydrophobicContact CD2-CG2 4.07Å
202K88Confident81.6Confident89 Ų8952.9 Ų52.939%0.38728%0.276SS..Hα-helixtrans-60.2-43.8176.7-77.4-178.6-178.1169.20112.1F104 E198 L205 L206F104-K202 HydrophobicContact CE1-CG 4.31Å; F104-K202 HydrophobicContact CE2-CB 4.17Å; F104-K202 HydrophobicContact CZ-CB 4Å; F104-K202 HydrophobicContact CZ-CG 4.25Å; F104-K202 VanDerWaalsContact CZ-O 3.25Å; F104-K202 WeakPolarHBondContact CZ-O 3.2Å; E198-K202 HydrophobicContact CG-CD 4.45Å; E198-K202 WeakPolarHBondContact O-CB 3.41Å; E198-K202 WeakPolarHBondContact O-CG 3.41Å; E198-K202 PolarHBondContact O-N 2.98Å; E198-K202 WeakPolarHBondContact OE1-CE 3.33Å; E198-K202 IonicContact OE1-NZ 4Å; E198-K202 PolarHBondContact OE1-NZ 3.3Å; K202-L205 PolarHBondContact O-N 3.09Å; K202-L206 PolarHBondContact O-N 2.86Å
203R89.7Confident83.2Confident128 Ų12851.2 Ų51.248%0.48326%0.259SS..Hα-helixtrans-63-44.5178-171.1173.9175.1136.62111.8L181 P199 I200 L201 L206 G207L181-R203 HydrophobicContact CD2-CG 3.69Å; P199-R203 WeakPolarHBondContact O-CB 3.43Å; P199-R203 PolarHBondContact O-N 2.99Å; I200-R203 PolarHBondContact O-N 3.3Å; L201-R203 PolarHBondContact O-N 3.29Å; R203-L206 PolarHBondContact O-N 2.96Å; R203-G207 PolarHBondContact O-N 3.41Å
204G91Very high85.1Confident0 Ų044.4 Ų44.40%022%0.224CC..Hα-helixtrans-66.2-42176.500000113.5L181 I200 L201 L206 G207 L208L181-G204 WeakPolarHBondContact O-CA 3.06Å; I200-G204 PolarHBondContact O-N 3.4Å; L201-G204 PolarHBondContact O-N 3.46Å; G204-L206 VanDerWaalsContact C-N 3.3Å; G204-L206 PolarHBondContact O-N 3.44Å; G204-G207 PolarHBondContact O-N 2.94Å; G204-L208 WeakPolarHBondContact O-CG 3.32Å; G204-L208 PolarHBondContact O-N 3.03Å
205L92Very high86.9Confident7 Ų738.8 Ų38.84%0.03719%0.194CC..Hα-helixtrans-58.5-42174.4-81.3171.8000111.8F104 L201 K202 G207 L208 F209 E278 V279F104-L205 HydrophobicContact CE1-CB 4.43Å; F104-L205 HydrophobicContact CZ-CB 4.28Å; L201-L205 VanDerWaalsContact O-CB 3.3Å; L201-L205 WeakPolarHBondContact O-CB 3.23Å; L201-L205 VanDerWaalsContact O-CG 3.29Å; L201-L205 WeakPolarHBondContact O-CG 3.31Å; L201-L205 PolarHBondContact O-N 2.68Å; K202-L205 PolarHBondContact O-N 3.09Å; L205-G207 VanDerWaalsContact C-N 3.33Å; L205-G207 PolarHBondContact O-N 3.39Å; L205-L208 PolarHBondContact O-N 3.12Å; L205-F209 HydrophobicContact CB-CE2 4.05Å; L205-F209 HydrophobicContact CB-CZ 4.12Å; L205-F209 HydrophobicContact CD2-CZ 4.26Å; L205-F209 VanDerWaalsContact O-CD2 3.24Å; L205-F209 WeakPolarHBondContact O-CD2 3.33Å; L205-F209 VanDerWaalsContact O-CG 3.23Å; L205-F209 WeakPolarHBondContact O-CG 3.38Å; L205-F209 PolarHBondContact O-N 3.43Å; L205-E278 HydrophobicContact CD2-CB 4.01Å; L205-E278 HydrophobicContact CD2-CG 3.83Å; L205-V279 HydrophobicContact CD1-CG2 4.34Å; L205-V279 HydrophobicContact CD2-CB 4.28Å; L205-V279 HydrophobicContact CD2-CG2 3.51Å; L205-V279 HydrophobicContact CG-CG2 3.58Å
206L92.4Very high88.4Confident5 Ų533.9 Ų33.93%0.02617%0.167CC..Hα-helixtrans-59.8-45.3175.9-175.365000111.6Q100 F104 L181 K202 R203 G204 L208 F209 I210Q100-L206 HydrophobicContact CB-CD2 4.17Å; Q100-L206 HydrophobicContact CG-CD2 3.45Å; Q100-L206 VanDerWaalsContact CG-CD2 3.45Å; F104-L206 HydrophobicContact CE2-CB 4.32Å; F104-L206 HydrophobicContact CZ-CB 4.33Å; L181-L206 HydrophobicContact CD1-CD2 4.29Å; L181-L206 HydrophobicContact CD1-CG 4.27Å; K202-L206 PolarHBondContact O-N 2.86Å; R203-L206 PolarHBondContact O-N 2.96Å; G204-L206 VanDerWaalsContact C-N 3.3Å; G204-L206 PolarHBondContact O-N 3.44Å; L206-L208 VanDerWaalsContact C-N 3.3Å; L206-L208 PolarHBondContact O-N 3.38Å; L206-F209 PolarHBondContact O-N 3.44Å; L206-I210 HydrophobicContact CG-CD1 4.17Å; L206-I210 WeakPolarHBondContact O-CG1 3.46Å; L206-I210 PolarHBondContact O-N 2.85Å; L206-I210 VanDerWaalsContact O-N 3.08Å
207G93.6Very high89.6Confident0 Ų028.5 Ų28.50%014%0.138CC..Hα-helixtrans-57.8-42.2174.200000112.6R203 G204 L205 I210 L211R203-G207 PolarHBondContact O-N 3.41Å; G204-G207 PolarHBondContact O-N 2.94Å; L205-G207 VanDerWaalsContact C-N 3.33Å; L205-G207 PolarHBondContact O-N 3.39Å; G207-I210 PolarHBondContact O-N 2.99Å; G207-L211 WeakPolarHBondContact O-CB 3.22Å; G207-L211 PolarHBondContact O-N 3.02Å
208L94.7Very high90.3Very high0 Ų027.8 Ų27.80%014%0.135CC..Hα-helixtrans-69.7-33.2177.4-68.2170.7000113.4I182 G204 L205 L206 L211 S212 L253 L256 V279 R282 V283I182-L208 HydrophobicContact CD1-CD2 3.98Å; I182-L208 HydrophobicContact CD1-CG 4.4Å; G204-L208 WeakPolarHBondContact O-CG 3.32Å; G204-L208 PolarHBondContact O-N 3.03Å; L205-L208 PolarHBondContact O-N 3.12Å; L206-L208 VanDerWaalsContact C-N 3.3Å; L206-L208 PolarHBondContact O-N 3.38Å; L208-L211 HydrophobicContact CD2-CD2 4.38Å; L208-L211 PolarHBondContact O-N 2.86Å; L208-S212 WeakPolarHBondContact O-CB 3Å; L208-S212 PolarHBondContact O-N 2.7Å; L208-L253 HydrophobicContact CD2-CD2 4.2Å; L208-L256 HydrophobicContact CD2-CD2 4.24Å; L208-V279 HydrophobicContact CD1-CG1 4.04Å; L208-R282 HydrophobicContact CB-CB 4.02Å; L208-R282 HydrophobicContact CD1-CB 4.1Å; L208-V283 HydrophobicContact CD1-CG2 3.8Å; L208-V283 HydrophobicContact CD2-CG2 3.95Å
209F93.9Very high90.5Very high0 Ų024.5 Ų24.50%012%0.124CC..Hα-helixtrans-65.9-44.3173.5-61.4-37.2000111.3F104 L115 L205 L206 L211 S212 A213 E278 R282F104-F209 AromaticContact CE1-CE2 3.82Å; F104-F209 HydrophobicContact CE1-CE2 3.82Å; F104-F209 HydrophobicContact CZ-CE2 4.12Å; L115-F209 HydrophobicContact CD1-CB 3.59Å; L205-F209 HydrophobicContact CB-CE2 4.05Å; L205-F209 HydrophobicContact CB-CZ 4.12Å; L205-F209 HydrophobicContact CD2-CZ 4.26Å; L205-F209 VanDerWaalsContact O-CD2 3.24Å; L205-F209 WeakPolarHBondContact O-CD2 3.33Å; L205-F209 VanDerWaalsContact O-CG 3.23Å; L205-F209 WeakPolarHBondContact O-CG 3.38Å; L205-F209 PolarHBondContact O-N 3.43Å; L206-F209 PolarHBondContact O-N 3.44Å; F209-L211 VanDerWaalsContact C-N 3.32Å; F209-L211 PolarHBondContact O-N 3.31Å; F209-S212 PolarHBondContact O-N 2.79Å; F209-A213 WeakPolarHBondContact O-CB 3.16Å; F209-A213 PolarHBondContact O-N 2.53Å; F209-E278 WeakPolarHBondContact CE1-OE1 3.47Å; F209-E278 VanDerWaalsContact CZ-OE1 3.25Å; F209-E278 WeakPolarHBondContact CZ-OE1 3.36Å; F209-R282 HydrophobicContact CD1-CG 4.47Å; F209-R282 HydrophobicContact CE1-CG 4.17Å
210I94.5Very high89.8Confident4 Ų427.5 Ų27.52%0.02113%0.125CC..Hα-helixtrans-63.4-42.4176.7-61.6162.5000109.9L96 L115 L174 I178 L181 L206 G207 A213 L214L96-I210 HydrophobicContact CD2-CD1 3.82Å; L96-I210 HydrophobicContact CD2-CG1 4.44Å; L115-I210 HydrophobicContact CD1-CG1 4.22Å; L115-I210 HydrophobicContact CD2-CG1 3.89Å; L174-I210 HydrophobicContact CD1-CG2 3.84Å; L174-I210 HydrophobicContact CG-CG2 4.47Å; I178-I210 HydrophobicContact CD1-CG2 3.85Å; I178-I210 HydrophobicContact CG1-CB 4.15Å; I178-I210 HydrophobicContact CG1-CG2 3.69Å; L181-I210 HydrophobicContact CD1-CD1 3.71Å; L206-I210 HydrophobicContact CG-CD1 4.17Å; L206-I210 WeakPolarHBondContact O-CG1 3.46Å; L206-I210 PolarHBondContact O-N 2.85Å; L206-I210 VanDerWaalsContact O-N 3.08Å; G207-I210 PolarHBondContact O-N 2.99Å; I210-A213 PolarHBondContact O-N 3.38Å; I210-L214 WeakPolarHBondContact O-CB 3.38Å; I210-L214 PolarHBondContact O-N 3.4Å
211L95.5Very high88.4Confident3 Ų328 Ų282%0.01613%0.133CC..Hα-helixtrans-61.4-47.4176.4179.656.8000112.4I178 I182 G207 L208 F209 A213 L214 L215 L249 L253I178-L211 HydrophobicContact CD1-CB 4.49Å; I178-L211 HydrophobicContact CG2-CB 4.07Å; I182-L211 HydrophobicContact CD1-CD2 4.4Å; G207-L211 WeakPolarHBondContact O-CB 3.22Å; G207-L211 PolarHBondContact O-N 3.02Å; L208-L211 HydrophobicContact CD2-CD2 4.38Å; L208-L211 PolarHBondContact O-N 2.86Å; F209-L211 VanDerWaalsContact C-N 3.32Å; F209-L211 PolarHBondContact O-N 3.31Å; L211-A213 VanDerWaalsContact C-N 3.32Å; L211-A213 PolarHBondContact O-N 3.13Å; L211-L214 PolarHBondContact O-N 2.8Å; L211-L215 HydrophobicContact CD1-CD1 4.13Å; L211-L215 HydrophobicContact CD1-CG 4.11Å; L211-L215 HydrophobicContact CG-CD1 4.11Å; L211-L215 WeakPolarHBondContact O-CG 3.48Å; L211-L215 PolarHBondContact O-N 3.21Å; L211-L249 HydrophobicContact CD1-CB 4.47Å; L211-L249 HydrophobicContact CD1-CD1 3.86Å; L211-L249 HydrophobicContact CD1-CD2 3.78Å; L211-L249 HydrophobicContact CD1-CG 4.25Å; L211-L253 HydrophobicContact CD2-CD1 3.99Å; L211-L253 HydrophobicContact CD2-CD2 3.79Å; L211-L253 HydrophobicContact CD2-CG 4.01Å
212S93.6Very high86.9Confident5 Ų534.6 Ų34.64%0.03516%0.163CC..Hα-helixtrans-57.6-47.1176.3-175.50000110.7Q112 L208 F209 L214 L215 D216Q112-S212 PolarHBondContact NE2-OG 3.18Å; L208-S212 WeakPolarHBondContact O-CB 3Å; L208-S212 PolarHBondContact O-N 2.7Å; F209-S212 PolarHBondContact O-N 2.79Å; S212-L214 VanDerWaalsContact C-N 3.32Å; S212-L214 PolarHBondContact O-N 3.26Å; S212-L215 PolarHBondContact O-N 3.15Å; S212-D216 WeakPolarHBondContact O-CB 3.45Å; S212-D216 VanDerWaalsContact O-CG 3.23Å; S212-D216 PolarHBondContact O-N 3.23Å
213A91.6Very high85.4Confident1 Ų131 Ų311%0.00815%0.149CC..Hα-helixtrans-63.1-37.8178.500000112.4Q112 L115 F209 I210 L211 E217Q112-A213 VanDerWaalsContact NE2-CA 3.31Å; L115-A213 HydrophobicContact CB-CB 3.69Å; F209-A213 WeakPolarHBondContact O-CB 3.16Å; F209-A213 PolarHBondContact O-N 2.53Å; I210-A213 PolarHBondContact O-N 3.38Å; L211-A213 VanDerWaalsContact C-N 3.32Å; L211-A213 PolarHBondContact O-N 3.13Å; A213-E217 WeakPolarHBondContact O-CB 3.5Å; A213-E217 VanDerWaalsContact O-CG 3.28Å; A213-E217 WeakPolarHBondContact O-CG 3.47Å; A213-E217 PolarHBondContact O-N 3.35Å
214L93.6Very high83.7Confident1 Ų126.5 Ų26.51%0.00514%0.136CC..Hα-helixtrans-65.3-45.3175.4-177.668.5000111.7L171 L174 I175 I178 I210 L211 S212 E217 F218 L249L171-L214 HydrophobicContact CD1-CD1 4.15Å; L171-L214 HydrophobicContact CD1-CD2 4.36Å; L174-L214 HydrophobicContact CD2-CD1 3.95Å; I175-L214 HydrophobicContact CG1-CD2 4.4Å; I178-L214 HydrophobicContact CD1-CD2 4.04Å; I210-L214 WeakPolarHBondContact O-CB 3.38Å; I210-L214 PolarHBondContact O-N 3.4Å; L211-L214 PolarHBondContact O-N 2.8Å; S212-L214 VanDerWaalsContact C-N 3.32Å; S212-L214 PolarHBondContact O-N 3.26Å; L214-E217 PolarHBondContact O-N 3.2Å; L214-F218 HydrophobicContact CD1-CD2 3.87Å; L214-F218 HydrophobicContact CD1-CE2 3.63Å; L214-F218 HydrophobicContact CG-CD2 4.39Å; L214-F218 WeakPolarHBondContact O-CD2 3.39Å; L214-F218 PolarHBondContact O-N 2.96Å; L214-F218 VanDerWaalsContact O-N 3.13Å; L214-L249 HydrophobicContact CD2-CD1 4.19Å
215L93.7Very high81.7Confident0 Ų026.9 Ų26.90%014%0.14CC..Hα-helixtrans-65.8-41.1178.6-68173.4000111.4L211 S212 E217 F218 S219 L246 L249 C286 M289 I290 W293L211-L215 HydrophobicContact CD1-CD1 4.13Å; L211-L215 HydrophobicContact CD1-CG 4.11Å; L211-L215 HydrophobicContact CG-CD1 4.11Å; L211-L215 WeakPolarHBondContact O-CG 3.48Å; L211-L215 PolarHBondContact O-N 3.21Å; S212-L215 PolarHBondContact O-N 3.15Å; L215-E217 VanDerWaalsContact C-N 3.35Å; L215-E217 PolarHBondContact O-N 2.95Å; L215-F218 PolarHBondContact O-N 2.96Å; L215-S219 WeakPolarHBondContact O-CB 3.26Å; L215-S219 PolarHBondContact O-N 3.27Å; L215-S219 VanDerWaalsContact O-N 3.07Å; L215-S219 PolarHBondContact O-OG 3.06Å; L215-L246 HydrophobicContact CD2-CD1 3.66Å; L215-L249 HydrophobicContact CD2-CD1 4.5Å; L215-C286 HydrophobicContact CD1-CB 3.96Å; L215-M289 HydrophobicContact CB-CE 3.52Å; L215-M289 HydrophobicContact CB-SD 4.38Å; L215-I290 HydrophobicContact CD1-CD1 4.09Å; L215-I290 HydrophobicContact CD1-CG1 3.99Å; L215-I290 HydrophobicContact CD2-CD1 4.36Å; L215-I290 HydrophobicContact CD2-CG1 4.03Å; L215-W293 HydrophobicContact CB-CZ3 4.37Å; L215-W293 HydrophobicContact CD2-CZ3 3.98Å
216D88.5Confident79.9Confident49 Ų4932.7 Ų32.726%0.26217%0.167SC..Hα-helixtrans-58.6-47.1175.2-75.4-34.6000110.4Q112 S212 F218 S219 Y220 M289Q112-D216 PolarHBondContact NE2-OD2 2.89Å; S212-D216 WeakPolarHBondContact O-CB 3.45Å; S212-D216 VanDerWaalsContact O-CG 3.23Å; S212-D216 PolarHBondContact O-N 3.23Å; D216-F218 VanDerWaalsContact C-N 3.34Å; D216-F218 PolarHBondContact O-N 3.38Å; D216-S219 PolarHBondContact O-N 3.09Å; D216-S219 PolarHBondContact O-OG 2.84Å; D216-Y220 WeakPolarHBondContact O-CD2 3.39Å; D216-Y220 WeakPolarHBondContact O-CE2 3.34Å; D216-M289 HydrophobicContact CB-CE 4.26Å; D216-M289 WeakPolarHBondContact OD1-CE 3.42Å
217E86.2Confident78.2Confident24 Ų2432.6 Ų32.611%0.11217%0.166CC..Hα-helixtrans-65.6-35.5-179.5-74.4-66.1144.800112.5R113 S116 K123 A213 L214 L215R113-E217 IonicContact NH1-OE1 3.06Å; S116-E217 VanDerWaalsContact CB-OE1 3.29Å; S116-E217 WeakPolarHBondContact CB-OE1 3.02Å; S116-E217 PolarHBondContact OG-OE1 2.94Å; K123-E217 WeakPolarHBondContact CD-O 3.34Å; K123-E217 WeakPolarHBondContact CE-O 3.37Å; K123-E217 PolarHBondContact NZ-O 2.99Å; A213-E217 WeakPolarHBondContact O-CB 3.5Å; A213-E217 VanDerWaalsContact O-CG 3.28Å; A213-E217 WeakPolarHBondContact O-CG 3.47Å; A213-E217 PolarHBondContact O-N 3.35Å; L214-E217 PolarHBondContact O-N 3.2Å; L215-E217 VanDerWaalsContact C-N 3.35Å; L215-E217 PolarHBondContact O-N 2.95Å
218F87.9Confident76.7Confident10 Ų1034.8 Ų34.84%0.04418%0.178CC..Hα-helixtrans-85.1-13.6-178.5-85.9-102.9000114.4K123 L171 L214 L215 D216 L237 F241 W293K123-F218 HydrophobicContact CB-CD2 4.34Å; K123-F218 HydrophobicContact CB-CE2 3.73Å; K123-F218 HydrophobicContact CB-CZ 3.91Å; K123-F218 HydrophobicContact CG-CD2 4.38Å; K123-F218 HydrophobicContact CG-CE1 4.21Å; K123-F218 HydrophobicContact CG-CE2 4.06Å; K123-F218 HydrophobicContact CG-CZ 3.98Å; L171-F218 HydrophobicContact CD1-CZ 4.37Å; L171-F218 HydrophobicContact CD2-CZ 4.47Å; L214-F218 HydrophobicContact CD1-CD2 3.87Å; L214-F218 HydrophobicContact CD1-CE2 3.63Å; L214-F218 HydrophobicContact CG-CD2 4.39Å; L214-F218 WeakPolarHBondContact O-CD2 3.39Å; L214-F218 PolarHBondContact O-N 2.96Å; L214-F218 VanDerWaalsContact O-N 3.13Å; L215-F218 PolarHBondContact O-N 2.96Å; D216-F218 VanDerWaalsContact C-N 3.34Å; D216-F218 PolarHBondContact O-N 3.38Å; F218-L237 HydrophobicContact CE1-CD1 4.15Å; F218-F241 HydrophobicContact CB-CD1 4.14Å; F218-F241 HydrophobicContact CB-CE1 3.71Å; F218-F241 HydrophobicContact CB-CZ 4.04Å; F218-F241 HydrophobicContact CD1-CB 4.15Å; F218-F241 AromaticContact CD1-CD1 3.68Å; F218-F241 HydrophobicContact CD1-CD1 3.68Å; F218-F241 AromaticContact CD1-CD2 3.75Å; F218-F241 HydrophobicContact CD1-CD2 3.75Å; F218-F241 AromaticContact CD1-CE1 3.95Å; F218-F241 HydrophobicContact CD1-CE1 3.95Å; F218-F241 HydrophobicContact CD1-CE2 4.02Å; F218-F241 AromaticContact CD1-CG 3.57Å; F218-F241 HydrophobicContact CD1-CG 3.57Å; F218-F241 HydrophobicContact CD1-CZ 4.11Å; F218-F241 HydrophobicContact CD2-CE2 4.4Å; F218-F241 HydrophobicContact CD2-CZ 4.36Å; F218-F241 HydrophobicContact CE1-CB 4.17Å; F218-F241 HydrophobicContact CE1-CD1 4.4Å; F218-F241 AromaticContact CE1-CD2 3.67Å; F218-F241 HydrophobicContact CE1-CD2 3.67Å; F218-F241 HydrophobicContact CE1-CE2 4.13Å; F218-F241 AromaticContact CE1-CG 3.82Å; F218-F241 HydrophobicContact CE1-CG 3.82Å; F218-F241 HydrophobicContact CG-CD1 4.15Å; F218-F241 HydrophobicContact CG-CD2 4.35Å; F218-F241 AromaticContact CG-CE1 3.93Å; F218-F241 HydrophobicContact CG-CE1 3.93Å; F218-F241 HydrophobicContact CG-CE2 4.15Å; F218-F241 HydrophobicContact CG-CG 4.34Å; F218-F241 AromaticContact CG-CZ 3.93Å; F218-F241 HydrophobicContact CG-CZ 3.93Å; F218-F241 HydrophobicContact CZ-CD2 4.22Å; F218-F241 HydrophobicContact CZ-CE2 4.36Å; F218-W293 VanDerWaalsContact C-CH2 3.47Å; F218-W293 HydrophobicContact CB-CH2 3.56Å; F218-W293 HydrophobicContact CB-CZ2 3.89Å; F218-W293 VanDerWaalsContact O-CZ2 3.31Å; F218-W293 WeakPolarHBondContact O-CZ2 3.29Å
219S83.9Confident75.2Confident41 Ų4135.4 Ų35.429%0.28718%0.181SC..Hα-helixtrans-80.2-28.5-176.466.70000114.2L215 D216 S221L215-S219 WeakPolarHBondContact O-CB 3.26Å; L215-S219 PolarHBondContact O-N 3.27Å; L215-S219 VanDerWaalsContact O-N 3.07Å; L215-S219 PolarHBondContact O-OG 3.06Å; D216-S219 PolarHBondContact O-N 3.09Å; D216-S219 PolarHBondContact O-OG 2.84Å; S219-S221 PolarHBondContact O-N 2.99Å
220Y68.1Low73.9Confident148 Ų14836.8 Ų36.858%0.5819%0.19SC*.  trans-64.7118.4179.7-69.9-80.1000112.4D216D216-Y220 WeakPolarHBondContact O-CD2 3.39Å; D216-Y220 WeakPolarHBondContact O-CE2 3.34Å
221S56.7Low72.7Confident60 Ų6040.7 Ų40.742%0.4221%0.21SC..THydrogen-bonded Turntrans-82-19.7-172.763.30000114.6S219 D223S219-S221 PolarHBondContact O-N 2.99Å; S221-D223 VanDerWaalsContact C-N 3.29Å; S221-D223 PolarHBondContact O-N 3.48Å
222E56Low71.7Confident151 Ų15142.4 Ų42.471%0.70622%0.218SC*.THydrogen-bonded Turntrans-83.13.7-174-60-168.3161.800114.5S224E222-S224 PolarHBondContact O-N 2.68Å
223D55.8Low71Confident15 Ų1542.2 Ų42.28%0.0822%0.217CC..THydrogen-bonded Turntrans-80.4-0.7-162.5-9210.2000117.2K123 S221 A225 Q226 L227K123-D223 IonicContact NZ-OD2 2.77Å; K123-D223 PolarHBondContact NZ-OD2 3.24Å; S221-D223 VanDerWaalsContact C-N 3.29Å; S221-D223 PolarHBondContact O-N 3.48Å; D223-A225 PolarHBondContact O-N 3.26Å; D223-Q226 PolarHBondContact O-N 2.9Å; D223-L227 HydrophobicContact CB-CD1 4.14Å; D223-L227 HydrophobicContact CB-CG 4.48Å; D223-L227 WeakPolarHBondContact O-CB 3.31Å; D223-L227 WeakPolarHBondContact O-CG 3.33Å; D223-L227 PolarHBondContact O-N 3.43Å
224S53.7Low70.4Confident32 Ų3242.7 Ų42.722%0.22422%0.219CC..THydrogen-bonded Turntrans-57.3-39178.661.80000111.7E222 N228 M229E222-S224 PolarHBondContact O-N 2.68Å; S224-N228 PolarHBondContact O-N 2.72Å; S224-M229 PolarHBondContact O-N 3.41Å; S224-M229 VanDerWaalsContact O-N 3.14Å
225A49.1Very low69.9Low9 Ų942.8 Ų42.87%0.07422%0.219CC..THydrogen-bonded Turntrans-81.4-27.9-179.400000113.8D223 N228 V1431D223-A225 PolarHBondContact O-N 3.26Å; A225-N228 PolarHBondContact O-OD1 3.19Å; A225-V1431 HydrophobicContact CB-CG1 4.4Å; A225-V1431 HydrophobicContact CB-CG2 3.35Å
226Q54.9Low69.6Low128 Ų12843 Ų4360%0.59822%0.22SC*.THydrogen-bonded Turntrans-73.5-37.6174.5-68.4-168.316.900111.2V69 D223 N228V69-Q226 WeakPolarHBondContact CG1-O 3.42Å; D223-Q226 PolarHBondContact O-N 2.9Å; Q226-N228 VanDerWaalsContact C-N 3.26Å; Q226-N228 PolarHBondContact O-N 2.91Å
227L57.6Low69.6Low4 Ų441 Ų412%0.02121%0.21CC..THydrogen-bonded Turntrans-81.5-1.2-179-67.1169.2000114.1V69 K123 R124 D223 M229V69-L227 HydrophobicContact CG1-CD2 4Å; V69-L227 HydrophobicContact CG2-CD2 4.01Å; K123-L227 HydrophobicContact CD-CD1 4.18Å; K123-L227 HydrophobicContact CG-CD1 4.21Å; R124-L227 HydrophobicContact CB-CD2 4.27Å; D223-L227 HydrophobicContact CB-CD1 4.14Å; D223-L227 HydrophobicContact CB-CG 4.48Å; D223-L227 WeakPolarHBondContact O-CB 3.31Å; D223-L227 WeakPolarHBondContact O-CG 3.33Å; D223-L227 PolarHBondContact O-N 3.43Å; L227-M229 VanDerWaalsContact C-N 3.32Å; L227-M229 HydrophobicContact CB-CE 4.08Å; L227-M229 HydrophobicContact CB-CG 4.11Å; L227-M229 HydrophobicContact CD1-CE 3.76Å; L227-M229 PolarHBondContact O-N 2.8Å
228N61.1Low69.7Low45 Ų4541.3 Ų41.324%0.24121%0.21CC..THydrogen-bonded Turntrans53.542.7-174.8-76-6.9000113.6S224 A225 Q226 T1538S224-N228 PolarHBondContact O-N 2.72Å; A225-N228 PolarHBondContact O-OD1 3.19Å; Q226-N228 VanDerWaalsContact C-N 3.26Å; Q226-N228 PolarHBondContact O-N 2.91Å; N228-T1538 VanDerWaalsContact CA-CG2 3.5Å; N228-T1538 HydrophobicContact CB-CG2 3.79Å; N228-T1538 VanDerWaalsContact CG-CB 3.49Å; N228-T1538 PolarHBondContact ND2-O 3.46Å; N228-T1538 WeakPolarHBondContact OD1-CB 3.37Å; N228-T1538 VanDerWaalsContact OD1-CG2 3.22Å; N228-T1538 WeakPolarHBondContact OD1-CG2 3.3Å
229M63.5Low69.8Low14 Ų1441 Ų417%0.06921%0.209CC..  trans-108145.3-175.3-77.5-155-71.100113.8A127 E131 S224 L227 A233 H234 L237A127-M229 WeakPolarHBondContact CA-SD 3.06Å; A127-M229 HydrophobicContact CB-CE 3.49Å; A127-M229 VanDerWaalsContact CB-CE 3.49Å; A127-M229 HydrophobicContact CB-CG 4.09Å; A127-M229 HydrophobicContact CB-SD 3.15Å; A127-M229 WeakPolarHBondContact CB-SD 3.48Å; E131-M229 HydrophobicContact CG-CG 4.25Å; E131-M229 HydrophobicContact CG-SD 4.22Å; E131-M229 WeakPolarHBondContact OE1-CG 3.22Å; S224-M229 PolarHBondContact O-N 3.41Å; S224-M229 VanDerWaalsContact O-N 3.14Å; L227-M229 VanDerWaalsContact C-N 3.32Å; L227-M229 HydrophobicContact CB-CE 4.08Å; L227-M229 HydrophobicContact CB-CG 4.11Å; L227-M229 HydrophobicContact CD1-CE 3.76Å; L227-M229 PolarHBondContact O-N 2.8Å; M229-A233 HydrophobicContact SD-CB 4.01Å; M229-H234 HydrophobicContact CE-CB 3.99Å; M229-L237 HydrophobicContact CE-CD2 3.8Å
230P65.5Low70.2Confident29 Ų2941 Ų4119%0.18820%0.203CC..  trans-64143164.227.9-31.4000110.1E232 A233 H234P230-E232 PolarHBondContact O-N 2.97Å; P230-E232 VanDerWaalsContact O-N 3.1Å; P230-A233 HydrophobicContact CG-CB 3.8Å; P230-A233 WeakPolarHBondContact O-CB 3.33Å; P230-A233 PolarHBondContact O-N 3.15Å; P230-H234 PolarHBondContact O-N 3.26Å
231L70.8Confident71.4Confident86 Ų8634 Ų3445%0.4518%0.176SC..Hα-helixtrans-50.6-40.9-174.7179.464.4000112.5A233 H234 V235L231-A233 PolarHBondContact O-N 2.97Å; L231-H234 WeakPolarHBondContact O-CB 3.42Å; L231-H234 PolarHBondContact O-N 3.47Å; L231-V235 WeakPolarHBondContact O-CG2 3.48Å; L231-V235 PolarHBondContact O-N 2.75Å
232E74.4Confident73Confident39 Ų3931.6 Ų31.618%0.18216%0.157CC..Hα-helixtrans-63-42.8179.3-53.395.8124.200111.2A134 R138 L157 P230 H234 V235 F236A134-E232 HydrophobicContact CB-CB 4.46Å; R138-E232 IonicContact CZ-OE1 3.32Å; R138-E232 IonicContact CZ-OE2 3.75Å; R138-E232 IonicContact NE-OE1 3.81Å; R138-E232 PolarHBondContact NE-OE1 3.35Å; R138-E232 IonicContact NH2-OE1 3.23Å; R138-E232 PolarHBondContact NH2-OE1 3.33Å; R138-E232 IonicContact NH2-OE2 2.71Å; R138-E232 PolarHBondContact NH2-OE2 2.95Å; L157-E232 HydrophobicContact CB-CG 4.17Å; L157-E232 HydrophobicContact CD2-CB 4Å; L157-E232 HydrophobicContact CD2-CG 4.17Å; P230-E232 PolarHBondContact O-N 2.97Å; P230-E232 VanDerWaalsContact O-N 3.1Å; E232-H234 VanDerWaalsContact C-N 3.29Å; E232-H234 PolarHBondContact O-N 2.91Å; E232-V235 PolarHBondContact O-N 3.5Å; E232-V235 VanDerWaalsContact O-N 3.16Å; E232-F236 VanDerWaalsContact O-CD2 3.23Å; E232-F236 WeakPolarHBondContact O-CD2 3.39Å; E232-F236 PolarHBondContact O-N 3.07Å
233A77.6Confident74.6Confident0 Ų025.8 Ų25.80%013%0.131CC..Hα-helixtrans-63.3-37.1176.600000112.1A130 E131 A134 M229 P230 L231 F236 L237A130-A233 WeakPolarHBondContact CB-O 3.25Å; E131-A233 HydrophobicContact CB-CB 4.19Å; E131-A233 HydrophobicContact CG-CB 3.6Å; A134-A233 HydrophobicContact CB-CB 4.25Å; M229-A233 HydrophobicContact SD-CB 4.01Å; P230-A233 HydrophobicContact CG-CB 3.8Å; P230-A233 WeakPolarHBondContact O-CB 3.33Å; P230-A233 PolarHBondContact O-N 3.15Å; L231-A233 PolarHBondContact O-N 2.97Å; A233-F236 PolarHBondContact O-N 3.43Å; A233-L237 WeakPolarHBondContact O-CB 3.49Å; A233-L237 PolarHBondContact O-N 3.16Å
234H80Confident76.4Confident11 Ų1128.2 Ų28.25%0.05114%0.14CC..Hα-helixtrans-63.4-42.1173.8-179.382.5000112M229 P230 L231 E232 L237 R238M229-H234 HydrophobicContact CE-CB 3.99Å; P230-H234 PolarHBondContact O-N 3.26Å; L231-H234 WeakPolarHBondContact O-CB 3.42Å; L231-H234 PolarHBondContact O-N 3.47Å; E232-H234 VanDerWaalsContact C-N 3.29Å; E232-H234 PolarHBondContact O-N 2.91Å; H234-L237 PolarHBondContact O-N 3.33Å; H234-R238 WeakPolarHBondContact NE2-CD 3.44Å; H234-R238 PolarHBondContact O-N 3.16Å
235V82.6Confident78.3Confident3 Ų326.9 Ų26.92%0.01813%0.13CC..Hα-helixtrans-63.8-44.5175174.30000111L157 L231 E232 L237 R238 A239 L296 L300L157-V235 HydrophobicContact CD2-CB 3.77Å; L157-V235 HydrophobicContact CD2-CG1 3.67Å; L157-V235 HydrophobicContact CD2-CG2 4.27Å; L231-V235 WeakPolarHBondContact O-CG2 3.48Å; L231-V235 PolarHBondContact O-N 2.75Å; E232-V235 PolarHBondContact O-N 3.5Å; E232-V235 VanDerWaalsContact O-N 3.16Å; V235-L237 PolarHBondContact O-N 3.13Å; V235-R238 PolarHBondContact O-N 3.28Å; V235-A239 WeakPolarHBondContact O-CB 3Å; V235-A239 PolarHBondContact O-N 3.13Å; V235-L296 HydrophobicContact CG1-CD1 4.09Å; V235-L300 HydrophobicContact CG1-CD1 3.82Å; V235-L300 HydrophobicContact CG1-CD2 4.35Å; V235-L300 HydrophobicContact CG2-CD1 4.16Å; V235-L300 HydrophobicContact CG2-CD2 4.12Å
236F88.1Confident80.5Confident4 Ų426.4 Ų26.42%0.01813%0.126CC..Hα-helixtrans-60.8-43.3176.2-89.4-103.4000111.9A130 V133 A134 W137 L157 P161 P164 E232 A233 R240A130-F236 HydrophobicContact CB-CB 4.18Å; V133-F236 HydrophobicContact CB-CD1 4.47Å; V133-F236 HydrophobicContact CG1-CD1 3.77Å; V133-F236 HydrophobicContact CG1-CE1 3.85Å; A134-F236 HydrophobicContact CB-CD2 4.08Å; A134-F236 HydrophobicContact CB-CE2 4.36Å; A134-F236 HydrophobicContact CB-CG 4.38Å; W137-F236 HydrophobicContact CB-CZ 3.95Å; W137-F236 HydrophobicContact CD2-CE2 4.38Å; W137-F236 HydrophobicContact CD2-CZ 4.13Å; W137-F236 HydrophobicContact CG-CE2 4.45Å; W137-F236 AromaticContact CG-CZ 3.77Å; W137-F236 HydrophobicContact CG-CZ 3.77Å; L157-F236 HydrophobicContact CD1-CE2 4.07Å; L157-F236 HydrophobicContact CD2-CD2 4.32Å; L157-F236 HydrophobicContact CD2-CE2 4.21Å; P161-F236 HydrophobicContact CB-CD1 4.36Å; P161-F236 HydrophobicContact CB-CE1 3.8Å; P161-F236 HydrophobicContact CB-CE2 4.17Å; P161-F236 HydrophobicContact CB-CZ 3.71Å; P161-F236 HydrophobicContact CG-CD1 3.82Å; P161-F236 HydrophobicContact CG-CD2 3.93Å; P161-F236 HydrophobicContact CG-CE1 3.76Å; P161-F236 HydrophobicContact CG-CE2 3.92Å; P161-F236 HydrophobicContact CG-CG 3.91Å; P161-F236 HydrophobicContact CG-CZ 3.83Å; P164-F236 HydrophobicContact CB-CD1 4.26Å; E232-F236 VanDerWaalsContact O-CD2 3.23Å; E232-F236 WeakPolarHBondContact O-CD2 3.39Å; E232-F236 PolarHBondContact O-N 3.07Å; A233-F236 PolarHBondContact O-N 3.43Å; F236-R240 WeakPolarHBondContact O-CB 3.39Å; F236-R240 PolarHBondContact O-N 3.18Å
237L89Confident82.3Confident9 Ų921.1 Ų21.15%0.04710%0.103CC..Hα-helixtrans-58.4-52.5175.4171.865.3000111.6K123 A127 A130 F218 M229 A233 H234 V235 R240 F241K123-L237 HydrophobicContact CG-CD2 4.46Å; A127-L237 HydrophobicContact CB-CD2 4.07Å; A130-L237 HydrophobicContact CB-CB 3.93Å; F218-L237 HydrophobicContact CE1-CD1 4.15Å; M229-L237 HydrophobicContact CE-CD2 3.8Å; A233-L237 WeakPolarHBondContact O-CB 3.49Å; A233-L237 PolarHBondContact O-N 3.16Å; H234-L237 PolarHBondContact O-N 3.33Å; V235-L237 PolarHBondContact O-N 3.13Å; L237-R240 PolarHBondContact O-N 2.92Å; L237-F241 PolarHBondContact O-N 3.15Å
238R88.5Confident84.1Confident29 Ų2925 Ų2511%0.10912%0.117CC..Hα-helixtrans-64.9-44-178.4-79.3-175.475.2175.55.6111.3H234 V235 R240 F241 Q242 D294 L296H234-R238 WeakPolarHBondContact NE2-CD 3.44Å; H234-R238 PolarHBondContact O-N 3.16Å; V235-R238 PolarHBondContact O-N 3.28Å; R238-R240 VanDerWaalsContact C-N 3.34Å; R238-R240 PolarHBondContact O-N 3.31Å; R238-F241 PolarHBondContact O-N 2.91Å; R238-Q242 VanDerWaalsContact O-CB 3.27Å; R238-Q242 WeakPolarHBondContact O-CB 3.27Å; R238-Q242 WeakPolarHBondContact O-CG 3.15Å; R238-Q242 PolarHBondContact O-N 2.96Å; R238-D294 IonicContact CZ-OD2 2.69Å; R238-D294 IonicContact NH1-OD2 2.98Å; R238-D294 PolarHBondContact NH2-O 3.31Å; R238-D294 IonicContact NH2-OD2 3.47Å; R238-D294 PolarHBondContact NH2-OD2 3.48Å; R238-L296 HydrophobicContact CB-CD1 3.64Å; R238-L296 HydrophobicContact CB-CD2 4.26Å; R238-L296 HydrophobicContact CB-CG 3.93Å
239A89Confident85.7Confident3 Ų323 Ų233%0.02511%0.107CC..Hα-helixtrans-58.7-46.2177.300000111.1P161 P164 V235 D243 L296P161-A239 HydrophobicContact CG-CB 4.25Å; P164-A239 HydrophobicContact CB-CB 4.12Å; P164-A239 HydrophobicContact CG-CB 4.41Å; V235-A239 WeakPolarHBondContact O-CB 3Å; V235-A239 PolarHBondContact O-N 3.13Å; A239-D243 VanDerWaalsContact O-CB 3.32Å; A239-D243 WeakPolarHBondContact O-CB 3.49Å; A239-D243 PolarHBondContact O-N 3.49Å; A239-D243 VanDerWaalsContact O-N 3.13Å; A239-L296 HydrophobicContact CB-CD1 3.92Å
240R92.7Very high87.2Confident41 Ų4122.3 Ų22.316%0.15510%0.103CC..Hα-helixtrans-57.9-56.6176.5-179.865.2-160.8177.213.2111.6P164 G165 F236 L237 R238 Q242 D243 Y244 E245P164-R240 HydrophobicContact CB-CB 3.92Å; P164-R240 HydrophobicContact CG-CB 3.87Å; G165-R240 WeakPolarHBondContact O-CD 3.43Å; G165-R240 PolarHBondContact O-NH1 3.37Å; F236-R240 WeakPolarHBondContact O-CB 3.39Å; F236-R240 PolarHBondContact O-N 3.18Å; L237-R240 PolarHBondContact O-N 2.92Å; R238-R240 VanDerWaalsContact C-N 3.34Å; R238-R240 PolarHBondContact O-N 3.31Å; R240-Q242 PolarHBondContact O-N 3.33Å; R240-D243 PolarHBondContact O-N 3.04Å; R240-Y244 WeakPolarHBondContact O-CD2 3.34Å; R240-Y244 PolarHBondContact O-N 3.47Å; R240-E245 IonicContact CZ-OE1 2.79Å; R240-E245 IonicContact NE-OE1 3.99Å; R240-E245 PolarHBondContact NE-OE1 2.95Å; R240-E245 IonicContact NE-OE2 3.42Å; R240-E245 IonicContact NH2-OE1 3.65Å; R240-E245 PolarHBondContact NH2-OE1 3.11Å
241F92.4Very high88.6Confident3 Ų325.6 Ų25.61%0.01311%0.114CC..Iπ-helixtrans-59.4-45.6-175.8-174.7-102.8000112L171 F218 L237 R238 E245 L246 L249 W293L171-F241 HydrophobicContact CD1-CE2 4.4Å; L171-F241 HydrophobicContact CD2-CD2 4Å; L171-F241 HydrophobicContact CD2-CE2 4.42Å; F218-F241 HydrophobicContact CB-CD1 4.14Å; F218-F241 HydrophobicContact CB-CE1 3.71Å; F218-F241 HydrophobicContact CB-CZ 4.04Å; F218-F241 HydrophobicContact CD1-CB 4.15Å; F218-F241 AromaticContact CD1-CD1 3.68Å; F218-F241 HydrophobicContact CD1-CD1 3.68Å; F218-F241 AromaticContact CD1-CD2 3.75Å; F218-F241 HydrophobicContact CD1-CD2 3.75Å; F218-F241 AromaticContact CD1-CE1 3.95Å; F218-F241 HydrophobicContact CD1-CE1 3.95Å; F218-F241 HydrophobicContact CD1-CE2 4.02Å; F218-F241 AromaticContact CD1-CG 3.57Å; F218-F241 HydrophobicContact CD1-CG 3.57Å; F218-F241 HydrophobicContact CD1-CZ 4.11Å; F218-F241 HydrophobicContact CD2-CE2 4.4Å; F218-F241 HydrophobicContact CD2-CZ 4.36Å; F218-F241 HydrophobicContact CE1-CB 4.17Å; F218-F241 HydrophobicContact CE1-CD1 4.4Å; F218-F241 AromaticContact CE1-CD2 3.67Å; F218-F241 HydrophobicContact CE1-CD2 3.67Å; F218-F241 HydrophobicContact CE1-CE2 4.13Å; F218-F241 AromaticContact CE1-CG 3.82Å; F218-F241 HydrophobicContact CE1-CG 3.82Å; F218-F241 HydrophobicContact CG-CD1 4.15Å; F218-F241 HydrophobicContact CG-CD2 4.35Å; F218-F241 AromaticContact CG-CE1 3.93Å; F218-F241 HydrophobicContact CG-CE1 3.93Å; F218-F241 HydrophobicContact CG-CE2 4.15Å; F218-F241 HydrophobicContact CG-CG 4.34Å; F218-F241 AromaticContact CG-CZ 3.93Å; F218-F241 HydrophobicContact CG-CZ 3.93Å; F218-F241 HydrophobicContact CZ-CD2 4.22Å; F218-F241 HydrophobicContact CZ-CE2 4.36Å; L237-F241 PolarHBondContact O-N 3.15Å; R238-F241 PolarHBondContact O-N 2.91Å; F241-E245 VanDerWaalsContact CA-OE2 3.31Å; F241-E245 WeakPolarHBondContact CA-OE2 3.5Å; F241-E245 HydrophobicContact CD2-CB 3.83Å; F241-E245 HydrophobicContact CE2-CB 4.07Å; F241-E245 PolarHBondContact O-N 3.36Å; F241-L246 HydrophobicContact CD1-CB 4.29Å; F241-L246 HydrophobicContact CE1-CB 4.15Å; F241-L246 HydrophobicContact CE1-CD1 4Å; F241-L246 HydrophobicContact CE1-CG 4.49Å; F241-L246 HydrophobicContact CZ-CD1 4.45Å; F241-L246 VanDerWaalsContact O-CB 3.23Å; F241-L246 WeakPolarHBondContact O-CB 3.33Å; F241-L246 PolarHBondContact O-N 3.44Å; F241-L249 HydrophobicContact CZ-CD1 4.46Å; F241-W293 HydrophobicContact CD1-CH2 4.37Å; F241-W293 AromaticContact CD1-CZ2 3.97Å; F241-W293 HydrophobicContact CD1-CZ2 3.97Å; F241-W293 AromaticContact CE1-CH2 3.68Å; F241-W293 HydrophobicContact CE1-CH2 3.68Å; F241-W293 AromaticContact CE1-CZ2 3.73Å; F241-W293 HydrophobicContact CE1-CZ2 3.73Å
242Q90.9Very high89.6Confident8 Ų824.4 Ų24.44%0.03711%0.108CC..Iπ-helixtrans-67.6-36.4-176.3-69.817212.700112.9R238 R240 D294 L296 W323R238-Q242 VanDerWaalsContact O-CB 3.27Å; R238-Q242 WeakPolarHBondContact O-CB 3.27Å; R238-Q242 WeakPolarHBondContact O-CG 3.15Å; R238-Q242 PolarHBondContact O-N 2.96Å; R240-Q242 PolarHBondContact O-N 3.33Å; Q242-D294 PolarHBondContact NE2-O 3.34Å; Q242-L296 VanDerWaalsContact OE1-N 3.14Å; Q242-W323 PolarHBondContact O-NE1 3.06Å
243D89.4Confident90.6Very high29 Ų2922.7 Ų22.716%0.15510%0.101CC..Iπ-helixtrans-88.8-17.1-173.2-79.1-9.7000114.3A239 R240 V247 S320 K322A239-D243 VanDerWaalsContact O-CB 3.32Å; A239-D243 WeakPolarHBondContact O-CB 3.49Å; A239-D243 PolarHBondContact O-N 3.49Å; A239-D243 VanDerWaalsContact O-N 3.13Å; R240-D243 PolarHBondContact O-N 3.04Å; D243-V247 WeakPolarHBondContact O-CG2 3.43Å; D243-S320 VanDerWaalsContact CG-OG 3.23Å; D243-S320 WeakPolarHBondContact OD1-CB 3.23Å; D243-S320 PolarHBondContact OD1-OG 3.15Å; D243-K322 HydrophobicContact CB-CB 4.35Å; D243-K322 HydrophobicContact CB-CG 4.04Å; D243-K322 VanDerWaalsContact O-CB 3.22Å; D243-K322 WeakPolarHBondContact O-CB 3.41Å
244Y92.8Very high91.3Very high66 Ų6623.5 Ų23.526%0.25911%0.105SC..Iπ-helixtrans-129.2-65.9-174-64.2-93000112.3P164 R240 V247 R248 K322P164-Y244 HydrophobicContact CG-CE2 4.17Å; R240-Y244 WeakPolarHBondContact O-CD2 3.34Å; R240-Y244 PolarHBondContact O-N 3.47Å; Y244-V247 PolarHBondContact O-N 3.12Å; Y244-R248 PolarHBondContact O-N 3.11Å; Y244-K322 WeakPolarHBondContact OH-CE 3.29Å
245E94.8Very high91.9Very high4 Ų426.6 Ų26.62%0.01913%0.127CC..Iπ-helixtrans-70.6-41.2-171.9-67.675.8-156.100112.1P167 L171 I172 I175 R240 F241 V247 R248 L249P167-E245 WeakPolarHBondContact CB-OE1 3.45Å; L171-E245 HydrophobicContact CD2-CB 4.49Å; L171-E245 HydrophobicContact CD2-CG 3.97Å; I172-E245 HydrophobicContact CD1-CG 4.02Å; I175-E245 HydrophobicContact CD1-CB 3.76Å; I175-E245 HydrophobicContact CD1-CG 3.8Å; R240-E245 IonicContact CZ-OE1 2.79Å; R240-E245 IonicContact NE-OE1 3.99Å; R240-E245 PolarHBondContact NE-OE1 2.95Å; R240-E245 IonicContact NE-OE2 3.42Å; R240-E245 IonicContact NH2-OE1 3.65Å; R240-E245 PolarHBondContact NH2-OE1 3.11Å; F241-E245 VanDerWaalsContact CA-OE2 3.31Å; F241-E245 WeakPolarHBondContact CA-OE2 3.5Å; F241-E245 HydrophobicContact CD2-CB 3.83Å; F241-E245 HydrophobicContact CE2-CB 4.07Å; F241-E245 PolarHBondContact O-N 3.36Å; E245-V247 VanDerWaalsContact C-N 3.35Å; E245-V247 PolarHBondContact O-N 3.18Å; E245-R248 WeakPolarHBondContact O-CB 3.32Å; E245-R248 PolarHBondContact O-N 3.17Å; E245-L249 WeakPolarHBondContact O-CG 3.43Å; E245-L249 PolarHBondContact O-N 3.31Å
246L94.7Very high92.4Very high0 Ų026.5 Ų26.50%013%0.126CC..Hα-helixtrans-64.4-38.9175.8-169.861.1000111.7L215 F241 L249 F250 I290 W293 W323L215-L246 HydrophobicContact CD2-CD1 3.66Å; F241-L246 HydrophobicContact CD1-CB 4.29Å; F241-L246 HydrophobicContact CE1-CB 4.15Å; F241-L246 HydrophobicContact CE1-CD1 4Å; F241-L246 HydrophobicContact CE1-CG 4.49Å; F241-L246 HydrophobicContact CZ-CD1 4.45Å; F241-L246 VanDerWaalsContact O-CB 3.23Å; F241-L246 WeakPolarHBondContact O-CB 3.33Å; F241-L246 PolarHBondContact O-N 3.44Å; L246-L249 PolarHBondContact O-N 3.25Å; L246-F250 WeakPolarHBondContact O-CB 3.24Å; L246-F250 PolarHBondContact O-N 3.08Å; L246-I290 HydrophobicContact CD1-CD1 4.28Å; L246-I290 HydrophobicContact CD1-CG1 3.89Å; L246-I290 HydrophobicContact CD1-CG2 4.2Å; L246-I290 HydrophobicContact CG-CG2 4.27Å; L246-W293 HydrophobicContact CD1-CE3 4.35Å; L246-W293 HydrophobicContact CD1-CZ3 4.34Å; L246-W293 HydrophobicContact CD2-CD2 3.77Å; L246-W293 HydrophobicContact CD2-CE3 4.21Å; L246-W293 HydrophobicContact CD2-CG 3.96Å; L246-W293 HydrophobicContact CD2-CZ2 4.49Å; L246-W323 HydrophobicContact CB-CZ2 4.27Å; L246-W323 HydrophobicContact CD2-CH2 4.37Å; L246-W323 HydrophobicContact CD2-CZ2 3.97Å; L246-W323 HydrophobicContact CG-CH2 4.1Å; L246-W323 HydrophobicContact CG-CZ2 3.92Å
247V94Very high92.6Very high17 Ų1726.3 Ų26.310%0.10313%0.126CC..Hα-helixtrans-60.6-46.3174.3-178.60000110.8D243 Y244 E245 F250 K251 W323D243-V247 WeakPolarHBondContact O-CG2 3.43Å; Y244-V247 PolarHBondContact O-N 3.12Å; E245-V247 VanDerWaalsContact C-N 3.35Å; E245-V247 PolarHBondContact O-N 3.18Å; V247-F250 PolarHBondContact O-N 3.19Å; V247-K251 WeakPolarHBondContact O-CB 3.47Å; V247-K251 PolarHBondContact O-N 3.38Å; V247-W323 HydrophobicContact CG2-CD2 3.71Å; V247-W323 HydrophobicContact CG2-CE3 4.48Å; V247-W323 HydrophobicContact CG2-CG 3.79Å; V247-W323 HydrophobicContact CG2-CZ2 3.92Å; V247-W323 VanDerWaalsContact CG2-NE1 3.27Å
248R94.5Very high92.7Very high84 Ų8429.7 Ų29.732%0.31714%0.144SC..Hα-helixtrans-60.1-48.1178179.2178.9174.8176.80.1111E179 Y244 E245 K251 N252E179-R248 VanDerWaalsContact CD-NH2 3.31Å; E179-R248 IonicContact OE1-CZ 2.77Å; E179-R248 IonicContact OE1-NE 3.66Å; E179-R248 PolarHBondContact OE1-NE 3.39Å; E179-R248 IonicContact OE1-NH2 2.91Å; E179-R248 PolarHBondContact OE1-NH2 2.86Å; E179-R248 IonicContact OE2-CZ 3.39Å; E179-R248 IonicContact OE2-NE 3.4Å; E179-R248 IonicContact OE2-NH2 2.97Å; E179-R248 PolarHBondContact OE2-NH2 2.84Å; Y244-R248 PolarHBondContact O-N 3.11Å; E245-R248 WeakPolarHBondContact O-CB 3.32Å; E245-R248 PolarHBondContact O-N 3.17Å; R248-K251 PolarHBondContact O-N 3.44Å; R248-N252 PolarHBondContact O-N 3.28Å; R248-N252 VanDerWaalsContact O-N 3.15Å; R248-N252 PolarHBondContact O-ND2 2.84Å
249L95.2Very high92.6Very high4 Ų430.7 Ų30.72%0.02115%0.15CC..Hα-helixtrans-62.2-44.7178.2-69.4174.2000111.9I175 L211 L214 L215 F241 E245 L246 N252 L253I175-L249 HydrophobicContact CG1-CD2 4.37Å; I175-L249 HydrophobicContact CG2-CD2 4Å; L211-L249 HydrophobicContact CD1-CB 4.47Å; L211-L249 HydrophobicContact CD1-CD1 3.86Å; L211-L249 HydrophobicContact CD1-CD2 3.78Å; L211-L249 HydrophobicContact CD1-CG 4.25Å; L214-L249 HydrophobicContact CD2-CD1 4.19Å; L215-L249 HydrophobicContact CD2-CD1 4.5Å; F241-L249 HydrophobicContact CZ-CD1 4.46Å; E245-L249 WeakPolarHBondContact O-CG 3.43Å; E245-L249 PolarHBondContact O-N 3.31Å; L246-L249 PolarHBondContact O-N 3.25Å; L249-N252 PolarHBondContact O-N 3.17Å; L249-L253 WeakPolarHBondContact O-CG 3.43Å; L249-L253 PolarHBondContact O-N 2.67Å
250F94.9Very high92.5Very high0 Ų030.9 Ų30.90%015%0.15CC..Hα-helixtrans-62-45.7178.2-173.2-116.3000112L246 V247 N252 L253 L254 L287 I290 T291 W323 T326 I327 F339L246-F250 WeakPolarHBondContact O-CB 3.24Å; L246-F250 PolarHBondContact O-N 3.08Å; V247-F250 PolarHBondContact O-N 3.19Å; F250-N252 VanDerWaalsContact C-N 3.31Å; F250-N252 PolarHBondContact O-N 3.48Å; F250-L253 PolarHBondContact O-N 3.09Å; F250-L254 HydrophobicContact CD1-CD1 3.84Å; F250-L254 HydrophobicContact CD1-CG 4.26Å; F250-L254 HydrophobicContact CE1-CD1 3.51Å; F250-L254 HydrophobicContact CE1-CD2 4.25Å; F250-L254 HydrophobicContact CE1-CG 4.02Å; F250-L254 HydrophobicContact CE2-CD2 4.2Å; F250-L254 HydrophobicContact CE2-CG 4.39Å; F250-L254 HydrophobicContact CZ-CD1 4.01Å; F250-L254 HydrophobicContact CZ-CD2 3.87Å; F250-L254 HydrophobicContact CZ-CG 4.09Å; F250-L254 WeakPolarHBondContact O-CG 3.35Å; F250-L254 PolarHBondContact O-N 3.23Å; F250-L287 HydrophobicContact CD2-CD2 4.06Å; F250-L287 HydrophobicContact CE2-CD2 3.71Å; F250-I290 HydrophobicContact CB-CD1 4.22Å; F250-I290 HydrophobicContact CB-CG2 4.16Å; F250-I290 HydrophobicContact CD2-CB 4.07Å; F250-I290 HydrophobicContact CD2-CD1 4Å; F250-I290 HydrophobicContact CD2-CG2 3.57Å; F250-I290 HydrophobicContact CE2-CG2 4.19Å; F250-I290 HydrophobicContact CG-CG2 4.04Å; F250-T291 HydrophobicContact CE2-CG2 4.41Å; F250-W323 HydrophobicContact CB-CH2 4.15Å; F250-W323 HydrophobicContact CB-CZ3 4.05Å; F250-W323 HydrophobicContact CD1-CE3 4.25Å; F250-W323 HydrophobicContact CD1-CH2 4.4Å; F250-W323 AromaticContact CD1-CZ3 3.52Å; F250-W323 HydrophobicContact CD1-CZ3 3.52Å; F250-W323 HydrophobicContact CE1-CZ3 4.07Å; F250-W323 HydrophobicContact CG-CH2 4.31Å; F250-W323 AromaticContact CG-CZ3 3.85Å; F250-W323 HydrophobicContact CG-CZ3 3.85Å; F250-T326 HydrophobicContact CD1-CG2 4.26Å; F250-I327 HydrophobicContact CE1-CD1 3.83Å; F250-I327 HydrophobicContact CE1-CG1 4.15Å; F250-I327 HydrophobicContact CZ-CD1 4.41Å; F250-F339 HydrophobicContact CE2-CZ 4.48Å; F250-F339 HydrophobicContact CZ-CE2 4.35Å; F250-F339 HydrophobicContact CZ-CZ 4.48Å
251K93.7Very high92.2Very high97 Ų9729.7 Ų29.742%0.42215%0.147SC..Hα-helixtrans-56.9-44.8177-175.1175.6-178.4171.50111.9V247 R248 L254 C255 T326V247-K251 WeakPolarHBondContact O-CB 3.47Å; V247-K251 PolarHBondContact O-N 3.38Å; R248-K251 PolarHBondContact O-N 3.44Å; K251-L254 PolarHBondContact O-N 2.9Å; K251-C255 PolarHBondContact O-N 3.45Å; K251-C255 PolarHBondContact O-SG 2.93Å; K251-C255 VanDerWaalsContact O-SG 3.41Å; K251-T326 HydrophobicContact CB-CG2 3.91Å; K251-T326 HydrophobicContact CG-CG2 4.26Å
252N92.7Very high91.9Very high61 Ų6134 Ų3433%0.32617%0.173SC..Hα-helixtrans-65.7-40.5177.9-68.5-16000112.1E179 R248 L249 F250 C255 L256E179-N252 WeakPolarHBondContact CG-ND2 3.39Å; E179-N252 PolarHBondContact OE1-ND2 3.01Å; R248-N252 PolarHBondContact O-N 3.28Å; R248-N252 VanDerWaalsContact O-N 3.15Å; R248-N252 PolarHBondContact O-ND2 2.84Å; L249-N252 PolarHBondContact O-N 3.17Å; F250-N252 VanDerWaalsContact C-N 3.31Å; F250-N252 PolarHBondContact O-N 3.48Å; N252-C255 PolarHBondContact O-N 3.29Å; N252-L256 WeakPolarHBondContact O-CB 3.37Å; N252-L256 PolarHBondContact O-N 3.46Å
253L94.8Very high91.4Very high4 Ų434.3 Ų34.32%0.02118%0.176CC..Hα-helixtrans-62.9-40.2174.8-78.5169.6000112.3L208 L211 L249 F250 L256 A257 V283 C286 L287 I290L208-L253 HydrophobicContact CD2-CD2 4.2Å; L211-L253 HydrophobicContact CD2-CD1 3.99Å; L211-L253 HydrophobicContact CD2-CD2 3.79Å; L211-L253 HydrophobicContact CD2-CG 4.01Å; L249-L253 WeakPolarHBondContact O-CG 3.43Å; L249-L253 PolarHBondContact O-N 2.67Å; F250-L253 PolarHBondContact O-N 3.09Å; L253-L256 PolarHBondContact O-N 3.07Å; L253-A257 VanDerWaalsContact O-CB 3.3Å; L253-A257 WeakPolarHBondContact O-CB 3.45Å; L253-A257 PolarHBondContact O-N 2.96Å; L253-V283 HydrophobicContact CD2-CG1 4.49Å; L253-C286 HydrophobicContact CD1-CB 3.68Å; L253-C286 HydrophobicContact CD2-CB 4.16Å; L253-L287 HydrophobicContact CB-CD2 3.89Å; L253-I290 HydrophobicContact CD1-CD1 3.47Å; L253-I290 VanDerWaalsContact CD1-CD1 3.47Å
254L93.6Very high91.1Very high17 Ų1733 Ų339%0.08917%0.169CC..Hα-helixtrans-62.9-43.7174.5-67.8177.8000111.5F250 K251 L256 A257 N258 L287 T326 T335 L338 F339F250-L254 HydrophobicContact CD1-CD1 3.84Å; F250-L254 HydrophobicContact CD1-CG 4.26Å; F250-L254 HydrophobicContact CE1-CD1 3.51Å; F250-L254 HydrophobicContact CE1-CD2 4.25Å; F250-L254 HydrophobicContact CE1-CG 4.02Å; F250-L254 HydrophobicContact CE2-CD2 4.2Å; F250-L254 HydrophobicContact CE2-CG 4.39Å; F250-L254 HydrophobicContact CZ-CD1 4.01Å; F250-L254 HydrophobicContact CZ-CD2 3.87Å; F250-L254 HydrophobicContact CZ-CG 4.09Å; F250-L254 WeakPolarHBondContact O-CG 3.35Å; F250-L254 PolarHBondContact O-N 3.23Å; K251-L254 PolarHBondContact O-N 2.9Å; L254-L256 VanDerWaalsContact C-N 3.34Å; L254-L256 PolarHBondContact O-N 3.47Å; L254-A257 PolarHBondContact O-N 3.36Å; L254-N258 WeakPolarHBondContact O-CB 3.31Å; L254-N258 PolarHBondContact O-N 2.98Å; L254-L287 HydrophobicContact CD2-CD2 4.06Å; L254-T326 HydrophobicContact CD1-CG2 4.44Å; L254-T335 HydrophobicContact CD1-CG2 4.08Å; L254-T335 HydrophobicContact CD2-CG2 4.18Å; L254-L338 HydrophobicContact CB-CD2 4.3Å; L254-L338 HydrophobicContact CD2-CD2 4.05Å; L254-L338 WeakPolarHBondContact O-CD2 3.45Å; L254-F339 HydrophobicContact CD2-CE2 3.74Å; L254-F339 HydrophobicContact CD2-CZ 4.37Å
255C91.9Very high90.3Very high75 Ų7533.3 Ų33.351%0.50718%0.18SC..Hα-helixtrans-60.9-44.3175.4-71.30000111.7K251 N252 N258 Q259K251-C255 PolarHBondContact O-N 3.45Å; K251-C255 PolarHBondContact O-SG 2.93Å; K251-C255 VanDerWaalsContact O-SG 3.41Å; N252-C255 PolarHBondContact O-N 3.29Å; C255-N258 PolarHBondContact O-N 3.44Å; C255-Q259 PolarHBondContact O-N 3.36Å
256L92.1Very high89.5Confident1 Ų138.2 Ų38.21%0.00522%0.215CC..Hα-helixtrans-62.2-50.2176.2179.765.8000111.2I182 L185 T186 L208 N252 L253 L254 N258 Q259 L260 V283I182-L256 HydrophobicContact CG2-CD1 4.19Å; I182-L256 HydrophobicContact CG2-CD2 3.8Å; I182-L256 HydrophobicContact CG2-CG 4.48Å; L185-L256 HydrophobicContact CB-CD1 3.65Å; L185-L256 HydrophobicContact CD1-CD1 4.27Å; T186-L256 HydrophobicContact CG2-CB 4.45Å; T186-L256 HydrophobicContact CG2-CD1 3.94Å; L208-L256 HydrophobicContact CD2-CD2 4.24Å; N252-L256 WeakPolarHBondContact O-CB 3.37Å; N252-L256 PolarHBondContact O-N 3.46Å; L253-L256 PolarHBondContact O-N 3.07Å; L254-L256 VanDerWaalsContact C-N 3.34Å; L254-L256 PolarHBondContact O-N 3.47Å; L256-N258 VanDerWaalsContact C-N 3.3Å; L256-N258 PolarHBondContact O-N 2.81Å; L256-Q259 PolarHBondContact O-N 2.92Å; L256-Q259 VanDerWaalsContact O-N 3.09Å; L256-L260 HydrophobicContact CD1-CD1 4.41Å; L256-L260 HydrophobicContact CD1-CD2 4.46Å; L256-L260 HydrophobicContact CD1-CG 4.23Å; L256-L260 HydrophobicContact CG-CD1 4.15Å; L256-L260 HydrophobicContact CG-CG 4.34Å; L256-L260 WeakPolarHBondContact O-CG 3.08Å; L256-L260 PolarHBondContact O-N 3.1Å; L256-V283 HydrophobicContact CD2-CG2 3.56Å; L256-V283 HydrophobicContact CG-CG2 4.27Å
257A92.5Very high88.7Confident1 Ų140.3 Ų40.31%0.00823%0.226CC..Hα-helixtrans-57.7-42.5179.100000112L253 L254 L260 L261 V283 L287 L338 L342L253-A257 VanDerWaalsContact O-CB 3.3Å; L253-A257 WeakPolarHBondContact O-CB 3.45Å; L253-A257 PolarHBondContact O-N 2.96Å; L254-A257 PolarHBondContact O-N 3.36Å; A257-L260 PolarHBondContact O-N 2.68Å; A257-L261 WeakPolarHBondContact O-CB 3.31Å; A257-L261 PolarHBondContact O-N 2.98Å; A257-V283 HydrophobicContact CB-CG1 4.04Å; A257-L287 HydrophobicContact CB-CD1 4.21Å; A257-L338 HydrophobicContact CB-CD2 4.33Å; A257-L342 HydrophobicContact CB-CD1 3.93Å
258N90.8Very high87.7Confident79 Ų7945.4 Ų45.442%0.42225%0.253SS..Hα-helixtrans-63.6-42.1175.4-174.767.7000112.1L254 C255 L256 L261 V262 L338L254-N258 WeakPolarHBondContact O-CB 3.31Å; L254-N258 PolarHBondContact O-N 2.98Å; C255-N258 PolarHBondContact O-N 3.44Å; L256-N258 VanDerWaalsContact C-N 3.3Å; L256-N258 PolarHBondContact O-N 2.81Å; N258-L261 PolarHBondContact O-N 3.27Å; N258-V262 WeakPolarHBondContact O-CG2 3.45Å; N258-V262 PolarHBondContact O-N 3.29Å; N258-L338 HydrophobicContact CB-CD1 3.87Å; N258-L338 HydrophobicContact CB-CD2 4.15Å
259Q88Confident86.9Confident51 Ų5142.2 Ų42.224%0.23824%0.244CC..Hα-helixtrans-64.6-44.9177.2-174.1658.500111.9C255 L256 L261 V262 C263C255-Q259 PolarHBondContact O-N 3.36Å; L256-Q259 PolarHBondContact O-N 2.92Å; L256-Q259 VanDerWaalsContact O-N 3.09Å; Q259-L261 VanDerWaalsContact C-N 3.32Å; Q259-L261 PolarHBondContact O-N 3.38Å; Q259-V262 PolarHBondContact O-N 3.48Å; Q259-C263 PolarHBondContact O-N 2.62Å; Q259-C263 PolarHBondContact O-SG 3.37Å; Q259-C263 VanDerWaalsContact O-SG 3.35Å
260L86.5Confident86.1Confident6 Ų647.1 Ų47.13%0.03128%0.278CS..Hα-helixtrans-61-42.6177.5-66-178.7000111.4L190 L256 A257 V262 C263 W264 V279 V283L190-L260 HydrophobicContact CD1-CD2 4.17Å; L256-L260 HydrophobicContact CD1-CD1 4.41Å; L256-L260 HydrophobicContact CD1-CD2 4.46Å; L256-L260 HydrophobicContact CD1-CG 4.23Å; L256-L260 HydrophobicContact CG-CD1 4.15Å; L256-L260 HydrophobicContact CG-CG 4.34Å; L256-L260 WeakPolarHBondContact O-CG 3.08Å; L256-L260 PolarHBondContact O-N 3.1Å; A257-L260 PolarHBondContact O-N 2.68Å; L260-V262 VanDerWaalsContact C-N 3.34Å; L260-V262 PolarHBondContact O-N 3.43Å; L260-C263 PolarHBondContact O-N 3.15Å; L260-W264 HydrophobicContact CB-CE3 4.19Å; L260-W264 HydrophobicContact CB-CZ3 4.32Å; L260-W264 HydrophobicContact CD1-CZ3 4.21Å; L260-W264 HydrophobicContact CD2-CE3 4.14Å; L260-W264 HydrophobicContact CD2-CH2 3.66Å; L260-W264 HydrophobicContact CD2-CZ2 4.13Å; L260-W264 HydrophobicContact CD2-CZ3 3.65Å; L260-W264 HydrophobicContact CG-CZ3 4.26Å; L260-W264 WeakPolarHBondContact O-CB 3.45Å; L260-W264 PolarHBondContact O-N 3.44Å; L260-V279 HydrophobicContact CD1-CG1 3.85Å; L260-V283 HydrophobicContact CD1-CG2 4.07Å
261L86.1Confident85.4Confident17 Ų1750.2 Ų50.29%0.08930%0.303CS..Hα-helixtrans-61.2-43.2175.4-174.172.8000111.3A257 N258 Q259 S265 L338 K341 W345A257-L261 WeakPolarHBondContact O-CB 3.31Å; A257-L261 PolarHBondContact O-N 2.98Å; N258-L261 PolarHBondContact O-N 3.27Å; Q259-L261 VanDerWaalsContact C-N 3.32Å; Q259-L261 PolarHBondContact O-N 3.38Å; L261-S265 WeakPolarHBondContact O-CA 3.09Å; L261-S265 WeakPolarHBondContact O-CB 3.26Å; L261-S265 PolarHBondContact O-N 3.1Å; L261-S265 PolarHBondContact O-OG 2.89Å; L261-L338 HydrophobicContact CD2-CD1 4.08Å; L261-K341 HydrophobicContact CD2-CB 3.57Å; L261-K341 HydrophobicContact CD2-CD 4.09Å; L261-K341 HydrophobicContact CD2-CG 4.48Å; L261-W345 HydrophobicContact CD1-CB 4.13Å; L261-W345 HydrophobicContact CD1-CD2 4.43Å; L261-W345 HydrophobicContact CD1-CE3 4.38Å; L261-W345 HydrophobicContact CD1-CG 4.34Å
262V85.5Confident84.9Confident94 Ų9446.4 Ų46.457%0.5729%0.288SS*.Hα-helixtrans-63-43.5176.5170.60000111.4N258 Q259 L260N258-V262 WeakPolarHBondContact O-CG2 3.45Å; N258-V262 PolarHBondContact O-N 3.29Å; Q259-V262 PolarHBondContact O-N 3.48Å; L260-V262 VanDerWaalsContact C-N 3.34Å; L260-V262 PolarHBondContact O-N 3.43Å
263C81.6Confident84.5Confident13 Ų1346.1 Ų46.19%0.08829%0.291CS..Hα-helixtrans-73.1-33.6-177.3-67.40000113.9L190 Q259 L260L190-C263 HydrophobicContact CB-CB 4.02Å; Q259-C263 PolarHBondContact O-N 2.62Å; Q259-C263 PolarHBondContact O-SG 3.37Å; Q259-C263 VanDerWaalsContact O-SG 3.35Å; L260-C263 PolarHBondContact O-N 3.15Å
264W82.8Confident84Confident2 Ų254.1 Ų54.11%0.00833%0.328CS..Hα-helixtrans-116.9-3.9-169.1-60.1-25.5000115L190 L201 L260 S266 L267 L272 Q276 V279 V280 W345L190-W264 HydrophobicContact CD1-CZ2 4.23Å; L201-W264 HydrophobicContact CD2-CH2 4.39Å; L201-W264 HydrophobicContact CD2-CZ2 4.43Å; L260-W264 HydrophobicContact CB-CE3 4.19Å; L260-W264 HydrophobicContact CB-CZ3 4.32Å; L260-W264 HydrophobicContact CD1-CZ3 4.21Å; L260-W264 HydrophobicContact CD2-CE3 4.14Å; L260-W264 HydrophobicContact CD2-CH2 3.66Å; L260-W264 HydrophobicContact CD2-CZ2 4.13Å; L260-W264 HydrophobicContact CD2-CZ3 3.65Å; L260-W264 HydrophobicContact CG-CZ3 4.26Å; L260-W264 WeakPolarHBondContact O-CB 3.45Å; L260-W264 PolarHBondContact O-N 3.44Å; W264-S266 PolarHBondContact O-N 3.48Å; W264-L267 PolarHBondContact O-N 3.42Å; W264-L272 HydrophobicContact CB-CD2 4.33Å; W264-L272 HydrophobicContact CD2-CD2 4.2Å; W264-L272 HydrophobicContact CE3-CD2 4.29Å; W264-L272 HydrophobicContact CG-CD2 4.24Å; W264-Q276 HydrophobicContact CH2-CB 3.95Å; W264-Q276 HydrophobicContact CH2-CG 3.91Å; W264-Q276 HydrophobicContact CZ2-CB 4.19Å; W264-Q276 HydrophobicContact CZ2-CG 3.69Å; W264-Q276 HydrophobicContact CZ3-CB 4.3Å; W264-V279 HydrophobicContact CH2-CG1 4.37Å; W264-V280 HydrophobicContact CE3-CG2 3.91Å; W264-V280 HydrophobicContact CZ3-CG2 3.63Å; W264-W345 HydrophobicContact CB-CH2 4.15Å; W264-W345 HydrophobicContact CB-CZ2 3.82Å; W264-W345 HydrophobicContact CE3-CH2 4.12Å
265S76.6Confident83.5Confident72 Ų7254.3 Ų54.350%0.50333%0.334SS..THydrogen-bonded Turntrans-58.4-20.7177.749.90000114.6L261 L267L261-S265 WeakPolarHBondContact O-CA 3.09Å; L261-S265 WeakPolarHBondContact O-CB 3.26Å; L261-S265 PolarHBondContact O-N 3.1Å; L261-S265 PolarHBondContact O-OG 2.89Å; S265-L267 VanDerWaalsContact C-N 3.28Å
266S76.5Confident83.3Confident108 Ų10851.8 Ų51.876%0.75532%0.315SS*.THydrogen-bonded Turntrans-77.1-13174.661.90000114W264W264-S266 PolarHBondContact O-N 3.48Å
267L78.3Confident83.1Confident44 Ų4454 Ų5423%0.2333%0.331CS..SBendtrans-104.8140.7177.7-66.9119.8000109.9W264 S265 W345W264-L267 PolarHBondContact O-N 3.42Å; S265-L267 VanDerWaalsContact C-N 3.28Å; L267-W345 PolarHBondContact O-NE1 3.2Å
268D74.2Confident82.9Confident123 Ų12356.7 Ų56.766%0.65834%0.343SS*.  trans-63.5139167.2-65.1-33000109.4S270 A271D268-S270 PolarHBondContact O-N 2.81Å; D268-A271 WeakPolarHBondContact O-CB 3.45Å; D268-A271 PolarHBondContact O-N 3.29Å
269C76.3Confident82.9Confident18 Ų1852.9 Ų52.912%0.12232%0.323CS..G310 helixtrans-56.3-29.5-177.5-1720000112.6A271 L272C269-A271 VanDerWaalsContact C-N 3.29Å; C269-A271 PolarHBondContact O-N 2.84Å; C269-L272 WeakPolarHBondContact O-CD1 3.13Å; C269-L272 WeakPolarHBondContact O-CG 3.36Å
270S78.3Confident83.1Confident107 Ų10750.8 Ų50.875%0.74831%0.313SS*.G310 helixtrans-72.3-17.4175.956.30000114.3D268D268-S270 PolarHBondContact O-N 2.81Å
271A81.4Confident83.4Confident64 Ų6453 Ų5353%0.52932%0.322SS..G310 helixtrans-89.4-3.1179.600000113.2D268 C269D268-A271 WeakPolarHBondContact O-CB 3.45Å; D268-A271 PolarHBondContact O-N 3.29Å; C269-A271 VanDerWaalsContact C-N 3.29Å; C269-A271 PolarHBondContact O-N 2.84Å
272L82.6Confident83.8Confident18 Ų1854.4 Ų54.49%0.09433%0.327CS..SBendtrans-66.1141.7176.6-65.9170.8000111W264 C269 Q276 V280 W345W264-L272 HydrophobicContact CB-CD2 4.33Å; W264-L272 HydrophobicContact CD2-CD2 4.2Å; W264-L272 HydrophobicContact CE3-CD2 4.29Å; W264-L272 HydrophobicContact CG-CD2 4.24Å; C269-L272 WeakPolarHBondContact O-CD1 3.13Å; C269-L272 WeakPolarHBondContact O-CG 3.36Å; L272-Q276 HydrophobicContact CB-CB 4.13Å; L272-Q276 HydrophobicContact CD2-CB 4.12Å; L272-V280 HydrophobicContact CD1-CG2 4.1Å; L272-W345 HydrophobicContact CD1-CH2 3.76Å; L272-W345 HydrophobicContact CD1-CZ2 3.83Å; L272-W345 HydrophobicContact CD2-CZ2 4.36Å; L272-W345 HydrophobicContact CG-CZ2 4.46Å
273S83.7Confident84.2Confident55 Ų5550 Ų5039%0.38530%0.3SS..  trans-62.2158.3168.763.50000111.2G275 Q276 S277S273-G275 VanDerWaalsContact C-N 3.27Å; S273-G275 PolarHBondContact O-N 2.99Å; S273-Q276 PolarHBondContact O-N 2.51Å; S273-Q276 WeakPolarHBondContact OG-CB 3.33Å; S273-Q276 WeakPolarHBondContact OG-CG 3.38Å; S273-Q276 PolarHBondContact OG-N 3.1Å; S273-Q276 PolarHBondContact OG-OE1 3.18Å; S273-S277 PolarHBondContact O-N 3.45Å
274Q84.1Confident84.9Confident171 Ų17149.6 Ų49.680%0.79930%0.297SS*.Hα-helixtrans-52.6-44.4179.7-174.8179.40.800112.5S277 E278Q274-S277 PolarHBondContact O-N 3.2Å; Q274-E278 PolarHBondContact O-N 2.72Å
275G83.9Confident85.4Confident22 Ų2249.8 Ų49.823%0.22730%0.299CS..Hα-helixtrans-66.5-38.6178.600000113.4S273 E278 V279S273-G275 VanDerWaalsContact C-N 3.27Å; S273-G275 PolarHBondContact O-N 2.99Å; G275-E278 PolarHBondContact O-N 2.89Å; G275-V279 WeakPolarHBondContact O-CG2 3.45Å; G275-V279 PolarHBondContact O-N 3.48Å; G275-V279 VanDerWaalsContact O-N 3.14Å
276Q86.9Confident86.3Confident22 Ų2246.4 Ų46.410%0.10328%0.275CS..Hα-helixtrans-67.8-43.5176.1-70.4165.7-2600111.4L201 W264 L272 S273 E278 V279 V280L201-Q276 HydrophobicContact CD1-CG 3.96Å; L201-Q276 HydrophobicContact CD2-CG 4.19Å; W264-Q276 HydrophobicContact CH2-CB 3.95Å; W264-Q276 HydrophobicContact CH2-CG 3.91Å; W264-Q276 HydrophobicContact CZ2-CB 4.19Å; W264-Q276 HydrophobicContact CZ2-CG 3.69Å; W264-Q276 HydrophobicContact CZ3-CB 4.3Å; L272-Q276 HydrophobicContact CB-CB 4.13Å; L272-Q276 HydrophobicContact CD2-CB 4.12Å; S273-Q276 PolarHBondContact O-N 2.51Å; S273-Q276 WeakPolarHBondContact OG-CB 3.33Å; S273-Q276 WeakPolarHBondContact OG-CG 3.38Å; S273-Q276 PolarHBondContact OG-N 3.1Å; S273-Q276 PolarHBondContact OG-OE1 3.18Å; Q276-E278 VanDerWaalsContact C-N 3.31Å; Q276-E278 PolarHBondContact O-N 3.49Å; Q276-V279 WeakPolarHBondContact O-CB 3.49Å; Q276-V279 PolarHBondContact O-N 3.24Å; Q276-V279 VanDerWaalsContact O-N 3.17Å; Q276-V280 WeakPolarHBondContact O-CG2 3.2Å; Q276-V280 PolarHBondContact O-N 3.3Å
277S87.9Confident87.2Confident48 Ų4841.4 Ų41.434%0.33624%0.24SC..Hα-helixtrans-59.6-42.1176.2-176.90000111.6S273 Q274 V279 V280 F281S273-S277 PolarHBondContact O-N 3.45Å; Q274-S277 PolarHBondContact O-N 3.2Å; S277-V279 PolarHBondContact O-N 3.25Å; S277-V280 PolarHBondContact O-N 3.4Å; S277-F281 WeakPolarHBondContact O-CB 3.46Å; S277-F281 PolarHBondContact O-N 3.46Å
278E88.8Confident87.9Confident56 Ų5640.2 Ų40.226%0.26223%0.234SC..Hα-helixtrans-64.2-38.2176.1-166.7172.7-175.600112.2R111 L205 F209 Q274 G275 Q276 F281 R282R111-E278 IonicContact NH2-OE1 3.4Å; L205-E278 HydrophobicContact CD2-CB 4.01Å; L205-E278 HydrophobicContact CD2-CG 3.83Å; F209-E278 WeakPolarHBondContact CE1-OE1 3.47Å; F209-E278 VanDerWaalsContact CZ-OE1 3.25Å; F209-E278 WeakPolarHBondContact CZ-OE1 3.36Å; Q274-E278 PolarHBondContact O-N 2.72Å; G275-E278 PolarHBondContact O-N 2.89Å; Q276-E278 VanDerWaalsContact C-N 3.31Å; Q276-E278 PolarHBondContact O-N 3.49Å; E278-F281 PolarHBondContact O-N 2.97Å; E278-R282 HydrophobicContact CG-CG 4.43Å; E278-R282 WeakPolarHBondContact O-CB 3.44Å; E278-R282 VanDerWaalsContact O-CG 3.24Å; E278-R282 WeakPolarHBondContact O-CG 3.34Å; E278-R282 PolarHBondContact O-N 3.26Å
279V91.4Very high88.8Confident0 Ų036.3 Ų36.30%021%0.212CC..Hα-helixtrans-60.2-49.4173.7170.70000110.5L185 L201 L205 L208 L260 W264 G275 Q276 S277 F281 R282 V283L185-V279 HydrophobicContact CD1-CG1 4.25Å; L201-V279 HydrophobicContact CD2-CG2 4.07Å; L205-V279 HydrophobicContact CD1-CG2 4.34Å; L205-V279 HydrophobicContact CD2-CB 4.28Å; L205-V279 HydrophobicContact CD2-CG2 3.51Å; L205-V279 HydrophobicContact CG-CG2 3.58Å; L208-V279 HydrophobicContact CD1-CG1 4.04Å; L260-V279 HydrophobicContact CD1-CG1 3.85Å; W264-V279 HydrophobicContact CH2-CG1 4.37Å; G275-V279 WeakPolarHBondContact O-CG2 3.45Å; G275-V279 PolarHBondContact O-N 3.48Å; G275-V279 VanDerWaalsContact O-N 3.14Å; Q276-V279 WeakPolarHBondContact O-CB 3.49Å; Q276-V279 PolarHBondContact O-N 3.24Å; Q276-V279 VanDerWaalsContact O-N 3.17Å; S277-V279 PolarHBondContact O-N 3.25Å; V279-F281 PolarHBondContact O-N 2.85Å; V279-R282 PolarHBondContact O-N 3.28Å; V279-V283 HydrophobicContact CG1-CG2 4.37Å; V279-V283 WeakPolarHBondContact O-CG2 3.41Å; V279-V283 PolarHBondContact O-N 3.47Å
280V92Very high89.6Confident6 Ų635.5 Ų35.54%0.03621%0.206CC..Hα-helixtrans-58.7-48.8178.9175.60000110.7W264 L272 Q276 S277 R282 V283 I284 W345 V346 L352W264-V280 HydrophobicContact CE3-CG2 3.91Å; W264-V280 HydrophobicContact CZ3-CG2 3.63Å; L272-V280 HydrophobicContact CD1-CG2 4.1Å; Q276-V280 WeakPolarHBondContact O-CG2 3.2Å; Q276-V280 PolarHBondContact O-N 3.3Å; S277-V280 PolarHBondContact O-N 3.4Å; V280-R282 VanDerWaalsContact C-N 3.32Å; V280-R282 PolarHBondContact O-N 3.32Å; V280-V283 PolarHBondContact O-N 2.84Å; V280-I284 HydrophobicContact CG1-CD1 3.63Å; V280-I284 HydrophobicContact CG1-CG1 4.44Å; V280-I284 WeakPolarHBondContact O-CB 3.49Å; V280-I284 WeakPolarHBondContact O-CG1 3.48Å; V280-I284 PolarHBondContact O-N 3.39Å; V280-W345 HydrophobicContact CG1-CH2 4.4Å; V280-W345 HydrophobicContact CG1-CZ3 3.89Å; V280-W345 HydrophobicContact CG2-CH2 3.73Å; V280-W345 HydrophobicContact CG2-CZ3 3.93Å; V280-V346 HydrophobicContact CG1-CG1 4.22Å; V280-L352 HydrophobicContact CG1-CD1 4.25Å
281F93.1Very high90.1Very high52 Ų5230.4 Ų30.423%0.22817%0.171CC..Hα-helixtrans-56.4-45.2178.3173-94.7000112S277 E278 V279 S285 L351 L352S277-F281 WeakPolarHBondContact O-CB 3.46Å; S277-F281 PolarHBondContact O-N 3.46Å; E278-F281 PolarHBondContact O-N 2.97Å; V279-F281 PolarHBondContact O-N 2.85Å; F281-S285 WeakPolarHBondContact O-CB 3.36Å; F281-S285 PolarHBondContact O-N 2.9Å; F281-S285 PolarHBondContact O-OG 3.37Å; F281-L351 HydrophobicContact CD2-CD2 4.27Å; F281-L351 HydrophobicContact CE2-CD2 3.79Å; F281-L351 HydrophobicContact CE2-CG 4.26Å; F281-L352 HydrophobicContact CB-CD2 4.14Å; F281-L352 HydrophobicContact CD2-CD2 3.69Å; F281-L352 HydrophobicContact CG-CD2 4.38Å
282R93.3Very high90.4Very high47 Ų4728.7 Ų28.718%0.17716%0.159CC..Hα-helixtrans-70.5-40.2-178.6-67.7-64.8176.4-178.8-0.2112.8L208 F209 E278 V279 V280 S285 C286L208-R282 HydrophobicContact CB-CB 4.02Å; L208-R282 HydrophobicContact CD1-CB 4.1Å; F209-R282 HydrophobicContact CD1-CG 4.47Å; F209-R282 HydrophobicContact CE1-CG 4.17Å; E278-R282 HydrophobicContact CG-CG 4.43Å; E278-R282 WeakPolarHBondContact O-CB 3.44Å; E278-R282 VanDerWaalsContact O-CG 3.24Å; E278-R282 WeakPolarHBondContact O-CG 3.34Å; E278-R282 PolarHBondContact O-N 3.26Å; V279-R282 PolarHBondContact O-N 3.28Å; V280-R282 VanDerWaalsContact C-N 3.32Å; V280-R282 PolarHBondContact O-N 3.32Å; R282-S285 PolarHBondContact O-N 3.32Å; R282-C286 PolarHBondContact O-N 3.05Å; R282-C286 PolarHBondContact O-SG 3.36Å
283V94.9Very high90.7Very high3 Ų328.1 Ų28.12%0.01816%0.156CC..Hα-helixtrans-61-47.8174.9172.30000110.4L208 L253 L256 A257 L260 V279 V280 S285 C286 L287L208-V283 HydrophobicContact CD1-CG2 3.8Å; L208-V283 HydrophobicContact CD2-CG2 3.95Å; L253-V283 HydrophobicContact CD2-CG1 4.49Å; L256-V283 HydrophobicContact CD2-CG2 3.56Å; L256-V283 HydrophobicContact CG-CG2 4.27Å; A257-V283 HydrophobicContact CB-CG1 4.04Å; L260-V283 HydrophobicContact CD1-CG2 4.07Å; V279-V283 HydrophobicContact CG1-CG2 4.37Å; V279-V283 WeakPolarHBondContact O-CG2 3.41Å; V279-V283 PolarHBondContact O-N 3.47Å; V280-V283 PolarHBondContact O-N 2.84Å; V283-S285 PolarHBondContact O-N 3.15Å; V283-C286 PolarHBondContact O-N 2.91Å; V283-L287 HydrophobicContact CG1-CD1 4.18Å; V283-L287 WeakPolarHBondContact O-CG 3.31Å; V283-L287 PolarHBondContact O-N 3.01Å
284I95.3Very high90.6Very high3 Ų327.5 Ų27.52%0.01515%0.148CC..Hα-helixtrans-62.5-44.1178.1-70.1171.6000111.1V280 C286 L287 D288 L342 V346 L352 R355 T356V280-I284 HydrophobicContact CG1-CD1 3.63Å; V280-I284 HydrophobicContact CG1-CG1 4.44Å; V280-I284 WeakPolarHBondContact O-CB 3.49Å; V280-I284 WeakPolarHBondContact O-CG1 3.48Å; V280-I284 PolarHBondContact O-N 3.39Å; I284-C286 VanDerWaalsContact C-N 3.32Å; I284-C286 PolarHBondContact O-N 3.16Å; I284-L287 PolarHBondContact O-N 3.48Å; I284-D288 WeakPolarHBondContact O-CB 3.16Å; I284-D288 PolarHBondContact O-N 3.13Å; I284-L342 HydrophobicContact CD1-CD2 3.79Å; I284-L342 HydrophobicContact CG1-CD2 3.82Å; I284-V346 HydrophobicContact CD1-CG1 4Å; I284-V346 HydrophobicContact CD1-CG2 4.26Å; I284-L352 HydrophobicContact CD1-CB 4.24Å; I284-L352 HydrophobicContact CD1-CD1 4.43Å; I284-L352 HydrophobicContact CD1-CD2 4.02Å; I284-L352 HydrophobicContact CD1-CG 4.47Å; I284-L352 HydrophobicContact CG2-CD2 4.48Å; I284-R355 HydrophobicContact CG2-CB 3.79Å; I284-T356 HydrophobicContact CB-CG2 4.47Å; I284-T356 HydrophobicContact CD1-CG2 3.9Å; I284-T356 HydrophobicContact CG1-CG2 4.03Å; I284-T356 HydrophobicContact CG2-CG2 3.62Å
285S94.2Very high90.5Very high7 Ų719.8 Ų19.85%0.04911%0.112CC..Hα-helixtrans-60.5-42.3177.8-59.40000111.5F281 R282 V283 D288 M289F281-S285 WeakPolarHBondContact O-CB 3.36Å; F281-S285 PolarHBondContact O-N 2.9Å; F281-S285 PolarHBondContact O-OG 3.37Å; R282-S285 PolarHBondContact O-N 3.32Å; V283-S285 PolarHBondContact O-N 3.15Å; S285-D288 PolarHBondContact O-N 2.88Å; S285-M289 VanDerWaalsContact O-CG 3.24Å; S285-M289 WeakPolarHBondContact O-CG 3.45Å; S285-M289 PolarHBondContact O-N 3.34Å
286C95.4Very high90.2Very high0 Ų019.9 Ų19.90%011%0.107CC..Hα-helixtrans-66.5-39.2176.5-64.40000112.1L215 L253 R282 V283 I284 M289 I290L215-C286 HydrophobicContact CD1-CB 3.96Å; L253-C286 HydrophobicContact CD1-CB 3.68Å; L253-C286 HydrophobicContact CD2-CB 4.16Å; R282-C286 PolarHBondContact O-N 3.05Å; R282-C286 PolarHBondContact O-SG 3.36Å; V283-C286 PolarHBondContact O-N 2.91Å; I284-C286 VanDerWaalsContact C-N 3.32Å; I284-C286 PolarHBondContact O-N 3.16Å; C286-M289 PolarHBondContact O-N 2.59Å; C286-I290 VanDerWaalsContact O-CG1 3.23Å; C286-I290 WeakPolarHBondContact O-CG1 3.19Å; C286-I290 PolarHBondContact O-N 3.02Å
287L95.4Very high89.6Confident4 Ų419.2 Ų19.22%0.02111%0.105CC..Hα-helixtrans-62.6-43.5174.5-70.4171.9000111.4F250 L253 L254 A257 V283 I284 I290 T291 F339F250-L287 HydrophobicContact CD2-CD2 4.06Å; F250-L287 HydrophobicContact CE2-CD2 3.71Å; L253-L287 HydrophobicContact CB-CD2 3.89Å; L254-L287 HydrophobicContact CD2-CD2 4.06Å; A257-L287 HydrophobicContact CB-CD1 4.21Å; V283-L287 HydrophobicContact CG1-CD1 4.18Å; V283-L287 WeakPolarHBondContact O-CG 3.31Å; V283-L287 PolarHBondContact O-N 3.01Å; I284-L287 PolarHBondContact O-N 3.48Å; L287-I290 PolarHBondContact O-N 3.43Å; L287-T291 WeakPolarHBondContact O-CG2 3.39Å; L287-T291 PolarHBondContact O-N 3.07Å; L287-T291 PolarHBondContact O-OG1 2.97Å; L287-T291 VanDerWaalsContact O-OG1 3.11Å; L287-F339 HydrophobicContact CB-CE1 4.12Å; L287-F339 HydrophobicContact CB-CZ 4.09Å; L287-F339 HydrophobicContact CD1-CE1 4.21Å; L287-F339 HydrophobicContact CD1-CZ 4.15Å; L287-F339 HydrophobicContact CD2-CZ 4.06Å; L287-F339 HydrophobicContact CG-CZ 4.33Å
288D93.4Very high88.6Confident19 Ų1922.4 Ų22.410%0.10211%0.11CC..Hα-helixtrans-62.3-45.9176.3-177.631000111.7I284 S285 I290 T291 G292 R355 C359 R362I284-D288 WeakPolarHBondContact O-CB 3.16Å; I284-D288 PolarHBondContact O-N 3.13Å; S285-D288 PolarHBondContact O-N 2.88Å; D288-I290 VanDerWaalsContact C-N 3.34Å; D288-I290 PolarHBondContact O-N 2.8Å; D288-T291 PolarHBondContact O-N 3.24Å; D288-T291 PolarHBondContact O-OG1 3Å; D288-T291 VanDerWaalsContact O-OG1 3.09Å; D288-G292 PolarHBondContact O-N 3.09Å; D288-R355 HydrophobicContact CB-CB 4.25Å; D288-R355 WeakPolarHBondContact OD2-CG 3.34Å; D288-R355 IonicContact OD2-CZ 3.79Å; D288-R355 IonicContact OD2-NH1 2.79Å; D288-R355 PolarHBondContact OD2-NH1 3.06Å; D288-C359 VanDerWaalsContact CA-SG 3.52Å; D288-R362 IonicContact OD1-CZ 2.8Å; D288-R362 IonicContact OD1-NH1 2.69Å; D288-R362 PolarHBondContact OD1-NH1 2.89Å
289M91.6Very high87.5Confident41 Ų4124.1 Ų24.120%0.20212%0.118CC..Hα-helixtrans-59.1-41.5174.9-71.4173.173.100113.3L215 D216 S285 C286 G292 W293L215-M289 HydrophobicContact CB-CE 3.52Å; L215-M289 HydrophobicContact CB-SD 4.38Å; D216-M289 HydrophobicContact CB-CE 4.26Å; D216-M289 WeakPolarHBondContact OD1-CE 3.42Å; S285-M289 VanDerWaalsContact O-CG 3.24Å; S285-M289 WeakPolarHBondContact O-CG 3.45Å; S285-M289 PolarHBondContact O-N 3.34Å; C286-M289 PolarHBondContact O-N 2.59Å; M289-G292 CarbonylContact O-C 3.58Å; M289-W293 PolarHBondContact O-N 2.68Å
290I93.2Very high86.3Confident0 Ų024.4 Ų24.40%012%0.119CC..Hα-helixtrans-72.1-39.5-179.7-64.9170.1000111L215 L246 F250 L253 C286 L287 D288 G292 W293 F317 W323L215-I290 HydrophobicContact CD1-CD1 4.09Å; L215-I290 HydrophobicContact CD1-CG1 3.99Å; L215-I290 HydrophobicContact CD2-CD1 4.36Å; L215-I290 HydrophobicContact CD2-CG1 4.03Å; L246-I290 HydrophobicContact CD1-CD1 4.28Å; L246-I290 HydrophobicContact CD1-CG1 3.89Å; L246-I290 HydrophobicContact CD1-CG2 4.2Å; L246-I290 HydrophobicContact CG-CG2 4.27Å; F250-I290 HydrophobicContact CB-CD1 4.22Å; F250-I290 HydrophobicContact CB-CG2 4.16Å; F250-I290 HydrophobicContact CD2-CB 4.07Å; F250-I290 HydrophobicContact CD2-CD1 4Å; F250-I290 HydrophobicContact CD2-CG2 3.57Å; F250-I290 HydrophobicContact CE2-CG2 4.19Å; F250-I290 HydrophobicContact CG-CG2 4.04Å; L253-I290 HydrophobicContact CD1-CD1 3.47Å; L253-I290 VanDerWaalsContact CD1-CD1 3.47Å; C286-I290 VanDerWaalsContact O-CG1 3.23Å; C286-I290 WeakPolarHBondContact O-CG1 3.19Å; C286-I290 PolarHBondContact O-N 3.02Å; L287-I290 PolarHBondContact O-N 3.43Å; D288-I290 VanDerWaalsContact C-N 3.34Å; D288-I290 PolarHBondContact O-N 2.8Å; I290-G292 VanDerWaalsContact C-N 3.33Å; I290-W293 VanDerWaalsContact O-CB 3.24Å; I290-W293 WeakPolarHBondContact O-CB 3.4Å; I290-W293 PolarHBondContact O-N 2.81Å; I290-F317 WeakPolarHBondContact O-CE2 3.48Å; I290-W323 HydrophobicContact CG2-CH2 3.82Å; I290-W323 HydrophobicContact CG2-CZ3 4.44Å
291T90.4Very high84.6Confident1 Ų128.5 Ų28.51%0.00614%0.14CC..Hα-helixtrans-71.9-28.8176.659.50000112.3F250 L287 D288 W293 F317 F339 C359 R362 F363F250-T291 HydrophobicContact CE2-CG2 4.41Å; L287-T291 WeakPolarHBondContact O-CG2 3.39Å; L287-T291 PolarHBondContact O-N 3.07Å; L287-T291 PolarHBondContact O-OG1 2.97Å; L287-T291 VanDerWaalsContact O-OG1 3.11Å; D288-T291 PolarHBondContact O-N 3.24Å; D288-T291 PolarHBondContact O-OG1 3Å; D288-T291 VanDerWaalsContact O-OG1 3.09Å; T291-W293 VanDerWaalsContact C-N 3.3Å; T291-W293 PolarHBondContact O-N 3.45Å; T291-F317 WeakPolarHBondContact O-CD2 3.33Å; T291-F339 HydrophobicContact CG2-CZ 4.39Å; T291-C359 HydrophobicContact CG2-CB 4.23Å; T291-C359 PolarHBondContact OG1-SG 3.37Å; T291-R362 VanDerWaalsContact C-CD 3.46Å; T291-R362 WeakPolarHBondContact O-CD 3.27Å; T291-F363 HydrophobicContact CG2-CE1 3.74Å; T291-F363 HydrophobicContact CG2-CZ 3.99Å
292G88Confident82.4Confident28 Ų2834.5 Ų34.529%0.28916%0.161SC..THydrogen-bonded Turntrans-86.516.217300000115.3D288 M289 I290D288-G292 PolarHBondContact O-N 3.09Å; M289-G292 CarbonylContact O-C 3.58Å; I290-G292 VanDerWaalsContact C-N 3.33Å
293W87.2Confident80.4Confident6 Ų633.5 Ų33.52%0.02316%0.158CC..  trans-69.6137.8-174.4-162.9-85.7000112.9L215 F218 F241 L246 M289 I290 T291 F295L215-W293 HydrophobicContact CB-CZ3 4.37Å; L215-W293 HydrophobicContact CD2-CZ3 3.98Å; F218-W293 VanDerWaalsContact C-CH2 3.47Å; F218-W293 HydrophobicContact CB-CH2 3.56Å; F218-W293 HydrophobicContact CB-CZ2 3.89Å; F218-W293 VanDerWaalsContact O-CZ2 3.31Å; F218-W293 WeakPolarHBondContact O-CZ2 3.29Å; F241-W293 HydrophobicContact CD1-CH2 4.37Å; F241-W293 AromaticContact CD1-CZ2 3.97Å; F241-W293 HydrophobicContact CD1-CZ2 3.97Å; F241-W293 AromaticContact CE1-CH2 3.68Å; F241-W293 HydrophobicContact CE1-CH2 3.68Å; F241-W293 AromaticContact CE1-CZ2 3.73Å; F241-W293 HydrophobicContact CE1-CZ2 3.73Å; L246-W293 HydrophobicContact CD1-CE3 4.35Å; L246-W293 HydrophobicContact CD1-CZ3 4.34Å; L246-W293 HydrophobicContact CD2-CD2 3.77Å; L246-W293 HydrophobicContact CD2-CE3 4.21Å; L246-W293 HydrophobicContact CD2-CG 3.96Å; L246-W293 HydrophobicContact CD2-CZ2 4.49Å; M289-W293 PolarHBondContact O-N 2.68Å; I290-W293 VanDerWaalsContact O-CB 3.24Å; I290-W293 WeakPolarHBondContact O-CB 3.4Å; I290-W293 PolarHBondContact O-N 2.81Å; T291-W293 VanDerWaalsContact C-N 3.3Å; T291-W293 PolarHBondContact O-N 3.45Å; W293-F295 HydrophobicContact CB-CD2 4.19Å; W293-F295 HydrophobicContact CB-CE2 3.71Å; W293-F295 HydrophobicContact CB-CZ 4.28Å; W293-F295 HydrophobicContact CG-CE2 4.35Å; W293-F295 WeakPolarHBondContact O-CD2 3.39Å; W293-F295 PolarHBondContact O-N 3.48Å
294D81.9Confident78.3Confident42 Ų4237.2 Ų37.223%0.22518%0.175CC..  trans-79100.7171.4179.241.2000110R238 Q242R238-D294 IonicContact CZ-OD2 2.69Å; R238-D294 IonicContact NH1-OD2 2.98Å; R238-D294 PolarHBondContact NH2-O 3.31Å; R238-D294 IonicContact NH2-OD2 3.47Å; R238-D294 PolarHBondContact NH2-OD2 3.48Å; Q242-D294 PolarHBondContact NE2-O 3.34Å
295F83Confident75.7Confident8 Ų842.3 Ų42.34%0.03521%0.206CC..PPolyproline II helixtrans-83146.3-178.1-77.4-93.4000112.2W293 F317 R318 W323W293-F295 HydrophobicContact CB-CD2 4.19Å; W293-F295 HydrophobicContact CB-CE2 3.71Å; W293-F295 HydrophobicContact CB-CZ 4.28Å; W293-F295 HydrophobicContact CG-CE2 4.35Å; W293-F295 WeakPolarHBondContact O-CD2 3.39Å; W293-F295 PolarHBondContact O-N 3.48Å; F295-F317 HydrophobicContact CD2-CD2 4.43Å; F295-F317 AromaticContact CE2-CD2 3.41Å; F295-F317 HydrophobicContact CE2-CD2 3.41Å; F295-F317 VanDerWaalsContact CE2-CD2 3.41Å; F295-F317 AromaticContact CE2-CE2 3.63Å; F295-F317 HydrophobicContact CE2-CE2 3.63Å; F295-F317 HydrophobicContact CE2-CG 4.26Å; F295-F317 AromaticContact CZ-CD2 3.94Å; F295-F317 HydrophobicContact CZ-CD2 3.94Å; F295-F317 AromaticContact CZ-CE2 3.65Å; F295-F317 HydrophobicContact CZ-CE2 3.65Å; F295-F317 HydrophobicContact CZ-CZ 4.38Å; F295-R318 HydrophobicContact CB-CB 3.76Å; F295-R318 VanDerWaalsContact CD1-O 3.27Å; F295-R318 WeakPolarHBondContact CD1-O 3.43Å; F295-R318 HydrophobicContact CD2-CB 4.31Å; F295-R318 VanDerWaalsContact CD2-N 3.26Å; F295-R318 HydrophobicContact CG-CB 3.99Å; F295-W323 HydrophobicContact CE1-CZ2 4.24Å; F295-W323 HydrophobicContact CZ-CZ2 4.15Å
296L77.9Confident73.2Confident24 Ų2444.2 Ų44.213%0.12622%0.219CC..PPolyproline II helixtrans-58.8133.1174.8-77.1171.5000111.4P160 V235 R238 A239 Q242 L300P160-L296 HydrophobicContact CG-CB 4.16Å; V235-L296 HydrophobicContact CG1-CD1 4.09Å; R238-L296 HydrophobicContact CB-CD1 3.64Å; R238-L296 HydrophobicContact CB-CD2 4.26Å; R238-L296 HydrophobicContact CB-CG 3.93Å; A239-L296 HydrophobicContact CB-CD1 3.92Å; Q242-L296 VanDerWaalsContact OE1-N 3.14Å; L296-L300 HydrophobicContact CD2-CD2 4.33Å
297P72.4Confident70.6Confident8 Ų848.1 Ų48.15%0.05224%0.24CC..PPolyproline II helixtrans-70.2153.3175.335.1-41000110.5P160 L300 F303P160-P297 WeakPolarHBondContact CD-O 3.38Å; P160-P297 VanDerWaalsContact CG-O 3.3Å; P160-P297 WeakPolarHBondContact CG-O 3.31Å; P297-L300 HydrophobicContact CG-CD2 4.06Å; P297-F303 HydrophobicContact CB-CB 3.96Å; P297-F303 HydrophobicContact CB-CD2 3.29Å; P297-F303 HydrophobicContact CB-CE2 3.67Å; P297-F303 HydrophobicContact CB-CG 3.77Å; P297-F303 HydrophobicContact CB-CZ 4.47Å; P297-F303 HydrophobicContact CG-CB 3.64Å; P297-F303 HydrophobicContact CG-CD1 3.75Å; P297-F303 HydrophobicContact CG-CD2 3.4Å; P297-F303 VanDerWaalsContact CG-CD2 3.4Å; P297-F303 HydrophobicContact CG-CE1 4.09Å; P297-F303 HydrophobicContact CG-CE2 3.72Å; P297-F303 HydrophobicContact CG-CG 3.38Å; P297-F303 HydrophobicContact CG-CZ 4.06Å
298R67.7Low67.7Low116 Ų11654.3 Ų54.344%0.43827%0.272SS..SBendtrans-68-37.9177.3-175.8178.8-87.8-130.617.2112.9T159 P160 N374T159-R298 WeakPolarHBondContact CA-O 3.47Å; T159-R298 WeakPolarHBondContact CB-O 3.25Å; T159-R298 VanDerWaalsContact CG2-O 3.26Å; T159-R298 WeakPolarHBondContact CG2-O 3.4Å; P160-R298 WeakPolarHBondContact CD-O 3.44Å; R298-N374 PolarHBondContact NH1-ND2 3.02Å; R298-N374 PolarHBondContact NH1-OD1 3.18Å; R298-N374 PolarHBondContact NH2-OD1 2.91Å
299E66.6Low64.8Low92 Ų9264.3 Ų64.343%0.4331%0.309SS..  trans-107.6101.2175.2-67.5-175175.900109.7R302 F303E299-R302 VanDerWaalsContact CD-NH1 3.28Å; E299-R302 IonicContact OE1-NH1 3.53Å; E299-R302 PolarHBondContact OE1-NH1 2.83Å; E299-R302 VanDerWaalsContact OE1-NH1 3.09Å; E299-R302 WeakPolarHBondContact OE2-CD 3.48Å; E299-R302 IonicContact OE2-CZ 3.86Å; E299-R302 IonicContact OE2-NE 3.77Å; E299-R302 IonicContact OE2-NH1 2.86Å; E299-R302 PolarHBondContact OE2-NH1 2.68Å; E299-F303 WeakPolarHBondContact O-CB 3.27Å; E299-F303 PolarHBondContact O-N 3.39Å
300L66.3Low62.2Low6 Ų666.2 Ų66.23%0.03131%0.313CS..Hα-helixtrans-67.8-40.1-176.1-65.3164.7000111.5L157 A158 V235 L296 P297 F303 H304L157-L300 HydrophobicContact CD2-CD1 4.15Å; L157-L300 HydrophobicContact CG-CD1 3.98Å; A158-L300 PolarHBondContact O-N 3.13Å; V235-L300 HydrophobicContact CG1-CD1 3.82Å; V235-L300 HydrophobicContact CG1-CD2 4.35Å; V235-L300 HydrophobicContact CG2-CD1 4.16Å; V235-L300 HydrophobicContact CG2-CD2 4.12Å; L296-L300 HydrophobicContact CD2-CD2 4.33Å; P297-L300 HydrophobicContact CG-CD2 4.06Å; L300-F303 PolarHBondContact O-N 3.44Å; L300-H304 PolarHBondContact O-CD2 3.49Å; L300-H304 PolarHBondContact O-N 3.13Å
301I54.9Low59.4Low92 Ų9270.4 Ų70.447%0.47234%0.343SS..Hα-helixtrans-66.4-47.9-174.1-60.2171.4000111.3I156 A158 F303 V305I156-I301 HydrophobicContact CG2-CD1 3.98Å; A158-I301 HydrophobicContact CB-CD1 3.85Å; I301-F303 VanDerWaalsContact C-N 3.33Å; I301-F303 PolarHBondContact O-N 3Å; I301-V305 WeakPolarHBondContact O-CB 3.4Å; I301-V305 WeakPolarHBondContact O-CG2 3.21Å; I301-V305 PolarHBondContact O-N 2.88Å; I301-V305 VanDerWaalsContact O-N 3.16Å
302R48.2Very low57Low177 Ų17778.6 Ų78.667%0.66839%0.387SS*.Hα-helixtrans-64.4-40.6178.1-74.3-160.8-175.3127.9-6.7111.6E299 V305 S306E299-R302 VanDerWaalsContact CD-NH1 3.28Å; E299-R302 IonicContact OE1-NH1 3.53Å; E299-R302 PolarHBondContact OE1-NH1 2.83Å; E299-R302 VanDerWaalsContact OE1-NH1 3.09Å; E299-R302 WeakPolarHBondContact OE2-CD 3.48Å; E299-R302 IonicContact OE2-CZ 3.86Å; E299-R302 IonicContact OE2-NE 3.77Å; E299-R302 IonicContact OE2-NH1 2.86Å; E299-R302 PolarHBondContact OE2-NH1 2.68Å; R302-V305 PolarHBondContact O-N 3.39Å; R302-S306 WeakPolarHBondContact O-CB 3.34Å; R302-S306 PolarHBondContact O-N 2.67Å; R302-S306 PolarHBondContact O-OG 3.24Å; R302-S306 VanDerWaalsContact O-OG 3.09Å
303F51.5Low54.9Low27 Ų2784.5 Ų84.512%0.11841%0.407CS..Hα-helixtrans-64.4-43.4-178.6-176.5-86.8000113.2P297 E299 L300 I301 S306 L307 R310P297-F303 HydrophobicContact CB-CB 3.96Å; P297-F303 HydrophobicContact CB-CD2 3.29Å; P297-F303 HydrophobicContact CB-CE2 3.67Å; P297-F303 HydrophobicContact CB-CG 3.77Å; P297-F303 HydrophobicContact CB-CZ 4.47Å; P297-F303 HydrophobicContact CG-CB 3.64Å; P297-F303 HydrophobicContact CG-CD1 3.75Å; P297-F303 HydrophobicContact CG-CD2 3.4Å; P297-F303 VanDerWaalsContact CG-CD2 3.4Å; P297-F303 HydrophobicContact CG-CE1 4.09Å; P297-F303 HydrophobicContact CG-CE2 3.72Å; P297-F303 HydrophobicContact CG-CG 3.38Å; P297-F303 HydrophobicContact CG-CZ 4.06Å; E299-F303 WeakPolarHBondContact O-CB 3.27Å; E299-F303 PolarHBondContact O-N 3.39Å; L300-F303 PolarHBondContact O-N 3.44Å; I301-F303 VanDerWaalsContact C-N 3.33Å; I301-F303 PolarHBondContact O-N 3Å; F303-S306 WeakPolarHBondContact CA-OG 3.4Å; F303-S306 PolarHBondContact O-N 3.17Å; F303-S306 PolarHBondContact O-OG 3.41Å; F303-L307 HydrophobicContact CD1-CD1 4.43Å; F303-L307 HydrophobicContact CE1-CD1 4.32Å; F303-L307 PolarHBondContact O-N 3.4Å; F303-R310 VanDerWaalsContact CD2-NH1 3.29Å; F303-R310 VanDerWaalsContact CE2-CZ 3.46Å
304H50Low53Low81 Ų8187.7 Ų87.738%0.37542%0.422SS..Hα-helixtrans-73.6-28.9177.6-72.2-60.3000112.6L300L300-H304 PolarHBondContact O-CD2 3.49Å; L300-H304 PolarHBondContact O-N 3.13Å
305V40.3Very low51.7Low109 Ų10988.6 Ų88.666%0.66144%0.435SS*.Hα-helixtrans-73.3-30.3173.4173.80000111.7I301 R302I301-V305 WeakPolarHBondContact O-CB 3.4Å; I301-V305 WeakPolarHBondContact O-CG2 3.21Å; I301-V305 PolarHBondContact O-N 2.88Å; I301-V305 VanDerWaalsContact O-N 3.16Å; R302-V305 PolarHBondContact O-N 3.39Å
306S41.2Very low50.9Low48 Ų4893.3 Ų93.334%0.33645%0.452SS..G310 helixtrans-83.7-3.5178.562.30000115.1R302 F303 L308 R309R302-S306 WeakPolarHBondContact O-CB 3.34Å; R302-S306 PolarHBondContact O-N 2.67Å; R302-S306 PolarHBondContact O-OG 3.24Å; R302-S306 VanDerWaalsContact O-OG 3.09Å; F303-S306 WeakPolarHBondContact CA-OG 3.4Å; F303-S306 PolarHBondContact O-N 3.17Å; F303-S306 PolarHBondContact O-OG 3.41Å; S306-L308 PolarHBondContact O-N 2.92Å; S306-R309 PolarHBondContact O-N 3.06Å
307L41.1Very low50.9Low82 Ų8292.1 Ų92.143%0.42945%0.446SS..G310 helixtrans-56.4-24.8-177.8-137.189.6000113F303 R309F303-L307 HydrophobicContact CD1-CD1 4.43Å; F303-L307 HydrophobicContact CE1-CD1 4.32Å; F303-L307 PolarHBondContact O-N 3.4Å; L307-R309 PolarHBondContact O-N 2.87Å
308L35.7Very low51.3Low133 Ų13394.6 Ų94.670%0.69646%0.455SS*.G310 helixtrans-72.3-2.1178.1-77.9133.2000115.1S306S306-L308 PolarHBondContact O-N 2.92Å
309R32.9Very low51.9Low230 Ų23089.1 Ų89.187%0.86843%0.434SS*.G310 helixtrans-135.113.9-174.7-74.9-167.8-178.3177.50.3116.2S306 L307 S311S306-R309 PolarHBondContact O-N 3.06Å; L307-R309 PolarHBondContact O-N 2.87Å; R309-S311 PolarHBondContact O-N 3.13Å
310R35.2Very low52.6Low81 Ų8185.7 Ų85.731%0.30642%0.42SS..  trans-87.4114.4-174.1-75.3179.1163.9-169.3-19.7112.8F303 E314F303-R310 VanDerWaalsContact CD2-NH1 3.29Å; F303-R310 VanDerWaalsContact CE2-CZ 3.46Å; R310-E314 WeakPolarHBondContact CD-OE2 3.41Å; R310-E314 IonicContact CZ-OE1 3.8Å; R310-E314 IonicContact CZ-OE2 3.8Å; R310-E314 IonicContact NE-OE2 3.83Å; R310-E314 PolarHBondContact NE-OE2 3.38Å; R310-E314 IonicContact NH2-OE1 2.64Å; R310-E314 PolarHBondContact NH2-OE1 3.23Å; R310-E314 VanDerWaalsContact NH2-OE1 3.08Å; R310-E314 IonicContact NH2-OE2 2.83Å; R310-E314 PolarHBondContact NH2-OE2 3.26Å
311S35.7Very low53.3Low88 Ų8888.5 Ų88.562%0.61544%0.444SS*.  trans-76.3156.514945.70000109.5R309 E313R309-S311 PolarHBondContact O-N 3.13Å; S311-E313 PolarHBondContact O-N 2.83Å
312D40.5Very low54.8Low173 Ų17389 Ų8993%0.92544%0.443SS*.SBendtrans-55.68-162.8-67.1-50.9000119.5E314D312-E314 PolarHBondContact O-N 3.18Å
313E42.4Very low56.8Low152 Ų15280.6 Ų80.671%0.7141%0.411SS*.THydrogen-bonded Turntrans-79.63.1-166.8-68.1-169.3161.300117.3S311S311-E313 PolarHBondContact O-N 2.83Å
314E47.9Very low58.5Low72 Ų7282.8 Ų82.834%0.33643%0.425SS..THydrogen-bonded Turntrans-114.38.1-161.3-71.8-163.195.600118.8R310 D312 R316R310-E314 WeakPolarHBondContact CD-OE2 3.41Å; R310-E314 IonicContact CZ-OE1 3.8Å; R310-E314 IonicContact CZ-OE2 3.8Å; R310-E314 IonicContact NE-OE2 3.83Å; R310-E314 PolarHBondContact NE-OE2 3.38Å; R310-E314 IonicContact NH2-OE1 2.64Å; R310-E314 PolarHBondContact NH2-OE1 3.23Å; R310-E314 VanDerWaalsContact NH2-OE1 3.08Å; R310-E314 IonicContact NH2-OE2 2.83Å; R310-E314 PolarHBondContact NH2-OE2 3.26Å; D312-E314 PolarHBondContact O-N 3.18Å; E314-R316 PolarHBondContact O-N 3.3Å
315A54.4Low60.2Low61 Ų6184.4 Ų84.450%0.50444%0.436SS..  trans-81.263.3170.100000112.1
316R65.7Low62.5Low107 Ų10779.4 Ų79.440%0.40441%0.406SS..  trans-83135.9178.1-61.3-173.5-165.7160.84.4111.2E314 R318E314-R316 PolarHBondContact O-N 3.3Å; R316-R318 HydrophobicContact CB-CG 4.32Å; R316-R318 WeakPolarHBondContact O-CG 3.5Å; R316-R318 PolarHBondContact O-N 3.46Å; R316-R318 VanDerWaalsContact O-N 3.1Å
317F79.4Confident64.6Low0 Ų077.1 Ų77.10%039%0.39CS..  trans-62.4110.8171.3-171.7-110.4000109.9I290 T291 F295 P319 W323 I327 R362 F363 M366 S367I290-F317 WeakPolarHBondContact O-CE2 3.48Å; T291-F317 WeakPolarHBondContact O-CD2 3.33Å; F295-F317 HydrophobicContact CD2-CD2 4.43Å; F295-F317 AromaticContact CE2-CD2 3.41Å; F295-F317 HydrophobicContact CE2-CD2 3.41Å; F295-F317 VanDerWaalsContact CE2-CD2 3.41Å; F295-F317 AromaticContact CE2-CE2 3.63Å; F295-F317 HydrophobicContact CE2-CE2 3.63Å; F295-F317 HydrophobicContact CE2-CG 4.26Å; F295-F317 AromaticContact CZ-CD2 3.94Å; F295-F317 HydrophobicContact CZ-CD2 3.94Å; F295-F317 AromaticContact CZ-CE2 3.65Å; F295-F317 HydrophobicContact CZ-CE2 3.65Å; F295-F317 HydrophobicContact CZ-CZ 4.38Å; F317-P319 HydrophobicContact CD1-CG 4.23Å; F317-P319 HydrophobicContact CE1-CB 4.22Å; F317-P319 HydrophobicContact CE1-CG 3.82Å; F317-P319 HydrophobicContact CZ-CB 4.41Å; F317-P319 HydrophobicContact CZ-CG 4.49Å; F317-P319 WeakPolarHBondContact O-CD 3.35Å; F317-W323 HydrophobicContact CZ-CE3 4.29Å; F317-W323 HydrophobicContact CZ-CH2 4.48Å; F317-W323 HydrophobicContact CZ-CZ3 4Å; F317-I327 HydrophobicContact CE1-CD1 3.28Å; F317-I327 HydrophobicContact CE1-CG2 4.46Å; F317-I327 HydrophobicContact CZ-CD1 3.3Å; F317-R362 HydrophobicContact CB-CB 4.41Å; F317-F363 HydrophobicContact CD1-CD1 4.37Å; F317-F363 HydrophobicContact CE1-CD1 4.46Å; F317-F363 HydrophobicContact CE1-CE1 4.33Å; F317-M366 HydrophobicContact CD1-CB 4.49Å; F317-M366 HydrophobicContact CD1-CG 3.87Å; F317-M366 HydrophobicContact CD1-SD 3.85Å; F317-M366 HydrophobicContact CE1-CG 4.49Å; F317-M366 HydrophobicContact CE1-SD 3.94Å; F317-M366 WeakPolarHBondContact O-CA 3.36Å; F317-S367 PolarHBondContact O-N 3.09Å; F317-S367 VanDerWaalsContact O-N 3.08Å
318R80.8Confident66.6Low60 Ų6073.3 Ų73.323%0.22637%0.37CS..  trans-125.368.6-170.1-76.5172.9177.2176.28.2113.5F295 R316 S320 S367F295-R318 HydrophobicContact CB-CB 3.76Å; F295-R318 VanDerWaalsContact CD1-O 3.27Å; F295-R318 WeakPolarHBondContact CD1-O 3.43Å; F295-R318 HydrophobicContact CD2-CB 4.31Å; F295-R318 VanDerWaalsContact CD2-N 3.26Å; F295-R318 HydrophobicContact CG-CB 3.99Å; R316-R318 HydrophobicContact CB-CG 4.32Å; R316-R318 WeakPolarHBondContact O-CG 3.5Å; R316-R318 PolarHBondContact O-N 3.46Å; R316-R318 VanDerWaalsContact O-N 3.1Å; R318-S320 PolarHBondContact O-N 2.87Å; R318-S367 WeakPolarHBondContact CA-O 3.24Å; R318-S367 WeakPolarHBondContact CG-OG 3.27Å; R318-S367 PolarHBondContact NE-OG 2.71Å; R318-S367 VanDerWaalsContact NE-OG 3.09Å
319P79.3Confident68.5Low0 Ų069.6 Ų69.60%036%0.355CS..  trans-67134.6-176.529.8-35.6000111.7F317 W323 I327 M366 L370F317-P319 HydrophobicContact CD1-CG 4.23Å; F317-P319 HydrophobicContact CE1-CB 4.22Å; F317-P319 HydrophobicContact CE1-CG 3.82Å; F317-P319 HydrophobicContact CZ-CB 4.41Å; F317-P319 HydrophobicContact CZ-CG 4.49Å; F317-P319 WeakPolarHBondContact O-CD 3.35Å; P319-W323 HydrophobicContact CB-CB 3.65Å; P319-W323 HydrophobicContact CB-CD2 3.9Å; P319-W323 HydrophobicContact CB-CE3 4.36Å; P319-W323 HydrophobicContact CB-CG 3.58Å; P319-I327 HydrophobicContact CG-CG2 4.23Å; P319-M366 HydrophobicContact CG-CG 3.87Å; P319-M366 HydrophobicContact CG-SD 3.54Å; P319-M366 VanDerWaalsContact CG-SD 3.54Å; P319-L370 HydrophobicContact CB-CD1 4.01Å; P319-L370 HydrophobicContact CG-CD1 4.22Å
320S81.5Confident70.7Confident21 Ų2164.9 Ų64.915%0.14735%0.347CS..  trans-77.4173176.776.40000111.9D243 R318 K322 W323 L370D243-S320 VanDerWaalsContact CG-OG 3.23Å; D243-S320 WeakPolarHBondContact OD1-CB 3.23Å; D243-S320 PolarHBondContact OD1-OG 3.15Å; R318-S320 PolarHBondContact O-N 2.87Å; S320-K322 PolarHBondContact O-N 3.4Å; S320-K322 PolarHBondContact OG-N 2.98Å; S320-W323 WeakPolarHBondContact O-CB 3.32Å; S320-W323 PolarHBondContact O-N 3.39Å; S320-L370 WeakPolarHBondContact O-CD1 3.43Å; S320-L370 WeakPolarHBondContact O-CG 3.49Å
321A81.6Confident73Confident65 Ų6561.8 Ų61.854%0.53734%0.339SS..G310 helixtrans-55.1-20.8177.300000114.2W323A321-W323 VanDerWaalsContact C-N 3.3Å; A321-W323 PolarHBondContact O-N 3.33Å
322K86.4Confident75.5Confident102 Ų10257.6 Ų57.644%0.44331%0.309SS..G310 helixtrans-72.8-20.2178.3-57.2-60.4-173.7179.20113.6D243 Y244 S320 N324D243-K322 HydrophobicContact CB-CB 4.35Å; D243-K322 HydrophobicContact CB-CG 4.04Å; D243-K322 VanDerWaalsContact O-CB 3.22Å; D243-K322 WeakPolarHBondContact O-CB 3.41Å; Y244-K322 WeakPolarHBondContact OH-CE 3.29Å; S320-K322 PolarHBondContact O-N 3.4Å; S320-K322 PolarHBondContact OG-N 2.98Å; K322-N324 PolarHBondContact O-N 3.35Å
323W90.2Very high77.6Confident0 Ų050.9 Ų50.90%028%0.275CS..G310 helixtrans-796.2177.9-73.771.2000113.7Q242 L246 V247 F250 I290 F295 F317 P319 S320 A321 D325 T326 I327 L370Q242-W323 PolarHBondContact O-NE1 3.06Å; L246-W323 HydrophobicContact CB-CZ2 4.27Å; L246-W323 HydrophobicContact CD2-CH2 4.37Å; L246-W323 HydrophobicContact CD2-CZ2 3.97Å; L246-W323 HydrophobicContact CG-CH2 4.1Å; L246-W323 HydrophobicContact CG-CZ2 3.92Å; V247-W323 HydrophobicContact CG2-CD2 3.71Å; V247-W323 HydrophobicContact CG2-CE3 4.48Å; V247-W323 HydrophobicContact CG2-CG 3.79Å; V247-W323 HydrophobicContact CG2-CZ2 3.92Å; V247-W323 VanDerWaalsContact CG2-NE1 3.27Å; F250-W323 HydrophobicContact CB-CH2 4.15Å; F250-W323 HydrophobicContact CB-CZ3 4.05Å; F250-W323 HydrophobicContact CD1-CE3 4.25Å; F250-W323 HydrophobicContact CD1-CH2 4.4Å; F250-W323 AromaticContact CD1-CZ3 3.52Å; F250-W323 HydrophobicContact CD1-CZ3 3.52Å; F250-W323 HydrophobicContact CE1-CZ3 4.07Å; F250-W323 HydrophobicContact CG-CH2 4.31Å; F250-W323 AromaticContact CG-CZ3 3.85Å; F250-W323 HydrophobicContact CG-CZ3 3.85Å; I290-W323 HydrophobicContact CG2-CH2 3.82Å; I290-W323 HydrophobicContact CG2-CZ3 4.44Å; F295-W323 HydrophobicContact CE1-CZ2 4.24Å; F295-W323 HydrophobicContact CZ-CZ2 4.15Å; F317-W323 HydrophobicContact CZ-CE3 4.29Å; F317-W323 HydrophobicContact CZ-CH2 4.48Å; F317-W323 HydrophobicContact CZ-CZ3 4Å; P319-W323 HydrophobicContact CB-CB 3.65Å; P319-W323 HydrophobicContact CB-CD2 3.9Å; P319-W323 HydrophobicContact CB-CE3 4.36Å; P319-W323 HydrophobicContact CB-CG 3.58Å; S320-W323 WeakPolarHBondContact O-CB 3.32Å; S320-W323 PolarHBondContact O-N 3.39Å; A321-W323 VanDerWaalsContact C-N 3.3Å; A321-W323 PolarHBondContact O-N 3.33Å; W323-D325 PolarHBondContact O-N 3.48Å; W323-D325 VanDerWaalsContact O-N 3.12Å; W323-T326 PolarHBondContact O-N 3.01Å; W323-T326 PolarHBondContact O-OG1 3.25Å; W323-T326 VanDerWaalsContact O-OG1 3.13Å; W323-I327 HydrophobicContact CE3-CD1 3.63Å; W323-I327 HydrophobicContact CE3-CG1 4.23Å; W323-I327 HydrophobicContact CZ3-CD1 3.94Å; W323-I327 PolarHBondContact O-N 3.06Å; W323-L370 HydrophobicContact CB-CD1 3.64Å
324N86.4Confident79.7Confident74 Ų7453.1 Ų53.140%0.39628%0.277SS..Hα-helixtrans-56-33.3-175.1-169.460.3000113.5K322 T326 G328 L370K322-N324 PolarHBondContact O-N 3.35Å; N324-T326 VanDerWaalsContact C-N 3.27Å; N324-T326 PolarHBondContact O-N 3.36Å; N324-G328 WeakPolarHBondContact O-CA 3.39Å; N324-G328 PolarHBondContact O-N 2.91Å; N324-G328 WeakPolarHBondContact OD1-CA 3.42Å; N324-L370 HydrophobicContact CB-CD2 4.08Å
325D85.6Confident81.7Confident114 Ų11450.2 Ų50.261%0.6126%0.264SS*.Hα-helixtrans-68.5-21.9-179.9-76.36.4000114.1W323 A331W323-D325 PolarHBondContact O-N 3.48Å; W323-D325 VanDerWaalsContact O-N 3.12Å; D325-A331 VanDerWaalsContact O-CB 3.24Å; D325-A331 WeakPolarHBondContact O-CB 3.21Å
326T88Confident83.4Confident5 Ų547.3 Ų47.33%0.03124%0.24CC..Hα-helixtrans-113.5-37.5-17650.80000112.5F250 K251 L254 W323 N324 T335F250-T326 HydrophobicContact CD1-CG2 4.26Å; K251-T326 HydrophobicContact CB-CG2 3.91Å; K251-T326 HydrophobicContact CG-CG2 4.26Å; L254-T326 HydrophobicContact CD1-CG2 4.44Å; W323-T326 PolarHBondContact O-N 3.01Å; W323-T326 PolarHBondContact O-OG1 3.25Å; W323-T326 VanDerWaalsContact O-OG1 3.13Å; N324-T326 VanDerWaalsContact C-N 3.27Å; N324-T326 PolarHBondContact O-N 3.36Å; T326-T335 PolarHBondContact O-OG1 2.85Å
327I85.6Confident84.6Confident0 Ų043.5 Ų43.50%023%0.228CC..Hα-helixtrans-130.44.4-171.3-54.7-177.4000111.6F250 F317 P319 W323 F332 M366 H408F250-I327 HydrophobicContact CE1-CD1 3.83Å; F250-I327 HydrophobicContact CE1-CG1 4.15Å; F250-I327 HydrophobicContact CZ-CD1 4.41Å; F317-I327 HydrophobicContact CE1-CD1 3.28Å; F317-I327 HydrophobicContact CE1-CG2 4.46Å; F317-I327 HydrophobicContact CZ-CD1 3.3Å; P319-I327 HydrophobicContact CG-CG2 4.23Å; W323-I327 HydrophobicContact CE3-CD1 3.63Å; W323-I327 HydrophobicContact CE3-CG1 4.23Å; W323-I327 HydrophobicContact CZ3-CD1 3.94Å; W323-I327 PolarHBondContact O-N 3.06Å; I327-F332 HydrophobicContact CG2-CD2 4.05Å; I327-M366 HydrophobicContact CG2-CE 3.64Å; I327-M366 HydrophobicContact CG2-SD 3.3Å; I327-M366 WeakPolarHBondContact CG2-SD 3.46Å; I327-H408 PolarHBondContact O-NE2 3.21Å
328G82.4Confident85.2Confident1 Ų144.2 Ų44.21%0.0123%0.232CC..SBendtrans-68.2171.1170.200000112.8N324 D330 A331 F332N324-G328 WeakPolarHBondContact O-CA 3.39Å; N324-G328 PolarHBondContact O-N 2.91Å; N324-G328 WeakPolarHBondContact OD1-CA 3.42Å; G328-D330 PolarHBondContact O-N 3.04Å; G328-A331 PolarHBondContact O-N 3.12Å; G328-F332 WeakPolarHBondContact O-CB 3.24Å; G328-F332 PolarHBondContact O-N 3.13Å
329S76.9Confident85.8Confident55 Ų5541.5 Ų41.539%0.38522%0.222SC..THydrogen-bonded Turntrans-50.9-35.4-174.455.70000114.3P333S329-P333 WeakPolarHBondContact O-CD 3.33Å
330D78.4Confident86.4Confident132 Ų13241.8 Ų41.871%0.70622%0.223SC*.THydrogen-bonded Turntrans-87-26.1-175.3-59.6-10000112.7G328G328-D330 PolarHBondContact O-N 3.04Å
331A84Confident86.9Confident15 Ų1543.9 Ų43.912%0.12423%0.23CC..THydrogen-bonded Turntrans-94.8-34.5-175.900000112.5D325 G328 P333 R334 T335D325-A331 VanDerWaalsContact O-CB 3.24Å; D325-A331 WeakPolarHBondContact O-CB 3.21Å; G328-A331 PolarHBondContact O-N 3.12Å; A331-P333 VanDerWaalsContact C-CD 3.47Å; A331-R334 WeakPolarHBondContact O-CB 3.45Å; A331-R334 PolarHBondContact O-N 3.35Å; A331-T335 PolarHBondContact O-N 3.05Å; A331-T335 PolarHBondContact O-OG1 3.41Å
332F87.2Confident87.3Confident0 Ų041.3 Ų41.30%021%0.206CC..Hα-helixtrans-53.6-42.7-174.4-176.2-112000114.6I327 G328 R334 T335 S336 F363 M366 H408 I411 L412I327-F332 HydrophobicContact CG2-CD2 4.05Å; G328-F332 WeakPolarHBondContact O-CB 3.24Å; G328-F332 PolarHBondContact O-N 3.13Å; F332-R334 PolarHBondContact O-N 3.43Å; F332-T335 PolarHBondContact O-N 2.94Å; F332-T335 VanDerWaalsContact O-N 3.14Å; F332-S336 PolarHBondContact O-N 3.49Å; F332-S336 PolarHBondContact O-OG 3.15Å; F332-F363 HydrophobicContact CE2-CB 4.14Å; F332-F363 HydrophobicContact CE2-CD2 4.38Å; F332-F363 HydrophobicContact CE2-CG 4.16Å; F332-F363 HydrophobicContact CZ-CB 4.22Å; F332-M366 HydrophobicContact CE2-CE 4.28Å; F332-H408 HydrophobicContact CD1-CB 4.45Å; F332-H408 AromaticContact CD1-CD2 3.47Å; F332-H408 VanDerWaalsContact CD1-CD2 3.47Å; F332-H408 WeakPolarHBondContact CD1-CD2 3.23Å; F332-H408 HydrophobicContact CE1-CB 4.28Å; F332-H408 AromaticContact CE1-CD2 3.9Å; F332-H408 AromaticContact CG-CD2 3.58Å; F332-I411 HydrophobicContact CD1-CB 4.44Å; F332-I411 HydrophobicContact CD1-CD1 4.36Å; F332-I411 HydrophobicContact CD1-CG2 4.08Å; F332-I411 HydrophobicContact CE1-CB 4.45Å; F332-I411 HydrophobicContact CE1-CG2 4.16Å; F332-L412 HydrophobicContact CE1-CD1 4.4Å; F332-L412 HydrophobicContact CE1-CD2 4.05Å; F332-L412 HydrophobicContact CE1-CG 3.84Å; F332-L412 HydrophobicContact CZ-CD1 4.04Å; F332-L412 HydrophobicContact CZ-CD2 3.67Å; F332-L412 HydrophobicContact CZ-CG 3.77Å
333P84.8Confident87.7Confident33 Ų3336.4 Ų36.421%0.21419%0.185CC..Hα-helixtrans-57.1-34.9176.6-2431.6000114S329 A331 S336 L337 I411S329-P333 WeakPolarHBondContact O-CD 3.33Å; A331-P333 VanDerWaalsContact C-CD 3.47Å; P333-S336 PolarHBondContact O-OG 3.41Å; P333-L337 WeakPolarHBondContact O-CB 3.41Å; P333-L337 PolarHBondContact O-N 3.36Å; P333-I411 HydrophobicContact CB-CG2 4.45Å; P333-I411 HydrophobicContact CG-CD1 3.82Å; P333-I411 HydrophobicContact CG-CG1 4.49Å; P333-I411 HydrophobicContact CG-CG2 4.47Å
334R86.8Confident87.7Confident199 Ų19938.4 Ų38.475%0.75120%0.197SC*.Hα-helixtrans-75.8-40.7179.2-61.3178.5-174.6165.44.1110.7A331 F332 L338A331-R334 WeakPolarHBondContact O-CB 3.45Å; A331-R334 PolarHBondContact O-N 3.35Å; F332-R334 PolarHBondContact O-N 3.43Å; R334-L338 WeakPolarHBondContact O-CB 3.14Å; R334-L338 PolarHBondContact O-N 3.31Å
335T90.8Very high87.9Confident10 Ų1036.5 Ų36.56%0.06119%0.185CC..Hα-helixtrans-64.1-50.6177.7-57.10000110.6L254 T326 A331 F332 L337 L338 F339 F363L254-T335 HydrophobicContact CD1-CG2 4.08Å; L254-T335 HydrophobicContact CD2-CG2 4.18Å; T326-T335 PolarHBondContact O-OG1 2.85Å; A331-T335 PolarHBondContact O-N 3.05Å; A331-T335 PolarHBondContact O-OG1 3.41Å; F332-T335 PolarHBondContact O-N 2.94Å; F332-T335 VanDerWaalsContact O-N 3.14Å; T335-L337 VanDerWaalsContact C-N 3.33Å; T335-L337 PolarHBondContact O-N 2.81Å; T335-L338 WeakPolarHBondContact O-CB 3.36Å; T335-L338 PolarHBondContact O-N 3.24Å; T335-L338 VanDerWaalsContact O-N 3.16Å; T335-F339 HydrophobicContact CG2-CD2 4.21Å; T335-F339 HydrophobicContact CG2-CE2 4.06Å; T335-F339 WeakPolarHBondContact O-CD2 3.49Å; T335-F339 PolarHBondContact O-N 2.87Å; T335-F363 HydrophobicContact CG2-CE2 4.44Å; T335-F363 HydrophobicContact CG2-CZ 4.25Å
336S89.9Confident88.1Confident0 Ų031.1 Ų31.10%016%0.156CC..Hα-helixtrans-59.4-43.6177.766.90000111.9F332 P333 L338 F339 I340 N415F332-S336 PolarHBondContact O-N 3.49Å; F332-S336 PolarHBondContact O-OG 3.15Å; P333-S336 PolarHBondContact O-OG 3.41Å; S336-L338 VanDerWaalsContact C-N 3.32Å; S336-L338 PolarHBondContact O-N 2.64Å; S336-F339 PolarHBondContact O-N 3.02Å; S336-I340 WeakPolarHBondContact O-CG1 3.32Å; S336-I340 PolarHBondContact O-N 3.44Å; S336-N415 PolarHBondContact OG-ND2 3.11Å
337L89.9Confident88.3Confident27 Ų2732.5 Ų32.514%0.14116%0.161CC..Hα-helixtrans-61.3-39.4177.1-179.863000112.4P333 T335 I340 K341 L457 I458P333-L337 WeakPolarHBondContact O-CB 3.41Å; P333-L337 PolarHBondContact O-N 3.36Å; T335-L337 VanDerWaalsContact C-N 3.33Å; T335-L337 PolarHBondContact O-N 2.81Å; L337-I340 PolarHBondContact O-N 3.18Å; L337-K341 HydrophobicContact CD1-CD 4.49Å; L337-K341 HydrophobicContact CD1-CG 4.38Å; L337-K341 HydrophobicContact CG-CD 4.32Å; L337-K341 WeakPolarHBondContact O-CG 3.45Å; L337-K341 PolarHBondContact O-N 3.24Å; L337-L457 HydrophobicContact CD2-CB 3.95Å; L337-L457 HydrophobicContact CD2-CD1 4.34Å; L337-I458 HydrophobicContact CD1-CB 4.42Å; L337-I458 HydrophobicContact CD1-CG1 3.69Å
338L92.1Very high88.4Confident16 Ų1638 Ų388%0.08419%0.193CC..Hα-helixtrans-61.5-46.4176.9177.261.8000111.1L254 A257 N258 L261 R334 T335 S336 K341 L342L254-L338 HydrophobicContact CB-CD2 4.3Å; L254-L338 HydrophobicContact CD2-CD2 4.05Å; L254-L338 WeakPolarHBondContact O-CD2 3.45Å; A257-L338 HydrophobicContact CB-CD2 4.33Å; N258-L338 HydrophobicContact CB-CD1 3.87Å; N258-L338 HydrophobicContact CB-CD2 4.15Å; L261-L338 HydrophobicContact CD2-CD1 4.08Å; R334-L338 WeakPolarHBondContact O-CB 3.14Å; R334-L338 PolarHBondContact O-N 3.31Å; T335-L338 WeakPolarHBondContact O-CB 3.36Å; T335-L338 PolarHBondContact O-N 3.24Å; T335-L338 VanDerWaalsContact O-N 3.16Å; S336-L338 VanDerWaalsContact C-N 3.32Å; S336-L338 PolarHBondContact O-N 2.64Å; L338-K341 PolarHBondContact O-N 2.91Å; L338-L342 WeakPolarHBondContact O-CB 3.34Å; L338-L342 PolarHBondContact O-N 2.88Å
339F94Very high88.7Confident3 Ų340 Ų401%0.01321%0.208CC..Hα-helixtrans-64-40.2177.8-84.3-91.3000112.5F250 L254 L287 T291 T335 S336 L342 H343 C359 L360 F363F250-F339 HydrophobicContact CE2-CZ 4.48Å; F250-F339 HydrophobicContact CZ-CE2 4.35Å; F250-F339 HydrophobicContact CZ-CZ 4.48Å; L254-F339 HydrophobicContact CD2-CE2 3.74Å; L254-F339 HydrophobicContact CD2-CZ 4.37Å; L287-F339 HydrophobicContact CB-CE1 4.12Å; L287-F339 HydrophobicContact CB-CZ 4.09Å; L287-F339 HydrophobicContact CD1-CE1 4.21Å; L287-F339 HydrophobicContact CD1-CZ 4.15Å; L287-F339 HydrophobicContact CD2-CZ 4.06Å; L287-F339 HydrophobicContact CG-CZ 4.33Å; T291-F339 HydrophobicContact CG2-CZ 4.39Å; T335-F339 HydrophobicContact CG2-CD2 4.21Å; T335-F339 HydrophobicContact CG2-CE2 4.06Å; T335-F339 WeakPolarHBondContact O-CD2 3.49Å; T335-F339 PolarHBondContact O-N 2.87Å; S336-F339 PolarHBondContact O-N 3.02Å; F339-L342 PolarHBondContact O-N 3.02Å; F339-H343 WeakPolarHBondContact O-CB 3.44Å; F339-H343 PolarHBondContact O-N 3Å; F339-C359 HydrophobicContact CD1-CB 3.61Å; F339-C359 HydrophobicContact CE1-CB 3.4Å; F339-C359 HydrophobicContact CZ-CB 4.3Å; F339-L360 HydrophobicContact CB-CD2 3.62Å; F339-L360 HydrophobicContact CB-CG 4.06Å; F339-F363 HydrophobicContact CB-CE2 4.49Å; F339-F363 AromaticContact CD2-CE2 3.56Å; F339-F363 HydrophobicContact CD2-CE2 3.56Å; F339-F363 AromaticContact CD2-CZ 3.9Å; F339-F363 HydrophobicContact CD2-CZ 3.9Å; F339-F363 AromaticContact CE2-CE2 3.79Å; F339-F363 HydrophobicContact CE2-CE2 3.79Å; F339-F363 AromaticContact CE2-CZ 3.6Å; F339-F363 HydrophobicContact CE2-CZ 3.6Å; F339-F363 AromaticContact CG-CE2 3.97Å; F339-F363 HydrophobicContact CG-CE2 3.97Å; F339-F363 HydrophobicContact CZ-CE2 4.38Å; F339-F363 HydrophobicContact CZ-CZ 4.01Å
340I92Very high89.2Confident6 Ų642 Ų423%0.03121%0.214CC..Hα-helixtrans-61-49.6175.2-67.6166.6000110.3S336 L337 L342 H343 T344 L360 N415 W419 I458S336-I340 WeakPolarHBondContact O-CG1 3.32Å; S336-I340 PolarHBondContact O-N 3.44Å; L337-I340 PolarHBondContact O-N 3.18Å; I340-L342 VanDerWaalsContact C-N 3.31Å; I340-L342 PolarHBondContact O-N 3.33Å; I340-H343 PolarHBondContact O-N 2.77Å; I340-T344 WeakPolarHBondContact O-CG2 3.37Å; I340-T344 PolarHBondContact O-N 2.66Å; I340-T344 PolarHBondContact O-OG1 3.34Å; I340-L360 HydrophobicContact CG1-CD1 4.04Å; I340-L360 HydrophobicContact CG1-CD2 4.16Å; I340-N415 HydrophobicContact CD1-CB 3.67Å; I340-W419 HydrophobicContact CG2-CD2 4.12Å; I340-W419 HydrophobicContact CG2-CG 4.02Å; I340-I458 HydrophobicContact CG2-CG2 4.46Å
341K91.2Very high89.7Confident65 Ų6540.4 Ų40.428%0.28321%0.205SC..Hα-helixtrans-60.9-43.1178.5-71.9178.3176.4-178.80111.9L261 L337 L338 T344 W345 L457 P459L261-K341 HydrophobicContact CD2-CB 3.57Å; L261-K341 HydrophobicContact CD2-CD 4.09Å; L261-K341 HydrophobicContact CD2-CG 4.48Å; L337-K341 HydrophobicContact CD1-CD 4.49Å; L337-K341 HydrophobicContact CD1-CG 4.38Å; L337-K341 HydrophobicContact CG-CD 4.32Å; L337-K341 WeakPolarHBondContact O-CG 3.45Å; L337-K341 PolarHBondContact O-N 3.24Å; L338-K341 PolarHBondContact O-N 2.91Å; K341-T344 WeakPolarHBondContact CA-OG1 3.39Å; K341-T344 PolarHBondContact O-N 2.97Å; K341-T344 PolarHBondContact O-OG1 3.3Å; K341-W345 PolarHBondContact O-N 3.37Å; K341-W345 VanDerWaalsContact O-N 3.12Å; K341-L457 WeakPolarHBondContact CE-O 3.09Å; K341-P459 HydrophobicContact CG-CG 3.97Å
342L91.9Very high90.1Very high10 Ų1040.1 Ų40.15%0.05220%0.201CC..Hα-helixtrans-64.1-46-179.7-170.4147.2000110.8A257 I284 L338 F339 I340 W345 V346 T356A257-L342 HydrophobicContact CB-CD1 3.93Å; I284-L342 HydrophobicContact CD1-CD2 3.79Å; I284-L342 HydrophobicContact CG1-CD2 3.82Å; L338-L342 WeakPolarHBondContact O-CB 3.34Å; L338-L342 PolarHBondContact O-N 2.88Å; F339-L342 PolarHBondContact O-N 3.02Å; I340-L342 VanDerWaalsContact C-N 3.31Å; I340-L342 PolarHBondContact O-N 3.33Å; L342-W345 PolarHBondContact O-N 3.24Å; L342-V346 HydrophobicContact CD2-CG2 4.49Å; L342-V346 WeakPolarHBondContact O-CG2 3.45Å; L342-V346 PolarHBondContact O-N 2.56Å; L342-V346 VanDerWaalsContact O-N 3.1Å; L342-T356 HydrophobicContact CD2-CG2 3.19Å
343H93.2Very high90.3Very high0 Ų040.1 Ų40.10%020%0.201CC..Hα-helixtrans-58.7-48.2173.3173.274.5000111.4F339 I340 W345 V346 R347 G353 T356 W419 E470F339-H343 WeakPolarHBondContact O-CB 3.44Å; F339-H343 PolarHBondContact O-N 3Å; I340-H343 PolarHBondContact O-N 2.77Å; H343-W345 PolarHBondContact O-N 3.41Å; H343-W345 VanDerWaalsContact O-N 3.08Å; H343-V346 PolarHBondContact O-N 2.75Å; H343-R347 WeakPolarHBondContact O-CB 3.29Å; H343-R347 PolarHBondContact O-N 3.09Å; H343-G353 PolarHBondContact ND1-O 3.16Å; H343-T356 WeakPolarHBondContact CB-OG1 3.44Å; H343-T356 PolarHBondContact ND1-OG1 2.94Å; H343-T356 VanDerWaalsContact ND1-OG1 3.12Å; H343-W419 AromaticContact CD2-CH2 3.4Å; H343-W419 VanDerWaalsContact CD2-CH2 3.4Å; H343-W419 WeakPolarHBondContact CD2-CH2 3.3Å; H343-W419 AromaticContact CD2-CZ2 3.25Å; H343-W419 WeakPolarHBondContact CD2-CZ2 3.39Å; H343-W419 AromaticContact NE2-CH2 3.6Å; H343-W419 AromaticContact NE2-CZ2 3.57Å; H343-E470 IonicContact CE1-OE1 3.38Å; H343-E470 IonicContact NE2-OE1 3.41Å; H343-E470 PolarHBondContact NE2-OE1 3.47Å
344T90.3Very high90.7Very high41 Ų4139.8 Ų39.825%0.25220%0.202SC..Hα-helixtrans-60-26179.5550000114.1I340 K341 W419 P459I340-T344 WeakPolarHBondContact O-CG2 3.37Å; I340-T344 PolarHBondContact O-N 2.66Å; I340-T344 PolarHBondContact O-OG1 3.34Å; K341-T344 WeakPolarHBondContact CA-OG1 3.39Å; K341-T344 PolarHBondContact O-N 2.97Å; K341-T344 PolarHBondContact O-OG1 3.3Å; T344-W419 HydrophobicContact CG2-CZ2 4.32Å; T344-W419 VanDerWaalsContact CG2-NE1 3.29Å; T344-P459 HydrophobicContact CG2-CB 3.99Å; T344-P459 HydrophobicContact CG2-CG 4.19Å
345W90.4Very high91Very high35 Ų3533.9 Ų33.913%0.13318%0.179CC..Hα-helixtrans-80.9-38.5175.6178.658.9000112.8L261 W264 L267 L272 V280 K341 L342 H343L261-W345 HydrophobicContact CD1-CB 4.13Å; L261-W345 HydrophobicContact CD1-CD2 4.43Å; L261-W345 HydrophobicContact CD1-CE3 4.38Å; L261-W345 HydrophobicContact CD1-CG 4.34Å; W264-W345 HydrophobicContact CB-CH2 4.15Å; W264-W345 HydrophobicContact CB-CZ2 3.82Å; W264-W345 HydrophobicContact CE3-CH2 4.12Å; L267-W345 PolarHBondContact O-NE1 3.2Å; L272-W345 HydrophobicContact CD1-CH2 3.76Å; L272-W345 HydrophobicContact CD1-CZ2 3.83Å; L272-W345 HydrophobicContact CD2-CZ2 4.36Å; L272-W345 HydrophobicContact CG-CZ2 4.46Å; V280-W345 HydrophobicContact CG1-CH2 4.4Å; V280-W345 HydrophobicContact CG1-CZ3 3.89Å; V280-W345 HydrophobicContact CG2-CH2 3.73Å; V280-W345 HydrophobicContact CG2-CZ3 3.93Å; K341-W345 PolarHBondContact O-N 3.37Å; K341-W345 VanDerWaalsContact O-N 3.12Å; L342-W345 PolarHBondContact O-N 3.24Å; H343-W345 PolarHBondContact O-N 3.41Å; H343-W345 VanDerWaalsContact O-N 3.08Å
346V91.2Very high91.2Very high0 Ų033.5 Ų33.50%018%0.177CC..Hα-helixtrans-95.7-6.6-175-54.90000115.1V280 I284 L342 H343 V348 S349 L352 T356V280-V346 HydrophobicContact CG1-CG1 4.22Å; I284-V346 HydrophobicContact CD1-CG1 4Å; I284-V346 HydrophobicContact CD1-CG2 4.26Å; L342-V346 HydrophobicContact CD2-CG2 4.49Å; L342-V346 WeakPolarHBondContact O-CG2 3.45Å; L342-V346 PolarHBondContact O-N 2.56Å; L342-V346 VanDerWaalsContact O-N 3.1Å; H343-V346 PolarHBondContact O-N 2.75Å; V346-V348 PolarHBondContact O-N 3.39Å; V346-S349 PolarHBondContact O-N 2.94Å; V346-L352 HydrophobicContact CB-CB 3.88Å; V346-L352 HydrophobicContact CB-CD1 4.25Å; V346-L352 HydrophobicContact CG1-CD1 4.38Å; V346-L352 HydrophobicContact CG2-CB 3.83Å; V346-T356 HydrophobicContact CG2-CG2 4Å
347R91Very high91.4Very high35 Ų3533.5 Ų33.513%0.13218%0.177CC..THydrogen-bonded Turntrans-55.3-18.9-172.266.1-175.6-60.9-114.1-1.3116.6H343 S349 N465 L467 Y469 E470H343-R347 WeakPolarHBondContact O-CB 3.29Å; H343-R347 PolarHBondContact O-N 3.09Å; R347-S349 PolarHBondContact O-N 3.32Å; R347-N465 PolarHBondContact NH1-O 3.34Å; R347-N465 PolarHBondContact NH2-O 2.95Å; R347-L467 WeakPolarHBondContact O-CD1 3.3Å; R347-Y469 WeakPolarHBondContact CA-OH 3.28Å; R347-Y469 PolarHBondContact O-OH 3.49Å; R347-E470 WeakPolarHBondContact CB-OE1 3.47Å; R347-E470 IonicContact CZ-OE1 2.71Å; R347-E470 IonicContact CZ-OE2 3.62Å; R347-E470 IonicContact NE-OE1 3.25Å; R347-E470 PolarHBondContact NE-OE1 3.44Å; R347-E470 IonicContact NE-OE2 3.41Å; R347-E470 VanDerWaalsContact NH2-CD 3.3Å; R347-E470 IonicContact NH2-OE1 3.68Å; R347-E470 PolarHBondContact NH2-OE1 3.08Å; R347-E470 VanDerWaalsContact NH2-OE1 3.11Å; R347-E470 IonicContact NH2-OE2 2.92Å; R347-E470 PolarHBondContact NH2-OE2 3.24Å
348V87.1Confident91.5Very high114 Ų11433.6 Ų33.669%0.69118%0.18SC*.THydrogen-bonded Turntrans-65.8-22.1174.9-176.90000111.8V346V346-V348 PolarHBondContact O-N 3.39Å
349S89.1Confident91.5Very high44 Ų4432.9 Ų32.931%0.30818%0.176SC..SBendtrans-101.9112.2173.6177.50000110V346 R347 L351 L352 G353V346-S349 PolarHBondContact O-N 2.94Å; R347-S349 PolarHBondContact O-N 3.32Å; S349-L351 PolarHBondContact O-N 2.99Å; S349-L351 VanDerWaalsContact O-N 3.17Å; S349-L352 PolarHBondContact O-N 3.38Å; S349-L352 VanDerWaalsContact O-N 3.12Å; S349-G353 PolarHBondContact O-N 3.43Å
350D87.3Confident91.5Very high98 Ų9832.9 Ų32.952%0.52418%0.176SC..Hα-helixtrans-54.5-38.1179.6-53.8-8.6000111.8A354 Y469D350-A354 WeakPolarHBondContact O-CB 3.48Å; D350-A354 PolarHBondContact O-N 2.89Å; D350-Y469 HydrophobicContact CB-CD1 3.89Å; D350-Y469 HydrophobicContact CB-CE1 4.09Å; D350-Y469 HydrophobicContact CB-CG 4.27Å; D350-Y469 VanDerWaalsContact OD1-CD1 3.23Å; D350-Y469 WeakPolarHBondContact OD1-CD1 3.29Å; D350-Y469 WeakPolarHBondContact OD1-CE1 3.38Å
351L89.9Confident91.5Very high97 Ų9732.8 Ų32.851%0.50818%0.176SC..Hα-helixtrans-63.8-43.3178.6-179.663.1000113.6F281 S349 R355F281-L351 HydrophobicContact CD2-CD2 4.27Å; F281-L351 HydrophobicContact CE2-CD2 3.79Å; F281-L351 HydrophobicContact CE2-CG 4.26Å; S349-L351 PolarHBondContact O-N 2.99Å; S349-L351 VanDerWaalsContact O-N 3.17Å; L351-R355 WeakPolarHBondContact O-CG 3.28Å
352L91.8Very high91.4Very high9 Ų933.1 Ų33.15%0.04718%0.175CC..Hα-helixtrans-82.1-40.3179.6-63.5-178.6000111.2V280 F281 I284 V346 S349 R355 T356V280-L352 HydrophobicContact CG1-CD1 4.25Å; F281-L352 HydrophobicContact CB-CD2 4.14Å; F281-L352 HydrophobicContact CD2-CD2 3.69Å; F281-L352 HydrophobicContact CG-CD2 4.38Å; I284-L352 HydrophobicContact CD1-CB 4.24Å; I284-L352 HydrophobicContact CD1-CD1 4.43Å; I284-L352 HydrophobicContact CD1-CD2 4.02Å; I284-L352 HydrophobicContact CD1-CG 4.47Å; I284-L352 HydrophobicContact CG2-CD2 4.48Å; V346-L352 HydrophobicContact CB-CB 3.88Å; V346-L352 HydrophobicContact CB-CD1 4.25Å; V346-L352 HydrophobicContact CG1-CD1 4.38Å; V346-L352 HydrophobicContact CG2-CB 3.83Å; S349-L352 PolarHBondContact O-N 3.38Å; S349-L352 VanDerWaalsContact O-N 3.12Å; L352-R355 PolarHBondContact O-N 3.25Å; L352-T356 VanDerWaalsContact O-CG2 3.25Å; L352-T356 WeakPolarHBondContact O-CG2 3.24Å; L352-T356 PolarHBondContact O-N 2.87Å; L352-T356 VanDerWaalsContact O-N 3.09Å; L352-T356 PolarHBondContact O-OG1 3.46Å
353G91.4Very high91.2Very high0 Ų032.8 Ų32.80%017%0.174CC..Hα-helixtrans-57.4-50176.500000111.5H343 S349 R355 T356 L357H343-G353 PolarHBondContact ND1-O 3.16Å; S349-G353 PolarHBondContact O-N 3.43Å; G353-R355 PolarHBondContact O-N 3.46Å; G353-T356 PolarHBondContact O-N 3.08Å; G353-T356 PolarHBondContact O-OG1 3.06Å; G353-L357 VanDerWaalsContact O-CB 3.27Å; G353-L357 WeakPolarHBondContact O-CB 3.14Å; G353-L357 PolarHBondContact O-N 3.45Å
354A93.1Very high90.9Very high27 Ų2732.8 Ų32.822%0.22317%0.174CC..Hα-helixtrans-58.1-50.3178.200000111.9D350 T356 L357 S358 Y469 I473D350-A354 WeakPolarHBondContact O-CB 3.48Å; D350-A354 PolarHBondContact O-N 2.89Å; A354-T356 PolarHBondContact O-N 3.05Å; A354-L357 PolarHBondContact O-N 2.95Å; A354-S358 WeakPolarHBondContact O-CB 3.37Å; A354-S358 PolarHBondContact O-N 3.11Å; A354-S358 PolarHBondContact O-OG 2.78Å; A354-Y469 HydrophobicContact CB-CD2 4.4Å; A354-I473 HydrophobicContact CB-CD1 3.63Å
355R94.2Very high90.5Very high75 Ų7532.1 Ų32.128%0.28317%0.171SC..Hα-helixtrans-59.6-44.7-179.5-69.9-179.9177.9-87.23.4113.1I284 D288 L351 L352 G353 L357 S358 C359I284-R355 HydrophobicContact CG2-CB 3.79Å; D288-R355 HydrophobicContact CB-CB 4.25Å; D288-R355 WeakPolarHBondContact OD2-CG 3.34Å; D288-R355 IonicContact OD2-CZ 3.79Å; D288-R355 IonicContact OD2-NH1 2.79Å; D288-R355 PolarHBondContact OD2-NH1 3.06Å; L351-R355 WeakPolarHBondContact O-CG 3.28Å; L352-R355 PolarHBondContact O-N 3.25Å; G353-R355 PolarHBondContact O-N 3.46Å; R355-L357 VanDerWaalsContact C-N 3.32Å; R355-S358 PolarHBondContact O-N 3.32Å; R355-C359 PolarHBondContact O-N 3.39Å; R355-C359 PolarHBondContact O-SG 3.31Å
356T94.5Very high90.2Very high2 Ų230.7 Ų30.71%0.01217%0.165CC..Hα-helixtrans-68.1-35.5-179.254.60000111.8I284 L342 H343 V346 L352 G353 A354 C359 L360I284-T356 HydrophobicContact CB-CG2 4.47Å; I284-T356 HydrophobicContact CD1-CG2 3.9Å; I284-T356 HydrophobicContact CG1-CG2 4.03Å; I284-T356 HydrophobicContact CG2-CG2 3.62Å; L342-T356 HydrophobicContact CD2-CG2 3.19Å; H343-T356 WeakPolarHBondContact CB-OG1 3.44Å; H343-T356 PolarHBondContact ND1-OG1 2.94Å; H343-T356 VanDerWaalsContact ND1-OG1 3.12Å; V346-T356 HydrophobicContact CG2-CG2 4Å; L352-T356 VanDerWaalsContact O-CG2 3.25Å; L352-T356 WeakPolarHBondContact O-CG2 3.24Å; L352-T356 PolarHBondContact O-N 2.87Å; L352-T356 VanDerWaalsContact O-N 3.09Å; L352-T356 PolarHBondContact O-OG1 3.46Å; G353-T356 PolarHBondContact O-N 3.08Å; G353-T356 PolarHBondContact O-OG1 3.06Å; A354-T356 PolarHBondContact O-N 3.05Å; T356-C359 WeakPolarHBondContact O-CB 3.32Å; T356-C359 PolarHBondContact O-N 3.46Å; T356-L360 PolarHBondContact O-N 3.4Å
357L93Very high89.4Confident0 Ų031.4 Ų31.40%017%0.17CC..Hα-helixtrans-72.2-41.3175.2-162.466.4000111.4G353 A354 R355 C359 L360 V361 W419 E470 I473 L474G353-L357 VanDerWaalsContact O-CB 3.27Å; G353-L357 WeakPolarHBondContact O-CB 3.14Å; G353-L357 PolarHBondContact O-N 3.45Å; A354-L357 PolarHBondContact O-N 2.95Å; R355-L357 VanDerWaalsContact C-N 3.32Å; L357-C359 PolarHBondContact O-N 2.96Å; L357-L360 HydrophobicContact CD1-CD1 4.28Å; L357-L360 WeakPolarHBondContact O-CA 3.28Å; L357-L360 WeakPolarHBondContact O-CB 3.34Å; L357-L360 PolarHBondContact O-N 3.2Å; L357-V361 WeakPolarHBondContact O-CG2 3.4Å; L357-V361 PolarHBondContact O-N 3.11Å; L357-W419 HydrophobicContact CD1-CH2 3.73Å; L357-W419 HydrophobicContact CD1-CZ3 4.05Å; L357-E470 HydrophobicContact CD2-CB 4.31Å; L357-E470 HydrophobicContact CD2-CG 4.48Å; L357-I473 HydrophobicContact CB-CG2 3.88Å; L357-I473 HydrophobicContact CD2-CB 3.51Å; L357-I473 HydrophobicContact CD2-CD1 4.42Å; L357-I473 HydrophobicContact CD2-CG2 3.53Å; L357-I473 HydrophobicContact CG-CB 4.14Å; L357-I473 HydrophobicContact CG-CG2 3.55Å; L357-L474 HydrophobicContact CD1-CD2 3.87Å; L357-L474 HydrophobicContact CD1-CG 4.36Å; L357-L474 HydrophobicContact CD2-CD2 4.46Å; L357-L474 HydrophobicContact CD2-CG 4.07Å
358S92.5Very high88.6Confident29 Ų2930.5 Ų30.520%0.20317%0.172CC..Hα-helixtrans-59.4-33.2172.2-59.90000112.4A354 R355 V361 R362A354-S358 WeakPolarHBondContact O-CB 3.37Å; A354-S358 PolarHBondContact O-N 3.11Å; A354-S358 PolarHBondContact O-OG 2.78Å; R355-S358 PolarHBondContact O-N 3.32Å; S358-V361 WeakPolarHBondContact O-CB 3.31Å; S358-V361 PolarHBondContact O-N 2.79Å; S358-R362 WeakPolarHBondContact O-CG 3.2Å; S358-R362 PolarHBondContact O-N 2.69Å
359C93.3Very high87.6Confident1 Ų127.1 Ų27.11%0.00715%0.153CC..Hα-helixtrans-61.1-43.7170.8-63.30000111.8D288 T291 F339 R355 T356 L357 R362 F363D288-C359 VanDerWaalsContact CA-SG 3.52Å; T291-C359 HydrophobicContact CG2-CB 4.23Å; T291-C359 PolarHBondContact OG1-SG 3.37Å; F339-C359 HydrophobicContact CD1-CB 3.61Å; F339-C359 HydrophobicContact CE1-CB 3.4Å; F339-C359 HydrophobicContact CZ-CB 4.3Å; R355-C359 PolarHBondContact O-N 3.39Å; R355-C359 PolarHBondContact O-SG 3.31Å; T356-C359 WeakPolarHBondContact O-CB 3.32Å; T356-C359 PolarHBondContact O-N 3.46Å; L357-C359 PolarHBondContact O-N 2.96Å; C359-R362 PolarHBondContact O-N 2.79Å; C359-F363 WeakPolarHBondContact O-CG 3.39Å; C359-F363 PolarHBondContact O-N 2.82Å; C359-F363 VanDerWaalsContact O-N 3.14Å
360L92.7Very high86.8Confident3 Ų326.3 Ų26.32%0.01614%0.144CC..Hα-helixtrans-65.7-40176.6-69.6170.6000111.7F339 I340 T356 L357 R362 F363 S364 F477F339-L360 HydrophobicContact CB-CD2 3.62Å; F339-L360 HydrophobicContact CB-CG 4.06Å; I340-L360 HydrophobicContact CG1-CD1 4.04Å; I340-L360 HydrophobicContact CG1-CD2 4.16Å; T356-L360 PolarHBondContact O-N 3.4Å; L357-L360 HydrophobicContact CD1-CD1 4.28Å; L357-L360 WeakPolarHBondContact O-CA 3.28Å; L357-L360 WeakPolarHBondContact O-CB 3.34Å; L357-L360 PolarHBondContact O-N 3.2Å; L360-R362 VanDerWaalsContact C-N 3.32Å; L360-R362 PolarHBondContact O-N 3.02Å; L360-F363 HydrophobicContact CD2-CD2 4.14Å; L360-F363 WeakPolarHBondContact O-CB 3.21Å; L360-F363 PolarHBondContact O-N 3.04Å; L360-F363 VanDerWaalsContact O-N 3.14Å; L360-S364 PolarHBondContact O-N 3.19Å; L360-F477 WeakPolarHBondContact O-CD2 3.41Å; L360-F477 WeakPolarHBondContact O-CE2 3.46Å
361V91.6Very high86Confident3 Ų321.8 Ų21.82%0.01812%0.12CC..Hα-helixtrans-55.2-48.5171.7176.80000110.2L357 S358 F363 S364 S365 I473 E476 F477 N480L357-V361 WeakPolarHBondContact O-CG2 3.4Å; L357-V361 PolarHBondContact O-N 3.11Å; S358-V361 WeakPolarHBondContact O-CB 3.31Å; S358-V361 PolarHBondContact O-N 2.79Å; V361-F363 VanDerWaalsContact C-N 3.26Å; V361-F363 PolarHBondContact O-N 3.15Å; V361-S364 WeakPolarHBondContact O-CB 3.24Å; V361-S364 PolarHBondContact O-N 3.05Å; V361-S364 PolarHBondContact O-OG 2.8Å; V361-S365 PolarHBondContact O-N 3.1Å; V361-I473 HydrophobicContact CG2-CG2 3.67Å; V361-I473 WeakPolarHBondContact CG2-O 3.32Å; V361-E476 HydrophobicContact CG1-CB 4.21Å; V361-E476 VanDerWaalsContact CG1-CD 3.46Å; V361-E476 HydrophobicContact CG1-CG 3.74Å; V361-E476 WeakPolarHBondContact CG1-OE1 3.33Å; V361-E476 HydrophobicContact CG2-CB 4.48Å; V361-F477 HydrophobicContact CG2-CB 3.77Å; V361-N480 WeakPolarHBondContact CG1-ND2 3.46Å
362R89Confident84.9Confident73 Ų7320.6 Ų20.628%0.27511%0.11SC..Hα-helixtrans-64.7-26.9179-68.6-177.4-175.4103.6-3.8113.8D288 T291 F317 S358 C359 L360 S364 S365 M366D288-R362 IonicContact OD1-CZ 2.8Å; D288-R362 IonicContact OD1-NH1 2.69Å; D288-R362 PolarHBondContact OD1-NH1 2.89Å; T291-R362 VanDerWaalsContact C-CD 3.46Å; T291-R362 WeakPolarHBondContact O-CD 3.27Å; F317-R362 HydrophobicContact CB-CB 4.41Å; S358-R362 WeakPolarHBondContact O-CG 3.2Å; S358-R362 PolarHBondContact O-N 2.69Å; C359-R362 PolarHBondContact O-N 2.79Å; L360-R362 VanDerWaalsContact C-N 3.32Å; L360-R362 PolarHBondContact O-N 3.02Å; R362-S364 VanDerWaalsContact C-N 3.33Å; R362-S365 PolarHBondContact O-N 3.38Å; R362-S365 PolarHBondContact O-OG 2.61Å; R362-M366 PolarHBondContact O-N 3.14Å
363F89.4Confident83.4Confident3 Ų323 Ų231%0.01313%0.125CC..Hα-helixtrans-68.3-31.4170.9-64.4-24.8000112.9T291 F317 F332 T335 F339 C359 L360 V361 M366 L412T291-F363 HydrophobicContact CG2-CE1 3.74Å; T291-F363 HydrophobicContact CG2-CZ 3.99Å; F317-F363 HydrophobicContact CD1-CD1 4.37Å; F317-F363 HydrophobicContact CE1-CD1 4.46Å; F317-F363 HydrophobicContact CE1-CE1 4.33Å; F332-F363 HydrophobicContact CE2-CB 4.14Å; F332-F363 HydrophobicContact CE2-CD2 4.38Å; F332-F363 HydrophobicContact CE2-CG 4.16Å; F332-F363 HydrophobicContact CZ-CB 4.22Å; T335-F363 HydrophobicContact CG2-CE2 4.44Å; T335-F363 HydrophobicContact CG2-CZ 4.25Å; F339-F363 HydrophobicContact CB-CE2 4.49Å; F339-F363 AromaticContact CD2-CE2 3.56Å; F339-F363 HydrophobicContact CD2-CE2 3.56Å; F339-F363 AromaticContact CD2-CZ 3.9Å; F339-F363 HydrophobicContact CD2-CZ 3.9Å; F339-F363 AromaticContact CE2-CE2 3.79Å; F339-F363 HydrophobicContact CE2-CE2 3.79Å; F339-F363 AromaticContact CE2-CZ 3.6Å; F339-F363 HydrophobicContact CE2-CZ 3.6Å; F339-F363 AromaticContact CG-CE2 3.97Å; F339-F363 HydrophobicContact CG-CE2 3.97Å; F339-F363 HydrophobicContact CZ-CE2 4.38Å; F339-F363 HydrophobicContact CZ-CZ 4.01Å; C359-F363 WeakPolarHBondContact O-CG 3.39Å; C359-F363 PolarHBondContact O-N 2.82Å; C359-F363 VanDerWaalsContact O-N 3.14Å; L360-F363 HydrophobicContact CD2-CD2 4.14Å; L360-F363 WeakPolarHBondContact O-CB 3.21Å; L360-F363 PolarHBondContact O-N 3.04Å; L360-F363 VanDerWaalsContact O-N 3.14Å; V361-F363 VanDerWaalsContact C-N 3.26Å; V361-F363 PolarHBondContact O-N 3.15Å; F363-M366 WeakPolarHBondContact O-CB 3.49Å; F363-L412 HydrophobicContact CB-CD2 4.39Å
364S86.1Confident81.4Confident0 Ų028.9 Ų28.90%016%0.157CC..Hα-helixtrans-72.3-27.8174.565.70000114L360 V361 R362 N480L360-S364 PolarHBondContact O-N 3.19Å; V361-S364 WeakPolarHBondContact O-CB 3.24Å; V361-S364 PolarHBondContact O-N 3.05Å; V361-S364 PolarHBondContact O-OG 2.8Å; R362-S364 VanDerWaalsContact C-N 3.33Å; S364-N480 WeakPolarHBondContact OG-CB 3.49Å; S364-N480 PolarHBondContact OG-ND2 3.21Å
365S82.5Confident79Confident27 Ų2731.8 Ų31.819%0.18918%0.176CC..THydrogen-bonded Turntrans-93.58.7177.465.70000113.9V361 R362 S367V361-S365 PolarHBondContact O-N 3.1Å; R362-S365 PolarHBondContact O-N 3.38Å; R362-S365 PolarHBondContact O-OG 2.61Å; S365-S367 PolarHBondContact O-N 3.39Å
366M82.6Confident76.1Confident4 Ų432.8 Ų32.82%0.0219%0.194CC..  trans-58.4137.7-176.4-169.817164.500111.4F317 P319 I327 F332 R362 F363 I371F317-M366 HydrophobicContact CD1-CB 4.49Å; F317-M366 HydrophobicContact CD1-CG 3.87Å; F317-M366 HydrophobicContact CD1-SD 3.85Å; F317-M366 HydrophobicContact CE1-CG 4.49Å; F317-M366 HydrophobicContact CE1-SD 3.94Å; F317-M366 WeakPolarHBondContact O-CA 3.36Å; P319-M366 HydrophobicContact CG-CG 3.87Å; P319-M366 HydrophobicContact CG-SD 3.54Å; P319-M366 VanDerWaalsContact CG-SD 3.54Å; I327-M366 HydrophobicContact CG2-CE 3.64Å; I327-M366 HydrophobicContact CG2-SD 3.3Å; I327-M366 WeakPolarHBondContact CG2-SD 3.46Å; F332-M366 HydrophobicContact CE2-CE 4.28Å; R362-M366 PolarHBondContact O-N 3.14Å; F363-M366 WeakPolarHBondContact O-CB 3.49Å; M366-I371 HydrophobicContact CB-CD1 3.55Å; M366-I371 HydrophobicContact CE-CD1 3.54Å; M366-I371 HydrophobicContact CE-CG1 3.85Å; M366-I371 HydrophobicContact CG-CD1 3.4Å; M366-I371 HydrophobicContact CG-CG1 4.39Å; M366-I371 WeakPolarHBondContact O-CD1 3.33Å; M366-I371 HydrophobicContact SD-CD1 4.17Å
367S76.2Confident73Confident15 Ų1538.5 Ų38.511%0.10523%0.234CC..  trans-139173.6177.948.90000111.8F317 R318 S365F317-S367 PolarHBondContact O-N 3.09Å; F317-S367 VanDerWaalsContact O-N 3.08Å; R318-S367 WeakPolarHBondContact CA-O 3.24Å; R318-S367 WeakPolarHBondContact CG-OG 3.27Å; R318-S367 PolarHBondContact NE-OG 2.71Å; R318-S367 VanDerWaalsContact NE-OG 3.09Å; S365-S367 PolarHBondContact O-N 3.39Å
368G72.7Confident70Confident17 Ų1742.9 Ų42.918%0.17527%0.271CS..SBendtrans112.4-176.8176.700000115.4L370 I371 Y372G368-L370 VanDerWaalsContact C-N 3.33Å; G368-L370 PolarHBondContact O-N 2.72Å; G368-I371 PolarHBondContact O-N 2.98Å; G368-Y372 WeakPolarHBondContact O-CD2 3.32Å; G368-Y372 PolarHBondContact O-N 2.99Å
369P67.7Low67Low43 Ų4346.8 Ų46.828%0.27930%0.297SS..THydrogen-bonded Turntrans-63.8-27.8-168.321.8-31.4000115.4I371 Y372P369-I371 VanDerWaalsContact C-N 3.32Å; P369-Y372 WeakPolarHBondContact CA-O 3.48Å; P369-Y372 CarbonylContact O-C 3.49Å
370L72.1Confident64Low26 Ų2654.2 Ų54.214%0.13634%0.335CS..THydrogen-bonded Turntrans-67.7-36.2176.2-82.6178.2000112.5P319 S320 W323 N324 G368P319-L370 HydrophobicContact CB-CD1 4.01Å; P319-L370 HydrophobicContact CG-CD1 4.22Å; S320-L370 WeakPolarHBondContact O-CD1 3.43Å; S320-L370 WeakPolarHBondContact O-CG 3.49Å; W323-L370 HydrophobicContact CB-CD1 3.64Å; N324-L370 HydrophobicContact CB-CD2 4.08Å; G368-L370 VanDerWaalsContact C-N 3.33Å; G368-L370 PolarHBondContact O-N 2.72Å
371I69.7Low60.8Low4 Ų461 Ų612%0.02137%0.371CS..THydrogen-bonded Turntrans-79.5-56.7174.6-67.9176.5000107.9M366 G368 P369 P373 C405M366-I371 HydrophobicContact CB-CD1 3.55Å; M366-I371 HydrophobicContact CE-CD1 3.54Å; M366-I371 HydrophobicContact CE-CG1 3.85Å; M366-I371 HydrophobicContact CG-CD1 3.4Å; M366-I371 HydrophobicContact CG-CG1 4.39Å; M366-I371 WeakPolarHBondContact O-CD1 3.33Å; M366-I371 HydrophobicContact SD-CD1 4.17Å; G368-I371 PolarHBondContact O-N 2.98Å; P369-I371 VanDerWaalsContact C-N 3.32Å; I371-P373 WeakPolarHBondContact O-CD 3.48Å; I371-C405 HydrophobicContact CG2-CB 3.64Å; I371-C405 WeakPolarHBondContact CG2-SG 3.42Å; I371-C405 PolarHBondContact O-SG 3.44Å
372Y67.8Low57.7Low72 Ų7268 Ų6828%0.28241%0.408SS..SBendtrans-104.190.2-176.2-48.7-80.4000111.7G368 P369 C405 R487G368-Y372 WeakPolarHBondContact O-CD2 3.32Å; G368-Y372 PolarHBondContact O-N 2.99Å; P369-Y372 WeakPolarHBondContact CA-O 3.48Å; P369-Y372 CarbonylContact O-C 3.49Å; Y372-C405 WeakPolarHBondContact CD1-SG 3.33Å; Y372-R487 PolarHBondContact OH-NH1 3.4Å; Y372-R487 PolarHBondContact OH-NH2 3.5Å
373P58.3Low54.7Low58 Ų5872.8 Ų72.838%0.37744%0.439SS..  trans-64.1138.8171.525.5-32.6000110.3I371 S375 P404I371-P373 WeakPolarHBondContact O-CD 3.48Å; P373-S375 PolarHBondContact O-N 2.85Å; P373-P404 HydrophobicContact CG-CG 4.03Å
374N51Low51.7Low125 Ų12577.1 Ų77.167%0.66847%0.47SS*.SBendtrans-72.758.6-173.3-65.6-20.3000114.4R298R298-N374 PolarHBondContact NH1-ND2 3.02Å; R298-N374 PolarHBondContact NH1-OD1 3.18Å; R298-N374 PolarHBondContact NH2-OD1 2.91Å
375S41.1Very low49Very low87 Ų8782.4 Ų82.461%0.60851%0.507SS*.  trans-113.711.3-179.546.60000115P373P373-S375 PolarHBondContact O-N 2.85Å
376S34.1Very low46.4Very low96 Ų9691.4 Ų91.467%0.67154%0.538SS*.SBendtrans-121.30.9-169.2-40.80000117.3
377S30.2Very low43.8Very low122 Ų12298.8 Ų98.885%0.85357%0.573SS**SBendtrans-113.70.2-177.6-53.70000115.4
378A29.4Very low41.7Very low93 Ų93105.5 Ų105.577%0.76961%0.607SS**SBendtrans-96.61.5178.100000114.5
379C29.1Very low39.5Very low111 Ų111107.9 Ų107.975%0.7563%0.631SS**SBendtrans-10710.7-171.2-55.70000115.4
380I30.4Very low37.6Very low156 Ų156113.8 Ų113.880%0.866%0.659SS**SBendtrans-100.9-4.5-179.5-62.9178.7000113.3
381N25.5Very low35.5Very low145 Ų145117.8 Ų117.878%0.77569%0.689SS**SBendtrans-135.191.6172.4-103-11.3000110.6
382N25.9Very low33.8Very low150 Ų150122 Ų12280%0.80272%0.719SS**  trans-175.977.3143.1-91.7-15.8000111.1S384N382-S384 VanDerWaalsContact C-N 3.3Å; N382-S384 PolarHBondContact O-N 2.99Å
383N26.1Very low32Very low174 Ų174122.4 Ų122.493%0.9373%0.732SS**  trans-77.985.7149.5-89.1-18.5000108
384S26.5Very low30.9Very low94 Ų94128.9 Ų128.966%0.65775%0.751SS**  trans174.5139.8144.747.10000113.3N382N382-S384 VanDerWaalsContact C-N 3.3Å; N382-S384 PolarHBondContact O-N 2.99Å
385S31Very low30.1Very low111 Ų111133 Ų13378%0.77676%0.759SS**  trans88.490.2159.5710000120.3
386Y27.8Very low30.1Very low217 Ų217134.2 Ų134.285%0.85176%0.758SS**  trans2.6135136.7-69.7-84.7000122.3
387H27.7Very low30.2Very low159 Ų159135 Ų13574%0.73675%0.751SS**  trans90.4122.7137.7-91.3-67.6000122.5
388N30.5Very low30.7Very low156 Ų156135.7 Ų135.783%0.83474%0.744SS**  trans78.2127.8157.1-57.2-11.9000116
389G27.3Very low31.4Very low66 Ų66138.7 Ų138.768%0.6874%0.742SS**  cis155.1142.8700000107.9
390I27.5Very low32.3Very low167 Ų167135.9 Ų135.986%0.85672%0.723SS**  trans93.5113.8160.9-48.5168.3000117.1
391S28.1Very low33.4Very low110 Ų110130.3 Ų130.377%0.76970%0.695SS**  trans70.781.9152.871.20000121.2
392S33.6Very low34.9Very low92 Ų92124.5 Ų124.564%0.64367%0.669SS**  trans-153.322.2144.689.60000114.6Y394S392-Y394 PolarHBondContact O-N 3.47Å
393S31.7Very low36.9Very low82 Ų82118.7 Ų118.757%0.57364%0.64SS**THydrogen-bonded Turntrans-79.4-7.1-166.463.90000116.2
394Y33.9Very low38.9Very low194 Ų194112.6 Ų112.676%0.76161%0.61SS**THydrogen-bonded Turntrans-98.2-15.6-175-107.8-84.5000115.7S392S392-Y394 PolarHBondContact O-N 3.47Å
395Y35.8Very low41.1Very low212 Ų212108.3 Ų108.383%0.83158%0.58SS**THydrogen-bonded Turntrans-98.9-22.3-177.2-96.8-85.1000114.3
396N39.5Very low43.4Very low111 Ų111103.1 Ų103.159%0.59454%0.544SS*.SBendtrans-86.3-18.8179.2-77.5-8.4000113.8
397E37.5Very low45.9Very low113 Ų11395 Ų9553%0.52851%0.514SS..SBendtrans-78.1-18.4-176.5-75-179.9175.600113.8S400E397-S400 VanDerWaalsContact O-CB 3.26Å; E397-S400 WeakPolarHBondContact O-CB 3.43Å; E397-S400 PolarHBondContact O-OG 3.42Å
398I39.5Very low48.5Very low136 Ų13687.8 Ų87.870%0.69748%0.481SS*.SBendtrans-90.4-24.3179.3-60.5173.9000112.1S400I398-S400 PolarHBondContact O-N 3.13Å; I398-S400 VanDerWaalsContact O-N 3.15Å
399Q44.3Very low51.1Low157 Ų15780.7 Ų80.773%0.73444%0.442SS*.G310 helixtrans-68.8-3167.1-76.6-177.2-700112.8L401Q399-L401 PolarHBondContact O-N 3.12Å
400S48.5Very low53.8Low51 Ų5177.6 Ų77.636%0.35741%0.41SS..G310 helixtrans-81.2-7-175.277.80000115.6E397 I398 R494E397-S400 VanDerWaalsContact O-CB 3.26Å; E397-S400 WeakPolarHBondContact O-CB 3.43Å; E397-S400 PolarHBondContact O-OG 3.42Å; I398-S400 PolarHBondContact O-N 3.13Å; I398-S400 VanDerWaalsContact O-N 3.15Å; S400-R494 PolarHBondContact O-NH1 3.13Å
401L52.8Low56.6Low40 Ų4069.8 Ų69.821%0.20937%0.37CS..G310 helixtrans-86.7-19.3-173.9-8886.1000115.4Q399 S514 I518Q399-L401 PolarHBondContact O-N 3.12Å; L401-S514 WeakPolarHBondContact CD2-OG 3.44Å; L401-I518 HydrophobicContact CB-CD1 3.77Å; L401-I518 HydrophobicContact CD2-CD1 3.87Å; L401-I518 HydrophobicContact CG-CD1 4.25Å; L401-I518 VanDerWaalsContact O-CD1 3.32Å; L401-I518 WeakPolarHBondContact O-CD1 3.44Å
402G57.8Low59.5Low22 Ų2264.8 Ų64.823%0.22734%0.335CS..  trans179136.5173.600000111.3
403S67.2Low62.1Low29 Ų2960.4 Ų60.420%0.20330%0.304CS..  trans-60.6139.9175.3177.70000109.5C405 T406 M407S403-C405 PolarHBondContact O-N 2.8Å; S403-C405 VanDerWaalsContact O-N 3.11Å; S403-C405 PolarHBondContact OG-N 3.21Å; S403-C405 PolarHBondContact OG-SG 3.07Å; S403-T406 WeakPolarHBondContact O-CB 3.42Å; S403-T406 PolarHBondContact O-N 2.93Å; S403-M407 PolarHBondContact O-N 2.83Å
404P68.3Low64.7Low45 Ų4556.6 Ų56.629%0.29228%0.277SS..Hα-helixtrans-51.1-35.2172.817.2-28.4000111.3P373 T406 M407 H408P373-P404 HydrophobicContact CG-CG 4.03Å; P404-T406 VanDerWaalsContact C-N 3.33Å; P404-T406 PolarHBondContact O-N 3.26Å; P404-M407 PolarHBondContact O-N 3.19Å; P404-H408 PolarHBondContact O-N 3.19Å; P404-H408 VanDerWaalsContact O-N 3.15Å; P404-H408 PolarHBondContact O-ND1 3.09Å
405C73.2Confident67.3Low5 Ų547.6 Ų47.63%0.03424%0.242CC..Hα-helixtrans-52.4-51.7172.8-37.60000112.1I371 Y372 S403 M407 H408 Y409I371-C405 HydrophobicContact CG2-CB 3.64Å; I371-C405 WeakPolarHBondContact CG2-SG 3.42Å; I371-C405 PolarHBondContact O-SG 3.44Å; Y372-C405 WeakPolarHBondContact CD1-SG 3.33Å; S403-C405 PolarHBondContact O-N 2.8Å; S403-C405 VanDerWaalsContact O-N 3.11Å; S403-C405 PolarHBondContact OG-N 3.21Å; S403-C405 PolarHBondContact OG-SG 3.07Å; C405-M407 VanDerWaalsContact C-N 3.29Å; C405-M407 PolarHBondContact O-N 2.93Å; C405-H408 PolarHBondContact O-N 3.47Å; C405-H408 VanDerWaalsContact O-N 3.11Å; C405-Y409 WeakPolarHBondContact O-CD2 3.45Å; C405-Y409 PolarHBondContact O-N 2.99Å; C405-Y409 VanDerWaalsContact O-N 3.09Å
406T79.9Confident69.8Low1 Ų137.6 Ų37.61%0.00620%0.203CC..Hα-helixtrans-61.7-41.3-172.3-55.40000110.4S403 P404 Y409 L410 R487 E490 P491S403-T406 WeakPolarHBondContact O-CB 3.42Å; S403-T406 PolarHBondContact O-N 2.93Å; P404-T406 VanDerWaalsContact C-N 3.33Å; P404-T406 PolarHBondContact O-N 3.26Å; T406-Y409 PolarHBondContact O-N 3.07Å; T406-L410 HydrophobicContact CG2-CD1 4.2Å; T406-L410 WeakPolarHBondContact O-CB 3.47Å; T406-L410 VanDerWaalsContact O-CG 3.28Å; T406-L410 WeakPolarHBondContact O-CG 3.3Å; T406-L410 PolarHBondContact O-N 3.35Å; T406-R487 VanDerWaalsContact CG2-O 3.29Å; T406-R487 WeakPolarHBondContact CG2-O 3.46Å; T406-E490 PolarHBondContact OG1-OE2 2.93Å; T406-P491 HydrophobicContact CG2-CG 3.73Å
407M79.4Confident72.2Confident48 Ų4832.5 Ų32.524%0.23618%0.176CC..Hα-helixtrans-65.2-42.1175.4-64-62.6-88.800112.1S403 P404 C405 Y409 L410 I411 R451S403-M407 PolarHBondContact O-N 2.83Å; P404-M407 PolarHBondContact O-N 3.19Å; C405-M407 VanDerWaalsContact C-N 3.29Å; C405-M407 PolarHBondContact O-N 2.93Å; M407-Y409 PolarHBondContact O-N 3.24Å; M407-L410 PolarHBondContact O-N 3Å; M407-I411 WeakPolarHBondContact O-CB 3.29Å; M407-I411 VanDerWaalsContact O-CD1 3.3Å; M407-I411 WeakPolarHBondContact O-CD1 3.33Å; M407-I411 WeakPolarHBondContact O-CG1 3.39Å; M407-I411 PolarHBondContact O-N 3.43Å; M407-R451 HydrophobicContact CE-CB 4.47Å
408H82.1Confident74.4Confident6 Ų628.2 Ų28.23%0.02816%0.158CC..Hα-helixtrans-59.6-44.9177.5-7479.3000112.1I327 F332 P404 C405 I411 L412I327-H408 PolarHBondContact O-NE2 3.21Å; F332-H408 HydrophobicContact CD1-CB 4.45Å; F332-H408 AromaticContact CD1-CD2 3.47Å; F332-H408 VanDerWaalsContact CD1-CD2 3.47Å; F332-H408 WeakPolarHBondContact CD1-CD2 3.23Å; F332-H408 HydrophobicContact CE1-CB 4.28Å; F332-H408 AromaticContact CE1-CD2 3.9Å; F332-H408 AromaticContact CG-CD2 3.58Å; P404-H408 PolarHBondContact O-N 3.19Å; P404-H408 VanDerWaalsContact O-N 3.15Å; P404-H408 PolarHBondContact O-ND1 3.09Å; C405-H408 PolarHBondContact O-N 3.47Å; C405-H408 VanDerWaalsContact O-N 3.11Å; H408-I411 PolarHBondContact O-N 2.91Å; H408-L412 PolarHBondContact O-N 2.79Å
409Y84.6Confident76.7Confident8 Ų821.8 Ų21.83%0.03113%0.125CC..Hα-helixtrans-65.7-44177.3-74.9-70.1000112C405 T406 M407 I411 L412 I413 L481 N484 R487C405-Y409 WeakPolarHBondContact O-CD2 3.45Å; C405-Y409 PolarHBondContact O-N 2.99Å; C405-Y409 VanDerWaalsContact O-N 3.09Å; T406-Y409 PolarHBondContact O-N 3.07Å; M407-Y409 PolarHBondContact O-N 3.24Å; Y409-I411 VanDerWaalsContact C-N 3.28Å; Y409-I411 PolarHBondContact O-N 3.25Å; Y409-L412 PolarHBondContact O-N 3.08Å; Y409-I413 VanDerWaalsContact O-CG1 3.25Å; Y409-I413 WeakPolarHBondContact O-CG1 3.44Å; Y409-I413 PolarHBondContact O-N 3.43Å; Y409-L481 HydrophobicContact CD1-CD2 4.06Å; Y409-N484 HydrophobicContact CD1-CB 3.98Å; Y409-N484 HydrophobicContact CE1-CB 3.34Å; Y409-N484 HydrophobicContact CE2-CB 4.09Å; Y409-N484 VanDerWaalsContact CZ-CB 3.41Å; Y409-N484 PolarHBondContact OH-ND2 3.36Å; Y409-N484 PolarHBondContact OH-OD1 2.71Å; Y409-R487 HydrophobicContact CD2-CB 4.49Å; Y409-R487 PolarHBondContact OH-NH1 3.42Å
410L85.5Confident78.7Confident0 Ų014.5 Ų14.50%09%0.091CC..Hα-helixtrans-61.1-37.2176-70.5174.2000112.3T406 M407 E414 I452 A488 V525T406-L410 HydrophobicContact CG2-CD1 4.2Å; T406-L410 WeakPolarHBondContact O-CB 3.47Å; T406-L410 VanDerWaalsContact O-CG 3.28Å; T406-L410 WeakPolarHBondContact O-CG 3.3Å; T406-L410 PolarHBondContact O-N 3.35Å; M407-L410 PolarHBondContact O-N 3Å; L410-E414 VanDerWaalsContact O-CB 3.26Å; L410-E414 WeakPolarHBondContact O-CB 3.24Å; L410-E414 PolarHBondContact O-N 3.02Å; L410-I452 HydrophobicContact CB-CD1 4.22Å; L410-A488 HydrophobicContact CD2-CB 4.17Å; L410-V525 HydrophobicContact CD2-CB 4.28Å; L410-V525 HydrophobicContact CD2-CG1 4.13Å
411I85.5Confident79.5Confident4 Ų414 Ų142%0.0219%0.094CC..Hα-helixtrans-63.2-47174.4-68.8157.5000111.1F332 P333 M407 H408 Y409 N415 I452F332-I411 HydrophobicContact CD1-CB 4.44Å; F332-I411 HydrophobicContact CD1-CD1 4.36Å; F332-I411 HydrophobicContact CD1-CG2 4.08Å; F332-I411 HydrophobicContact CE1-CB 4.45Å; F332-I411 HydrophobicContact CE1-CG2 4.16Å; P333-I411 HydrophobicContact CB-CG2 4.45Å; P333-I411 HydrophobicContact CG-CD1 3.82Å; P333-I411 HydrophobicContact CG-CG1 4.49Å; P333-I411 HydrophobicContact CG-CG2 4.47Å; M407-I411 WeakPolarHBondContact O-CB 3.29Å; M407-I411 VanDerWaalsContact O-CD1 3.3Å; M407-I411 WeakPolarHBondContact O-CD1 3.33Å; M407-I411 WeakPolarHBondContact O-CG1 3.39Å; M407-I411 PolarHBondContact O-N 3.43Å; H408-I411 PolarHBondContact O-N 2.91Å; Y409-I411 VanDerWaalsContact C-N 3.28Å; Y409-I411 PolarHBondContact O-N 3.25Å; I411-N415 VanDerWaalsContact CG2-ND2 3.34Å; I411-N415 WeakPolarHBondContact CG2-ND2 3.29Å; I411-N415 WeakPolarHBondContact O-CB 3.38Å; I411-N415 PolarHBondContact O-N 3.29Å; I411-N415 PolarHBondContact O-ND2 3.19Å; I411-I452 HydrophobicContact CB-CG2 4.25Å; I411-I452 HydrophobicContact CG1-CB 4.41Å; I411-I452 HydrophobicContact CG1-CG2 3.78Å
412L88.2Confident79.9Confident4 Ų418 Ų182%0.02111%0.11CC..Hα-helixtrans-63.2-45.9178.6-74.5173.6000112F332 F363 H408 Y409 N415 L416 F477 L481F332-L412 HydrophobicContact CE1-CD1 4.4Å; F332-L412 HydrophobicContact CE1-CD2 4.05Å; F332-L412 HydrophobicContact CE1-CG 3.84Å; F332-L412 HydrophobicContact CZ-CD1 4.04Å; F332-L412 HydrophobicContact CZ-CD2 3.67Å; F332-L412 HydrophobicContact CZ-CG 3.77Å; F363-L412 HydrophobicContact CB-CD2 4.39Å; H408-L412 PolarHBondContact O-N 2.79Å; Y409-L412 PolarHBondContact O-N 3.08Å; L412-N415 PolarHBondContact O-N 3.35Å; L412-L416 WeakPolarHBondContact O-CB 3.4Å; L412-L416 PolarHBondContact O-N 2.93Å; L412-F477 HydrophobicContact CB-CZ 4.49Å; L412-F477 HydrophobicContact CD2-CE2 4.23Å; L412-F477 HydrophobicContact CD2-CZ 4.17Å; L412-L481 HydrophobicContact CB-CD2 3.75Å; L412-L481 HydrophobicContact CD1-CD2 3.9Å; L412-L481 HydrophobicContact CG-CD2 4.49Å
413I88.6Confident79.5Confident1 Ų125.7 Ų25.71%0.00514%0.14CC..Hα-helixtrans-63.6-46179.7-65.1167.4000110.2Y409 N415 L416 N417 L481 A488 V525 M526 F529Y409-I413 VanDerWaalsContact O-CG1 3.25Å; Y409-I413 WeakPolarHBondContact O-CG1 3.44Å; Y409-I413 PolarHBondContact O-N 3.43Å; I413-N415 VanDerWaalsContact C-N 3.35Å; I413-N415 PolarHBondContact O-N 3.29Å; I413-L416 PolarHBondContact O-N 3.38Å; I413-N417 WeakPolarHBondContact O-CB 3.1Å; I413-N417 PolarHBondContact O-N 2.88Å; I413-N417 PolarHBondContact O-ND2 2.94Å; I413-L481 HydrophobicContact CG1-CB 4.49Å; I413-L481 HydrophobicContact CG1-CD1 4.14Å; I413-L481 HydrophobicContact CG1-CD2 4.37Å; I413-A488 HydrophobicContact CD1-CB 4.34Å; I413-V525 HydrophobicContact CB-CG1 3.84Å; I413-V525 HydrophobicContact CG2-CG1 3.43Å; I413-V525 VanDerWaalsContact CG2-CG1 3.43Å; I413-M526 HydrophobicContact CD1-SD 3.86Å; I413-F529 HydrophobicContact CG2-CB 3.57Å; I413-F529 HydrophobicContact CG2-CD2 3.67Å; I413-F529 HydrophobicContact CG2-CG 3.7Å
414E87.5Confident78.3Confident2 Ų227.9 Ų27.91%0.00915%0.148CC..Hα-helixtrans-69.2-35-179.7-175.854.1-164.300112.6L410 L416 N417 C418 I448 I452 W524 V525L410-E414 VanDerWaalsContact O-CB 3.26Å; L410-E414 WeakPolarHBondContact O-CB 3.24Å; L410-E414 PolarHBondContact O-N 3.02Å; E414-L416 VanDerWaalsContact C-N 3.34Å; E414-N417 PolarHBondContact O-N 3.28Å; E414-N417 PolarHBondContact OE2-ND2 2.98Å; E414-C418 WeakPolarHBondContact O-CB 3.33Å; E414-C418 PolarHBondContact O-N 3.45Å; E414-C418 PolarHBondContact O-SG 2.76Å; E414-C418 PolarHBondContact OE1-SG 2.91Å; E414-I448 HydrophobicContact CG-CG2 4.16Å; E414-I452 HydrophobicContact CB-CG2 3.8Å; E414-I452 HydrophobicContact CG-CG2 4.14Å; E414-W524 VanDerWaalsContact CD-CZ3 3.42Å; E414-W524 WeakPolarHBondContact OE1-CH2 3.29Å; E414-W524 WeakPolarHBondContact OE1-CZ3 3.34Å; E414-W524 WeakPolarHBondContact OE2-CZ3 3.18Å; E414-V525 HydrophobicContact CB-CG1 4.15Å; E414-V525 HydrophobicContact CB-CG2 4.17Å; E414-V525 HydrophobicContact CG-CG2 4.44Å
415N88.2Confident76.8Confident4 Ų431.3 Ų31.32%0.02117%0.17CC..Hα-helixtrans-61.2-44.2171.8-77.5-30.4000111.4S336 I340 I411 L412 I413 C418 W419 A453 I458S336-N415 PolarHBondContact OG-ND2 3.11Å; I340-N415 HydrophobicContact CD1-CB 3.67Å; I411-N415 VanDerWaalsContact CG2-ND2 3.34Å; I411-N415 WeakPolarHBondContact CG2-ND2 3.29Å; I411-N415 WeakPolarHBondContact O-CB 3.38Å; I411-N415 PolarHBondContact O-N 3.29Å; I411-N415 PolarHBondContact O-ND2 3.19Å; L412-N415 PolarHBondContact O-N 3.35Å; I413-N415 VanDerWaalsContact C-N 3.35Å; I413-N415 PolarHBondContact O-N 3.29Å; N415-C418 PolarHBondContact O-N 2.67Å; N415-W419 WeakPolarHBondContact O-CB 3.28Å; N415-W419 PolarHBondContact O-N 3.02Å; N415-A453 WeakPolarHBondContact OD1-CB 3.49Å; N415-I458 VanDerWaalsContact OD1-CD1 3.28Å; N415-I458 WeakPolarHBondContact OD1-CD1 3.27Å
416L88.8Confident75.2Confident2 Ų236.4 Ų36.41%0.0120%0.195CC..Hα-helixtrans-63.2-44174.9178.1138.3000111.6L412 I413 E414 C418 W419 L420 F477 I478 F529 V532L412-L416 WeakPolarHBondContact O-CB 3.4Å; L412-L416 PolarHBondContact O-N 2.93Å; I413-L416 PolarHBondContact O-N 3.38Å; E414-L416 VanDerWaalsContact C-N 3.34Å; L416-C418 PolarHBondContact O-N 3.46Å; L416-W419 PolarHBondContact O-N 3.06Å; L416-L420 HydrophobicContact CD1-CD1 4.45Å; L416-L420 HydrophobicContact CD2-CD1 4.47Å; L416-L420 HydrophobicContact CG-CD1 4.16Å; L416-L420 PolarHBondContact O-N 3.41Å; L416-F477 HydrophobicContact CB-CE1 4.17Å; L416-F477 HydrophobicContact CD1-CD1 3.59Å; L416-F477 HydrophobicContact CD1-CE1 3.46Å; L416-F477 VanDerWaalsContact CD1-CE1 3.46Å; L416-F477 HydrophobicContact CG-CE1 4.41Å; L416-I478 HydrophobicContact CD1-CD1 4.05Å; L416-I478 HydrophobicContact CD1-CG1 3.58Å; L416-F529 HydrophobicContact CD2-CD2 3.95Å; L416-F529 HydrophobicContact CD2-CE2 4.04Å; L416-V532 HydrophobicContact CD2-CG1 3.81Å
417N88.2Confident73Confident4 Ų445.4 Ų45.42%0.02123%0.234CC..Hα-helixtrans-58.5-46.5177-71-23.3000111.7I413 E414 W419 G421 V525 K528 F529I413-N417 WeakPolarHBondContact O-CB 3.1Å; I413-N417 PolarHBondContact O-N 2.88Å; I413-N417 PolarHBondContact O-ND2 2.94Å; E414-N417 PolarHBondContact O-N 3.28Å; E414-N417 PolarHBondContact OE2-ND2 2.98Å; N417-W419 VanDerWaalsContact C-N 3.35Å; N417-G421 WeakPolarHBondContact O-CA 3.49Å; N417-G421 PolarHBondContact O-N 2.95Å; N417-V525 PolarHBondContact ND2-O 3.23Å; N417-K528 HydrophobicContact CB-CB 4.25Å; N417-K528 HydrophobicContact CB-CD 4.45Å; N417-K528 WeakPolarHBondContact ND2-CB 3.3Å; N417-F529 WeakPolarHBondContact OD1-CA 3.46Å; N417-F529 PolarHBondContact OD1-N 3.31Å
418C85.3Confident70.6Confident23 Ų2350.5 Ų50.516%0.15526%0.263CS..Hα-helixtrans-69-35.5177.7-74.20000112.1E414 N415 L416 I458E414-C418 WeakPolarHBondContact O-CB 3.33Å; E414-C418 PolarHBondContact O-N 3.45Å; E414-C418 PolarHBondContact O-SG 2.76Å; E414-C418 PolarHBondContact OE1-SG 2.91Å; N415-C418 PolarHBondContact O-N 2.67Å; L416-C418 PolarHBondContact O-N 3.46Å; C418-I458 HydrophobicContact CB-CB 4.05Å; C418-I458 HydrophobicContact CB-CD1 3.53Å; C418-I458 HydrophobicContact CB-CG1 4.4Å; C418-I458 HydrophobicContact CB-CG2 3.9Å
419W87.4Confident68.2Low2 Ų253.8 Ų53.81%0.00829%0.286CS..Hα-helixtrans-68.6-43.3-179.3-17625.7000112I340 H343 T344 L357 N415 L416 N417 I458 P459 S460 L461 L474I340-W419 HydrophobicContact CG2-CD2 4.12Å; I340-W419 HydrophobicContact CG2-CG 4.02Å; H343-W419 AromaticContact CD2-CH2 3.4Å; H343-W419 VanDerWaalsContact CD2-CH2 3.4Å; H343-W419 WeakPolarHBondContact CD2-CH2 3.3Å; H343-W419 AromaticContact CD2-CZ2 3.25Å; H343-W419 WeakPolarHBondContact CD2-CZ2 3.39Å; H343-W419 AromaticContact NE2-CH2 3.6Å; H343-W419 AromaticContact NE2-CZ2 3.57Å; T344-W419 HydrophobicContact CG2-CZ2 4.32Å; T344-W419 VanDerWaalsContact CG2-NE1 3.29Å; L357-W419 HydrophobicContact CD1-CH2 3.73Å; L357-W419 HydrophobicContact CD1-CZ3 4.05Å; N415-W419 WeakPolarHBondContact O-CB 3.28Å; N415-W419 PolarHBondContact O-N 3.02Å; L416-W419 PolarHBondContact O-N 3.06Å; N417-W419 VanDerWaalsContact C-N 3.35Å; W419-I458 HydrophobicContact CB-CG2 4.03Å; W419-P459 WeakPolarHBondContact CA-O 3.31Å; W419-P459 VanDerWaalsContact CD1-O 3.23Å; W419-S460 CarbonylContact O-C 3.51Å; W419-L461 HydrophobicContact CZ2-CD2 4.41Å; W419-L461 PolarHBondContact O-N 3.25Å; W419-L474 HydrophobicContact CH2-CD2 4.02Å; W419-L474 HydrophobicContact CZ3-CD2 3.7Å
420L85.2Confident65.9Low4 Ų459.2 Ų59.22%0.02131%0.314CS..Hα-helixtrans-101.1-6.1-176.4-59.4179.4000114.3L416 K422 L463 L466 V532L416-L420 HydrophobicContact CD1-CD1 4.45Å; L416-L420 HydrophobicContact CD2-CD1 4.47Å; L416-L420 HydrophobicContact CG-CD1 4.16Å; L416-L420 PolarHBondContact O-N 3.41Å; L420-K422 PolarHBondContact O-N 3Å; L420-L463 HydrophobicContact CB-CD2 4.1Å; L420-L463 HydrophobicContact CD1-CD2 4.3Å; L420-L463 HydrophobicContact CD2-CD2 4.32Å; L420-L463 HydrophobicContact CG-CD2 4.48Å; L420-L466 HydrophobicContact CD2-CD2 4.28Å; L420-V532 HydrophobicContact CB-CG1 3.88Å; L420-V532 HydrophobicContact CD1-CG1 4.01Å
421G66.9Low63.6Low40 Ų4069.1 Ų69.141%0.41236%0.357SS..  trans-87.326.9-163.300000117.9N417 E423N417-G421 WeakPolarHBondContact O-CA 3.49Å; N417-G421 PolarHBondContact O-N 2.95Å; G421-E423 PolarHBondContact O-N 2.91Å; G421-E423 VanDerWaalsContact O-N 3.14Å
422K59.7Low61.5Low124 Ų12473.3 Ų73.354%0.53938%0.379SS..  trans-75.8104.3168.5-104.9-179.5178.2160.70109.1L420 I424 S460 T462L420-K422 PolarHBondContact O-N 3Å; K422-I424 PolarHBondContact O-N 3.23Å; K422-I424 VanDerWaalsContact O-N 3.13Å; K422-S460 WeakPolarHBondContact CD-OG 3.41Å; K422-S460 VanDerWaalsContact CE-OG 3.3Å; K422-S460 WeakPolarHBondContact CE-OG 3.4Å; K422-S460 PolarHBondContact NZ-OG 3.23Å; K422-T462 HydrophobicContact CB-CG2 4.12Å; K422-T462 HydrophobicContact CD-CG2 4.43Å
423E49Very low59.6Low184 Ų18475.3 Ų75.386%0.8639%0.394SS*.  trans-37.9113.7178.3-66.8178.2170.500112.1G421 P425G421-E423 PolarHBondContact O-N 2.91Å; G421-E423 VanDerWaalsContact O-N 3.14Å; E423-P425 WeakPolarHBondContact O-CD 3.48Å
424I43.6Very low57.7Low75 Ų7576 Ų7639%0.38540%0.396SS..  trans-64.5121.3154.3-59.7167.1000104.4K422 M426 L463K422-I424 PolarHBondContact O-N 3.23Å; K422-I424 VanDerWaalsContact O-N 3.13Å; I424-M426 HydrophobicContact CG2-CG 4.47Å; I424-M426 PolarHBondContact O-N 3.37Å; I424-L463 HydrophobicContact CD1-CD1 4.26Å
425P37.2Very low55.8Low116 Ų11682.7 Ų82.775%0.75343%0.428SS*.  trans-73.781179.831.3-32.1000107.8E423 K427E423-P425 WeakPolarHBondContact O-CD 3.48Å; P425-K427 PolarHBondContact O-N 3Å
426M38.4Very low53.9Low112 Ų11287.1 Ų87.155%0.55246%0.459SS*.  trans-67.992.7164.3-78.9-116.5168.700106.6I424 D428 Q638I424-M426 HydrophobicContact CG2-CG 4.47Å; I424-M426 PolarHBondContact O-N 3.37Å; M426-D428 PolarHBondContact O-N 3.1Å; M426-Q638 PolarHBondContact SD-NE2 3.47Å
427K33Very low52Low190 Ų19092.2 Ų92.283%0.82649%0.486SS*.  trans-51.4125.3165-85.6175.9172.7173.80107.6P425P425-K427 PolarHBondContact O-N 3Å
428D30.5Very low50.3Low156 Ų15693 Ų9383%0.83449%0.491SS*.SBendtrans7073.6167.3-52.6-35.4000116.5M426M426-D428 PolarHBondContact O-N 3.1Å
429S31.8Very low48.8Very low74 Ų74100.3 Ų100.352%0.51753%0.528SS..SBendtrans-159.9104.7140.336.10000111.2
430I36.4Very low47.2Very low123 Ų123104.2 Ų104.263%0.63155%0.547SS*.  trans52.290.2158.5-45-178.7000115.9L432I430-L432 HydrophobicContact CG2-CB 3.72Å; I430-L432 HydrophobicContact CG2-CD1 3.53Å; I430-L432 HydrophobicContact CG2-CG 3.75Å; I430-L432 PolarHBondContact O-N 3.35Å
431K37.3Very low45.7Very low208 Ų208105.6 Ų105.690%0.90455%0.553SS**  trans-59.576150.3-81-179.5171.2-179.60110.2
432L41.3Very low45.4Very low91 Ų91108.5 Ų108.548%0.47657%0.565SS.*  trans-114.549.7158.1-90.4162.9000107.3I430I430-L432 HydrophobicContact CG2-CB 3.72Å; I430-L432 HydrophobicContact CG2-CD1 3.53Å; I430-L432 HydrophobicContact CG2-CG 3.75Å; I430-L432 PolarHBondContact O-N 3.35Å
433S47.5Very low45.4Very low46 Ų46104.9 Ų104.932%0.32256%0.559SS.*  trans-66.4138.8166.749.80000108.2E435 S436S433-E435 VanDerWaalsContact CB-OE2 3.31Å; S433-E435 WeakPolarHBondContact CB-OE2 3.34Å; S433-E435 PolarHBondContact O-N 3.44Å; S433-E435 PolarHBondContact OG-OE2 2.89Å; S433-S436 PolarHBondContact O-N 2.81Å
434F48.8Very low45.9Very low15 Ų1596.3 Ų96.37%0.06652%0.519CS..G310 helixtrans-44.9-13.7168.2-80.3-87.4000114.6S436 L437 T438 M441 L523 D527 L624 L627 L628F434-S436 VanDerWaalsContact C-N 3.27Å; F434-S436 PolarHBondContact O-N 3.08Å; F434-L437 PolarHBondContact O-N 2.58Å; F434-T438 PolarHBondContact O-OG1 2.97Å; F434-M441 HydrophobicContact CB-CE 4.18Å; F434-L523 HydrophobicContact CD1-CD2 4.1Å; F434-L523 HydrophobicContact CE1-CD2 3.32Å; F434-L523 HydrophobicContact CE2-CD2 3.98Å; F434-L523 HydrophobicContact CZ-CD2 3.27Å; F434-D527 HydrophobicContact CE2-CB 4.22Å; F434-L624 HydrophobicContact CD1-CD2 3.76Å; F434-L624 HydrophobicContact CE1-CB 3.87Å; F434-L624 HydrophobicContact CE1-CD2 3.6Å; F434-L624 HydrophobicContact CE1-CG 4.23Å; F434-L627 HydrophobicContact CZ-CB 4.35Å; F434-L628 HydrophobicContact CZ-CB 4.19Å
435E47.4Very low46.7Very low144 Ų14495.2 Ų95.267%0.67352%0.517SS*.G310 helixtrans-56.1-28.4174.6-65175141.300114.6S433S433-E435 VanDerWaalsContact CB-OE2 3.31Å; S433-E435 WeakPolarHBondContact CB-OE2 3.34Å; S433-E435 PolarHBondContact O-N 3.44Å; S433-E435 PolarHBondContact OG-OE2 2.89Å
436S48.9Very low47.9Very low97 Ų9792.4 Ų92.468%0.67850%0.5SS*.G310 helixtrans-81.5-18.6-178.772.40000114.6S433 F434S433-S436 PolarHBondContact O-N 2.81Å; F434-S436 VanDerWaalsContact C-N 3.27Å; F434-S436 PolarHBondContact O-N 3.08Å
437L47.5Very low49Very low108 Ų10889.2 Ų89.257%0.56548%0.484SS*.THydrogen-bonded Turntrans-107.6-3-170.1-110.4142.3000114.2F434 L627F434-L437 PolarHBondContact O-N 2.58Å; L437-L627 HydrophobicContact CD1-CD1 3.66Å
438T53.1Low50.4Low21 Ų2180.4 Ų80.413%0.12945%0.445CS..  trans-133.191.2-173.2-7.30000110.7F434 Q440 M441 I444F434-T438 PolarHBondContact O-OG1 2.97Å; T438-Q440 HydrophobicContact CG2-CB 4.2Å; T438-Q440 PolarHBondContact O-N 3.26Å; T438-M441 HydrophobicContact CG2-CE 4.48Å; T438-M441 WeakPolarHBondContact O-CG 3.24Å; T438-M441 PolarHBondContact O-N 2.5Å; T438-M441 VanDerWaalsContact OG1-CE 3.23Å; T438-M441 WeakPolarHBondContact OG1-CE 3.09Å; T438-I444 HydrophobicContact CG2-CD1 4.04Å
439D53.1Low52Low176 Ų17674.7 Ų74.794%0.94142%0.418SS*.THydrogen-bonded Turntrans-54.3-9.9164.1-75.4-34000112.7
440Q54.6Low53.5Low84 Ų8477.7 Ų77.739%0.39343%0.428SS..THydrogen-bonded Turntrans-935.9178.6-57-178.7-14.100114.3T438 A443 I444T438-Q440 HydrophobicContact CG2-CB 4.2Å; T438-Q440 PolarHBondContact O-N 3.26Å; Q440-A443 WeakPolarHBondContact O-CA 3.43Å; Q440-A443 WeakPolarHBondContact O-CB 3.16Å; Q440-A443 PolarHBondContact O-N 3.44Å; Q440-I444 PolarHBondContact O-N 3.41Å
441M53.9Low54.7Low33 Ų3377.7 Ų77.716%0.16342%0.42CS..Hα-helixtrans-52.1-43.9-178-88.6-60.7143.800115.2F434 T438 A443 I444 C445F434-M441 HydrophobicContact CB-CE 4.18Å; T438-M441 HydrophobicContact CG2-CE 4.48Å; T438-M441 WeakPolarHBondContact O-CG 3.24Å; T438-M441 PolarHBondContact O-N 2.5Å; T438-M441 VanDerWaalsContact OG1-CE 3.23Å; T438-M441 WeakPolarHBondContact OG1-CE 3.09Å; M441-A443 VanDerWaalsContact C-N 3.25Å; M441-A443 PolarHBondContact O-N 3.31Å; M441-I444 HydrophobicContact CE-CD1 4.2Å; M441-I444 PolarHBondContact O-N 3.45Å; M441-C445 WeakPolarHBondContact O-CB 3.38Å; M441-C445 PolarHBondContact O-N 3.48Å; M441-C445 PolarHBondContact O-SG 2.96Å
442P60.6Low56.1Low101 Ų10168.1 Ų68.166%0.65638%0.379SS*.Hα-helixtrans-62.3-34176.2-21.732.6000112.8S446P442-S446 VanDerWaalsContact O-CB 3.27Å; P442-S446 WeakPolarHBondContact O-CB 3.36Å; P442-S446 PolarHBondContact O-N 3.28Å; P442-S446 PolarHBondContact O-OG 3.27Å
443A59.4Low57.1Low49 Ų4964.3 Ų64.341%0.40536%0.36SS..Hα-helixtrans-70.8-44.417900000111Q440 M441 S446 E447Q440-A443 WeakPolarHBondContact O-CA 3.43Å; Q440-A443 WeakPolarHBondContact O-CB 3.16Å; Q440-A443 PolarHBondContact O-N 3.44Å; M441-A443 VanDerWaalsContact C-N 3.25Å; M441-A443 PolarHBondContact O-N 3.31Å; A443-S446 PolarHBondContact O-N 3.12Å; A443-S446 PolarHBondContact O-OG 2.84Å; A443-E447 WeakPolarHBondContact O-CB 3.33Å; A443-E447 PolarHBondContact O-N 3.32Å
444I59.9Low57.9Low4 Ų465.2 Ų65.22%0.02136%0.362CS..Hα-helixtrans-62.4-48.7175.6-62.2167.8000110.2T438 Q440 M441 S446 E447 I448 L520 I521T438-I444 HydrophobicContact CG2-CD1 4.04Å; Q440-I444 PolarHBondContact O-N 3.41Å; M441-I444 HydrophobicContact CE-CD1 4.2Å; M441-I444 PolarHBondContact O-N 3.45Å; I444-S446 VanDerWaalsContact C-N 3.3Å; I444-S446 PolarHBondContact O-N 2.84Å; I444-E447 PolarHBondContact O-N 3.26Å; I444-I448 HydrophobicContact CG2-CD1 3.8Å; I444-I448 HydrophobicContact CG2-CG1 4.32Å; I444-I448 VanDerWaalsContact O-CG1 3.28Å; I444-I448 WeakPolarHBondContact O-CG1 3.08Å; I444-I448 PolarHBondContact O-N 3.25Å; I444-L520 HydrophobicContact CD1-CD1 4.06Å; I444-I521 HydrophobicContact CG2-CG1 4.31Å
445C59.9Low58.5Low51 Ų5167.3 Ų67.335%0.34538%0.378SS..Hα-helixtrans-58.8-41.5176.1-69.90000112M441 E447 I448 S449M441-C445 WeakPolarHBondContact O-CB 3.38Å; M441-C445 PolarHBondContact O-N 3.48Å; M441-C445 PolarHBondContact O-SG 2.96Å; C445-E447 VanDerWaalsContact C-N 3.31Å; C445-E447 PolarHBondContact O-N 2.97Å; C445-I448 PolarHBondContact O-N 3.46Å; C445-S449 WeakPolarHBondContact O-CB 3.34Å; C445-S449 PolarHBondContact O-N 3.33Å; C445-S449 PolarHBondContact O-OG 3.5Å; C445-S449 VanDerWaalsContact O-OG 3.04Å
446S62.7Low59.4Low57 Ų5771.1 Ų71.140%0.39939%0.386SS..Hα-helixtrans-65.6-35.5175.879.10000112.3P442 A443 I444 S449 N450P442-S446 VanDerWaalsContact O-CB 3.27Å; P442-S446 WeakPolarHBondContact O-CB 3.36Å; P442-S446 PolarHBondContact O-N 3.28Å; P442-S446 PolarHBondContact O-OG 3.27Å; A443-S446 PolarHBondContact O-N 3.12Å; A443-S446 PolarHBondContact O-OG 2.84Å; I444-S446 VanDerWaalsContact C-N 3.3Å; I444-S446 PolarHBondContact O-N 2.84Å; S446-S449 PolarHBondContact O-N 3.4Å; S446-N450 VanDerWaalsContact O-CB 3.28Å; S446-N450 WeakPolarHBondContact O-CB 3.34Å; S446-N450 PolarHBondContact O-N 3.04Å; S446-N450 PolarHBondContact O-ND2 2.99Å; S446-N450 VanDerWaalsContact O-ND2 3.09Å
447E61.5Low60.6Low46 Ų4670.6 Ų70.622%0.21538%0.376CS..Hα-helixtrans-76.5-34.9-179.6-165.8163.3-162.200111.5A443 I444 C445 N450 R451 I521A443-E447 WeakPolarHBondContact O-CB 3.33Å; A443-E447 PolarHBondContact O-N 3.32Å; I444-E447 PolarHBondContact O-N 3.26Å; C445-E447 VanDerWaalsContact C-N 3.31Å; C445-E447 PolarHBondContact O-N 2.97Å; E447-N450 PolarHBondContact O-N 2.87Å; E447-R451 HydrophobicContact CG-CG 4.12Å; E447-R451 WeakPolarHBondContact O-CB 3.42Å; E447-R451 WeakPolarHBondContact O-CG 3.12Å; E447-R451 PolarHBondContact O-N 3.28Å; E447-R451 IonicContact OE1-CZ 3.76Å; E447-R451 IonicContact OE1-NE 2.76Å; E447-R451 PolarHBondContact OE1-NE 3.42Å; E447-R451 IonicContact OE1-NH2 2.65Å; E447-R451 PolarHBondContact OE1-NH2 3.21Å; E447-I521 HydrophobicContact CG-CD1 4.16Å
448I62.3Low62Low4 Ų466.2 Ų66.22%0.02135%0.352CS..Hα-helixtrans-63.4-45.9169.2-66.6173.7000110.3E414 I444 C445 N450 R451 I452 A453 I521 W524E414-I448 HydrophobicContact CG-CG2 4.16Å; I444-I448 HydrophobicContact CG2-CD1 3.8Å; I444-I448 HydrophobicContact CG2-CG1 4.32Å; I444-I448 VanDerWaalsContact O-CG1 3.28Å; I444-I448 WeakPolarHBondContact O-CG1 3.08Å; I444-I448 PolarHBondContact O-N 3.25Å; C445-I448 PolarHBondContact O-N 3.46Å; I448-N450 VanDerWaalsContact C-N 3.27Å; I448-N450 PolarHBondContact O-N 3.07Å; I448-R451 PolarHBondContact O-N 2.91Å; I448-I452 HydrophobicContact CG2-CB 4.29Å; I448-I452 WeakPolarHBondContact O-CA 3.23Å; I448-I452 WeakPolarHBondContact O-CB 3.48Å; I448-I452 PolarHBondContact O-N 2.91Å; I448-A453 PolarHBondContact O-N 3.44Å; I448-A453 VanDerWaalsContact O-N 3.08Å; I448-I521 HydrophobicContact CD1-CG1 4.34Å; I448-I521 HydrophobicContact CD1-CG2 4.23Å; I448-I521 HydrophobicContact CG1-CB 4.4Å; I448-I521 HydrophobicContact CG1-CD1 4.28Å; I448-I521 HydrophobicContact CG1-CG1 3.85Å; I448-I521 HydrophobicContact CG1-CG2 3.84Å; I448-W524 HydrophobicContact CD1-CD2 3.96Å; I448-W524 HydrophobicContact CD1-CE3 3.34Å; I448-W524 HydrophobicContact CD1-CH2 4.04Å; I448-W524 HydrophobicContact CD1-CZ3 3.39Å; I448-W524 HydrophobicContact CG2-CZ3 4.21Å
449S63.3Low63.4Low37 Ų3767 Ų6726%0.25936%0.358SS..Hα-helixtrans-61.6-35.1174.6-61.30000112.9C445 S446 A453C445-S449 WeakPolarHBondContact O-CB 3.34Å; C445-S449 PolarHBondContact O-N 3.33Å; C445-S449 PolarHBondContact O-OG 3.5Å; C445-S449 VanDerWaalsContact O-OG 3.04Å; S446-S449 PolarHBondContact O-N 3.4Å; S449-A453 WeakPolarHBondContact CA-O 3.5Å
450N64.8Low64.8Low137 Ų13761.3 Ų61.373%0.73333%0.332SS*.Hα-helixtrans-82.1-29.1179.8-70.9-23.9000113.8S446 E447 I448S446-N450 VanDerWaalsContact O-CB 3.28Å; S446-N450 WeakPolarHBondContact O-CB 3.34Å; S446-N450 PolarHBondContact O-N 3.04Å; S446-N450 PolarHBondContact O-ND2 2.99Å; S446-N450 VanDerWaalsContact O-ND2 3.09Å; E447-N450 PolarHBondContact O-N 2.87Å; I448-N450 VanDerWaalsContact C-N 3.27Å; I448-N450 PolarHBondContact O-N 3.07Å
451R61.6Low66.2Low123 Ų12358.1 Ų58.146%0.46432%0.317SS..Hα-helixtrans-109.6-24.9-172.1-66.3-168.8-174.4-104.66.4115.3M407 E447 I448M407-R451 HydrophobicContact CE-CB 4.47Å; E447-R451 HydrophobicContact CG-CG 4.12Å; E447-R451 WeakPolarHBondContact O-CB 3.42Å; E447-R451 WeakPolarHBondContact O-CG 3.12Å; E447-R451 PolarHBondContact O-N 3.28Å; E447-R451 IonicContact OE1-CZ 3.76Å; E447-R451 IonicContact OE1-NE 2.76Å; E447-R451 PolarHBondContact OE1-NE 3.42Å; E447-R451 IonicContact OE1-NH2 2.65Å; E447-R451 PolarHBondContact OE1-NH2 3.21Å; I448-R451 PolarHBondContact O-N 2.91Å
452I66.6Low67.6Low6 Ų658.9 Ų58.93%0.03132%0.324CS..THydrogen-bonded Turntrans-121.5-64.7-170-60.4-173.8000110.7L410 I411 E414 I448 I521L410-I452 HydrophobicContact CB-CD1 4.22Å; I411-I452 HydrophobicContact CB-CG2 4.25Å; I411-I452 HydrophobicContact CG1-CB 4.41Å; I411-I452 HydrophobicContact CG1-CG2 3.78Å; E414-I452 HydrophobicContact CB-CG2 3.8Å; E414-I452 HydrophobicContact CG-CG2 4.14Å; I448-I452 HydrophobicContact CG2-CB 4.29Å; I448-I452 WeakPolarHBondContact O-CA 3.23Å; I448-I452 WeakPolarHBondContact O-CB 3.48Å; I448-I452 PolarHBondContact O-N 2.91Å; I452-I521 HydrophobicContact CD1-CG2 3.26Å
453A61.1Low68.7Low11 Ų1154.4 Ų54.49%0.09130%0.295CS..  trans-162133-179.500000111.8N415 I448 S449 S455 I458N415-A453 WeakPolarHBondContact OD1-CB 3.49Å; I448-A453 PolarHBondContact O-N 3.44Å; I448-A453 VanDerWaalsContact O-N 3.08Å; S449-A453 WeakPolarHBondContact CA-O 3.5Å; A453-S455 PolarHBondContact O-N 3.36Å; A453-I458 HydrophobicContact CB-CD1 4.02Å
454D64.6Low69.7Low65 Ų6557.7 Ų57.735%0.34830%0.302SS..  trans-73.598170.6-169.6-2.7000108.9R456 L457D454-R456 PolarHBondContact O-N 2.99Å; D454-L457 HydrophobicContact CB-CD1 3.96Å; D454-L457 HydrophobicContact CB-CG 4.18Å; D454-L457 PolarHBondContact O-N 3.39Å
455S61.4Low71Confident59 Ų5962.1 Ų62.141%0.41333%0.325SS..THydrogen-bonded Turntrans-54.4-20.8-175.159.30000113.9A453 L457A453-S455 PolarHBondContact O-N 3.36Å; S455-L457 VanDerWaalsContact C-N 3.3Å; S455-L457 PolarHBondContact O-N 3.34Å
456R66.1Low72.3Confident224 Ų22460.6 Ų60.685%0.84531%0.314SS*.THydrogen-bonded Turntrans-72.1-22.9177.3-59.4178.9-172.6-178.54.4113.6D454D454-R456 PolarHBondContact O-N 2.99Å
457L73.8Confident73.5Confident87 Ų8760.6 Ų60.646%0.45531%0.309SS..SBendtrans-91.6-13.9-175.8-62.1177.5000112.9L337 K341 D454 S455L337-L457 HydrophobicContact CD2-CB 3.95Å; L337-L457 HydrophobicContact CD2-CD1 4.34Å; K341-L457 WeakPolarHBondContact CE-O 3.09Å; D454-L457 HydrophobicContact CB-CD1 3.96Å; D454-L457 HydrophobicContact CB-CG 4.18Å; D454-L457 PolarHBondContact O-N 3.39Å; S455-L457 VanDerWaalsContact C-N 3.3Å; S455-L457 PolarHBondContact O-N 3.34Å
458I78.4Confident74.7Confident15 Ų1560.1 Ų60.18%0.07731%0.31CS..SBendtrans-85.5124.4-178.3-60.9166000108.5L337 I340 N415 C418 W419 A453L337-I458 HydrophobicContact CD1-CB 4.42Å; L337-I458 HydrophobicContact CD1-CG1 3.69Å; I340-I458 HydrophobicContact CG2-CG2 4.46Å; N415-I458 VanDerWaalsContact OD1-CD1 3.28Å; N415-I458 WeakPolarHBondContact OD1-CD1 3.27Å; C418-I458 HydrophobicContact CB-CB 4.05Å; C418-I458 HydrophobicContact CB-CD1 3.53Å; C418-I458 HydrophobicContact CB-CG1 4.4Å; C418-I458 HydrophobicContact CB-CG2 3.9Å; W419-I458 HydrophobicContact CB-CG2 4.03Å; A453-I458 HydrophobicContact CB-CD1 4.02Å
459P81.1Confident75.9Confident38 Ų3861.1 Ų61.125%0.24731%0.313CS..PPolyproline II helixtrans-60140.7172.8-17.829.4000110.5K341 T344 W419K341-P459 HydrophobicContact CG-CG 3.97Å; T344-P459 HydrophobicContact CG2-CB 3.99Å; T344-P459 HydrophobicContact CG2-CG 4.19Å; W419-P459 WeakPolarHBondContact CA-O 3.31Å; W419-P459 VanDerWaalsContact CD1-O 3.23Å
460S82.3Confident77.3Confident56 Ų5659.3 Ų59.339%0.39230%0.301SS..PPolyproline II helixtrans-100.5127.2175.267.90000110.6W419 K422W419-S460 CarbonylContact O-C 3.51Å; K422-S460 WeakPolarHBondContact CD-OG 3.41Å; K422-S460 VanDerWaalsContact CE-OG 3.3Å; K422-S460 WeakPolarHBondContact CE-OG 3.4Å; K422-S460 PolarHBondContact NZ-OG 3.23Å
461L85Confident78.6Confident17 Ų1753 Ų539%0.08927%0.267CS..  trans-114.5132.1173.5-178.561.9000109.6W419 N465 L466W419-L461 HydrophobicContact CZ2-CD2 4.41Å; W419-L461 PolarHBondContact O-N 3.25Å; L461-N465 HydrophobicContact CD1-CB 3.86Å; L461-L466 HydrophobicContact CD2-CD2 3.64Å; L461-L466 HydrophobicContact CD2-CG 4.48Å
462T84.1Confident79.9Confident49 Ų4947.8 Ų47.830%0.30125%0.25SC..  trans-79.8138.3172.849.30000109.6K422 E464 N465K422-T462 HydrophobicContact CB-CG2 4.12Å; K422-T462 HydrophobicContact CD-CG2 4.43Å; T462-E464 PolarHBondContact O-N 3.09Å; T462-E464 VanDerWaalsContact O-N 3.14Å; T462-N465 WeakPolarHBondContact O-CB 3.3Å; T462-N465 PolarHBondContact O-N 3.1Å; T462-N465 PolarHBondContact OG1-ND2 2.82Å
463L83.6Confident81Confident8 Ų848.6 Ų48.64%0.04225%0.254CS..G310 helixtrans-56.2-32.5-177.7-67.3172000113.3L420 I424 N465 L466 L536 Q539L420-L463 HydrophobicContact CB-CD2 4.1Å; L420-L463 HydrophobicContact CD1-CD2 4.3Å; L420-L463 HydrophobicContact CD2-CD2 4.32Å; L420-L463 HydrophobicContact CG-CD2 4.48Å; I424-L463 HydrophobicContact CD1-CD1 4.26Å; L463-N465 PolarHBondContact O-N 3.14Å; L463-L466 HydrophobicContact CD2-CD1 3.74Å; L463-L466 WeakPolarHBondContact O-CB 3.38Å; L463-L466 WeakPolarHBondContact O-CG 3.46Å; L463-L466 PolarHBondContact O-N 3.31Å; L463-L536 HydrophobicContact CD2-CB 4.43Å; L463-L536 HydrophobicContact CD2-CD1 4.06Å; L463-Q539 HydrophobicContact CB-CG 4.48Å
464E80.7Confident82.5Confident118 Ų11848.1 Ų48.155%0.55125%0.249SC*.G310 helixtrans-65-19.7176.7-60.2-172.414800114T462 R542T462-E464 PolarHBondContact O-N 3.09Å; T462-E464 VanDerWaalsContact O-N 3.14Å; E464-R542 IonicContact OE1-NH1 3.37Å
465N86.2Confident83.8Confident97 Ų9745 Ų4552%0.51923%0.233SC..G310 helixtrans-95.96-179.9-71.2-20.6000112.5R347 L461 T462 L463R347-N465 PolarHBondContact NH1-O 3.34Å; R347-N465 PolarHBondContact NH2-O 2.95Å; L461-N465 HydrophobicContact CD1-CB 3.86Å; T462-N465 WeakPolarHBondContact O-CB 3.3Å; T462-N465 PolarHBondContact O-N 3.1Å; T462-N465 PolarHBondContact OG1-ND2 2.82Å; L463-N465 PolarHBondContact O-N 3.14Å
466L87.3Confident85.2Confident19 Ų1946.3 Ų46.310%0.09923%0.233CC..  trans-67.2138.1174.4-72.6171.1000110.4L420 L461 L463 E470 L471 L474 L536L420-L466 HydrophobicContact CD2-CD2 4.28Å; L461-L466 HydrophobicContact CD2-CD2 3.64Å; L461-L466 HydrophobicContact CD2-CG 4.48Å; L463-L466 HydrophobicContact CD2-CD1 3.74Å; L463-L466 WeakPolarHBondContact O-CB 3.38Å; L463-L466 WeakPolarHBondContact O-CG 3.46Å; L463-L466 PolarHBondContact O-N 3.31Å; L466-E470 WeakPolarHBondContact CA-OE2 3.48Å; L466-E470 HydrophobicContact CD2-CB 4.47Å; L466-E470 WeakPolarHBondContact CD2-OE2 3.3Å; L466-L471 HydrophobicContact CB-CD2 3.99Å; L466-L471 HydrophobicContact CD1-CD2 4.09Å; L466-L474 HydrophobicContact CD1-CD1 4.25Å; L466-L474 HydrophobicContact CD2-CD1 3.59Å; L466-L536 HydrophobicContact CD1-CD1 3.57Å
467L88.5Confident86.5Confident57 Ų5736 Ų3630%0.29819%0.194SC..  trans-87.4150.6177-62.5168.6000109.7R347 Y469 E470 L471R347-L467 WeakPolarHBondContact O-CD1 3.3Å; L467-Y469 VanDerWaalsContact C-N 3.34Å; L467-Y469 HydrophobicContact CB-CD1 3.88Å; L467-Y469 HydrophobicContact CB-CE1 3.7Å; L467-Y469 HydrophobicContact CD1-CE1 3.6Å; L467-Y469 HydrophobicContact CG-CE1 4.29Å; L467-Y469 PolarHBondContact O-N 3.39Å; L467-E470 HydrophobicContact CB-CG 4.16Å; L467-E470 PolarHBondContact N-OE2 3.4Å; L467-E470 WeakPolarHBondContact O-CB 3.5Å; L467-E470 PolarHBondContact O-N 2.95Å; L467-L471 PolarHBondContact O-N 3.41Å
468P85Confident87.3Confident35 Ų3531.8 Ų31.823%0.22717%0.172CC..Hα-helixtrans-55.6-42.1-175.4-28.636.2000114.6E470 L471 N553 L556P468-E470 PolarHBondContact O-N 3.49Å; P468-L471 WeakPolarHBondContact O-CB 3.33Å; P468-L471 PolarHBondContact O-N 2.89Å; P468-L471 VanDerWaalsContact O-N 3.11Å; P468-N553 HydrophobicContact CB-CB 3.78Å; P468-N553 WeakPolarHBondContact CB-OD1 3.37Å; P468-N553 HydrophobicContact CG-CB 3.92Å; P468-N553 WeakPolarHBondContact CG-OD1 3.37Å; P468-L556 HydrophobicContact CB-CD1 4.42Å
469Y89.2Confident87.8Confident25 Ų2533 Ų3310%0.09818%0.177CC..Hα-helixtrans-64.4-26.1176.881.8-96.1000113.1R347 D350 A354 L467 L471 S472 I473R347-Y469 WeakPolarHBondContact CA-OH 3.28Å; R347-Y469 PolarHBondContact O-OH 3.49Å; D350-Y469 HydrophobicContact CB-CD1 3.89Å; D350-Y469 HydrophobicContact CB-CE1 4.09Å; D350-Y469 HydrophobicContact CB-CG 4.27Å; D350-Y469 VanDerWaalsContact OD1-CD1 3.23Å; D350-Y469 WeakPolarHBondContact OD1-CD1 3.29Å; D350-Y469 WeakPolarHBondContact OD1-CE1 3.38Å; A354-Y469 HydrophobicContact CB-CD2 4.4Å; L467-Y469 VanDerWaalsContact C-N 3.34Å; L467-Y469 HydrophobicContact CB-CD1 3.88Å; L467-Y469 HydrophobicContact CB-CE1 3.7Å; L467-Y469 HydrophobicContact CD1-CE1 3.6Å; L467-Y469 HydrophobicContact CG-CE1 4.29Å; L467-Y469 PolarHBondContact O-N 3.39Å; Y469-L471 VanDerWaalsContact C-N 3.3Å; Y469-S472 PolarHBondContact O-OG 2.79Å; Y469-I473 HydrophobicContact CD2-CD1 4.29Å
470E92.5Very high88.1Confident0 Ų032.4 Ų32.40%017%0.171CC..Hα-helixtrans-73.3-27.3177.8-63.3172.7152.300110.6H343 R347 L357 L466 L467 P468 L474H343-E470 IonicContact CE1-OE1 3.38Å; H343-E470 IonicContact NE2-OE1 3.41Å; H343-E470 PolarHBondContact NE2-OE1 3.47Å; R347-E470 WeakPolarHBondContact CB-OE1 3.47Å; R347-E470 IonicContact CZ-OE1 2.71Å; R347-E470 IonicContact CZ-OE2 3.62Å; R347-E470 IonicContact NE-OE1 3.25Å; R347-E470 PolarHBondContact NE-OE1 3.44Å; R347-E470 IonicContact NE-OE2 3.41Å; R347-E470 VanDerWaalsContact NH2-CD 3.3Å; R347-E470 IonicContact NH2-OE1 3.68Å; R347-E470 PolarHBondContact NH2-OE1 3.08Å; R347-E470 VanDerWaalsContact NH2-OE1 3.11Å; R347-E470 IonicContact NH2-OE2 2.92Å; R347-E470 PolarHBondContact NH2-OE2 3.24Å; L357-E470 HydrophobicContact CD2-CB 4.31Å; L357-E470 HydrophobicContact CD2-CG 4.48Å; L466-E470 WeakPolarHBondContact CA-OE2 3.48Å; L466-E470 HydrophobicContact CD2-CB 4.47Å; L466-E470 WeakPolarHBondContact CD2-OE2 3.3Å; L467-E470 HydrophobicContact CB-CG 4.16Å; L467-E470 PolarHBondContact N-OE2 3.4Å; L467-E470 WeakPolarHBondContact O-CB 3.5Å; L467-E470 PolarHBondContact O-N 2.95Å; P468-E470 PolarHBondContact O-N 3.49Å; E470-L474 HydrophobicContact CB-CD1 4.15Å; E470-L474 WeakPolarHBondContact O-CA 3.45Å; E470-L474 WeakPolarHBondContact O-CB 3.39Å; E470-L474 WeakPolarHBondContact O-CG 3.45Å; E470-L474 PolarHBondContact O-N 3.48Å
471L91Very high88.4Confident4 Ų429.8 Ų29.82%0.02115%0.153CC..Hα-helixtrans-62.9-49.7-177.3-58.6-180000111.4L466 L467 P468 Y469 S475 L536 V543 A557 A560L466-L471 HydrophobicContact CB-CD2 3.99Å; L466-L471 HydrophobicContact CD1-CD2 4.09Å; L467-L471 PolarHBondContact O-N 3.41Å; P468-L471 WeakPolarHBondContact O-CB 3.33Å; P468-L471 PolarHBondContact O-N 2.89Å; P468-L471 VanDerWaalsContact O-N 3.11Å; Y469-L471 VanDerWaalsContact C-N 3.3Å; L471-S475 WeakPolarHBondContact O-CB 3.46Å; L471-S475 PolarHBondContact O-N 3.17Å; L471-L536 HydrophobicContact CD2-CD1 4.37Å; L471-V543 HydrophobicContact CD1-CB 4.33Å; L471-V543 HydrophobicContact CD1-CG1 4.22Å; L471-V543 HydrophobicContact CD1-CG2 4.35Å; L471-A557 HydrophobicContact CD1-CB 4.06Å; L471-A560 HydrophobicContact CB-CB 3.99Å; L471-A560 WeakPolarHBondContact O-CB 3.5Å
472S88.7Confident88.5Confident14 Ų1429.1 Ų29.110%0.09815%0.149CC..Hα-helixtrans-64.5-46.7-179.861.90000111.4Y469 S475 E476Y469-S472 PolarHBondContact O-OG 2.79Å; S472-S475 WeakPolarHBondContact O-CB 3.35Å; S472-S475 PolarHBondContact O-N 2.93Å; S472-S475 PolarHBondContact O-OG 3.25Å; S472-E476 PolarHBondContact O-N 3.46Å; S472-E476 VanDerWaalsContact O-N 3.15Å
473I91.1Very high88.4Confident23 Ų2331.1 Ų31.112%0.11816%0.158CC..Hα-helixtrans-71.9-36.9-178.2-53.6172.4000111.6A354 L357 V361 Y469 S475 E476 F477A354-I473 HydrophobicContact CB-CD1 3.63Å; L357-I473 HydrophobicContact CB-CG2 3.88Å; L357-I473 HydrophobicContact CD2-CB 3.51Å; L357-I473 HydrophobicContact CD2-CD1 4.42Å; L357-I473 HydrophobicContact CD2-CG2 3.53Å; L357-I473 HydrophobicContact CG-CB 4.14Å; L357-I473 HydrophobicContact CG-CG2 3.55Å; V361-I473 HydrophobicContact CG2-CG2 3.67Å; V361-I473 WeakPolarHBondContact CG2-O 3.32Å; Y469-I473 HydrophobicContact CD2-CD1 4.29Å; I473-S475 VanDerWaalsContact C-N 3.29Å; I473-S475 PolarHBondContact O-N 3.08Å; I473-E476 WeakPolarHBondContact O-CB 3.41Å; I473-E476 PolarHBondContact O-N 3.42Å; I473-F477 PolarHBondContact O-N 3.17Å
474L92.5Very high88.1Confident0 Ų032.2 Ų32.20%016%0.163CC..Hα-helixtrans-64.6-35.7171.9-77.4171000111.3L357 W419 L466 E470 E476 F477 I478L357-L474 HydrophobicContact CD1-CD2 3.87Å; L357-L474 HydrophobicContact CD1-CG 4.36Å; L357-L474 HydrophobicContact CD2-CD2 4.46Å; L357-L474 HydrophobicContact CD2-CG 4.07Å; W419-L474 HydrophobicContact CH2-CD2 4.02Å; W419-L474 HydrophobicContact CZ3-CD2 3.7Å; L466-L474 HydrophobicContact CD1-CD1 4.25Å; L466-L474 HydrophobicContact CD2-CD1 3.59Å; E470-L474 HydrophobicContact CB-CD1 4.15Å; E470-L474 WeakPolarHBondContact O-CA 3.45Å; E470-L474 WeakPolarHBondContact O-CB 3.39Å; E470-L474 WeakPolarHBondContact O-CG 3.45Å; E470-L474 PolarHBondContact O-N 3.48Å; L474-E476 VanDerWaalsContact C-N 3.28Å; L474-E476 PolarHBondContact O-N 3.32Å; L474-F477 HydrophobicContact CD2-CD1 4.42Å; L474-F477 PolarHBondContact O-N 2.9Å; L474-I478 WeakPolarHBondContact O-CB 3.3Å; L474-I478 VanDerWaalsContact O-CG1 3.28Å; L474-I478 WeakPolarHBondContact O-CG1 3.16Å; L474-I478 PolarHBondContact O-N 3.17Å
475S92.2Very high88.1Confident0 Ų026.7 Ų26.70%014%0.138CC..Hα-helixtrans-60.8-40.1174.679.90000111.4L471 S472 I473 I478 F479 R563L471-S475 WeakPolarHBondContact O-CB 3.46Å; L471-S475 PolarHBondContact O-N 3.17Å; S472-S475 WeakPolarHBondContact O-CB 3.35Å; S472-S475 PolarHBondContact O-N 2.93Å; S472-S475 PolarHBondContact O-OG 3.25Å; I473-S475 VanDerWaalsContact C-N 3.29Å; I473-S475 PolarHBondContact O-N 3.08Å; S475-I478 PolarHBondContact O-N 3Å; S475-F479 WeakPolarHBondContact O-CB 3.47Å; S475-F479 PolarHBondContact O-N 3.17Å; S475-R563 PolarHBondContact OG-NH1 2.91Å; S475-R563 VanDerWaalsContact OG-NH1 3.11Å
476E90.4Very high87.8Confident87 Ų8724.7 Ų24.741%0.40713%0.131SC..Hα-helixtrans-66-43.8175-165-168.7160.100111.9V361 S472 I473 L474 I478 F479 N480V361-E476 HydrophobicContact CG1-CB 4.21Å; V361-E476 VanDerWaalsContact CG1-CD 3.46Å; V361-E476 HydrophobicContact CG1-CG 3.74Å; V361-E476 WeakPolarHBondContact CG1-OE1 3.33Å; V361-E476 HydrophobicContact CG2-CB 4.48Å; S472-E476 PolarHBondContact O-N 3.46Å; S472-E476 VanDerWaalsContact O-N 3.15Å; I473-E476 WeakPolarHBondContact O-CB 3.41Å; I473-E476 PolarHBondContact O-N 3.42Å; L474-E476 VanDerWaalsContact C-N 3.28Å; L474-E476 PolarHBondContact O-N 3.32Å; E476-I478 VanDerWaalsContact C-N 3.35Å; E476-I478 PolarHBondContact O-N 2.98Å; E476-F479 PolarHBondContact O-N 3.41Å; E476-N480 WeakPolarHBondContact O-CB 3.38Å; E476-N480 PolarHBondContact O-N 3.31Å; E476-N480 PolarHBondContact O-ND2 3.3Å
477F92Very high87.3Confident6 Ų627 Ų273%0.02614%0.139CC..Hα-helixtrans-58.2-48.6176177.8-137.7000111.3L360 V361 L412 L416 I473 L474 N480 L481L360-F477 WeakPolarHBondContact O-CD2 3.41Å; L360-F477 WeakPolarHBondContact O-CE2 3.46Å; V361-F477 HydrophobicContact CG2-CB 3.77Å; L412-F477 HydrophobicContact CB-CZ 4.49Å; L412-F477 HydrophobicContact CD2-CE2 4.23Å; L412-F477 HydrophobicContact CD2-CZ 4.17Å; L416-F477 HydrophobicContact CB-CE1 4.17Å; L416-F477 HydrophobicContact CD1-CD1 3.59Å; L416-F477 HydrophobicContact CD1-CE1 3.46Å; L416-F477 VanDerWaalsContact CD1-CE1 3.46Å; L416-F477 HydrophobicContact CG-CE1 4.41Å; I473-F477 PolarHBondContact O-N 3.17Å; L474-F477 HydrophobicContact CD2-CD1 4.42Å; L474-F477 PolarHBondContact O-N 2.9Å; F477-N480 PolarHBondContact O-N 2.92Å; F477-L481 HydrophobicContact CD2-CD1 4.46Å; F477-L481 HydrophobicContact CE1-CD1 4.29Å; F477-L481 HydrophobicContact CE2-CD1 4.08Å; F477-L481 HydrophobicContact CE2-CG 4.35Å; F477-L481 HydrophobicContact CZ-CD1 3.97Å; F477-L481 WeakPolarHBondContact O-CG 3.41Å; F477-L481 PolarHBondContact O-N 3.11Å
478I92Very high87.1Confident0 Ų024.3 Ų24.30%013%0.125CC..Hα-helixtrans-67.4-43.9-179.4-70169.4000110.5L416 L474 S475 E476 N480 L481 M482 F529 L533 L536 L564L416-I478 HydrophobicContact CD1-CD1 4.05Å; L416-I478 HydrophobicContact CD1-CG1 3.58Å; L474-I478 WeakPolarHBondContact O-CB 3.3Å; L474-I478 VanDerWaalsContact O-CG1 3.28Å; L474-I478 WeakPolarHBondContact O-CG1 3.16Å; L474-I478 PolarHBondContact O-N 3.17Å; S475-I478 PolarHBondContact O-N 3Å; E476-I478 VanDerWaalsContact C-N 3.35Å; E476-I478 PolarHBondContact O-N 2.98Å; I478-N480 VanDerWaalsContact C-N 3.33Å; I478-N480 PolarHBondContact O-N 2.85Å; I478-L481 CarbonylContact O-C 3.56Å; I478-L481 WeakPolarHBondContact O-CA 3.21Å; I478-L481 WeakPolarHBondContact O-CB 3.3Å; I478-L481 PolarHBondContact O-N 3.15Å; I478-M482 HydrophobicContact CG2-CE 4.28Å; I478-M482 HydrophobicContact CG2-CG 4.18Å; I478-M482 HydrophobicContact CG2-SD 4.31Å; I478-M482 VanDerWaalsContact O-CG 3.3Å; I478-M482 WeakPolarHBondContact O-CG 3.4Å; I478-M482 PolarHBondContact O-N 3.37Å; I478-F529 HydrophobicContact CG2-CE2 4.22Å; I478-F529 HydrophobicContact CG2-CZ 3.91Å; I478-L533 HydrophobicContact CG2-CD1 3.87Å; I478-L536 HydrophobicContact CD1-CD2 3.21Å; I478-L564 HydrophobicContact CB-CD2 3.77Å; I478-L564 HydrophobicContact CD1-CD2 4.24Å; I478-L564 HydrophobicContact CG2-CD2 3.51Å
479F88.9Confident87.1Confident41 Ų4122.7 Ų22.718%0.1811%0.114CC..Hα-helixtrans-56.2-45.4177.2179.1-102.1000112.4S475 E476 L481 M482 L483 R563 N566 C567S475-F479 WeakPolarHBondContact O-CB 3.47Å; S475-F479 PolarHBondContact O-N 3.17Å; E476-F479 PolarHBondContact O-N 3.41Å; F479-L481 VanDerWaalsContact C-N 3.29Å; F479-L481 PolarHBondContact O-N 2.82Å; F479-M482 HydrophobicContact CB-CE 4.26Å; F479-M482 HydrophobicContact CD2-CE 4.1Å; F479-M482 WeakPolarHBondContact O-CA 3.1Å; F479-M482 WeakPolarHBondContact O-CB 3.24Å; F479-M482 PolarHBondContact O-N 3.35Å; F479-L483 HydrophobicContact CD1-CD1 3.92Å; F479-L483 HydrophobicContact CD1-CG 4.37Å; F479-L483 HydrophobicContact CE1-CD1 3.42Å; F479-L483 VanDerWaalsContact CE1-CD1 3.42Å; F479-L483 HydrophobicContact CE1-CG 4.03Å; F479-L483 HydrophobicContact CZ-CD1 3.88Å; F479-L483 HydrophobicContact CZ-CD2 4.17Å; F479-L483 HydrophobicContact CZ-CG 4.1Å; F479-L483 PolarHBondContact O-N 2.91Å; F479-R563 HydrophobicContact CB-CG 3.83Å; F479-R563 HydrophobicContact CD1-CG 4.47Å; F479-R563 HydrophobicContact CD2-CG 3.99Å; F479-R563 WeakPolarHBondContact CD2-O 3.41Å; F479-R563 HydrophobicContact CG-CG 3.86Å; F479-N566 HydrophobicContact CE2-CB 4.11Å; F479-C567 HydrophobicContact CD2-CB 4.47Å; F479-C567 HydrophobicContact CE2-CB 4.28Å; F479-C567 WeakPolarHBondContact CE2-SG 3.45Å
480N87.3Confident86.8Confident24 Ų2423.9 Ų23.913%0.12812%0.121CC..Hα-helixtrans-62-34.3174.7-76.7-32.6000113.2V361 S364 E476 F477 I478 N484V361-N480 WeakPolarHBondContact CG1-ND2 3.46Å; S364-N480 WeakPolarHBondContact OG-CB 3.49Å; S364-N480 PolarHBondContact OG-ND2 3.21Å; E476-N480 WeakPolarHBondContact O-CB 3.38Å; E476-N480 PolarHBondContact O-N 3.31Å; E476-N480 PolarHBondContact O-ND2 3.3Å; F477-N480 PolarHBondContact O-N 2.92Å; I478-N480 VanDerWaalsContact C-N 3.33Å; I478-N480 PolarHBondContact O-N 2.85Å; N480-N484 PolarHBondContact O-ND2 3.09Å
481L88.7Confident86.4Confident1 Ų124.1 Ų24.11%0.00512%0.122CC..Hα-helixtrans-69.3-38.8171.5-63.4174.9000111.5Y409 L412 I413 F477 I478 F479 N484 S485 F529Y409-L481 HydrophobicContact CD1-CD2 4.06Å; L412-L481 HydrophobicContact CB-CD2 3.75Å; L412-L481 HydrophobicContact CD1-CD2 3.9Å; L412-L481 HydrophobicContact CG-CD2 4.49Å; I413-L481 HydrophobicContact CG1-CB 4.49Å; I413-L481 HydrophobicContact CG1-CD1 4.14Å; I413-L481 HydrophobicContact CG1-CD2 4.37Å; F477-L481 HydrophobicContact CD2-CD1 4.46Å; F477-L481 HydrophobicContact CE1-CD1 4.29Å; F477-L481 HydrophobicContact CE2-CD1 4.08Å; F477-L481 HydrophobicContact CE2-CG 4.35Å; F477-L481 HydrophobicContact CZ-CD1 3.97Å; F477-L481 WeakPolarHBondContact O-CG 3.41Å; F477-L481 PolarHBondContact O-N 3.11Å; I478-L481 CarbonylContact O-C 3.56Å; I478-L481 WeakPolarHBondContact O-CA 3.21Å; I478-L481 WeakPolarHBondContact O-CB 3.3Å; I478-L481 PolarHBondContact O-N 3.15Å; F479-L481 VanDerWaalsContact C-N 3.29Å; F479-L481 PolarHBondContact O-N 2.82Å; L481-N484 CarbonylContact O-C 3.6Å; L481-N484 PolarHBondContact O-N 3.37Å; L481-S485 PolarHBondContact O-N 3.2Å; L481-F529 HydrophobicContact CB-CZ 4.34Å; L481-F529 HydrophobicContact CD1-CE2 4.46Å
482M86.9Confident86.2Confident4 Ų423.9 Ų23.92%0.0212%0.121CC..Hα-helixtrans-64-46.4178.3-65.8-164.5-69.100112I478 F479 N484 S485 F529 L533 L564 C567 L571I478-M482 HydrophobicContact CG2-CE 4.28Å; I478-M482 HydrophobicContact CG2-CG 4.18Å; I478-M482 HydrophobicContact CG2-SD 4.31Å; I478-M482 VanDerWaalsContact O-CG 3.3Å; I478-M482 WeakPolarHBondContact O-CG 3.4Å; I478-M482 PolarHBondContact O-N 3.37Å; F479-M482 HydrophobicContact CB-CE 4.26Å; F479-M482 HydrophobicContact CD2-CE 4.1Å; F479-M482 WeakPolarHBondContact O-CA 3.1Å; F479-M482 WeakPolarHBondContact O-CB 3.24Å; F479-M482 PolarHBondContact O-N 3.35Å; M482-N484 PolarHBondContact O-N 3.01Å; M482-N484 VanDerWaalsContact O-N 3.13Å; M482-S485 WeakPolarHBondContact O-CB 3.43Å; M482-S485 PolarHBondContact O-N 2.84Å; M482-S485 PolarHBondContact O-OG 3.14Å; M482-F529 HydrophobicContact CG-CE1 4.14Å; M482-F529 HydrophobicContact CG-CZ 4.1Å; M482-L533 HydrophobicContact SD-CD1 4.43Å; M482-L533 HydrophobicContact SD-CD2 3.64Å; M482-L564 HydrophobicContact CE-CD2 4.37Å; M482-C567 HydrophobicContact CB-CB 4.24Å; M482-C567 HydrophobicContact CE-CB 4.25Å; M482-L571 HydrophobicContact CB-CD1 3.66Å; M482-L571 HydrophobicContact CG-CD1 3.43Å; M482-L571 VanDerWaalsContact CG-CD1 3.43Å; M482-L571 HydrophobicContact SD-CD1 3.96Å
483L80.9Confident86Confident91 Ų9128 Ų2848%0.47614%0.138SC..Hα-helixtrans-57.7-28.5176.9-73.7178.1000113.2F479F479-L483 HydrophobicContact CD1-CD1 3.92Å; F479-L483 HydrophobicContact CD1-CG 4.37Å; F479-L483 HydrophobicContact CE1-CD1 3.42Å; F479-L483 VanDerWaalsContact CE1-CD1 3.42Å; F479-L483 HydrophobicContact CE1-CG 4.03Å; F479-L483 HydrophobicContact CZ-CD1 3.88Å; F479-L483 HydrophobicContact CZ-CD2 4.17Å; F479-L483 HydrophobicContact CZ-CG 4.1Å; F479-L483 PolarHBondContact O-N 2.91Å
484N77.2Confident85.5Confident30 Ų3030.1 Ų30.116%0.1615%0.145CC..THydrogen-bonded Turntrans-104.88.9-179.6-65.8-68.2000113.4Y409 N480 L481 M482 S486 R487Y409-N484 HydrophobicContact CD1-CB 3.98Å; Y409-N484 HydrophobicContact CE1-CB 3.34Å; Y409-N484 HydrophobicContact CE2-CB 4.09Å; Y409-N484 VanDerWaalsContact CZ-CB 3.41Å; Y409-N484 PolarHBondContact OH-ND2 3.36Å; Y409-N484 PolarHBondContact OH-OD1 2.71Å; N480-N484 PolarHBondContact O-ND2 3.09Å; L481-N484 CarbonylContact O-C 3.6Å; L481-N484 PolarHBondContact O-N 3.37Å; M482-N484 PolarHBondContact O-N 3.01Å; M482-N484 VanDerWaalsContact O-N 3.13Å; N484-S486 VanDerWaalsContact C-N 3.26Å; N484-S486 PolarHBondContact O-N 3.02Å; N484-R487 PolarHBondContact O-N 3.46Å; N484-R487 PolarHBondContact OD1-NH1 3.27Å
485S81.1Confident85Confident2 Ų230.1 Ų30.11%0.01415%0.145CC..THydrogen-bonded Turntrans-65.8-24.2-173.864.10000113.8L481 M482 R487 A488 W489 L574L481-S485 PolarHBondContact O-N 3.2Å; M482-S485 WeakPolarHBondContact O-CB 3.43Å; M482-S485 PolarHBondContact O-N 2.84Å; M482-S485 PolarHBondContact O-OG 3.14Å; S485-R487 PolarHBondContact O-N 3.41Å; S485-R487 VanDerWaalsContact O-N 3.12Å; S485-A488 WeakPolarHBondContact O-CB 3.43Å; S485-A488 PolarHBondContact O-N 3.48Å; S485-W489 VanDerWaalsContact O-CD1 3.27Å; S485-L574 VanDerWaalsContact OG-CD1 3.31Å; S485-L574 WeakPolarHBondContact OG-CD1 3.34Å
486S80Confident84.5Confident55 Ų5531.7 Ų31.739%0.38515%0.153SC..Hα-helixtrans-53-34173.460.10000112.3N484 W489N484-S486 VanDerWaalsContact C-N 3.26Å; N484-S486 PolarHBondContact O-N 3.02Å; S486-W489 PolarHBondContact O-N 3.02Å
487R77.5Confident84Confident69 Ų6929.6 Ų29.626%0.2615%0.148SC..Hα-helixtrans-71.7-31.9178-56.6-165.7-173.5107.15.4112.9Y372 T406 Y409 N484 S485 W489 E490Y372-R487 PolarHBondContact OH-NH1 3.4Å; Y372-R487 PolarHBondContact OH-NH2 3.5Å; T406-R487 VanDerWaalsContact CG2-O 3.29Å; T406-R487 WeakPolarHBondContact CG2-O 3.46Å; Y409-R487 HydrophobicContact CD2-CB 4.49Å; Y409-R487 PolarHBondContact OH-NH1 3.42Å; N484-R487 PolarHBondContact O-N 3.46Å; N484-R487 PolarHBondContact OD1-NH1 3.27Å; S485-R487 PolarHBondContact O-N 3.41Å; S485-R487 VanDerWaalsContact O-N 3.12Å; R487-W489 PolarHBondContact O-N 3.18Å; R487-E490 WeakPolarHBondContact O-CB 3.33Å; R487-E490 PolarHBondContact O-N 2.95Å
488A83.1Confident83.3Confident0 Ų029.8 Ų29.80%015%0.149CC..Hα-helixtrans-65.4-25.1177.200000112L410 I413 S485 P491 S522 M526L410-A488 HydrophobicContact CD2-CB 4.17Å; I413-A488 HydrophobicContact CD1-CB 4.34Å; S485-A488 WeakPolarHBondContact O-CB 3.43Å; S485-A488 PolarHBondContact O-N 3.48Å; A488-P491 WeakPolarHBondContact O-CD 3.29Å; A488-S522 WeakPolarHBondContact O-CB 3.35Å; A488-S522 PolarHBondContact O-OG 3.03Å; A488-M526 HydrophobicContact CB-CG 4.33Å; A488-M526 HydrophobicContact CB-SD 3.77Å
489W85.6Confident82.1Confident0 Ų031.6 Ų31.60%016%0.161CC..Hα-helixtrans-83.4-14.8177-63.4117.4000114.6S485 S486 R487 P491 V492 E493 M526 F530 I575 P576 L625 L628S485-W489 VanDerWaalsContact O-CD1 3.27Å; S486-W489 PolarHBondContact O-N 3.02Å; R487-W489 PolarHBondContact O-N 3.18Å; W489-P491 VanDerWaalsContact C-CD 3.46Å; W489-P491 VanDerWaalsContact C-N 3.35Å; W489-V492 HydrophobicContact CE3-CB 4.45Å; W489-V492 HydrophobicContact CE3-CG2 4.11Å; W489-V492 WeakPolarHBondContact O-CA 3.45Å; W489-V492 WeakPolarHBondContact O-CB 3.49Å; W489-V492 PolarHBondContact O-N 3.16Å; W489-E493 PolarHBondContact O-N 3.45Å; W489-M526 HydrophobicContact CH2-CB 3.56Å; W489-M526 HydrophobicContact CH2-CG 3.94Å; W489-M526 HydrophobicContact CZ2-CB 3.85Å; W489-M526 HydrophobicContact CZ2-CE 3.78Å; W489-M526 HydrophobicContact CZ2-CG 3.94Å; W489-M526 HydrophobicContact CZ3-CB 4.16Å; W489-M526 HydrophobicContact CZ3-CG 4.27Å; W489-F530 HydrophobicContact CH2-CE2 4.27Å; W489-F530 AromaticContact CZ2-CE2 3.9Å; W489-F530 HydrophobicContact CZ2-CE2 3.9Å; W489-F530 HydrophobicContact CZ2-CZ 4.32Å; W489-I575 HydrophobicContact CH2-CG1 4.37Å; W489-I575 HydrophobicContact CZ2-CG1 3.87Å; W489-P576 HydrophobicContact CB-CG 3.93Å; W489-P576 HydrophobicContact CD2-CG 4.35Å; W489-P576 HydrophobicContact CE3-CG 4.25Å; W489-P576 HydrophobicContact CG-CG 4.25Å; W489-L625 HydrophobicContact CZ3-CD2 4.34Å; W489-L628 HydrophobicContact CH2-CD1 3.99Å; W489-L628 HydrophobicContact CH2-CD2 4.37Å
490E83Confident80.9Confident51 Ų5137 Ų3724%0.23819%0.185CC..Hα-helixtrans-50.3-44.5-178.5-177.5-169.9-162.900113.4T406 R487 V492 E493 R494T406-E490 PolarHBondContact OG1-OE2 2.93Å; R487-E490 WeakPolarHBondContact O-CB 3.33Å; R487-E490 PolarHBondContact O-N 2.95Å; E490-V492 VanDerWaalsContact C-N 3.29Å; E490-V492 PolarHBondContact O-N 3.36Å; E490-E493 PolarHBondContact O-N 2.95Å; E490-R494 WeakPolarHBondContact O-CG 3.39Å; E490-R494 PolarHBondContact O-N 3.02Å; E490-R494 IonicContact OE1-CZ 3.84Å; E490-R494 IonicContact OE1-NE 3.19Å; E490-R494 PolarHBondContact OE1-NE 3.3Å; E490-R494 IonicContact OE1-NH2 2.85Å; E490-R494 PolarHBondContact OE1-NH2 3.01Å; E490-R494 IonicContact OE2-NH2 3.16Å
491P84.7Confident79.4Confident4 Ų439.4 Ų39.43%0.02620%0.2CC..Hα-helixtrans-64.8-33.6178.3-22.937.6000112.8T406 A488 W489 V495 I518 S522T406-P491 HydrophobicContact CG2-CG 3.73Å; A488-P491 WeakPolarHBondContact O-CD 3.29Å; W489-P491 VanDerWaalsContact C-CD 3.46Å; W489-P491 VanDerWaalsContact C-N 3.35Å; P491-V495 WeakPolarHBondContact O-CG2 3.28Å; P491-V495 PolarHBondContact O-N 3.36Å; P491-V495 VanDerWaalsContact O-N 3.13Å; P491-I518 HydrophobicContact CB-CB 4.5Å; P491-I518 HydrophobicContact CB-CG2 3.74Å; P491-I518 HydrophobicContact CG-CG2 3.95Å; P491-S522 WeakPolarHBondContact CG-OG 3.29Å
492V86.1Confident77.7Confident0 Ų041.3 Ų41.30%021%0.213CC..Hα-helixtrans-68.1-44.2176.1179.10000110.3W489 E490 R494 V495 L496 L523 P576 M621 L625W489-V492 HydrophobicContact CE3-CB 4.45Å; W489-V492 HydrophobicContact CE3-CG2 4.11Å; W489-V492 WeakPolarHBondContact O-CA 3.45Å; W489-V492 WeakPolarHBondContact O-CB 3.49Å; W489-V492 PolarHBondContact O-N 3.16Å; E490-V492 VanDerWaalsContact C-N 3.29Å; E490-V492 PolarHBondContact O-N 3.36Å; V492-R494 VanDerWaalsContact C-N 3.34Å; V492-R494 PolarHBondContact O-N 3.28Å; V492-V495 PolarHBondContact O-N 3.2Å; V492-L496 HydrophobicContact CG1-CD1 4.33Å; V492-L496 WeakPolarHBondContact O-CG 3.46Å; V492-L496 PolarHBondContact O-N 2.99Å; V492-L523 HydrophobicContact CG2-CB 4.47Å; V492-P576 HydrophobicContact CB-CG 4.49Å; V492-P576 HydrophobicContact CG1-CG 4.19Å; V492-M621 HydrophobicContact CG1-CE 4.41Å; V492-M621 HydrophobicContact CG1-CG 3.93Å; V492-M621 HydrophobicContact CG1-SD 3.99Å; V492-M621 HydrophobicContact CG2-CE 4.35Å; V492-L625 HydrophobicContact CG1-CD1 3.85Å; V492-L625 HydrophobicContact CG1-CD2 4.16Å; V492-L625 HydrophobicContact CG1-CG 4.3Å
493E84.6Confident76Confident99 Ų9945.7 Ų45.746%0.46325%0.245SC..Hα-helixtrans-62.7-39176.4-66-176.6167.400112.5W489 E490 L496 S497 P576W489-E493 PolarHBondContact O-N 3.45Å; E490-E493 PolarHBondContact O-N 2.95Å; E493-L496 PolarHBondContact O-N 3.24Å; E493-S497 PolarHBondContact O-N 3.36Å; E493-S497 PolarHBondContact O-OG 3.44Å; E493-S497 VanDerWaalsContact O-OG 3.09Å; E493-P576 HydrophobicContact CG-CB 4.2Å; E493-P576 HydrophobicContact CG-CG 3.82Å
494R80.1Confident74.5Confident69 Ų6950 Ų5026%0.2626%0.262SS..Hα-helixtrans-61-43.6173.6-73.3-178-171.7-176.61.4111.7S400 E490 V492 L496 S497 L498S400-R494 PolarHBondContact O-NH1 3.13Å; E490-R494 WeakPolarHBondContact O-CG 3.39Å; E490-R494 PolarHBondContact O-N 3.02Å; E490-R494 IonicContact OE1-CZ 3.84Å; E490-R494 IonicContact OE1-NE 3.19Å; E490-R494 PolarHBondContact OE1-NE 3.3Å; E490-R494 IonicContact OE1-NH2 2.85Å; E490-R494 PolarHBondContact OE1-NH2 3.01Å; E490-R494 IonicContact OE2-NH2 3.16Å; V492-R494 VanDerWaalsContact C-N 3.34Å; V492-R494 PolarHBondContact O-N 3.28Å; R494-L496 VanDerWaalsContact C-N 3.32Å; R494-L496 PolarHBondContact O-N 3.23Å; R494-S497 WeakPolarHBondContact CA-OG 3.45Å; R494-S497 PolarHBondContact O-N 2.92Å; R494-S497 PolarHBondContact O-OG 2.92Å; R494-L498 PolarHBondContact O-N 3.34Å
495V83.3Confident73.2Confident0 Ų056 Ų560%029%0.289CS..Hα-helixtrans-62-41.3175.1173.20000111.4P491 V492 S497 L498 L515 F516 M621P491-V495 WeakPolarHBondContact O-CG2 3.28Å; P491-V495 PolarHBondContact O-N 3.36Å; P491-V495 VanDerWaalsContact O-N 3.13Å; V492-V495 PolarHBondContact O-N 3.2Å; V495-S497 VanDerWaalsContact C-N 3.25Å; V495-S497 PolarHBondContact O-N 3.13Å; V495-L498 HydrophobicContact CG1-CD1 4.29Å; V495-L498 WeakPolarHBondContact O-CB 3.45Å; V495-L498 WeakPolarHBondContact O-CG 3.45Å; V495-L498 PolarHBondContact O-N 3.49Å; V495-L515 HydrophobicContact CG2-CB 4.39Å; V495-L515 VanDerWaalsContact CG2-O 3.24Å; V495-L515 WeakPolarHBondContact CG2-O 2.96Å; V495-F516 HydrophobicContact CG1-CD2 3.88Å; V495-M621 HydrophobicContact CB-CE 4.13Å; V495-M621 HydrophobicContact CG1-CB 3.85Å; V495-M621 HydrophobicContact CG1-CE 4.04Å; V495-M621 HydrophobicContact CG1-CG 4.09Å; V495-M621 HydrophobicContact CG2-CE 4.14Å
496L82.2Confident71.9Confident33 Ų3361.2 Ų61.217%0.17333%0.326CS..Hα-helixtrans-67.4-24.5178.1-67.8174.2000113.3V492 E493 R494 P576 M621 K622 L625V492-L496 HydrophobicContact CG1-CD1 4.33Å; V492-L496 WeakPolarHBondContact O-CG 3.46Å; V492-L496 PolarHBondContact O-N 2.99Å; E493-L496 PolarHBondContact O-N 3.24Å; R494-L496 VanDerWaalsContact C-N 3.32Å; R494-L496 PolarHBondContact O-N 3.23Å; L496-P576 HydrophobicContact CD1-CB 3.84Å; L496-M621 HydrophobicContact CD2-CB 4.32Å; L496-M621 HydrophobicContact CD2-CG 4.19Å; L496-M621 HydrophobicContact CG-CG 4.44Å; L496-K622 HydrophobicContact CD2-CD 4.42Å; L496-K622 HydrophobicContact CD2-CG 3.52Å; L496-L625 HydrophobicContact CD1-CD1 3.87Å; L496-L625 HydrophobicContact CD2-CD1 4.47Å
497S79.5Confident71Confident42 Ų4261.5 Ų61.529%0.29432%0.322SS..Hα-helixtrans-92.4-9.5179.459.20000114.7E493 R494 V495 P499 K500 V501E493-S497 PolarHBondContact O-N 3.36Å; E493-S497 PolarHBondContact O-OG 3.44Å; E493-S497 VanDerWaalsContact O-OG 3.09Å; R494-S497 WeakPolarHBondContact CA-OG 3.45Å; R494-S497 PolarHBondContact O-N 2.92Å; R494-S497 PolarHBondContact O-OG 2.92Å; V495-S497 VanDerWaalsContact C-N 3.25Å; V495-S497 PolarHBondContact O-N 3.13Å; S497-P499 VanDerWaalsContact C-N 3.29Å; S497-P499 VanDerWaalsContact O-N 3.12Å; S497-K500 WeakPolarHBondContact O-CB 3.28Å; S497-K500 PolarHBondContact O-N 2.9Å; S497-V501 PolarHBondContact O-N 2.96Å
498L76.9Confident70.5Confident10 Ų1060.7 Ų60.75%0.05233%0.327CS..Hα-helixtrans-44.8-43176.5-70.7170.9000114.4R494 V495 K500 V501 S502 L515R494-L498 PolarHBondContact O-N 3.34Å; V495-L498 HydrophobicContact CG1-CD1 4.29Å; V495-L498 WeakPolarHBondContact O-CB 3.45Å; V495-L498 WeakPolarHBondContact O-CG 3.45Å; V495-L498 PolarHBondContact O-N 3.49Å; L498-K500 PolarHBondContact O-N 3.39Å; L498-V501 PolarHBondContact O-N 3.2Å; L498-S502 PolarHBondContact O-N 3.42Å; L498-L515 HydrophobicContact CD2-CD1 3.91Å
499P67.5Low69.8Low38 Ų3863.8 Ų63.825%0.24735%0.349CS..Hα-helixtrans-59.4-32.2177.7-27.838.6000114.2S497 S502 D615 A618S497-P499 VanDerWaalsContact C-N 3.29Å; S497-P499 VanDerWaalsContact O-N 3.12Å; P499-S502 PolarHBondContact O-OG 2.98Å; P499-D615 WeakPolarHBondContact CB-OD1 3.49Å; P499-D615 WeakPolarHBondContact CG-OD1 3.49Å; P499-A618 HydrophobicContact CG-CB 3.94Å
500K63.2Low69.2Low155 Ų15571.5 Ų71.567%0.67439%0.385SS*.Hα-helixtrans-80.7-38-177.8-62.8179.1178.9177.80112S497 L498 S503S497-K500 WeakPolarHBondContact O-CB 3.28Å; S497-K500 PolarHBondContact O-N 2.9Å; L498-K500 PolarHBondContact O-N 3.39Å; K500-S503 PolarHBondContact O-OG 3.4Å
501V56.2Low68.7Low74 Ų7470.9 Ų70.945%0.44838%0.383SS..Hα-helixtrans-72.6-32.3-174.8-178.20000112.3S497 L498 S503 Q504 L507S497-V501 PolarHBondContact O-N 2.96Å; L498-V501 PolarHBondContact O-N 3.2Å; V501-S503 PolarHBondContact O-N 2.85Å; V501-Q504 PolarHBondContact O-N 2.8Å; V501-L507 HydrophobicContact CG1-CD1 3.79Å
502S53.2Low68.1Low41 Ų4171.4 Ų71.429%0.28739%0.387SS..THydrogen-bonded Turntrans-63.3-7.2-178.464.40000115.7L498 P499L498-S502 PolarHBondContact O-N 3.42Å; P499-S502 PolarHBondContact O-OG 2.98Å
503S51.2Low67.7Low97 Ų9774.1 Ų74.168%0.67840%0.399SS*.THydrogen-bonded Turntrans-81.4-10.4179.363.50000114.9K500 V501K500-S503 PolarHBondContact O-OG 3.4Å; V501-S503 PolarHBondContact O-N 2.85Å
504Q47.8Very low67.2Low180 Ų18070.8 Ų70.884%0.84139%0.387SS*.THydrogen-bonded Turntrans-126.4-24.7-175-70.8-173.9-20.400116.1V501V501-Q504 PolarHBondContact O-N 2.8Å
505E51.1Low67.2Low158 Ų15868.2 Ų68.274%0.73838%0.378SS*.SBendtrans-146139.9175.8-69.9-179.2159.400111.6L507E505-L507 PolarHBondContact O-N 3.39Å
506S53.5Low67.1Low111 Ų11168.7 Ų68.778%0.77638%0.38SS*.  trans-77.184.4-176.158.80000112.2
507L60.8Low66.9Low60 Ų6068.8 Ų68.831%0.31438%0.38SS..  trans-63.1134.2167.6-84.1114.3000110.8V501 E505 I511V501-L507 HydrophobicContact CG1-CD1 3.79Å; E505-L507 PolarHBondContact O-N 3.39Å; L507-I511 HydrophobicContact CD2-CB 4.26Å; L507-I511 HydrophobicContact CD2-CG2 3.63Å
508S67.6Low66.8Low52 Ų5267.4 Ų67.436%0.36437%0.369SS..  trans-67.8148.7176.776.60000111E510 I511 C512S508-E510 PolarHBondContact O-N 3Å; S508-E510 VanDerWaalsContact O-N 3.13Å; S508-I511 PolarHBondContact O-N 3.43Å; S508-I511 VanDerWaalsContact O-N 3.07Å; S508-I511 WeakPolarHBondContact OG-CD1 3.47Å; S508-I511 VanDerWaalsContact OG-CG1 3.31Å; S508-I511 WeakPolarHBondContact OG-CG1 3.5Å; S508-I511 PolarHBondContact OG-N 2.87Å; S508-C512 PolarHBondContact O-N 3.05Å
509S68.4Low67.1Low66 Ų6666.9 Ų66.946%0.46237%0.367SS..Hα-helixtrans-59-26.5178.7-172.30000113Q513 N613S509-Q513 WeakPolarHBondContact O-CB 3.36Å; S509-Q513 PolarHBondContact O-N 2.97Å; S509-Q513 VanDerWaalsContact O-N 3.16Å; S509-N613 PolarHBondContact OG-ND2 3.28Å
510E72.9Confident67.8Low161 Ų16165.7 Ų65.775%0.75236%0.358SS*.Hα-helixtrans-71-37177.4-67.5177.617700111.9S508 Q513 S514S508-E510 PolarHBondContact O-N 3Å; S508-E510 VanDerWaalsContact O-N 3.13Å; E510-Q513 PolarHBondContact O-N 3.29Å; E510-S514 PolarHBondContact O-N 3.48Å; E510-S514 PolarHBondContact O-OG 3.02Å
511I71.9Confident68.7Low39 Ų3958.5 Ų58.520%0.233%0.327CS..Hα-helixtrans-68.9-42.5176.5-63164.6000110.3L507 S508 Q513 S514 L515L507-I511 HydrophobicContact CD2-CB 4.26Å; L507-I511 HydrophobicContact CD2-CG2 3.63Å; S508-I511 PolarHBondContact O-N 3.43Å; S508-I511 VanDerWaalsContact O-N 3.07Å; S508-I511 WeakPolarHBondContact OG-CD1 3.47Å; S508-I511 VanDerWaalsContact OG-CG1 3.31Å; S508-I511 WeakPolarHBondContact OG-CG1 3.5Å; S508-I511 PolarHBondContact OG-N 2.87Å; I511-Q513 VanDerWaalsContact C-N 3.31Å; I511-Q513 PolarHBondContact O-N 3.03Å; I511-S514 WeakPolarHBondContact CA-OG 3.46Å; I511-S514 PolarHBondContact O-N 3.09Å; I511-S514 PolarHBondContact O-OG 3.41Å; I511-L515 HydrophobicContact CG2-CD1 4.16Å; I511-L515 HydrophobicContact CG2-CG 4.42Å; I511-L515 WeakPolarHBondContact O-CG 3.41Å; I511-L515 PolarHBondContact O-N 2.73Å
512C72.2Confident70.1Confident15 Ų1555 Ų5510%0.10131%0.306CS..Hα-helixtrans-60.6-40.7175.3-65.90000112.4S508 F516 L617S508-C512 PolarHBondContact O-N 3.05Å; C512-F516 PolarHBondContact O-N 3.49Å; C512-L617 HydrophobicContact CB-CD1 4.31Å
513Q77.9Confident71.7Confident56 Ų5653.1 Ų53.126%0.26229%0.292SS..Hα-helixtrans-68.2-41.1178.9-17062.529.500111.8S509 E510 I511 F516 H517S509-Q513 WeakPolarHBondContact O-CB 3.36Å; S509-Q513 PolarHBondContact O-N 2.97Å; S509-Q513 VanDerWaalsContact O-N 3.16Å; E510-Q513 PolarHBondContact O-N 3.29Å; I511-Q513 VanDerWaalsContact C-N 3.31Å; I511-Q513 PolarHBondContact O-N 3.03Å; Q513-F516 WeakPolarHBondContact O-CB 3.2Å; Q513-F516 PolarHBondContact O-N 3.24Å; Q513-H517 PolarHBondContact NE2-NE2 2.91Å; Q513-H517 PolarHBondContact O-CD2 3.31Å; Q513-H517 PolarHBondContact O-N 3.05Å
514S74.7Confident73.2Confident29 Ų2950.6 Ų50.620%0.20327%0.268CS..Hα-helixtrans-68.3-38.1176.952.50000112.9L401 E510 I511 F516 H517 I518L401-S514 WeakPolarHBondContact CD2-OG 3.44Å; E510-S514 PolarHBondContact O-N 3.48Å; E510-S514 PolarHBondContact O-OG 3.02Å; I511-S514 WeakPolarHBondContact CA-OG 3.46Å; I511-S514 PolarHBondContact O-N 3.09Å; I511-S514 PolarHBondContact O-OG 3.41Å; S514-F516 VanDerWaalsContact C-N 3.31Å; S514-F516 PolarHBondContact O-N 2.85Å; S514-H517 PolarHBondContact O-N 3.04Å; S514-I518 WeakPolarHBondContact O-CG1 3.22Å; S514-I518 PolarHBondContact O-N 3.48Å
515L78.3Confident75Confident15 Ų1542 Ų428%0.07923%0.228CC..Hα-helixtrans-59.6-42.4170-73.4171.6000111.6V495 L498 I511 I518 G519V495-L515 HydrophobicContact CG2-CB 4.39Å; V495-L515 VanDerWaalsContact CG2-O 3.24Å; V495-L515 WeakPolarHBondContact CG2-O 2.96Å; L498-L515 HydrophobicContact CD2-CD1 3.91Å; I511-L515 HydrophobicContact CG2-CD1 4.16Å; I511-L515 HydrophobicContact CG2-CG 4.42Å; I511-L515 WeakPolarHBondContact O-CG 3.41Å; I511-L515 PolarHBondContact O-N 2.73Å; L515-I518 PolarHBondContact O-N 3.42Å; L515-G519 PolarHBondContact O-N 3.4Å
516F81.7Confident76.8Confident10 Ų1034.5 Ų34.54%0.04419%0.193CC..Hα-helixtrans-61.9-42.6175.2-178.2-102.4000112.3V495 C512 Q513 S514 G519 L520 L617 K620 M621V495-F516 HydrophobicContact CG1-CD2 3.88Å; C512-F516 PolarHBondContact O-N 3.49Å; Q513-F516 WeakPolarHBondContact O-CB 3.2Å; Q513-F516 PolarHBondContact O-N 3.24Å; S514-F516 VanDerWaalsContact C-N 3.31Å; S514-F516 PolarHBondContact O-N 2.85Å; F516-G519 PolarHBondContact O-N 3.42Å; F516-L520 HydrophobicContact CD1-CD1 3.83Å; F516-L520 HydrophobicContact CD1-CG 4.3Å; F516-L520 HydrophobicContact CE1-CD1 3.41Å; F516-L520 VanDerWaalsContact CE1-CD1 3.41Å; F516-L520 HydrophobicContact CE1-CD2 4.44Å; F516-L520 HydrophobicContact CE1-CG 3.96Å; F516-L520 HydrophobicContact CZ-CD1 4Å; F516-L520 HydrophobicContact CZ-CD2 4.19Å; F516-L520 HydrophobicContact CZ-CG 4.12Å; F516-L520 WeakPolarHBondContact O-CG 3.37Å; F516-L520 PolarHBondContact O-N 3.06Å; F516-L617 HydrophobicContact CB-CD1 4.16Å; F516-L617 HydrophobicContact CB-CD2 4.24Å; F516-L617 HydrophobicContact CD1-CD2 3.89Å; F516-L617 HydrophobicContact CD2-CB 3.9Å; F516-L617 HydrophobicContact CD2-CD2 3.96Å; F516-L617 HydrophobicContact CD2-CG 4.43Å; F516-L617 HydrophobicContact CE1-CD2 4.19Å; F516-L617 HydrophobicContact CE2-CB 4.42Å; F516-L617 HydrophobicContact CE2-CD2 4.29Å; F516-L617 WeakPolarHBondContact CE2-O 3.38Å; F516-L617 HydrophobicContact CG-CB 4.35Å; F516-L617 HydrophobicContact CG-CD2 3.76Å; F516-L617 HydrophobicContact CG-CG 4.43Å; F516-L617 HydrophobicContact CZ-CD2 4.41Å; F516-K620 HydrophobicContact CE2-CB 4.08Å; F516-K620 HydrophobicContact CZ-CB 4.05Å; F516-K620 HydrophobicContact CZ-CD 4.36Å; F516-M621 HydrophobicContact CE2-CB 4.36Å
517H78.7Confident78.4Confident36 Ų3630.2 Ų30.217%0.16716%0.161CC..Hα-helixtrans-63.1-43.3175.8-75.7-63.5000112.7Q513 S514 G519 L520 I521Q513-H517 PolarHBondContact NE2-NE2 2.91Å; Q513-H517 PolarHBondContact O-CD2 3.31Å; Q513-H517 PolarHBondContact O-N 3.05Å; S514-H517 PolarHBondContact O-N 3.04Å; H517-G519 VanDerWaalsContact C-N 3.34Å; H517-G519 PolarHBondContact O-N 3.14Å; H517-L520 WeakPolarHBondContact O-CB 3.27Å; H517-L520 PolarHBondContact O-N 2.88Å; H517-I521 WeakPolarHBondContact O-CG1 3.21Å; H517-I521 PolarHBondContact O-N 3.15Å
518I77.6Confident79.5Confident12 Ų1230.9 Ų30.96%0.06216%0.161CC..Hα-helixtrans-65.3-40.2176.2-62.5171000110.7L401 P491 S514 L515 L520 I521 S522L401-I518 HydrophobicContact CB-CD1 3.77Å; L401-I518 HydrophobicContact CD2-CD1 3.87Å; L401-I518 HydrophobicContact CG-CD1 4.25Å; L401-I518 VanDerWaalsContact O-CD1 3.32Å; L401-I518 WeakPolarHBondContact O-CD1 3.44Å; P491-I518 HydrophobicContact CB-CB 4.5Å; P491-I518 HydrophobicContact CB-CG2 3.74Å; P491-I518 HydrophobicContact CG-CG2 3.95Å; S514-I518 WeakPolarHBondContact O-CG1 3.22Å; S514-I518 PolarHBondContact O-N 3.48Å; L515-I518 PolarHBondContact O-N 3.42Å; I518-L520 VanDerWaalsContact C-N 3.32Å; I518-L520 PolarHBondContact O-N 2.94Å; I518-I521 WeakPolarHBondContact O-CB 3.38Å; I518-I521 PolarHBondContact O-N 2.87Å; I518-S522 PolarHBondContact O-N 3.03Å
519G82.9Confident80.6Confident0 Ų028.4 Ų28.40%014%0.144CC..Hα-helixtrans-59.5-39.8172.700000113.1L515 F516 H517 I521 S522 L523 M621L515-G519 PolarHBondContact O-N 3.4Å; F516-G519 PolarHBondContact O-N 3.42Å; H517-G519 VanDerWaalsContact C-N 3.34Å; H517-G519 PolarHBondContact O-N 3.14Å; G519-I521 VanDerWaalsContact C-N 3.35Å; G519-S522 PolarHBondContact O-N 3.45Å; G519-L523 WeakPolarHBondContact O-CB 3.49Å; G519-L523 PolarHBondContact O-N 2.65Å; G519-M621 VanDerWaalsContact C-CE 3.43Å
520L82.6Confident81.6Confident12 Ų1225.3 Ų25.36%0.06312%0.122CC..Hα-helixtrans-64-40.5174.9-77.3174.1000112I444 F516 H517 I518 L523 W524 L624I444-L520 HydrophobicContact CD1-CD1 4.06Å; F516-L520 HydrophobicContact CD1-CD1 3.83Å; F516-L520 HydrophobicContact CD1-CG 4.3Å; F516-L520 HydrophobicContact CE1-CD1 3.41Å; F516-L520 VanDerWaalsContact CE1-CD1 3.41Å; F516-L520 HydrophobicContact CE1-CD2 4.44Å; F516-L520 HydrophobicContact CE1-CG 3.96Å; F516-L520 HydrophobicContact CZ-CD1 4Å; F516-L520 HydrophobicContact CZ-CD2 4.19Å; F516-L520 HydrophobicContact CZ-CG 4.12Å; F516-L520 WeakPolarHBondContact O-CG 3.37Å; F516-L520 PolarHBondContact O-N 3.06Å; H517-L520 WeakPolarHBondContact O-CB 3.27Å; H517-L520 PolarHBondContact O-N 2.88Å; I518-L520 VanDerWaalsContact C-N 3.32Å; I518-L520 PolarHBondContact O-N 2.94Å; L520-L523 PolarHBondContact O-N 3.36Å; L520-W524 WeakPolarHBondContact O-CB 3.47Å; L520-W524 PolarHBondContact O-N 3.22Å; L520-L624 HydrophobicContact CD2-CD1 3.34Å
521I80.7Confident82.4Confident5 Ų519.1 Ų19.13%0.02610%0.099CC..Hα-helixtrans-62.2-50.7176.3-67.8168.8000110.2I444 E447 I448 I452 H517 I518 G519 L523 W524 V525I444-I521 HydrophobicContact CG2-CG1 4.31Å; E447-I521 HydrophobicContact CG-CD1 4.16Å; I448-I521 HydrophobicContact CD1-CG1 4.34Å; I448-I521 HydrophobicContact CD1-CG2 4.23Å; I448-I521 HydrophobicContact CG1-CB 4.4Å; I448-I521 HydrophobicContact CG1-CD1 4.28Å; I448-I521 HydrophobicContact CG1-CG1 3.85Å; I448-I521 HydrophobicContact CG1-CG2 3.84Å; I452-I521 HydrophobicContact CD1-CG2 3.26Å; H517-I521 WeakPolarHBondContact O-CG1 3.21Å; H517-I521 PolarHBondContact O-N 3.15Å; I518-I521 WeakPolarHBondContact O-CB 3.38Å; I518-I521 PolarHBondContact O-N 2.87Å; G519-I521 VanDerWaalsContact C-N 3.35Å; I521-L523 VanDerWaalsContact C-N 3.29Å; I521-L523 PolarHBondContact O-N 2.94Å; I521-W524 PolarHBondContact O-N 3.32Å; I521-V525 HydrophobicContact CG2-CG2 4.2Å; I521-V525 WeakPolarHBondContact O-CB 3.28Å; I521-V525 VanDerWaalsContact O-CG2 3.29Å; I521-V525 WeakPolarHBondContact O-CG2 3.22Å; I521-V525 PolarHBondContact O-N 3.46Å
522S85.7Confident83.2Confident0 Ų017.9 Ų17.90%09%0.093CC..Hα-helixtrans-52.6-47.8174.8-78.40000111.9A488 P491 I518 G519 W524 V525 M526A488-S522 WeakPolarHBondContact O-CB 3.35Å; A488-S522 PolarHBondContact O-OG 3.03Å; P491-S522 WeakPolarHBondContact CG-OG 3.29Å; I518-S522 PolarHBondContact O-N 3.03Å; G519-S522 PolarHBondContact O-N 3.45Å; S522-W524 PolarHBondContact O-N 2.87Å; S522-V525 PolarHBondContact O-N 3.48Å; S522-M526 WeakPolarHBondContact O-CB 3.38Å; S522-M526 VanDerWaalsContact O-CG 3.23Å; S522-M526 WeakPolarHBondContact O-CG 3.36Å; S522-M526 PolarHBondContact O-N 2.99Å
523L86.4Confident84.1Confident2 Ų217.2 Ų17.21%0.019%0.088CC..Hα-helixtrans-64.3-41.8-177.3-168.7150.1000112.2F434 V492 G519 L520 I521 D527 M621 L624 L625 L628F434-L523 HydrophobicContact CD1-CD2 4.1Å; F434-L523 HydrophobicContact CE1-CD2 3.32Å; F434-L523 HydrophobicContact CE2-CD2 3.98Å; F434-L523 HydrophobicContact CZ-CD2 3.27Å; V492-L523 HydrophobicContact CG2-CB 4.47Å; G519-L523 WeakPolarHBondContact O-CB 3.49Å; G519-L523 PolarHBondContact O-N 2.65Å; L520-L523 PolarHBondContact O-N 3.36Å; I521-L523 VanDerWaalsContact C-N 3.29Å; I521-L523 PolarHBondContact O-N 2.94Å; L523-D527 PolarHBondContact O-N 3.24Å; L523-M621 HydrophobicContact CD1-SD 3.73Å; L523-L624 HydrophobicContact CD1-CB 3.95Å; L523-L625 HydrophobicContact CD1-CD2 3.87Å; L523-L625 HydrophobicContact CD1-CG 4.05Å; L523-L628 HydrophobicContact CD2-CD1 4.19Å; L523-L628 HydrophobicContact CG-CD1 4.08Å
524W83.6Confident84.7Confident43 Ų4314.8 Ų14.816%0.1638%0.078CC..Hα-helixtrans-68.2-44.1178.2-179.688.5000112.7E414 I448 L520 I521 S522 M526 D527 K528E414-W524 VanDerWaalsContact CD-CZ3 3.42Å; E414-W524 WeakPolarHBondContact OE1-CH2 3.29Å; E414-W524 WeakPolarHBondContact OE1-CZ3 3.34Å; E414-W524 WeakPolarHBondContact OE2-CZ3 3.18Å; I448-W524 HydrophobicContact CD1-CD2 3.96Å; I448-W524 HydrophobicContact CD1-CE3 3.34Å; I448-W524 HydrophobicContact CD1-CH2 4.04Å; I448-W524 HydrophobicContact CD1-CZ3 3.39Å; I448-W524 HydrophobicContact CG2-CZ3 4.21Å; L520-W524 WeakPolarHBondContact O-CB 3.47Å; L520-W524 PolarHBondContact O-N 3.22Å; I521-W524 PolarHBondContact O-N 3.32Å; S522-W524 PolarHBondContact O-N 2.87Å; W524-M526 VanDerWaalsContact C-N 3.3Å; W524-M526 PolarHBondContact O-N 3.47Å; W524-D527 PolarHBondContact O-N 3.49Å; W524-K528 HydrophobicContact CD2-CD 4.28Å; W524-K528 HydrophobicContact CE3-CD 4.22Å; W524-K528 HydrophobicContact CH2-CD 3.89Å; W524-K528 HydrophobicContact CZ2-CD 3.88Å; W524-K528 HydrophobicContact CZ3-CD 4.03Å; W524-K528 PolarHBondContact O-N 3.31Å
525V85.4Confident85.5Confident0 Ų015.4 Ų15.40%08%0.082CC..Hα-helixtrans-61-42.2176.7171.70000110.2L410 I413 E414 N417 I521 S522 F529L410-V525 HydrophobicContact CD2-CB 4.28Å; L410-V525 HydrophobicContact CD2-CG1 4.13Å; I413-V525 HydrophobicContact CB-CG1 3.84Å; I413-V525 HydrophobicContact CG2-CG1 3.43Å; I413-V525 VanDerWaalsContact CG2-CG1 3.43Å; E414-V525 HydrophobicContact CB-CG1 4.15Å; E414-V525 HydrophobicContact CB-CG2 4.17Å; E414-V525 HydrophobicContact CG-CG2 4.44Å; N417-V525 PolarHBondContact ND2-O 3.23Å; I521-V525 HydrophobicContact CG2-CG2 4.2Å; I521-V525 WeakPolarHBondContact O-CB 3.28Å; I521-V525 VanDerWaalsContact O-CG2 3.29Å; I521-V525 WeakPolarHBondContact O-CG2 3.22Å; I521-V525 PolarHBondContact O-N 3.46Å; S522-V525 PolarHBondContact O-N 3.48Å; V525-F529 WeakPolarHBondContact O-CB 3.38Å; V525-F529 PolarHBondContact O-N 3.44Å
526M88.7Confident86.1Confident0 Ų014.7 Ų14.70%08%0.078CC..Hα-helixtrans-69.7-41.2178.8-69.9-57.2-6700113I413 A488 W489 S522 W524 K528 F529 F530I413-M526 HydrophobicContact CD1-SD 3.86Å; A488-M526 HydrophobicContact CB-CG 4.33Å; A488-M526 HydrophobicContact CB-SD 3.77Å; W489-M526 HydrophobicContact CH2-CB 3.56Å; W489-M526 HydrophobicContact CH2-CG 3.94Å; W489-M526 HydrophobicContact CZ2-CB 3.85Å; W489-M526 HydrophobicContact CZ2-CE 3.78Å; W489-M526 HydrophobicContact CZ2-CG 3.94Å; W489-M526 HydrophobicContact CZ3-CB 4.16Å; W489-M526 HydrophobicContact CZ3-CG 4.27Å; S522-M526 WeakPolarHBondContact O-CB 3.38Å; S522-M526 VanDerWaalsContact O-CG 3.23Å; S522-M526 WeakPolarHBondContact O-CG 3.36Å; S522-M526 PolarHBondContact O-N 2.99Å; W524-M526 VanDerWaalsContact C-N 3.3Å; W524-M526 PolarHBondContact O-N 3.47Å; M526-K528 VanDerWaalsContact C-N 3.31Å; M526-K528 PolarHBondContact O-N 3.35Å; M526-F529 HydrophobicContact CE-CD1 4.17Å; M526-F529 WeakPolarHBondContact O-CB 3.48Å; M526-F529 PolarHBondContact O-N 3.28Å; M526-F529 VanDerWaalsContact O-N 3.09Å; M526-F530 WeakPolarHBondContact O-CD2 3.37Å; M526-F530 PolarHBondContact O-N 2.88Å
527D86.8Confident86.6Confident22 Ų2214.2 Ų14.212%0.1188%0.076CC..Hα-helixtrans-61-41.4176.6-177.342.3000112F434 L523 W524 F529 F530 A531 L628 R635F434-D527 HydrophobicContact CE2-CB 4.22Å; L523-D527 PolarHBondContact O-N 3.24Å; W524-D527 PolarHBondContact O-N 3.49Å; D527-F529 VanDerWaalsContact C-N 3.33Å; D527-F529 PolarHBondContact O-N 3.35Å; D527-F530 PolarHBondContact O-N 2.97Å; D527-A531 PolarHBondContact O-N 3.44Å; D527-A531 VanDerWaalsContact O-N 3.15Å; D527-L628 HydrophobicContact CB-CD1 3.98Å; D527-R635 IonicContact OD1-CZ 3.97Å; D527-R635 IonicContact OD1-NH1 2.81Å; D527-R635 PolarHBondContact OD1-NH1 3.32Å; D527-R635 IonicContact OD1-NH2 3.35Å; D527-R635 PolarHBondContact OD1-NH2 3.4Å; D527-R635 IonicContact OD2-NH2 2.93Å
528K85.3Confident87.2Confident73 Ų7313.5 Ų13.532%0.3177%0.074SC..Hα-helixtrans-61.8-41.3171.8-79.2-172.5165-169.70112.4N417 W524 M526 F530 A531 V532N417-K528 HydrophobicContact CB-CB 4.25Å; N417-K528 HydrophobicContact CB-CD 4.45Å; N417-K528 WeakPolarHBondContact ND2-CB 3.3Å; W524-K528 HydrophobicContact CD2-CD 4.28Å; W524-K528 HydrophobicContact CE3-CD 4.22Å; W524-K528 HydrophobicContact CH2-CD 3.89Å; W524-K528 HydrophobicContact CZ2-CD 3.88Å; W524-K528 HydrophobicContact CZ3-CD 4.03Å; W524-K528 PolarHBondContact O-N 3.31Å; M526-K528 VanDerWaalsContact C-N 3.31Å; M526-K528 PolarHBondContact O-N 3.35Å; K528-F530 PolarHBondContact O-N 3.26Å; K528-A531 WeakPolarHBondContact O-CB 3.16Å; K528-A531 PolarHBondContact O-N 2.99Å; K528-A531 VanDerWaalsContact O-N 3.12Å; K528-V532 WeakPolarHBondContact O-CG2 3.39Å; K528-V532 PolarHBondContact O-N 2.9Å
529F90.4Very high87.7Confident1 Ų114 Ų140%0.0048%0.075CC..Hα-helixtrans-60.6-44.4178.2-177.7-114.3000111.9I413 L416 N417 I478 L481 M482 V525 M526 D527 A531 V532 L533 L571I413-F529 HydrophobicContact CG2-CB 3.57Å; I413-F529 HydrophobicContact CG2-CD2 3.67Å; I413-F529 HydrophobicContact CG2-CG 3.7Å; L416-F529 HydrophobicContact CD2-CD2 3.95Å; L416-F529 HydrophobicContact CD2-CE2 4.04Å; N417-F529 WeakPolarHBondContact OD1-CA 3.46Å; N417-F529 PolarHBondContact OD1-N 3.31Å; I478-F529 HydrophobicContact CG2-CE2 4.22Å; I478-F529 HydrophobicContact CG2-CZ 3.91Å; L481-F529 HydrophobicContact CB-CZ 4.34Å; L481-F529 HydrophobicContact CD1-CE2 4.46Å; M482-F529 HydrophobicContact CG-CE1 4.14Å; M482-F529 HydrophobicContact CG-CZ 4.1Å; V525-F529 WeakPolarHBondContact O-CB 3.38Å; V525-F529 PolarHBondContact O-N 3.44Å; M526-F529 HydrophobicContact CE-CD1 4.17Å; M526-F529 WeakPolarHBondContact O-CB 3.48Å; M526-F529 PolarHBondContact O-N 3.28Å; M526-F529 VanDerWaalsContact O-N 3.09Å; D527-F529 VanDerWaalsContact C-N 3.33Å; D527-F529 PolarHBondContact O-N 3.35Å; F529-A531 VanDerWaalsContact C-N 3.3Å; F529-A531 PolarHBondContact O-N 3.49Å; F529-V532 PolarHBondContact O-N 3.16Å; F529-L533 VanDerWaalsContact O-CB 3.26Å; F529-L533 WeakPolarHBondContact O-CB 3.46Å; F529-L533 PolarHBondContact O-N 3.38Å; F529-L571 HydrophobicContact CE1-CD1 3.99Å
530F90.2Very high88.1Confident0 Ų014 Ų140%08%0.076CC..Hα-helixtrans-58.3-41.4172.6-76.6-72.7000112.7W489 M526 D527 K528 S534 W568 L571 L572 I575 L628 N632W489-F530 HydrophobicContact CH2-CE2 4.27Å; W489-F530 AromaticContact CZ2-CE2 3.9Å; W489-F530 HydrophobicContact CZ2-CE2 3.9Å; W489-F530 HydrophobicContact CZ2-CZ 4.32Å; M526-F530 WeakPolarHBondContact O-CD2 3.37Å; M526-F530 PolarHBondContact O-N 2.88Å; D527-F530 PolarHBondContact O-N 2.97Å; K528-F530 PolarHBondContact O-N 3.26Å; F530-S534 WeakPolarHBondContact O-CB 3.42Å; F530-S534 PolarHBondContact O-N 3.07Å; F530-S534 PolarHBondContact O-OG 3.37Å; F530-S534 VanDerWaalsContact O-OG 3.06Å; F530-W568 HydrophobicContact CD1-CH2 4.41Å; F530-W568 HydrophobicContact CD1-CZ3 4.45Å; F530-L571 HydrophobicContact CD1-CD2 3.85Å; F530-L571 HydrophobicContact CE1-CD2 2.93Å; F530-L571 HydrophobicContact CE1-CG 4.42Å; F530-L571 HydrophobicContact CE2-CD2 4.25Å; F530-L571 HydrophobicContact CZ-CD2 3.17Å; F530-L571 HydrophobicContact CZ-CG 4.5Å; F530-L572 HydrophobicContact CD1-CD2 4.27Å; F530-L572 HydrophobicContact CE1-CD2 3.52Å; F530-L572 HydrophobicContact CE1-CG 4.31Å; F530-L572 HydrophobicContact CZ-CD2 4.13Å; F530-I575 HydrophobicContact CE2-CD1 4.31Å; F530-I575 HydrophobicContact CZ-CD1 3.86Å; F530-I575 HydrophobicContact CZ-CG1 4.13Å; F530-L628 HydrophobicContact CE2-CD2 4.16Å; F530-N632 WeakPolarHBondContact CB-OD1 3.32Å; F530-N632 WeakPolarHBondContact CE1-ND2 3.49Å; F530-N632 WeakPolarHBondContact CE2-ND2 3.41Å; F530-N632 WeakPolarHBondContact CG-OD1 3.5Å; F530-N632 WeakPolarHBondContact CZ-ND2 3.5Å
531A88.1Confident88.5Confident31 Ų3113.5 Ų13.526%0.2567%0.073SC..Hα-helixtrans-65-45.7178.300000111.9D527 K528 F529 S534 S535D527-A531 PolarHBondContact O-N 3.44Å; D527-A531 VanDerWaalsContact O-N 3.15Å; K528-A531 WeakPolarHBondContact O-CB 3.16Å; K528-A531 PolarHBondContact O-N 2.99Å; K528-A531 VanDerWaalsContact O-N 3.12Å; F529-A531 VanDerWaalsContact C-N 3.3Å; F529-A531 PolarHBondContact O-N 3.49Å; A531-S534 PolarHBondContact O-OG 3.31Å; A531-S535 WeakPolarHBondContact O-CB 3.29Å; A531-S535 PolarHBondContact O-N 2.94Å; A531-S535 PolarHBondContact O-OG 3.3Å
532V88.9Confident88.9Confident13 Ų1317.4 Ų17.48%0.0799%0.087CC..Hα-helixtrans-64.1-45177.1173.10000111L416 L420 K528 F529 S535 L536L416-V532 HydrophobicContact CD2-CG1 3.81Å; L420-V532 HydrophobicContact CB-CG1 3.88Å; L420-V532 HydrophobicContact CD1-CG1 4.01Å; K528-V532 WeakPolarHBondContact O-CG2 3.39Å; K528-V532 PolarHBondContact O-N 2.9Å; F529-V532 PolarHBondContact O-N 3.16Å; V532-S535 PolarHBondContact O-N 3.41Å; V532-L536 WeakPolarHBondContact O-CB 3.41Å; V532-L536 PolarHBondContact O-N 3.46Å
533L91.3Very high89Confident1 Ų118.6 Ų18.61%0.00510%0.095CC..Hα-helixtrans-59.3-49.7178.1178.154.9000111.8I478 M482 F529 S535 L536 L537 L564 W568I478-L533 HydrophobicContact CG2-CD1 3.87Å; M482-L533 HydrophobicContact SD-CD1 4.43Å; M482-L533 HydrophobicContact SD-CD2 3.64Å; F529-L533 VanDerWaalsContact O-CB 3.26Å; F529-L533 WeakPolarHBondContact O-CB 3.46Å; F529-L533 PolarHBondContact O-N 3.38Å; L533-S535 VanDerWaalsContact C-N 3.32Å; L533-S535 PolarHBondContact O-N 2.5Å; L533-L536 PolarHBondContact O-N 3.48Å; L533-L537 HydrophobicContact CD1-CD1 4.35Å; L533-L537 HydrophobicContact CG-CD1 4.39Å; L533-L537 WeakPolarHBondContact O-CB 2.9Å; L533-L537 PolarHBondContact O-N 3.13Å; L533-L564 HydrophobicContact CD1-CB 4.34Å; L533-L564 HydrophobicContact CD1-CD1 4.39Å; L533-L564 HydrophobicContact CD1-CD2 3.77Å; L533-L564 HydrophobicContact CD1-CG 4.38Å; L533-W568 HydrophobicContact CB-CZ3 4.32Å; L533-W568 HydrophobicContact CD2-CE3 3.52Å; L533-W568 HydrophobicContact CD2-CZ3 3.52Å; L533-W568 HydrophobicContact CG-CE3 3.9Å; L533-W568 HydrophobicContact CG-CZ3 3.65Å
534S91.3Very high89Confident6 Ų620.6 Ų20.64%0.04210%0.104CC..Hα-helixtrans-61.9-39.4177.462.30000112.6F530 A531 I538F530-S534 WeakPolarHBondContact O-CB 3.42Å; F530-S534 PolarHBondContact O-N 3.07Å; F530-S534 PolarHBondContact O-OG 3.37Å; F530-S534 VanDerWaalsContact O-OG 3.06Å; A531-S534 PolarHBondContact O-OG 3.31Å; S534-I538 VanDerWaalsContact O-CG1 3.32Å; S534-I538 WeakPolarHBondContact O-CG1 3.35Å; S534-I538 PolarHBondContact O-N 3.36Å; S534-I538 VanDerWaalsContact O-N 3.1Å
535S90.1Very high89.1Confident41 Ų4119.8 Ų19.829%0.28710%0.104SC..Hα-helixtrans-69.3-38.4178-56.60000112.1A531 V532 L533 I538 Q539A531-S535 WeakPolarHBondContact O-CB 3.29Å; A531-S535 PolarHBondContact O-N 2.94Å; A531-S535 PolarHBondContact O-OG 3.3Å; V532-S535 PolarHBondContact O-N 3.41Å; L533-S535 VanDerWaalsContact C-N 3.32Å; L533-S535 PolarHBondContact O-N 2.5Å; S535-I538 PolarHBondContact O-N 2.9Å; S535-Q539 PolarHBondContact O-N 3.39Å
536L90.8Very high88.9Confident1 Ų124.1 Ų24.11%0.00512%0.124CC..Hα-helixtrans-66.5-43.5176-18065.9000111.2L463 L466 L471 I478 V532 L533 I538 Q539 C540 L564L463-L536 HydrophobicContact CD2-CB 4.43Å; L463-L536 HydrophobicContact CD2-CD1 4.06Å; L466-L536 HydrophobicContact CD1-CD1 3.57Å; L471-L536 HydrophobicContact CD2-CD1 4.37Å; I478-L536 HydrophobicContact CD1-CD2 3.21Å; V532-L536 WeakPolarHBondContact O-CB 3.41Å; V532-L536 PolarHBondContact O-N 3.46Å; L533-L536 PolarHBondContact O-N 3.48Å; L536-I538 PolarHBondContact O-N 3.31Å; L536-Q539 PolarHBondContact O-N 2.96Å; L536-Q539 VanDerWaalsContact O-N 3.13Å; L536-C540 PolarHBondContact O-N 3.33Å; L536-C540 PolarHBondContact O-SG 3.19Å; L536-L564 HydrophobicContact CD2-CD1 3.78Å; L536-L564 HydrophobicContact CG-CD1 3.99Å
537L92.3Very high88.2Confident0 Ų025.5 Ų25.50%013%0.133CC..Hα-helixtrans-56-48.8173.8-85.5167.3000111.3L533 Q539 C540 I541 L564 F565 W568 L639L533-L537 HydrophobicContact CD1-CD1 4.35Å; L533-L537 HydrophobicContact CG-CD1 4.39Å; L533-L537 WeakPolarHBondContact O-CB 2.9Å; L533-L537 PolarHBondContact O-N 3.13Å; L537-Q539 VanDerWaalsContact C-N 3.27Å; L537-Q539 PolarHBondContact O-N 2.85Å; L537-C540 PolarHBondContact O-N 3.5Å; L537-I541 WeakPolarHBondContact O-CB 3.31Å; L537-I541 WeakPolarHBondContact O-CD1 3.24Å; L537-I541 VanDerWaalsContact O-CG1 3.23Å; L537-I541 WeakPolarHBondContact O-CG1 3.42Å; L537-I541 PolarHBondContact O-N 3.18Å; L537-L564 HydrophobicContact CD2-CB 3.49Å; L537-L564 VanDerWaalsContact CD2-CB 3.49Å; L537-L564 HydrophobicContact CD2-CD1 4.05Å; L537-L564 HydrophobicContact CD2-CG 4.43Å; L537-L564 HydrophobicContact CG-CB 4.02Å; L537-L564 HydrophobicContact CG-CD1 4.13Å; L537-F565 HydrophobicContact CD1-CD1 4.22Å; L537-F565 HydrophobicContact CD1-CE1 3.96Å; L537-F565 HydrophobicContact CD1-CZ 4.31Å; L537-F565 HydrophobicContact CD2-CD1 4.35Å; L537-F565 HydrophobicContact CD2-CD2 3.89Å; L537-F565 HydrophobicContact CD2-CE1 4.33Å; L537-F565 HydrophobicContact CD2-CE2 3.87Å; L537-F565 HydrophobicContact CD2-CG 4.15Å; L537-F565 HydrophobicContact CD2-CZ 4.1Å; L537-W568 HydrophobicContact CD1-CE3 4.23Å; L537-L639 HydrophobicContact CB-CD2 3.92Å; L537-L639 HydrophobicContact CD1-CD1 4.25Å; L537-L639 HydrophobicContact CD1-CD2 4.36Å
538I91.6Very high87.2Confident21 Ų2127 Ų2711%0.10815%0.145CC..Hα-helixtrans-57.5-42.5176-70.2169.4000110.9S534 S535 L536 R542 Q638 L639 F642S534-I538 VanDerWaalsContact O-CG1 3.32Å; S534-I538 WeakPolarHBondContact O-CG1 3.35Å; S534-I538 PolarHBondContact O-N 3.36Å; S534-I538 VanDerWaalsContact O-N 3.1Å; S535-I538 PolarHBondContact O-N 2.9Å; L536-I538 PolarHBondContact O-N 3.31Å; I538-R542 VanDerWaalsContact O-CB 3.31Å; I538-R542 WeakPolarHBondContact O-CB 3.38Å; I538-R542 PolarHBondContact O-N 3.26Å; I538-Q638 HydrophobicContact CD1-CG 4.34Å; I538-L639 HydrophobicContact CD1-CD2 4.38Å; I538-L639 HydrophobicContact CG1-CD2 3.86Å; I538-F642 HydrophobicContact CB-CD1 4.36Å; I538-F642 HydrophobicContact CB-CE1 4.41Å; I538-F642 HydrophobicContact CG1-CD1 4.24Å; I538-F642 HydrophobicContact CG1-CG 4.35Å; I538-F642 HydrophobicContact CG2-CD1 3.97Å; I538-F642 HydrophobicContact CG2-CD2 4.25Å; I538-F642 HydrophobicContact CG2-CE1 3.74Å; I538-F642 HydrophobicContact CG2-CE2 4.03Å; I538-F642 HydrophobicContact CG2-CG 4.22Å; I538-F642 HydrophobicContact CG2-CZ 3.77Å; I538-F642 WeakPolarHBondContact O-CE1 3.46Å
539Q89.5Confident86Confident21 Ų2129 Ų2910%0.09816%0.164CC..Hα-helixtrans-66.8-42.1178.1-177.160.818.500112.4L463 S535 L536 L537 R542 V543L463-Q539 HydrophobicContact CB-CG 4.48Å; S535-Q539 PolarHBondContact O-N 3.39Å; L536-Q539 PolarHBondContact O-N 2.96Å; L536-Q539 VanDerWaalsContact O-N 3.13Å; L537-Q539 VanDerWaalsContact C-N 3.27Å; L537-Q539 PolarHBondContact O-N 2.85Å; Q539-R542 WeakPolarHBondContact O-CB 3.25Å; Q539-R542 PolarHBondContact O-N 3.44Å; Q539-V543 WeakPolarHBondContact O-CG2 3.41Å; Q539-V543 PolarHBondContact O-N 3.28Å
540C91.2Very high84.5Confident1 Ų136 Ų361%0.00720%0.196CC..Hα-helixtrans-64-45.2177.3-60.90000110.8L536 L537 R542 V543 Q544 V561L536-C540 PolarHBondContact O-N 3.33Å; L536-C540 PolarHBondContact O-SG 3.19Å; L537-C540 PolarHBondContact O-N 3.5Å; C540-R542 VanDerWaalsContact C-N 3.29Å; C540-R542 PolarHBondContact O-N 3Å; C540-V543 PolarHBondContact O-N 3.05Å; C540-Q544 WeakPolarHBondContact O-CB 3.25Å; C540-Q544 PolarHBondContact O-N 3.4Å; C540-V561 HydrophobicContact CB-CG2 3.52Å
541I91Very high83.7Confident1 Ų139.1 Ų39.11%0.00521%0.213CC..Hα-helixtrans-59.6-42175.1-66163.4000110.5L537 Q544 T545 V561 F565 F642 Y643 S646L537-I541 WeakPolarHBondContact O-CB 3.31Å; L537-I541 WeakPolarHBondContact O-CD1 3.24Å; L537-I541 VanDerWaalsContact O-CG1 3.23Å; L537-I541 WeakPolarHBondContact O-CG1 3.42Å; L537-I541 PolarHBondContact O-N 3.18Å; I541-Q544 PolarHBondContact O-N 2.85Å; I541-T545 WeakPolarHBondContact O-CG2 3.24Å; I541-T545 PolarHBondContact O-N 3.45Å; I541-T545 PolarHBondContact O-OG1 3.27Å; I541-V561 HydrophobicContact CG1-CG1 4.23Å; I541-V561 HydrophobicContact CG1-CG2 3.8Å; I541-F565 HydrophobicContact CD1-CE2 4.21Å; I541-F565 HydrophobicContact CD1-CZ 4.41Å; I541-F642 HydrophobicContact CB-CD1 4.25Å; I541-F642 HydrophobicContact CB-CE1 4.03Å; I541-F642 HydrophobicContact CD1-CD1 4.45Å; I541-F642 HydrophobicContact CG2-CD1 3.91Å; I541-F642 HydrophobicContact CG2-CE1 3.78Å; I541-Y643 HydrophobicContact CD1-CD2 3.96Å; I541-Y643 HydrophobicContact CG1-CD2 4.42Å; I541-S646 WeakPolarHBondContact CG2-OG 3.23Å
542R89.2Confident83.3Confident88 Ų8843.5 Ų43.533%0.33223%0.233SC..Hα-helixtrans-61.7-48.2177.1-179.2-177.6166.2-162.1-4.4111.6E464 I538 Q539 C540 Q544 T545 E546 F642E464-R542 IonicContact OE1-NH1 3.37Å; I538-R542 VanDerWaalsContact O-CB 3.31Å; I538-R542 WeakPolarHBondContact O-CB 3.38Å; I538-R542 PolarHBondContact O-N 3.26Å; Q539-R542 WeakPolarHBondContact O-CB 3.25Å; Q539-R542 PolarHBondContact O-N 3.44Å; C540-R542 VanDerWaalsContact C-N 3.29Å; C540-R542 PolarHBondContact O-N 3Å; R542-Q544 VanDerWaalsContact C-N 3.32Å; R542-Q544 PolarHBondContact O-N 3.01Å; R542-T545 PolarHBondContact O-N 3.18Å; R542-T545 PolarHBondContact O-OG1 2.72Å; R542-E546 WeakPolarHBondContact CG-OE1 3.36Å; R542-E546 IonicContact CZ-OE1 3.64Å; R542-E546 IonicContact NE-OE1 3.91Å; R542-E546 PolarHBondContact NE-OE1 2.97Å; R542-E546 IonicContact NH2-OE1 3.99Å; R542-E546 PolarHBondContact NH2-OE1 3.26Å; R542-E546 WeakPolarHBondContact O-CG 3.16Å; R542-E546 PolarHBondContact O-N 3.1Å; R542-F642 HydrophobicContact CB-CE1 4.44Å; R542-F642 HydrophobicContact CB-CZ 4.25Å
543V87.1Confident83Confident25 Ų2546.3 Ų46.315%0.15225%0.247CC..Hα-helixtrans-60.1-44.7177173.60000110.4L471 Q539 C540 T545 E546 C547 A557L471-V543 HydrophobicContact CD1-CB 4.33Å; L471-V543 HydrophobicContact CD1-CG1 4.22Å; L471-V543 HydrophobicContact CD1-CG2 4.35Å; Q539-V543 WeakPolarHBondContact O-CG2 3.41Å; Q539-V543 PolarHBondContact O-N 3.28Å; C540-V543 PolarHBondContact O-N 3.05Å; V543-T545 VanDerWaalsContact C-N 3.29Å; V543-T545 PolarHBondContact O-N 2.9Å; V543-E546 PolarHBondContact O-N 3.13Å; V543-C547 PolarHBondContact O-N 3.38Å; V543-A557 HydrophobicContact CB-CB 4.19Å; V543-A557 HydrophobicContact CG1-CB 3.92Å
544Q87.3Confident82.6Confident44 Ų4446.7 Ų46.721%0.20625%0.251CS..Hα-helixtrans-56.6-41.1176-171.1-176.62.500112C540 I541 R542 A557 H558C540-Q544 WeakPolarHBondContact O-CB 3.25Å; C540-Q544 PolarHBondContact O-N 3.4Å; I541-Q544 PolarHBondContact O-N 2.85Å; R542-Q544 VanDerWaalsContact C-N 3.32Å; R542-Q544 PolarHBondContact O-N 3.01Å; Q544-A557 HydrophobicContact CB-CB 4.15Å; Q544-H558 HydrophobicContact CG-CB 4.4Å; Q544-H558 PolarHBondContact NE2-ND1 3.1Å
545T84.7Confident82.3Confident26 Ų2653 Ų5316%0.1628%0.28CS..Hα-helixtrans-73.5-24.4176.455.30000115I541 R542 V543 S646I541-T545 WeakPolarHBondContact O-CG2 3.24Å; I541-T545 PolarHBondContact O-N 3.45Å; I541-T545 PolarHBondContact O-OG1 3.27Å; R542-T545 PolarHBondContact O-N 3.18Å; R542-T545 PolarHBondContact O-OG1 2.72Å; V543-T545 VanDerWaalsContact C-N 3.29Å; V543-T545 PolarHBondContact O-N 2.9Å; T545-S646 WeakPolarHBondContact CG2-O 3.4Å
546E82Confident82.2Confident91 Ų9153.3 Ų53.343%0.42528%0.278SS..Hα-helixtrans-86.5-18.8179.6-72179.2-167.700112.2R542 V543 R656R542-E546 WeakPolarHBondContact CG-OE1 3.36Å; R542-E546 IonicContact CZ-OE1 3.64Å; R542-E546 IonicContact NE-OE1 3.91Å; R542-E546 PolarHBondContact NE-OE1 2.97Å; R542-E546 IonicContact NH2-OE1 3.99Å; R542-E546 PolarHBondContact NH2-OE1 3.26Å; R542-E546 WeakPolarHBondContact O-CG 3.16Å; R542-E546 PolarHBondContact O-N 3.1Å; V543-E546 PolarHBondContact O-N 3.13Å; E546-R656 PolarHBondContact O-NH1 3.03Å; E546-R656 PolarHBondContact O-NH2 2.93Å
547C74.3Confident82.2Confident28 Ų2853.2 Ų53.219%0.18928%0.278CS..SBendtrans-84.9149.7175.5-74.60000111.7V543 D551V543-C547 PolarHBondContact O-N 3.38Å; C547-D551 HydrophobicContact CB-CB 4.05Å
548S64.3Low82.1Confident53 Ų5355.1 Ų55.137%0.37129%0.287SS..  trans-78.1161.3167.763.80000110.5E550 D551S548-E550 PolarHBondContact O-N 2.96Å; S548-D551 PolarHBondContact N-OD2 2.8Å; S548-D551 PolarHBondContact O-N 3.16Å; S548-D551 VanDerWaalsContact O-N 3.08Å; S548-D551 PolarHBondContact OG-OD1 3.48Å; S548-D551 PolarHBondContact OG-OD2 3.38Å
549T60.3Low82Confident115 Ų11557.8 Ų57.871%0.70630%0.299SS*.THydrogen-bonded Turntrans-58.1-28.5-17839.70000113.2E664T549-E664 PolarHBondContact OG1-OE1 2.95Å
550E60Low82.1Confident148 Ų14856.8 Ų56.869%0.69229%0.294SS*.THydrogen-bonded Turntrans-88.5-4.8179-60-172.6157.100114.3S548 D552S548-E550 PolarHBondContact O-N 2.96Å; E550-D552 PolarHBondContact O-N 3.09Å
551D71.9Confident82.3Confident67 Ų6756.8 Ų56.836%0.35829%0.294SS..  trans-80.3118.8-177.6-71.1-44.2000110.8C547 S548 N553 G554 Q555C547-D551 HydrophobicContact CB-CB 4.05Å; S548-D551 PolarHBondContact N-OD2 2.8Å; S548-D551 PolarHBondContact O-N 3.16Å; S548-D551 VanDerWaalsContact O-N 3.08Å; S548-D551 PolarHBondContact OG-OD1 3.48Å; S548-D551 PolarHBondContact OG-OD2 3.38Å; D551-N553 PolarHBondContact O-N 3.4Å; D551-G554 WeakPolarHBondContact O-CA 3.35Å; D551-G554 PolarHBondContact O-N 3Å; D551-Q555 PolarHBondContact O-N 2.91Å
552D79.4Confident82.4Confident123 Ų12357.6 Ų57.666%0.65830%0.298SS*.Hα-helixtrans-46.4-34.8171.7-69.6-23.2000112.1E550 G554 Q555 L556E550-D552 PolarHBondContact O-N 3.09Å; D552-G554 VanDerWaalsContact C-N 3.35Å; D552-G554 PolarHBondContact O-N 3.27Å; D552-Q555 PolarHBondContact O-N 3.06Å; D552-L556 VanDerWaalsContact O-CG 3.3Å; D552-L556 WeakPolarHBondContact O-CG 3.48Å; D552-L556 PolarHBondContact O-N 3.47Å
553N83.6Confident82.5Confident71 Ų7156.5 Ų56.538%0.3829%0.293SS..Hα-helixtrans-64.2-36.4178-63.5-30000113.2P468 D551 A557P468-N553 HydrophobicContact CB-CB 3.78Å; P468-N553 WeakPolarHBondContact CB-OD1 3.37Å; P468-N553 HydrophobicContact CG-CB 3.92Å; P468-N553 WeakPolarHBondContact CG-OD1 3.37Å; D551-N553 PolarHBondContact O-N 3.4Å; N553-A557 WeakPolarHBondContact O-CB 3.29Å; N553-A557 PolarHBondContact O-N 3.19Å
554G82.8Confident82.7Confident10 Ų1055.3 Ų55.310%0.10329%0.286CS..Hα-helixtrans-68.2-40.3176.500000111.4D551 D552 A557 H558D551-G554 WeakPolarHBondContact O-CA 3.35Å; D551-G554 PolarHBondContact O-N 3Å; D552-G554 VanDerWaalsContact C-N 3.35Å; D552-G554 PolarHBondContact O-N 3.27Å; G554-A557 PolarHBondContact O-N 2.96Å; G554-H558 WeakPolarHBondContact O-CB 3.3Å; G554-H558 PolarHBondContact O-N 3.4Å
555Q85.5Confident82.9Confident139 Ų13953.2 Ų53.265%0.6528%0.277SS*.Hα-helixtrans-65.5-44.1175.9-16817512.800111.7D551 D552 A557 H558 E559D551-Q555 PolarHBondContact O-N 2.91Å; D552-Q555 PolarHBondContact O-N 3.06Å; Q555-A557 VanDerWaalsContact C-N 3.3Å; Q555-A557 PolarHBondContact O-N 3.25Å; Q555-H558 PolarHBondContact O-N 3.16Å; Q555-E559 WeakPolarHBondContact O-CB 3.44Å; Q555-E559 PolarHBondContact O-N 2.85Å
556L88Confident82.9Confident46 Ų4655.3 Ų55.324%0.24129%0.287CS..Hα-helixtrans-61.2-38.6174.5-68.6169.7000112.3P468 D552 A560P468-L556 HydrophobicContact CB-CD1 4.42Å; D552-L556 VanDerWaalsContact O-CG 3.3Å; D552-L556 WeakPolarHBondContact O-CG 3.48Å; D552-L556 PolarHBondContact O-N 3.47Å; L556-A560 WeakPolarHBondContact O-CB 3.17Å; L556-A560 PolarHBondContact O-N 3.14Å; L556-A560 VanDerWaalsContact O-N 3.07Å
557A90.1Very high82.8Confident0 Ų051.3 Ų51.30%027%0.269CS..Hα-helixtrans-68.5-40.8175.700000111.8L471 V543 Q544 N553 G554 Q555 A560 V561L471-A557 HydrophobicContact CD1-CB 4.06Å; V543-A557 HydrophobicContact CB-CB 4.19Å; V543-A557 HydrophobicContact CG1-CB 3.92Å; Q544-A557 HydrophobicContact CB-CB 4.15Å; N553-A557 WeakPolarHBondContact O-CB 3.29Å; N553-A557 PolarHBondContact O-N 3.19Å; G554-A557 PolarHBondContact O-N 2.96Å; Q555-A557 VanDerWaalsContact C-N 3.3Å; Q555-A557 PolarHBondContact O-N 3.25Å; A557-A560 WeakPolarHBondContact O-CB 3.49Å; A557-A560 PolarHBondContact O-N 3.44Å; A557-V561 WeakPolarHBondContact O-CG2 3.47Å; A557-V561 PolarHBondContact O-N 3.36Å
558H90Very high83.3Confident39 Ų3950 Ų5018%0.18126%0.26CS..Hα-helixtrans-62.2-47.8174.8176.846.8000111.6Q544 G554 Q555 A560 V561 E562 S677Q544-H558 HydrophobicContact CG-CB 4.4Å; Q544-H558 PolarHBondContact NE2-ND1 3.1Å; G554-H558 WeakPolarHBondContact O-CB 3.3Å; G554-H558 PolarHBondContact O-N 3.4Å; Q555-H558 PolarHBondContact O-N 3.16Å; H558-A560 PolarHBondContact O-N 3.36Å; H558-V561 WeakPolarHBondContact O-CB 3.35Å; H558-V561 PolarHBondContact O-N 2.82Å; H558-E562 IonicContact CE1-OE1 3.08Å; H558-E562 PolarHBondContact CE1-OE1 2.96Å; H558-E562 VanDerWaalsContact CE1-OE1 3.3Å; H558-E562 IonicContact ND1-OE1 2.58Å; H558-E562 PolarHBondContact O-N 3.33Å; H558-S677 PolarHBondContact CE1-O 3.15Å; H558-S677 PolarHBondContact NE2-O 2.85Å
559E90.1Very high84.1Confident78 Ų7848.3 Ų48.336%0.36425%0.248SC..Hα-helixtrans-56.4-40.4175.8-164.2-157.8146.500111.5Q555 R563Q555-E559 WeakPolarHBondContact O-CB 3.44Å; Q555-E559 PolarHBondContact O-N 2.85Å; E559-R563 WeakPolarHBondContact O-CB 3.43Å; E559-R563 PolarHBondContact O-N 3.35Å; E559-R563 VanDerWaalsContact O-N 3.1Å; E559-R563 IonicContact OE1-CZ 3.29Å; E559-R563 IonicContact OE1-NH1 2.98Å; E559-R563 PolarHBondContact OE1-NH1 3.48Å; E559-R563 IonicContact OE1-NH2 2.67Å; E559-R563 PolarHBondContact OE1-NH2 3.2Å
560A91.9Very high85.1Confident0 Ų047.4 Ų47.40%024%0.239CC..Hα-helixtrans-65.3-41.7174.900000112.6L471 L556 A557 H558 L564L471-A560 HydrophobicContact CB-CB 3.99Å; L471-A560 WeakPolarHBondContact O-CB 3.5Å; L556-A560 WeakPolarHBondContact O-CB 3.17Å; L556-A560 PolarHBondContact O-N 3.14Å; L556-A560 VanDerWaalsContact O-N 3.07Å; A557-A560 WeakPolarHBondContact O-CB 3.49Å; A557-A560 PolarHBondContact O-N 3.44Å; H558-A560 PolarHBondContact O-N 3.36Å; A560-L564 VanDerWaalsContact O-CB 3.31Å; A560-L564 WeakPolarHBondContact O-CB 3.45Å; A560-L564 WeakPolarHBondContact O-CG 3.36Å; A560-L564 PolarHBondContact O-N 3.31Å
561V93.8Very high86.2Confident0 Ų040.5 Ų40.50%021%0.207CC..Hα-helixtrans-62.4-50.7177.7169.60000111C540 I541 A557 H558 R563 L564 F565C540-V561 HydrophobicContact CB-CG2 3.52Å; I541-V561 HydrophobicContact CG1-CG1 4.23Å; I541-V561 HydrophobicContact CG1-CG2 3.8Å; A557-V561 WeakPolarHBondContact O-CG2 3.47Å; A557-V561 PolarHBondContact O-N 3.36Å; H558-V561 WeakPolarHBondContact O-CB 3.35Å; H558-V561 PolarHBondContact O-N 2.82Å; V561-R563 PolarHBondContact O-N 2.9Å; V561-L564 PolarHBondContact O-N 3.03Å; V561-F565 HydrophobicContact CG1-CD2 3.56Å; V561-F565 HydrophobicContact CG1-CE2 3.73Å; V561-F565 WeakPolarHBondContact O-CB 3.35Å; V561-F565 WeakPolarHBondContact O-CD2 3.41Å; V561-F565 PolarHBondContact O-N 3.34Å
562E93.6Very high86.8Confident19 Ų1938.3 Ų38.39%0.08920%0.195CC..Hα-helixtrans-60.1-48.2-179.6-64-51.1128.900110.9H558 L564 F565 N566 D680 S681H558-E562 IonicContact CE1-OE1 3.08Å; H558-E562 PolarHBondContact CE1-OE1 2.96Å; H558-E562 VanDerWaalsContact CE1-OE1 3.3Å; H558-E562 IonicContact ND1-OE1 2.58Å; H558-E562 PolarHBondContact O-N 3.33Å; E562-L564 PolarHBondContact O-N 2.56Å; E562-F565 PolarHBondContact O-N 3.26Å; E562-F565 VanDerWaalsContact O-N 3.16Å; E562-N566 WeakPolarHBondContact O-CB 3.39Å; E562-N566 PolarHBondContact O-N 2.96Å; E562-D680 HydrophobicContact CB-CB 4.5Å; E562-D680 WeakPolarHBondContact OE2-CB 3.07Å; E562-D680 PolarHBondContact OE2-N 3.27Å; E562-S681 WeakPolarHBondContact OE1-CB 3.36Å; E562-S681 PolarHBondContact OE1-OG 3.45Å; E562-S681 WeakPolarHBondContact OE2-CB 3.48Å; E562-S681 PolarHBondContact OE2-N 3.26Å; E562-S681 PolarHBondContact OE2-OG 2.92Å
563R91.3Very high86.9Confident64 Ų6439.1 Ų39.124%0.24220%0.199CC..Hα-helixtrans-63.5-38.5-179.8-171.3170.3-63106-2.9113.3S475 F479 E559 V561S475-R563 PolarHBondContact OG-NH1 2.91Å; S475-R563 VanDerWaalsContact OG-NH1 3.11Å; F479-R563 HydrophobicContact CB-CG 3.83Å; F479-R563 HydrophobicContact CD1-CG 4.47Å; F479-R563 HydrophobicContact CD2-CG 3.99Å; F479-R563 WeakPolarHBondContact CD2-O 3.41Å; F479-R563 HydrophobicContact CG-CG 3.86Å; E559-R563 WeakPolarHBondContact O-CB 3.43Å; E559-R563 PolarHBondContact O-N 3.35Å; E559-R563 VanDerWaalsContact O-N 3.1Å; E559-R563 IonicContact OE1-CZ 3.29Å; E559-R563 IonicContact OE1-NH1 2.98Å; E559-R563 PolarHBondContact OE1-NH1 3.48Å; E559-R563 IonicContact OE1-NH2 2.67Å; E559-R563 PolarHBondContact OE1-NH2 3.2Å; V561-R563 PolarHBondContact O-N 2.9Å
564L91.7Very high86.9Confident0 Ų038.9 Ų38.90%020%0.198CC..Hα-helixtrans-71.7-31.9177-71.7179000112.3I478 M482 L533 L536 L537 A560 V561 E562I478-L564 HydrophobicContact CB-CD2 3.77Å; I478-L564 HydrophobicContact CD1-CD2 4.24Å; I478-L564 HydrophobicContact CG2-CD2 3.51Å; M482-L564 HydrophobicContact CE-CD2 4.37Å; L533-L564 HydrophobicContact CD1-CB 4.34Å; L533-L564 HydrophobicContact CD1-CD1 4.39Å; L533-L564 HydrophobicContact CD1-CD2 3.77Å; L533-L564 HydrophobicContact CD1-CG 4.38Å; L536-L564 HydrophobicContact CD2-CD1 3.78Å; L536-L564 HydrophobicContact CG-CD1 3.99Å; L537-L564 HydrophobicContact CD2-CB 3.49Å; L537-L564 VanDerWaalsContact CD2-CB 3.49Å; L537-L564 HydrophobicContact CD2-CD1 4.05Å; L537-L564 HydrophobicContact CD2-CG 4.43Å; L537-L564 HydrophobicContact CG-CB 4.02Å; L537-L564 HydrophobicContact CG-CD1 4.13Å; A560-L564 VanDerWaalsContact O-CB 3.31Å; A560-L564 WeakPolarHBondContact O-CB 3.45Å; A560-L564 WeakPolarHBondContact O-CG 3.36Å; A560-L564 PolarHBondContact O-N 3.31Å; V561-L564 PolarHBondContact O-N 3.03Å; E562-L564 PolarHBondContact O-N 2.56Å
565F91.8Very high86.9Confident1 Ų138.7 Ų38.70%0.00419%0.194CC..Hα-helixtrans-78.3-31.3177-87.9-51.7000113.7L537 I541 V561 E562 C567 W568 Y643 S681 A684 V685L537-F565 HydrophobicContact CD1-CD1 4.22Å; L537-F565 HydrophobicContact CD1-CE1 3.96Å; L537-F565 HydrophobicContact CD1-CZ 4.31Å; L537-F565 HydrophobicContact CD2-CD1 4.35Å; L537-F565 HydrophobicContact CD2-CD2 3.89Å; L537-F565 HydrophobicContact CD2-CE1 4.33Å; L537-F565 HydrophobicContact CD2-CE2 3.87Å; L537-F565 HydrophobicContact CD2-CG 4.15Å; L537-F565 HydrophobicContact CD2-CZ 4.1Å; I541-F565 HydrophobicContact CD1-CE2 4.21Å; I541-F565 HydrophobicContact CD1-CZ 4.41Å; V561-F565 HydrophobicContact CG1-CD2 3.56Å; V561-F565 HydrophobicContact CG1-CE2 3.73Å; V561-F565 WeakPolarHBondContact O-CB 3.35Å; V561-F565 WeakPolarHBondContact O-CD2 3.41Å; V561-F565 PolarHBondContact O-N 3.34Å; E562-F565 PolarHBondContact O-N 3.26Å; E562-F565 VanDerWaalsContact O-N 3.16Å; F565-C567 VanDerWaalsContact C-N 3.3Å; F565-C567 PolarHBondContact O-N 3.45Å; F565-C567 VanDerWaalsContact O-N 3.14Å; F565-W568 HydrophobicContact CD1-CB 4.29Å; F565-W568 HydrophobicContact CD1-CG 4.45Å; F565-W568 WeakPolarHBondContact O-CB 3.25Å; F565-W568 PolarHBondContact O-N 3.43Å; F565-Y643 HydrophobicContact CE2-CD2 4.2Å; F565-Y643 HydrophobicContact CE2-CE2 4.46Å; F565-S681 VanDerWaalsContact CD2-CB 3.42Å; F565-A684 HydrophobicContact CB-CB 3.67Å; F565-A684 HydrophobicContact CD1-CB 3.33Å; F565-A684 HydrophobicContact CE1-CB 4.17Å; F565-A684 HydrophobicContact CG-CB 3.75Å; F565-V685 HydrophobicContact CE1-CG2 4.1Å; F565-V685 HydrophobicContact CE2-CG2 3.98Å; F565-V685 HydrophobicContact CZ-CG2 3.63Å
566N85.3Confident86.7Confident69 Ų6932.5 Ų32.537%0.36917%0.166SC..Hα-helixtrans-46.4-47.2-176.3-172.8-45.8000113.5F479 E562 D680F479-N566 HydrophobicContact CE2-CB 4.11Å; E562-N566 WeakPolarHBondContact O-CB 3.39Å; E562-N566 PolarHBondContact O-N 2.96Å; N566-D680 HydrophobicContact CB-CB 4.2Å; N566-D680 WeakPolarHBondContact CB-OD2 3.29Å; N566-D680 PolarHBondContact ND2-OD2 3.05Å
567C79.5Confident85.7Confident8 Ų832.8 Ų32.85%0.05417%0.172CC..THydrogen-bonded Turntrans-103.59.8178.6-66.90000115F479 M482 F565 S569 D570 L571F479-C567 HydrophobicContact CD2-CB 4.47Å; F479-C567 HydrophobicContact CE2-CB 4.28Å; F479-C567 WeakPolarHBondContact CE2-SG 3.45Å; M482-C567 HydrophobicContact CB-CB 4.24Å; M482-C567 HydrophobicContact CE-CB 4.25Å; F565-C567 VanDerWaalsContact C-N 3.3Å; F565-C567 PolarHBondContact O-N 3.45Å; F565-C567 VanDerWaalsContact O-N 3.14Å; C567-S569 PolarHBondContact O-N 2.69Å; C567-D570 PolarHBondContact O-N 2.98Å; C567-L571 VanDerWaalsContact O-CB 3.25Å; C567-L571 WeakPolarHBondContact O-CB 3.32Å; C567-L571 PolarHBondContact O-N 2.97Å
568W85.5Confident84Confident0 Ų035.8 Ų35.80%019%0.193CC..Hα-helixtrans-61.4-47-176172.2-97.3000112.1F530 L533 L537 F565 L571 L572 Q636 L639 A684 C688F530-W568 HydrophobicContact CD1-CH2 4.41Å; F530-W568 HydrophobicContact CD1-CZ3 4.45Å; L533-W568 HydrophobicContact CB-CZ3 4.32Å; L533-W568 HydrophobicContact CD2-CE3 3.52Å; L533-W568 HydrophobicContact CD2-CZ3 3.52Å; L533-W568 HydrophobicContact CG-CE3 3.9Å; L533-W568 HydrophobicContact CG-CZ3 3.65Å; L537-W568 HydrophobicContact CD1-CE3 4.23Å; F565-W568 HydrophobicContact CD1-CB 4.29Å; F565-W568 HydrophobicContact CD1-CG 4.45Å; F565-W568 WeakPolarHBondContact O-CB 3.25Å; F565-W568 PolarHBondContact O-N 3.43Å; W568-L571 PolarHBondContact O-N 3.26Å; W568-L572 HydrophobicContact CZ2-CD1 4.23Å; W568-L572 PolarHBondContact O-N 3.28Å; W568-Q636 HydrophobicContact CZ2-CG 4.08Å; W568-L639 HydrophobicContact CH2-CD1 3.83Å; W568-L639 HydrophobicContact CZ2-CD1 3.6Å; W568-L639 HydrophobicContact CZ3-CD1 4.42Å; W568-A684 HydrophobicContact CB-CB 4.43Å; W568-C688 PolarHBondContact NE1-SG 3.23Å
569S80.4Confident81.9Confident18 Ų1838.5 Ų38.513%0.12621%0.208CC..Hα-helixtrans-65.1-47179.6-64.50000111.6C567 L571 L572 D573 S687C567-S569 PolarHBondContact O-N 2.69Å; S569-L571 VanDerWaalsContact C-N 3.27Å; S569-L571 PolarHBondContact O-N 3.1Å; S569-L572 WeakPolarHBondContact O-CB 3.5Å; S569-L572 PolarHBondContact O-N 3.22Å; S569-L572 VanDerWaalsContact O-N 3.12Å; S569-D573 PolarHBondContact O-N 3.1Å; S569-D573 VanDerWaalsContact O-N 3.1Å; S569-S687 WeakPolarHBondContact OG-CB 3.36Å; S569-S687 PolarHBondContact OG-OG 3.44Å
570D80.6Confident79.5Confident96 Ų9638 Ų3851%0.51321%0.214SC..Hα-helixtrans-58.8-40.4178.2-68.4-13.8000111.9C567 L572 D573 L574C567-D570 PolarHBondContact O-N 2.98Å; D570-L572 VanDerWaalsContact C-N 3.3Å; D570-L572 PolarHBondContact O-N 3.49Å; D570-D573 PolarHBondContact O-N 3.4Å; D570-D573 VanDerWaalsContact O-N 3.17Å; D570-L574 WeakPolarHBondContact O-CG 3.26Å; D570-L574 PolarHBondContact O-N 3.15Å
571L84.2Confident76.7Confident3 Ų345.8 Ų45.82%0.01625%0.25CC..Hα-helixtrans-65.4-33.2179.8-172.8146.2000112.6M482 F529 F530 C567 W568 S569M482-L571 HydrophobicContact CB-CD1 3.66Å; M482-L571 HydrophobicContact CG-CD1 3.43Å; M482-L571 VanDerWaalsContact CG-CD1 3.43Å; M482-L571 HydrophobicContact SD-CD1 3.96Å; F529-L571 HydrophobicContact CE1-CD1 3.99Å; F530-L571 HydrophobicContact CD1-CD2 3.85Å; F530-L571 HydrophobicContact CE1-CD2 2.93Å; F530-L571 HydrophobicContact CE1-CG 4.42Å; F530-L571 HydrophobicContact CE2-CD2 4.25Å; F530-L571 HydrophobicContact CZ-CD2 3.17Å; F530-L571 HydrophobicContact CZ-CG 4.5Å; C567-L571 VanDerWaalsContact O-CB 3.25Å; C567-L571 WeakPolarHBondContact O-CB 3.32Å; C567-L571 PolarHBondContact O-N 2.97Å; W568-L571 PolarHBondContact O-N 3.26Å; S569-L571 VanDerWaalsContact C-N 3.27Å; S569-L571 PolarHBondContact O-N 3.1Å
572L84.4Confident73.9Confident21 Ų2153 Ų5311%0.1128%0.284CS..Hα-helixtrans-72.1-36.2173.4-70.2171.2000112.1F530 W568 S569 D570 L574 I575 N632 Q636F530-L572 HydrophobicContact CD1-CD2 4.27Å; F530-L572 HydrophobicContact CE1-CD2 3.52Å; F530-L572 HydrophobicContact CE1-CG 4.31Å; F530-L572 HydrophobicContact CZ-CD2 4.13Å; W568-L572 HydrophobicContact CZ2-CD1 4.23Å; W568-L572 PolarHBondContact O-N 3.28Å; S569-L572 WeakPolarHBondContact O-CB 3.5Å; S569-L572 PolarHBondContact O-N 3.22Å; S569-L572 VanDerWaalsContact O-N 3.12Å; D570-L572 VanDerWaalsContact C-N 3.3Å; D570-L572 PolarHBondContact O-N 3.49Å; L572-L574 VanDerWaalsContact C-N 3.27Å; L572-L574 PolarHBondContact O-N 2.92Å; L572-I575 HydrophobicContact CD2-CD1 4.02Å; L572-I575 WeakPolarHBondContact O-CB 3.22Å; L572-I575 WeakPolarHBondContact O-CG1 3.33Å; L572-I575 PolarHBondContact O-N 2.83Å; L572-N632 HydrophobicContact CD2-CB 3.91Å; L572-N632 WeakPolarHBondContact CD2-ND2 3.44Å; L572-Q636 HydrophobicContact CD1-CG 4.03Å
573D81Confident71Confident139 Ų13953.3 Ų53.374%0.74329%0.289SS*.Hα-helixtrans-68.5-27.3177-77.8-22.2000112.7S569 D570 I575S569-D573 PolarHBondContact O-N 3.1Å; S569-D573 VanDerWaalsContact O-N 3.1Å; D570-D573 PolarHBondContact O-N 3.4Å; D570-D573 VanDerWaalsContact O-N 3.17Å; D573-I575 PolarHBondContact O-N 3.36Å
574L82.7Confident68.4Low67 Ų6757.9 Ų57.935%0.35131%0.306SS..THydrogen-bonded Turntrans-69.9-12.7173.7-72.1174.3000114.4S485 D570 L572 P576S485-L574 VanDerWaalsContact OG-CD1 3.31Å; S485-L574 WeakPolarHBondContact OG-CD1 3.34Å; D570-L574 WeakPolarHBondContact O-CG 3.26Å; D570-L574 PolarHBondContact O-N 3.15Å; L572-L574 VanDerWaalsContact C-N 3.27Å; L572-L574 PolarHBondContact O-N 2.92Å; L574-P576 VanDerWaalsContact O-CD 3.32Å; L574-P576 WeakPolarHBondContact O-CD 3.33Å
575I83.8Confident65.8Low6 Ų661.6 Ų61.63%0.03133%0.332CS..SBendtrans-62.6122.3177-62.2168.9000108.7W489 F530 L572 D573 S577 L625 L628 R629 N632W489-I575 HydrophobicContact CH2-CG1 4.37Å; W489-I575 HydrophobicContact CZ2-CG1 3.87Å; F530-I575 HydrophobicContact CE2-CD1 4.31Å; F530-I575 HydrophobicContact CZ-CD1 3.86Å; F530-I575 HydrophobicContact CZ-CG1 4.13Å; L572-I575 HydrophobicContact CD2-CD1 4.02Å; L572-I575 WeakPolarHBondContact O-CB 3.22Å; L572-I575 WeakPolarHBondContact O-CG1 3.33Å; L572-I575 PolarHBondContact O-N 2.83Å; D573-I575 PolarHBondContact O-N 3.36Å; I575-S577 PolarHBondContact O-N 3.35Å; I575-L625 HydrophobicContact CG2-CD2 4.14Å; I575-L628 HydrophobicContact CD1-CD2 3.69Å; I575-L628 HydrophobicContact CG1-CD2 4.34Å; I575-L628 HydrophobicContact CG2-CD2 4.31Å; I575-R629 HydrophobicContact CG2-CG 4.34Å; I575-R629 PolarHBondContact O-NH2 3.05Å; I575-N632 WeakPolarHBondContact CD1-ND2 3.32Å
576P81.1Confident63Low9 Ų968.8 Ų68.86%0.05837%0.366CS..PPolyproline II helixtrans-52.3132.6-176.8-3036000112.7W489 V492 E493 L496 L574 L625 R629W489-P576 HydrophobicContact CB-CG 3.93Å; W489-P576 HydrophobicContact CD2-CG 4.35Å; W489-P576 HydrophobicContact CE3-CG 4.25Å; W489-P576 HydrophobicContact CG-CG 4.25Å; V492-P576 HydrophobicContact CB-CG 4.49Å; V492-P576 HydrophobicContact CG1-CG 4.19Å; E493-P576 HydrophobicContact CG-CB 4.2Å; E493-P576 HydrophobicContact CG-CG 3.82Å; L496-P576 HydrophobicContact CD1-CB 3.84Å; L574-P576 VanDerWaalsContact O-CD 3.32Å; L574-P576 WeakPolarHBondContact O-CD 3.33Å; P576-L625 HydrophobicContact CB-CD1 4.29Å; P576-R629 PolarHBondContact O-NH2 3.45Å
577S67.8Low60.5Low51 Ų5171.6 Ų71.636%0.35738%0.375SS..PPolyproline II helixtrans-92.9144.5179.870.70000111.5I575 L579I575-S577 PolarHBondContact O-N 3.35Å; S577-L579 VanDerWaalsContact C-N 3.27Å; S577-L579 PolarHBondContact O-N 3.09Å
578S53Low58.5Low63 Ų6374.5 Ų74.544%0.44139%0.39SS..SBendtrans-80-3.5-172.657.60000114.7K622S578-K622 PolarHBondContact O-NZ 3.31Å
579L45.6Very low55.9Low96 Ų9681.3 Ų81.350%0.50342%0.421SS..SBendtrans-126.7129.4-168.1-73.9147.3000109.6S577 E581 A583S577-L579 VanDerWaalsContact C-N 3.27Å; S577-L579 PolarHBondContact O-N 3.09Å; L579-E581 PolarHBondContact O-N 2.9Å; L579-A583 HydrophobicContact CD2-CB 4.32Å
580S41.4Very low53.3Low69 Ų6986.7 Ų86.748%0.48345%0.449SS..  trans-59.4138.6173.166.70000109.6Q582 A583S580-Q582 PolarHBondContact O-N 3.36Å; S580-A583 WeakPolarHBondContact O-CB 3.28Å; S580-A583 PolarHBondContact O-N 2.79Å
581E33.3Very low51Low162 Ų16289.2 Ų89.276%0.75746%0.461SS*.Hα-helixtrans-48.9-29.2-179.6-69174.5143.300114.1L579 A583 R584L579-E581 PolarHBondContact O-N 2.9Å; E581-A583 PolarHBondContact O-N 3.41Å; E581-R584 PolarHBondContact O-N 3.47Å; E581-R584 VanDerWaalsContact O-N 3.11Å
582Q33.2Very low48.3Very low153 Ų15395 Ų9572%0.71550%0.497SS*.Hα-helixtrans-61-21.3173.2-75.6178.8-22.400114.6S580 S585 Q586S580-Q582 PolarHBondContact O-N 3.36Å; Q582-S585 PolarHBondContact O-OG 3.29Å; Q582-Q586 PolarHBondContact O-N 2.86Å
583A33.7Very low45.5Very low24 Ų2498.4 Ų98.420%0.19853%0.529CS..Hα-helixtrans-88-21.6175.800000113.1L579 S580 E581 S585 K587L579-A583 HydrophobicContact CD2-CB 4.32Å; S580-A583 WeakPolarHBondContact O-CB 3.28Å; S580-A583 PolarHBondContact O-N 2.79Å; E581-A583 PolarHBondContact O-N 3.41Å; A583-S585 VanDerWaalsContact C-N 3.26Å; A583-S585 PolarHBondContact O-N 3.28Å; A583-K587 VanDerWaalsContact O-CB 3.26Å; A583-K587 WeakPolarHBondContact O-CB 3.34Å; A583-K587 PolarHBondContact O-N 3.26Å
584R37.1Very low43.1Very low161 Ų16199.8 Ų99.861%0.60853%0.534SS*.Hα-helixtrans-66.2-31.2172.6-92.3180170.1163.4-6.8111.5E581 N588E581-R584 PolarHBondContact O-N 3.47Å; E581-R584 VanDerWaalsContact O-N 3.11Å; R584-N588 PolarHBondContact O-ND2 2.88Å
585S35.6Very low40.5Very low78 Ų78102.9 Ų102.955%0.54555%0.551SS.*Hα-helixtrans-86.6-32.4175.759.90000113.7Q582 A583Q582-S585 PolarHBondContact O-OG 3.29Å; A583-S585 VanDerWaalsContact C-N 3.26Å; A583-S585 PolarHBondContact O-N 3.28Å
586Q33.6Very low37.8Very low151 Ų151108.3 Ų108.371%0.70659%0.589SS**Hα-helixtrans-97.2-22.7-176-74-174.6-19.400115.9Q582Q582-Q586 PolarHBondContact O-N 2.86Å
587K32.5Very low35.1Very low128 Ų128112.8 Ų112.856%0.55762%0.617SS**G310 helixtrans-93.1-6.6-179.6-113.6-177.3-179.6-171.20115A583 H589 N590A583-K587 VanDerWaalsContact O-CB 3.26Å; A583-K587 WeakPolarHBondContact O-CB 3.34Å; A583-K587 PolarHBondContact O-N 3.26Å; K587-H589 PolarHBondContact O-N 3.42Å; K587-H589 VanDerWaalsContact O-N 3.12Å; K587-N590 PolarHBondContact O-N 3.31Å
588N37.8Very low33.3Very low69 Ų69116.4 Ų116.437%0.36963%0.632SS.*G310 helixtrans-67.2-1.9163.9-74.4-5.8000113R584 Y769R584-N588 PolarHBondContact O-ND2 2.88Å; N588-Y769 PolarHBondContact ND2-OH 3.27Å
589H31.6Very low32.3Very low143 Ų143121.1 Ų121.166%0.66265%0.652SS**G310 helixtrans-100.7-4175-78.1-52000115.2K587K587-H589 PolarHBondContact O-N 3.42Å; K587-H589 VanDerWaalsContact O-N 3.12Å
590N25.4Very low31.7Very low131 Ų131123.6 Ų123.670%0.70167%0.666SS**  trans-155.665.1177.6-77.6-46.6000112.6K587K587-N590 PolarHBondContact O-N 3.31Å
591L31.5Very low31.3Very low149 Ų149127.3 Ų127.378%0.7868%0.681SS**  trans-110.568159.7-84.4158.2000108.2
592T27.8Very low31.6Very low124 Ų124122.5 Ų122.576%0.76167%0.665SS**  trans-112.9121.3160.9520000106.5
593A26.4Very low32.2Very low94 Ų94119.7 Ų119.778%0.77766%0.66SS**  trans75.599.7-177.300000115.4
594I31.3Very low32.7Very low167 Ų167125.6 Ų125.686%0.85669%0.688SS**  -154.7114.3111.4-86.5145.6000106.5
595D26.9Very low33.4Very low132 Ų132119.9 Ų119.971%0.70667%0.671SS**  trans-55.9154.8170.6-80.2-49000112.2T597D595-T597 PolarHBondContact O-N 3.11Å
596S27.7Very low34.1Very low120 Ų120124.6 Ų124.684%0.83969%0.689SS**SBendtrans-59.479.2160.755.10000111.7
597T25Very low35.3Very low104 Ų104119.4 Ų119.464%0.63867%0.668SS**  trans-156.7137.6158.646.80000108.1D595D595-T597 PolarHBondContact O-N 3.11Å
598D29.6Very low36.5Very low127 Ų127119.4 Ų119.468%0.67968%0.679SS**  trans84.994.5171.2-54.1-15.5000114.3
599D31.1Very low37.8Very low161 Ų161118.6 Ų118.686%0.86169%0.687SS**SBend25.111171.5-87.1-14.6000112.4
600D32.3Very low39.2Very low149 Ų149118.8 Ų118.880%0.79769%0.688SS**  trans89.86.1170.5-74.1-19.9000122.8S602D600-S602 VanDerWaalsContact C-N 3.33Å; D600-S602 PolarHBondContact O-N 3.31Å; D600-S602 VanDerWaalsContact O-N 3.09Å
601N35Very low41.1Very low146 Ų146114.8 Ų114.878%0.78167%0.668SS**  trans-88.967167.3-81.9-35.9000113.3
602S39.7Very low42.9Very low61 Ų61111.3 Ų111.343%0.42765%0.648SS.*  trans-63.2126.3155.856.50000108.4D600 L604D600-S602 VanDerWaalsContact C-N 3.33Å; D600-S602 PolarHBondContact O-N 3.31Å; D600-S602 VanDerWaalsContact O-N 3.09Å; S602-L604 PolarHBondContact O-N 2.94Å
603P44.8Very low45.1Very low94 Ų94108.1 Ų108.161%0.6163%0.626SS**  trans-58.2118.8168.224.6-29.4000107P605 Q619P603-P605 VanDerWaalsContact O-N 3.12Å; P603-Q619 PolarHBondContact O-NE2 2.96Å
604L45.2Very low47.3Very low149 Ų149103.9 Ų103.978%0.7859%0.591SS**  trans-45.7125.4172.9-93.596000107.4S602 L606S602-L604 PolarHBondContact O-N 2.94Å; L604-L606 PolarHBondContact O-N 2.88Å
605P49.8Very low49.5Very low41 Ų4197.3 Ų97.327%0.26656%0.558SS.*  trans-62.5106.6172.924.8-29.8000106.4P603 T607 Q612P603-P605 VanDerWaalsContact O-N 3.12Å; P605-T607 PolarHBondContact O-N 3.21Å; P605-T607 VanDerWaalsContact O-N 3.08Å; P605-Q612 HydrophobicContact CB-CG 4.37Å; P605-Q612 HydrophobicContact CG-CG 4.26Å
606L52.3Low52Low176 Ų17695 Ų9592%0.92154%0.542SS*.  trans-68.74.8172.9-78.2158.4000111.6L604L604-L606 PolarHBondContact O-N 2.88Å
607T57.9Low54.6Low42 Ų4289.5 Ų89.526%0.25850%0.504SS..  trans-99.8130-179.555.70000110.4P605 V611 Q612 D615P605-T607 PolarHBondContact O-N 3.21Å; P605-T607 VanDerWaalsContact O-N 3.08Å; T607-V611 HydrophobicContact CG2-CG1 3.99Å; T607-Q612 WeakPolarHBondContact O-CB 3.4Å; T607-Q612 WeakPolarHBondContact O-CG 3.29Å; T607-D615 VanDerWaalsContact CB-OD2 3.29Å; T607-D615 WeakPolarHBondContact CB-OD2 3.22Å; T607-D615 WeakPolarHBondContact CG2-OD2 3.32Å; T607-D615 PolarHBondContact OG1-OD2 2.98Å
608T57.9Low57.3Low129 Ų12984.8 Ų84.879%0.79148%0.475SS*.  trans-111.1142.4176.255.90000109.9
609G65.5Low59.8Low52 Ų5281.4 Ų81.454%0.53646%0.455SS..SBendtrans98.7-153.7176.900000113.8V611 Q612G609-V611 PolarHBondContact O-N 3.17Å; G609-V611 VanDerWaalsContact O-N 3.16Å; G609-Q612 VanDerWaalsContact O-CB 3.3Å; G609-Q612 WeakPolarHBondContact O-CB 3.36Å; G609-Q612 PolarHBondContact O-N 3.42Å
610Q59.5Low62.2Low147 Ų14779.5 Ų79.569%0.68744%0.44SS*.Hα-helixtrans-59-27.1-177.8-73.6-176.8-28.900113.4Q612 N613Q610-Q612 VanDerWaalsContact C-N 3.32Å; Q610-Q612 PolarHBondContact O-N 3.49Å; Q610-N613 PolarHBondContact O-N 3.34Å
611V65.5Low64.7Low46 Ų4672.4 Ų72.428%0.27940%0.402SS..Hα-helixtrans-67.9-29.3177-174.50000112.6T607 G609 N613 S614 D615T607-V611 HydrophobicContact CG2-CG1 3.99Å; G609-V611 PolarHBondContact O-N 3.17Å; G609-V611 VanDerWaalsContact O-N 3.16Å; V611-N613 VanDerWaalsContact C-N 3.31Å; V611-N613 PolarHBondContact O-N 3.3Å; V611-S614 WeakPolarHBondContact CA-OG 3.38Å; V611-S614 PolarHBondContact O-N 2.96Å; V611-S614 PolarHBondContact O-OG 3.39Å; V611-D615 PolarHBondContact O-N 2.95Å
612Q70.2Confident67Low76 Ų7669.7 Ų69.736%0.35538%0.383SS..Hα-helixtrans-62.9-38.3178.9-169.2-177.72.500111.7P605 T607 G609 Q610 D615 Q616P605-Q612 HydrophobicContact CB-CG 4.37Å; P605-Q612 HydrophobicContact CG-CG 4.26Å; T607-Q612 WeakPolarHBondContact O-CB 3.4Å; T607-Q612 WeakPolarHBondContact O-CG 3.29Å; G609-Q612 VanDerWaalsContact O-CB 3.3Å; G609-Q612 WeakPolarHBondContact O-CB 3.36Å; G609-Q612 PolarHBondContact O-N 3.42Å; Q610-Q612 VanDerWaalsContact C-N 3.32Å; Q610-Q612 PolarHBondContact O-N 3.49Å; Q612-D615 PolarHBondContact O-N 2.99Å; Q612-Q616 VanDerWaalsContact O-CG 3.29Å; Q612-Q616 WeakPolarHBondContact O-CG 3.41Å; Q612-Q616 PolarHBondContact O-N 3.44Å
613N72.7Confident69.1Low57 Ų5773.3 Ų73.331%0.30539%0.391SS..Hα-helixtrans-68-45.6178.6-168.214.9000110.9S509 Q610 V611 D615 Q616 L617S509-N613 PolarHBondContact OG-ND2 3.28Å; Q610-N613 PolarHBondContact O-N 3.34Å; V611-N613 VanDerWaalsContact C-N 3.31Å; V611-N613 PolarHBondContact O-N 3.3Å; N613-D615 VanDerWaalsContact C-N 3.33Å; N613-D615 PolarHBondContact O-N 2.8Å; N613-Q616 PolarHBondContact O-N 3.35Å; N613-L617 WeakPolarHBondContact O-CG 3.28Å; N613-L617 PolarHBondContact O-N 3.05Å
614S74.5Confident70.9Confident6 Ų669.4 Ų69.44%0.04237%0.365CS..Hα-helixtrans-61.2-39.4175.143.40000113V611 L617 A618V611-S614 WeakPolarHBondContact CA-OG 3.38Å; V611-S614 PolarHBondContact O-N 2.96Å; V611-S614 PolarHBondContact O-OG 3.39Å; S614-L617 PolarHBondContact O-N 2.93Å; S614-A618 WeakPolarHBondContact O-CB 3.48Å; S614-A618 PolarHBondContact O-N 3.26Å
615D77Confident72.8Confident29 Ų2962.6 Ų62.616%0.15533%0.329CS..Hα-helixtrans-65.4-41.5176.5-83.9-29.3000112.2P499 T607 V611 Q612 N613 A618 Q619P499-D615 WeakPolarHBondContact CB-OD1 3.49Å; P499-D615 WeakPolarHBondContact CG-OD1 3.49Å; T607-D615 VanDerWaalsContact CB-OD2 3.29Å; T607-D615 WeakPolarHBondContact CB-OD2 3.22Å; T607-D615 WeakPolarHBondContact CG2-OD2 3.32Å; T607-D615 PolarHBondContact OG1-OD2 2.98Å; V611-D615 PolarHBondContact O-N 2.95Å; Q612-D615 PolarHBondContact O-N 2.99Å; N613-D615 VanDerWaalsContact C-N 3.33Å; N613-D615 PolarHBondContact O-N 2.8Å; D615-A618 PolarHBondContact O-N 3.19Å; D615-Q619 WeakPolarHBondContact O-CB 3.44Å; D615-Q619 VanDerWaalsContact O-CG 3.3Å; D615-Q619 WeakPolarHBondContact O-CG 3.36Å; D615-Q619 PolarHBondContact O-N 3.44Å
616Q80Confident74.3Confident82 Ų8262.1 Ų62.138%0.38333%0.332SS..Hα-helixtrans-63-42.6176.2-76.1177.70.100112.1Q612 N613 Q619 K620Q612-Q616 VanDerWaalsContact O-CG 3.29Å; Q612-Q616 WeakPolarHBondContact O-CG 3.41Å; Q612-Q616 PolarHBondContact O-N 3.44Å; N613-Q616 PolarHBondContact O-N 3.35Å; Q616-Q619 PolarHBondContact O-N 3.14Å; Q616-K620 WeakPolarHBondContact O-CG 3.48Å; Q616-K620 PolarHBondContact O-N 3.44Å
617L80.8Confident75.8Confident6 Ų655.8 Ų55.83%0.03130%0.299CS..Hα-helixtrans-63.4-44.9176.2-67.2177.5000111.5C512 F516 N613 S614 Q619 K620 M621C512-L617 HydrophobicContact CB-CD1 4.31Å; F516-L617 HydrophobicContact CB-CD1 4.16Å; F516-L617 HydrophobicContact CB-CD2 4.24Å; F516-L617 HydrophobicContact CD1-CD2 3.89Å; F516-L617 HydrophobicContact CD2-CB 3.9Å; F516-L617 HydrophobicContact CD2-CD2 3.96Å; F516-L617 HydrophobicContact CD2-CG 4.43Å; F516-L617 HydrophobicContact CE1-CD2 4.19Å; F516-L617 HydrophobicContact CE2-CB 4.42Å; F516-L617 HydrophobicContact CE2-CD2 4.29Å; F516-L617 WeakPolarHBondContact CE2-O 3.38Å; F516-L617 HydrophobicContact CG-CB 4.35Å; F516-L617 HydrophobicContact CG-CD2 3.76Å; F516-L617 HydrophobicContact CG-CG 4.43Å; F516-L617 HydrophobicContact CZ-CD2 4.41Å; N613-L617 WeakPolarHBondContact O-CG 3.28Å; N613-L617 PolarHBondContact O-N 3.05Å; S614-L617 PolarHBondContact O-N 2.93Å; L617-Q619 PolarHBondContact O-N 3.14Å; L617-K620 PolarHBondContact O-N 3.07Å; L617-M621 PolarHBondContact O-N 3.17Å
618A81.8Confident77.1Confident4 Ų453.8 Ų53.83%0.03329%0.286CS..Hα-helixtrans-62.8-41175.800000112.1P499 S614 D615 M621 K622P499-A618 HydrophobicContact CG-CB 3.94Å; S614-A618 WeakPolarHBondContact O-CB 3.48Å; S614-A618 PolarHBondContact O-N 3.26Å; D615-A618 PolarHBondContact O-N 3.19Å; A618-M621 PolarHBondContact O-N 3.26Å; A618-K622 WeakPolarHBondContact O-CG 3.35Å; A618-K622 PolarHBondContact O-N 2.93Å
619Q81.8Confident78.4Confident57 Ų5751.8 Ų51.827%0.26626%0.264SS..Hα-helixtrans-63.8-41.4175.5-76.8-177-5.100112.5P603 D615 Q616 L617 K622 K623P603-Q619 PolarHBondContact O-NE2 2.96Å; D615-Q619 WeakPolarHBondContact O-CB 3.44Å; D615-Q619 VanDerWaalsContact O-CG 3.3Å; D615-Q619 WeakPolarHBondContact O-CG 3.36Å; D615-Q619 PolarHBondContact O-N 3.44Å; Q616-Q619 PolarHBondContact O-N 3.14Å; L617-Q619 PolarHBondContact O-N 3.14Å; Q619-K622 PolarHBondContact O-N 3.11Å; Q619-K623 PolarHBondContact O-N 3.43Å; Q619-K623 VanDerWaalsContact O-N 3.09Å
620K82.2Confident79.3Confident121 Ų12154.5 Ų54.553%0.52627%0.267SS..Hα-helixtrans-59.4-47.7173.3-76.3179.9179.6-178.40111F516 Q616 L617 K622 K623 L624F516-K620 HydrophobicContact CE2-CB 4.08Å; F516-K620 HydrophobicContact CZ-CB 4.05Å; F516-K620 HydrophobicContact CZ-CD 4.36Å; Q616-K620 WeakPolarHBondContact O-CG 3.48Å; Q616-K620 PolarHBondContact O-N 3.44Å; L617-K620 PolarHBondContact O-N 3.07Å; K620-K622 VanDerWaalsContact C-N 3.3Å; K620-K622 PolarHBondContact O-N 3.45Å; K620-K623 PolarHBondContact O-N 3.12Å; K620-K623 VanDerWaalsContact O-N 3.17Å; K620-L624 WeakPolarHBondContact O-CG 3.47Å; K620-L624 PolarHBondContact O-N 3.31Å; K620-L624 VanDerWaalsContact O-N 3.11Å
621M85.1Confident80.6Confident0 Ų048.8 Ų48.80%024%0.243CC..Hα-helixtrans-58.6-41177-172.761.589.500112.1V492 V495 L496 F516 G519 L523 L617 A618 K623 L624 L625V492-M621 HydrophobicContact CG1-CE 4.41Å; V492-M621 HydrophobicContact CG1-CG 3.93Å; V492-M621 HydrophobicContact CG1-SD 3.99Å; V492-M621 HydrophobicContact CG2-CE 4.35Å; V495-M621 HydrophobicContact CB-CE 4.13Å; V495-M621 HydrophobicContact CG1-CB 3.85Å; V495-M621 HydrophobicContact CG1-CE 4.04Å; V495-M621 HydrophobicContact CG1-CG 4.09Å; V495-M621 HydrophobicContact CG2-CE 4.14Å; L496-M621 HydrophobicContact CD2-CB 4.32Å; L496-M621 HydrophobicContact CD2-CG 4.19Å; L496-M621 HydrophobicContact CG-CG 4.44Å; F516-M621 HydrophobicContact CE2-CB 4.36Å; G519-M621 VanDerWaalsContact C-CE 3.43Å; L523-M621 HydrophobicContact CD1-SD 3.73Å; L617-M621 PolarHBondContact O-N 3.17Å; A618-M621 PolarHBondContact O-N 3.26Å; M621-K623 PolarHBondContact O-N 2.79Å; M621-L624 PolarHBondContact O-N 3.41Å; M621-L625 HydrophobicContact CG-CD1 4.46Å; M621-L625 PolarHBondContact O-N 2.92Å
622K83.8Confident81.6Confident89 Ų8946.8 Ų46.839%0.38723%0.23SC..Hα-helixtrans-61.6-41.8175.5-72.4-179-176-1620113.1L496 S578 A618 Q619 K620 L624 L625 G626L496-K622 HydrophobicContact CD2-CD 4.42Å; L496-K622 HydrophobicContact CD2-CG 3.52Å; S578-K622 PolarHBondContact O-NZ 3.31Å; A618-K622 WeakPolarHBondContact O-CG 3.35Å; A618-K622 PolarHBondContact O-N 2.93Å; Q619-K622 PolarHBondContact O-N 3.11Å; K620-K622 VanDerWaalsContact C-N 3.3Å; K620-K622 PolarHBondContact O-N 3.45Å; K622-L624 VanDerWaalsContact C-N 3.33Å; K622-L625 PolarHBondContact O-N 3.35Å; K622-G626 PolarHBondContact O-N 2.94Å; K622-G626 VanDerWaalsContact O-N 3.1Å
623K82.6Confident82.4Confident136 Ų13645.2 Ų45.259%0.59123%0.228SC*.Hα-helixtrans-61.4-43.6175.7-73.6-172.7176.3-171.10111.2Q619 K620 M621 G626 L627Q619-K623 PolarHBondContact O-N 3.43Å; Q619-K623 VanDerWaalsContact O-N 3.09Å; K620-K623 PolarHBondContact O-N 3.12Å; K620-K623 VanDerWaalsContact O-N 3.17Å; M621-K623 PolarHBondContact O-N 2.79Å; K623-G626 PolarHBondContact O-N 3.36Å; K623-L627 PolarHBondContact O-N 3.04Å
624L82.2Confident83.2Confident13 Ų1345.1 Ų45.17%0.06823%0.232CC..Hα-helixtrans-64-41.5178.3-67.1176.6000112.6F434 L520 L523 K620 M621 K622 G626 L627 L628F434-L624 HydrophobicContact CD1-CD2 3.76Å; F434-L624 HydrophobicContact CE1-CB 3.87Å; F434-L624 HydrophobicContact CE1-CD2 3.6Å; F434-L624 HydrophobicContact CE1-CG 4.23Å; L520-L624 HydrophobicContact CD2-CD1 3.34Å; L523-L624 HydrophobicContact CD1-CB 3.95Å; K620-L624 WeakPolarHBondContact O-CG 3.47Å; K620-L624 PolarHBondContact O-N 3.31Å; K620-L624 VanDerWaalsContact O-N 3.11Å; M621-L624 PolarHBondContact O-N 3.41Å; K622-L624 VanDerWaalsContact C-N 3.33Å; L624-G626 VanDerWaalsContact C-N 3.28Å; L624-G626 PolarHBondContact O-N 3.21Å; L624-L627 PolarHBondContact O-N 3.36Å; L624-L628 PolarHBondContact O-N 3.26Å; L624-L628 VanDerWaalsContact O-N 3.1Å
625L85.2Confident83.9Confident5 Ų546.5 Ų46.53%0.02624%0.236CC..Hα-helixtrans-62.7-34.1173.3-76.3171.4000112.8W489 V492 L496 L523 I575 P576 M621 K622 L628 R629W489-L625 HydrophobicContact CZ3-CD2 4.34Å; V492-L625 HydrophobicContact CG1-CD1 3.85Å; V492-L625 HydrophobicContact CG1-CD2 4.16Å; V492-L625 HydrophobicContact CG1-CG 4.3Å; L496-L625 HydrophobicContact CD1-CD1 3.87Å; L496-L625 HydrophobicContact CD2-CD1 4.47Å; L523-L625 HydrophobicContact CD1-CD2 3.87Å; L523-L625 HydrophobicContact CD1-CG 4.05Å; I575-L625 HydrophobicContact CG2-CD2 4.14Å; P576-L625 HydrophobicContact CB-CD1 4.29Å; M621-L625 HydrophobicContact CG-CD1 4.46Å; M621-L625 PolarHBondContact O-N 2.92Å; K622-L625 PolarHBondContact O-N 3.35Å; L625-L628 PolarHBondContact O-N 3.17Å; L625-R629 WeakPolarHBondContact O-CG 3.27Å; L625-R629 PolarHBondContact O-N 3.38Å; L625-R629 VanDerWaalsContact O-N 3.1Å
626G82.8Confident84.6Confident32 Ų3246.5 Ų46.533%0.3324%0.235SC..Hα-helixtrans-62-42.4173.600000112.5K622 K623 L624 R629 N630K622-G626 PolarHBondContact O-N 2.94Å; K622-G626 VanDerWaalsContact O-N 3.1Å; K623-G626 PolarHBondContact O-N 3.36Å; L624-G626 VanDerWaalsContact C-N 3.28Å; L624-G626 PolarHBondContact O-N 3.21Å; G626-R629 PolarHBondContact O-N 2.97Å; G626-N630 PolarHBondContact O-N 3.43Å
627L82.6Confident85.2Confident42 Ų4243.2 Ų43.222%0.2222%0.221CC..Hα-helixtrans-65-44.4176.3-66.3176000112.1F434 L437 K623 L624 R629 N630 S631F434-L627 HydrophobicContact CZ-CB 4.35Å; L437-L627 HydrophobicContact CD1-CD1 3.66Å; K623-L627 PolarHBondContact O-N 3.04Å; L624-L627 PolarHBondContact O-N 3.36Å; L627-R629 VanDerWaalsContact C-N 3.3Å; L627-R629 PolarHBondContact O-N 3.44Å; L627-N630 PolarHBondContact O-N 3.09Å; L627-N630 VanDerWaalsContact O-N 3.15Å; L627-S631 PolarHBondContact O-N 2.93Å; L627-S631 PolarHBondContact O-OG 3.16Å
628L84.9Confident85.7Confident0 Ų045.8 Ų45.80%023%0.233CC..Hα-helixtrans-58.5-42.6177.3-174.9149.7000111.7F434 W489 L523 D527 F530 I575 L624 L625 N630 S631 N632F434-L628 HydrophobicContact CZ-CB 4.19Å; W489-L628 HydrophobicContact CH2-CD1 3.99Å; W489-L628 HydrophobicContact CH2-CD2 4.37Å; L523-L628 HydrophobicContact CD2-CD1 4.19Å; L523-L628 HydrophobicContact CG-CD1 4.08Å; D527-L628 HydrophobicContact CB-CD1 3.98Å; F530-L628 HydrophobicContact CE2-CD2 4.16Å; I575-L628 HydrophobicContact CD1-CD2 3.69Å; I575-L628 HydrophobicContact CG1-CD2 4.34Å; I575-L628 HydrophobicContact CG2-CD2 4.31Å; L624-L628 PolarHBondContact O-N 3.26Å; L624-L628 VanDerWaalsContact O-N 3.1Å; L625-L628 PolarHBondContact O-N 3.17Å; L628-N630 PolarHBondContact O-N 3.02Å; L628-S631 PolarHBondContact O-N 3.4Å; L628-N632 WeakPolarHBondContact CD2-ND2 3.11Å; L628-N632 PolarHBondContact O-N 3.16Å
629R85.7Confident86.2Confident88 Ų8845.6 Ų45.633%0.33223%0.231SC..Hα-helixtrans-60.8-43.6175.8-73.6176.5-177-100.7-2.9111.8I575 P576 L625 G626 L627 S631 N632 S633I575-R629 HydrophobicContact CG2-CG 4.34Å; I575-R629 PolarHBondContact O-NH2 3.05Å; P576-R629 PolarHBondContact O-NH2 3.45Å; L625-R629 WeakPolarHBondContact O-CG 3.27Å; L625-R629 PolarHBondContact O-N 3.38Å; L625-R629 VanDerWaalsContact O-N 3.1Å; G626-R629 PolarHBondContact O-N 2.97Å; L627-R629 VanDerWaalsContact C-N 3.3Å; L627-R629 PolarHBondContact O-N 3.44Å; R629-S631 PolarHBondContact O-N 3.44Å; R629-N632 PolarHBondContact O-N 3.34Å; R629-S633 PolarHBondContact O-N 3.2Å; R629-S633 PolarHBondContact O-OG 3.18Å
630N84.7Confident86.8Confident109 Ų10943 Ų4358%0.58322%0.219SC*.Hα-helixtrans-62.9-42.2177.6-66.7-13000112G626 L627 L628 N632 S633 S634G626-N630 PolarHBondContact O-N 3.43Å; L627-N630 PolarHBondContact O-N 3.09Å; L627-N630 VanDerWaalsContact O-N 3.15Å; L628-N630 PolarHBondContact O-N 3.02Å; N630-N632 VanDerWaalsContact C-N 3.34Å; N630-N632 PolarHBondContact O-N 3.35Å; N630-S633 PolarHBondContact O-N 3.01Å; N630-S634 PolarHBondContact O-N 3.35Å; N630-S634 VanDerWaalsContact O-N 3.12Å
631S85.7Confident87.4Confident27 Ų2741.4 Ų41.419%0.18921%0.214CC..Hα-helixtrans-61.1-42.8174.9-59.60000111.6L627 L628 R629 S634 R635L627-S631 PolarHBondContact O-N 2.93Å; L627-S631 PolarHBondContact O-OG 3.16Å; L628-S631 PolarHBondContact O-N 3.4Å; R629-S631 PolarHBondContact O-N 3.44Å; S631-S634 WeakPolarHBondContact O-CB 3.3Å; S631-S634 PolarHBondContact O-N 2.88Å; S631-R635 WeakPolarHBondContact O-CG 3.37Å; S631-R635 PolarHBondContact O-N 3.06Å; S631-R635 VanDerWaalsContact O-N 3.08Å
632N87.1Confident87.7Confident3 Ų343.7 Ų43.72%0.01622%0.224CC..Hα-helixtrans-66-39.3176.5-79-11.1000112.9F530 L572 I575 L628 R629 N630 S634 R635 Q636F530-N632 WeakPolarHBondContact CB-OD1 3.32Å; F530-N632 WeakPolarHBondContact CE1-ND2 3.49Å; F530-N632 WeakPolarHBondContact CE2-ND2 3.41Å; F530-N632 WeakPolarHBondContact CG-OD1 3.5Å; F530-N632 WeakPolarHBondContact CZ-ND2 3.5Å; L572-N632 HydrophobicContact CD2-CB 3.91Å; L572-N632 WeakPolarHBondContact CD2-ND2 3.44Å; I575-N632 WeakPolarHBondContact CD1-ND2 3.32Å; L628-N632 WeakPolarHBondContact CD2-ND2 3.11Å; L628-N632 PolarHBondContact O-N 3.16Å; R629-N632 PolarHBondContact O-N 3.34Å; N630-N632 VanDerWaalsContact C-N 3.34Å; N630-N632 PolarHBondContact O-N 3.35Å; N632-S634 VanDerWaalsContact C-N 3.27Å; N632-S634 PolarHBondContact O-N 2.98Å; N632-R635 PolarHBondContact O-N 2.89Å; N632-R635 VanDerWaalsContact O-N 3.13Å; N632-R635 PolarHBondContact OD1-NH1 3.02Å; N632-Q636 WeakPolarHBondContact O-CG 3.37Å; N632-Q636 PolarHBondContact O-N 2.9Å
633S87.4Confident88.2Confident44 Ų4439.6 Ų39.631%0.30821%0.206SC..Hα-helixtrans-59.3-39.2173.1-61.30000112R629 N630 Q636 S637 S691R629-S633 PolarHBondContact O-N 3.2Å; R629-S633 PolarHBondContact O-OG 3.18Å; N630-S633 PolarHBondContact O-N 3.01Å; S633-Q636 PolarHBondContact O-N 3.01Å; S633-S637 PolarHBondContact O-N 2.91Å; S633-S637 VanDerWaalsContact O-N 3.07Å; S633-S691 WeakPolarHBondContact O-CB 3.35Å; S633-S691 PolarHBondContact O-OG 3.31Å
634S88.7Confident88.8Confident55 Ų5533.5 Ų33.539%0.38518%0.18SC..Hα-helixtrans-64.2-41.9174.5-170.30000112N630 S631 N632 S637 Q638N630-S634 PolarHBondContact O-N 3.35Å; N630-S634 VanDerWaalsContact O-N 3.12Å; S631-S634 WeakPolarHBondContact O-CB 3.3Å; S631-S634 PolarHBondContact O-N 2.88Å; N632-S634 VanDerWaalsContact C-N 3.27Å; N632-S634 PolarHBondContact O-N 2.98Å; S634-S637 PolarHBondContact O-N 3.21Å; S634-Q638 PolarHBondContact O-N 2.93Å; S634-Q638 VanDerWaalsContact O-N 3.11Å
635R89.1Confident89.3Confident35 Ų3534.2 Ų34.213%0.13219%0.188CC..Hα-helixtrans-64.8-41.9176.9-67.4172.9-170.9123.6-1.2111.7D527 S631 N632 Q638 L639D527-R635 IonicContact OD1-CZ 3.97Å; D527-R635 IonicContact OD1-NH1 2.81Å; D527-R635 PolarHBondContact OD1-NH1 3.32Å; D527-R635 IonicContact OD1-NH2 3.35Å; D527-R635 PolarHBondContact OD1-NH2 3.4Å; D527-R635 IonicContact OD2-NH2 2.93Å; S631-R635 WeakPolarHBondContact O-CG 3.37Å; S631-R635 PolarHBondContact O-N 3.06Å; S631-R635 VanDerWaalsContact O-N 3.08Å; N632-R635 PolarHBondContact O-N 2.89Å; N632-R635 VanDerWaalsContact O-N 3.13Å; N632-R635 PolarHBondContact OD1-NH1 3.02Å; R635-Q638 PolarHBondContact O-N 2.98Å; R635-L639 WeakPolarHBondContact O-CG 3.41Å; R635-L639 PolarHBondContact O-N 3.32Å
636Q92.8Very high89.6Confident28 Ų2834.2 Ų34.213%0.13119%0.188CC..Hα-helixtrans-58.6-48174.7-74.7-178.9-63.800111.6W568 L572 N632 S633 Q638 L639 F640 C688W568-Q636 HydrophobicContact CZ2-CG 4.08Å; L572-Q636 HydrophobicContact CD1-CG 4.03Å; N632-Q636 WeakPolarHBondContact O-CG 3.37Å; N632-Q636 PolarHBondContact O-N 2.9Å; S633-Q636 PolarHBondContact O-N 3.01Å; Q636-Q638 VanDerWaalsContact C-N 3.27Å; Q636-Q638 PolarHBondContact O-N 3.36Å; Q636-L639 PolarHBondContact O-N 3.3Å; Q636-F640 PolarHBondContact O-N 2.97Å; Q636-C688 HydrophobicContact CB-CB 4.09Å; Q636-C688 HydrophobicContact CG-CB 4.49Å; Q636-C688 WeakPolarHBondContact O-CB 3.35Å
637S91.1Very high90.1Very high13 Ų1333.6 Ų33.69%0.09118%0.176CC..Hα-helixtrans-59.1-39.9176.9-169.60000112S633 S634 Q641 S691 T692S633-S637 PolarHBondContact O-N 2.91Å; S633-S637 VanDerWaalsContact O-N 3.07Å; S634-S637 PolarHBondContact O-N 3.21Å; S637-Q641 WeakPolarHBondContact O-CG 3.44Å; S637-Q641 PolarHBondContact O-N 3.02Å; S637-Q641 VanDerWaalsContact O-N 3.11Å; S637-S691 PolarHBondContact N-OG 2.71Å; S637-T692 WeakPolarHBondContact CB-OG1 3.44Å; S637-T692 PolarHBondContact OG-OG1 2.83Å
638Q91.5Very high90.5Very high60 Ų6031.8 Ų31.828%0.2817%0.167SC..Hα-helixtrans-67.8-44.7177.2-174.6179.713.200112.3M426 I538 S634 R635 Q636 F640 Q641 F642M426-Q638 PolarHBondContact SD-NE2 3.47Å; I538-Q638 HydrophobicContact CD1-CG 4.34Å; S634-Q638 PolarHBondContact O-N 2.93Å; S634-Q638 VanDerWaalsContact O-N 3.11Å; R635-Q638 PolarHBondContact O-N 2.98Å; Q636-Q638 VanDerWaalsContact C-N 3.27Å; Q636-Q638 PolarHBondContact O-N 3.36Å; Q638-F640 VanDerWaalsContact C-N 3.32Å; Q638-F640 PolarHBondContact O-N 2.94Å; Q638-Q641 PolarHBondContact O-N 2.98Å; Q638-F642 WeakPolarHBondContact O-CB 3.46Å; Q638-F642 PolarHBondContact O-N 3.01Å
639L93.6Very high90.7Very high0 Ų032.1 Ų32.10%017%0.17CC..Hα-helixtrans-60.1-43.2176.8-75.7171.6000111.1L537 I538 W568 R635 Q636 F642 Y643L537-L639 HydrophobicContact CB-CD2 3.92Å; L537-L639 HydrophobicContact CD1-CD1 4.25Å; L537-L639 HydrophobicContact CD1-CD2 4.36Å; I538-L639 HydrophobicContact CD1-CD2 4.38Å; I538-L639 HydrophobicContact CG1-CD2 3.86Å; W568-L639 HydrophobicContact CH2-CD1 3.83Å; W568-L639 HydrophobicContact CZ2-CD1 3.6Å; W568-L639 HydrophobicContact CZ3-CD1 4.42Å; R635-L639 WeakPolarHBondContact O-CG 3.41Å; R635-L639 PolarHBondContact O-N 3.32Å; Q636-L639 PolarHBondContact O-N 3.3Å; L639-F642 PolarHBondContact O-N 3.38Å; L639-Y643 VanDerWaalsContact O-CB 3.3Å; L639-Y643 WeakPolarHBondContact O-CB 3.39Å; L639-Y643 PolarHBondContact O-N 3.04Å
640F94.9Very high90.5Very high3 Ų333.7 Ų33.71%0.01318%0.181CC..Hα-helixtrans-58.9-49.6175.2178.5-100.4000111.9Q636 Q638 F642 L644 V685 C688 L700 I735Q636-F640 PolarHBondContact O-N 2.97Å; Q638-F640 VanDerWaalsContact C-N 3.32Å; Q638-F640 PolarHBondContact O-N 2.94Å; F640-F642 PolarHBondContact O-N 3.25Å; F640-L644 HydrophobicContact CE1-CD2 4.41Å; F640-L644 VanDerWaalsContact O-CB 3.27Å; F640-L644 WeakPolarHBondContact O-CB 3.32Å; F640-L644 PolarHBondContact O-N 3.08Å; F640-V685 HydrophobicContact CD2-CG1 3.7Å; F640-V685 WeakPolarHBondContact CD2-O 3.31Å; F640-V685 HydrophobicContact CE2-CG1 4.28Å; F640-C688 HydrophobicContact CB-CB 4.19Å; F640-L700 HydrophobicContact CZ-CD1 4.27Å; F640-L700 HydrophobicContact CZ-CD2 4.34Å; F640-L700 HydrophobicContact CZ-CG 4.25Å; F640-I735 HydrophobicContact CE2-CG2 3.79Å; F640-I735 HydrophobicContact CZ-CG2 4.34Å
641Q93.2Very high90.2Very high88 Ų8834.8 Ų34.841%0.41119%0.194SC..Hα-helixtrans-63.8-40.4179.4-71.7177.13.500112.5S637 Q638 A645 E695S637-Q641 WeakPolarHBondContact O-CG 3.44Å; S637-Q641 PolarHBondContact O-N 3.02Å; S637-Q641 VanDerWaalsContact O-N 3.11Å; Q638-Q641 PolarHBondContact O-N 2.98Å; Q641-A645 WeakPolarHBondContact O-CB 3.33Å; Q641-A645 PolarHBondContact O-N 2.94Å; Q641-E695 PolarHBondContact NE2-OE1 2.98Å; Q641-E695 VanDerWaalsContact NE2-OE1 3.14Å
642F93.1Very high90Very high48 Ų4836.8 Ų36.821%0.21121%0.205CC..Hα-helixtrans-71.5-42.4-179.2-165.2-94.4000112.1I538 I541 R542 Q638 L639 F640 L644 A645 S646 L654I538-F642 HydrophobicContact CB-CD1 4.36Å; I538-F642 HydrophobicContact CB-CE1 4.41Å; I538-F642 HydrophobicContact CG1-CD1 4.24Å; I538-F642 HydrophobicContact CG1-CG 4.35Å; I538-F642 HydrophobicContact CG2-CD1 3.97Å; I538-F642 HydrophobicContact CG2-CD2 4.25Å; I538-F642 HydrophobicContact CG2-CE1 3.74Å; I538-F642 HydrophobicContact CG2-CE2 4.03Å; I538-F642 HydrophobicContact CG2-CG 4.22Å; I538-F642 HydrophobicContact CG2-CZ 3.77Å; I538-F642 WeakPolarHBondContact O-CE1 3.46Å; I541-F642 HydrophobicContact CB-CD1 4.25Å; I541-F642 HydrophobicContact CB-CE1 4.03Å; I541-F642 HydrophobicContact CD1-CD1 4.45Å; I541-F642 HydrophobicContact CG2-CD1 3.91Å; I541-F642 HydrophobicContact CG2-CE1 3.78Å; R542-F642 HydrophobicContact CB-CE1 4.44Å; R542-F642 HydrophobicContact CB-CZ 4.25Å; Q638-F642 WeakPolarHBondContact O-CB 3.46Å; Q638-F642 PolarHBondContact O-N 3.01Å; L639-F642 PolarHBondContact O-N 3.38Å; F640-F642 PolarHBondContact O-N 3.25Å; F642-L644 VanDerWaalsContact C-N 3.34Å; F642-A645 PolarHBondContact O-N 2.92Å; F642-S646 WeakPolarHBondContact O-CB 3.28Å; F642-S646 PolarHBondContact O-N 3.32Å; F642-L654 HydrophobicContact CE2-CD1 3.92Å; F642-L654 HydrophobicContact CZ-CD1 3.88Å
643Y94.3Very high90Very high2 Ų237.1 Ų37.11%0.00821%0.209CC..Hα-helixtrans-63.4-41.2174.2-171.2-88.5000111.4I541 F565 L639 A645 S646 K647 S681 L682 V685 I735I541-Y643 HydrophobicContact CD1-CD2 3.96Å; I541-Y643 HydrophobicContact CG1-CD2 4.42Å; F565-Y643 HydrophobicContact CE2-CD2 4.2Å; F565-Y643 HydrophobicContact CE2-CE2 4.46Å; L639-Y643 VanDerWaalsContact O-CB 3.3Å; L639-Y643 WeakPolarHBondContact O-CB 3.39Å; L639-Y643 PolarHBondContact O-N 3.04Å; Y643-A645 VanDerWaalsContact C-N 3.34Å; Y643-A645 PolarHBondContact O-N 3.27Å; Y643-S646 PolarHBondContact O-N 3.09Å; Y643-S646 PolarHBondContact O-OG 3.48Å; Y643-K647 HydrophobicContact CD1-CG 4.44Å; Y643-K647 HydrophobicContact CE1-CG 4.12Å; Y643-K647 PolarHBondContact O-N 3.34Å; Y643-K647 VanDerWaalsContact OH-CE 3.32Å; Y643-K647 WeakPolarHBondContact OH-CE 3.49Å; Y643-S681 PolarHBondContact OH-OG 2.98Å; Y643-S681 VanDerWaalsContact OH-OG 3.13Å; Y643-L682 HydrophobicContact CE1-CD2 4.41Å; Y643-V685 HydrophobicContact CD1-CB 4.12Å; Y643-V685 HydrophobicContact CD1-CG1 3.67Å; Y643-V685 HydrophobicContact CD1-CG2 3.75Å; Y643-V685 HydrophobicContact CD2-CG2 3.72Å; Y643-V685 HydrophobicContact CE1-CB 4.49Å; Y643-V685 HydrophobicContact CE1-CG1 4.37Å; Y643-V685 HydrophobicContact CE1-CG2 4.19Å; Y643-V685 HydrophobicContact CE2-CG2 4.2Å; Y643-V685 HydrophobicContact CG-CB 4.31Å; Y643-V685 HydrophobicContact CG-CG1 4.02Å; Y643-V685 HydrophobicContact CG-CG2 3.48Å; Y643-V685 VanDerWaalsContact CG-CG2 3.48Å; Y643-I735 HydrophobicContact CD1-CD1 4.07Å; Y643-I735 HydrophobicContact CE1-CD1 4.1Å; Y643-I735 HydrophobicContact CE1-CG1 4.28Å
644L94.2Very high89.9Confident9 Ų938.7 Ų38.75%0.04721%0.213CC..Hα-helixtrans-61.1-45.3173.5-171.768.3000110.9F640 F642 S646 K647 M648 T699 L700 L703 L732 I735F640-L644 HydrophobicContact CE1-CD2 4.41Å; F640-L644 VanDerWaalsContact O-CB 3.27Å; F640-L644 WeakPolarHBondContact O-CB 3.32Å; F640-L644 PolarHBondContact O-N 3.08Å; F642-L644 VanDerWaalsContact C-N 3.34Å; L644-S646 VanDerWaalsContact C-N 3.3Å; L644-S646 PolarHBondContact O-N 3.39Å; L644-K647 PolarHBondContact O-N 3Å; L644-M648 WeakPolarHBondContact O-CG 3.4Å; L644-M648 PolarHBondContact O-N 3.37Å; L644-T699 HydrophobicContact CD2-CG2 3.84Å; L644-L700 HydrophobicContact CD1-CD2 4.24Å; L644-L703 HydrophobicContact CD1-CD1 4.44Å; L644-L703 HydrophobicContact CD2-CD1 3.61Å; L644-L703 HydrophobicContact CG-CD1 4.08Å; L644-L732 HydrophobicContact CD1-CD2 3.88Å; L644-I735 HydrophobicContact CD1-CD1 3.73Å
645A93.2Very high89.9Confident28 Ų2837.7 Ų37.723%0.23120%0.201CC..Hα-helixtrans-64-34177.400000112.7Q641 F642 Y643 K647 M648 G653 L654Q641-A645 WeakPolarHBondContact O-CB 3.33Å; Q641-A645 PolarHBondContact O-N 2.94Å; F642-A645 PolarHBondContact O-N 2.92Å; Y643-A645 VanDerWaalsContact C-N 3.34Å; Y643-A645 PolarHBondContact O-N 3.27Å; A645-K647 VanDerWaalsContact C-N 3.3Å; A645-K647 PolarHBondContact O-N 2.82Å; A645-M648 PolarHBondContact O-N 3.07Å; A645-G653 CarbonylContact O-C 3.55Å; A645-G653 WeakPolarHBondContact O-CA 3.43Å; A645-L654 PolarHBondContact O-N 2.95Å
646S92Very high89.3Confident4 Ų442.9 Ų42.93%0.02822%0.22CC..Hα-helixtrans-65.8-32.1-178.779.20000112.8I541 T545 F642 Y643 L644I541-S646 WeakPolarHBondContact CG2-OG 3.23Å; T545-S646 WeakPolarHBondContact CG2-O 3.4Å; F642-S646 WeakPolarHBondContact O-CB 3.28Å; F642-S646 PolarHBondContact O-N 3.32Å; Y643-S646 PolarHBondContact O-N 3.09Å; Y643-S646 PolarHBondContact O-OG 3.48Å; L644-S646 VanDerWaalsContact C-N 3.3Å; L644-S646 PolarHBondContact O-N 3.39Å
647K91.9Very high88.3Confident20 Ų2045.2 Ų45.29%0.08724%0.237CC..Hα-helixtrans-87.8-15.8180-60.5-60-170.8161.30114.4Y643 L644 A645 R655 W731Y643-K647 HydrophobicContact CD1-CG 4.44Å; Y643-K647 HydrophobicContact CE1-CG 4.12Å; Y643-K647 PolarHBondContact O-N 3.34Å; Y643-K647 VanDerWaalsContact OH-CE 3.32Å; Y643-K647 WeakPolarHBondContact OH-CE 3.49Å; L644-K647 PolarHBondContact O-N 3Å; A645-K647 VanDerWaalsContact C-N 3.3Å; A645-K647 PolarHBondContact O-N 2.82Å; K647-R655 WeakPolarHBondContact O-CD 3.44Å; K647-R655 PolarHBondContact O-NE 3.49Å; K647-W731 HydrophobicContact CB-CB 3.82Å; K647-W731 HydrophobicContact CB-CD2 4.14Å; K647-W731 HydrophobicContact CB-CG 3.67Å; K647-W731 HydrophobicContact CD-CD2 3.7Å; K647-W731 HydrophobicContact CD-CE3 4Å; K647-W731 HydrophobicContact CD-CG 4.14Å; K647-W731 HydrophobicContact CD-CH2 4.44Å; K647-W731 HydrophobicContact CD-CZ2 4.15Å; K647-W731 HydrophobicContact CD-CZ3 4.36Å; K647-W731 HydrophobicContact CG-CB 4.37Å; K647-W731 HydrophobicContact CG-CD2 3.92Å; K647-W731 HydrophobicContact CG-CE3 4.14Å; K647-W731 HydrophobicContact CG-CG 4Å
648M91.7Very high87Confident3 Ų346.6 Ų46.62%0.01525%0.246CC..SBendtrans-90.3141.6-177.5-62-65.6-6700112.2L644 A645 G653 L654 R655 L703 R707 D728 L732L644-M648 WeakPolarHBondContact O-CG 3.4Å; L644-M648 PolarHBondContact O-N 3.37Å; A645-M648 PolarHBondContact O-N 3.07Å; M648-G653 CarbonylContact O-C 3.52Å; M648-G653 VanDerWaalsContact O-C 3.25Å; M648-G653 WeakPolarHBondContact O-CA 3.27Å; M648-L654 PolarHBondContact O-N 2.86Å; M648-R655 VanDerWaalsContact O-CB 3.26Å; M648-R655 WeakPolarHBondContact O-CB 3.38Å; M648-R655 PolarHBondContact O-N 3.48Å; M648-L703 HydrophobicContact CE-CD2 4.42Å; M648-R707 HydrophobicContact CE-CG 4.32Å; M648-D728 WeakPolarHBondContact CA-OD1 3.2Å; M648-D728 HydrophobicContact CE-CB 3.85Å; M648-D728 VanDerWaalsContact CE-OD2 3.31Å; M648-D728 WeakPolarHBondContact CE-OD2 3.23Å; M648-D728 HydrophobicContact SD-CB 4.09Å; M648-L732 HydrophobicContact CE-CD1 4.08Å; M648-L732 HydrophobicContact CE-CG 4.49Å; M648-L732 HydrophobicContact SD-CD1 4.24Å; M648-L732 HydrophobicContact SD-CD2 4.31Å; M648-L732 HydrophobicContact SD-CG 4.02Å
649A87.9Confident85.6Confident8 Ų846.7 Ų46.77%0.06625%0.254CS..BIsolated β-bridgetrans-67.8152.8177.300000113.2V652 G653 D724 D728A649-V652 PolarHBondContact O-N 3.35Å; A649-V652 VanDerWaalsContact O-N 3.1Å; A649-G653 PolarHBondContact O-N 3.04Å; A649-D724 HydrophobicContact CB-CB 4.21Å; A649-D728 WeakPolarHBondContact CB-OD1 3.43Å; A649-D728 PolarHBondContact N-OD1 2.71Å
650Q82.5Confident83.7Confident120 Ų12053.7 Ų53.756%0.56129%0.286SS*.THydrogen-bonded Turntrans-59.5141.6168.9-69-173.42.900111.2R655Q650-R655 PolarHBondContact N-O 2.95Å
651P78Confident81.7Confident133 Ų13360.9 Ų60.986%0.86433%0.325SS*.THydrogen-bonded Turncis-92.53.611.536.8-37.2000114.9
652V82.7Confident79.8Confident69 Ų6960 Ų6042%0.41832%0.323SS..THydrogen-bonded Turntrans-87.9-35-173.81790000112A649 L703A649-V652 PolarHBondContact O-N 3.35Å; A649-V652 VanDerWaalsContact O-N 3.1Å; V652-L703 HydrophobicContact CG1-CD2 3.85Å
653G86.1Confident78.1Confident9 Ų963.8 Ų63.89%0.09335%0.345CS..SBendtrans-122.9-161.6176.200000113.8A645 M648 A649A645-G653 CarbonylContact O-C 3.55Å; A645-G653 WeakPolarHBondContact O-CA 3.43Å; M648-G653 CarbonylContact O-C 3.52Å; M648-G653 VanDerWaalsContact O-C 3.25Å; M648-G653 WeakPolarHBondContact O-CA 3.27Å; A649-G653 PolarHBondContact O-N 3.04Å
654L86.4Confident76.5Confident77 Ų7768.2 Ų68.240%0.40337%0.366SS..SBendtrans-104.6-13.4-173.2-57171.8000112.7F642 A645 M648 R656F642-L654 HydrophobicContact CE2-CD1 3.92Å; F642-L654 HydrophobicContact CZ-CD1 3.88Å; A645-L654 PolarHBondContact O-N 2.95Å; M648-L654 PolarHBondContact O-N 2.86Å; L654-R656 PolarHBondContact O-N 3.01Å
655R87Confident75.1Confident35 Ų3577.1 Ų77.113%0.13241%0.407CS..BIsolated β-bridgetrans-62.8130.9179.9-170.3170.359.187.22.3110.3K647 M648 Q650 D724 D728K647-R655 WeakPolarHBondContact O-CD 3.44Å; K647-R655 PolarHBondContact O-NE 3.49Å; M648-R655 VanDerWaalsContact O-CB 3.26Å; M648-R655 WeakPolarHBondContact O-CB 3.38Å; M648-R655 PolarHBondContact O-N 3.48Å; Q650-R655 PolarHBondContact N-O 2.95Å; R655-D724 IonicContact NH1-OD1 3.27Å; R655-D724 PolarHBondContact NH1-OD1 3.44Å; R655-D724 PolarHBondContact NH2-O 3.43Å; R655-D728 IonicContact CZ-OD1 3.91Å; R655-D728 IonicContact NH2-OD1 3.37Å; R655-D728 PolarHBondContact NH2-OD1 3.03Å
656R78.3Confident73.9Confident143 Ų14381.2 Ų81.254%0.5442%0.424SS..PPolyproline II helixtrans-67.7141.1175.4-69.4-177.2-179.71576.5110.2E546 L654E546-R656 PolarHBondContact O-NH1 3.03Å; E546-R656 PolarHBondContact O-NH2 2.93Å; L654-R656 PolarHBondContact O-N 3.01Å
657T70.9Confident72.8Confident77 Ų7784.4 Ų84.447%0.47244%0.441SS..PPolyproline II helixtrans-73.3137176.953.60000110.8S659 D724T657-S659 PolarHBondContact O-N 2.96Å; T657-D724 WeakPolarHBondContact CB-OD2 3.37Å
658C64.2Low71.7Confident43 Ų4389.4 Ų89.429%0.29147%0.468SS..PPolyproline II helixtrans-57.7127179.7-68.90000112.6D724C658-D724 PolarHBondContact N-OD1 3.17Å
659S62.1Low70.4Confident62 Ų6297.9 Ų97.943%0.43451%0.507SS..PPolyproline II helixtrans-85.2153.2167.637.40000111.3T657 D661 N662T657-S659 PolarHBondContact O-N 2.96Å; S659-D661 PolarHBondContact O-N 2.92Å; S659-N662 PolarHBondContact O-N 3.34Å; S659-N662 VanDerWaalsContact O-N 3.16Å; S659-N662 PolarHBondContact OG-OD1 3.29Å
660H53.2Low69.5Low147 Ų147104 Ų10468%0.68154%0.538SS*.THydrogen-bonded Turntrans-55.8-17-178.5-102.5-57.4000115.3L720H660-L720 HydrophobicContact CB-CD1 4.39Å; H660-L720 WeakPolarHBondContact CD2-CD1 3.25Å; H660-L720 WeakPolarHBondContact NE2-CD1 3.35Å
661D52.6Low68.9Low154 Ų154102.6 Ų102.682%0.82454%0.535SS*.THydrogen-bonded Turntrans-85.4-7.8-177.5-68-27.5000113.7S659S659-D661 PolarHBondContact O-N 2.92Å
662N53.6Low68.5Low70 Ų70103.3 Ų103.337%0.37453%0.526SS..  trans-98.621.2-169.7-62.135.5000114.5S659 E664S659-N662 PolarHBondContact O-N 3.34Å; S659-N662 VanDerWaalsContact O-N 3.16Å; S659-N662 PolarHBondContact OG-OD1 3.29Å; N662-E664 PolarHBondContact O-N 3.31Å
663N56.5Low68.4Low127 Ų127102.7 Ų102.768%0.67952%0.521SS*.  trans-77.767.5170.8-75.9-0.8000109
664E61.3Low68.4Low94 Ų94105.2 Ų105.244%0.43953%0.532SS..  trans-64.5135.9170.6-70.1170.7-145.800108.8T549 N662 I666T549-E664 PolarHBondContact OG1-OE1 2.95Å; N662-E664 PolarHBondContact O-N 3.31Å; E664-I666 PolarHBondContact O-N 3.34Å; E664-I666 VanDerWaalsContact O-N 3.15Å
665E65.4Low68.3Low197 Ų197102.7 Ų102.792%0.92152%0.518SS*.  trans-74.9103.2173.4-166.4167.8-165.100107.3D667E665-D667 PolarHBondContact O-N 3.15Å
666I68.3Low68.1Low114 Ų114104.3 Ų104.359%0.58553%0.532SS*.  trans-74.1113.6179.5-57.8175.3000108E664 L668 N671E664-I666 PolarHBondContact O-N 3.34Å; E664-I666 VanDerWaalsContact O-N 3.15Å; I666-L668 HydrophobicContact CG2-CD2 4.17Å; I666-L668 PolarHBondContact O-N 2.88Å; I666-N671 HydrophobicContact CG2-CB 4.11Å; I666-N671 WeakPolarHBondContact CG2-ND2 3.49Å
667D68.4Low68.4Low70 Ų7098.8 Ų98.837%0.37452%0.515SS..  trans-76.8104170.1-170.2-22.4000109.2E665 E669 L670 N671E665-D667 PolarHBondContact O-N 3.15Å; D667-E669 PolarHBondContact O-N 2.95Å; D667-E669 WeakPolarHBondContact OD1-CB 3.45Å; D667-E669 PolarHBondContact OD1-N 2.77Å; D667-L670 HydrophobicContact CB-CB 4.19Å; D667-L670 HydrophobicContact CB-CG 4.48Å; D667-L670 PolarHBondContact O-N 3.49Å; D667-L670 PolarHBondContact OD1-N 2.98Å; D667-L670 VanDerWaalsContact OD2-CD1 3.31Å; D667-L670 WeakPolarHBondContact OD2-CD1 3.41Å; D667-L670 WeakPolarHBondContact OD2-CG 3.46Å; D667-N671 PolarHBondContact N-ND2 3.29Å; D667-N671 VanDerWaalsContact O-CB 3.25Å; D667-N671 WeakPolarHBondContact O-CB 3.37Å; D667-N671 PolarHBondContact O-N 3.45Å
668L68.8Low69.3Low125 Ų12595.2 Ų95.265%0.65449%0.494SS*.THydrogen-bonded Turntrans-66.8-12.7-179.5-61.3176.1000113.4I666I666-L668 HydrophobicContact CG2-CD2 4.17Å; I666-L668 PolarHBondContact O-N 2.88Å
669E64.2Low70.5Confident182 Ų18296 Ų9685%0.8549%0.493SS*.THydrogen-bonded Turntrans-88.6-29.3175.8-61.2-174177.500112.1D667D667-E669 PolarHBondContact O-N 2.95Å; D667-E669 WeakPolarHBondContact OD1-CB 3.45Å; D667-E669 PolarHBondContact OD1-N 2.77Å
670L69Low71.9Confident137 Ų13795.7 Ų95.772%0.71749%0.487SS*.THydrogen-bonded Turntrans-103.6-32.3-176.6-62.2-179.9000113.7D667D667-L670 HydrophobicContact CB-CB 4.19Å; D667-L670 HydrophobicContact CB-CG 4.48Å; D667-L670 PolarHBondContact O-N 3.49Å; D667-L670 PolarHBondContact OD1-N 2.98Å; D667-L670 VanDerWaalsContact OD2-CD1 3.31Å; D667-L670 WeakPolarHBondContact OD2-CD1 3.41Å; D667-L670 WeakPolarHBondContact OD2-CG 3.46Å
671N69.7Low73.8Confident90 Ų9088.7 Ų88.748%0.48145%0.454SS..SBendtrans-87.6128.1-176.7-64.7-24.4000110.7I666 D667I666-N671 HydrophobicContact CG2-CB 4.11Å; I666-N671 WeakPolarHBondContact CG2-ND2 3.49Å; D667-N671 PolarHBondContact N-ND2 3.29Å; D667-N671 VanDerWaalsContact O-CB 3.25Å; D667-N671 WeakPolarHBondContact O-CB 3.37Å; D667-N671 PolarHBondContact O-N 3.45Å
672E70.1Confident75.7Confident148 Ų14881.4 Ų81.469%0.69242%0.415SS*.PPolyproline II helixtrans-69.5138.2174.1-65.6-173.8171.300110.8
673D80.1Confident77.5Confident56 Ų5681.1 Ų81.130%0.29941%0.411SS..PPolyproline II helixtrans-62.9144.5173.6-176.62.1000109.7M675 T676 S677D673-M675 PolarHBondContact O-N 3.48Å; D673-M675 VanDerWaalsContact O-N 3.14Å; D673-M675 PolarHBondContact OD1-N 3.25Å; D673-T676 PolarHBondContact N-OG1 3.07Å; D673-T676 WeakPolarHBondContact O-CA 3.21Å; D673-T676 PolarHBondContact O-N 2.89Å; D673-T676 PolarHBondContact O-OG1 2.9Å; D673-S677 PolarHBondContact O-N 3.48Å; D673-S677 PolarHBondContact O-OG 3.13Å
674D86.5Confident79.1Confident61 Ų6175 Ų7533%0.32638%0.378SS..Hα-helixtrans-54.9-33.9178.3-79.5-42.8000112.1T676 S677 S678 H730 W731D674-T676 VanDerWaalsContact C-N 3.28Å; D674-T676 PolarHBondContact O-N 3.38Å; D674-S677 WeakPolarHBondContact CA-OG 3.28Å; D674-S677 PolarHBondContact O-OG 3.34Å; D674-S678 VanDerWaalsContact O-CB 3.31Å; D674-S678 WeakPolarHBondContact O-CB 3.28Å; D674-S678 PolarHBondContact O-N 3.05Å; D674-H730 IonicContact OD2-NE2 2.71Å; D674-W731 HydrophobicContact CB-CH2 3.87Å; D674-W731 HydrophobicContact CB-CZ2 4.12Å
675M85.2Confident80.7Confident25 Ų2570.6 Ų70.612%0.12336%0.357CS..Hα-helixtrans-62.6-33.5175.3179.6177.360.100112.8D673 L734 A745 W842D673-M675 PolarHBondContact O-N 3.48Å; D673-M675 VanDerWaalsContact O-N 3.14Å; D673-M675 PolarHBondContact OD1-N 3.25Å; M675-L734 HydrophobicContact CB-CD1 4.49Å; M675-L734 HydrophobicContact CB-CD2 4.34Å; M675-L734 HydrophobicContact CG-CD2 4.42Å; M675-A745 HydrophobicContact CG-CB 3.76Å; M675-A745 HydrophobicContact SD-CB 4.39Å; M675-W842 HydrophobicContact CG-CZ2 4.33Å; M675-W842 HydrophobicContact SD-CD2 3.94Å; M675-W842 HydrophobicContact SD-CG 3.91Å; M675-W842 HydrophobicContact SD-CZ2 3.93Å; M675-W842 PolarHBondContact SD-NE1 3.45Å
676T82.2Confident81.9Confident68 Ų6861.2 Ų61.242%0.41731%0.313SS..Hα-helixtrans-89.1-40.6178.242.90000112.6D673 D674 S678D673-T676 PolarHBondContact N-OG1 3.07Å; D673-T676 WeakPolarHBondContact O-CA 3.21Å; D673-T676 PolarHBondContact O-N 2.89Å; D673-T676 PolarHBondContact O-OG1 2.9Å; D674-T676 VanDerWaalsContact C-N 3.28Å; D674-T676 PolarHBondContact O-N 3.38Å; T676-S678 VanDerWaalsContact C-N 3.32Å; T676-S678 PolarHBondContact O-N 3.49Å
677S85.1Confident82.9Confident27 Ų2757 Ų5719%0.18929%0.294CS..Hα-helixtrans-68.1-33.2-179.6670000112.3H558 D673 D674H558-S677 PolarHBondContact CE1-O 3.15Å; H558-S677 PolarHBondContact NE2-O 2.85Å; D673-S677 PolarHBondContact O-N 3.48Å; D673-S677 PolarHBondContact O-OG 3.13Å; D674-S677 WeakPolarHBondContact CA-OG 3.28Å; D674-S677 PolarHBondContact O-OG 3.34Å
678S89.2Confident84.1Confident2 Ų253.6 Ų53.61%0.01428%0.276CS..THydrogen-bonded Turntrans-106.423.3-178.3-54.30000113.8D674 T676 D680 S681 L682D674-S678 VanDerWaalsContact O-CB 3.31Å; D674-S678 WeakPolarHBondContact O-CB 3.28Å; D674-S678 PolarHBondContact O-N 3.05Å; T676-S678 VanDerWaalsContact C-N 3.32Å; T676-S678 PolarHBondContact O-N 3.49Å; S678-D680 PolarHBondContact O-N 3.23Å; S678-S681 PolarHBondContact O-OG 3.31Å; S678-L682 VanDerWaalsContact O-CB 3.24Å; S678-L682 WeakPolarHBondContact O-CB 3.12Å; S678-L682 WeakPolarHBondContact O-CD1 3.35Å; S678-L682 WeakPolarHBondContact O-CG 3.46Å; S678-L682 PolarHBondContact O-N 3.37Å
679E89.8Confident85.1Confident61 Ų6147.7 Ų47.729%0.28525%0.245SC..Hα-helixtrans-60-46.6-173.6179.9168.8-161.200112.7L682 F683 P744 A745E679-L682 PolarHBondContact O-N 2.82Å; E679-F683 WeakPolarHBondContact O-CB 3.1Å; E679-F683 PolarHBondContact O-N 2.98Å; E679-P744 WeakPolarHBondContact OE1-CA 3.35Å; E679-A745 HydrophobicContact CG-CB 3.95Å; E679-A745 PolarHBondContact OE1-N 2.76Å
680D89.9Confident86.4Confident55 Ų5539.7 Ų39.729%0.29421%0.208SC..Hα-helixtrans-66.9-45.9-175.8-75.4-25.1000110.8E562 N566 S678 F683 A684E562-D680 HydrophobicContact CB-CB 4.5Å; E562-D680 WeakPolarHBondContact OE2-CB 3.07Å; E562-D680 PolarHBondContact OE2-N 3.27Å; N566-D680 HydrophobicContact CB-CB 4.2Å; N566-D680 WeakPolarHBondContact CB-OD2 3.29Å; N566-D680 PolarHBondContact ND2-OD2 3.05Å; S678-D680 PolarHBondContact O-N 3.23Å; D680-F683 PolarHBondContact O-N 3.27Å; D680-A684 WeakPolarHBondContact O-CB 3.28Å; D680-A684 PolarHBondContact O-N 2.76Å
681S93.2Very high87.3Confident0 Ų034.5 Ų34.50%018%0.183CC..Hα-helixtrans-66.7-40.9177.366.70000112.4E562 F565 Y643 S678 F683 A684 V685E562-S681 WeakPolarHBondContact OE1-CB 3.36Å; E562-S681 PolarHBondContact OE1-OG 3.45Å; E562-S681 WeakPolarHBondContact OE2-CB 3.48Å; E562-S681 PolarHBondContact OE2-N 3.26Å; E562-S681 PolarHBondContact OE2-OG 2.92Å; F565-S681 VanDerWaalsContact CD2-CB 3.42Å; Y643-S681 PolarHBondContact OH-OG 2.98Å; Y643-S681 VanDerWaalsContact OH-OG 3.13Å; S678-S681 PolarHBondContact O-OG 3.31Å; S681-F683 PolarHBondContact O-N 2.88Å; S681-A684 PolarHBondContact O-N 3.42Å; S681-V685 WeakPolarHBondContact O-CB 3.16Å; S681-V685 WeakPolarHBondContact O-CG2 3.4Å; S681-V685 PolarHBondContact O-N 2.92Å
682L93.3Very high88.3Confident0 Ų032.2 Ų32.20%017%0.173CC..Hα-helixtrans-62.2-43.8175.4-74.9169.1000111.7Y643 S678 E679 G686 W731 L734 I735 H738Y643-L682 HydrophobicContact CE1-CD2 4.41Å; S678-L682 VanDerWaalsContact O-CB 3.24Å; S678-L682 WeakPolarHBondContact O-CB 3.12Å; S678-L682 WeakPolarHBondContact O-CD1 3.35Å; S678-L682 WeakPolarHBondContact O-CG 3.46Å; S678-L682 PolarHBondContact O-N 3.37Å; E679-L682 PolarHBondContact O-N 2.82Å; L682-G686 PolarHBondContact O-N 3.35Å; L682-W731 HydrophobicContact CD2-CE3 4.34Å; L682-W731 HydrophobicContact CD2-CZ3 4.3Å; L682-L734 HydrophobicContact CD1-CB 4.01Å; L682-L734 HydrophobicContact CD1-CD1 3.96Å; L682-L734 HydrophobicContact CD2-CB 3.89Å; L682-I735 HydrophobicContact CD2-CG1 3.86Å; L682-H738 VanDerWaalsContact O-CB 3.25Å; L682-H738 WeakPolarHBondContact O-CB 3.15Å
683F91.3Very high89.2Confident64 Ų6426.3 Ų26.328%0.28115%0.147SC..Hα-helixtrans-62.6-47.8176.7179.6-94.4000112.2E679 D680 S681 G686 S687 H738 S742E679-F683 WeakPolarHBondContact O-CB 3.1Å; E679-F683 PolarHBondContact O-N 2.98Å; D680-F683 PolarHBondContact O-N 3.27Å; S681-F683 PolarHBondContact O-N 2.88Å; F683-G686 PolarHBondContact O-N 3.01Å; F683-S687 PolarHBondContact O-N 2.84Å; F683-S687 PolarHBondContact O-OG 2.96Å; F683-H738 WeakPolarHBondContact CA-ND1 3.15Å; F683-S742 WeakPolarHBondContact CE2-OG 3.43Å
684A91.4Very high89.6Confident0 Ų029.1 Ų29.10%016%0.158CC..Hα-helixtrans-69.1-38.8-179.200000112.3F565 W568 D680 S681 S687 C688F565-A684 HydrophobicContact CB-CB 3.67Å; F565-A684 HydrophobicContact CD1-CB 3.33Å; F565-A684 HydrophobicContact CE1-CB 4.17Å; F565-A684 HydrophobicContact CG-CB 3.75Å; W568-A684 HydrophobicContact CB-CB 4.43Å; D680-A684 WeakPolarHBondContact O-CB 3.28Å; D680-A684 PolarHBondContact O-N 2.76Å; S681-A684 PolarHBondContact O-N 3.42Å; A684-S687 CarbonylContact O-C 3.56Å; A684-S687 WeakPolarHBondContact O-CB 3.24Å; A684-S687 PolarHBondContact O-N 3.07Å; A684-C688 PolarHBondContact O-N 3.29Å; A684-C688 PolarHBondContact O-SG 3.34Å
685V93.1Very high89.9Confident0 Ų030.9 Ų30.90%017%0.165CC..Hα-helixtrans-68.5-41.2176.7170.70000110.9F565 F640 Y643 S681 S687 C688 G689F565-V685 HydrophobicContact CE1-CG2 4.1Å; F565-V685 HydrophobicContact CE2-CG2 3.98Å; F565-V685 HydrophobicContact CZ-CG2 3.63Å; F640-V685 HydrophobicContact CD2-CG1 3.7Å; F640-V685 WeakPolarHBondContact CD2-O 3.31Å; F640-V685 HydrophobicContact CE2-CG1 4.28Å; Y643-V685 HydrophobicContact CD1-CB 4.12Å; Y643-V685 HydrophobicContact CD1-CG1 3.67Å; Y643-V685 HydrophobicContact CD1-CG2 3.75Å; Y643-V685 HydrophobicContact CD2-CG2 3.72Å; Y643-V685 HydrophobicContact CE1-CB 4.49Å; Y643-V685 HydrophobicContact CE1-CG1 4.37Å; Y643-V685 HydrophobicContact CE1-CG2 4.19Å; Y643-V685 HydrophobicContact CE2-CG2 4.2Å; Y643-V685 HydrophobicContact CG-CB 4.31Å; Y643-V685 HydrophobicContact CG-CG1 4.02Å; Y643-V685 HydrophobicContact CG-CG2 3.48Å; Y643-V685 VanDerWaalsContact CG-CG2 3.48Å; S681-V685 WeakPolarHBondContact O-CB 3.16Å; S681-V685 WeakPolarHBondContact O-CG2 3.4Å; S681-V685 PolarHBondContact O-N 2.92Å; V685-S687 PolarHBondContact O-N 2.97Å; V685-C688 WeakPolarHBondContact O-CB 3Å; V685-C688 PolarHBondContact O-N 3.46Å; V685-C688 VanDerWaalsContact O-N 3.1Å; V685-G689 PolarHBondContact O-N 3.46Å
686G91.2Very high90.4Very high0 Ų029.9 Ų29.90%016%0.16CC..Hα-helixtrans-53.2-45.717000000111.3L682 F683 G689 F739L682-G686 PolarHBondContact O-N 3.35Å; F683-G686 PolarHBondContact O-N 3.01Å; G686-G689 PolarHBondContact O-N 3.4Å; G686-F739 WeakPolarHBondContact O-CD2 3.47Å
687S89.5Confident90.9Very high25 Ų2526.6 Ų26.618%0.17514%0.14CC..Hα-helixtrans-66-38.1175.4-58.20000113.2S569 F683 A684 V685 G689 L690S569-S687 WeakPolarHBondContact OG-CB 3.36Å; S569-S687 PolarHBondContact OG-OG 3.44Å; F683-S687 PolarHBondContact O-N 2.84Å; F683-S687 PolarHBondContact O-OG 2.96Å; A684-S687 CarbonylContact O-C 3.56Å; A684-S687 WeakPolarHBondContact O-CB 3.24Å; A684-S687 PolarHBondContact O-N 3.07Å; V685-S687 PolarHBondContact O-N 2.97Å; S687-G689 VanDerWaalsContact C-N 3.33Å; S687-G689 PolarHBondContact O-N 3.41Å; S687-L690 WeakPolarHBondContact O-CB 3.36Å; S687-L690 PolarHBondContact O-N 3.26Å
688C92.6Very high91.3Very high0 Ų028.7 Ų28.70%015%0.152CC..Hα-helixtrans-61.7-40.2175.2-71.20000112.1W568 Q636 F640 A684 V685 L690 S691W568-C688 PolarHBondContact NE1-SG 3.23Å; Q636-C688 HydrophobicContact CB-CB 4.09Å; Q636-C688 HydrophobicContact CG-CB 4.49Å; Q636-C688 WeakPolarHBondContact O-CB 3.35Å; F640-C688 HydrophobicContact CB-CB 4.19Å; A684-C688 PolarHBondContact O-N 3.29Å; A684-C688 PolarHBondContact O-SG 3.34Å; V685-C688 WeakPolarHBondContact O-CB 3Å; V685-C688 PolarHBondContact O-N 3.46Å; V685-C688 VanDerWaalsContact O-N 3.1Å; C688-L690 PolarHBondContact O-N 3.01Å; C688-L690 VanDerWaalsContact O-N 3.1Å; C688-S691 PolarHBondContact O-N 3.23Å; C688-S691 VanDerWaalsContact O-N 3.15Å; C688-S691 PolarHBondContact O-OG 3.44Å
689G91.6Very high91.5Very high0 Ų030.3 Ų30.30%016%0.161CC..Hα-helixtrans-59.5-23177.100000113.7V685 G686 S687 S691 T692 S696V685-G689 PolarHBondContact O-N 3.46Å; G686-G689 PolarHBondContact O-N 3.4Å; S687-G689 VanDerWaalsContact C-N 3.33Å; S687-G689 PolarHBondContact O-N 3.41Å; G689-S691 VanDerWaalsContact C-N 3.26Å; G689-S691 PolarHBondContact O-N 2.9Å; G689-T692 CarbonylContact O-C 3.25Å; G689-S696 WeakPolarHBondContact O-CB 3.49Å; G689-S696 PolarHBondContact O-OG 2.98Å
690L91.4Very high91.8Very high15 Ų1527.4 Ų27.48%0.07915%0.148CC..THydrogen-bonded Turntrans-75.7-7.1-179.9-59172.6000114S687 C688 T692 P693 F739 P764 Q766 I767S687-L690 WeakPolarHBondContact O-CB 3.36Å; S687-L690 PolarHBondContact O-N 3.26Å; C688-L690 PolarHBondContact O-N 3.01Å; C688-L690 VanDerWaalsContact O-N 3.1Å; L690-T692 VanDerWaalsContact C-N 3.29Å; L690-P693 WeakPolarHBondContact O-CD 3.36Å; L690-F739 HydrophobicContact CD2-CD2 4.11Å; L690-F739 HydrophobicContact CD2-CE2 3.71Å; L690-F739 HydrophobicContact CD2-CZ 4.16Å; L690-F739 HydrophobicContact CG-CD2 4.46Å; L690-F739 HydrophobicContact CG-CE2 4.29Å; L690-P764 HydrophobicContact CD1-CB 3.44Å; L690-P764 VanDerWaalsContact CD1-CB 3.44Å; L690-P764 HydrophobicContact CD1-CG 3.94Å; L690-P764 HydrophobicContact CD2-CB 4.01Å; L690-P764 HydrophobicContact CD2-CG 4.39Å; L690-P764 HydrophobicContact CG-CB 4.4Å; L690-Q766 HydrophobicContact CB-CB 4.21Å; L690-Q766 HydrophobicContact CB-CG 4.22Å; L690-Q766 HydrophobicContact CD2-CB 4.44Å; L690-I767 HydrophobicContact CD2-CD1 3.68Å; L690-I767 HydrophobicContact CD2-CG1 3.64Å
691S88.2Confident92Very high28 Ų2825.7 Ų25.720%0.19614%0.14CC..THydrogen-bonded Turntrans-66.8-33.717362.40000112.3S633 S637 C688 G689S633-S691 WeakPolarHBondContact O-CB 3.35Å; S633-S691 PolarHBondContact O-OG 3.31Å; S637-S691 PolarHBondContact N-OG 2.71Å; C688-S691 PolarHBondContact O-N 3.23Å; C688-S691 VanDerWaalsContact O-N 3.15Å; C688-S691 PolarHBondContact O-OG 3.44Å; G689-S691 VanDerWaalsContact C-N 3.26Å; G689-S691 PolarHBondContact O-N 2.9Å
692T89.4Confident92Very high42 Ų4231.4 Ų31.426%0.25816%0.161SC..SBendtrans-136.861.8-177.541.40000109.2S637 G689 L690 E694 E695 S696S637-T692 WeakPolarHBondContact CB-OG1 3.44Å; S637-T692 PolarHBondContact OG-OG1 2.83Å; G689-T692 CarbonylContact O-C 3.25Å; L690-T692 VanDerWaalsContact C-N 3.29Å; T692-E694 VanDerWaalsContact C-N 3.31Å; T692-E694 PolarHBondContact O-N 3.28Å; T692-E695 PolarHBondContact O-N 2.97Å; T692-E695 VanDerWaalsContact O-N 3.11Å; T692-S696 PolarHBondContact O-N 3.14Å; T692-S696 PolarHBondContact O-OG 3.45Å
693P89.7Confident92.1Very high23 Ų2331.7 Ų31.715%0.14916%0.162CC..Hα-helixtrans-59.9-38.2-163.423.4-33.2000113L690 I697 F739 L770L690-P693 WeakPolarHBondContact O-CD 3.36Å; P693-I697 WeakPolarHBondContact O-CB 3.39Å; P693-I697 VanDerWaalsContact O-CD1 3.25Å; P693-I697 WeakPolarHBondContact O-CD1 3.33Å; P693-I697 WeakPolarHBondContact O-CG1 3.35Å; P693-I697 PolarHBondContact O-N 2.84Å; P693-F739 HydrophobicContact CB-CZ 4.47Å; P693-L770 HydrophobicContact CB-CD1 4.13Å; P693-L770 HydrophobicContact CG-CD1 3.74Å
694E88.9Confident92.3Very high115 Ų11528.7 Ų28.754%0.53715%0.15SC..Hα-helixtrans-66-39.8179.9-172170.8-170.400112.8T692 T698 L770T692-E694 VanDerWaalsContact C-N 3.31Å; T692-E694 PolarHBondContact O-N 3.28Å; E694-T698 WeakPolarHBondContact O-CB 3.27Å; E694-T698 PolarHBondContact O-N 2.83Å; E694-T698 PolarHBondContact O-OG1 3.37Å; E694-L770 HydrophobicContact CB-CD1 4.46Å
695E92.2Very high92.4Very high98 Ų9829.8 Ų29.846%0.45816%0.155SC..Hα-helixtrans-70-44.5177.5-172.1-179.6170.900111.1Q641 T692 I697 T698 T699Q641-E695 PolarHBondContact NE2-OE1 2.98Å; Q641-E695 VanDerWaalsContact NE2-OE1 3.14Å; T692-E695 PolarHBondContact O-N 2.97Å; T692-E695 VanDerWaalsContact O-N 3.11Å; E695-I697 PolarHBondContact O-N 2.88Å; E695-T698 PolarHBondContact O-N 3.27Å; E695-T699 WeakPolarHBondContact O-CB 3.33Å; E695-T699 PolarHBondContact O-N 2.87Å; E695-T699 PolarHBondContact O-OG1 3.05Å
696S94.4Very high92.3Very high4 Ų433.2 Ų33.23%0.02817%0.171CC..Hα-helixtrans-58.6-48.2176.4-59.60000111.4G689 T692 T698 T699 L700G689-S696 WeakPolarHBondContact O-CB 3.49Å; G689-S696 PolarHBondContact O-OG 2.98Å; T692-S696 PolarHBondContact O-N 3.14Å; T692-S696 PolarHBondContact O-OG 3.45Å; S696-T698 PolarHBondContact O-N 2.96Å; S696-T699 PolarHBondContact O-N 3.32Å; S696-L700 WeakPolarHBondContact O-CG 3.01Å; S696-L700 PolarHBondContact O-N 3Å
697I93.8Very high92.4Very high0 Ų033.5 Ų33.50%017%0.172CC..Hα-helixtrans-61.4-46.8177.1-69.7161.4000110.9P693 E695 T699 L700 V701 F739 L770 S811 L812 L815P693-I697 WeakPolarHBondContact O-CB 3.39Å; P693-I697 VanDerWaalsContact O-CD1 3.25Å; P693-I697 WeakPolarHBondContact O-CD1 3.33Å; P693-I697 WeakPolarHBondContact O-CG1 3.35Å; P693-I697 PolarHBondContact O-N 2.84Å; E695-I697 PolarHBondContact O-N 2.88Å; I697-T699 PolarHBondContact O-N 3.18Å; I697-L700 PolarHBondContact O-N 3.32Å; I697-V701 HydrophobicContact CG2-CG2 4.16Å; I697-V701 WeakPolarHBondContact O-CB 3.42Å; I697-V701 VanDerWaalsContact O-CG2 3.25Å; I697-V701 WeakPolarHBondContact O-CG2 3.47Å; I697-V701 PolarHBondContact O-N 3.42Å; I697-F739 HydrophobicContact CD1-CE1 4.07Å; I697-F739 HydrophobicContact CD1-CZ 4.11Å; I697-F739 HydrophobicContact CG1-CE1 3.46Å; I697-F739 VanDerWaalsContact CG1-CE1 3.46Å; I697-F739 HydrophobicContact CG1-CZ 3.64Å; I697-L770 HydrophobicContact CD1-CD2 3.52Å; I697-S811 VanDerWaalsContact CG2-C 3.41Å; I697-S811 WeakPolarHBondContact CG2-O 3.43Å; I697-L812 HydrophobicContact CD1-CB 4.09Å; I697-L812 HydrophobicContact CD1-CD1 3.79Å; I697-L812 HydrophobicContact CG1-CD1 4.23Å; I697-L815 HydrophobicContact CG2-CB 4.19Å; I697-L815 HydrophobicContact CG2-CD2 4.3Å
698T92.7Very high92.4Very high71 Ų7132.8 Ų32.844%0.43617%0.167SC..Hα-helixtrans-60.7-37.6-179-57.50000111E694 E695 S696 R702E694-T698 WeakPolarHBondContact O-CB 3.27Å; E694-T698 PolarHBondContact O-N 2.83Å; E694-T698 PolarHBondContact O-OG1 3.37Å; E695-T698 PolarHBondContact O-N 3.27Å; S696-T698 PolarHBondContact O-N 2.96Å; T698-R702 WeakPolarHBondContact O-CB 3.49Å; T698-R702 PolarHBondContact O-N 3.21Å; T698-R702 VanDerWaalsContact O-N 3.09Å
699T94.1Very high92.3Very high35 Ų3536 Ų3622%0.21519%0.187CC..Hα-helixtrans-67-48176-57.40000111.8L644 E695 S696 I697 V701 R702 L703L644-T699 HydrophobicContact CD2-CG2 3.84Å; E695-T699 WeakPolarHBondContact O-CB 3.33Å; E695-T699 PolarHBondContact O-N 2.87Å; E695-T699 PolarHBondContact O-OG1 3.05Å; S696-T699 PolarHBondContact O-N 3.32Å; I697-T699 PolarHBondContact O-N 3.18Å; T699-V701 PolarHBondContact O-N 3.44Å; T699-R702 PolarHBondContact O-N 3.06Å; T699-L703 HydrophobicContact CG2-CD1 4.04Å; T699-L703 HydrophobicContact CG2-CG 4.49Å; T699-L703 WeakPolarHBondContact O-CG 3.47Å; T699-L703 PolarHBondContact O-N 3.15Å
700L95.9Very high92.1Very high1 Ų139.9 Ų39.91%0.00521%0.205CC..Hα-helixtrans-60.1-45.5177-71.1173.5000111.8F640 L644 S696 I697 R702 L703 L704 L732 I735 F739 L815F640-L700 HydrophobicContact CZ-CD1 4.27Å; F640-L700 HydrophobicContact CZ-CD2 4.34Å; F640-L700 HydrophobicContact CZ-CG 4.25Å; L644-L700 HydrophobicContact CD1-CD2 4.24Å; S696-L700 WeakPolarHBondContact O-CG 3.01Å; S696-L700 PolarHBondContact O-N 3Å; I697-L700 PolarHBondContact O-N 3.32Å; L700-R702 VanDerWaalsContact C-N 3.33Å; L700-R702 PolarHBondContact O-N 3.09Å; L700-L703 PolarHBondContact O-N 3.46Å; L700-L704 WeakPolarHBondContact O-CB 3.46Å; L700-L704 PolarHBondContact O-N 3.05Å; L700-L732 HydrophobicContact CD2-CD2 3.96Å; L700-I735 HydrophobicContact CD2-CG2 4.39Å; L700-F739 HydrophobicContact CD1-CD1 4.18Å; L700-F739 HydrophobicContact CD1-CG 4.41Å; L700-L815 HydrophobicContact CB-CD1 4.06Å; L700-L815 HydrophobicContact CB-CD2 4.38Å; L700-L815 HydrophobicContact CD1-CD2 4.26Å
701V94.3Very high91.9Very high19 Ų1939.5 Ų39.512%0.11520%0.203CC..Hα-helixtrans-57.4-47.2176.7169.70000111I697 T699 N705 I814 L815I697-V701 HydrophobicContact CG2-CG2 4.16Å; I697-V701 WeakPolarHBondContact O-CB 3.42Å; I697-V701 VanDerWaalsContact O-CG2 3.25Å; I697-V701 WeakPolarHBondContact O-CG2 3.47Å; I697-V701 PolarHBondContact O-N 3.42Å; T699-V701 PolarHBondContact O-N 3.44Å; V701-N705 WeakPolarHBondContact CG1-ND2 3.49Å; V701-N705 VanDerWaalsContact O-CB 3.3Å; V701-N705 WeakPolarHBondContact O-CB 3.41Å; V701-N705 VanDerWaalsContact O-CG 3.25Å; V701-N705 PolarHBondContact O-N 3.04Å; V701-N705 PolarHBondContact O-ND2 2.91Å; V701-N705 VanDerWaalsContact O-ND2 3.12Å; V701-I814 HydrophobicContact CG1-CG2 3.73Å; V701-I814 HydrophobicContact CG2-CG2 4.43Å; V701-L815 HydrophobicContact CG2-CB 3.56Å; V701-L815 HydrophobicContact CG2-CD1 3.96Å; V701-L815 HydrophobicContact CG2-CG 4.31Å
702R94.2Very high91.9Very high119 Ų11939.1 Ų39.145%0.44920%0.198SC..Hα-helixtrans-62.4-52.2-179-175.6-175.163.876.70.2110.9T698 T699 L700 N705 E706T698-R702 WeakPolarHBondContact O-CB 3.49Å; T698-R702 PolarHBondContact O-N 3.21Å; T698-R702 VanDerWaalsContact O-N 3.09Å; T699-R702 PolarHBondContact O-N 3.06Å; L700-R702 VanDerWaalsContact C-N 3.33Å; L700-R702 PolarHBondContact O-N 3.09Å; R702-N705 PolarHBondContact O-N 3.24Å; R702-E706 VanDerWaalsContact CG-OE1 3.28Å; R702-E706 WeakPolarHBondContact CG-OE1 3.44Å; R702-E706 IonicContact CZ-OE1 2.88Å; R702-E706 IonicContact NH1-OE1 3.6Å; R702-E706 PolarHBondContact NH1-OE1 2.74Å; R702-E706 IonicContact NH1-OE2 3.92Å; R702-E706 PolarHBondContact NH1-OE2 3.37Å; R702-E706 WeakPolarHBondContact O-CB 3.48Å; R702-E706 VanDerWaalsContact O-CG 3.28Å; R702-E706 WeakPolarHBondContact O-CG 3.4Å; R702-E706 PolarHBondContact O-N 2.78Å
703L94.9Very high91.6Very high6 Ų644.3 Ų44.33%0.03122%0.22CC..Hα-helixtrans-62.6-47.9-178.3-68.8175.7000111.5L644 M648 V652 T699 L700 N705 E706 R707 L732L644-L703 HydrophobicContact CD1-CD1 4.44Å; L644-L703 HydrophobicContact CD2-CD1 3.61Å; L644-L703 HydrophobicContact CG-CD1 4.08Å; M648-L703 HydrophobicContact CE-CD2 4.42Å; V652-L703 HydrophobicContact CG1-CD2 3.85Å; T699-L703 HydrophobicContact CG2-CD1 4.04Å; T699-L703 HydrophobicContact CG2-CG 4.49Å; T699-L703 WeakPolarHBondContact O-CG 3.47Å; T699-L703 PolarHBondContact O-N 3.15Å; L700-L703 PolarHBondContact O-N 3.46Å; L703-N705 PolarHBondContact O-N 3.26Å; L703-E706 PolarHBondContact O-N 2.78Å; L703-R707 WeakPolarHBondContact O-CG 3.14Å; L703-R707 PolarHBondContact O-N 3.01Å; L703-L732 HydrophobicContact CB-CD1 4.08Å; L703-L732 HydrophobicContact CB-CD2 4.05Å; L703-L732 HydrophobicContact CD1-CD2 4.24Å
704L95Very high91.1Very high2 Ų245.8 Ų45.81%0.0123%0.226CC..Hα-helixtrans-57.9-51.2179-175.467.8000111.1L700 E706 R707 V708 L815 L819 L822L700-L704 WeakPolarHBondContact O-CB 3.46Å; L700-L704 PolarHBondContact O-N 3.05Å; L704-E706 PolarHBondContact O-N 3.42Å; L704-R707 PolarHBondContact O-N 2.76Å; L704-V708 HydrophobicContact CD1-CG2 4.28Å; L704-V708 HydrophobicContact CG-CG2 4.37Å; L704-V708 WeakPolarHBondContact O-CB 3.45Å; L704-V708 VanDerWaalsContact O-CG2 3.24Å; L704-V708 WeakPolarHBondContact O-CG2 3.31Å; L704-V708 PolarHBondContact O-N 3.15Å; L704-L815 HydrophobicContact CD2-CD1 4.25Å; L704-L819 HydrophobicContact CD2-CD2 3.61Å; L704-L819 HydrophobicContact CD2-CG 3.92Å; L704-L822 HydrophobicContact CD1-CD2 3.98Å
705N92.4Very high90Very high23 Ų2344.5 Ų44.512%0.12322%0.22CC..Hα-helixtrans-65.1-38.2-178.2-72.2-30.2000113V701 R702 L703 T709 S818V701-N705 WeakPolarHBondContact CG1-ND2 3.49Å; V701-N705 VanDerWaalsContact O-CB 3.3Å; V701-N705 WeakPolarHBondContact O-CB 3.41Å; V701-N705 VanDerWaalsContact O-CG 3.25Å; V701-N705 PolarHBondContact O-N 3.04Å; V701-N705 PolarHBondContact O-ND2 2.91Å; V701-N705 VanDerWaalsContact O-ND2 3.12Å; R702-N705 PolarHBondContact O-N 3.24Å; L703-N705 PolarHBondContact O-N 3.26Å; N705-T709 WeakPolarHBondContact O-CB 3.35Å; N705-T709 PolarHBondContact O-N 3.5Å; N705-T709 PolarHBondContact O-OG1 2.92Å; N705-S818 PolarHBondContact ND2-OG 3.1Å; N705-S818 VanDerWaalsContact OD1-CB 3.31Å; N705-S818 WeakPolarHBondContact OD1-CB 3.49Å; N705-S818 PolarHBondContact OD1-OG 3.26Å
706E92.3Very high88.2Confident71 Ų7147.1 Ų47.133%0.33224%0.237SC..Hα-helixtrans-59.8-48.1173.9-77.1172.1-167.800111.1R702 L703 L704 T709 Q710R702-E706 VanDerWaalsContact CG-OE1 3.28Å; R702-E706 WeakPolarHBondContact CG-OE1 3.44Å; R702-E706 IonicContact CZ-OE1 2.88Å; R702-E706 IonicContact NH1-OE1 3.6Å; R702-E706 PolarHBondContact NH1-OE1 2.74Å; R702-E706 IonicContact NH1-OE2 3.92Å; R702-E706 PolarHBondContact NH1-OE2 3.37Å; R702-E706 WeakPolarHBondContact O-CB 3.48Å; R702-E706 VanDerWaalsContact O-CG 3.28Å; R702-E706 WeakPolarHBondContact O-CG 3.4Å; R702-E706 PolarHBondContact O-N 2.78Å; L703-E706 PolarHBondContact O-N 2.78Å; L704-E706 PolarHBondContact O-N 3.42Å; E706-T709 WeakPolarHBondContact O-CB 3.19Å; E706-T709 PolarHBondContact O-N 3.04Å; E706-Q710 WeakPolarHBondContact O-CG 3.48Å; E706-Q710 PolarHBondContact O-N 3.27Å; E706-Q710 VanDerWaalsContact O-N 3.07Å
707R92.2Very high86.1Confident7 Ų750.8 Ų50.83%0.02626%0.262CS..Hα-helixtrans-69.5-40.1-179.2-63.5-44.3178.4-88.40.2112.9M648 L703 L704 T709 Q710 L711 L725 D728 I729 L732M648-R707 HydrophobicContact CE-CG 4.32Å; L703-R707 WeakPolarHBondContact O-CG 3.14Å; L703-R707 PolarHBondContact O-N 3.01Å; L704-R707 PolarHBondContact O-N 2.76Å; R707-T709 VanDerWaalsContact C-N 3.26Å; R707-T709 PolarHBondContact O-N 3.34Å; R707-Q710 WeakPolarHBondContact O-CB 3.24Å; R707-Q710 PolarHBondContact O-N 3.47Å; R707-Q710 VanDerWaalsContact O-N 3.16Å; R707-L711 WeakPolarHBondContact O-CB 3.4Å; R707-L711 PolarHBondContact O-N 2.56Å; R707-L725 HydrophobicContact CB-CD1 3.75Å; R707-L725 HydrophobicContact CG-CD1 4.01Å; R707-D728 HydrophobicContact CG-CB 4.32Å; R707-D728 IonicContact CZ-OD2 3.77Å; R707-D728 IonicContact NE-OD2 2.85Å; R707-D728 PolarHBondContact NE-OD2 3.07Å; R707-D728 IonicContact NH2-OD2 2.98Å; R707-I729 HydrophobicContact CB-CD1 4.12Å; R707-I729 HydrophobicContact CB-CG1 3.78Å; R707-L732 HydrophobicContact CG-CD1 4.35Å
708V90.4Very high84.3Confident9 Ų960.6 Ų60.66%0.05531%0.308CS..Hα-helixtrans-61.8-37.5173.9173.50000111L704 L711 I712 L822 L825L704-V708 HydrophobicContact CD1-CG2 4.28Å; L704-V708 HydrophobicContact CG-CG2 4.37Å; L704-V708 WeakPolarHBondContact O-CB 3.45Å; L704-V708 VanDerWaalsContact O-CG2 3.24Å; L704-V708 WeakPolarHBondContact O-CG2 3.31Å; L704-V708 PolarHBondContact O-N 3.15Å; V708-L711 WeakPolarHBondContact O-CB 3.36Å; V708-L711 PolarHBondContact O-N 2.97Å; V708-I712 HydrophobicContact CG1-CD1 4.09Å; V708-I712 WeakPolarHBondContact O-CD1 3.41Å; V708-I712 VanDerWaalsContact O-CG1 3.29Å; V708-I712 WeakPolarHBondContact O-CG1 3.43Å; V708-I712 PolarHBondContact O-N 3.44Å; V708-L822 HydrophobicContact CG1-CD1 4.5Å; V708-L822 HydrophobicContact CG2-CB 4.34Å; V708-L822 HydrophobicContact CG2-CD1 3.83Å; V708-L822 HydrophobicContact CG2-CD2 4.07Å; V708-L822 HydrophobicContact CG2-CG 4.3Å; V708-L825 HydrophobicContact CG1-CD1 3.98Å
709T89.7Confident82.7Confident68 Ų6859.3 Ų59.342%0.41730%0.302SS..Hα-helixtrans-65.1-41.7175.1-57.10000111.7N705 E706 R707 L711 Q713N705-T709 WeakPolarHBondContact O-CB 3.35Å; N705-T709 PolarHBondContact O-N 3.5Å; N705-T709 PolarHBondContact O-OG1 2.92Å; E706-T709 WeakPolarHBondContact O-CB 3.19Å; E706-T709 PolarHBondContact O-N 3.04Å; R707-T709 VanDerWaalsContact C-N 3.26Å; R707-T709 PolarHBondContact O-N 3.34Å; T709-L711 VanDerWaalsContact C-N 3.32Å; T709-Q713 WeakPolarHBondContact O-CG 3.35Å; T709-Q713 PolarHBondContact O-N 3.38Å
710Q88.6Confident81Confident82 Ų8259.7 Ų59.738%0.38330%0.302SS..Hα-helixtrans-64.4-38.5174.2-68.3168.9-0.200111.6E706 R707 I712 Q713 L714 L725E706-Q710 WeakPolarHBondContact O-CG 3.48Å; E706-Q710 PolarHBondContact O-N 3.27Å; E706-Q710 VanDerWaalsContact O-N 3.07Å; R707-Q710 WeakPolarHBondContact O-CB 3.24Å; R707-Q710 PolarHBondContact O-N 3.47Å; R707-Q710 VanDerWaalsContact O-N 3.16Å; Q710-I712 PolarHBondContact O-N 3.29Å; Q710-Q713 WeakPolarHBondContact O-CB 3.48Å; Q710-Q713 PolarHBondContact O-N 3.11Å; Q710-Q713 VanDerWaalsContact O-N 3.13Å; Q710-L714 WeakPolarHBondContact O-CG 3.44Å; Q710-L714 PolarHBondContact O-N 3.04Å; Q710-L725 HydrophobicContact CB-CD1 4.19Å; Q710-L725 HydrophobicContact CB-CD2 3.9Å
711L87.4Confident79.6Confident6 Ų667.2 Ų67.23%0.03134%0.335CS..Hα-helixtrans-63.5-43.2179.8-178.465.3000111.2R707 V708 T709 Q713 L714 L725 F726 I729 L822 I831R707-L711 WeakPolarHBondContact O-CB 3.4Å; R707-L711 PolarHBondContact O-N 2.56Å; V708-L711 WeakPolarHBondContact O-CB 3.36Å; V708-L711 PolarHBondContact O-N 2.97Å; T709-L711 VanDerWaalsContact C-N 3.32Å; L711-Q713 VanDerWaalsContact C-N 3.26Å; L711-Q713 PolarHBondContact O-N 3.26Å; L711-L714 PolarHBondContact O-N 2.98Å; L711-L725 HydrophobicContact CB-CD2 3.93Å; L711-L725 HydrophobicContact CD1-CD2 4.21Å; L711-F726 HydrophobicContact CD1-CD1 3.9Å; L711-F726 HydrophobicContact CD1-CE1 3.44Å; L711-F726 VanDerWaalsContact CD1-CE1 3.44Å; L711-I729 HydrophobicContact CB-CD1 4.23Å; L711-I729 HydrophobicContact CD2-CD1 3.77Å; L711-I729 HydrophobicContact CG-CD1 4.43Å; L711-L822 HydrophobicContact CD2-CD1 4.3Å; L711-I831 HydrophobicContact CD1-CG2 4.2Å; L711-I831 HydrophobicContact CD2-CG2 3.62Å; L711-I831 HydrophobicContact CG-CG2 3.49Å; L711-I831 VanDerWaalsContact CG-CG2 3.49Å
712I86.7Confident78.7Confident21 Ų2167 Ų6711%0.10833%0.334CS..Hα-helixtrans-62.4-34.7175-66.4161.6000111.3V708 Q710 L714 Q715 M795 L825V708-I712 HydrophobicContact CG1-CD1 4.09Å; V708-I712 WeakPolarHBondContact O-CD1 3.41Å; V708-I712 VanDerWaalsContact O-CG1 3.29Å; V708-I712 WeakPolarHBondContact O-CG1 3.43Å; V708-I712 PolarHBondContact O-N 3.44Å; Q710-I712 PolarHBondContact O-N 3.29Å; I712-L714 VanDerWaalsContact C-N 3.34Å; I712-Q715 WeakPolarHBondContact O-CG 3.39Å; I712-M795 HydrophobicContact CG1-CG 4.38Å; I712-M795 HydrophobicContact CG2-CE 4.08Å; I712-M795 HydrophobicContact CG2-CG 3.76Å; I712-M795 HydrophobicContact CG2-SD 4.33Å; I712-L825 HydrophobicContact CD1-CD1 3.91Å; I712-L825 HydrophobicContact CG1-CD1 4.34Å
713Q84.5Confident78.1Confident150 Ų15064.6 Ų64.670%0.70133%0.329SS*.Hα-helixtrans-72.7-26.4179.5-69.1170.68.800113.2T709 Q710 L711T709-Q713 WeakPolarHBondContact O-CG 3.35Å; T709-Q713 PolarHBondContact O-N 3.38Å; Q710-Q713 WeakPolarHBondContact O-CB 3.48Å; Q710-Q713 PolarHBondContact O-N 3.11Å; Q710-Q713 VanDerWaalsContact O-N 3.13Å; L711-Q713 VanDerWaalsContact C-N 3.26Å; L711-Q713 PolarHBondContact O-N 3.26Å
714L78.6Confident77.7Confident54 Ų5465.1 Ų65.128%0.28333%0.332SS..THydrogen-bonded Turntrans-87.33.7-174.5-75.7174.1000114.9Q710 L711 I712 N716 C717 L725Q710-L714 WeakPolarHBondContact O-CG 3.44Å; Q710-L714 PolarHBondContact O-N 3.04Å; L711-L714 PolarHBondContact O-N 2.98Å; I712-L714 VanDerWaalsContact C-N 3.34Å; L714-N716 PolarHBondContact O-N 3.41Å; L714-C717 PolarHBondContact O-N 2.79Å; L714-C717 VanDerWaalsContact O-N 3.08Å; L714-L725 HydrophobicContact CD1-CD2 3.6Å
715Q64.9Low77.4Confident88 Ų8865.4 Ų65.441%0.41133%0.334SS..THydrogen-bonded Turntrans-43.1-18.9-170.3-91.8-167.5-38.600118.9I712 M795 I831I712-Q715 WeakPolarHBondContact O-CG 3.39Å; Q715-M795 PolarHBondContact NE2-SD 3.45Å; Q715-M795 PolarHBondContact OE1-SD 3.29Å; Q715-M795 VanDerWaalsContact OE1-SD 3.38Å; Q715-I831 HydrophobicContact CG-CG1 4.46Å
716N55.3Low77.3Confident154 Ų15466.8 Ų66.882%0.82434%0.339SS*.THydrogen-bonded Turntrans-12411.5-172.7-65.7-26.6000114.7L714L714-N716 PolarHBondContact O-N 3.41Å
717C50.1Low77.2Confident81 Ų8166 Ų6655%0.54734%0.335SS..  trans-131.4108.6-177.8-75.30000113.8L714 S719L714-C717 PolarHBondContact O-N 2.79Å; L714-C717 VanDerWaalsContact O-N 3.08Å; C717-S719 VanDerWaalsContact C-N 3.28Å; C717-S719 PolarHBondContact O-N 3.37Å
718E55.1Low77.3Confident205 Ų20566 Ų6696%0.95834%0.335SS*.  trans-63.485.3157.6-68173.3-18000109
719S59.5Low77.5Confident44 Ų4465.5 Ų65.531%0.30833%0.333SS..  trans-131.8148.2178.466.50000109.2C717 K721 S722C717-S719 VanDerWaalsContact C-N 3.28Å; C717-S719 PolarHBondContact O-N 3.37Å; S719-K721 PolarHBondContact O-N 3.4Å; S719-S722 WeakPolarHBondContact O-CB 3.46Å; S719-S722 PolarHBondContact O-N 2.89Å; S719-S722 PolarHBondContact O-OG 3.27Å
720L59.5Low77.7Confident44 Ų4462.5 Ų62.523%0.2331%0.314CS..Hα-helixtrans-46.7-31.3177.8-74.5162.9000114H660 S722 I723 D724H660-L720 HydrophobicContact CB-CD1 4.39Å; H660-L720 WeakPolarHBondContact CD2-CD1 3.25Å; H660-L720 WeakPolarHBondContact NE2-CD1 3.35Å; L720-S722 PolarHBondContact O-N 2.98Å; L720-I723 HydrophobicContact CD2-CD1 4.35Å; L720-I723 WeakPolarHBondContact O-CB 3.48Å; L720-I723 PolarHBondContact O-N 2.98Å; L720-I723 VanDerWaalsContact O-N 3.08Å; L720-D724 PolarHBondContact O-N 3.46Å
721K66.3Low78.1Confident159 Ų15959 Ų5969%0.69130%0.297SS*.Hα-helixtrans-61.6-25.7175.7-66.6-174.9178.4-177.60114.1S719 L725S719-K721 PolarHBondContact O-N 3.4Å; K721-L725 WeakPolarHBondContact O-CB 3.42Å; K721-L725 PolarHBondContact O-N 3.09Å
722S75.4Confident78.5Confident14 Ų1458.8 Ų58.810%0.09830%0.296CS..Hα-helixtrans-72.5-34.5174.766.60000111.4S719 L720 L725 F726S719-S722 WeakPolarHBondContact O-CB 3.46Å; S719-S722 PolarHBondContact O-N 2.89Å; S719-S722 PolarHBondContact O-OG 3.27Å; L720-S722 PolarHBondContact O-N 2.98Å; S722-L725 PolarHBondContact O-N 3.36Å; S722-F726 WeakPolarHBondContact O-CB 3.43Å; S722-F726 WeakPolarHBondContact O-CD1 3.48Å; S722-F726 WeakPolarHBondContact O-CD2 3.39Å; S722-F726 WeakPolarHBondContact O-CG 3.32Å; S722-F726 PolarHBondContact O-N 3.01Å
723I81.3Confident79Confident68 Ų6857.8 Ų57.835%0.34929%0.291SS..Hα-helixtrans-65.1-50.8178.8-58.1175.9000109.7L720 L725 F726 E727L720-I723 HydrophobicContact CD2-CD1 4.35Å; L720-I723 WeakPolarHBondContact O-CB 3.48Å; L720-I723 PolarHBondContact O-N 2.98Å; L720-I723 VanDerWaalsContact O-N 3.08Å; I723-L725 PolarHBondContact O-N 2.9Å; I723-F726 PolarHBondContact O-N 3.49Å; I723-E727 WeakPolarHBondContact O-CB 3.35Å; I723-E727 PolarHBondContact O-N 3.45Å
724D85.7Confident79.5Confident17 Ų1750.6 Ų50.69%0.09126%0.258CS..Hα-helixtrans-57.4-38.7176.3-74.1-33.8000111.9A649 R655 T657 C658 L720 D728A649-D724 HydrophobicContact CB-CB 4.21Å; R655-D724 IonicContact NH1-OD1 3.27Å; R655-D724 PolarHBondContact NH1-OD1 3.44Å; R655-D724 PolarHBondContact NH2-O 3.43Å; T657-D724 WeakPolarHBondContact CB-OD2 3.37Å; C658-D724 PolarHBondContact N-OD1 3.17Å; L720-D724 PolarHBondContact O-N 3.46Å; D724-D728 PolarHBondContact O-N 3.02Å
725L89.5Confident80.4Confident9 Ų948.1 Ų48.15%0.04725%0.245CC..Hα-helixtrans-69.7-37.8177.1-178.163.7000112.7R707 Q710 L711 L714 K721 S722 I723 E727 D728 I729R707-L725 HydrophobicContact CB-CD1 3.75Å; R707-L725 HydrophobicContact CG-CD1 4.01Å; Q710-L725 HydrophobicContact CB-CD1 4.19Å; Q710-L725 HydrophobicContact CB-CD2 3.9Å; L711-L725 HydrophobicContact CB-CD2 3.93Å; L711-L725 HydrophobicContact CD1-CD2 4.21Å; L714-L725 HydrophobicContact CD1-CD2 3.6Å; K721-L725 WeakPolarHBondContact O-CB 3.42Å; K721-L725 PolarHBondContact O-N 3.09Å; S722-L725 PolarHBondContact O-N 3.36Å; I723-L725 PolarHBondContact O-N 2.9Å; L725-E727 VanDerWaalsContact C-N 3.33Å; L725-D728 PolarHBondContact O-N 3.14Å; L725-I729 HydrophobicContact CG-CD1 4.38Å; L725-I729 WeakPolarHBondContact O-CG1 3.26Å; L725-I729 PolarHBondContact O-N 3.42Å
726F90.5Very high81.8Confident52 Ų5244 Ų4423%0.22823%0.226CC..Hα-helixtrans-63.7-46.1175.7-62.3-18.8000109.8L711 S722 I723 D728 I729 H730 L836L711-F726 HydrophobicContact CD1-CD1 3.9Å; L711-F726 HydrophobicContact CD1-CE1 3.44Å; L711-F726 VanDerWaalsContact CD1-CE1 3.44Å; S722-F726 WeakPolarHBondContact O-CB 3.43Å; S722-F726 WeakPolarHBondContact O-CD1 3.48Å; S722-F726 WeakPolarHBondContact O-CD2 3.39Å; S722-F726 WeakPolarHBondContact O-CG 3.32Å; S722-F726 PolarHBondContact O-N 3.01Å; I723-F726 PolarHBondContact O-N 3.49Å; F726-D728 VanDerWaalsContact C-N 3.34Å; F726-D728 PolarHBondContact O-N 2.67Å; F726-I729 PolarHBondContact O-N 3.25Å; F726-H730 WeakPolarHBondContact O-CB 3.38Å; F726-H730 PolarHBondContact O-N 3.31Å; F726-L836 HydrophobicContact CB-CD1 4Å; F726-L836 HydrophobicContact CB-CG 4.47Å; F726-L836 HydrophobicContact CD1-CD1 3.87Å; F726-L836 HydrophobicContact CG-CD1 4.12Å; F726-L836 WeakPolarHBondContact O-CD2 3.4Å
727E90Very high83.7Confident54 Ų5436.8 Ų36.825%0.25219%0.187SC..Hα-helixtrans-60.3-41.5177.8-167.466.1-165.600112.3I723 L725 I729 H730 W731I723-E727 WeakPolarHBondContact O-CB 3.35Å; I723-E727 PolarHBondContact O-N 3.45Å; L725-E727 VanDerWaalsContact C-N 3.33Å; E727-I729 VanDerWaalsContact C-N 3.31Å; E727-I729 PolarHBondContact O-N 3.45Å; E727-H730 WeakPolarHBondContact O-CB 3.44Å; E727-H730 PolarHBondContact O-N 2.84Å; E727-W731 PolarHBondContact O-N 2.91Å; E727-W731 VanDerWaalsContact O-N 3.14Å; E727-W731 PolarHBondContact OE1-NE1 2.96Å
728D94.1Very high85.7Confident6 Ų633.2 Ų33.23%0.03216%0.162CC..Hα-helixtrans-56.8-43.4172.7-8514.6000111.9M648 A649 R655 R707 D724 L725 F726 L732M648-D728 WeakPolarHBondContact CA-OD1 3.2Å; M648-D728 HydrophobicContact CE-CB 3.85Å; M648-D728 VanDerWaalsContact CE-OD2 3.31Å; M648-D728 WeakPolarHBondContact CE-OD2 3.23Å; M648-D728 HydrophobicContact SD-CB 4.09Å; A649-D728 WeakPolarHBondContact CB-OD1 3.43Å; A649-D728 PolarHBondContact N-OD1 2.71Å; R655-D728 IonicContact CZ-OD1 3.91Å; R655-D728 IonicContact NH2-OD1 3.37Å; R655-D728 PolarHBondContact NH2-OD1 3.03Å; R707-D728 HydrophobicContact CG-CB 4.32Å; R707-D728 IonicContact CZ-OD2 3.77Å; R707-D728 IonicContact NE-OD2 2.85Å; R707-D728 PolarHBondContact NE-OD2 3.07Å; R707-D728 IonicContact NH2-OD2 2.98Å; D724-D728 PolarHBondContact O-N 3.02Å; L725-D728 PolarHBondContact O-N 3.14Å; F726-D728 VanDerWaalsContact C-N 3.34Å; F726-D728 PolarHBondContact O-N 2.67Å; D728-L732 WeakPolarHBondContact O-CB 3.46Å; D728-L732 WeakPolarHBondContact O-CD1 3.19Å; D728-L732 WeakPolarHBondContact O-CG 3.49Å; D728-L732 PolarHBondContact O-N 3.41Å
729I95Very high87.5Confident0 Ų023.4 Ų23.40%012%0.117CC..Hα-helixtrans-73.3-37.4-179.1-63.5172.4000110.8R707 L711 L725 F726 E727 L732 L733 L822 L836R707-I729 HydrophobicContact CB-CD1 4.12Å; R707-I729 HydrophobicContact CB-CG1 3.78Å; L711-I729 HydrophobicContact CB-CD1 4.23Å; L711-I729 HydrophobicContact CD2-CD1 3.77Å; L711-I729 HydrophobicContact CG-CD1 4.43Å; L725-I729 HydrophobicContact CG-CD1 4.38Å; L725-I729 WeakPolarHBondContact O-CG1 3.26Å; L725-I729 PolarHBondContact O-N 3.42Å; F726-I729 PolarHBondContact O-N 3.25Å; E727-I729 VanDerWaalsContact C-N 3.31Å; E727-I729 PolarHBondContact O-N 3.45Å; I729-L732 PolarHBondContact O-N 3.13Å; I729-L733 HydrophobicContact CG2-CD1 4.06Å; I729-L733 HydrophobicContact CG2-CG 4.3Å; I729-L733 WeakPolarHBondContact O-CG 3.36Å; I729-L733 PolarHBondContact O-N 3.03Å; I729-L822 HydrophobicContact CG2-CD2 3.78Å; I729-L836 HydrophobicContact CB-CD1 4.32Å; I729-L836 HydrophobicContact CB-CD2 3.88Å; I729-L836 HydrophobicContact CG2-CD1 4.32Å; I729-L836 HydrophobicContact CG2-CD2 3.79Å
730H94.8Very high89.1Confident4 Ų421.4 Ų21.42%0.01910%0.102CC..Hα-helixtrans-54.6-56.9176.5169.469.3000110.6D674 F726 E727 L732 L733 L734 L836 D839D674-H730 IonicContact OD2-NE2 2.71Å; F726-H730 WeakPolarHBondContact O-CB 3.38Å; F726-H730 PolarHBondContact O-N 3.31Å; E727-H730 WeakPolarHBondContact O-CB 3.44Å; E727-H730 PolarHBondContact O-N 2.84Å; H730-L732 VanDerWaalsContact C-N 3.33Å; H730-L732 PolarHBondContact O-N 3.01Å; H730-L733 WeakPolarHBondContact O-CB 3.48Å; H730-L733 PolarHBondContact O-N 3.24Å; H730-L733 VanDerWaalsContact O-N 3.11Å; H730-L734 VanDerWaalsContact CE1-CD1 3.49Å; H730-L734 WeakPolarHBondContact CE1-CD1 3.42Å; H730-L734 WeakPolarHBondContact NE2-CD1 3.05Å; H730-L734 PolarHBondContact O-N 2.89Å; H730-L836 HydrophobicContact CB-CD2 3.86Å; H730-L836 VanDerWaalsContact N-CD2 3.34Å; H730-D839 IonicContact CE1-OD1 3.76Å; H730-D839 IonicContact CE1-OD2 3.03Å; H730-D839 IonicContact CG-OD2 3.85Å; H730-D839 VanDerWaalsContact ND1-CG 3.32Å; H730-D839 IonicContact ND1-OD1 2.79Å; H730-D839 PolarHBondContact ND1-OD1 3.31Å; H730-D839 IonicContact ND1-OD2 3.58Å; H730-D839 PolarHBondContact ND1-OD2 3.47Å
731W95.7Very high90.6Very high8 Ų819.3 Ų19.33%0.039%0.092CC..Hα-helixtrans-64.1-35.5178.8-70.7107.7000113.2K647 D674 L682 E727 L733 L734 I735K647-W731 HydrophobicContact CB-CB 3.82Å; K647-W731 HydrophobicContact CB-CD2 4.14Å; K647-W731 HydrophobicContact CB-CG 3.67Å; K647-W731 HydrophobicContact CD-CD2 3.7Å; K647-W731 HydrophobicContact CD-CE3 4Å; K647-W731 HydrophobicContact CD-CG 4.14Å; K647-W731 HydrophobicContact CD-CH2 4.44Å; K647-W731 HydrophobicContact CD-CZ2 4.15Å; K647-W731 HydrophobicContact CD-CZ3 4.36Å; K647-W731 HydrophobicContact CG-CB 4.37Å; K647-W731 HydrophobicContact CG-CD2 3.92Å; K647-W731 HydrophobicContact CG-CE3 4.14Å; K647-W731 HydrophobicContact CG-CG 4Å; D674-W731 HydrophobicContact CB-CH2 3.87Å; D674-W731 HydrophobicContact CB-CZ2 4.12Å; L682-W731 HydrophobicContact CD2-CE3 4.34Å; L682-W731 HydrophobicContact CD2-CZ3 4.3Å; E727-W731 PolarHBondContact O-N 2.91Å; E727-W731 VanDerWaalsContact O-N 3.14Å; E727-W731 PolarHBondContact OE1-NE1 2.96Å; W731-L733 VanDerWaalsContact C-N 3.31Å; W731-L733 PolarHBondContact O-N 3.45Å; W731-L734 HydrophobicContact CE3-CD1 4.26Å; W731-L734 HydrophobicContact CZ3-CD1 4.2Å; W731-L734 PolarHBondContact O-N 3.28Å; W731-I735 WeakPolarHBondContact O-CB 3.38Å; W731-I735 WeakPolarHBondContact O-CD1 3.44Å; W731-I735 VanDerWaalsContact O-CG1 3.23Å; W731-I735 WeakPolarHBondContact O-CG1 2.96Å; W731-I735 PolarHBondContact O-N 3.33Å
732L96.8Very high91.5Very high2 Ų213.3 Ų13.31%0.017%0.07CC..Hα-helixtrans-62.9-37.8174.7-76.4171.3000112.3L644 M648 L700 L703 R707 D728 I729 H730 S736L644-L732 HydrophobicContact CD1-CD2 3.88Å; M648-L732 HydrophobicContact CE-CD1 4.08Å; M648-L732 HydrophobicContact CE-CG 4.49Å; M648-L732 HydrophobicContact SD-CD1 4.24Å; M648-L732 HydrophobicContact SD-CD2 4.31Å; M648-L732 HydrophobicContact SD-CG 4.02Å; L700-L732 HydrophobicContact CD2-CD2 3.96Å; L703-L732 HydrophobicContact CB-CD1 4.08Å; L703-L732 HydrophobicContact CB-CD2 4.05Å; L703-L732 HydrophobicContact CD1-CD2 4.24Å; R707-L732 HydrophobicContact CG-CD1 4.35Å; D728-L732 WeakPolarHBondContact O-CB 3.46Å; D728-L732 WeakPolarHBondContact O-CD1 3.19Å; D728-L732 WeakPolarHBondContact O-CG 3.49Å; D728-L732 PolarHBondContact O-N 3.41Å; I729-L732 PolarHBondContact O-N 3.13Å; H730-L732 VanDerWaalsContact C-N 3.33Å; H730-L732 PolarHBondContact O-N 3.01Å; L732-S736 WeakPolarHBondContact O-CB 3.34Å; L732-S736 PolarHBondContact O-N 3.24Å; L732-S736 PolarHBondContact O-OG 3.4Å
733L96.5Very high91.8Very high0 Ų012.9 Ų12.90%07%0.068CC..Hα-helixtrans-67.9-48.5175.6-70.9172000110.7I729 H730 W731 I735 S736 G737 L819 L822 L836 D839 N840 L843I729-L733 HydrophobicContact CG2-CD1 4.06Å; I729-L733 HydrophobicContact CG2-CG 4.3Å; I729-L733 WeakPolarHBondContact O-CG 3.36Å; I729-L733 PolarHBondContact O-N 3.03Å; H730-L733 WeakPolarHBondContact O-CB 3.48Å; H730-L733 PolarHBondContact O-N 3.24Å; H730-L733 VanDerWaalsContact O-N 3.11Å; W731-L733 VanDerWaalsContact C-N 3.31Å; W731-L733 PolarHBondContact O-N 3.45Å; L733-I735 PolarHBondContact O-N 3.07Å; L733-S736 PolarHBondContact O-N 3.49Å; L733-G737 PolarHBondContact O-N 2.91Å; L733-L819 HydrophobicContact CD2-CD2 3.59Å; L733-L822 HydrophobicContact CD1-CD2 4.49Å; L733-L822 HydrophobicContact CD2-CD2 4.21Å; L733-L836 HydrophobicContact CD1-CD2 4.37Å; L733-D839 HydrophobicContact CB-CB 4.04Å; L733-D839 HydrophobicContact CD1-CB 3.78Å; L733-N840 HydrophobicContact CD1-CB 4.07Å; L733-N840 HydrophobicContact CD2-CB 4.37Å; L733-L843 HydrophobicContact CD2-CD1 4.39Å; L733-L843 WeakPolarHBondContact O-CD1 3.47Å
734L95.6Very high91.8Very high0 Ų011.3 Ų11.30%06%0.062CC..Hα-helixtrans-60.3-48.9179.4-64.4-171.4000112.4M675 L682 H730 W731 S736 G737 H738 W842M675-L734 HydrophobicContact CB-CD1 4.49Å; M675-L734 HydrophobicContact CB-CD2 4.34Å; M675-L734 HydrophobicContact CG-CD2 4.42Å; L682-L734 HydrophobicContact CD1-CB 4.01Å; L682-L734 HydrophobicContact CD1-CD1 3.96Å; L682-L734 HydrophobicContact CD2-CB 3.89Å; H730-L734 VanDerWaalsContact CE1-CD1 3.49Å; H730-L734 WeakPolarHBondContact CE1-CD1 3.42Å; H730-L734 WeakPolarHBondContact NE2-CD1 3.05Å; H730-L734 PolarHBondContact O-N 2.89Å; W731-L734 HydrophobicContact CE3-CD1 4.26Å; W731-L734 HydrophobicContact CZ3-CD1 4.2Å; W731-L734 PolarHBondContact O-N 3.28Å; L734-S736 VanDerWaalsContact C-N 3.33Å; L734-S736 PolarHBondContact O-N 2.79Å; L734-G737 PolarHBondContact O-N 3.32Å; L734-G737 VanDerWaalsContact O-N 3.11Å; L734-H738 PolarHBondContact O-CD2 2.84Å; L734-H738 PolarHBondContact O-N 3.4Å; L734-H738 VanDerWaalsContact O-N 3.17Å; L734-W842 HydrophobicContact CD2-CE3 4.17Å; L734-W842 HydrophobicContact CD2-CH2 4.1Å; L734-W842 HydrophobicContact CD2-CZ3 3.86Å
735I95.7Very high91.6Very high2 Ų210.6 Ų10.61%0.016%0.058CC..Hα-helixtrans-61.3-42.8177.6-66.5167.3000110.6F640 Y643 L644 L682 L700 W731 L733 G737 H738 F739F640-I735 HydrophobicContact CE2-CG2 3.79Å; F640-I735 HydrophobicContact CZ-CG2 4.34Å; Y643-I735 HydrophobicContact CD1-CD1 4.07Å; Y643-I735 HydrophobicContact CE1-CD1 4.1Å; Y643-I735 HydrophobicContact CE1-CG1 4.28Å; L644-I735 HydrophobicContact CD1-CD1 3.73Å; L682-I735 HydrophobicContact CD2-CG1 3.86Å; L700-I735 HydrophobicContact CD2-CG2 4.39Å; W731-I735 WeakPolarHBondContact O-CB 3.38Å; W731-I735 WeakPolarHBondContact O-CD1 3.44Å; W731-I735 VanDerWaalsContact O-CG1 3.23Å; W731-I735 WeakPolarHBondContact O-CG1 2.96Å; W731-I735 PolarHBondContact O-N 3.33Å; L733-I735 PolarHBondContact O-N 3.07Å; I735-G737 VanDerWaalsContact C-N 3.29Å; I735-G737 PolarHBondContact O-N 3.24Å; I735-H738 PolarHBondContact O-N 3.42Å; I735-F739 WeakPolarHBondContact O-CB 3.38Å; I735-F739 PolarHBondContact O-N 2.87Å
736S95.7Very high91.2Very high2 Ų212.6 Ų12.61%0.0147%0.073CC..Hα-helixtrans-63.2-36.4176.6-61.90000111.8L732 L733 L734 F739 L740L732-S736 WeakPolarHBondContact O-CB 3.34Å; L732-S736 PolarHBondContact O-N 3.24Å; L732-S736 PolarHBondContact O-OG 3.4Å; L733-S736 PolarHBondContact O-N 3.49Å; L734-S736 VanDerWaalsContact C-N 3.33Å; L734-S736 PolarHBondContact O-N 2.79Å; S736-F739 PolarHBondContact O-N 2.96Å; S736-L740 VanDerWaalsContact O-CB 3.29Å; S736-L740 WeakPolarHBondContact O-CB 3.23Å; S736-L740 WeakPolarHBondContact O-CG 3.48Å; S736-L740 PolarHBondContact O-N 3.12Å
737G94Very high90.5Very high2 Ų210.3 Ų10.32%0.0216%0.063CC..Hα-helixtrans-62.9-45.5178.300000113.1L733 L734 I735 V741L733-G737 PolarHBondContact O-N 2.91Å; L734-G737 PolarHBondContact O-N 3.32Å; L734-G737 VanDerWaalsContact O-N 3.11Å; I735-G737 VanDerWaalsContact C-N 3.29Å; I735-G737 PolarHBondContact O-N 3.24Å; G737-V741 PolarHBondContact O-N 3.36Å
738H92.2Very high89.3Confident5 Ų511.5 Ų11.52%0.0237%0.074CC..Hα-helixtrans-76.6-29176.3-75.5-92.7000113.4L682 F683 L734 I735 W842 R846L682-H738 VanDerWaalsContact O-CB 3.25Å; L682-H738 WeakPolarHBondContact O-CB 3.15Å; F683-H738 WeakPolarHBondContact CA-ND1 3.15Å; L734-H738 PolarHBondContact O-CD2 2.84Å; L734-H738 PolarHBondContact O-N 3.4Å; L734-H738 VanDerWaalsContact O-N 3.17Å; I735-H738 PolarHBondContact O-N 3.42Å; H738-W842 AromaticContact CD2-CH2 3.68Å; H738-W842 AromaticContact NE2-CH2 3.78Å; H738-W842 AromaticContact NE2-CZ2 3.76Å; H738-R846 PolarHBondContact CD2-NH1 3.1Å; H738-R846 PolarHBondContact CE1-NH1 3.36Å; H738-R846 VanDerWaalsContact CE1-NH1 3.33Å; H738-R846 PolarHBondContact NE2-NH1 3.17Å; H738-R846 VanDerWaalsContact NE2-NH1 3.13Å
739F94.5Very high87.4Confident0 Ų013.3 Ų13.30%09%0.087CC..Hα-helixtrans-68.8-44.1174.6174.3-97.7000112.1G686 L690 P693 I697 L700 I735 S736 I767G686-F739 WeakPolarHBondContact O-CD2 3.47Å; L690-F739 HydrophobicContact CD2-CD2 4.11Å; L690-F739 HydrophobicContact CD2-CE2 3.71Å; L690-F739 HydrophobicContact CD2-CZ 4.16Å; L690-F739 HydrophobicContact CG-CD2 4.46Å; L690-F739 HydrophobicContact CG-CE2 4.29Å; P693-F739 HydrophobicContact CB-CZ 4.47Å; I697-F739 HydrophobicContact CD1-CE1 4.07Å; I697-F739 HydrophobicContact CD1-CZ 4.11Å; I697-F739 HydrophobicContact CG1-CE1 3.46Å; I697-F739 VanDerWaalsContact CG1-CE1 3.46Å; I697-F739 HydrophobicContact CG1-CZ 3.64Å; L700-F739 HydrophobicContact CD1-CD1 4.18Å; L700-F739 HydrophobicContact CD1-CG 4.41Å; I735-F739 WeakPolarHBondContact O-CB 3.38Å; I735-F739 PolarHBondContact O-N 2.87Å; S736-F739 PolarHBondContact O-N 2.96Å; F739-I767 HydrophobicContact CD1-CD1 4.43Å; F739-I767 HydrophobicContact CE1-CD1 4.09Å; F739-I767 HydrophobicContact CZ-CD1 4.35Å; F739-I767 WeakPolarHBondContact O-CD1 3.41Å
740L93.3Very high85.5Confident1 Ų114.3 Ų14.31%0.0059%0.093CC..Hα-helixtrans-79-32.6-175.9-66.1174.3000112.8S736 P764 I767 L812 L815 L816 L819 L847 Y851S736-L740 VanDerWaalsContact O-CB 3.29Å; S736-L740 WeakPolarHBondContact O-CB 3.23Å; S736-L740 WeakPolarHBondContact O-CG 3.48Å; S736-L740 PolarHBondContact O-N 3.12Å; L740-P764 VanDerWaalsContact O-CD 3.28Å; L740-P764 WeakPolarHBondContact O-CD 3.46Å; L740-I767 HydrophobicContact CD2-CD1 4.47Å; L740-L812 HydrophobicContact CD2-CD1 3.37Å; L740-L815 HydrophobicContact CD1-CD2 4.43Å; L740-L815 HydrophobicContact CD2-CD2 4.21Å; L740-L816 HydrophobicContact CD1-CD2 4.15Å; L740-L819 HydrophobicContact CD1-CD1 3.93Å; L740-L847 HydrophobicContact CB-CD2 4.05Å; L740-L847 HydrophobicContact CD1-CD2 4.07Å; L740-Y851 PolarHBondContact O-OH 3.25Å; L740-Y851 VanDerWaalsContact O-OH 3.08Å
741V89.8Confident83.3Confident1 Ų117 Ų171%0.00611%0.107CC..  trans-134.6122.2-1751770000109.6G737 F761 R846 L847 T850 Y851G737-V741 PolarHBondContact O-N 3.36Å; V741-F761 HydrophobicContact CG1-CB 4.28Å; V741-F761 HydrophobicContact CG1-CD1 3.94Å; V741-R846 HydrophobicContact CB-CB 4.16Å; V741-R846 HydrophobicContact CG1-CB 4.18Å; V741-R846 HydrophobicContact CG2-CB 4.15Å; V741-R846 PolarHBondContact O-NH2 3.34Å; V741-L847 HydrophobicContact CG2-CD2 4.09Å; V741-T850 HydrophobicContact CG1-CG2 3.68Å; V741-T850 HydrophobicContact CG2-CG2 4.36Å; V741-T850 WeakPolarHBondContact CG2-OG1 3.27Å; V741-Y851 HydrophobicContact CG2-CD2 4.47Å; V741-Y851 HydrophobicContact CG2-CE2 3.95Å
742S86Confident80.9Confident33 Ų3326.3 Ų26.323%0.23114%0.143CC..BIsolated β-bridgetrans-79133.1169.4-173.70000109.5F683 F761 S762F683-S742 WeakPolarHBondContact CE2-OG 3.43Å; S742-F761 CarbonylContact O-C 3.57Å; S742-F761 VanDerWaalsContact O-CA 3.26Å; S742-F761 WeakPolarHBondContact O-CA 3.39Å; S742-S762 PolarHBondContact N-O 3.21Å; S742-S762 PolarHBondContact O-N 3.01Å
743G81Confident78.4Confident5 Ų529.1 Ų29.15%0.05216%0.156CC..SBendtrans154.5168.7179.800000112.5Q760 R846G743-Q760 WeakPolarHBondContact CA-O 3.48Å; G743-R846 PolarHBondContact O-NH2 3.12Å
744P81.1Confident75.9Confident35 Ų3532.8 Ų32.823%0.22720%0.195CC..  trans-65.9153.5-179.328.4-34.3000111.5E679 S746 Q760 F761E679-P744 WeakPolarHBondContact OE1-CA 3.35Å; P744-S746 VanDerWaalsContact C-N 3.34Å; P744-Q760 HydrophobicContact CG-CB 4.46Å; P744-F761 HydrophobicContact CG-CE1 4.44Å; P744-F761 HydrophobicContact CG-CE2 4.27Å; P744-F761 HydrophobicContact CG-CZ 3.85Å; P744-F761 VanDerWaalsContact O-CE1 3.27Å; P744-F761 WeakPolarHBondContact O-CE1 3.44Å; P744-F761 WeakPolarHBondContact O-CZ 3.5Å
745A82.8Confident73.2Confident1 Ų135.5 Ų35.51%0.00821%0.214CC..SBendtrans-68.9-36.2175.400000111.3M675 E679 L747 W842M675-A745 HydrophobicContact CG-CB 3.76Å; M675-A745 HydrophobicContact SD-CB 4.39Å; E679-A745 HydrophobicContact CG-CB 3.95Å; E679-A745 PolarHBondContact OE1-N 2.76Å; A745-L747 PolarHBondContact O-N 3.36Å; A745-W842 HydrophobicContact CB-CZ2 4.39Å; A745-W842 PolarHBondContact O-NE1 3.39Å
746S79.4Confident70.5Confident51 Ų5140.9 Ų40.936%0.35725%0.249SC..  trans-68.3116.6176.1-173.90000112P744 T748P744-S746 VanDerWaalsContact C-N 3.34Å; S746-T748 PolarHBondContact O-N 2.89Å; S746-T748 PolarHBondContact OG-OG1 3.47Å
747L76Confident67.8Low4 Ų449 Ų492%0.02128%0.279CS..THydrogen-bonded Turntrans-79.72.5177-62.3175.4000113.4A745 S749 V750 F761 W842 T845 R846 R948A745-L747 PolarHBondContact O-N 3.36Å; L747-S749 PolarHBondContact O-N 3.2Å; L747-V750 HydrophobicContact CD2-CG2 4.32Å; L747-V750 WeakPolarHBondContact O-CB 3.49Å; L747-V750 PolarHBondContact O-N 2.88Å; L747-V750 VanDerWaalsContact O-N 3.1Å; L747-F761 HydrophobicContact CD2-CE1 4.46Å; L747-F761 HydrophobicContact CD2-CZ 4.2Å; L747-W842 HydrophobicContact CD1-CG 4.36Å; L747-T845 HydrophobicContact CD1-CG2 3.91Å; L747-T845 HydrophobicContact CD2-CG2 4.27Å; L747-R846 HydrophobicContact CD2-CG 4.03Å; L747-R948 HydrophobicContact CD1-CB 4.43Å
748T65.7Low65.5Low79 Ų7954.1 Ų54.149%0.48531%0.306SS..Hα-helixtrans-62.1-30.9-177.955.50000112.7S746 V750 L751S746-T748 PolarHBondContact O-N 2.89Å; S746-T748 PolarHBondContact OG-OG1 3.47Å; T748-V750 VanDerWaalsContact C-N 3.31Å; T748-V750 PolarHBondContact O-N 3.29Å; T748-L751 PolarHBondContact O-N 2.94Å
749S54.1Low63.7Low45 Ų4559.7 Ų59.732%0.31534%0.34SS..Hα-helixtrans-67.8-29.5176.158.80000113.1L747 L751 Q760L747-S749 PolarHBondContact O-N 3.2Å; S749-L751 VanDerWaalsContact C-N 3.25Å; S749-L751 PolarHBondContact O-N 2.97Å; S749-Q760 PolarHBondContact OG-OE1 3.28Å
750V54.6Low62.4Low21 Ų2162.9 Ų62.913%0.12736%0.355CS..Hα-helixtrans-71.3-22.6177.8-167.70000111.8L747 T748 F761 V952L747-V750 HydrophobicContact CD2-CG2 4.32Å; L747-V750 WeakPolarHBondContact O-CB 3.49Å; L747-V750 PolarHBondContact O-N 2.88Å; L747-V750 VanDerWaalsContact O-N 3.1Å; T748-V750 VanDerWaalsContact C-N 3.31Å; T748-V750 PolarHBondContact O-N 3.29Å; V750-F761 HydrophobicContact CG2-CD2 3.71Å; V750-F761 HydrophobicContact CG2-CE2 3.13Å; V750-F761 HydrophobicContact CG2-CZ 3.75Å; V750-V952 HydrophobicContact CG1-CG2 3.46Å; V750-V952 VanDerWaalsContact CG1-CG2 3.46Å
751L49.4Very low61.7Low60 Ų6063.1 Ų63.131%0.31436%0.356SS..Hα-helixtrans-93.9-16.2-170.3-61.7167.5000114.3T748 S749 M753 R948 N951T748-L751 PolarHBondContact O-N 2.94Å; S749-L751 VanDerWaalsContact C-N 3.25Å; S749-L751 PolarHBondContact O-N 2.97Å; L751-M753 PolarHBondContact O-N 3.44Å; L751-R948 HydrophobicContact CD1-CG 3.96Å; L751-R948 HydrophobicContact CD2-CG 4.4Å; L751-N951 HydrophobicContact CD2-CB 3.85Å
752R45.6Very low61.2Low204 Ų20465.8 Ų65.877%0.7738%0.375SS*.  trans-89.4105.9-177-71.5-169.9-174.2179.73.7111.9
753M42.7Very low61.2Low60 Ų6064.8 Ų64.830%0.29637%0.367SS..THydrogen-bonded Turntrans-63.9129169.6-76.1-75.8144.700111.5L751 M955 S1086 N1090L751-M753 PolarHBondContact O-N 3.44Å; M753-M955 HydrophobicContact CE-CB 3.65Å; M753-M955 HydrophobicContact CE-CE 3.18Å; M753-M955 HydrophobicContact CE-CG 3.7Å; M753-M955 HydrophobicContact CE-SD 4.24Å; M753-M955 HydrophobicContact CG-CE 4.1Å; M753-M955 HydrophobicContact SD-CE 3.55Å; M753-M955 VanDerWaalsContact SD-CE 3.55Å; M753-S1086 WeakPolarHBondContact CG-OG 3.27Å; M753-N1090 PolarHBondContact SD-ND2 3.24Å
754G45Very low61.5Low78 Ų7865.1 Ų65.180%0.80437%0.368SS*.THydrogen-bonded Turntrans96.45167.600000117.2
755S39.1Very low61.5Low57 Ų5769.4 Ų69.440%0.39939%0.385SS..  trans-87.9130.8167.8-169.40000109.6W757S755-W757 PolarHBondContact O-N 3.47Å; S755-W757 PolarHBondContact OG-NE1 3.46Å
756P38.9Very low61.5Low115 Ų11574.1 Ų74.175%0.74741%0.407SS*.SBendtrans-71.834.3-176.530.9-36.7000114.5
757W38.4Very low61.8Low171 Ų17171.7 Ų71.765%0.64839%0.39SS*.  trans-106.439.1-173.4-63.857.4000111.2S755 T759S755-W757 PolarHBondContact O-N 3.47Å; S755-W757 PolarHBondContact OG-NE1 3.46Å; W757-T759 PolarHBondContact O-N 2.92Å
758D44.9Very low62.1Low111 Ų11171.7 Ų71.759%0.59439%0.39SS*.THydrogen-bonded Turntrans-59.923.9-177.7-72.2-36.9000115.5V856D758-V856 VanDerWaalsContact O-O 3.08Å
759T55Low62.7Low121 Ų12171.9 Ų71.974%0.74238%0.382SS*.THydrogen-bonded Turntrans-147.918.9-169.665.20000116.2W757W757-T759 PolarHBondContact O-N 2.92Å
760Q67.3Low63.9Low67 Ų6771.3 Ų71.331%0.31338%0.376SS..SBendtrans-77.2-29-179.1-72-170.1-13.200113.9G743 P744 S749G743-Q760 WeakPolarHBondContact CA-O 3.48Å; P744-Q760 HydrophobicContact CG-CB 4.46Å; S749-Q760 PolarHBondContact OG-OE1 3.28Å
761F78.1Confident64.7Low7 Ų771.5 Ų71.53%0.03138%0.382CS..  trans-106.1126179.6-64-86.4000110.9V741 S742 P744 L747 V750 R846 T850 V856V741-F761 HydrophobicContact CG1-CB 4.28Å; V741-F761 HydrophobicContact CG1-CD1 3.94Å; S742-F761 CarbonylContact O-C 3.57Å; S742-F761 VanDerWaalsContact O-CA 3.26Å; S742-F761 WeakPolarHBondContact O-CA 3.39Å; P744-F761 HydrophobicContact CG-CE1 4.44Å; P744-F761 HydrophobicContact CG-CE2 4.27Å; P744-F761 HydrophobicContact CG-CZ 3.85Å; P744-F761 VanDerWaalsContact O-CE1 3.27Å; P744-F761 WeakPolarHBondContact O-CE1 3.44Å; P744-F761 WeakPolarHBondContact O-CZ 3.5Å; L747-F761 HydrophobicContact CD2-CE1 4.46Å; L747-F761 HydrophobicContact CD2-CZ 4.2Å; V750-F761 HydrophobicContact CG2-CD2 3.71Å; V750-F761 HydrophobicContact CG2-CE2 3.13Å; V750-F761 HydrophobicContact CG2-CZ 3.75Å; F761-R846 HydrophobicContact CE1-CG 4.28Å; F761-T850 HydrophobicContact CB-CG2 3.74Å; F761-V856 HydrophobicContact CB-CG1 4.35Å
762S80.6Confident65.8Low56 Ų5671.8 Ų71.839%0.39239%0.389SS..BIsolated β-bridgetrans-143.1153.4179.967.60000112.5S742 P764S742-S762 PolarHBondContact N-O 3.21Å; S742-S762 PolarHBondContact O-N 3.01Å; S762-P764 WeakPolarHBondContact O-CD 3.49Å
763I86.1Confident66.8Low13 Ų1369.2 Ų69.27%0.06739%0.39CS..  trans-79.4123.6171.7-55.2172.7000107.7H765 I767 L768 Y851I763-H765 PolarHBondContact O-N 3.4Å; I763-I767 HydrophobicContact CG2-CB 4.33Å; I763-I767 HydrophobicContact CG2-CG2 4.13Å; I763-L768 HydrophobicContact CB-CD1 4.42Å; I763-L768 HydrophobicContact CB-CD2 4.16Å; I763-L768 HydrophobicContact CB-CG 4.16Å; I763-L768 HydrophobicContact CD1-CD2 4.14Å; I763-L768 HydrophobicContact CG2-CD1 4.5Å; I763-L768 HydrophobicContact CG2-CD2 3.81Å; I763-L768 HydrophobicContact CG2-CG 3.75Å; I763-Y851 HydrophobicContact CD1-CD1 3.72Å; I763-Y851 HydrophobicContact CD1-CD2 4.45Å; I763-Y851 HydrophobicContact CD1-CE1 3.74Å; I763-Y851 HydrophobicContact CD1-CE2 4.47Å; I763-Y851 HydrophobicContact CD1-CG 4.1Å; I763-Y851 HydrophobicContact CG1-CD1 4.43Å; I763-Y851 HydrophobicContact CG1-CD2 4.44Å; I763-Y851 HydrophobicContact CG1-CE1 4.15Å; I763-Y851 HydrophobicContact CG1-CE2 4.17Å; I763-Y851 HydrophobicContact CG2-CE1 4.09Å
764P85.8Confident68.2Low12 Ų1271.4 Ų71.48%0.07840%0.403CS..  trans-56.2135177-23.832.8000112.1L690 L740 S762 Q766 I767 L768L690-P764 HydrophobicContact CD1-CB 3.44Å; L690-P764 VanDerWaalsContact CD1-CB 3.44Å; L690-P764 HydrophobicContact CD1-CG 3.94Å; L690-P764 HydrophobicContact CD2-CB 4.01Å; L690-P764 HydrophobicContact CD2-CG 4.39Å; L690-P764 HydrophobicContact CG-CB 4.4Å; L740-P764 VanDerWaalsContact O-CD 3.28Å; L740-P764 WeakPolarHBondContact O-CD 3.46Å; S762-P764 WeakPolarHBondContact O-CD 3.49Å; P764-Q766 PolarHBondContact O-N 3.23Å; P764-I767 HydrophobicContact CB-CD1 4.37Å; P764-I767 HydrophobicContact CG-CD1 4.12Å; P764-I767 WeakPolarHBondContact O-CB 3.34Å; P764-I767 PolarHBondContact O-N 3.47Å; P764-L768 PolarHBondContact O-N 3.47Å
765H81.7Confident69.5Low125 Ų12572.7 Ų72.758%0.57940%0.395SS*.Hα-helixtrans-57.5-36.9-174.9-73.3-52.4000113I763 I767 L768 Y769I763-H765 PolarHBondContact O-N 3.4Å; H765-I767 VanDerWaalsContact C-N 3.25Å; H765-I767 PolarHBondContact O-N 2.91Å; H765-L768 WeakPolarHBondContact O-CB 3.5Å; H765-L768 PolarHBondContact O-N 2.83Å; H765-L768 VanDerWaalsContact O-N 3.13Å; H765-Y769 WeakPolarHBondContact O-CD2 3.28Å; H765-Y769 PolarHBondContact O-N 3.45Å
766Q83.7Confident71.5Confident99 Ų9971.8 Ų71.846%0.46339%0.388SS..Hα-helixtrans-60.8-35.3178.1-6385.2-2000112L690 P764 L770L690-Q766 HydrophobicContact CB-CB 4.21Å; L690-Q766 HydrophobicContact CB-CG 4.22Å; L690-Q766 HydrophobicContact CD2-CB 4.44Å; P764-Q766 PolarHBondContact O-N 3.23Å; Q766-L770 PolarHBondContact O-N 2.96Å
767I86.1Confident73.6Confident1 Ų168.4 Ų68.41%0.00536%0.363CS..Hα-helixtrans-72.5-39175.7-70.4175.1000110.6L690 F739 L740 I763 P764 H765 Y769 L770 L812 I871L690-I767 HydrophobicContact CD2-CD1 3.68Å; L690-I767 HydrophobicContact CD2-CG1 3.64Å; F739-I767 HydrophobicContact CD1-CD1 4.43Å; F739-I767 HydrophobicContact CE1-CD1 4.09Å; F739-I767 HydrophobicContact CZ-CD1 4.35Å; F739-I767 WeakPolarHBondContact O-CD1 3.41Å; L740-I767 HydrophobicContact CD2-CD1 4.47Å; I763-I767 HydrophobicContact CG2-CB 4.33Å; I763-I767 HydrophobicContact CG2-CG2 4.13Å; P764-I767 HydrophobicContact CB-CD1 4.37Å; P764-I767 HydrophobicContact CG-CD1 4.12Å; P764-I767 WeakPolarHBondContact O-CB 3.34Å; P764-I767 PolarHBondContact O-N 3.47Å; H765-I767 VanDerWaalsContact C-N 3.25Å; H765-I767 PolarHBondContact O-N 2.91Å; I767-Y769 VanDerWaalsContact C-N 3.34Å; I767-Y769 PolarHBondContact O-N 2.98Å; I767-L770 VanDerWaalsContact O-CB 3.3Å; I767-L770 WeakPolarHBondContact O-CB 3.13Å; I767-L770 PolarHBondContact O-N 3.33Å; I767-L812 HydrophobicContact CG2-CD2 3.62Å; I767-I871 HydrophobicContact CG2-CD1 4.44Å; I767-I871 VanDerWaalsContact O-CD1 3.32Å; I767-I871 WeakPolarHBondContact O-CD1 3.24Å
768L80.7Confident75.7Confident4 Ų462.5 Ų62.52%0.02135%0.346CS..Hα-helixtrans-59.1-44.3179.4-73.6171.4000111.9I763 P764 H765 L770 N865 S869I763-L768 HydrophobicContact CB-CD1 4.42Å; I763-L768 HydrophobicContact CB-CD2 4.16Å; I763-L768 HydrophobicContact CB-CG 4.16Å; I763-L768 HydrophobicContact CD1-CD2 4.14Å; I763-L768 HydrophobicContact CG2-CD1 4.5Å; I763-L768 HydrophobicContact CG2-CD2 3.81Å; I763-L768 HydrophobicContact CG2-CG 3.75Å; P764-L768 PolarHBondContact O-N 3.47Å; H765-L768 WeakPolarHBondContact O-CB 3.5Å; H765-L768 PolarHBondContact O-N 2.83Å; H765-L768 VanDerWaalsContact O-N 3.13Å; L768-L770 VanDerWaalsContact C-N 3.31Å; L768-L770 PolarHBondContact O-N 2.89Å; L768-N865 HydrophobicContact CD1-CB 4.3Å; L768-N865 WeakPolarHBondContact CD1-OD1 3.41Å; L768-N865 HydrophobicContact CD2-CB 3.95Å; L768-S869 WeakPolarHBondContact O-CA 3.4Å; L768-S869 WeakPolarHBondContact O-CB 3.41Å; L768-S869 PolarHBondContact O-OG 2.88Å
769Y78.2Confident77.6Confident82 Ų8262.5 Ų62.532%0.32235%0.35SS..THydrogen-bonded Turntrans-84.50.7-179.1-64.3-75.6000114.4N588 H765 I767 G771 S772 R868N588-Y769 PolarHBondContact ND2-OH 3.27Å; H765-Y769 WeakPolarHBondContact O-CD2 3.28Å; H765-Y769 PolarHBondContact O-N 3.45Å; I767-Y769 VanDerWaalsContact C-N 3.34Å; I767-Y769 PolarHBondContact O-N 2.98Å; Y769-G771 PolarHBondContact O-N 2.83Å; Y769-G771 VanDerWaalsContact O-N 3.08Å; Y769-S772 PolarHBondContact O-N 2.91Å; Y769-S772 VanDerWaalsContact O-N 3.16Å; Y769-S772 PolarHBondContact O-OG 3.2Å; Y769-R868 HydrophobicContact CD1-CB 4.36Å; Y769-R868 HydrophobicContact CE1-CB 3.8Å; Y769-R868 HydrophobicContact CE1-CG 3.99Å; Y769-R868 WeakPolarHBondContact OH-CD 3.23Å
770L79.9Confident79.1Confident34 Ų3458 Ų5818%0.17832%0.321CS..THydrogen-bonded Turntrans-62.2115.8-176.3-169.967.2000110.9P693 E694 I697 Q766 I767 L768 P870 I871P693-L770 HydrophobicContact CB-CD1 4.13Å; P693-L770 HydrophobicContact CG-CD1 3.74Å; E694-L770 HydrophobicContact CB-CD1 4.46Å; I697-L770 HydrophobicContact CD1-CD2 3.52Å; Q766-L770 PolarHBondContact O-N 2.96Å; I767-L770 VanDerWaalsContact O-CB 3.3Å; I767-L770 WeakPolarHBondContact O-CB 3.13Å; I767-L770 PolarHBondContact O-N 3.33Å; L768-L770 VanDerWaalsContact C-N 3.31Å; L768-L770 PolarHBondContact O-N 2.89Å; L770-P870 VanDerWaalsContact O-CG 3.23Å; L770-P870 WeakPolarHBondContact O-CG 3.16Å; L770-I871 HydrophobicContact CB-CD1 4.13Å
771G71.5Confident80.1Confident25 Ų2554.9 Ų54.926%0.25831%0.306SS..THydrogen-bonded Turntrans77.120.3178.400000115Y769 D773 N774Y769-G771 PolarHBondContact O-N 2.83Å; Y769-G771 VanDerWaalsContact O-N 3.08Å; G771-D773 PolarHBondContact O-N 3.09Å; G771-D773 VanDerWaalsContact O-N 3.13Å; G771-N774 PolarHBondContact O-N 3.1Å; G771-N774 VanDerWaalsContact O-N 3.13Å
772S72.2Confident80.5Confident66 Ų6657.2 Ų57.246%0.46232%0.315SS..THydrogen-bonded Turntrans-53.8-3017659.80000113.6Y769Y769-S772 PolarHBondContact O-N 2.91Å; Y769-S772 VanDerWaalsContact O-N 3.16Å; Y769-S772 PolarHBondContact O-OG 3.2Å
773D67.1Low80.7Confident150 Ų15061 Ų6180%0.80232%0.321SS*.THydrogen-bonded Turntrans-96.5-8.8-174.3-56.5-11.8000112.5G771G771-D773 PolarHBondContact O-N 3.09Å; G771-D773 VanDerWaalsContact O-N 3.13Å
774N71.9Confident80.8Confident105 Ų10560.4 Ų60.456%0.56132%0.318SS*.SBendtrans-94.6143-176.5-70.4-18000110.8G771 V776G771-N774 PolarHBondContact O-N 3.1Å; G771-N774 VanDerWaalsContact O-N 3.13Å; N774-V776 PolarHBondContact O-N 3.47Å
775T73.5Confident80.9Confident105 Ų10559.9 Ų59.964%0.64431%0.314SS*.  trans-67.9118.7169.7550000109H808T775-H808 VanDerWaalsContact O-CB 3.29Å; T775-H808 WeakPolarHBondContact O-CB 3.32Å; T775-H808 PolarHBondContact O-ND1 3.44Å; T775-H808 VanDerWaalsContact O-ND1 3.08Å; T775-H808 PolarHBondContact OG1-CE1 3.27Å; T775-H808 PolarHBondContact OG1-ND1 2.96Å
776V79.3Confident81.2Confident39 Ų3955.9 Ų55.924%0.23630%0.295CS..  trans-104.7129.5-177.4175.80000111N774 V778 P810 P870 I874N774-V776 PolarHBondContact O-N 3.47Å; V776-V778 PolarHBondContact O-N 3.48Å; V776-V778 VanDerWaalsContact O-N 3.15Å; V776-P810 HydrophobicContact CG1-CG 3.69Å; V776-P810 HydrophobicContact CG2-CG 4.28Å; V776-P870 HydrophobicContact CG2-CB 3.94Å; V776-I874 HydrophobicContact CG1-CD1 3.61Å; V776-I874 HydrophobicContact CG1-CG1 4.4Å
777D84.4Confident81.2Confident44 Ų4453.1 Ų53.124%0.23528%0.283CS..  trans-82.789.4175.1-172.1-19.6000110.7V779 N780 S781 H808D777-V779 VanDerWaalsContact C-N 3.3Å; D777-V779 PolarHBondContact O-N 3.17Å; D777-V779 PolarHBondContact OD1-N 3.11Å; D777-V779 VanDerWaalsContact OD1-N 3.16Å; D777-N780 PolarHBondContact OD1-N 3.09Å; D777-N780 PolarHBondContact OD2-ND2 3.26Å; D777-S781 WeakPolarHBondContact O-CB 3.34Å; D777-S781 PolarHBondContact O-N 2.96Å; D777-S781 PolarHBondContact O-OG 3.32Å; D777-H808 HydrophobicContact CB-CB 4.07Å; D777-H808 PolarHBondContact N-O 3.18Å
778V82.8Confident81.3Confident47 Ų4753 Ų5329%0.28528%0.283SS..Hα-helixtrans-62.3-36.9-179.1-179.80000111.9V776 R782 I874V776-V778 PolarHBondContact O-N 3.48Å; V776-V778 VanDerWaalsContact O-N 3.15Å; V778-R782 HydrophobicContact CG1-CG 4.36Å; V778-R782 WeakPolarHBondContact O-CB 3.33Å; V778-R782 WeakPolarHBondContact O-CG 3.4Å; V778-R782 PolarHBondContact O-N 3.1Å; V778-I874 HydrophobicContact CG1-CG1 4.28Å; V778-I874 HydrophobicContact CG2-CG1 4.25Å
779V83.8Confident81.5Confident111 Ų11153 Ų5367%0.67328%0.283SS*.Hα-helixtrans-69.5-51-173.9177.80000110.4D777 S781 R782 R783D777-V779 VanDerWaalsContact C-N 3.3Å; D777-V779 PolarHBondContact O-N 3.17Å; D777-V779 PolarHBondContact OD1-N 3.11Å; D777-V779 VanDerWaalsContact OD1-N 3.16Å; V779-S781 VanDerWaalsContact C-N 3.34Å; V779-R782 PolarHBondContact O-N 3.06Å; V779-R783 WeakPolarHBondContact O-CB 3.22Å; V779-R783 PolarHBondContact O-N 3.25Å
780N86.4Confident81.6Confident27 Ų2751.7 Ų51.714%0.14429%0.288CS..Hα-helixtrans-71.1-31.3178.9-72.7-44000112D777 R783 L784 I809D777-N780 PolarHBondContact OD1-N 3.09Å; D777-N780 PolarHBondContact OD2-ND2 3.26Å; N780-R783 PolarHBondContact O-N 3.03Å; N780-L784 PolarHBondContact O-N 3.38Å; N780-I809 HydrophobicContact CB-CD1 3.99Å; N780-I809 HydrophobicContact CB-CG1 4.36Å
781S88.1Confident81.4Confident0 Ų055.3 Ų55.30%030%0.304CS..Hα-helixtrans-60.8-49.4172-61.40000111.9D777 V779 R783 L784 I785 P810D777-S781 WeakPolarHBondContact O-CB 3.34Å; D777-S781 PolarHBondContact O-N 2.96Å; D777-S781 PolarHBondContact O-OG 3.32Å; V779-S781 VanDerWaalsContact C-N 3.34Å; S781-R783 VanDerWaalsContact C-N 3.32Å; S781-R783 PolarHBondContact O-N 2.97Å; S781-L784 PolarHBondContact O-N 3.05Å; S781-I785 WeakPolarHBondContact O-CG1 3.1Å; S781-I785 PolarHBondContact O-N 2.88Å; S781-I785 VanDerWaalsContact O-N 3.15Å; S781-P810 WeakPolarHBondContact OG-CD 3.31Å
782R87.5Confident81.4Confident57 Ų5755 Ų5522%0.21530%0.298CS..Hα-helixtrans-63.7-37.4176.5-73.2-178.6177.9171.35.9112.1V778 V779 I785 F786 T873 I874 I917V778-R782 HydrophobicContact CG1-CG 4.36Å; V778-R782 WeakPolarHBondContact O-CB 3.33Å; V778-R782 WeakPolarHBondContact O-CG 3.4Å; V778-R782 PolarHBondContact O-N 3.1Å; V779-R782 PolarHBondContact O-N 3.06Å; R782-I785 PolarHBondContact O-N 2.89Å; R782-F786 WeakPolarHBondContact O-CB 3.43Å; R782-F786 PolarHBondContact O-N 3.47Å; R782-T873 PolarHBondContact NH2-O 3.1Å; R782-I874 HydrophobicContact CG-CG2 3.99Å; R782-I874 PolarHBondContact NE-O 3.26Å; R782-I874 PolarHBondContact NH2-O 3.26Å; R782-I917 HydrophobicContact CB-CD1 4.26Å; R782-I917 HydrophobicContact CB-CG1 4.46Å; R782-I917 HydrophobicContact CG-CB 4.24Å; R782-I917 HydrophobicContact CG-CG1 4.33Å; R782-I917 HydrophobicContact CG-CG2 4.34Å; R782-I917 WeakPolarHBondContact O-CD1 3.22Å
783R84.8Confident81Confident135 Ų13553.6 Ų53.651%0.50929%0.287SS..Hα-helixtrans-63.8-40.2175.7-173.8170.5173.8-177.42.3112V779 N780 S781 F786 M787 L804V779-R783 WeakPolarHBondContact O-CB 3.22Å; V779-R783 PolarHBondContact O-N 3.25Å; N780-R783 PolarHBondContact O-N 3.03Å; S781-R783 VanDerWaalsContact C-N 3.32Å; S781-R783 PolarHBondContact O-N 2.97Å; R783-F786 PolarHBondContact O-N 3.47Å; R783-M787 HydrophobicContact CG-SD 4.36Å; R783-M787 VanDerWaalsContact O-CG 3.32Å; R783-M787 WeakPolarHBondContact O-CG 3.49Å; R783-M787 PolarHBondContact O-N 3.22Å; R783-L804 HydrophobicContact CG-CD2 4.28Å
784L88Confident81.3Confident1 Ų152.6 Ų52.61%0.00528%0.282CS..Hα-helixtrans-63.9-42.4176.3-174.365.5000111.8N780 S781 M787 S788 W799 P801 L804 I809 I814 C817N780-L784 PolarHBondContact O-N 3.38Å; S781-L784 PolarHBondContact O-N 3.05Å; L784-M787 PolarHBondContact O-N 2.93Å; L784-S788 PolarHBondContact O-N 2.89Å; L784-W799 HydrophobicContact CD1-CH2 3.78Å; L784-W799 HydrophobicContact CD1-CZ2 4.24Å; L784-W799 HydrophobicContact CD1-CZ3 4.36Å; L784-W799 HydrophobicContact CG-CH2 4.48Å; L784-P801 HydrophobicContact CD1-CG 4.04Å; L784-L804 HydrophobicContact CB-CD1 4.4Å; L784-L804 HydrophobicContact CD1-CD1 4.08Å; L784-I809 HydrophobicContact CD2-CG2 4.32Å; L784-I814 HydrophobicContact CD2-CG1 4.11Å; L784-C817 HydrophobicContact CD2-CB 4.45Å; L784-C817 HydrophobicContact CG-CB 4.22Å
785I88.6Confident81.6Confident1 Ų148.7 Ų48.71%0.00526%0.261CS..Hα-helixtrans-61.1-45.5174.8-64.1164.7000110.8S781 R782 M787 S788 I789 I813 C817 I874 L875 I917 C921S781-I785 WeakPolarHBondContact O-CG1 3.1Å; S781-I785 PolarHBondContact O-N 2.88Å; S781-I785 VanDerWaalsContact O-N 3.15Å; R782-I785 PolarHBondContact O-N 2.89Å; I785-M787 VanDerWaalsContact C-N 3.29Å; I785-M787 PolarHBondContact O-N 3.42Å; I785-S788 PolarHBondContact O-N 3Å; I785-S788 VanDerWaalsContact O-N 3.09Å; I785-S788 PolarHBondContact O-OG 3.42Å; I785-I789 PolarHBondContact O-N 3.24Å; I785-I813 HydrophobicContact CD1-CD1 4.36Å; I785-I813 HydrophobicContact CD1-CG2 4Å; I785-I813 HydrophobicContact CG1-CG2 3.81Å; I785-C817 VanDerWaalsContact CA-SG 3.52Å; I785-C817 VanDerWaalsContact CG1-SG 3.52Å; I785-I874 HydrophobicContact CD1-CG2 3.86Å; I785-L875 HydrophobicContact CD1-CD2 3.71Å; I785-I917 HydrophobicContact CB-CD1 4.05Å; I785-I917 HydrophobicContact CB-CG1 4.13Å; I785-I917 HydrophobicContact CD1-CG1 4.23Å; I785-I917 HydrophobicContact CG2-CD1 3.9Å; I785-I917 HydrophobicContact CG2-CG1 3.79Å; I785-C921 VanDerWaalsContact CG2-SG 3.52Å
786F86Confident81.8Confident40 Ų4050.2 Ų50.218%0.17527%0.265CS..Hα-helixtrans-60.3-40.3178.1-177.9-107.1000112.1R782 R783 S788 A790 Q791 I917 V920R782-F786 WeakPolarHBondContact O-CB 3.43Å; R782-F786 PolarHBondContact O-N 3.47Å; R783-F786 PolarHBondContact O-N 3.47Å; F786-S788 VanDerWaalsContact C-N 3.31Å; F786-S788 PolarHBondContact O-N 3.08Å; F786-A790 HydrophobicContact CD2-CB 3.88Å; F786-A790 HydrophobicContact CE2-CB 3.84Å; F786-A790 WeakPolarHBondContact O-CB 3.46Å; F786-A790 PolarHBondContact O-N 3.07Å; F786-Q791 HydrophobicContact CD1-CG 4.13Å; F786-Q791 HydrophobicContact CE1-CB 4.37Å; F786-Q791 HydrophobicContact CE1-CG 3.53Å; F786-Q791 VanDerWaalsContact CE1-OE1 3.29Å; F786-Q791 HydrophobicContact CZ-CG 3.82Å; F786-Q791 PolarHBondContact O-N 3.32Å; F786-I917 HydrophobicContact CB-CD1 4.37Å; F786-V920 HydrophobicContact CD2-CG1 3.68Å; F786-V920 HydrophobicContact CD2-CG2 4.15Å; F786-V920 HydrophobicContact CE2-CG1 4.38Å
787M85.3Confident81.9Confident41 Ų4150 Ų5020%0.20227%0.265CS..Hα-helixtrans-70.4-22175.9-68.4178.672.600113.9R783 L784 I785 Q791 C792 P793 P801 L804R783-M787 HydrophobicContact CG-SD 4.36Å; R783-M787 VanDerWaalsContact O-CG 3.32Å; R783-M787 WeakPolarHBondContact O-CG 3.49Å; R783-M787 PolarHBondContact O-N 3.22Å; L784-M787 PolarHBondContact O-N 2.93Å; I785-M787 VanDerWaalsContact C-N 3.29Å; I785-M787 PolarHBondContact O-N 3.42Å; M787-Q791 CarbonylContact O-C 3.39Å; M787-C792 WeakPolarHBondContact O-CA 3.07Å; M787-C792 PolarHBondContact O-N 3.23Å; M787-P793 WeakPolarHBondContact O-CD 3.48Å; M787-P801 HydrophobicContact CE-CB 4.23Å; M787-P801 HydrophobicContact CE-CG 4.17Å; M787-L804 HydrophobicContact SD-CD1 3.88Å
788S87.4Confident81.6Confident0 Ų057.1 Ų57.10%029%0.289CS..Hα-helixtrans-88-20.6-17766.70000114.7L784 I785 F786 C792 C817L784-S788 PolarHBondContact O-N 2.89Å; I785-S788 PolarHBondContact O-N 3Å; I785-S788 VanDerWaalsContact O-N 3.09Å; I785-S788 PolarHBondContact O-OG 3.42Å; F786-S788 VanDerWaalsContact C-N 3.31Å; F786-S788 PolarHBondContact O-N 3.08Å; S788-C792 PolarHBondContact O-SG 2.72Å; S788-C817 VanDerWaalsContact CB-O 3.31Å; S788-C817 WeakPolarHBondContact CB-O 3.46Å
789I85.1Confident81.5Confident4 Ų456.4 Ų56.42%0.02128%0.281CS..Hα-helixtrans-128.8-29.7-175.2-152.3177000114.6I785 F820 V920 L925I785-I789 PolarHBondContact O-N 3.24Å; I789-F820 HydrophobicContact CB-CB 4.19Å; I789-F820 HydrophobicContact CB-CG 4.33Å; I789-F820 HydrophobicContact CD1-CB 4.41Å; I789-F820 HydrophobicContact CD1-CD1 3.65Å; I789-F820 HydrophobicContact CD1-CD2 4.43Å; I789-F820 HydrophobicContact CD1-CE1 3.92Å; I789-F820 HydrophobicContact CD1-CG 3.94Å; I789-F820 HydrophobicContact CD1-CZ 4.44Å; I789-F820 HydrophobicContact CG1-CB 4.25Å; I789-F820 HydrophobicContact CG1-CD1 4.37Å; I789-F820 HydrophobicContact CG1-CG 4.3Å; I789-V920 HydrophobicContact CG2-CG1 4.1Å; I789-L925 HydrophobicContact CD1-CD2 4.04Å; I789-L925 HydrophobicContact CD1-CG 3.91Å
790A79.8Confident81.4Confident53 Ų5352.9 Ų52.944%0.43826%0.26SS..THydrogen-bonded Turntrans-108.1-35.6-175.700000113.1F786 V920F786-A790 HydrophobicContact CD2-CB 3.88Å; F786-A790 HydrophobicContact CE2-CB 3.84Å; F786-A790 WeakPolarHBondContact O-CB 3.46Å; F786-A790 PolarHBondContact O-N 3.07Å; A790-V920 HydrophobicContact CB-CG1 3.88Å
791Q76.6Confident81.2Confident111 Ų11152.2 Ų52.252%0.51926%0.258SS..SBendtrans-12049.9176.2-68-171.2-13.800111F786 M787 P793F786-Q791 HydrophobicContact CD1-CG 4.13Å; F786-Q791 HydrophobicContact CE1-CB 4.37Å; F786-Q791 HydrophobicContact CE1-CG 3.53Å; F786-Q791 VanDerWaalsContact CE1-OE1 3.29Å; F786-Q791 HydrophobicContact CZ-CG 3.82Å; F786-Q791 PolarHBondContact O-N 3.32Å; M787-Q791 CarbonylContact O-C 3.39Å; Q791-P793 WeakPolarHBondContact O-CD 3.35Å; Q791-P793 VanDerWaalsContact O-N 3.11Å
792C70.7Confident80.5Confident19 Ų1957.8 Ų57.813%0.12829%0.287CS..  trans-55.6120.6179.7-69.70000110.2M787 S788 W824M787-C792 WeakPolarHBondContact O-CA 3.07Å; M787-C792 PolarHBondContact O-N 3.23Å; S788-C792 PolarHBondContact O-SG 2.72Å; C792-W824 HydrophobicContact CB-CD2 3.32Å; C792-W824 HydrophobicContact CB-CE3 3.35Å; C792-W824 HydrophobicContact CB-CG 3.87Å; C792-W824 HydrophobicContact CB-CH2 3.85Å; C792-W824 HydrophobicContact CB-CZ2 3.86Å; C792-W824 HydrophobicContact CB-CZ3 3.56Å
793P63.6Low79.8Confident36 Ų3662.3 Ų62.323%0.23432%0.316CS..  trans-69154.5178.329.3-34.7000110.1M787 Q791 S797M787-P793 WeakPolarHBondContact O-CD 3.48Å; Q791-P793 WeakPolarHBondContact O-CD 3.35Å; Q791-P793 VanDerWaalsContact O-N 3.11Å; P793-S797 VanDerWaalsContact CB-OG 3.28Å; P793-S797 WeakPolarHBondContact CB-OG 3.48Å; P793-S797 WeakPolarHBondContact CG-OG 3.35Å
794D73.6Confident79.4Confident128 Ų12856.2 Ų56.268%0.68429%0.293SS*.  trans-44.8146.2179.6-67.7-32.4000111.5N796 S797D794-N796 PolarHBondContact O-N 3.12Å; D794-S797 WeakPolarHBondContact O-CB 3.35Å; D794-S797 PolarHBondContact O-N 3.38Å; D794-S797 PolarHBondContact O-OG 2.83Å
795M78.1Confident78.8Confident24 Ų2459.4 Ų59.412%0.11831%0.314CS..THydrogen-bonded Turntrans-44.2-38.5-175.6-176.8-169.28600115.3I712 Q715 S797 L825 Y829 I831I712-M795 HydrophobicContact CG1-CG 4.38Å; I712-M795 HydrophobicContact CG2-CE 4.08Å; I712-M795 HydrophobicContact CG2-CG 3.76Å; I712-M795 HydrophobicContact CG2-SD 4.33Å; Q715-M795 PolarHBondContact NE2-SD 3.45Å; Q715-M795 PolarHBondContact OE1-SD 3.29Å; Q715-M795 VanDerWaalsContact OE1-SD 3.38Å; M795-S797 VanDerWaalsContact C-N 3.3Å; M795-S797 PolarHBondContact O-N 3.49Å; M795-L825 HydrophobicContact CB-CD2 4.36Å; M795-L825 HydrophobicContact CG-CD2 4.22Å; M795-Y829 HydrophobicContact CB-CD2 4.3Å; M795-Y829 HydrophobicContact CB-CE2 3.89Å; M795-I831 HydrophobicContact CG-CD1 4Å; M795-I831 HydrophobicContact SD-CD1 3.84Å
796N78.2Confident78.2Confident136 Ų13662.9 Ų62.973%0.72733%0.328SS*.THydrogen-bonded Turntrans-83.51.3-178.5-66.6-32000114.6D794D794-N796 PolarHBondContact O-N 3.12Å
797S80.7Confident77.5Confident36 Ų3665.4 Ų65.425%0.25235%0.347SS..SBendtrans-68.6140.4177.163.20000111.1P793 D794 M795 R821P793-S797 VanDerWaalsContact CB-OG 3.28Å; P793-S797 WeakPolarHBondContact CB-OG 3.48Å; P793-S797 WeakPolarHBondContact CG-OG 3.35Å; D794-S797 WeakPolarHBondContact O-CB 3.35Å; D794-S797 PolarHBondContact O-N 3.38Å; D794-S797 PolarHBondContact O-OG 2.83Å; M795-S797 VanDerWaalsContact C-N 3.3Å; M795-S797 PolarHBondContact O-N 3.49Å; S797-R821 PolarHBondContact O-NH2 3.39Å; S797-R821 PolarHBondContact OG-NH1 2.96Å; S797-R821 PolarHBondContact OG-NH2 3.01Å
798R78.2Confident77.2Confident192 Ų19268.9 Ų68.973%0.72536%0.362SS*.  trans-65.1144.6173.8-75.2-174.3176.7-171-2.9111.3D802R798-D802 IonicContact NH1-OD2 3.97Å
799W81.9Confident77.1Confident32 Ų3269.5 Ų69.512%0.12137%0.365CS..SBendtrans-135.2135.7176.5-165.4-108.6000110.6L784 P801 C817 S818 R821L784-W799 HydrophobicContact CD1-CH2 3.78Å; L784-W799 HydrophobicContact CD1-CZ2 4.24Å; L784-W799 HydrophobicContact CD1-CZ3 4.36Å; L784-W799 HydrophobicContact CG-CH2 4.48Å; W799-P801 HydrophobicContact CE3-CG 4.48Å; W799-P801 HydrophobicContact CZ3-CG 4.23Å; W799-C817 HydrophobicContact CH2-CB 4.31Å; W799-C817 HydrophobicContact CZ2-CB 3.7Å; W799-S818 PolarHBondContact NE1-OG 3.34Å; W799-R821 VanDerWaalsContact CB-CZ 3.48Å; W799-R821 VanDerWaalsContact CG-CD 3.46Å
800P80Confident77.2Confident37 Ų3770.4 Ų70.424%0.2437%0.372CS..SBendcis-59.3155.1-11.3-24.336.9000112.9D802 Y806 I814P800-D802 PolarHBondContact O-N 3.14Å; P800-Y806 HydrophobicContact CB-CE1 3.6Å; P800-Y806 HydrophobicContact CB-CE2 4.39Å; P800-Y806 VanDerWaalsContact CB-CZ 3.42Å; P800-Y806 WeakPolarHBondContact CB-OH 3.46Å; P800-I814 HydrophobicContact CG-CG2 4.23Å
801P82.2Confident77.6Confident14 Ų1469.4 Ų69.49%0.09136%0.361CS..  trans-67.7125.9-177.127.6-35.2000113.4L784 M787 W799 N803 L804 Y806L784-P801 HydrophobicContact CD1-CG 4.04Å; M787-P801 HydrophobicContact CE-CB 4.23Å; M787-P801 HydrophobicContact CE-CG 4.17Å; W799-P801 HydrophobicContact CE3-CG 4.48Å; W799-P801 HydrophobicContact CZ3-CG 4.23Å; P801-N803 PolarHBondContact O-N 3.14Å; P801-L804 HydrophobicContact CG-CD1 4.02Å; P801-L804 PolarHBondContact O-N 2.84Å; P801-Y806 WeakPolarHBondContact CD-OH 3.43Å; P801-Y806 PolarHBondContact O-OH 3.39Å
802D75.2Confident78.2Confident116 Ų11664.1 Ų64.162%0.6234%0.337SS*.THydrogen-bonded Turntrans-59.3-14.9-177.1-62.8-34.6000114.8R798 P800 L804R798-D802 IonicContact NH1-OD2 3.97Å; P800-D802 PolarHBondContact O-N 3.14Å; D802-L804 PolarHBondContact O-N 3.5Å
803N72.7Confident79.1Confident152 Ų15263.2 Ų63.281%0.81333%0.331SS*.THydrogen-bonded Turntrans-85.31.8-171.4-62-14.4000115P801P801-N803 PolarHBondContact O-N 3.14Å
804L75.1Confident80.5Confident8 Ų862.6 Ų62.64%0.04233%0.325CS..SBendtrans-115.5135.6179.8-74.3168000110.9R783 L784 M787 P801 D802 Y806R783-L804 HydrophobicContact CG-CD2 4.28Å; L784-L804 HydrophobicContact CB-CD1 4.4Å; L784-L804 HydrophobicContact CD1-CD1 4.08Å; M787-L804 HydrophobicContact SD-CD1 3.88Å; P801-L804 HydrophobicContact CG-CD1 4.02Å; P801-L804 PolarHBondContact O-N 2.84Å; D802-L804 PolarHBondContact O-N 3.5Å; L804-Y806 VanDerWaalsContact O-CD2 3.3Å; L804-Y806 WeakPolarHBondContact O-CD2 3.3Å; L804-Y806 VanDerWaalsContact O-CE2 3.3Å; L804-Y806 WeakPolarHBondContact O-CE2 3.35Å; L804-Y806 PolarHBondContact O-N 3.18Å
805P75.4Confident81.4Confident68 Ų6856.5 Ų56.544%0.44229%0.292SS..  trans-70.8111170.229.3-31.2000109.2T807P805-T807 PolarHBondContact O-N 3.47Å
806Y77Confident82.2Confident73 Ų7355.5 Ų55.529%0.28629%0.288SS..  trans-74.6-7.2177.3-66.1-75.1000114P800 P801 L804 H808 I809 I814P800-Y806 HydrophobicContact CB-CE1 3.6Å; P800-Y806 HydrophobicContact CB-CE2 4.39Å; P800-Y806 VanDerWaalsContact CB-CZ 3.42Å; P800-Y806 WeakPolarHBondContact CB-OH 3.46Å; P801-Y806 WeakPolarHBondContact CD-OH 3.43Å; P801-Y806 PolarHBondContact O-OH 3.39Å; L804-Y806 VanDerWaalsContact O-CD2 3.3Å; L804-Y806 WeakPolarHBondContact O-CD2 3.3Å; L804-Y806 VanDerWaalsContact O-CE2 3.3Å; L804-Y806 WeakPolarHBondContact O-CE2 3.35Å; L804-Y806 PolarHBondContact O-N 3.18Å; Y806-H808 PolarHBondContact O-N 3.05Å; Y806-H808 VanDerWaalsContact O-N 3.17Å; Y806-I809 HydrophobicContact CD1-CD1 4.2Å; Y806-I809 PolarHBondContact O-N 3.31Å; Y806-I814 HydrophobicContact CD1-CD1 4.37Å
807T70.9Confident82.9Confident94 Ų9449 Ų4958%0.57725%0.253SS*.THydrogen-bonded Turntrans-57.5119.7175.551.20000109.1P805P805-T807 PolarHBondContact O-N 3.47Å
808H79.6Confident83.5Confident113 Ų11347.5 Ų47.552%0.52324%0.242SC..THydrogen-bonded Turntrans73.911.8-179.7-52.7-71.9000117.3T775 D777 Y806T775-H808 VanDerWaalsContact O-CB 3.29Å; T775-H808 WeakPolarHBondContact O-CB 3.32Å; T775-H808 PolarHBondContact O-ND1 3.44Å; T775-H808 VanDerWaalsContact O-ND1 3.08Å; T775-H808 PolarHBondContact OG1-CE1 3.27Å; T775-H808 PolarHBondContact OG1-ND1 2.96Å; D777-H808 HydrophobicContact CB-CB 4.07Å; D777-H808 PolarHBondContact N-O 3.18Å; Y806-H808 PolarHBondContact O-N 3.05Å; Y806-H808 VanDerWaalsContact O-N 3.17Å
809I85.1Confident84.3Confident13 Ų1338.3 Ų38.37%0.06721%0.207CC..  trans-85125167.4-58.8-178.1000108.7N780 L784 Y806 S811 I813 I814N780-I809 HydrophobicContact CB-CD1 3.99Å; N780-I809 HydrophobicContact CB-CG1 4.36Å; L784-I809 HydrophobicContact CD2-CG2 4.32Å; Y806-I809 HydrophobicContact CD1-CD1 4.2Å; Y806-I809 PolarHBondContact O-N 3.31Å; I809-S811 PolarHBondContact O-N 3.01Å; I809-I813 HydrophobicContact CG2-CB 4.4Å; I809-I813 HydrophobicContact CG2-CG2 4.46Å; I809-I814 HydrophobicContact CG2-CG1 4.09Å
810P87.3Confident84.9Confident24 Ų2436.9 Ų36.916%0.15620%0.202CC..  trans-63.9134.8179.7-20.532.3000111.7V776 S781 L812 I813 I814 I874V776-P810 HydrophobicContact CG1-CG 3.69Å; V776-P810 HydrophobicContact CG2-CG 4.28Å; S781-P810 WeakPolarHBondContact OG-CD 3.31Å; P810-L812 PolarHBondContact O-N 3.38Å; P810-L812 VanDerWaalsContact O-N 3.07Å; P810-I813 HydrophobicContact CB-CG1 4.23Å; P810-I813 HydrophobicContact CG-CG1 4.26Å; P810-I813 WeakPolarHBondContact O-CB 3.13Å; P810-I813 PolarHBondContact O-N 3.38Å; P810-I814 PolarHBondContact O-N 3.37Å; P810-I874 HydrophobicContact CG-CD1 4.04Å
811S87Confident85.5Confident32 Ų3235.7 Ų35.722%0.22419%0.193CC..Hα-helixtrans-54.8-30.9178.9-52.70000112.8I697 I809 I813 I814 L815I697-S811 VanDerWaalsContact CG2-C 3.41Å; I697-S811 WeakPolarHBondContact CG2-O 3.43Å; I809-S811 PolarHBondContact O-N 3.01Å; S811-I813 VanDerWaalsContact C-N 3.35Å; S811-I813 PolarHBondContact O-N 3.19Å; S811-I814 WeakPolarHBondContact O-CB 3.38Å; S811-I814 PolarHBondContact O-N 3.15Å; S811-L815 PolarHBondContact O-N 3.43Å
812L89.6Confident86Confident0 Ų035 Ų350%019%0.189CC..Hα-helixtrans-62.4-40.2176.1-172.868.1000112.6I697 L740 I767 P810 I814 L815 L816 I871I697-L812 HydrophobicContact CD1-CB 4.09Å; I697-L812 HydrophobicContact CD1-CD1 3.79Å; I697-L812 HydrophobicContact CG1-CD1 4.23Å; L740-L812 HydrophobicContact CD2-CD1 3.37Å; I767-L812 HydrophobicContact CG2-CD2 3.62Å; P810-L812 PolarHBondContact O-N 3.38Å; P810-L812 VanDerWaalsContact O-N 3.07Å; L812-I814 VanDerWaalsContact C-N 3.27Å; L812-I814 PolarHBondContact O-N 3.2Å; L812-L815 WeakPolarHBondContact O-CB 3Å; L812-L815 PolarHBondContact O-N 3.39Å; L812-L816 WeakPolarHBondContact O-CG 3.33Å; L812-L816 PolarHBondContact O-N 3.42Å; L812-I871 HydrophobicContact CB-CD1 4.46Å; L812-I871 HydrophobicContact CD2-CB 4.34Å; L812-I871 HydrophobicContact CD2-CD1 3.29Å; L812-I871 HydrophobicContact CD2-CG1 3.74Å; L812-I871 HydrophobicContact CD2-CG2 3.83Å; L812-I871 HydrophobicContact CG-CD1 4.5Å
813I90.5Very high86.9Confident0 Ų029.6 Ų29.60%016%0.159CC..Hα-helixtrans-64.9-38176.8-62.2-56.8000109.8I785 I809 P810 S811 L815 L816 C817 I871 I874 L875I785-I813 HydrophobicContact CD1-CD1 4.36Å; I785-I813 HydrophobicContact CD1-CG2 4Å; I785-I813 HydrophobicContact CG1-CG2 3.81Å; I809-I813 HydrophobicContact CG2-CB 4.4Å; I809-I813 HydrophobicContact CG2-CG2 4.46Å; P810-I813 HydrophobicContact CB-CG1 4.23Å; P810-I813 HydrophobicContact CG-CG1 4.26Å; P810-I813 WeakPolarHBondContact O-CB 3.13Å; P810-I813 PolarHBondContact O-N 3.38Å; S811-I813 VanDerWaalsContact C-N 3.35Å; S811-I813 PolarHBondContact O-N 3.19Å; I813-L815 VanDerWaalsContact C-N 3.33Å; I813-L815 PolarHBondContact O-N 3.28Å; I813-L816 HydrophobicContact CD1-CD1 4.36Å; I813-L816 PolarHBondContact O-N 3.06Å; I813-C817 WeakPolarHBondContact O-CB 3.11Å; I813-C817 PolarHBondContact O-N 3.28Å; I813-C817 PolarHBondContact O-SG 3.3Å; I813-I871 HydrophobicContact CD1-CG2 4.19Å; I813-I874 HydrophobicContact CD1-CD1 4.35Å; I813-I874 HydrophobicContact CD1-CG2 4.2Å; I813-I874 HydrophobicContact CG1-CD1 4.05Å; I813-L875 HydrophobicContact CD1-CD2 4.47Å
814I91.7Very high87.9Confident23 Ų2324.4 Ų24.412%0.11813%0.128CC..Hα-helixtrans-62.5-43.2176.1-55.2177.1000110.2V701 L784 P800 Y806 I809 P810 S811 L812 C817 S818V701-I814 HydrophobicContact CG1-CG2 3.73Å; V701-I814 HydrophobicContact CG2-CG2 4.43Å; L784-I814 HydrophobicContact CD2-CG1 4.11Å; P800-I814 HydrophobicContact CG-CG2 4.23Å; Y806-I814 HydrophobicContact CD1-CD1 4.37Å; I809-I814 HydrophobicContact CG2-CG1 4.09Å; P810-I814 PolarHBondContact O-N 3.37Å; S811-I814 WeakPolarHBondContact O-CB 3.38Å; S811-I814 PolarHBondContact O-N 3.15Å; L812-I814 VanDerWaalsContact C-N 3.27Å; L812-I814 PolarHBondContact O-N 3.2Å; I814-C817 PolarHBondContact O-N 3.42Å; I814-S818 WeakPolarHBondContact O-CB 3.1Å; I814-S818 PolarHBondContact O-N 3.49Å; I814-S818 PolarHBondContact O-OG 2.99Å
815L94Very high88.6Confident0 Ų024.1 Ų24.10%013%0.127CC..Hα-helixtrans-59-51.4175.4-17758.5000112I697 L700 V701 L704 L740 S811 L812 I813 C817 S818 L819I697-L815 HydrophobicContact CG2-CB 4.19Å; I697-L815 HydrophobicContact CG2-CD2 4.3Å; L700-L815 HydrophobicContact CB-CD1 4.06Å; L700-L815 HydrophobicContact CB-CD2 4.38Å; L700-L815 HydrophobicContact CD1-CD2 4.26Å; V701-L815 HydrophobicContact CG2-CB 3.56Å; V701-L815 HydrophobicContact CG2-CD1 3.96Å; V701-L815 HydrophobicContact CG2-CG 4.31Å; L704-L815 HydrophobicContact CD2-CD1 4.25Å; L740-L815 HydrophobicContact CD1-CD2 4.43Å; L740-L815 HydrophobicContact CD2-CD2 4.21Å; S811-L815 PolarHBondContact O-N 3.43Å; L812-L815 WeakPolarHBondContact O-CB 3Å; L812-L815 PolarHBondContact O-N 3.39Å; I813-L815 VanDerWaalsContact C-N 3.33Å; I813-L815 PolarHBondContact O-N 3.28Å; L815-C817 VanDerWaalsContact C-N 3.29Å; L815-C817 PolarHBondContact O-N 2.9Å; L815-S818 WeakPolarHBondContact O-CB 3.35Å; L815-S818 PolarHBondContact O-N 3.48Å; L815-S818 VanDerWaalsContact O-N 3.14Å; L815-L819 HydrophobicContact CD1-CD1 4.37Å; L815-L819 HydrophobicContact CD1-CG 4.47Å; L815-L819 HydrophobicContact CG-CD1 4.15Å; L815-L819 WeakPolarHBondContact O-CG 3.3Å; L815-L819 PolarHBondContact O-N 3Å
816L93.7Very high89.4Confident3 Ų320.9 Ų20.92%0.01611%0.106CC..Hα-helixtrans-57.1-43.8177.3-68.6174.6000111.5L740 L812 I813 S818 L819 F820 L847 L875L740-L816 HydrophobicContact CD1-CD2 4.15Å; L812-L816 WeakPolarHBondContact O-CG 3.33Å; L812-L816 PolarHBondContact O-N 3.42Å; I813-L816 HydrophobicContact CD1-CD1 4.36Å; I813-L816 PolarHBondContact O-N 3.06Å; L816-S818 PolarHBondContact O-N 2.96Å; L816-L819 PolarHBondContact O-N 3.23Å; L816-F820 HydrophobicContact CB-CE2 4.38Å; L816-F820 WeakPolarHBondContact O-CD2 3.5Å; L816-F820 WeakPolarHBondContact O-CG 3.38Å; L816-F820 PolarHBondContact O-N 3.26Å; L816-L847 HydrophobicContact CD2-CD1 3.6Å; L816-L847 HydrophobicContact CD2-CD2 3.99Å; L816-L847 HydrophobicContact CD2-CG 4.48Å; L816-L875 HydrophobicContact CD1-CD1 4.29Å
817C93.2Very high90.1Very high0 Ų017.5 Ų17.50%09%0.093CC..Hα-helixtrans-67.2-35.8178.7-64.80000112.4L784 I785 S788 W799 I813 I814 L815 R821L784-C817 HydrophobicContact CD2-CB 4.45Å; L784-C817 HydrophobicContact CG-CB 4.22Å; I785-C817 VanDerWaalsContact CA-SG 3.52Å; I785-C817 VanDerWaalsContact CG1-SG 3.52Å; S788-C817 VanDerWaalsContact CB-O 3.31Å; S788-C817 WeakPolarHBondContact CB-O 3.46Å; W799-C817 HydrophobicContact CH2-CB 4.31Å; W799-C817 HydrophobicContact CZ2-CB 3.7Å; I813-C817 WeakPolarHBondContact O-CB 3.11Å; I813-C817 PolarHBondContact O-N 3.28Å; I813-C817 PolarHBondContact O-SG 3.3Å; I814-C817 PolarHBondContact O-N 3.42Å; L815-C817 VanDerWaalsContact C-N 3.29Å; L815-C817 PolarHBondContact O-N 2.9Å; C817-R821 WeakPolarHBondContact O-CB 3.25Å; C817-R821 PolarHBondContact O-N 3.24Å
818S93.6Very high90.9Very high3 Ų314 Ų142%0.0217%0.073CC..Hα-helixtrans-65.2-40.5173.1-75.20000112.2N705 W799 I814 L815 L816 R821 L822N705-S818 PolarHBondContact ND2-OG 3.1Å; N705-S818 VanDerWaalsContact OD1-CB 3.31Å; N705-S818 WeakPolarHBondContact OD1-CB 3.49Å; N705-S818 PolarHBondContact OD1-OG 3.26Å; W799-S818 PolarHBondContact NE1-OG 3.34Å; I814-S818 WeakPolarHBondContact O-CB 3.1Å; I814-S818 PolarHBondContact O-N 3.49Å; I814-S818 PolarHBondContact O-OG 2.99Å; L815-S818 WeakPolarHBondContact O-CB 3.35Å; L815-S818 PolarHBondContact O-N 3.48Å; L815-S818 VanDerWaalsContact O-N 3.14Å; L816-S818 PolarHBondContact O-N 2.96Å; S818-R821 PolarHBondContact O-N 3.47Å; S818-L822 PolarHBondContact O-N 2.98Å
819L95.5Very high91.3Very high0 Ų012.8 Ų12.80%07%0.065CC..Hα-helixtrans-66-44.1176-67.1166.3000111.8L704 L733 L740 L815 L816 R821 L822 L823 L843 M844L704-L819 HydrophobicContact CD2-CD2 3.61Å; L704-L819 HydrophobicContact CD2-CG 3.92Å; L733-L819 HydrophobicContact CD2-CD2 3.59Å; L740-L819 HydrophobicContact CD1-CD1 3.93Å; L815-L819 HydrophobicContact CD1-CD1 4.37Å; L815-L819 HydrophobicContact CD1-CG 4.47Å; L815-L819 HydrophobicContact CG-CD1 4.15Å; L815-L819 WeakPolarHBondContact O-CG 3.3Å; L815-L819 PolarHBondContact O-N 3Å; L816-L819 PolarHBondContact O-N 3.23Å; L819-R821 VanDerWaalsContact C-N 3.35Å; L819-R821 PolarHBondContact O-N 3.38Å; L819-L822 PolarHBondContact O-N 3.44Å; L819-L823 PolarHBondContact O-N 3.38Å; L819-L843 HydrophobicContact CD1-CD1 4.19Å; L819-L843 HydrophobicContact CD1-CD2 3.96Å; L819-L843 HydrophobicContact CD2-CD1 4.24Å; L819-M844 HydrophobicContact CB-CE 3.6Å
820F93.7Very high91.3Very high2 Ų213.8 Ų13.81%0.0098%0.078CC..Hα-helixtrans-60.3-44.1173.8-70.1-41.1000112.4I789 L816 L822 L823 W824 M844 F852 L925I789-F820 HydrophobicContact CB-CB 4.19Å; I789-F820 HydrophobicContact CB-CG 4.33Å; I789-F820 HydrophobicContact CD1-CB 4.41Å; I789-F820 HydrophobicContact CD1-CD1 3.65Å; I789-F820 HydrophobicContact CD1-CD2 4.43Å; I789-F820 HydrophobicContact CD1-CE1 3.92Å; I789-F820 HydrophobicContact CD1-CG 3.94Å; I789-F820 HydrophobicContact CD1-CZ 4.44Å; I789-F820 HydrophobicContact CG1-CB 4.25Å; I789-F820 HydrophobicContact CG1-CD1 4.37Å; I789-F820 HydrophobicContact CG1-CG 4.3Å; L816-F820 HydrophobicContact CB-CE2 4.38Å; L816-F820 WeakPolarHBondContact O-CD2 3.5Å; L816-F820 WeakPolarHBondContact O-CG 3.38Å; L816-F820 PolarHBondContact O-N 3.26Å; F820-L822 VanDerWaalsContact C-N 3.31Å; F820-L822 PolarHBondContact O-N 3.44Å; F820-L823 PolarHBondContact O-N 3.35Å; F820-W824 PolarHBondContact O-N 2.96Å; F820-M844 HydrophobicContact CD1-CE 3.74Å; F820-M844 HydrophobicContact CD1-SD 3.6Å; F820-M844 HydrophobicContact CE1-CE 4.06Å; F820-M844 HydrophobicContact CE1-SD 3.37Å; F820-M844 WeakPolarHBondContact CE1-SD 3.47Å; F820-M844 HydrophobicContact CZ-SD 4.48Å; F820-F852 HydrophobicContact CZ-CE2 4.1Å; F820-F852 AromaticContact CZ-CZ 3.86Å; F820-F852 HydrophobicContact CZ-CZ 3.86Å; F820-L925 HydrophobicContact CD1-CD2 4.3Å; F820-L925 HydrophobicContact CE1-CD2 4.1Å
821R92.2Very high91.3Very high11 Ų1113.1 Ų13.14%0.0427%0.074CC..Hα-helixtrans-60.9-42.7176.7177.6175.9170.1134.3-2.1111.2S797 W799 C817 S818 L819 W824 L825S797-R821 PolarHBondContact O-NH2 3.39Å; S797-R821 PolarHBondContact OG-NH1 2.96Å; S797-R821 PolarHBondContact OG-NH2 3.01Å; W799-R821 VanDerWaalsContact CB-CZ 3.48Å; W799-R821 VanDerWaalsContact CG-CD 3.46Å; C817-R821 WeakPolarHBondContact O-CB 3.25Å; C817-R821 PolarHBondContact O-N 3.24Å; S818-R821 PolarHBondContact O-N 3.47Å; L819-R821 VanDerWaalsContact C-N 3.35Å; L819-R821 PolarHBondContact O-N 3.38Å; R821-W824 PolarHBondContact O-N 3.21Å; R821-L825 HydrophobicContact CG-CD1 4.08Å; R821-L825 HydrophobicContact CG-CG 4.42Å; R821-L825 VanDerWaalsContact O-CG 3.26Å; R821-L825 WeakPolarHBondContact O-CG 3.3Å; R821-L825 PolarHBondContact O-N 2.79Å
822L93.3Very high91.2Very high1 Ų112.6 Ų12.61%0.0057%0.073CC..Hα-helixtrans-60.2-47.5176.617754.2000111.1L704 V708 L711 I729 L733 S818 L819 F820 W824 L825 Q826L704-L822 HydrophobicContact CD1-CD2 3.98Å; V708-L822 HydrophobicContact CG1-CD1 4.5Å; V708-L822 HydrophobicContact CG2-CB 4.34Å; V708-L822 HydrophobicContact CG2-CD1 3.83Å; V708-L822 HydrophobicContact CG2-CD2 4.07Å; V708-L822 HydrophobicContact CG2-CG 4.3Å; L711-L822 HydrophobicContact CD2-CD1 4.3Å; I729-L822 HydrophobicContact CG2-CD2 3.78Å; L733-L822 HydrophobicContact CD1-CD2 4.49Å; L733-L822 HydrophobicContact CD2-CD2 4.21Å; S818-L822 PolarHBondContact O-N 2.98Å; L819-L822 PolarHBondContact O-N 3.44Å; F820-L822 VanDerWaalsContact C-N 3.31Å; F820-L822 PolarHBondContact O-N 3.44Å; L822-W824 VanDerWaalsContact C-N 3.3Å; L822-W824 PolarHBondContact O-N 3.25Å; L822-L825 PolarHBondContact O-N 3.02Å; L822-Q826 HydrophobicContact CD1-CG 4.13Å; L822-Q826 WeakPolarHBondContact O-CB 3.43Å; L822-Q826 WeakPolarHBondContact O-CG 3.41Å; L822-Q826 PolarHBondContact O-N 3.32Å
823L94.5Very high91.1Very high1 Ų114.1 Ų14.11%0.0058%0.084CC..Hα-helixtrans-59.2-44.9178-178.460.4000111L819 F820 L825 Q826 V827 N840 F841 M844 L925 C928L819-L823 PolarHBondContact O-N 3.38Å; F820-L823 PolarHBondContact O-N 3.35Å; L823-L825 VanDerWaalsContact C-N 3.34Å; L823-L825 PolarHBondContact O-N 3.16Å; L823-Q826 WeakPolarHBondContact O-CB 3.18Å; L823-Q826 PolarHBondContact O-N 3.35Å; L823-V827 HydrophobicContact CD1-CG1 3.99Å; L823-V827 WeakPolarHBondContact O-CG1 3.41Å; L823-V827 VanDerWaalsContact O-CG2 3.29Å; L823-V827 WeakPolarHBondContact O-CG2 3.25Å; L823-V827 PolarHBondContact O-N 3.28Å; L823-N840 VanDerWaalsContact CA-ND2 3.32Å; L823-N840 WeakPolarHBondContact CA-ND2 3.28Å; L823-N840 WeakPolarHBondContact CB-ND2 3.48Å; L823-N840 HydrophobicContact CD1-CB 4.2Å; L823-N840 PolarHBondContact N-ND2 2.73Å; L823-N840 VanDerWaalsContact N-ND2 3.14Å; L823-F841 HydrophobicContact CD1-CD1 4.32Å; L823-F841 HydrophobicContact CD1-CD2 4.4Å; L823-F841 HydrophobicContact CD1-CE1 4.1Å; L823-F841 HydrophobicContact CD1-CE2 4.19Å; L823-F841 HydrophobicContact CD1-CG 4.45Å; L823-F841 HydrophobicContact CD1-CZ 4.03Å; L823-F841 HydrophobicContact CD2-CD1 4.43Å; L823-F841 HydrophobicContact CD2-CE1 4.21Å; L823-M844 HydrophobicContact CD2-CG 3.77Å; L823-L925 HydrophobicContact CD2-CD2 3.98Å; L823-C928 HydrophobicContact CD2-CB 3.97Å; L823-C928 HydrophobicContact CG-CB 4.14Å
824W92.4Very high91Very high43 Ų4315.3 Ų15.316%0.1639%0.093CC..Hα-helixtrans-62.2-42.3179.5-169.290.9000112.2C792 F820 R821 L822 Q826 V827 A828 Y829C792-W824 HydrophobicContact CB-CD2 3.32Å; C792-W824 HydrophobicContact CB-CE3 3.35Å; C792-W824 HydrophobicContact CB-CG 3.87Å; C792-W824 HydrophobicContact CB-CH2 3.85Å; C792-W824 HydrophobicContact CB-CZ2 3.86Å; C792-W824 HydrophobicContact CB-CZ3 3.56Å; F820-W824 PolarHBondContact O-N 2.96Å; R821-W824 PolarHBondContact O-N 3.21Å; L822-W824 VanDerWaalsContact C-N 3.3Å; L822-W824 PolarHBondContact O-N 3.25Å; W824-Q826 PolarHBondContact O-N 3.49Å; W824-V827 PolarHBondContact O-N 2.91Å; W824-A828 HydrophobicContact CD2-CB 4.04Å; W824-A828 HydrophobicContact CE3-CB 4.19Å; W824-A828 HydrophobicContact CH2-CB 4.16Å; W824-A828 HydrophobicContact CZ2-CB 3.97Å; W824-A828 HydrophobicContact CZ3-CB 4.3Å; W824-A828 WeakPolarHBondContact O-CB 3.4Å; W824-A828 PolarHBondContact O-N 3.03Å; W824-Y829 HydrophobicContact CE3-CE2 4.19Å; W824-Y829 AromaticContact CH2-CE2 3.86Å; W824-Y829 HydrophobicContact CH2-CE2 3.86Å; W824-Y829 HydrophobicContact CZ3-CD2 4.26Å; W824-Y829 AromaticContact CZ3-CE2 3.38Å; W824-Y829 HydrophobicContact CZ3-CE2 3.38Å; W824-Y829 AromaticContact CZ3-CZ 3.99Å
825L90.3Very high90.9Very high3 Ų316.8 Ų16.82%0.01610%0.1CC..Hα-helixtrans-62.5-42.6175.7-71171.5000112.2V708 I712 M795 R821 L822 L823 Y829 I831V708-L825 HydrophobicContact CG1-CD1 3.98Å; I712-L825 HydrophobicContact CD1-CD1 3.91Å; I712-L825 HydrophobicContact CG1-CD1 4.34Å; M795-L825 HydrophobicContact CB-CD2 4.36Å; M795-L825 HydrophobicContact CG-CD2 4.22Å; R821-L825 HydrophobicContact CG-CD1 4.08Å; R821-L825 HydrophobicContact CG-CG 4.42Å; R821-L825 VanDerWaalsContact O-CG 3.26Å; R821-L825 WeakPolarHBondContact O-CG 3.3Å; R821-L825 PolarHBondContact O-N 2.79Å; L822-L825 PolarHBondContact O-N 3.02Å; L823-L825 VanDerWaalsContact C-N 3.34Å; L823-L825 PolarHBondContact O-N 3.16Å; L825-Y829 HydrophobicContact CD2-CD2 3.78Å; L825-Y829 HydrophobicContact CD2-CE2 3.89Å; L825-Y829 WeakPolarHBondContact O-CB 3.27Å; L825-Y829 PolarHBondContact O-N 3.49Å; L825-I831 HydrophobicContact CB-CD1 4.32Å; L825-I831 HydrophobicContact CD2-CD1 4.39Å
826Q91.8Very high90.9Very high0 Ų016.8 Ų16.80%010%0.1CC..Hα-helixtrans-59.2-46.9177.2-79.2169.4-34.400112L822 L823 W824 G830 I831 L836 V837 N840 W936L822-Q826 HydrophobicContact CD1-CG 4.13Å; L822-Q826 WeakPolarHBondContact O-CB 3.43Å; L822-Q826 WeakPolarHBondContact O-CG 3.41Å; L822-Q826 PolarHBondContact O-N 3.32Å; L823-Q826 WeakPolarHBondContact O-CB 3.18Å; L823-Q826 PolarHBondContact O-N 3.35Å; W824-Q826 PolarHBondContact O-N 3.49Å; Q826-G830 WeakPolarHBondContact O-CA 3.36Å; Q826-G830 PolarHBondContact O-N 2.9Å; Q826-I831 WeakPolarHBondContact CA-O 3.47Å; Q826-I831 VanDerWaalsContact CG-O 3.22Å; Q826-I831 WeakPolarHBondContact CG-O 3.38Å; Q826-L836 VanDerWaalsContact NE2-C 3.33Å; Q826-L836 PolarHBondContact NE2-O 3.28Å; Q826-V837 HydrophobicContact CB-CG2 3.7Å; Q826-V837 HydrophobicContact CG-CG2 3.91Å; Q826-N840 PolarHBondContact OE1-ND2 3.46Å; Q826-W936 PolarHBondContact O-NE1 3.33Å
827V91.3Very high90.9Very high1 Ų116.7 Ų16.71%0.00610%0.099CC..Hα-helixtrans-85.1-34.4-175.2-56.80000113.4L823 W824 V837 F841 C928 L931 A932 K935L823-V827 HydrophobicContact CD1-CG1 3.99Å; L823-V827 WeakPolarHBondContact O-CG1 3.41Å; L823-V827 VanDerWaalsContact O-CG2 3.29Å; L823-V827 WeakPolarHBondContact O-CG2 3.25Å; L823-V827 PolarHBondContact O-N 3.28Å; W824-V827 PolarHBondContact O-N 2.91Å; V827-V837 HydrophobicContact CG1-CG1 4.49Å; V827-F841 HydrophobicContact CG1-CE2 4.18Å; V827-F841 HydrophobicContact CG1-CZ 3.97Å; V827-C928 HydrophobicContact CG2-CB 3.98Å; V827-L931 HydrophobicContact CB-CB 3.98Å; V827-L931 HydrophobicContact CG2-CB 3.89Å; V827-L931 HydrophobicContact CG2-CD1 4.09Å; V827-A932 HydrophobicContact CB-CB 4.31Å; V827-A932 HydrophobicContact CG1-CB 3.81Å; V827-K935 WeakPolarHBondContact O-CD 3.31Å
828A88.9Confident90.9Very high21 Ų2117.2 Ų17.217%0.17410%0.103CC..Hα-helixtrans-78.7-39.6-179.200000112.2W824 L931 K935W824-A828 HydrophobicContact CD2-CB 4.04Å; W824-A828 HydrophobicContact CE3-CB 4.19Å; W824-A828 HydrophobicContact CH2-CB 4.16Å; W824-A828 HydrophobicContact CZ2-CB 3.97Å; W824-A828 HydrophobicContact CZ3-CB 4.3Å; W824-A828 WeakPolarHBondContact O-CB 3.4Å; W824-A828 PolarHBondContact O-N 3.03Å; A828-L931 HydrophobicContact CB-CD1 4.13Å; A828-K935 WeakPolarHBondContact O-CE 3.45Å; A828-K935 PolarHBondContact O-NZ 2.88Å
829Y87.6Confident90.9Very high87 Ų8717.2 Ų17.234%0.34110%0.103SC..Hα-helixtrans-110.5-13-175.3-59.1-67.1000113.9M795 W824 L825 I831 K935M795-Y829 HydrophobicContact CB-CD2 4.3Å; M795-Y829 HydrophobicContact CB-CE2 3.89Å; W824-Y829 HydrophobicContact CE3-CE2 4.19Å; W824-Y829 AromaticContact CH2-CE2 3.86Å; W824-Y829 HydrophobicContact CH2-CE2 3.86Å; W824-Y829 HydrophobicContact CZ3-CD2 4.26Å; W824-Y829 AromaticContact CZ3-CE2 3.38Å; W824-Y829 HydrophobicContact CZ3-CE2 3.38Å; W824-Y829 AromaticContact CZ3-CZ 3.99Å; L825-Y829 HydrophobicContact CD2-CD2 3.78Å; L825-Y829 HydrophobicContact CD2-CE2 3.89Å; L825-Y829 WeakPolarHBondContact O-CB 3.27Å; L825-Y829 PolarHBondContact O-N 3.49Å; Y829-I831 VanDerWaalsContact C-N 3.35Å; Y829-I831 HydrophobicContact CD2-CD1 4.22Å; Y829-I831 HydrophobicContact CG-CD1 4.3Å; Y829-K935 PolarHBondContact O-NZ 2.91Å; Y829-K935 VanDerWaalsContact O-NZ 3.09Å
830G85.6Confident91Very high34 Ų3417.2 Ų17.235%0.35110%0.103SC..  trans73.530.8-176.700000112Q826Q826-G830 WeakPolarHBondContact O-CA 3.36Å; Q826-G830 PolarHBondContact O-N 2.9Å
831I86.1Confident91.1Very high11 Ų1117.2 Ų17.26%0.05610%0.102CC..  trans-84.3127.1-179-65.2167.9000108.7L711 Q715 M795 L825 Q826 Y829L711-I831 HydrophobicContact CD1-CG2 4.2Å; L711-I831 HydrophobicContact CD2-CG2 3.62Å; L711-I831 HydrophobicContact CG-CG2 3.49Å; L711-I831 VanDerWaalsContact CG-CG2 3.49Å; Q715-I831 HydrophobicContact CG-CG1 4.46Å; M795-I831 HydrophobicContact CG-CD1 4Å; M795-I831 HydrophobicContact SD-CD1 3.84Å; L825-I831 HydrophobicContact CB-CD1 4.32Å; L825-I831 HydrophobicContact CD2-CD1 4.39Å; Q826-I831 WeakPolarHBondContact CA-O 3.47Å; Q826-I831 VanDerWaalsContact CG-O 3.22Å; Q826-I831 WeakPolarHBondContact CG-O 3.38Å; Y829-I831 VanDerWaalsContact C-N 3.35Å; Y829-I831 HydrophobicContact CD2-CD1 4.22Å; Y829-I831 HydrophobicContact CG-CD1 4.3Å
832G85.7Confident91.1Very high21 Ų2116.8 Ų16.822%0.21610%0.101CC..SBendtrans109-159.3-179.700000112.8
833S88Confident91.2Very high32 Ų3216.8 Ų16.822%0.22410%0.101CC..  trans-115.9166.1177.365.60000111.2Q835 L836 V837S833-Q835 VanDerWaalsContact C-N 3.29Å; S833-Q835 PolarHBondContact O-N 3.1Å; S833-L836 PolarHBondContact O-N 3.29Å; S833-L836 WeakPolarHBondContact OG-CG 3.36Å; S833-L836 PolarHBondContact OG-N 3.3Å; S833-V837 WeakPolarHBondContact O-CG2 3.46Å; S833-V837 PolarHBondContact O-N 3.23Å
834A88.7Confident91.2Very high24 Ų2416.8 Ų16.820%0.19810%0.101CC..Hα-helixtrans-55.7-45175.700000111.6L836 V837 T838 W936 E939A834-L836 PolarHBondContact O-N 2.91Å; A834-V837 PolarHBondContact O-N 3.36Å; A834-V837 VanDerWaalsContact O-N 3.16Å; A834-T838 PolarHBondContact O-N 3.39Å; A834-T838 PolarHBondContact O-OG1 3.11Å; A834-W936 VanDerWaalsContact CA-CZ3 3.45Å; A834-W936 HydrophobicContact CB-CE3 4.2Å; A834-W936 HydrophobicContact CB-CZ3 3.77Å; A834-E939 HydrophobicContact CB-CB 4.35Å; A834-E939 HydrophobicContact CB-CG 3.89Å
835Q89.1Confident91.2Very high54 Ų5414.8 Ų14.825%0.2529%0.093SC..Hα-helixtrans-54.2-49.9176.3-171.763.425.600112S833 V837 T838 D839S833-Q835 VanDerWaalsContact C-N 3.29Å; S833-Q835 PolarHBondContact O-N 3.1Å; Q835-V837 PolarHBondContact O-N 3.44Å; Q835-T838 CarbonylContact O-C 3.48Å; Q835-T838 WeakPolarHBondContact O-CA 3.48Å; Q835-T838 VanDerWaalsContact O-CB 3.25Å; Q835-T838 WeakPolarHBondContact O-CB 3.43Å; Q835-T838 PolarHBondContact O-N 2.98Å; Q835-D839 PolarHBondContact NE2-OD1 2.91Å; Q835-D839 PolarHBondContact O-N 2.73Å
836L92.9Very high91.2Very high1 Ų114.7 Ų14.71%0.0059%0.093CC..Hα-helixtrans-61.9-32.8-179-71-177.6000113.7F726 I729 H730 L733 Q826 S833 A834 N840F726-L836 HydrophobicContact CB-CD1 4Å; F726-L836 HydrophobicContact CB-CG 4.47Å; F726-L836 HydrophobicContact CD1-CD1 3.87Å; F726-L836 HydrophobicContact CG-CD1 4.12Å; F726-L836 WeakPolarHBondContact O-CD2 3.4Å; I729-L836 HydrophobicContact CB-CD1 4.32Å; I729-L836 HydrophobicContact CB-CD2 3.88Å; I729-L836 HydrophobicContact CG2-CD1 4.32Å; I729-L836 HydrophobicContact CG2-CD2 3.79Å; H730-L836 HydrophobicContact CB-CD2 3.86Å; H730-L836 VanDerWaalsContact N-CD2 3.34Å; L733-L836 HydrophobicContact CD1-CD2 4.37Å; Q826-L836 VanDerWaalsContact NE2-C 3.33Å; Q826-L836 PolarHBondContact NE2-O 3.28Å; S833-L836 PolarHBondContact O-N 3.29Å; S833-L836 WeakPolarHBondContact OG-CG 3.36Å; S833-L836 PolarHBondContact OG-N 3.3Å; A834-L836 PolarHBondContact O-N 2.91Å; L836-N840 WeakPolarHBondContact O-CB 3.34Å; L836-N840 PolarHBondContact O-N 2.78Å
837V94.1Very high91.2Very high0 Ų014.7 Ų14.70%09%0.093CC..Hα-helixtrans-73.4-40.2175.8-178.80000110.1Q826 V827 S833 A834 Q835 N840 F841 W936Q826-V837 HydrophobicContact CB-CG2 3.7Å; Q826-V837 HydrophobicContact CG-CG2 3.91Å; V827-V837 HydrophobicContact CG1-CG1 4.49Å; S833-V837 WeakPolarHBondContact O-CG2 3.46Å; S833-V837 PolarHBondContact O-N 3.23Å; A834-V837 PolarHBondContact O-N 3.36Å; A834-V837 VanDerWaalsContact O-N 3.16Å; Q835-V837 PolarHBondContact O-N 3.44Å; V837-N840 PolarHBondContact O-N 2.76Å; V837-F841 HydrophobicContact CG1-CD2 3.61Å; V837-F841 HydrophobicContact CG1-CE2 3.48Å; V837-F841 VanDerWaalsContact CG1-CE2 3.48Å; V837-F841 VanDerWaalsContact O-CD2 3.26Å; V837-F841 WeakPolarHBondContact O-CD2 3.4Å; V837-F841 PolarHBondContact O-N 2.96Å; V837-W936 HydrophobicContact CG2-CD2 4.34Å; V837-W936 HydrophobicContact CG2-CH2 4.18Å; V837-W936 HydrophobicContact CG2-CZ2 3.55Å
838T93.2Very high91.1Very high12 Ų1214.7 Ų14.77%0.0749%0.093CC..Hα-helixtrans-56.9-50.1172.7-57.10000111.2A834 Q835 N840 F841 W842 A942 S945A834-T838 PolarHBondContact O-N 3.39Å; A834-T838 PolarHBondContact O-OG1 3.11Å; Q835-T838 CarbonylContact O-C 3.48Å; Q835-T838 WeakPolarHBondContact O-CA 3.48Å; Q835-T838 VanDerWaalsContact O-CB 3.25Å; Q835-T838 WeakPolarHBondContact O-CB 3.43Å; Q835-T838 PolarHBondContact O-N 2.98Å; T838-N840 VanDerWaalsContact C-N 3.33Å; T838-N840 PolarHBondContact O-N 3.42Å; T838-F841 PolarHBondContact O-N 2.96Å; T838-W842 WeakPolarHBondContact O-CB 3.36Å; T838-W842 PolarHBondContact O-N 3.14Å; T838-A942 WeakPolarHBondContact OG1-CA 3.34Å; T838-A942 PolarHBondContact OG1-N 2.89Å; T838-S945 VanDerWaalsContact CG2-OG 3.26Å; T838-S945 WeakPolarHBondContact CG2-OG 3.45Å
839D94.7Very high90.9Very high3 Ų313.7 Ų13.72%0.0169%0.085CC..Hα-helixtrans-61.3-41.3179.7-55.4-33.8000111.8H730 L733 Q835 W842 L843H730-D839 IonicContact CE1-OD1 3.76Å; H730-D839 IonicContact CE1-OD2 3.03Å; H730-D839 IonicContact CG-OD2 3.85Å; H730-D839 VanDerWaalsContact ND1-CG 3.32Å; H730-D839 IonicContact ND1-OD1 2.79Å; H730-D839 PolarHBondContact ND1-OD1 3.31Å; H730-D839 IonicContact ND1-OD2 3.58Å; H730-D839 PolarHBondContact ND1-OD2 3.47Å; L733-D839 HydrophobicContact CB-CB 4.04Å; L733-D839 HydrophobicContact CD1-CB 3.78Å; Q835-D839 PolarHBondContact NE2-OD1 2.91Å; Q835-D839 PolarHBondContact O-N 2.73Å; D839-W842 WeakPolarHBondContact O-CB 3.21Å; D839-W842 PolarHBondContact O-N 2.83Å; D839-L843 WeakPolarHBondContact O-CB 3.06Å; D839-L843 PolarHBondContact O-N 3.26Å
840N96Very high90.6Very high0 Ų09.6 Ų9.60%07%0.068CC..Hα-helixtrans-71.3-40-179.5-157.6-13.7000111.2L733 L823 Q826 L836 V837 T838 W842 L843 M844L733-N840 HydrophobicContact CD1-CB 4.07Å; L733-N840 HydrophobicContact CD2-CB 4.37Å; L823-N840 VanDerWaalsContact CA-ND2 3.32Å; L823-N840 WeakPolarHBondContact CA-ND2 3.28Å; L823-N840 WeakPolarHBondContact CB-ND2 3.48Å; L823-N840 HydrophobicContact CD1-CB 4.2Å; L823-N840 PolarHBondContact N-ND2 2.73Å; L823-N840 VanDerWaalsContact N-ND2 3.14Å; Q826-N840 PolarHBondContact OE1-ND2 3.46Å; L836-N840 WeakPolarHBondContact O-CB 3.34Å; L836-N840 PolarHBondContact O-N 2.78Å; V837-N840 PolarHBondContact O-N 2.76Å; T838-N840 VanDerWaalsContact C-N 3.33Å; T838-N840 PolarHBondContact O-N 3.42Å; N840-W842 VanDerWaalsContact C-N 3.32Å; N840-W842 PolarHBondContact O-N 3.48Å; N840-L843 PolarHBondContact O-N 3.15Å; N840-M844 WeakPolarHBondContact O-CB 3.41Å; N840-M844 VanDerWaalsContact O-CG 3.25Å; N840-M844 WeakPolarHBondContact O-CG 3.1Å; N840-M844 PolarHBondContact O-N 3.48Å; N840-M844 VanDerWaalsContact OD1-CE 3.3Å; N840-M844 WeakPolarHBondContact OD1-CE 3.27Å
841F95.7Very high90.6Very high1 Ų18.1 Ų8.10%0.0045%0.052CC..Hα-helixtrans-62.8-39.1171.3-84.4-58.1000112.4L823 V827 V837 T838 M844 T845 V929 A932 L946 L949L823-F841 HydrophobicContact CD1-CD1 4.32Å; L823-F841 HydrophobicContact CD1-CD2 4.4Å; L823-F841 HydrophobicContact CD1-CE1 4.1Å; L823-F841 HydrophobicContact CD1-CE2 4.19Å; L823-F841 HydrophobicContact CD1-CG 4.45Å; L823-F841 HydrophobicContact CD1-CZ 4.03Å; L823-F841 HydrophobicContact CD2-CD1 4.43Å; L823-F841 HydrophobicContact CD2-CE1 4.21Å; V827-F841 HydrophobicContact CG1-CE2 4.18Å; V827-F841 HydrophobicContact CG1-CZ 3.97Å; V837-F841 HydrophobicContact CG1-CD2 3.61Å; V837-F841 HydrophobicContact CG1-CE2 3.48Å; V837-F841 VanDerWaalsContact CG1-CE2 3.48Å; V837-F841 VanDerWaalsContact O-CD2 3.26Å; V837-F841 WeakPolarHBondContact O-CD2 3.4Å; V837-F841 PolarHBondContact O-N 2.96Å; T838-F841 PolarHBondContact O-N 2.96Å; F841-M844 PolarHBondContact O-N 2.97Å; F841-T845 WeakPolarHBondContact O-CB 3.45Å; F841-T845 PolarHBondContact O-N 3.44Å; F841-T845 PolarHBondContact O-OG1 2.87Å; F841-V929 HydrophobicContact CE1-CG2 4.04Å; F841-A932 HydrophobicContact CE2-CB 3.77Å; F841-A932 HydrophobicContact CZ-CB 3.62Å; F841-L946 HydrophobicContact CD1-CB 4.48Å; F841-L946 HydrophobicContact CD2-CB 4.23Å; F841-L946 HydrophobicContact CE1-CB 4.43Å; F841-L946 HydrophobicContact CE2-CB 4.17Å; F841-L946 HydrophobicContact CG-CB 4.4Å; F841-L946 HydrophobicContact CZ-CB 4.28Å; F841-L946 HydrophobicContact CZ-CD1 4.47Å; F841-L949 HydrophobicContact CD1-CD2 3.69Å; F841-L949 HydrophobicContact CE1-CD2 4.01Å
842W93.8Very high90.5Very high3 Ų37.7 Ų7.71%0.0115%0.05CC..Hα-helixtrans-59.3-49.5173.1166.890.6000111.4M675 L734 H738 A745 L747 T838 D839 N840 M844 T845 R846M675-W842 HydrophobicContact CG-CZ2 4.33Å; M675-W842 HydrophobicContact SD-CD2 3.94Å; M675-W842 HydrophobicContact SD-CG 3.91Å; M675-W842 HydrophobicContact SD-CZ2 3.93Å; M675-W842 PolarHBondContact SD-NE1 3.45Å; L734-W842 HydrophobicContact CD2-CE3 4.17Å; L734-W842 HydrophobicContact CD2-CH2 4.1Å; L734-W842 HydrophobicContact CD2-CZ3 3.86Å; H738-W842 AromaticContact CD2-CH2 3.68Å; H738-W842 AromaticContact NE2-CH2 3.78Å; H738-W842 AromaticContact NE2-CZ2 3.76Å; A745-W842 HydrophobicContact CB-CZ2 4.39Å; A745-W842 PolarHBondContact O-NE1 3.39Å; L747-W842 HydrophobicContact CD1-CG 4.36Å; T838-W842 WeakPolarHBondContact O-CB 3.36Å; T838-W842 PolarHBondContact O-N 3.14Å; D839-W842 WeakPolarHBondContact O-CB 3.21Å; D839-W842 PolarHBondContact O-N 2.83Å; N840-W842 VanDerWaalsContact C-N 3.32Å; N840-W842 PolarHBondContact O-N 3.48Å; W842-M844 PolarHBondContact O-N 3.02Å; W842-T845 WeakPolarHBondContact O-CB 3.45Å; W842-T845 PolarHBondContact O-N 3.28Å; W842-T845 VanDerWaalsContact O-N 3.13Å; W842-R846 PolarHBondContact O-N 3.12Å; W842-R846 VanDerWaalsContact O-N 3.13Å
843L95.2Very high90.1Very high1 Ų16.7 Ų6.71%0.0054%0.04CC..Hα-helixtrans-60.3-45.6177.6-178152.9000111.1L733 L819 D839 N840 T845 R846 L847L733-L843 HydrophobicContact CD2-CD1 4.39Å; L733-L843 WeakPolarHBondContact O-CD1 3.47Å; L819-L843 HydrophobicContact CD1-CD1 4.19Å; L819-L843 HydrophobicContact CD1-CD2 3.96Å; L819-L843 HydrophobicContact CD2-CD1 4.24Å; D839-L843 WeakPolarHBondContact O-CB 3.06Å; D839-L843 PolarHBondContact O-N 3.26Å; N840-L843 PolarHBondContact O-N 3.15Å; L843-T845 VanDerWaalsContact C-N 3.25Å; L843-T845 PolarHBondContact O-N 3.23Å; L843-R846 WeakPolarHBondContact O-CB 3.16Å; L843-R846 PolarHBondContact O-N 3.27Å; L843-L847 HydrophobicContact CD2-CD1 3.44Å; L843-L847 VanDerWaalsContact CD2-CD1 3.44Å; L843-L847 HydrophobicContact CD2-CG 3.9Å; L843-L847 PolarHBondContact O-N 3.45Å
844M94.9Very high89Confident0 Ų07.3 Ų7.30%04%0.039CC..Hα-helixtrans-64.2-31.6178.1-69.9-5415300112.4L819 F820 L823 N840 F841 W842 L847 A848 L925 L949L819-M844 HydrophobicContact CB-CE 3.6Å; F820-M844 HydrophobicContact CD1-CE 3.74Å; F820-M844 HydrophobicContact CD1-SD 3.6Å; F820-M844 HydrophobicContact CE1-CE 4.06Å; F820-M844 HydrophobicContact CE1-SD 3.37Å; F820-M844 WeakPolarHBondContact CE1-SD 3.47Å; F820-M844 HydrophobicContact CZ-SD 4.48Å; L823-M844 HydrophobicContact CD2-CG 3.77Å; N840-M844 WeakPolarHBondContact O-CB 3.41Å; N840-M844 VanDerWaalsContact O-CG 3.25Å; N840-M844 WeakPolarHBondContact O-CG 3.1Å; N840-M844 PolarHBondContact O-N 3.48Å; N840-M844 VanDerWaalsContact OD1-CE 3.3Å; N840-M844 WeakPolarHBondContact OD1-CE 3.27Å; F841-M844 PolarHBondContact O-N 2.97Å; W842-M844 PolarHBondContact O-N 3.02Å; M844-L847 HydrophobicContact CE-CD1 4.37Å; M844-L847 PolarHBondContact O-N 3.47Å; M844-L847 HydrophobicContact SD-CD1 3.89Å; M844-A848 WeakPolarHBondContact O-CB 2.98Å; M844-A848 PolarHBondContact O-N 3.31Å; M844-L925 HydrophobicContact CB-CD2 4.14Å; M844-L925 HydrophobicContact CG-CD2 3.94Å; M844-L925 HydrophobicContact SD-CD2 4.11Å; M844-L949 HydrophobicContact CB-CD1 4.41Å; M844-L949 HydrophobicContact CB-CD2 4.24Å
845T91.8Very high87.4Confident1 Ų111.3 Ų11.31%0.0066%0.057CC..Hα-helixtrans-64.3-44.2174.3-55.40000110.6L747 F841 W842 L843 A848 A849 L949 V952L747-T845 HydrophobicContact CD1-CG2 3.91Å; L747-T845 HydrophobicContact CD2-CG2 4.27Å; F841-T845 WeakPolarHBondContact O-CB 3.45Å; F841-T845 PolarHBondContact O-N 3.44Å; F841-T845 PolarHBondContact O-OG1 2.87Å; W842-T845 WeakPolarHBondContact O-CB 3.45Å; W842-T845 PolarHBondContact O-N 3.28Å; W842-T845 VanDerWaalsContact O-N 3.13Å; L843-T845 VanDerWaalsContact C-N 3.25Å; L843-T845 PolarHBondContact O-N 3.23Å; T845-A848 PolarHBondContact O-N 3.45Å; T845-A849 WeakPolarHBondContact O-CB 3.29Å; T845-A849 PolarHBondContact O-N 3.38Å; T845-L949 WeakPolarHBondContact OG1-CA 3.4Å; T845-L949 WeakPolarHBondContact OG1-CB 3.4Å; T845-L949 PolarHBondContact OG1-N 3.24Å; T845-V952 HydrophobicContact CG2-CB 4.33Å; T845-V952 HydrophobicContact CG2-CG2 3.62Å
846R90.1Very high85.7Confident1 Ų19.7 Ų9.70%0.0045%0.051CC..Hα-helixtrans-63.2-44.2175.5-64.4177.869.8146.68.8111.9H738 V741 G743 L747 F761 W842 L843 A849 T850H738-R846 PolarHBondContact CD2-NH1 3.1Å; H738-R846 PolarHBondContact CE1-NH1 3.36Å; H738-R846 VanDerWaalsContact CE1-NH1 3.33Å; H738-R846 PolarHBondContact NE2-NH1 3.17Å; H738-R846 VanDerWaalsContact NE2-NH1 3.13Å; V741-R846 HydrophobicContact CB-CB 4.16Å; V741-R846 HydrophobicContact CG1-CB 4.18Å; V741-R846 HydrophobicContact CG2-CB 4.15Å; V741-R846 PolarHBondContact O-NH2 3.34Å; G743-R846 PolarHBondContact O-NH2 3.12Å; L747-R846 HydrophobicContact CD2-CG 4.03Å; F761-R846 HydrophobicContact CE1-CG 4.28Å; W842-R846 PolarHBondContact O-N 3.12Å; W842-R846 VanDerWaalsContact O-N 3.13Å; L843-R846 WeakPolarHBondContact O-CB 3.16Å; L843-R846 PolarHBondContact O-N 3.27Å; R846-A849 PolarHBondContact O-N 3.48Å; R846-T850 PolarHBondContact O-N 3.31Å; R846-T850 PolarHBondContact O-OG1 3.46Å
847L91.1Very high83.9Confident1 Ų110.5 Ų10.51%0.0056%0.056CC..Hα-helixtrans-63.3-42175.7-70.8-178.2000111.8L740 V741 L816 L843 M844 T850 Y851 F852L740-L847 HydrophobicContact CB-CD2 4.05Å; L740-L847 HydrophobicContact CD1-CD2 4.07Å; V741-L847 HydrophobicContact CG2-CD2 4.09Å; L816-L847 HydrophobicContact CD2-CD1 3.6Å; L816-L847 HydrophobicContact CD2-CD2 3.99Å; L816-L847 HydrophobicContact CD2-CG 4.48Å; L843-L847 HydrophobicContact CD2-CD1 3.44Å; L843-L847 VanDerWaalsContact CD2-CD1 3.44Å; L843-L847 HydrophobicContact CD2-CG 3.9Å; L843-L847 PolarHBondContact O-N 3.45Å; M844-L847 HydrophobicContact CE-CD1 4.37Å; M844-L847 PolarHBondContact O-N 3.47Å; M844-L847 HydrophobicContact SD-CD1 3.89Å; L847-T850 PolarHBondContact O-N 3.48Å; L847-T850 PolarHBondContact O-OG1 2.79Å; L847-Y851 HydrophobicContact CB-CD2 4.43Å; L847-Y851 HydrophobicContact CD2-CD2 3.56Å; L847-Y851 HydrophobicContact CD2-CE2 3.47Å; L847-Y851 VanDerWaalsContact CD2-CE2 3.47Å; L847-Y851 WeakPolarHBondContact O-CB 3.38Å; L847-Y851 PolarHBondContact O-N 2.99Å; L847-F852 HydrophobicContact CB-CE2 4.46Å
848A89.3Confident82.3Confident0 Ų015.5 Ų15.50%08%0.082CC..Iπ-helixtrans-64.1-43.417900000112.3M844 T845 T850 F852 C853 L949 V952 L953M844-A848 WeakPolarHBondContact O-CB 2.98Å; M844-A848 PolarHBondContact O-N 3.31Å; T845-A848 PolarHBondContact O-N 3.45Å; A848-T850 PolarHBondContact O-N 2.9Å; A848-F852 HydrophobicContact CB-CD2 4.26Å; A848-F852 PolarHBondContact O-N 2.99Å; A848-C853 WeakPolarHBondContact O-CB 3.42Å; A848-C853 PolarHBondContact O-N 2.89Å; A848-C853 PolarHBondContact O-SG 3.12Å; A848-L949 HydrophobicContact CB-CD1 3.86Å; A848-V952 HydrophobicContact CB-CG1 4.23Å; A848-L953 HydrophobicContact CB-CD2 3.94Å
849A84.3Confident80.8Confident1 Ų123.4 Ų23.41%0.00811%0.111CC..Iπ-helixtrans-61.1-32.217800000112.9T845 R846 V856 V952T845-A849 WeakPolarHBondContact O-CB 3.29Å; T845-A849 PolarHBondContact O-N 3.38Å; R846-A849 PolarHBondContact O-N 3.48Å; A849-V856 HydrophobicContact CB-CG2 4.33Å; A849-V856 WeakPolarHBondContact O-CB 3.49Å; A849-V952 HydrophobicContact CB-CG1 4.13Å
850T83.1Confident79.4Confident0 Ų029 Ų290%014%0.141CC..Iπ-helixtrans-106.4-44.2-171.651.40000115.2V741 F761 R846 L847 A848V741-T850 HydrophobicContact CG1-CG2 3.68Å; V741-T850 HydrophobicContact CG2-CG2 4.36Å; V741-T850 WeakPolarHBondContact CG2-OG1 3.27Å; F761-T850 HydrophobicContact CB-CG2 3.74Å; R846-T850 PolarHBondContact O-N 3.31Å; R846-T850 PolarHBondContact O-OG1 3.46Å; L847-T850 PolarHBondContact O-N 3.48Å; L847-T850 PolarHBondContact O-OG1 2.79Å; A848-T850 PolarHBondContact O-N 2.9Å
851Y85.8Confident78Confident4 Ų431.7 Ų31.72%0.01616%0.157CC..Iπ-helixtrans-92.2-27.4-174.9-69.4-91.5000113.6L740 V741 I763 L847 M872 L875 Q876L740-Y851 PolarHBondContact O-OH 3.25Å; L740-Y851 VanDerWaalsContact O-OH 3.08Å; V741-Y851 HydrophobicContact CG2-CD2 4.47Å; V741-Y851 HydrophobicContact CG2-CE2 3.95Å; I763-Y851 HydrophobicContact CD1-CD1 3.72Å; I763-Y851 HydrophobicContact CD1-CD2 4.45Å; I763-Y851 HydrophobicContact CD1-CE1 3.74Å; I763-Y851 HydrophobicContact CD1-CE2 4.47Å; I763-Y851 HydrophobicContact CD1-CG 4.1Å; I763-Y851 HydrophobicContact CG1-CD1 4.43Å; I763-Y851 HydrophobicContact CG1-CD2 4.44Å; I763-Y851 HydrophobicContact CG1-CE1 4.15Å; I763-Y851 HydrophobicContact CG1-CE2 4.17Å; I763-Y851 HydrophobicContact CG2-CE1 4.09Å; L847-Y851 HydrophobicContact CB-CD2 4.43Å; L847-Y851 HydrophobicContact CD2-CD2 3.56Å; L847-Y851 HydrophobicContact CD2-CE2 3.47Å; L847-Y851 VanDerWaalsContact CD2-CE2 3.47Å; L847-Y851 WeakPolarHBondContact O-CB 3.38Å; L847-Y851 PolarHBondContact O-N 2.99Å; Y851-M872 WeakPolarHBondContact O-CE 3.38Å; Y851-L875 HydrophobicContact CD1-CD1 3.82Å; Y851-L875 HydrophobicContact CG-CD1 4.4Å; Y851-Q876 PolarHBondContact O-NE2 3.2Å
852F84Confident76.7Confident2 Ų231.7 Ų31.71%0.00916%0.157CC..Iπ-helixtrans-109.2-40.3-172.4-55-44.3000113.5F820 L847 A848 L875 N918 C921 I922 L925F820-F852 HydrophobicContact CZ-CE2 4.1Å; F820-F852 AromaticContact CZ-CZ 3.86Å; F820-F852 HydrophobicContact CZ-CZ 3.86Å; L847-F852 HydrophobicContact CB-CE2 4.46Å; A848-F852 HydrophobicContact CB-CD2 4.26Å; A848-F852 PolarHBondContact O-N 2.99Å; F852-L875 HydrophobicContact CE1-CD1 4.34Å; F852-L875 HydrophobicContact CE1-CD2 4.26Å; F852-N918 WeakPolarHBondContact CB-OD1 3.39Å; F852-N918 WeakPolarHBondContact CD1-OD1 3.47Å; F852-N918 PolarHBondContact O-ND2 2.95Å; F852-C921 HydrophobicContact CD1-CB 4.36Å; F852-C921 HydrophobicContact CE1-CB 4Å; F852-C921 HydrophobicContact CE2-CB 4.39Å; F852-C921 HydrophobicContact CZ-CB 4.06Å; F852-I922 HydrophobicContact CB-CG1 4.44Å; F852-L925 HydrophobicContact CD2-CD1 4.44Å; F852-L925 HydrophobicContact CE2-CD1 4.41Å
853C76.7Confident75.6Confident0 Ų035.7 Ų35.70%018%0.178CC..  trans-92.9152.3-174.4-65.10000113.1A848 H956A848-C853 WeakPolarHBondContact O-CB 3.42Å; A848-C853 PolarHBondContact O-N 2.89Å; A848-C853 PolarHBondContact O-SG 3.12Å; C853-H956 VanDerWaalsContact CA-O 3.32Å; C853-H956 WeakPolarHBondContact CA-O 3.39Å; C853-H956 HydrophobicContact CB-CB 3.56Å; C853-H956 WeakPolarHBondContact CB-O 3.26Å
854H64.2Low74.4Confident44 Ų4437.4 Ų37.420%0.20419%0.189CC..SBendtrans-103.7-26.4-172.2-71.842.5000114.4V856 V857 L862 H956 P958H854-V856 VanDerWaalsContact C-N 3.31Å; H854-V856 PolarHBondContact O-N 3.01Å; H854-V857 CarbonylContact O-C 3.56Å; H854-V857 PolarHBondContact O-N 2.78Å; H854-L862 HydrophobicContact CB-CD2 4.43Å; H854-L862 WeakPolarHBondContact CD2-CD2 3.46Å; H854-L862 VanDerWaalsContact CE1-CD2 3.4Å; H854-L862 WeakPolarHBondContact CE1-CD2 3.41Å; H854-L862 WeakPolarHBondContact NE2-CD2 3.33Å; H854-H956 PolarHBondContact N-O 3.38Å; H854-P958 WeakPolarHBondContact CE1-CB 3.49Å; H854-P958 WeakPolarHBondContact ND1-CB 3.32Å
855N55.4Low73.2Confident109 Ų10938.4 Ų38.458%0.58320%0.195SC*.THydrogen-bonded Turntrans-79.6-10.2-170.8-82.8-6.9000114.3H956N855-H956 HydrophobicContact CB-CB 4.12Å; N855-H956 VanDerWaalsContact CB-ND1 3.26Å; N855-H956 WeakPolarHBondContact CB-ND1 3.05Å
856V54.6Low72.3Confident19 Ų1939.4 Ų39.412%0.11520%0.2CC..THydrogen-bonded Turntrans-89-13.5174.2-174.50000111.4D758 F761 A849 H854D758-V856 VanDerWaalsContact O-O 3.08Å; F761-V856 HydrophobicContact CB-CG1 4.35Å; A849-V856 HydrophobicContact CB-CG2 4.33Å; A849-V856 WeakPolarHBondContact O-CB 3.49Å; H854-V856 VanDerWaalsContact C-N 3.31Å; H854-V856 PolarHBondContact O-N 3.01Å
857V53.8Low71.4Confident19 Ų1944 Ų4412%0.11523%0.232CC..SBendtrans-138.1101.3-174.4179.60000106.5H854 R859 T861 L862H854-V857 CarbonylContact O-C 3.56Å; H854-V857 PolarHBondContact O-N 2.78Å; V857-R859 PolarHBondContact O-N 2.91Å; V857-T861 WeakPolarHBondContact CG1-OG1 3.34Å; V857-L862 HydrophobicContact CG1-CB 4.36Å; V857-L862 HydrophobicContact CG1-CD1 4.4Å
858D60.7Low70.4Confident104 Ų10447.2 Ų47.256%0.55624%0.244SC*.  trans-34.1130-178.9179.612.5000111.3D860 T861 L862D858-D860 CarbonylContact O-C 3.58Å; D858-D860 PolarHBondContact O-N 3.12Å; D858-T861 HydrophobicContact CB-CG2 4.1Å; D858-T861 PolarHBondContact N-OG1 2.9Å; D858-T861 CarbonylContact O-C 3.59Å; D858-T861 VanDerWaalsContact O-CA 3.31Å; D858-T861 WeakPolarHBondContact O-CA 3.43Å; D858-T861 WeakPolarHBondContact O-CB 3.41Å; D858-T861 PolarHBondContact O-N 3.1Å; D858-T861 PolarHBondContact O-OG1 3.22Å; D858-L862 PolarHBondContact O-N 2.89Å
859R62.4Low69.8Low178 Ų17847.4 Ų47.467%0.67225%0.246SC*.Hα-helixtrans-51.6-35.1-171.1-175.2-179.8-178.9176.10.7111.8V857 L862 M863V857-R859 PolarHBondContact O-N 2.91Å; R859-L862 PolarHBondContact O-N 2.94Å; R859-M863 WeakPolarHBondContact O-CB 3.45Å; R859-M863 VanDerWaalsContact O-CG 3.28Å; R859-M863 WeakPolarHBondContact O-CG 3.49Å; R859-M863 PolarHBondContact O-N 2.96Å
860D65.8Low69.5Low120 Ų12048.6 Ų48.664%0.64225%0.253SS*.Hα-helixtrans-66.1-40.5176.2-70.3-18000112.1D858 S864D858-D860 CarbonylContact O-C 3.58Å; D858-D860 PolarHBondContact O-N 3.12Å; D860-S864 WeakPolarHBondContact O-CB 3.46Å; D860-S864 PolarHBondContact O-N 3.07Å
861T66Low69.4Low57 Ų5748.7 Ų48.735%0.3525%0.254SS..Hα-helixtrans-66-40.1173.263.20000112.1V857 D858 S864 N865V857-T861 WeakPolarHBondContact CG1-OG1 3.34Å; D858-T861 HydrophobicContact CB-CG2 4.1Å; D858-T861 PolarHBondContact N-OG1 2.9Å; D858-T861 CarbonylContact O-C 3.59Å; D858-T861 VanDerWaalsContact O-CA 3.31Å; D858-T861 WeakPolarHBondContact O-CA 3.43Å; D858-T861 WeakPolarHBondContact O-CB 3.41Å; D858-T861 PolarHBondContact O-N 3.1Å; D858-T861 PolarHBondContact O-OG1 3.22Å; T861-S864 WeakPolarHBondContact O-CB 3.46Å; T861-S864 PolarHBondContact O-N 3.41Å; T861-S864 PolarHBondContact O-OG 3.49Å; T861-N865 WeakPolarHBondContact O-CB 3.44Å; T861-N865 PolarHBondContact O-N 3.41Å; T861-N865 PolarHBondContact O-ND2 3.08Å; T861-N865 PolarHBondContact O-OD1 3.22Å
862L67.1Low69.2Low1 Ų148.5 Ų48.51%0.00525%0.253CS..Hα-helixtrans-62.8-47.7175.1-168.578.6000112H854 V857 D858 R859 S864 N865 I866 M872H854-L862 HydrophobicContact CB-CD2 4.43Å; H854-L862 WeakPolarHBondContact CD2-CD2 3.46Å; H854-L862 VanDerWaalsContact CE1-CD2 3.4Å; H854-L862 WeakPolarHBondContact CE1-CD2 3.41Å; H854-L862 WeakPolarHBondContact NE2-CD2 3.33Å; V857-L862 HydrophobicContact CG1-CB 4.36Å; V857-L862 HydrophobicContact CG1-CD1 4.4Å; D858-L862 PolarHBondContact O-N 2.89Å; R859-L862 PolarHBondContact O-N 2.94Å; L862-S864 VanDerWaalsContact C-N 3.26Å; L862-S864 PolarHBondContact O-N 2.97Å; L862-N865 CarbonylContact O-C 3.6Å; L862-N865 WeakPolarHBondContact O-CA 3.18Å; L862-N865 WeakPolarHBondContact O-CB 3.4Å; L862-N865 PolarHBondContact O-N 2.99Å; L862-I866 HydrophobicContact CG-CD1 4.4Å; L862-I866 WeakPolarHBondContact O-CG1 3.3Å; L862-I866 PolarHBondContact O-N 3.32Å; L862-M872 HydrophobicContact CD1-CE 3.24Å; L862-M872 HydrophobicContact CG-CE 4.09Å
863M70.6Confident69Low88 Ų8851.4 Ų51.443%0.43327%0.271SS..Hα-helixtrans-60.8-38.5175.1-70.5-60.5-65.700111.3R859 N865 I866 S867R859-M863 WeakPolarHBondContact O-CB 3.45Å; R859-M863 VanDerWaalsContact O-CG 3.28Å; R859-M863 WeakPolarHBondContact O-CG 3.49Å; R859-M863 PolarHBondContact O-N 2.96Å; M863-N865 VanDerWaalsContact C-N 3.3Å; M863-N865 PolarHBondContact O-N 3.41Å; M863-I866 PolarHBondContact O-N 3.33Å; M863-I866 HydrophobicContact SD-CD1 3.93Å; M863-S867 PolarHBondContact O-N 3.48Å; M863-S867 VanDerWaalsContact O-N 3.13Å
864S70.1Confident69.3Low36 Ų3651.4 Ų51.425%0.25227%0.271SS..Hα-helixtrans-61.9-39.9173.389.90000111.6D860 T861 L862 S867 R868D860-S864 WeakPolarHBondContact O-CB 3.46Å; D860-S864 PolarHBondContact O-N 3.07Å; T861-S864 WeakPolarHBondContact O-CB 3.46Å; T861-S864 PolarHBondContact O-N 3.41Å; T861-S864 PolarHBondContact O-OG 3.49Å; L862-S864 VanDerWaalsContact C-N 3.26Å; L862-S864 PolarHBondContact O-N 2.97Å; S864-S867 PolarHBondContact O-N 3.47Å; S864-S867 PolarHBondContact O-OG 3.38Å; S864-R868 VanDerWaalsContact O-CD 3.31Å; S864-R868 WeakPolarHBondContact O-CD 3.23Å; S864-R868 VanDerWaalsContact O-CG 3.31Å; S864-R868 WeakPolarHBondContact O-CG 3.45Å; S864-R868 PolarHBondContact O-N 3.15Å
865N70.4Confident70.1Confident21 Ų2149.3 Ų49.311%0.11226%0.261CS..Hα-helixtrans-70.2-41.1178.4-68.8-17.3000111.8L768 T861 L862 M863 S867 R868 S869L768-N865 HydrophobicContact CD1-CB 4.3Å; L768-N865 WeakPolarHBondContact CD1-OD1 3.41Å; L768-N865 HydrophobicContact CD2-CB 3.95Å; T861-N865 WeakPolarHBondContact O-CB 3.44Å; T861-N865 PolarHBondContact O-N 3.41Å; T861-N865 PolarHBondContact O-ND2 3.08Å; T861-N865 PolarHBondContact O-OD1 3.22Å; L862-N865 CarbonylContact O-C 3.6Å; L862-N865 WeakPolarHBondContact O-CA 3.18Å; L862-N865 WeakPolarHBondContact O-CB 3.4Å; L862-N865 PolarHBondContact O-N 2.99Å; M863-N865 VanDerWaalsContact C-N 3.3Å; M863-N865 PolarHBondContact O-N 3.41Å; N865-S867 VanDerWaalsContact C-N 3.31Å; N865-S867 PolarHBondContact O-N 3.31Å; N865-R868 PolarHBondContact O-N 3.25Å; N865-R868 VanDerWaalsContact O-N 3.12Å; N865-S869 WeakPolarHBondContact O-CB 3.29Å; N865-S869 PolarHBondContact O-N 3.12Å
866I72.8Confident71Confident23 Ų2345 Ų4512%0.11824%0.237CC..Hα-helixtrans-55.6-48.3174.5-67.8163.5000110.3L862 M863 R868 S869 M872 T873 Q876L862-I866 HydrophobicContact CG-CD1 4.4Å; L862-I866 WeakPolarHBondContact O-CG1 3.3Å; L862-I866 PolarHBondContact O-N 3.32Å; M863-I866 PolarHBondContact O-N 3.33Å; M863-I866 HydrophobicContact SD-CD1 3.93Å; I866-R868 PolarHBondContact O-N 2.91Å; I866-R868 VanDerWaalsContact O-N 3.15Å; I866-S869 PolarHBondContact O-N 3.44Å; I866-M872 HydrophobicContact CB-CG 4.35Å; I866-M872 HydrophobicContact CG1-CB 4.38Å; I866-M872 HydrophobicContact CG1-CG 3.55Å; I866-T873 PolarHBondContact O-OG1 3.09Å; I866-Q876 HydrophobicContact CD1-CB 4.26Å; I866-Q876 HydrophobicContact CG1-CB 4.42Å
867S71.3Confident71.5Confident97 Ų9745 Ų4568%0.67824%0.24SC*.Hα-helixtrans-63.7-22-178.673.30000114.2M863 S864 N865M863-S867 PolarHBondContact O-N 3.48Å; M863-S867 VanDerWaalsContact O-N 3.13Å; S864-S867 PolarHBondContact O-N 3.47Å; S864-S867 PolarHBondContact O-OG 3.38Å; N865-S867 VanDerWaalsContact C-N 3.31Å; N865-S867 PolarHBondContact O-N 3.31Å
868R69.6Low71.4Confident68 Ų6850.6 Ų50.626%0.25727%0.269SS..Hα-helixtrans-104.2-13.2-174.1-70.6168.4176.9175.25.9113.2Y769 S864 N865 I866Y769-R868 HydrophobicContact CD1-CB 4.36Å; Y769-R868 HydrophobicContact CE1-CB 3.8Å; Y769-R868 HydrophobicContact CE1-CG 3.99Å; Y769-R868 WeakPolarHBondContact OH-CD 3.23Å; S864-R868 VanDerWaalsContact O-CD 3.31Å; S864-R868 WeakPolarHBondContact O-CD 3.23Å; S864-R868 VanDerWaalsContact O-CG 3.31Å; S864-R868 WeakPolarHBondContact O-CG 3.45Å; S864-R868 PolarHBondContact O-N 3.15Å; N865-R868 PolarHBondContact O-N 3.25Å; N865-R868 VanDerWaalsContact O-N 3.12Å; I866-R868 PolarHBondContact O-N 2.91Å; I866-R868 VanDerWaalsContact O-N 3.15Å
869S78.1Confident70.9Confident5 Ų548.2 Ų48.24%0.03526%0.26CS..  trans-124.3117.4-169.2-174.10000113.1L768 N865 I866 I871 M872 T873L768-S869 WeakPolarHBondContact O-CA 3.4Å; L768-S869 WeakPolarHBondContact O-CB 3.41Å; L768-S869 PolarHBondContact O-OG 2.88Å; N865-S869 WeakPolarHBondContact O-CB 3.29Å; N865-S869 PolarHBondContact O-N 3.12Å; I866-S869 PolarHBondContact O-N 3.44Å; S869-I871 PolarHBondContact O-N 3.19Å; S869-I871 PolarHBondContact OG-N 2.93Å; S869-M872 PolarHBondContact O-N 2.9Å; S869-M872 PolarHBondContact OG-N 3.05Å; S869-T873 PolarHBondContact O-N 3.1Å; S869-T873 PolarHBondContact O-OG1 3.21Å
870P76.6Confident69.9Low25 Ų2547.6 Ų47.616%0.16227%0.27CS..Hα-helixtrans-63.7-31.1173.125.8-32.5000111.6L770 V776 T873 I874L770-P870 VanDerWaalsContact O-CG 3.23Å; L770-P870 WeakPolarHBondContact O-CG 3.16Å; V776-P870 HydrophobicContact CG2-CB 3.94Å; P870-T873 PolarHBondContact O-N 3.38Å; P870-I874 WeakPolarHBondContact O-CG1 3.19Å; P870-I874 PolarHBondContact O-N 3.23Å
871I81.8Confident68.6Low2 Ų252 Ų521%0.0128%0.278CS..Hα-helixtrans-65.4-46.9176.1-64.7140.5000110.2I767 L770 L812 I813 S869 T873 I874 L875I767-I871 HydrophobicContact CG2-CD1 4.44Å; I767-I871 VanDerWaalsContact O-CD1 3.32Å; I767-I871 WeakPolarHBondContact O-CD1 3.24Å; L770-I871 HydrophobicContact CB-CD1 4.13Å; L812-I871 HydrophobicContact CB-CD1 4.46Å; L812-I871 HydrophobicContact CD2-CB 4.34Å; L812-I871 HydrophobicContact CD2-CD1 3.29Å; L812-I871 HydrophobicContact CD2-CG1 3.74Å; L812-I871 HydrophobicContact CD2-CG2 3.83Å; L812-I871 HydrophobicContact CG-CD1 4.5Å; I813-I871 HydrophobicContact CD1-CG2 4.19Å; S869-I871 PolarHBondContact O-N 3.19Å; S869-I871 PolarHBondContact OG-N 2.93Å; I871-T873 VanDerWaalsContact C-N 3.27Å; I871-T873 PolarHBondContact O-N 3.47Å; I871-I874 WeakPolarHBondContact O-CB 3.11Å; I871-I874 PolarHBondContact O-N 3.18Å; I871-I874 VanDerWaalsContact O-N 3.07Å; I871-L875 HydrophobicContact CG2-CD1 3.96Å; I871-L875 HydrophobicContact CG2-CG 4.46Å; I871-L875 WeakPolarHBondContact O-CG 3.49Å; I871-L875 PolarHBondContact O-N 2.76Å
872M81.9Confident67.3Low1 Ų154 Ų541%0.00529%0.292CS..Hα-helixtrans-68.5-31-179.7-159.961.1161.800111.9Y851 L862 I866 S869 I874 L875 Q876Y851-M872 WeakPolarHBondContact O-CE 3.38Å; L862-M872 HydrophobicContact CD1-CE 3.24Å; L862-M872 HydrophobicContact CG-CE 4.09Å; I866-M872 HydrophobicContact CB-CG 4.35Å; I866-M872 HydrophobicContact CG1-CB 4.38Å; I866-M872 HydrophobicContact CG1-CG 3.55Å; S869-M872 PolarHBondContact O-N 2.9Å; S869-M872 PolarHBondContact OG-N 3.05Å; M872-I874 VanDerWaalsContact C-N 3.33Å; M872-L875 PolarHBondContact O-N 3.43Å; M872-Q876 HydrophobicContact CE-CG 3.69Å; M872-Q876 HydrophobicContact CG-CG 4.33Å; M872-Q876 WeakPolarHBondContact O-CA 3.26Å; M872-Q876 WeakPolarHBondContact O-CB 3.28Å; M872-Q876 PolarHBondContact O-N 3.4Å; M872-Q876 HydrophobicContact SD-CG 3.85Å
873T79.3Confident65.7Low62 Ų6261.1 Ų61.138%0.3833%0.329SS..Hα-helixtrans-65-35.2170-55.70000112.4R782 I866 S869 P870 I871R782-T873 PolarHBondContact NH2-O 3.1Å; I866-T873 PolarHBondContact O-OG1 3.09Å; S869-T873 PolarHBondContact O-N 3.1Å; S869-T873 PolarHBondContact O-OG1 3.21Å; P870-T873 PolarHBondContact O-N 3.38Å; I871-T873 VanDerWaalsContact C-N 3.27Å; I871-T873 PolarHBondContact O-N 3.47Å
874I82Confident64Low0 Ų062.4 Ų62.40%034%0.344CS..Hα-helixtrans-65.5-52.2172.9-70.3163.2000109.7V776 V778 R782 I785 P810 I813 P870 I871 M872 I917V776-I874 HydrophobicContact CG1-CD1 3.61Å; V776-I874 HydrophobicContact CG1-CG1 4.4Å; V778-I874 HydrophobicContact CG1-CG1 4.28Å; V778-I874 HydrophobicContact CG2-CG1 4.25Å; R782-I874 HydrophobicContact CG-CG2 3.99Å; R782-I874 PolarHBondContact NE-O 3.26Å; R782-I874 PolarHBondContact NH2-O 3.26Å; I785-I874 HydrophobicContact CD1-CG2 3.86Å; P810-I874 HydrophobicContact CG-CD1 4.04Å; I813-I874 HydrophobicContact CD1-CD1 4.35Å; I813-I874 HydrophobicContact CD1-CG2 4.2Å; I813-I874 HydrophobicContact CG1-CD1 4.05Å; P870-I874 WeakPolarHBondContact O-CG1 3.19Å; P870-I874 PolarHBondContact O-N 3.23Å; I871-I874 WeakPolarHBondContact O-CB 3.11Å; I871-I874 PolarHBondContact O-N 3.18Å; I871-I874 VanDerWaalsContact O-N 3.07Å; M872-I874 VanDerWaalsContact C-N 3.33Å; I874-I917 WeakPolarHBondContact O-CG2 3.07Å
875L81.6Confident62.5Low1 Ų163.8 Ų63.81%0.00536%0.358CS..Hα-helixtrans-75.7-37.2-170.7-65.5177.8000113.9I785 I813 L816 Y851 F852 I871 M872 I917 N918I785-L875 HydrophobicContact CD1-CD2 3.71Å; I813-L875 HydrophobicContact CD1-CD2 4.47Å; L816-L875 HydrophobicContact CD1-CD1 4.29Å; Y851-L875 HydrophobicContact CD1-CD1 3.82Å; Y851-L875 HydrophobicContact CG-CD1 4.4Å; F852-L875 HydrophobicContact CE1-CD1 4.34Å; F852-L875 HydrophobicContact CE1-CD2 4.26Å; I871-L875 HydrophobicContact CG2-CD1 3.96Å; I871-L875 HydrophobicContact CG2-CG 4.46Å; I871-L875 WeakPolarHBondContact O-CG 3.49Å; I871-L875 PolarHBondContact O-N 2.76Å; M872-L875 PolarHBondContact O-N 3.43Å; L875-I917 WeakPolarHBondContact O-CG2 3.26Å; L875-N918 WeakPolarHBondContact O-CB 3.43Å; L875-N918 PolarHBondContact O-N 3.08Å
876Q75.3Confident60.7Low17 Ų1771.6 Ų71.68%0.07939%0.393CS..  trans-109.8110.5179.7-60.5-149.5-4.700109.5Y851 I866 M872Y851-Q876 PolarHBondContact O-NE2 3.2Å; I866-Q876 HydrophobicContact CD1-CB 4.26Å; I866-Q876 HydrophobicContact CG1-CB 4.42Å; M872-Q876 HydrophobicContact CE-CG 3.69Å; M872-Q876 HydrophobicContact CG-CG 4.33Å; M872-Q876 WeakPolarHBondContact O-CA 3.26Å; M872-Q876 WeakPolarHBondContact O-CB 3.28Å; M872-Q876 PolarHBondContact O-N 3.4Å; M872-Q876 HydrophobicContact SD-CG 3.85Å
877A63.5Low58.6Low21 Ų2178.3 Ų78.317%0.17442%0.424CS..  trans-101.7129.6176.100000109.8S879 D915A877-S879 PolarHBondContact O-N 2.87Å; A877-D915 WeakPolarHBondContact CB-O 3.31Å
878D52.7Low56.6Low136 Ų13676.6 Ų76.673%0.72742%0.422SS*.  trans-67.794.3170.5-79-28.8000109.4
879S50.3Low54.5Low53 Ų5379.5 Ų79.537%0.37145%0.447SS..  trans-89.4106167670000109.4A877 R881 N916A877-S879 PolarHBondContact O-N 2.87Å; S879-R881 PolarHBondContact O-N 3.3Å; S879-R881 VanDerWaalsContact O-N 3.08Å; S879-N916 PolarHBondContact OG-ND2 3.35Å
880D41.5Very low52Low165 Ų16585.9 Ų85.988%0.88247%0.474SS*.SBendtrans-69.52.5-178.6-103.1-22000115.2
881R37.9Very low49.7Very low213 Ų21392.3 Ų92.380%0.80451%0.507SS*.  trans-149.1123.7176-70.9-171175.9173.7-1.8113.1S879 L883S879-R881 PolarHBondContact O-N 3.3Å; S879-R881 VanDerWaalsContact O-N 3.08Å; R881-L883 PolarHBondContact O-N 3.22Å
882P38.2Very low47.1Very low99 Ų9996.1 Ų96.164%0.64353%0.533SS*.PPolyproline II helixtrans-68.8116.1163.127.9-29.6000108.6
883L34.7Very low44.4Very low150 Ų150103.6 Ų103.679%0.78557%0.573SS**PPolyproline II helixtrans-69.1130.9163.7-80.5150.8000107.7R881 A885R881-L883 PolarHBondContact O-N 3.22Å; L883-A885 PolarHBondContact O-N 3.33Å
884P34.2Very low41.8Very low115 Ų115109.2 Ų109.275%0.74759%0.592SS**PPolyproline II helixtrans-61.9136.7-178.923.9-31.2000110.3H886P884-H886 PolarHBondContact O-N 2.77Å
885A37.6Very low39.1Very low66 Ų66115.4 Ų115.455%0.54563%0.631SS.*PPolyproline II helixtrans-52.2128.4176.100000109.9L883 Q887L883-A885 PolarHBondContact O-N 3.33Å; A885-Q887 PolarHBondContact O-N 3.34Å; A885-Q887 VanDerWaalsContact O-N 3.15Å
886H33.6Very low36.4Very low184 Ų184126.5 Ų126.585%0.85267%0.674SS**PPolyproline II helixtrans-56.3121.6169.3-86.6-84.7000108.5P884 G888P884-H886 PolarHBondContact O-N 2.77Å; H886-G888 PolarHBondContact O-N 2.85Å
887Q28.8Very low34Very low165 Ų165133.2 Ų133.277%0.77171%0.71SS**PPolyproline II helixtrans-47.8126.2171.9-73.6169.2-3100109.5A885 V889A885-Q887 PolarHBondContact O-N 3.34Å; A885-Q887 VanDerWaalsContact O-N 3.15Å; Q887-V889 PolarHBondContact O-N 3.49Å
888G28.8Very low32.3Very low61 Ų61135.9 Ų135.963%0.62974%0.74SS**  trans-57.899.9177.200000110.5H886H886-G888 PolarHBondContact O-N 2.85Å
889V25.7Very low31.1Very low129 Ų129138.1 Ų138.178%0.78275%0.746SS**  trans-87.8108.2164.1177.70000106.7Q887 L891Q887-V889 PolarHBondContact O-N 3.49Å; V889-L891 PolarHBondContact O-N 3.1Å
890F26.1Very low29.9Very low138 Ų138142.5 Ų142.561%0.60577%0.766SS**  trans-38.4122168.6-86.3-95.7000112.4S892F890-S892 VanDerWaalsContact C-N 3.32Å; F890-S892 VanDerWaalsContact CD1-OG 3.3Å; F890-S892 WeakPolarHBondContact CD1-OG 3.49Å
891L28.4Very low29.2Very low161 Ų161143.7 Ų143.784%0.84377%0.766SS**  trans-96.428.9160.1-82.7168.8000111.7V889 N893V889-L891 PolarHBondContact O-N 3.1Å; L891-N893 PolarHBondContact O-N 3.23Å; L891-N893 VanDerWaalsContact O-N 3.08Å
892S26.7Very low28.8Very low81 Ų81141.9 Ų141.957%0.56677%0.77SS**  trans-83.268.3165.968.50000110.2F890F890-S892 VanDerWaalsContact C-N 3.32Å; F890-S892 VanDerWaalsContact CD1-OG 3.3Å; F890-S892 WeakPolarHBondContact CD1-OG 3.49Å
893N25.4Very low28.2Very low159 Ų159144 Ų14485%0.8578%0.776SS**  trans-171.159.5158.9-97.2-18.2000110.3L891L891-N893 PolarHBondContact O-N 3.23Å; L891-N893 VanDerWaalsContact O-N 3.08Å
894K25.2Very low27.8Very low179 Ų179145 Ų14578%0.77878%0.776SS**  trans-131.196.6152.1-82.3-171.4178177.40108.5Y896K894-Y896 PolarHBondContact O-N 3.44Å; K894-Y896 VanDerWaalsContact O-N 3.14Å
895T24.9Very low27.5Very low131 Ų131149.8 Ų149.880%0.80479%0.785SS**  trans-47.2114.5157.641.60000109N897T895-N897 PolarHBondContact O-N 2.93Å; T895-N897 VanDerWaalsContact O-N 3.11Å
896Y25.5Very low26.9Very low233 Ų233156.2 Ų156.291%0.91480%0.801SS**  trans-61.7107.3166.8-100.2-97.9000108.5K894K894-Y896 PolarHBondContact O-N 3.44Å; K894-Y896 VanDerWaalsContact O-N 3.14Å
897N24.8Very low26.5Very low158 Ų158156.2 Ų156.285%0.84580%0.801SS**  trans-139.7122.3160.7-97.7-14.1000107.3T895T895-N897 PolarHBondContact O-N 2.93Å; T895-N897 VanDerWaalsContact O-N 3.11Å
898G27.5Very low26.5Very low78 Ų78156 Ų15680%0.80481%0.805SS**  trans105.3112.6156.600000116
899E26.2Very low26.5Very low182 Ų182158.4 Ų158.485%0.8581%0.81SS**  trans-46.7150.9157.3-62170.914400112.2
900N26.7Very low26.6Very low145 Ų145159.2 Ų159.278%0.77581%0.809SS**  trans80.299.8170.9-53-45.7000117.2
901Q27.2Very low27.3Very low190 Ų190156.9 Ų156.989%0.88881%0.808SS**  166.889.8122-89.4169.718.700110.3
902I28.4Very low27.6Very low176 Ų176157.1 Ų157.190%0.90381%0.805SS**  trans-92.187155.4-61.7172.6000105.6
903L26.4Very low28.6Very low143 Ų143157.7 Ų157.775%0.74981%0.809SS**  trans-158.1124.7161.6-103.9153.1000108.2
904E26.3Very low29.9Very low170 Ų170152.9 Ų152.979%0.79479%0.787SS**  trans76.787.8156.5-57.3-174.9166.700119.1
905K27.1Very low31.6Very low216 Ų216149.9 Ų149.994%0.93978%0.779SS**  -135.778.5122.2-97.8-177.3-179.4-179.70109.9
906K24.8Very low34Very low202 Ų202145.1 Ų145.188%0.87875%0.749SS**  trans-79.6101.4155.6-91179.5173.6173.90106.8
907E25.1Very low36.8Very low184 Ų184134.1 Ų134.186%0.8671%0.706SS**  trans-17790.2150.5-105.6174-163.900107.3
908N29.6Very low39.7Very low160 Ų160127 Ų12786%0.85667%0.668SS**  trans-138.6138.4153.7-89.8-28.6000106.6
909P29Very low42.5Very low112 Ų112127.5 Ų127.573%0.72765%0.645SS**  trans-65.9154.3-167.930.5-34.6000110.6
910L28.4Very low45.4Very low145 Ų145119.5 Ų119.576%0.75961%0.609SS**  trans-46.8125173.7-73.7100.4000109.8E912L910-E912 PolarHBondContact O-N 3.31Å
911P39Very low48.4Very low90 Ų90112.6 Ų112.658%0.58457%0.572SS**  trans-78.378.3172.731.8-29.6000107.8S913P911-S913 PolarHBondContact O-N 3.19Å
912E36.6Very low51.3Low166 Ų166103.6 Ų103.678%0.77653%0.53SS*.  trans-68117.7158.8-69.9-177.716900106.5L910L910-E912 PolarHBondContact O-N 3.31Å
913S47.7Very low54.2Low93 Ų9397.6 Ų97.665%0.6550%0.498SS*.  trans80.780.2-174.974.30000116.6P911 D915P911-S913 PolarHBondContact O-N 3.19Å; S913-D915 WeakPolarHBondContact CB-OD1 3.35Å; S913-D915 PolarHBondContact O-N 3.37Å
914C52.5Low57.2Low57 Ų5791 Ų9139%0.38547%0.465SS..  trans-84.991.6159-153.30000107.6N916C914-N916 VanDerWaalsContact C-N 3.25Å; C914-N916 PolarHBondContact O-N 2.89Å
915D59.5Low60.4Low116 Ų11682.9 Ų82.962%0.6243%0.427SS*.  trans-69.4-12.9-166.1-74.6-22000115.1A877 S913A877-D915 WeakPolarHBondContact CB-O 3.31Å; S913-D915 WeakPolarHBondContact CB-OD1 3.35Å; S913-D915 PolarHBondContact O-N 3.37Å
916N75.8Confident63.5Low32 Ų3272.6 Ų72.617%0.17138%0.382CS..  trans-137.692.3-179.1-166.1-25.4000112.7S879 C914 N918 R919 V920S879-N916 PolarHBondContact OG-ND2 3.35Å; C914-N916 VanDerWaalsContact C-N 3.25Å; C914-N916 PolarHBondContact O-N 2.89Å; N916-N918 PolarHBondContact OD1-N 2.77Å; N916-R919 HydrophobicContact CB-CB 4.31Å; N916-R919 PolarHBondContact O-N 3.41Å; N916-R919 PolarHBondContact OD1-N 3.38Å; N916-V920 PolarHBondContact O-N 3.03Å
917I85.2Confident66.7Low1 Ų166.3 Ų66.31%0.00536%0.357CS..Hα-helixtrans-71.5-29.6-178.5-16169000112.9R782 I785 F786 I874 L875 R919 V920 C921R782-I917 HydrophobicContact CB-CD1 4.26Å; R782-I917 HydrophobicContact CB-CG1 4.46Å; R782-I917 HydrophobicContact CG-CB 4.24Å; R782-I917 HydrophobicContact CG-CG1 4.33Å; R782-I917 HydrophobicContact CG-CG2 4.34Å; R782-I917 WeakPolarHBondContact O-CD1 3.22Å; I785-I917 HydrophobicContact CB-CD1 4.05Å; I785-I917 HydrophobicContact CB-CG1 4.13Å; I785-I917 HydrophobicContact CD1-CG1 4.23Å; I785-I917 HydrophobicContact CG2-CD1 3.9Å; I785-I917 HydrophobicContact CG2-CG1 3.79Å; F786-I917 HydrophobicContact CB-CD1 4.37Å; I874-I917 WeakPolarHBondContact O-CG2 3.07Å; L875-I917 WeakPolarHBondContact O-CG2 3.26Å; I917-R919 VanDerWaalsContact C-N 3.27Å; I917-R919 PolarHBondContact O-N 3Å; I917-V920 HydrophobicContact CD1-CB 4.16Å; I917-V920 HydrophobicContact CD1-CG1 4.3Å; I917-V920 HydrophobicContact CD1-CG2 4.41Å; I917-V920 WeakPolarHBondContact O-CA 3.44Å; I917-V920 WeakPolarHBondContact O-CB 3.39Å; I917-V920 PolarHBondContact O-N 3.5Å; I917-C921 PolarHBondContact O-N 2.88Å; I917-C921 PolarHBondContact O-SG 3.24Å
918N85.6Confident69.9Low9 Ų957.6 Ų57.65%0.04832%0.316CS..Hα-helixtrans-58.4-45.3176.5-168.82.7000110.2F852 L875 N916 V920 C921 I922F852-N918 WeakPolarHBondContact CB-OD1 3.39Å; F852-N918 WeakPolarHBondContact CD1-OD1 3.47Å; F852-N918 PolarHBondContact O-ND2 2.95Å; L875-N918 WeakPolarHBondContact O-CB 3.43Å; L875-N918 PolarHBondContact O-N 3.08Å; N916-N918 PolarHBondContact OD1-N 2.77Å; N918-V920 VanDerWaalsContact C-N 3.32Å; N918-V920 PolarHBondContact O-N 3.39Å; N918-C921 WeakPolarHBondContact O-CB 3.43Å; N918-C921 PolarHBondContact O-N 3.26Å; N918-C921 VanDerWaalsContact O-N 3.16Å; N918-I922 WeakPolarHBondContact O-CG1 3.41Å; N918-I922 PolarHBondContact O-N 3.14Å
919R85.5Confident73Confident89 Ų8950 Ų5034%0.33628%0.275SS..Hα-helixtrans-57.8-43.2174-178.1176-169.9-1561.4112.4N916 I917 C921 I922 Q923 S962N916-R919 HydrophobicContact CB-CB 4.31Å; N916-R919 PolarHBondContact O-N 3.41Å; N916-R919 PolarHBondContact OD1-N 3.38Å; I917-R919 VanDerWaalsContact C-N 3.27Å; I917-R919 PolarHBondContact O-N 3Å; R919-C921 VanDerWaalsContact C-N 3.35Å; R919-I922 PolarHBondContact O-N 3.28Å; R919-Q923 HydrophobicContact CG-CG 4.33Å; R919-Q923 WeakPolarHBondContact O-CB 3.49Å; R919-Q923 VanDerWaalsContact O-CG 3.25Å; R919-Q923 WeakPolarHBondContact O-CG 3.41Å; R919-Q923 PolarHBondContact O-N 3.24Å; R919-S962 VanDerWaalsContact CZ-O 3.28Å; R919-S962 PolarHBondContact NE-O 3.25Å; R919-S962 PolarHBondContact NH2-O 3.42Å
920V86.3Confident76Confident14 Ų1447.7 Ų47.79%0.08525%0.252CS..Hα-helixtrans-60.3-45.4176.5172.40000110.8F786 I789 A790 N916 I917 N918 Q923 G924F786-V920 HydrophobicContact CD2-CG1 3.68Å; F786-V920 HydrophobicContact CD2-CG2 4.15Å; F786-V920 HydrophobicContact CE2-CG1 4.38Å; I789-V920 HydrophobicContact CG2-CG1 4.1Å; A790-V920 HydrophobicContact CB-CG1 3.88Å; N916-V920 PolarHBondContact O-N 3.03Å; I917-V920 HydrophobicContact CD1-CB 4.16Å; I917-V920 HydrophobicContact CD1-CG1 4.3Å; I917-V920 HydrophobicContact CD1-CG2 4.41Å; I917-V920 WeakPolarHBondContact O-CA 3.44Å; I917-V920 WeakPolarHBondContact O-CB 3.39Å; I917-V920 PolarHBondContact O-N 3.5Å; N918-V920 VanDerWaalsContact C-N 3.32Å; N918-V920 PolarHBondContact O-N 3.39Å; V920-Q923 PolarHBondContact O-N 3.03Å; V920-G924 PolarHBondContact O-N 3.3Å
921C89.5Confident79Confident0 Ų043.1 Ų43.10%023%0.228CC..Hα-helixtrans-61.6-49.2178.3-68.40000111.5I785 F852 I917 N918 R919 Q923 G924 L925I785-C921 VanDerWaalsContact CG2-SG 3.52Å; F852-C921 HydrophobicContact CD1-CB 4.36Å; F852-C921 HydrophobicContact CE1-CB 4Å; F852-C921 HydrophobicContact CE2-CB 4.39Å; F852-C921 HydrophobicContact CZ-CB 4.06Å; I917-C921 PolarHBondContact O-N 2.88Å; I917-C921 PolarHBondContact O-SG 3.24Å; N918-C921 WeakPolarHBondContact O-CB 3.43Å; N918-C921 PolarHBondContact O-N 3.26Å; N918-C921 VanDerWaalsContact O-N 3.16Å; R919-C921 VanDerWaalsContact C-N 3.35Å; C921-Q923 PolarHBondContact O-N 3.16Å; C921-G924 PolarHBondContact O-N 2.89Å; C921-L925 WeakPolarHBondContact O-CG 3.38Å; C921-L925 PolarHBondContact O-N 2.76Å
922I89.4Confident81.5Confident0 Ų038.9 Ų38.90%020%0.201CC..Hα-helixtrans-59.6-48178.4-66.7170.2000110.7F852 N918 R919 G924 L925 L926 L953 D963 L964F852-I922 HydrophobicContact CB-CG1 4.44Å; N918-I922 WeakPolarHBondContact O-CG1 3.41Å; N918-I922 PolarHBondContact O-N 3.14Å; R919-I922 PolarHBondContact O-N 3.28Å; I922-G924 PolarHBondContact O-N 2.85Å; I922-L925 PolarHBondContact O-N 3.26Å; I922-L926 HydrophobicContact CG2-CD1 4.32Å; I922-L926 WeakPolarHBondContact O-CG 3.34Å; I922-L926 PolarHBondContact O-N 2.89Å; I922-L953 HydrophobicContact CG1-CD2 4.27Å; I922-L953 HydrophobicContact CG2-CD2 4.29Å; I922-D963 HydrophobicContact CD1-CB 3.89Å; I922-D963 HydrophobicContact CG2-CB 4.2Å; I922-L964 HydrophobicContact CG2-CD2 4.22Å
923Q89.6Confident84.1Confident50 Ų5031.7 Ų31.723%0.23417%0.168CC..Hα-helixtrans-68.3-34.4-179.5-68.6-177-8.500112.9R919 V920 C921 L926 M927 S962 D963 C966R919-Q923 HydrophobicContact CG-CG 4.33Å; R919-Q923 WeakPolarHBondContact O-CB 3.49Å; R919-Q923 VanDerWaalsContact O-CG 3.25Å; R919-Q923 WeakPolarHBondContact O-CG 3.41Å; R919-Q923 PolarHBondContact O-N 3.24Å; V920-Q923 PolarHBondContact O-N 3.03Å; C921-Q923 PolarHBondContact O-N 3.16Å; Q923-L926 PolarHBondContact O-N 3.31Å; Q923-M927 PolarHBondContact O-N 2.87Å; Q923-S962 PolarHBondContact NE2-O 3.13Å; Q923-D963 WeakPolarHBondContact CG-O 3.38Å; Q923-D963 PolarHBondContact NE2-O 2.84Å; Q923-C966 HydrophobicContact CB-CB 4.38Å; Q923-C966 HydrophobicContact CG-CB 3.84Å
924G89Confident85.9Confident5 Ų533 Ų335%0.05217%0.167CC..Hα-helixtrans-64-45.1172.900000112V920 C921 I922 L926 M927 C928V920-G924 PolarHBondContact O-N 3.3Å; C921-G924 PolarHBondContact O-N 2.89Å; I922-G924 PolarHBondContact O-N 2.85Å; G924-L926 PolarHBondContact O-N 3.46Å; G924-M927 WeakPolarHBondContact O-CB 3.41Å; G924-M927 PolarHBondContact O-N 3.38Å; G924-M927 VanDerWaalsContact O-N 3.15Å; G924-C928 PolarHBondContact O-N 3.15Å; G924-C928 PolarHBondContact O-SG 2.77Å
925L93.7Very high87.5Confident0 Ų034.5 Ų34.50%017%0.167CC..Hα-helixtrans-62.7-40.4174.4-71.1175.5000111.9I789 F820 L823 M844 F852 C921 I922 M927 C928 V929 L949 L953I789-L925 HydrophobicContact CD1-CD2 4.04Å; I789-L925 HydrophobicContact CD1-CG 3.91Å; F820-L925 HydrophobicContact CD1-CD2 4.3Å; F820-L925 HydrophobicContact CE1-CD2 4.1Å; L823-L925 HydrophobicContact CD2-CD2 3.98Å; M844-L925 HydrophobicContact CB-CD2 4.14Å; M844-L925 HydrophobicContact CG-CD2 3.94Å; M844-L925 HydrophobicContact SD-CD2 4.11Å; F852-L925 HydrophobicContact CD2-CD1 4.44Å; F852-L925 HydrophobicContact CE2-CD1 4.41Å; C921-L925 WeakPolarHBondContact O-CG 3.38Å; C921-L925 PolarHBondContact O-N 2.76Å; I922-L925 PolarHBondContact O-N 3.26Å; L925-M927 VanDerWaalsContact C-N 3.31Å; L925-M927 PolarHBondContact O-N 2.93Å; L925-C928 WeakPolarHBondContact O-CB 3.49Å; L925-C928 PolarHBondContact O-N 3.33Å; L925-C928 VanDerWaalsContact O-N 3.14Å; L925-V929 WeakPolarHBondContact O-CG2 3.17Å; L925-V929 PolarHBondContact O-N 3.22Å; L925-L949 HydrophobicContact CB-CD2 4.45Å; L925-L949 HydrophobicContact CD2-CD2 4.46Å; L925-L953 HydrophobicContact CB-CD1 4.22Å
926L91.8Very high88.9Confident0 Ų030.6 Ų30.60%014%0.144CC..Hα-helixtrans-61.9-37.8173.1-72.5175.5000112.4I922 Q923 G924 V929 R930 L950 L953 L964 A968 W969I922-L926 HydrophobicContact CG2-CD1 4.32Å; I922-L926 WeakPolarHBondContact O-CG 3.34Å; I922-L926 PolarHBondContact O-N 2.89Å; Q923-L926 PolarHBondContact O-N 3.31Å; G924-L926 PolarHBondContact O-N 3.46Å; L926-V929 PolarHBondContact O-N 2.85Å; L926-R930 WeakPolarHBondContact O-CB 3.31Å; L926-R930 PolarHBondContact O-N 3.42Å; L926-L950 HydrophobicContact CD2-CD1 3.66Å; L926-L953 HydrophobicContact CD2-CD1 4.08Å; L926-L953 HydrophobicContact CG-CD1 4.32Å; L926-L964 HydrophobicContact CD1-CD2 3.94Å; L926-A968 HydrophobicContact CB-CB 4.23Å; L926-W969 HydrophobicContact CD1-CB 4.43Å; L926-W969 HydrophobicContact CD1-CE3 4.13Å; L926-W969 HydrophobicContact CD2-CE3 3.7Å; L926-W969 HydrophobicContact CD2-CZ3 4.02Å
927M91.4Very high89.2Confident69 Ų6930.4 Ų30.434%0.3415%0.145SC..Hα-helixtrans-64.8-41.1172.8-173.960.67500111.3Q923 G924 L925 V929 R930 L931 A968Q923-M927 PolarHBondContact O-N 2.87Å; G924-M927 WeakPolarHBondContact O-CB 3.41Å; G924-M927 PolarHBondContact O-N 3.38Å; G924-M927 VanDerWaalsContact O-N 3.15Å; L925-M927 VanDerWaalsContact C-N 3.31Å; L925-M927 PolarHBondContact O-N 2.93Å; M927-V929 VanDerWaalsContact C-N 3.34Å; M927-V929 PolarHBondContact O-N 3.36Å; M927-R930 WeakPolarHBondContact O-CB 3.42Å; M927-R930 PolarHBondContact O-N 2.88Å; M927-L931 HydrophobicContact CG-CD1 4.28Å; M927-L931 WeakPolarHBondContact O-CG 3.34Å; M927-L931 PolarHBondContact O-N 2.91Å; M927-A968 HydrophobicContact CB-CB 4.31Å; M927-A968 HydrophobicContact CE-CB 4.02Å; M927-A968 HydrophobicContact SD-CB 4.22Å
928C93.3Very high89.1Confident1 Ų137.2 Ų37.21%0.00718%0.177CC..Hα-helixtrans-60.4-42.9174.2-70.20000112L823 V827 G924 L925 R930 L931 A932L823-C928 HydrophobicContact CD2-CB 3.97Å; L823-C928 HydrophobicContact CG-CB 4.14Å; V827-C928 HydrophobicContact CG2-CB 3.98Å; G924-C928 PolarHBondContact O-N 3.15Å; G924-C928 PolarHBondContact O-SG 2.77Å; L925-C928 WeakPolarHBondContact O-CB 3.49Å; L925-C928 PolarHBondContact O-N 3.33Å; L925-C928 VanDerWaalsContact O-N 3.14Å; C928-R930 PolarHBondContact O-N 3.35Å; C928-L931 PolarHBondContact O-N 3.48Å; C928-A932 WeakPolarHBondContact O-CB 3.23Å; C928-A932 PolarHBondContact O-N 3.34Å
929V93.9Very high89.2Confident0 Ų041 Ų410%019%0.194CC..Hα-helixtrans-58.9-47.2174.1167.30000110.9F841 L925 L926 M927 L931 A932 L933 L946 L949 L950 I972F841-V929 HydrophobicContact CE1-CG2 4.04Å; L925-V929 WeakPolarHBondContact O-CG2 3.17Å; L925-V929 PolarHBondContact O-N 3.22Å; L926-V929 PolarHBondContact O-N 2.85Å; M927-V929 VanDerWaalsContact C-N 3.34Å; M927-V929 PolarHBondContact O-N 3.36Å; V929-L931 VanDerWaalsContact C-N 3.34Å; V929-L931 PolarHBondContact O-N 3.3Å; V929-A932 PolarHBondContact O-N 3.35Å; V929-L933 PolarHBondContact O-N 2.91Å; V929-L946 HydrophobicContact CB-CD1 4Å; V929-L946 HydrophobicContact CG1-CD1 3.49Å; V929-L946 VanDerWaalsContact CG1-CD1 3.49Å; V929-L946 HydrophobicContact CG1-CG 4.03Å; V929-L946 HydrophobicContact CG2-CD1 4.28Å; V929-L946 WeakPolarHBondContact O-CD1 3.49Å; V929-L949 HydrophobicContact CG2-CD2 4.09Å; V929-L950 HydrophobicContact CG1-CD1 4.27Å; V929-I972 HydrophobicContact CB-CD1 4.31Å; V929-I972 HydrophobicContact CG1-CD1 3.76Å
930R92.5Very high89.2Confident64 Ų6440.1 Ų40.124%0.24220%0.2CC..Hα-helixtrans-60.7-40.8178.5172.856.5168.995-0.6113L926 M927 C928 A968 D971 I972L926-R930 WeakPolarHBondContact O-CB 3.31Å; L926-R930 PolarHBondContact O-N 3.42Å; M927-R930 WeakPolarHBondContact O-CB 3.42Å; M927-R930 PolarHBondContact O-N 2.88Å; C928-R930 PolarHBondContact O-N 3.35Å; R930-A968 HydrophobicContact CB-CB 4.26Å; R930-D971 HydrophobicContact CG-CB 4.45Å; R930-D971 IonicContact CZ-OD2 2.88Å; R930-D971 IonicContact NE-OD2 3.82Å; R930-D971 IonicContact NH2-OD2 3.68Å; R930-I972 HydrophobicContact CB-CD1 4.16Å; R930-I972 HydrophobicContact CB-CG1 3.97Å
931L91.3Very high89.1Confident49 Ų4943.5 Ų43.526%0.25722%0.215SC..Hα-helixtrans-69.7-38.9176.2-68.6173.7000111.1V827 A828 M927 C928 V929 N934 K935V827-L931 HydrophobicContact CB-CB 3.98Å; V827-L931 HydrophobicContact CG2-CB 3.89Å; V827-L931 HydrophobicContact CG2-CD1 4.09Å; A828-L931 HydrophobicContact CB-CD1 4.13Å; M927-L931 HydrophobicContact CG-CD1 4.28Å; M927-L931 WeakPolarHBondContact O-CG 3.34Å; M927-L931 PolarHBondContact O-N 2.91Å; C928-L931 PolarHBondContact O-N 3.48Å; V929-L931 VanDerWaalsContact C-N 3.34Å; V929-L931 PolarHBondContact O-N 3.3Å; L931-N934 WeakPolarHBondContact O-CB 3.35Å; L931-N934 PolarHBondContact O-N 3.19Å; L931-N934 VanDerWaalsContact O-N 3.16Å; L931-K935 PolarHBondContact O-N 2.97Å
932A92Very high89.1Confident2 Ų243.6 Ų43.62%0.01722%0.216CC..Hα-helixtrans-64.1-40.5177.800000112.6V827 F841 C928 V929 N934 K935 W936 L946V827-A932 HydrophobicContact CB-CB 4.31Å; V827-A932 HydrophobicContact CG1-CB 3.81Å; F841-A932 HydrophobicContact CE2-CB 3.77Å; F841-A932 HydrophobicContact CZ-CB 3.62Å; C928-A932 WeakPolarHBondContact O-CB 3.23Å; C928-A932 PolarHBondContact O-N 3.34Å; V929-A932 PolarHBondContact O-N 3.35Å; A932-N934 PolarHBondContact O-N 3.32Å; A932-N934 VanDerWaalsContact O-N 3.07Å; A932-K935 PolarHBondContact O-N 3.33Å; A932-K935 VanDerWaalsContact O-N 3.08Å; A932-W936 WeakPolarHBondContact O-CA 3.31Å; A932-W936 WeakPolarHBondContact O-CB 3.36Å; A932-W936 PolarHBondContact O-N 2.88Å; A932-L946 HydrophobicContact CB-CD1 3.84Å
933L89.4Confident89.2Confident15 Ų1543.8 Ų43.88%0.07922%0.216CC..Hα-helixtrans-57-25.4174.7-75.8173.9000113.5V929 S937 L943 L946 I972 L997V929-L933 PolarHBondContact O-N 2.91Å; L933-S937 WeakPolarHBondContact O-CB 3.07Å; L933-S937 PolarHBondContact O-OG 3.38Å; L933-L943 HydrophobicContact CD2-CD1 3.81Å; L933-L946 HydrophobicContact CD2-CD1 4.21Å; L933-L946 HydrophobicContact CD2-CD2 3.83Å; L933-L946 HydrophobicContact CG-CD1 4.01Å; L933-L946 HydrophobicContact CG-CD2 4.47Å; L933-I972 HydrophobicContact CD1-CG1 4.18Å; L933-I972 HydrophobicContact CD1-CG2 4.14Å; L933-L997 HydrophobicContact CD2-CD2 4.33Å
934N86.7Confident89.1Confident119 Ų11943.6 Ų43.664%0.63622%0.221SC*.Hα-helixtrans-83.2-36.5177.2-168.822000112.6L931 A932L931-N934 WeakPolarHBondContact O-CB 3.35Å; L931-N934 PolarHBondContact O-N 3.19Å; L931-N934 VanDerWaalsContact O-N 3.16Å; A932-N934 PolarHBondContact O-N 3.32Å; A932-N934 VanDerWaalsContact O-N 3.07Å
935K86.1Confident89.1Confident89 Ų8943.6 Ų43.639%0.38722%0.22SC..Hα-helixtrans-97.9-33.4-173.4-67.3-152.7-177.7-146.50114.9V827 A828 Y829 L931 A932V827-K935 WeakPolarHBondContact O-CD 3.31Å; A828-K935 WeakPolarHBondContact O-CE 3.45Å; A828-K935 PolarHBondContact O-NZ 2.88Å; Y829-K935 PolarHBondContact O-NZ 2.91Å; Y829-K935 VanDerWaalsContact O-NZ 3.09Å; L931-K935 PolarHBondContact O-N 2.97Å; A932-K935 PolarHBondContact O-N 3.33Å; A932-K935 VanDerWaalsContact O-N 3.08Å
936W87.8Confident89.1Confident34 Ų3443.7 Ų43.713%0.12922%0.221CC..SBendtrans-118.212.2-167.1-62.3105.6000112.4Q826 A834 V837 A932 H938 E939 A942Q826-W936 PolarHBondContact O-NE1 3.33Å; A834-W936 VanDerWaalsContact CA-CZ3 3.45Å; A834-W936 HydrophobicContact CB-CE3 4.2Å; A834-W936 HydrophobicContact CB-CZ3 3.77Å; V837-W936 HydrophobicContact CG2-CD2 4.34Å; V837-W936 HydrophobicContact CG2-CH2 4.18Å; V837-W936 HydrophobicContact CG2-CZ2 3.55Å; A932-W936 WeakPolarHBondContact O-CA 3.31Å; A932-W936 WeakPolarHBondContact O-CB 3.36Å; A932-W936 PolarHBondContact O-N 2.88Å; W936-H938 PolarHBondContact O-N 2.82Å; W936-E939 HydrophobicContact CE3-CG 4Å; W936-E939 HydrophobicContact CZ3-CG 4.46Å; W936-E939 PolarHBondContact O-N 3.47Å; W936-E939 VanDerWaalsContact O-N 3.12Å; W936-A942 HydrophobicContact CB-CB 4.38Å
937S83.3Confident89Confident28 Ų2843.9 Ų43.920%0.19622%0.221CC..THydrogen-bonded Turntrans-67.2-19.1179.641.30000114.3L933 E939L933-S937 WeakPolarHBondContact O-CB 3.07Å; L933-S937 PolarHBondContact O-OG 3.38Å; S937-E939 VanDerWaalsContact C-N 3.31Å
938H83.7Confident88.9Confident144 Ų14443.6 Ų43.667%0.66722%0.217SC*.THydrogen-bonded Turntrans-78.2-15.6174.6-56-52.7000113.1W936 P940W936-H938 PolarHBondContact O-N 2.82Å; H938-P940 WeakPolarHBondContact O-CD 3.15Å
939E87.7Confident88.8Confident88 Ų8843.6 Ų43.641%0.41122%0.216SC..  trans-99.8107.7-177.6-66.7-63.1163.100110.4A834 W936 S937 Q941 A942 L943A834-E939 HydrophobicContact CB-CB 4.35Å; A834-E939 HydrophobicContact CB-CG 3.89Å; W936-E939 HydrophobicContact CE3-CG 4Å; W936-E939 HydrophobicContact CZ3-CG 4.46Å; W936-E939 PolarHBondContact O-N 3.47Å; W936-E939 VanDerWaalsContact O-N 3.12Å; S937-E939 VanDerWaalsContact C-N 3.31Å; E939-Q941 PolarHBondContact O-N 3.39Å; E939-A942 HydrophobicContact CB-CB 3.97Å; E939-A942 PolarHBondContact O-N 2.85Å; E939-L943 WeakPolarHBondContact O-CB 3.44Å; E939-L943 PolarHBondContact O-N 3.46Å
940P83.9Confident88.7Confident71 Ų7143.6 Ų43.646%0.46122%0.216SC..Hα-helixtrans-67-36.3-169.625.1-33.5000113.2H938 L943 S944H938-P940 WeakPolarHBondContact O-CD 3.15Å; P940-L943 PolarHBondContact O-N 3.06Å; P940-S944 WeakPolarHBondContact O-CB 3.13Å; P940-S944 PolarHBondContact O-N 3.07Å
941Q85.6Confident88.4Confident86 Ų8641.4 Ų41.440%0.40221%0.21SC..Hα-helixtrans-68.3-44.3178.6-68.2-180-10.700111.9E939 L943 S944 S945E939-Q941 PolarHBondContact O-N 3.39Å; Q941-L943 VanDerWaalsContact C-N 3.28Å; Q941-L943 PolarHBondContact O-N 3.45Å; Q941-S944 WeakPolarHBondContact O-CB 3.49Å; Q941-S944 PolarHBondContact O-N 3.42Å; Q941-S945 PolarHBondContact O-N 3.13Å
942A90Very high88.1Confident2 Ų239.1 Ų39.12%0.01720%0.198CC..Hα-helixtrans-60.9-41.8175.600000110.6T838 W936 E939 S945 L946T838-A942 WeakPolarHBondContact OG1-CA 3.34Å; T838-A942 PolarHBondContact OG1-N 2.89Å; W936-A942 HydrophobicContact CB-CB 4.38Å; E939-A942 HydrophobicContact CB-CB 3.97Å; E939-A942 PolarHBondContact O-N 2.85Å; A942-S945 PolarHBondContact O-N 3.42Å; A942-L946 WeakPolarHBondContact O-CB 3.48Å; A942-L946 PolarHBondContact O-N 3.34Å
943L90.2Very high87.9Confident3 Ų339 Ų392%0.01620%0.197CC..Hα-helixtrans-68-37.3177.4-162.4117.3000112.7L933 E939 P940 Q941 L946 T947 L989 S993L933-L943 HydrophobicContact CD2-CD1 3.81Å; E939-L943 WeakPolarHBondContact O-CB 3.44Å; E939-L943 PolarHBondContact O-N 3.46Å; P940-L943 PolarHBondContact O-N 3.06Å; Q941-L943 VanDerWaalsContact C-N 3.28Å; Q941-L943 PolarHBondContact O-N 3.45Å; L943-L946 HydrophobicContact CB-CD2 4.38Å; L943-L946 HydrophobicContact CD1-CD2 4.12Å; L943-L946 HydrophobicContact CG-CD2 3.73Å; L943-L946 VanDerWaalsContact O-CD2 3.24Å; L943-L946 WeakPolarHBondContact O-CD2 3.41Å; L943-T947 WeakPolarHBondContact O-CB 3.26Å; L943-T947 PolarHBondContact O-N 3.36Å; L943-T947 PolarHBondContact O-OG1 3.35Å; L943-L989 HydrophobicContact CD1-CD2 3.61Å; L943-L989 HydrophobicContact CD2-CD2 4.03Å; L943-S993 VanDerWaalsContact CD2-OG 3.3Å; L943-S993 WeakPolarHBondContact CD2-OG 3.3Å
944S88.2Confident87.7Confident46 Ų4638.3 Ų38.332%0.32219%0.193SC..Hα-helixtrans-59.3-50.3171.8-175.90000111P940 Q941 L946 T947 R948P940-S944 WeakPolarHBondContact O-CB 3.13Å; P940-S944 PolarHBondContact O-N 3.07Å; Q941-S944 WeakPolarHBondContact O-CB 3.49Å; Q941-S944 PolarHBondContact O-N 3.42Å; S944-L946 PolarHBondContact O-N 3.05Å; S944-T947 PolarHBondContact O-N 3.27Å; S944-R948 VanDerWaalsContact O-CG 3.32Å; S944-R948 WeakPolarHBondContact O-CG 3.36Å; S944-R948 PolarHBondContact O-N 3.28Å; S944-R948 PolarHBondContact OG-NH2 2.82Å
945S89.4Confident87.1Confident5 Ų533.8 Ų33.84%0.03517%0.169CC..Hα-helixtrans-64-39.8179.1-72.20000113.4T838 Q941 A942 T947 R948 L949T838-S945 VanDerWaalsContact CG2-OG 3.26Å; T838-S945 WeakPolarHBondContact CG2-OG 3.45Å; Q941-S945 PolarHBondContact O-N 3.13Å; A942-S945 PolarHBondContact O-N 3.42Å; S945-T947 VanDerWaalsContact C-N 3.34Å; S945-T947 PolarHBondContact O-N 3.28Å; S945-R948 PolarHBondContact O-N 2.64Å; S945-L949 PolarHBondContact O-N 3.37Å; S945-L949 VanDerWaalsContact O-N 3.16Å
946L93.3Very high86.7Confident3 Ų330.7 Ų30.72%0.01616%0.156CC..Hα-helixtrans-61.1-43.3172.5137.1141.4000111.7F841 V929 A932 L933 A942 L943 S944 R948 L949 L950F841-L946 HydrophobicContact CD1-CB 4.48Å; F841-L946 HydrophobicContact CD2-CB 4.23Å; F841-L946 HydrophobicContact CE1-CB 4.43Å; F841-L946 HydrophobicContact CE2-CB 4.17Å; F841-L946 HydrophobicContact CG-CB 4.4Å; F841-L946 HydrophobicContact CZ-CB 4.28Å; F841-L946 HydrophobicContact CZ-CD1 4.47Å; V929-L946 HydrophobicContact CB-CD1 4Å; V929-L946 HydrophobicContact CG1-CD1 3.49Å; V929-L946 VanDerWaalsContact CG1-CD1 3.49Å; V929-L946 HydrophobicContact CG1-CG 4.03Å; V929-L946 HydrophobicContact CG2-CD1 4.28Å; V929-L946 WeakPolarHBondContact O-CD1 3.49Å; A932-L946 HydrophobicContact CB-CD1 3.84Å; L933-L946 HydrophobicContact CD2-CD1 4.21Å; L933-L946 HydrophobicContact CD2-CD2 3.83Å; L933-L946 HydrophobicContact CG-CD1 4.01Å; L933-L946 HydrophobicContact CG-CD2 4.47Å; A942-L946 WeakPolarHBondContact O-CB 3.48Å; A942-L946 PolarHBondContact O-N 3.34Å; L943-L946 HydrophobicContact CB-CD2 4.38Å; L943-L946 HydrophobicContact CD1-CD2 4.12Å; L943-L946 HydrophobicContact CG-CD2 3.73Å; L943-L946 VanDerWaalsContact O-CD2 3.24Å; L943-L946 WeakPolarHBondContact O-CD2 3.41Å; S944-L946 PolarHBondContact O-N 3.05Å; L946-R948 VanDerWaalsContact C-N 3.29Å; L946-R948 PolarHBondContact O-N 3.11Å; L946-L949 PolarHBondContact O-N 2.77Å; L946-L950 PolarHBondContact O-N 2.99Å
947T90.4Very high86.3Confident3 Ų329.6 Ų29.62%0.01815%0.153CC..Hα-helixtrans-67.3-34.4-178.7-56.80000111L943 S944 S945 L950 N951 P996 L997 A1000L943-T947 WeakPolarHBondContact O-CB 3.26Å; L943-T947 PolarHBondContact O-N 3.36Å; L943-T947 PolarHBondContact O-OG1 3.35Å; S944-T947 PolarHBondContact O-N 3.27Å; S945-T947 VanDerWaalsContact C-N 3.34Å; S945-T947 PolarHBondContact O-N 3.28Å; T947-L950 PolarHBondContact O-N 3.29Å; T947-N951 WeakPolarHBondContact O-CB 3.37Å; T947-N951 PolarHBondContact O-N 3.08Å; T947-P996 VanDerWaalsContact CG2-C 3.44Å; T947-P996 HydrophobicContact CG2-CB 3.77Å; T947-P996 HydrophobicContact CG2-CG 4.16Å; T947-P996 WeakPolarHBondContact CG2-O 3.42Å; T947-L997 HydrophobicContact CG2-CB 4.37Å; T947-A1000 HydrophobicContact CG2-CB 4.44Å
948R88.7Confident85.8Confident64 Ų6430 Ų3024%0.24216%0.155CC..Hα-helixtrans-61.9-47.2172.2-66.9174.7-171.9156.2-2.6111.9L747 L751 S944 S945 L946 L950 N951 V952L747-R948 HydrophobicContact CD1-CB 4.43Å; L751-R948 HydrophobicContact CD1-CG 3.96Å; L751-R948 HydrophobicContact CD2-CG 4.4Å; S944-R948 VanDerWaalsContact O-CG 3.32Å; S944-R948 WeakPolarHBondContact O-CG 3.36Å; S944-R948 PolarHBondContact O-N 3.28Å; S944-R948 PolarHBondContact OG-NH2 2.82Å; S945-R948 PolarHBondContact O-N 2.64Å; L946-R948 VanDerWaalsContact C-N 3.29Å; L946-R948 PolarHBondContact O-N 3.11Å; R948-L950 VanDerWaalsContact C-N 3.3Å; R948-L950 PolarHBondContact O-N 3.16Å; R948-N951 PolarHBondContact O-N 3.37Å; R948-V952 WeakPolarHBondContact O-CG2 3.45Å; R948-V952 PolarHBondContact O-N 3.45Å
949L91.7Very high85.5Confident0 Ų025.8 Ų25.80%014%0.137CC..Hα-helixtrans-57.7-46.2174.2177.561.4000111F841 M844 T845 A848 L925 V929 S945 L946 N951 V952 L953F841-L949 HydrophobicContact CD1-CD2 3.69Å; F841-L949 HydrophobicContact CE1-CD2 4.01Å; M844-L949 HydrophobicContact CB-CD1 4.41Å; M844-L949 HydrophobicContact CB-CD2 4.24Å; T845-L949 WeakPolarHBondContact OG1-CA 3.4Å; T845-L949 WeakPolarHBondContact OG1-CB 3.4Å; T845-L949 PolarHBondContact OG1-N 3.24Å; A848-L949 HydrophobicContact CB-CD1 3.86Å; L925-L949 HydrophobicContact CB-CD2 4.45Å; L925-L949 HydrophobicContact CD2-CD2 4.46Å; V929-L949 HydrophobicContact CG2-CD2 4.09Å; S945-L949 PolarHBondContact O-N 3.37Å; S945-L949 VanDerWaalsContact O-N 3.16Å; L946-L949 PolarHBondContact O-N 2.77Å; L949-N951 VanDerWaalsContact C-N 3.34Å; L949-N951 PolarHBondContact O-N 3.46Å; L949-V952 PolarHBondContact O-N 2.85Å; L949-L953 HydrophobicContact CD1-CD1 4.2Å; L949-L953 HydrophobicContact CD1-CG 4.21Å; L949-L953 HydrophobicContact CG-CD1 4.12Å; L949-L953 WeakPolarHBondContact O-CG 3.4Å; L949-L953 PolarHBondContact O-N 2.94Å
950L91.4Very high85Confident0 Ų022.5 Ų22.50%012%0.124CC..Hα-helixtrans-59.8-45.2179.4-169.665000111.4L926 V929 L946 T947 R948 V952 L953 S954 W969 I972 L997 A1000L926-L950 HydrophobicContact CD2-CD1 3.66Å; V929-L950 HydrophobicContact CG1-CD1 4.27Å; L946-L950 PolarHBondContact O-N 2.99Å; T947-L950 PolarHBondContact O-N 3.29Å; R948-L950 VanDerWaalsContact C-N 3.3Å; R948-L950 PolarHBondContact O-N 3.16Å; L950-V952 PolarHBondContact O-N 3.49Å; L950-L953 PolarHBondContact O-N 3.5Å; L950-S954 WeakPolarHBondContact O-CB 3.48Å; L950-S954 PolarHBondContact O-N 3.45Å; L950-S954 PolarHBondContact O-OG 3.31Å; L950-W969 HydrophobicContact CD1-CE3 4.13Å; L950-W969 HydrophobicContact CD1-CH2 4.2Å; L950-W969 HydrophobicContact CD1-CZ3 3.42Å; L950-W969 VanDerWaalsContact CD1-CZ3 3.42Å; L950-W969 HydrophobicContact CG-CZ3 4.2Å; L950-I972 HydrophobicContact CD2-CG2 4.33Å; L950-L997 HydrophobicContact CD2-CD1 3.92Å; L950-A1000 HydrophobicContact CB-CB 4.28Å; L950-A1000 HydrophobicContact CD2-CB 3.77Å; L950-A1000 HydrophobicContact CG-CB 3.92Å
951N86.3Confident84.5Confident18 Ų1820.6 Ų20.610%0.09611%0.112CC..Hα-helixtrans-57.7-47.3175.4-91-29000111.7L751 T947 R948 L949 L953 S954 M955 A1000L751-N951 HydrophobicContact CD2-CB 3.85Å; T947-N951 WeakPolarHBondContact O-CB 3.37Å; T947-N951 PolarHBondContact O-N 3.08Å; R948-N951 PolarHBondContact O-N 3.37Å; L949-N951 VanDerWaalsContact C-N 3.34Å; L949-N951 PolarHBondContact O-N 3.46Å; N951-L953 PolarHBondContact O-N 3.16Å; N951-S954 WeakPolarHBondContact CA-OG 3.3Å; N951-S954 PolarHBondContact O-N 2.81Å; N951-S954 PolarHBondContact O-OG 3.22Å; N951-M955 WeakPolarHBondContact O-CG 3.31Å; N951-M955 PolarHBondContact O-N 3.33Å; N951-A1000 WeakPolarHBondContact OD1-CA 3.47Å; N951-A1000 WeakPolarHBondContact OD1-CB 3.44Å; N951-A1000 PolarHBondContact OD1-N 3.22Å
952V85Confident84.1Confident2 Ų217.4 Ų17.41%0.01210%0.099CC..Hα-helixtrans-59.6-48.6178.7172.50000111.9V750 T845 A848 A849 R948 L949 L950 S954 M955 H956V750-V952 HydrophobicContact CG1-CG2 3.46Å; V750-V952 VanDerWaalsContact CG1-CG2 3.46Å; T845-V952 HydrophobicContact CG2-CB 4.33Å; T845-V952 HydrophobicContact CG2-CG2 3.62Å; A848-V952 HydrophobicContact CB-CG1 4.23Å; A849-V952 HydrophobicContact CB-CG1 4.13Å; R948-V952 WeakPolarHBondContact O-CG2 3.45Å; R948-V952 PolarHBondContact O-N 3.45Å; L949-V952 PolarHBondContact O-N 2.85Å; L950-V952 PolarHBondContact O-N 3.49Å; V952-S954 VanDerWaalsContact C-N 3.28Å; V952-S954 PolarHBondContact O-N 3.29Å; V952-M955 PolarHBondContact O-N 3.37Å; V952-H956 PolarHBondContact O-CD2 2.97Å; V952-H956 PolarHBondContact O-N 2.92Å
953L87.7Confident83.7Confident0 Ų017.4 Ų17.40%010%0.099CC..Hα-helixtrans-62.9-38.5178.2-65.6176.8000111.6A848 I922 L925 L926 L949 L950 N951 S957 L964A848-L953 HydrophobicContact CB-CD2 3.94Å; I922-L953 HydrophobicContact CG1-CD2 4.27Å; I922-L953 HydrophobicContact CG2-CD2 4.29Å; L925-L953 HydrophobicContact CB-CD1 4.22Å; L926-L953 HydrophobicContact CD2-CD1 4.08Å; L926-L953 HydrophobicContact CG-CD1 4.32Å; L949-L953 HydrophobicContact CD1-CD1 4.2Å; L949-L953 HydrophobicContact CD1-CG 4.21Å; L949-L953 HydrophobicContact CG-CD1 4.12Å; L949-L953 WeakPolarHBondContact O-CG 3.4Å; L949-L953 PolarHBondContact O-N 2.94Å; L950-L953 PolarHBondContact O-N 3.5Å; N951-L953 PolarHBondContact O-N 3.16Å; L953-S957 WeakPolarHBondContact O-CB 3.44Å; L953-S957 PolarHBondContact O-N 2.91Å; L953-S957 PolarHBondContact O-OG 2.6Å; L953-L964 HydrophobicContact CB-CD2 4.27Å
954S83.8Confident83.4Confident0 Ų017.3 Ų17.30%010%0.099CC..Hα-helixtrans-66-38.1-17980.90000112.8L950 N951 V952 G1004 S1007L950-S954 WeakPolarHBondContact O-CB 3.48Å; L950-S954 PolarHBondContact O-N 3.45Å; L950-S954 PolarHBondContact O-OG 3.31Å; N951-S954 WeakPolarHBondContact CA-OG 3.3Å; N951-S954 PolarHBondContact O-N 2.81Å; N951-S954 PolarHBondContact O-OG 3.22Å; V952-S954 VanDerWaalsContact C-N 3.28Å; V952-S954 PolarHBondContact O-N 3.29Å; S954-G1004 VanDerWaalsContact CB-CA 3.47Å; S954-S1007 VanDerWaalsContact O-CB 3.27Å; S954-S1007 WeakPolarHBondContact O-CB 3.39Å; S954-S1007 PolarHBondContact O-OG 3.12Å
955M75.8Confident83.1Confident24 Ų2415.9 Ų15.912%0.1189%0.09CC..Hα-helixtrans-96.4-29-172.1-66.2-53.3-79.300114.3M753 N951 V952 C1003 S1086 N1090M753-M955 HydrophobicContact CE-CB 3.65Å; M753-M955 HydrophobicContact CE-CE 3.18Å; M753-M955 HydrophobicContact CE-CG 3.7Å; M753-M955 HydrophobicContact CE-SD 4.24Å; M753-M955 HydrophobicContact CG-CE 4.1Å; M753-M955 HydrophobicContact SD-CE 3.55Å; M753-M955 VanDerWaalsContact SD-CE 3.55Å; N951-M955 WeakPolarHBondContact O-CG 3.31Å; N951-M955 PolarHBondContact O-N 3.33Å; V952-M955 PolarHBondContact O-N 3.37Å; M955-C1003 HydrophobicContact SD-CB 3.52Å; M955-C1003 VanDerWaalsContact SD-CB 3.52Å; M955-S1086 WeakPolarHBondContact CE-OG 3.47Å; M955-N1090 WeakPolarHBondContact CE-ND2 3.43Å
956H76.7Confident82.8Confident24 Ų2416.5 Ų16.511%0.1119%0.094CC..Hα-helixtrans-119.74.3-168.1-52.2-79.4000114.6C853 H854 N855 V952C853-H956 VanDerWaalsContact CA-O 3.32Å; C853-H956 WeakPolarHBondContact CA-O 3.39Å; C853-H956 HydrophobicContact CB-CB 3.56Å; C853-H956 WeakPolarHBondContact CB-O 3.26Å; H854-H956 PolarHBondContact N-O 3.38Å; N855-H956 HydrophobicContact CB-CB 4.12Å; N855-H956 VanDerWaalsContact CB-ND1 3.26Å; N855-H956 WeakPolarHBondContact CB-ND1 3.05Å; V952-H956 PolarHBondContact O-CD2 2.97Å; V952-H956 PolarHBondContact O-N 2.92Å
957S79.6Confident82.4Confident11 Ų1120 Ų208%0.07712%0.118CC..  trans-62.9136.6177.551.30000112.8L953 S960L953-S957 WeakPolarHBondContact O-CB 3.44Å; L953-S957 PolarHBondContact O-N 2.91Å; L953-S957 PolarHBondContact O-OG 2.6Å; S957-S960 PolarHBondContact O-OG 2.88Å; S957-S960 WeakPolarHBondContact OG-CA 3.12Å; S957-S960 WeakPolarHBondContact OG-CB 3.25Å; S957-S960 PolarHBondContact OG-OG 2.68Å; S957-S960 VanDerWaalsContact OG-OG 3.05Å
958P72.7Confident82.2Confident36 Ų3619.9 Ų19.923%0.23412%0.118CC..THydrogen-bonded Turntrans-62.6-48-175.211.2-19.7000114.5H854H854-P958 WeakPolarHBondContact CE1-CB 3.49Å; H854-P958 WeakPolarHBondContact ND1-CB 3.32Å
959N77.4Confident82.3Confident56 Ų5616.8 Ų16.830%0.29911%0.106SC..THydrogen-bonded Turntrans-126.467.9179.5-74.2-48.8000108.5S961 S962 D963N959-S961 PolarHBondContact O-N 3.38Å; N959-S962 VanDerWaalsContact CB-OG 3.23Å; N959-S962 WeakPolarHBondContact CB-OG 3.3Å; N959-S962 PolarHBondContact O-N 2.8Å; N959-S962 PolarHBondContact O-OG 2.69Å; N959-D963 WeakPolarHBondContact CA-OD2 3.48Å; N959-D963 PolarHBondContact N-OD2 2.91Å; N959-D963 WeakPolarHBondContact O-CB 3.34Å; N959-D963 PolarHBondContact O-N 2.79Å
960S77Confident82.2Confident18 Ų1820.7 Ų20.713%0.12612%0.122CC..Hα-helixtrans-46.6-38.9-176.4-31.80000113.2S957 S962 D963 L964 S1007S957-S960 PolarHBondContact O-OG 2.88Å; S957-S960 WeakPolarHBondContact OG-CA 3.12Å; S957-S960 WeakPolarHBondContact OG-CB 3.25Å; S957-S960 PolarHBondContact OG-OG 2.68Å; S957-S960 VanDerWaalsContact OG-OG 3.05Å; S960-S962 VanDerWaalsContact C-N 3.31Å; S960-S962 PolarHBondContact O-N 3.11Å; S960-D963 PolarHBondContact O-N 3.45Å; S960-L964 WeakPolarHBondContact O-CB 3.21Å; S960-L964 PolarHBondContact O-N 3.04Å; S960-S1007 WeakPolarHBondContact CB-O 3.46Å
961S74.7Confident82Confident31 Ų3123.5 Ų23.522%0.21714%0.137CC..Hα-helixtrans-62.2-28.7177.260.60000115.1N959 A965N959-S961 PolarHBondContact O-N 3.38Å; S961-A965 WeakPolarHBondContact O-CB 3.3Å
962S76.9Confident82.1Confident19 Ų1922.6 Ų22.613%0.13313%0.132CC..Hα-helixtrans-98.9-37.3174.154.80000112.4R919 Q923 N959 S960R919-S962 VanDerWaalsContact CZ-O 3.28Å; R919-S962 PolarHBondContact NE-O 3.25Å; R919-S962 PolarHBondContact NH2-O 3.42Å; Q923-S962 PolarHBondContact NE2-O 3.13Å; N959-S962 VanDerWaalsContact CB-OG 3.23Å; N959-S962 WeakPolarHBondContact CB-OG 3.3Å; N959-S962 PolarHBondContact O-N 2.8Å; N959-S962 PolarHBondContact O-OG 2.69Å; S960-S962 VanDerWaalsContact C-N 3.31Å; S960-S962 PolarHBondContact O-N 3.11Å
963D80.9Confident82.3Confident3 Ų322.7 Ų22.72%0.01613%0.132CC..Hα-helixtrans-77.5-47.5-167.7-58.1-16.9000110.5I922 Q923 N959 S960I922-D963 HydrophobicContact CD1-CB 3.89Å; I922-D963 HydrophobicContact CG2-CB 4.2Å; Q923-D963 WeakPolarHBondContact CG-O 3.38Å; Q923-D963 PolarHBondContact NE2-O 2.84Å; N959-D963 WeakPolarHBondContact CA-OD2 3.48Å; N959-D963 PolarHBondContact N-OD2 2.91Å; N959-D963 WeakPolarHBondContact O-CB 3.34Å; N959-D963 PolarHBondContact O-N 2.79Å; S960-D963 PolarHBondContact O-N 3.45Å
964L83Confident82.3Confident0 Ų026.6 Ų26.60%016%0.156CC..THydrogen-bonded Turntrans-81.7-24.6180-57.6174.9000112.8I922 L926 L953 S960 C966 W969 I1008I922-L964 HydrophobicContact CG2-CD2 4.22Å; L926-L964 HydrophobicContact CD1-CD2 3.94Å; L953-L964 HydrophobicContact CB-CD2 4.27Å; S960-L964 WeakPolarHBondContact O-CB 3.21Å; S960-L964 PolarHBondContact O-N 3.04Å; L964-C966 VanDerWaalsContact C-N 3.3Å; L964-C966 PolarHBondContact O-N 3.46Å; L964-W969 HydrophobicContact CB-CD2 4.46Å; L964-W969 HydrophobicContact CD2-CE3 4.33Å; L964-W969 HydrophobicContact CD2-CZ3 4.34Å; L964-W969 WeakPolarHBondContact O-CB 3.2Å; L964-I1008 HydrophobicContact CB-CD1 3.74Å; L964-I1008 HydrophobicContact CB-CG1 3.79Å; L964-I1008 HydrophobicContact CD1-CG1 4.14Å
965A82.1Confident82.4Confident17 Ų1728.5 Ų28.514%0.1417%0.166CC..  trans-71.980-178.100000112.2S961S961-A965 WeakPolarHBondContact O-CB 3.3Å
966C83.4Confident82.9Confident18 Ų1827.6 Ų27.612%0.12216%0.162CC..SBendtrans-138.6163.517772.10000111.1Q923 L964 A968 W969 Y970Q923-C966 HydrophobicContact CB-CB 4.38Å; Q923-C966 HydrophobicContact CG-CB 3.84Å; L964-C966 VanDerWaalsContact C-N 3.3Å; L964-C966 PolarHBondContact O-N 3.46Å; C966-A968 PolarHBondContact O-N 3.39Å; C966-W969 PolarHBondContact O-N 3.38Å; C966-W969 VanDerWaalsContact O-N 3.13Å; C966-Y970 WeakPolarHBondContact O-CD2 3.27Å; C966-Y970 PolarHBondContact O-N 2.96Å
967S85.3Confident83.2Confident75 Ų7526.6 Ų26.652%0.52416%0.158SC..Hα-helixtrans-56.2-36.9-179.659.20000112.7W969 Y970 D971S967-W969 PolarHBondContact O-N 2.91Å; S967-Y970 PolarHBondContact O-N 3.36Å; S967-D971 PolarHBondContact O-N 3.1Å
968A87Confident83.4Confident1 Ų126.3 Ų26.31%0.00816%0.157CC..Hα-helixtrans-61.7-42.5178.700000112.4L926 M927 R930 C966 D971 I972L926-A968 HydrophobicContact CB-CB 4.23Å; M927-A968 HydrophobicContact CB-CB 4.31Å; M927-A968 HydrophobicContact CE-CB 4.02Å; M927-A968 HydrophobicContact SD-CB 4.22Å; R930-A968 HydrophobicContact CB-CB 4.26Å; C966-A968 PolarHBondContact O-N 3.39Å; A968-D971 PolarHBondContact O-N 3.47Å; A968-I972 WeakPolarHBondContact O-CD1 3.41Å; A968-I972 VanDerWaalsContact O-CG1 3.23Å; A968-I972 WeakPolarHBondContact O-CG1 3.42Å; A968-I972 PolarHBondContact O-N 2.56Å
969W90.1Very high83.7Confident0 Ų028.8 Ų28.80%017%0.173CC..Hα-helixtrans-62.7-47177.5-176.7-93.6000111.9L926 L950 L964 C966 S967 D971 I972 C973 I1008L926-W969 HydrophobicContact CD1-CB 4.43Å; L926-W969 HydrophobicContact CD1-CE3 4.13Å; L926-W969 HydrophobicContact CD2-CE3 3.7Å; L926-W969 HydrophobicContact CD2-CZ3 4.02Å; L950-W969 HydrophobicContact CD1-CE3 4.13Å; L950-W969 HydrophobicContact CD1-CH2 4.2Å; L950-W969 HydrophobicContact CD1-CZ3 3.42Å; L950-W969 VanDerWaalsContact CD1-CZ3 3.42Å; L950-W969 HydrophobicContact CG-CZ3 4.2Å; L964-W969 HydrophobicContact CB-CD2 4.46Å; L964-W969 HydrophobicContact CD2-CE3 4.33Å; L964-W969 HydrophobicContact CD2-CZ3 4.34Å; L964-W969 WeakPolarHBondContact O-CB 3.2Å; C966-W969 PolarHBondContact O-N 3.38Å; C966-W969 VanDerWaalsContact O-N 3.13Å; S967-W969 PolarHBondContact O-N 2.91Å; W969-D971 VanDerWaalsContact C-N 3.29Å; W969-D971 PolarHBondContact O-N 2.95Å; W969-I972 PolarHBondContact O-N 3.21Å; W969-C973 PolarHBondContact NE1-SG 3.16Å; W969-C973 WeakPolarHBondContact O-CB 3.45Å; W969-C973 PolarHBondContact O-N 3.34Å; W969-C973 PolarHBondContact O-SG 3.41Å; W969-I1008 HydrophobicContact CD2-CD1 4.48Å; W969-I1008 HydrophobicContact CG-CD1 4.29Å
970Y88.5Confident83.8Confident81 Ų8131.9 Ų31.932%0.31819%0.185SC..Hα-helixtrans-60.1-42.9176.4-69.7-71.6000111C966 S967 I972 C973 T974 L1033C966-Y970 WeakPolarHBondContact O-CD2 3.27Å; C966-Y970 PolarHBondContact O-N 2.96Å; S967-Y970 PolarHBondContact O-N 3.36Å; Y970-I972 PolarHBondContact O-N 3.01Å; Y970-C973 WeakPolarHBondContact O-CB 3.35Å; Y970-C973 PolarHBondContact O-N 3.35Å; Y970-T974 WeakPolarHBondContact O-CG2 3.16Å; Y970-T974 PolarHBondContact O-N 3.5Å; Y970-T974 PolarHBondContact O-OG1 3.46Å; Y970-L1033 HydrophobicContact CD1-CD1 3.82Å; Y970-L1033 HydrophobicContact CD1-CD2 4.17Å; Y970-L1033 HydrophobicContact CE1-CD1 3.83Å; Y970-L1033 HydrophobicContact CE1-CD2 3.86Å; Y970-L1033 HydrophobicContact CE1-CG 4.3Å
971D87.3Confident84.1Confident59 Ų5931.1 Ų31.132%0.31618%0.18SC..Hα-helixtrans-65-40.7178.6-63.6-18.9000112R930 S967 A968 W969 C973 T974 I975R930-D971 HydrophobicContact CG-CB 4.45Å; R930-D971 IonicContact CZ-OD2 2.88Å; R930-D971 IonicContact NE-OD2 3.82Å; R930-D971 IonicContact NH2-OD2 3.68Å; S967-D971 PolarHBondContact O-N 3.1Å; A968-D971 PolarHBondContact O-N 3.47Å; W969-D971 VanDerWaalsContact C-N 3.29Å; W969-D971 PolarHBondContact O-N 2.95Å; D971-C973 VanDerWaalsContact C-N 3.34Å; D971-C973 PolarHBondContact O-N 3.17Å; D971-T974 VanDerWaalsContact CA-OG1 3.32Å; D971-T974 WeakPolarHBondContact CA-OG1 3.27Å; D971-T974 PolarHBondContact O-N 3.39Å; D971-T974 PolarHBondContact O-OG1 2.94Å; D971-I975 WeakPolarHBondContact O-CG1 3.39Å; D971-I975 PolarHBondContact O-N 3.11Å
972I90.1Very high84.4Confident0 Ų030.4 Ų30.40%018%0.175CC..Hα-helixtrans-58.3-48.2174-67.4162.1000110V929 R930 L933 L950 A968 W969 Y970 T974 I975 V976V929-I972 HydrophobicContact CB-CD1 4.31Å; V929-I972 HydrophobicContact CG1-CD1 3.76Å; R930-I972 HydrophobicContact CB-CD1 4.16Å; R930-I972 HydrophobicContact CB-CG1 3.97Å; L933-I972 HydrophobicContact CD1-CG1 4.18Å; L933-I972 HydrophobicContact CD1-CG2 4.14Å; L950-I972 HydrophobicContact CD2-CG2 4.33Å; A968-I972 WeakPolarHBondContact O-CD1 3.41Å; A968-I972 VanDerWaalsContact O-CG1 3.23Å; A968-I972 WeakPolarHBondContact O-CG1 3.42Å; A968-I972 PolarHBondContact O-N 2.56Å; W969-I972 PolarHBondContact O-N 3.21Å; Y970-I972 PolarHBondContact O-N 3.01Å; I972-T974 VanDerWaalsContact C-N 3.3Å; I972-T974 PolarHBondContact O-N 2.9Å; I972-I975 WeakPolarHBondContact O-CB 3.47Å; I972-I975 PolarHBondContact O-N 2.81Å; I972-I975 VanDerWaalsContact O-N 3.09Å; I972-V976 WeakPolarHBondContact O-CG2 3.49Å; I972-V976 PolarHBondContact O-N 3.36Å; I972-V976 VanDerWaalsContact O-N 3.1Å
973C89.3Confident84.6Confident3 Ų334.8 Ų34.82%0.0219%0.194CC..Hα-helixtrans-58.1-41176.5-72.70000112.1W969 Y970 D971 V976 A977 L1037W969-C973 PolarHBondContact NE1-SG 3.16Å; W969-C973 WeakPolarHBondContact O-CB 3.45Å; W969-C973 PolarHBondContact O-N 3.34Å; W969-C973 PolarHBondContact O-SG 3.41Å; Y970-C973 WeakPolarHBondContact O-CB 3.35Å; Y970-C973 PolarHBondContact O-N 3.35Å; D971-C973 VanDerWaalsContact C-N 3.34Å; D971-C973 PolarHBondContact O-N 3.17Å; C973-V976 PolarHBondContact O-N 2.74Å; C973-A977 PolarHBondContact O-N 2.67Å; C973-L1037 HydrophobicContact CB-CD1 4.34Å; C973-L1037 HydrophobicContact CB-CD2 3.99Å
974T87.4Confident84.6Confident82 Ų8239.3 Ų39.350%0.50322%0.215SC..Hα-helixtrans-69.8-29.9176.160.70000113.4Y970 D971 I972 G978Y970-T974 WeakPolarHBondContact O-CG2 3.16Å; Y970-T974 PolarHBondContact O-N 3.5Å; Y970-T974 PolarHBondContact O-OG1 3.46Å; D971-T974 VanDerWaalsContact CA-OG1 3.32Å; D971-T974 WeakPolarHBondContact CA-OG1 3.27Å; D971-T974 PolarHBondContact O-N 3.39Å; D971-T974 PolarHBondContact O-OG1 2.94Å; I972-T974 VanDerWaalsContact C-N 3.3Å; I972-T974 PolarHBondContact O-N 2.9Å; T974-G978 WeakPolarHBondContact O-CA 3.41Å; T974-G978 PolarHBondContact O-N 3.3Å
975I86.2Confident84.5Confident41 Ų4140.6 Ų40.621%0.2122%0.223CC..Hα-helixtrans-66.3-43.6174.2-71.6164000109.9D971 I972 T985D971-I975 WeakPolarHBondContact O-CG1 3.39Å; D971-I975 PolarHBondContact O-N 3.11Å; I972-I975 WeakPolarHBondContact O-CB 3.47Å; I972-I975 PolarHBondContact O-N 2.81Å; I972-I975 VanDerWaalsContact O-N 3.09Å; I975-T985 HydrophobicContact CG2-CG2 3.6Å; I975-T985 VanDerWaalsContact O-CB 3.28Å; I975-T985 WeakPolarHBondContact O-CB 3.46Å; I975-T985 VanDerWaalsContact O-CG2 3.32Å; I975-T985 WeakPolarHBondContact O-CG2 3.45Å; I975-T985 PolarHBondContact O-OG1 3.27Å
976V85.8Confident84.8Confident4 Ų439.9 Ų39.92%0.02422%0.216CC..Hα-helixtrans-78.5-39.4-174.2176.70000112.8I972 C973 A981 W986 L997 V998I972-V976 WeakPolarHBondContact O-CG2 3.49Å; I972-V976 PolarHBondContact O-N 3.36Å; I972-V976 VanDerWaalsContact O-N 3.1Å; C973-V976 PolarHBondContact O-N 2.74Å; V976-A981 WeakPolarHBondContact O-CB 3.29Å; V976-W986 PolarHBondContact O-NE1 2.73Å; V976-L997 HydrophobicContact CG2-CD1 4.49Å; V976-L997 HydrophobicContact CG2-CD2 3.73Å; V976-L997 HydrophobicContact CG2-CG 3.82Å; V976-V998 HydrophobicContact CG1-CB 4.46Å; V976-V998 HydrophobicContact CG1-CG2 3.64Å
977A83.6Confident84.8Confident3 Ų342 Ų423%0.02523%0.229CC..Hα-helixtrans-132.69.2-170.500000113.9C973 L1037 E1040 I1041C973-A977 PolarHBondContact O-N 2.67Å; A977-L1037 HydrophobicContact CB-CD2 3.4Å; A977-E1040 WeakPolarHBondContact O-CB 3.36Å; A977-I1041 HydrophobicContact CB-CD1 4.23Å; A977-I1041 HydrophobicContact CB-CG1 3.84Å
978G83.3Confident84.7Confident6 Ų643.6 Ų43.66%0.06223%0.232CC..SBendtrans-67.9168.717500000112.6T974 Q980 A981 Q1044T974-G978 WeakPolarHBondContact O-CA 3.41Å; T974-G978 PolarHBondContact O-N 3.3Å; G978-Q980 PolarHBondContact O-N 2.93Å; G978-A981 WeakPolarHBondContact O-CB 3.28Å; G978-A981 PolarHBondContact O-N 2.94Å; G978-Q1044 PolarHBondContact O-NE2 2.9Å
979P78Confident84.6Confident87 Ų8744.3 Ų44.357%0.56524%0.236SC*.THydrogen-bonded Turntrans-62.8-17.2-169.422.2-33.5000115.2Q1044P979-Q1044 PolarHBondContact O-NE2 3.2Å; P979-Q1044 VanDerWaalsContact O-NE2 3.07Å
980Q80.4Confident84.4Confident121 Ų12146.9 Ų46.957%0.56525%0.254SS*.THydrogen-bonded Turntrans-105.12.2176-65.5-177.7-27.700113.7G978 S982 E983 H984G978-Q980 PolarHBondContact O-N 2.93Å; Q980-S982 VanDerWaalsContact C-N 3.3Å; Q980-S982 PolarHBondContact O-N 3.3Å; Q980-E983 PolarHBondContact O-N 3.41Å; Q980-H984 PolarHBondContact O-N 3.44Å; Q980-H984 VanDerWaalsContact O-N 3.07Å
981A82.7Confident84.2Confident2 Ų245.1 Ų45.12%0.01725%0.251CS..Iπ-helixtrans-59.7-39.3-175.500000112.7V976 G978 E983 T985 W986V976-A981 WeakPolarHBondContact O-CB 3.29Å; G978-A981 WeakPolarHBondContact O-CB 3.28Å; G978-A981 PolarHBondContact O-N 2.94Å; A981-E983 PolarHBondContact O-N 2.86Å; A981-T985 PolarHBondContact O-N 2.98Å; A981-W986 PolarHBondContact O-N 2.92Å
982S81.4Confident84Confident16 Ų1648 Ų4811%0.11227%0.267CS..Iπ-helixtrans-64.3-25176.363.70000114.5Q980Q980-S982 VanDerWaalsContact C-N 3.3Å; Q980-S982 PolarHBondContact O-N 3.3Å
983E80.2Confident83.9Confident111 Ų11148.6 Ų48.652%0.51927%0.271SS..Iπ-helixtrans-95.1-30.3-176.8-69178.1-171.100113Q980 A981Q980-E983 PolarHBondContact O-N 3.41Å; A981-E983 PolarHBondContact O-N 2.86Å
984H82.7Confident84Confident99 Ų9948.5 Ų48.546%0.45827%0.27SS..Iπ-helixtrans-118.8-46.1-172.9-62.3-36.6000113.4Q980 N988Q980-H984 PolarHBondContact O-N 3.44Å; Q980-H984 VanDerWaalsContact O-N 3.07Å; H984-N988 PolarHBondContact O-ND2 2.84Å
985T80.8Confident84.2Confident27 Ų2744.7 Ų44.717%0.16625%0.247CC..Iπ-helixtrans-83.2-52.8-170.9-43.60000111.7I975 A981 P987 N988 L989I975-T985 HydrophobicContact CG2-CG2 3.6Å; I975-T985 VanDerWaalsContact O-CB 3.28Å; I975-T985 WeakPolarHBondContact O-CB 3.46Å; I975-T985 VanDerWaalsContact O-CG2 3.32Å; I975-T985 WeakPolarHBondContact O-CG2 3.45Å; I975-T985 PolarHBondContact O-OG1 3.27Å; A981-T985 PolarHBondContact O-N 2.98Å; T985-P987 VanDerWaalsContact C-CD 3.48Å; T985-N988 PolarHBondContact O-N 3.29Å; T985-N988 VanDerWaalsContact O-N 3.16Å; T985-L989 HydrophobicContact CG2-CD1 3.89Å; T985-L989 PolarHBondContact O-N 2.84Å
986W87.1Confident84.4Confident2 Ų244.2 Ų44.21%0.00825%0.247CC..G310 helixtrans-60.5-39.1-174.5-54.6-8.6000113.6V976 A981 N988 L994 Q1044 I1048 N1072 V1076V976-W986 PolarHBondContact O-NE1 2.73Å; A981-W986 PolarHBondContact O-N 2.92Å; W986-N988 VanDerWaalsContact C-N 3.31Å; W986-N988 PolarHBondContact O-N 2.66Å; W986-L994 HydrophobicContact CB-CD2 4.01Å; W986-L994 HydrophobicContact CG-CD2 4.16Å; W986-Q1044 HydrophobicContact CH2-CB 3.84Å; W986-Q1044 HydrophobicContact CZ2-CB 4.48Å; W986-I1048 HydrophobicContact CE3-CD1 4.4Å; W986-I1048 HydrophobicContact CZ3-CD1 3.69Å; W986-N1072 HydrophobicContact CB-CB 4.02Å; W986-N1072 PolarHBondContact O-ND2 3.4Å; W986-V1076 HydrophobicContact CD2-CG2 3.74Å; W986-V1076 HydrophobicContact CE3-CG2 4.1Å; W986-V1076 HydrophobicContact CG-CG2 4.22Å; W986-V1076 HydrophobicContact CH2-CG1 4.44Å; W986-V1076 HydrophobicContact CH2-CG2 4.15Å; W986-V1076 HydrophobicContact CZ2-CB 4.41Å; W986-V1076 HydrophobicContact CZ2-CG1 4.13Å; W986-V1076 HydrophobicContact CZ2-CG2 3.78Å; W986-V1076 HydrophobicContact CZ3-CG2 4.29Å
987P83.7Confident84.6Confident61 Ų6144 Ų4440%0.39625%0.246SC..G310 helixtrans-71.9-21.4177.8-16.931.7000114.8T985 N1072T985-P987 VanDerWaalsContact C-CD 3.48Å; P987-N1072 WeakPolarHBondContact CA-ND2 3.47Å
988N84.1Confident85Confident110 Ų11044 Ų4459%0.58825%0.245SC*.G310 helixtrans-90.7-9.3-175.3-72.9-10.5000113.1H984 T985 W986H984-N988 PolarHBondContact O-ND2 2.84Å; T985-N988 PolarHBondContact O-N 3.29Å; T985-N988 VanDerWaalsContact O-N 3.16Å; W986-N988 VanDerWaalsContact C-N 3.31Å; W986-N988 PolarHBondContact O-N 2.66Å
989L84Confident85.4Confident15 Ų1545.2 Ų45.28%0.07925%0.249CC..SBendtrans-108.3145.7178.4-69.2167.2000109.5L943 T985 L994 L997L943-L989 HydrophobicContact CD1-CD2 3.61Å; L943-L989 HydrophobicContact CD2-CD2 4.03Å; T985-L989 HydrophobicContact CG2-CD1 3.89Å; T985-L989 PolarHBondContact O-N 2.84Å; L989-L994 HydrophobicContact CD1-CD1 4.09Å; L989-L997 HydrophobicContact CD1-CD2 4.1Å
990S85.5Confident85.9Confident55 Ų5541.1 Ų41.139%0.38522%0.222SC..  trans-66152.5168.967.20000110.8D992 S993 L994S990-D992 VanDerWaalsContact C-N 3.29Å; S990-D992 PolarHBondContact O-N 3.16Å; S990-S993 VanDerWaalsContact O-CB 3.31Å; S990-S993 WeakPolarHBondContact O-CB 3.47Å; S990-S993 PolarHBondContact O-N 2.91Å; S990-S993 VanDerWaalsContact O-N 3.12Å; S990-S993 VanDerWaalsContact OG-CB 3.26Å; S990-S993 WeakPolarHBondContact OG-CB 3.49Å; S990-S993 PolarHBondContact OG-N 3.34Å; S990-S993 PolarHBondContact OG-OG 3.06Å; S990-L994 PolarHBondContact O-N 3.24Å
991T85.1Confident86.5Confident43 Ų4335.5 Ų35.526%0.26420%0.196SC..Hα-helixtrans-58.2-41.9178.146.60000111.8S993 L994 I995 V1071 A1075T991-S993 PolarHBondContact O-N 3.48Å; T991-L994 PolarHBondContact O-N 2.74Å; T991-I995 WeakPolarHBondContact O-CD1 3.25Å; T991-I995 VanDerWaalsContact O-CG1 3.26Å; T991-I995 WeakPolarHBondContact O-CG1 3.41Å; T991-I995 PolarHBondContact O-N 3.13Å; T991-V1071 HydrophobicContact CG2-CG1 3.62Å; T991-A1075 HydrophobicContact CG2-CB 4.11Å
992D83.7Confident86.8Confident121 Ų12135.8 Ų35.865%0.64720%0.197SC*.Hα-helixtrans-64.8-26.2178.6-64.4-35000113.5S990 P996S990-D992 VanDerWaalsContact C-N 3.29Å; S990-D992 PolarHBondContact O-N 3.16Å; D992-P996 WeakPolarHBondContact O-CD 3.5Å; D992-P996 WeakPolarHBondContact O-CG 3.4Å
993S87.5Confident87Confident12 Ų1235 Ų358%0.08419%0.192CC..Hα-helixtrans-82.7-40.1175.4-79.10000112.8L943 S990 T991 P996 L997L943-S993 VanDerWaalsContact CD2-OG 3.3Å; L943-S993 WeakPolarHBondContact CD2-OG 3.3Å; S990-S993 VanDerWaalsContact O-CB 3.31Å; S990-S993 WeakPolarHBondContact O-CB 3.47Å; S990-S993 PolarHBondContact O-N 2.91Å; S990-S993 VanDerWaalsContact O-N 3.12Å; S990-S993 VanDerWaalsContact OG-CB 3.26Å; S990-S993 WeakPolarHBondContact OG-CB 3.49Å; S990-S993 PolarHBondContact OG-N 3.34Å; S990-S993 PolarHBondContact OG-OG 3.06Å; T991-S993 PolarHBondContact O-N 3.48Å; S993-P996 WeakPolarHBondContact O-CD 3.42Å; S993-P996 WeakPolarHBondContact O-CG 3.45Å; S993-L997 WeakPolarHBondContact O-CB 3.29Å; S993-L997 PolarHBondContact O-N 3.08Å
994L91.1Very high87.3Confident0 Ų029.8 Ų29.80%017%0.168CC..Hα-helixtrans-69-39.5-175.4-176.159.9000112.1W986 L989 S990 T991 L997 V998 A1075 V1076W986-L994 HydrophobicContact CB-CD2 4.01Å; W986-L994 HydrophobicContact CG-CD2 4.16Å; L989-L994 HydrophobicContact CD1-CD1 4.09Å; S990-L994 PolarHBondContact O-N 3.24Å; T991-L994 PolarHBondContact O-N 2.74Å; L994-L997 PolarHBondContact O-N 2.87Å; L994-V998 HydrophobicContact CD1-CG2 4.09Å; L994-V998 HydrophobicContact CG-CG2 4.35Å; L994-V998 VanDerWaalsContact O-CG2 3.31Å; L994-V998 WeakPolarHBondContact O-CG2 3.26Å; L994-V998 PolarHBondContact O-N 3.26Å; L994-A1075 HydrophobicContact CD2-CB 4.25Å; L994-V1076 HydrophobicContact CD1-CG2 4.47Å; L994-V1076 HydrophobicContact CD2-CG2 3.71Å; L994-V1076 HydrophobicContact CG-CG2 4.11Å
995I92Very high87.5Confident2 Ų225 Ų251%0.0115%0.146CC..Hα-helixtrans-55.4-59.4-179.7-66.8160.2000112.3T991 L997 V998 E999 A1075 R1078 G1079T991-I995 WeakPolarHBondContact O-CD1 3.25Å; T991-I995 VanDerWaalsContact O-CG1 3.26Å; T991-I995 WeakPolarHBondContact O-CG1 3.41Å; T991-I995 PolarHBondContact O-N 3.13Å; I995-L997 VanDerWaalsContact C-N 3.28Å; I995-L997 PolarHBondContact O-N 3.37Å; I995-V998 PolarHBondContact O-N 3.49Å; I995-E999 PolarHBondContact O-N 2.81Å; I995-A1075 HydrophobicContact CD1-CB 4.49Å; I995-A1075 HydrophobicContact CG1-CB 4.05Å; I995-A1075 WeakPolarHBondContact CG1-O 3.5Å; I995-R1078 HydrophobicContact CD1-CB 4.31Å; I995-R1078 VanDerWaalsContact CD1-CZ 3.45Å; I995-R1078 HydrophobicContact CG1-CB 4.07Å; I995-R1078 HydrophobicContact CG2-CB 4.43Å; I995-G1079 VanDerWaalsContact O-CA 3.32Å; I995-G1079 WeakPolarHBondContact O-CA 3.42Å
996P88.9Confident87.7Confident32 Ų3224.2 Ų24.221%0.20814%0.14CC..Hα-helixtrans-69.1-25.8-178.429.1-37000112.6T947 D992 S993 E999 A1000T947-P996 VanDerWaalsContact CG2-C 3.44Å; T947-P996 HydrophobicContact CG2-CB 3.77Å; T947-P996 HydrophobicContact CG2-CG 4.16Å; T947-P996 WeakPolarHBondContact CG2-O 3.42Å; D992-P996 WeakPolarHBondContact O-CD 3.5Å; D992-P996 WeakPolarHBondContact O-CG 3.4Å; S993-P996 WeakPolarHBondContact O-CD 3.42Å; S993-P996 WeakPolarHBondContact O-CG 3.45Å; P996-E999 WeakPolarHBondContact O-CB 3.48Å; P996-E999 PolarHBondContact O-N 3.04Å; P996-A1000 WeakPolarHBondContact O-CB 3.47Å; P996-A1000 PolarHBondContact O-N 3.15Å
997L91.4Very high87.4Confident0 Ų025 Ų250%015%0.146CC..Hα-helixtrans-69.4-43.4176.8-177.364.9000111.7L933 T947 L950 V976 L989 S993 L994 I995 E999 A1000 C1001L933-L997 HydrophobicContact CD2-CD2 4.33Å; T947-L997 HydrophobicContact CG2-CB 4.37Å; L950-L997 HydrophobicContact CD2-CD1 3.92Å; V976-L997 HydrophobicContact CG2-CD1 4.49Å; V976-L997 HydrophobicContact CG2-CD2 3.73Å; V976-L997 HydrophobicContact CG2-CG 3.82Å; L989-L997 HydrophobicContact CD1-CD2 4.1Å; S993-L997 WeakPolarHBondContact O-CB 3.29Å; S993-L997 PolarHBondContact O-N 3.08Å; L994-L997 PolarHBondContact O-N 2.87Å; I995-L997 VanDerWaalsContact C-N 3.28Å; I995-L997 PolarHBondContact O-N 3.37Å; L997-E999 VanDerWaalsContact C-N 3.31Å; L997-A1000 PolarHBondContact O-N 3.25Å; L997-C1001 PolarHBondContact O-N 3.01Å; L997-C1001 VanDerWaalsContact O-N 3.11Å; L997-C1001 PolarHBondContact O-SG 3.14Å
998V92.5Very high87.4Confident1 Ų122.7 Ų22.71%0.00613%0.13CC..Hα-helixtrans-62.5-43172.8171.30000110.2V976 L994 I995 A1000 C1001 L1002 V1076 V1080V976-V998 HydrophobicContact CG1-CB 4.46Å; V976-V998 HydrophobicContact CG1-CG2 3.64Å; L994-V998 HydrophobicContact CD1-CG2 4.09Å; L994-V998 HydrophobicContact CG-CG2 4.35Å; L994-V998 VanDerWaalsContact O-CG2 3.31Å; L994-V998 WeakPolarHBondContact O-CG2 3.26Å; L994-V998 PolarHBondContact O-N 3.26Å; I995-V998 PolarHBondContact O-N 3.49Å; V998-A1000 PolarHBondContact O-N 2.93Å; V998-C1001 PolarHBondContact O-N 3.06Å; V998-L1002 HydrophobicContact CG1-CD1 3.97Å; V998-L1002 WeakPolarHBondContact O-CG 3.44Å; V998-L1002 PolarHBondContact O-N 2.93Å; V998-L1002 VanDerWaalsContact O-N 3.12Å; V998-V1076 HydrophobicContact CG1-CG1 4.3Å; V998-V1076 HydrophobicContact CG2-CG1 4.22Å; V998-V1076 HydrophobicContact CG2-CG2 4.3Å; V998-V1080 HydrophobicContact CG1-CG2 4.02Å
999E91Very high87.2Confident33 Ų3317.9 Ų17.915%0.15410%0.104CC..Hα-helixtrans-55.1-52.4175.5-178.2179179.400111.5I995 P996 L997 C1001 L1002 C1003 R1082 A1083I995-E999 PolarHBondContact O-N 2.81Å; P996-E999 WeakPolarHBondContact O-CB 3.48Å; P996-E999 PolarHBondContact O-N 3.04Å; L997-E999 VanDerWaalsContact C-N 3.31Å; E999-C1001 PolarHBondContact O-N 2.91Å; E999-L1002 PolarHBondContact O-N 2.87Å; E999-C1003 VanDerWaalsContact O-CB 3.26Å; E999-C1003 WeakPolarHBondContact O-CB 3.4Å; E999-C1003 PolarHBondContact O-N 2.77Å; E999-C1003 PolarHBondContact O-SG 3.24Å; E999-R1082 HydrophobicContact CG-CB 4.26Å; E999-A1083 HydrophobicContact CG-CB 4.28Å
1000A89.2Confident86.8Confident0 Ų021.4 Ų21.40%012%0.119CC..Hα-helixtrans-58.4-43.3179.600000113.3T947 L950 N951 P996 L997 V998 G1004T947-A1000 HydrophobicContact CG2-CB 4.44Å; L950-A1000 HydrophobicContact CB-CB 4.28Å; L950-A1000 HydrophobicContact CD2-CB 3.77Å; L950-A1000 HydrophobicContact CG-CB 3.92Å; N951-A1000 WeakPolarHBondContact OD1-CA 3.47Å; N951-A1000 WeakPolarHBondContact OD1-CB 3.44Å; N951-A1000 PolarHBondContact OD1-N 3.22Å; P996-A1000 WeakPolarHBondContact O-CB 3.47Å; P996-A1000 PolarHBondContact O-N 3.15Å; L997-A1000 PolarHBondContact O-N 3.25Å; V998-A1000 PolarHBondContact O-N 2.93Å; A1000-G1004 PolarHBondContact O-N 2.89Å
1001C91.5Very high85.9Confident3 Ų325.4 Ų25.42%0.0213%0.129CC..Hα-helixtrans-66.4-40.7-178.6-67.80000112.2L997 V998 E999 S1005L997-C1001 PolarHBondContact O-N 3.01Å; L997-C1001 VanDerWaalsContact O-N 3.11Å; L997-C1001 PolarHBondContact O-SG 3.14Å; V998-C1001 PolarHBondContact O-N 3.06Å; E999-C1001 PolarHBondContact O-N 2.91Å; C1001-S1005 VanDerWaalsContact O-CB 3.31Å; C1001-S1005 WeakPolarHBondContact O-CB 3.49Å; C1001-S1005 PolarHBondContact O-N 2.85Å; C1001-S1005 PolarHBondContact O-OG 3.08Å
1002L89.8Confident85Confident8 Ų829 Ų294%0.04215%0.147CC..Hα-helixtrans-71.5-45.4178.4-70.3173.9000111.4V998 E999 G1004 S1005 W1006 L1034 L1037 I1038 I1041 V1080 A1083V998-L1002 HydrophobicContact CG1-CD1 3.97Å; V998-L1002 WeakPolarHBondContact O-CG 3.44Å; V998-L1002 PolarHBondContact O-N 2.93Å; V998-L1002 VanDerWaalsContact O-N 3.12Å; E999-L1002 PolarHBondContact O-N 2.87Å; L1002-G1004 VanDerWaalsContact C-N 3.35Å; L1002-G1004 PolarHBondContact O-N 3.47Å; L1002-S1005 PolarHBondContact O-N 2.79Å; L1002-W1006 WeakPolarHBondContact O-CB 3.49Å; L1002-W1006 PolarHBondContact O-N 3.38Å; L1002-L1034 HydrophobicContact CD2-CD1 3.91Å; L1002-L1037 HydrophobicContact CD2-CB 4.25Å; L1002-I1038 HydrophobicContact CD2-CG1 4.28Å; L1002-I1041 HydrophobicContact CD2-CD1 4.47Å; L1002-V1080 HydrophobicContact CD1-CB 4.1Å; L1002-V1080 HydrophobicContact CD1-CG1 4.26Å; L1002-V1080 HydrophobicContact CD1-CG2 3.69Å; L1002-A1083 HydrophobicContact CB-CB 3.76Å; L1002-A1083 HydrophobicContact CD1-CB 3.91Å; L1002-A1083 HydrophobicContact CG-CB 4.5Å
1003C86Confident84Confident1 Ų124.1 Ų24.11%0.00712%0.121CC..Hα-helixtrans-55.8-46.8174.7-78.40000112.1M955 E999 W1006 S1007M955-C1003 HydrophobicContact SD-CB 3.52Å; M955-C1003 VanDerWaalsContact SD-CB 3.52Å; E999-C1003 VanDerWaalsContact O-CB 3.26Å; E999-C1003 WeakPolarHBondContact O-CB 3.4Å; E999-C1003 PolarHBondContact O-N 2.77Å; E999-C1003 PolarHBondContact O-SG 3.24Å; C1003-W1006 WeakPolarHBondContact O-CB 3.27Å; C1003-W1006 PolarHBondContact O-N 2.95Å; C1003-S1007 PolarHBondContact O-N 3.12Å; C1003-S1007 PolarHBondContact O-OG 2.63Å
1004G85.9Confident82.4Confident0 Ų026.5 Ų26.50%014%0.137CC..Hα-helixtrans-70.5-35.817900000113.8S954 A1000 L1002 W1006 S1007 I1008S954-G1004 VanDerWaalsContact CB-CA 3.47Å; A1000-G1004 PolarHBondContact O-N 2.89Å; L1002-G1004 VanDerWaalsContact C-N 3.35Å; L1002-G1004 PolarHBondContact O-N 3.47Å; G1004-W1006 VanDerWaalsContact C-N 3.32Å; G1004-S1007 WeakPolarHBondContact O-CB 3.17Å; G1004-S1007 PolarHBondContact O-N 3.23Å; G1004-I1008 WeakPolarHBondContact O-CG1 3.34Å; G1004-I1008 PolarHBondContact O-N 2.99Å
1005S87.5Confident80.5Confident0 Ų030.4 Ų30.40%017%0.165CC..Hα-helixtrans-67.8-35.9175.5-58.90000111.5C1001 L1002 I1008 D1009 L1037C1001-S1005 VanDerWaalsContact O-CB 3.31Å; C1001-S1005 WeakPolarHBondContact O-CB 3.49Å; C1001-S1005 PolarHBondContact O-N 2.85Å; C1001-S1005 PolarHBondContact O-OG 3.08Å; L1002-S1005 PolarHBondContact O-N 2.79Å; S1005-I1008 PolarHBondContact O-N 3.2Å; S1005-D1009 PolarHBondContact O-N 2.9Å; S1005-L1037 WeakPolarHBondContact OG-CD1 3.46Å
1006W84.9Confident78.3Confident9 Ų933.4 Ų33.43%0.03419%0.186CC..Hα-helixtrans-60-47168171.9-100.3000111.7L1002 C1003 G1004 I1008 D1009 K1010 L1013 L1034 I1087 S1091 L1097L1002-W1006 WeakPolarHBondContact O-CB 3.49Å; L1002-W1006 PolarHBondContact O-N 3.38Å; C1003-W1006 WeakPolarHBondContact O-CB 3.27Å; C1003-W1006 PolarHBondContact O-N 2.95Å; G1004-W1006 VanDerWaalsContact C-N 3.32Å; W1006-I1008 VanDerWaalsContact C-N 3.27Å; W1006-I1008 PolarHBondContact O-N 3.49Å; W1006-D1009 PolarHBondContact O-N 3.5Å; W1006-D1009 VanDerWaalsContact O-N 3.17Å; W1006-K1010 HydrophobicContact CZ2-CG 4.33Å; W1006-K1010 WeakPolarHBondContact O-CA 3.45Å; W1006-K1010 VanDerWaalsContact O-CB 3.27Å; W1006-K1010 WeakPolarHBondContact O-CB 3.24Å; W1006-K1010 PolarHBondContact O-N 3.31Å; W1006-L1013 HydrophobicContact CE3-CD1 4.06Å; W1006-L1013 HydrophobicContact CZ3-CD1 3.97Å; W1006-L1034 HydrophobicContact CB-CD2 4.01Å; W1006-L1034 HydrophobicContact CD2-CD2 4.42Å; W1006-L1034 HydrophobicContact CE3-CD2 3.56Å; W1006-L1034 HydrophobicContact CZ3-CD2 4.41Å; W1006-I1087 HydrophobicContact CB-CD1 3.85Å; W1006-I1087 HydrophobicContact CB-CG1 4.1Å; W1006-I1087 HydrophobicContact CD2-CG2 3.56Å; W1006-I1087 VanDerWaalsContact CE2-CG2 3.48Å; W1006-I1087 HydrophobicContact CE3-CG2 4.13Å; W1006-I1087 HydrophobicContact CG-CD1 4.16Å; W1006-I1087 HydrophobicContact CG-CG1 4.01Å; W1006-I1087 HydrophobicContact CG-CG2 3.77Å; W1006-I1087 HydrophobicContact CH2-CG2 4.45Å; W1006-I1087 HydrophobicContact CZ2-CG2 3.96Å; W1006-S1091 WeakPolarHBondContact CZ2-OG 3.49Å; W1006-L1097 HydrophobicContact CE3-CD1 3.63Å; W1006-L1097 HydrophobicContact CZ3-CB 4.05Å; W1006-L1097 HydrophobicContact CZ3-CD1 3.58Å; W1006-L1097 HydrophobicContact CZ3-CG 4.33Å
1007S80.8Confident76.4Confident20 Ų2033.7 Ų33.714%0.1419%0.191CC..Hα-helixtrans-59.3-37177.9-61.50000112.8S954 S960 C1003 G1004S954-S1007 VanDerWaalsContact O-CB 3.27Å; S954-S1007 WeakPolarHBondContact O-CB 3.39Å; S954-S1007 PolarHBondContact O-OG 3.12Å; S960-S1007 WeakPolarHBondContact CB-O 3.46Å; C1003-S1007 PolarHBondContact O-N 3.12Å; C1003-S1007 PolarHBondContact O-OG 2.63Å; G1004-S1007 WeakPolarHBondContact O-CB 3.17Å; G1004-S1007 PolarHBondContact O-N 3.23Å
1008I83Confident74.4Confident11 Ų1135 Ų356%0.05620%0.198CC..Hα-helixtrans-64.7-49173.9-66.2166.3000111.1L964 W969 G1004 S1005 W1006 L1033L964-I1008 HydrophobicContact CB-CD1 3.74Å; L964-I1008 HydrophobicContact CB-CG1 3.79Å; L964-I1008 HydrophobicContact CD1-CG1 4.14Å; W969-I1008 HydrophobicContact CD2-CD1 4.48Å; W969-I1008 HydrophobicContact CG-CD1 4.29Å; G1004-I1008 WeakPolarHBondContact O-CG1 3.34Å; G1004-I1008 PolarHBondContact O-N 2.99Å; S1005-I1008 PolarHBondContact O-N 3.2Å; W1006-I1008 VanDerWaalsContact C-N 3.27Å; W1006-I1008 PolarHBondContact O-N 3.49Å; I1008-L1033 HydrophobicContact CD1-CD2 4.18Å
1009D80.1Confident72.3Confident10 Ų1039.2 Ų39.25%0.05322%0.223CC..Hα-helixtrans-87.5-15.1-169.8-71.7-23000114.2S1005 W1006 K1011 N1012 L1013 S1032 L1033 L1034S1005-D1009 PolarHBondContact O-N 2.9Å; W1006-D1009 PolarHBondContact O-N 3.5Å; W1006-D1009 VanDerWaalsContact O-N 3.17Å; D1009-K1011 PolarHBondContact O-N 3.01Å; D1009-N1012 WeakPolarHBondContact O-CA 3.34Å; D1009-N1012 PolarHBondContact O-N 3.42Å; D1009-L1013 HydrophobicContact CB-CD1 3.51Å; D1009-L1013 HydrophobicContact CB-CG 4.23Å; D1009-L1013 PolarHBondContact O-N 2.97Å; D1009-S1032 WeakPolarHBondContact OD2-CB 3.17Å; D1009-S1032 PolarHBondContact OD2-OG 3.19Å; D1009-L1033 PolarHBondContact OD2-N 3.03Å; D1009-L1034 WeakPolarHBondContact OD2-CB 3.32Å; D1009-L1034 PolarHBondContact OD2-N 2.95Å
1010K74.5Confident70.1Confident89 Ų8943.8 Ų43.839%0.38725%0.245SC..THydrogen-bonded Turntrans-51.6-33.8-173.4-177.4178.8-176.6177.50113.6W1006 N1090W1006-K1010 HydrophobicContact CZ2-CG 4.33Å; W1006-K1010 WeakPolarHBondContact O-CA 3.45Å; W1006-K1010 VanDerWaalsContact O-CB 3.27Å; W1006-K1010 WeakPolarHBondContact O-CB 3.24Å; W1006-K1010 PolarHBondContact O-N 3.31Å; K1010-N1090 PolarHBondContact NZ-O 3.16Å
1011K68.3Low68.1Low139 Ų13948 Ų4860%0.60426%0.264SS*.THydrogen-bonded Turntrans-75.3-25.9178.2-68.8-178.2-178171.90113.3D1009D1009-K1011 PolarHBondContact O-N 3.01Å
1012N65Low65.8Low119 Ų11955.8 Ų55.864%0.63630%0.3SS*.THydrogen-bonded Turntrans-93.6-26.5-178.3-63.1-23.8000112.1D1009 S1014D1009-N1012 WeakPolarHBondContact O-CA 3.34Å; D1009-N1012 PolarHBondContact O-N 3.42Å; N1012-S1014 VanDerWaalsContact C-N 3.28Å; N1012-S1014 PolarHBondContact O-N 2.88Å
1013L63.6Low63.5Low17 Ų1762.7 Ų62.79%0.08933%0.332CS..  trans-77.372.6174.6-72.5155.4000110.7W1006 D1009 L1018 L1034W1006-L1013 HydrophobicContact CE3-CD1 4.06Å; W1006-L1013 HydrophobicContact CZ3-CD1 3.97Å; D1009-L1013 HydrophobicContact CB-CD1 3.51Å; D1009-L1013 HydrophobicContact CB-CG 4.23Å; D1009-L1013 PolarHBondContact O-N 2.97Å; L1013-L1018 HydrophobicContact CD2-CD1 4Å; L1013-L1018 HydrophobicContact CD2-CD2 4.07Å; L1013-L1018 HydrophobicContact CD2-CG 3.96Å; L1013-L1034 HydrophobicContact CD1-CD2 4.35Å
1014S53.3Low61.1Low62 Ų6270.1 Ų70.143%0.43437%0.366SS..  trans-79.6145.6163.558.80000109.8N1012 S1016 A1017N1012-S1014 VanDerWaalsContact C-N 3.28Å; N1012-S1014 PolarHBondContact O-N 2.88Å; S1014-S1016 PolarHBondContact O-N 2.79Å; S1014-S1016 PolarHBondContact OG-OG 3.41Å; S1014-A1017 WeakPolarHBondContact O-CB 3.4Å; S1014-A1017 PolarHBondContact O-N 2.84Å
1015S50.7Low58.7Low82 Ų8275.4 Ų75.457%0.57340%0.404SS*.Hα-helixtrans-53.2-19.6-176.345.60000114.7
1016S46.1Very low56.2Low66 Ų6682.8 Ų82.846%0.46244%0.443SS..Hα-helixtrans-76.9-28.2173.551.20000114.7S1014 Q1020S1014-S1016 PolarHBondContact O-N 2.79Å; S1014-S1016 PolarHBondContact OG-OG 3.41Å; S1016-Q1020 WeakPolarHBondContact O-CB 3.39Å; S1016-Q1020 WeakPolarHBondContact O-CG 3.29Å; S1016-Q1020 PolarHBondContact O-N 3.26Å
1017A48.3Very low54Low38 Ų3890.4 Ų90.431%0.31448%0.479SS..Hα-helixtrans-75.6-39.4-173.500000112.8S1014 V1019 Q1020 Q1021S1014-A1017 WeakPolarHBondContact O-CB 3.4Å; S1014-A1017 PolarHBondContact O-N 2.84Å; A1017-V1019 VanDerWaalsContact C-N 3.34Å; A1017-V1019 PolarHBondContact O-N 3.42Å; A1017-Q1020 PolarHBondContact O-N 3.14Å; A1017-Q1021 PolarHBondContact O-N 3.3Å
1018L50.9Low52.1Low28 Ų2899.3 Ų99.315%0.14752%0.518CS..Hα-helixtrans-66.8-34.3178.3-78.4160.9000112.4L1013 L1035 D1096 L1100L1013-L1018 HydrophobicContact CD2-CD1 4Å; L1013-L1018 HydrophobicContact CD2-CD2 4.07Å; L1013-L1018 HydrophobicContact CD2-CG 3.96Å; L1018-L1035 HydrophobicContact CD2-CD1 4.22Å; L1018-L1035 HydrophobicContact CD2-CD2 4.17Å; L1018-D1096 HydrophobicContact CD1-CB 3.82Å; L1018-L1100 HydrophobicContact CD2-CD1 4.09Å
1019V48.7Very low50.3Low89 Ų89103.6 Ų103.654%0.53955%0.545SS..Hα-helixtrans-78-33.2178.2-179.70000111.8A1017A1017-V1019 VanDerWaalsContact C-N 3.34Å; A1017-V1019 PolarHBondContact O-N 3.42Å
1020Q44.3Very low49.1Very low129 Ų129107.3 Ų107.360%0.60357%0.571SS**Hα-helixtrans-75.6-28.5-179.5-82.2-179.1-20.100114.1S1016 A1017 Q1022 H1023S1016-Q1020 WeakPolarHBondContact O-CB 3.39Å; S1016-Q1020 WeakPolarHBondContact O-CG 3.29Å; S1016-Q1020 PolarHBondContact O-N 3.26Å; A1017-Q1020 PolarHBondContact O-N 3.14Å; Q1020-Q1022 PolarHBondContact O-N 2.95Å; Q1020-H1023 PolarHBondContact O-N 2.56Å; Q1020-H1023 VanDerWaalsContact O-N 3.12Å
1021Q46.3Very low48.5Very low87 Ų87106 Ų10641%0.40757%0.569SS.*THydrogen-bonded Turntrans-64.7-21.6177.1-86-168.3-36.600113.6A1017 H1023 D1031A1017-Q1021 PolarHBondContact O-N 3.3Å; Q1021-H1023 VanDerWaalsContact C-N 3.3Å; Q1021-H1023 PolarHBondContact O-N 3.37Å; Q1021-D1031 PolarHBondContact NE2-OD1 3.46Å
1022Q44.1Very low49Very low167 Ų167100.6 Ų100.678%0.7855%0.548SS*.THydrogen-bonded Turntrans-75.3-13.5174.5-76.3-170.2-1400114.2Q1020Q1020-Q1022 PolarHBondContact O-N 2.95Å
1023H41.5Very low49.7Very low154 Ų15495.9 Ų95.971%0.71352%0.523SS*.THydrogen-bonded Turntrans-117.8-5.9-172.1-79.1-49.9000116.2Q1020 Q1021Q1020-H1023 PolarHBondContact O-N 2.56Å; Q1020-H1023 VanDerWaalsContact O-N 3.12Å; Q1021-H1023 VanDerWaalsContact C-N 3.3Å; Q1021-H1023 PolarHBondContact O-N 3.37Å
1024H35Very low50.7Low156 Ų15695.1 Ų95.172%0.72252%0.519SS*.  trans-125.595.7177.1-77.2-26.9000112.1N1026H1024-N1026 VanDerWaalsContact C-N 3.32Å; H1024-N1026 PolarHBondContact O-N 3.49Å
1025S36.6Very low52.1Low112 Ų11293.3 Ų93.378%0.78350%0.504SS*.  trans-84.518.4-178.161.90000115.1
1026N34.1Very low53.7Low154 Ų15491.8 Ų91.882%0.82449%0.488SS*.SBendtrans-141.112.4-167.3-83.1-21.5000117.9H1024H1024-N1026 VanDerWaalsContact C-N 3.32Å; H1024-N1026 PolarHBondContact O-N 3.49Å
1027E38.3Very low55.6Low170 Ų17089.2 Ų89.279%0.79447%0.469SS*.SBendtrans-126.9128.6166.4-77.8-174.8160.900109.9V1029E1027-V1029 PolarHBondContact O-N 3.07Å
1028E41.1Very low57.4Low207 Ų20788 Ų8897%0.96746%0.458SS*.  trans-6570.3175.8-69.8179161.300110.4S1030E1028-S1030 PolarHBondContact O-N 2.95Å
1029V45.8Very low59.1Low100 Ų10092 Ų9261%0.60647%0.47SS*.  trans-80.8110.5166.3-177.50000106.1E1027 D1031E1027-V1029 PolarHBondContact O-N 3.07Å; V1029-D1031 PolarHBondContact O-N 3.3Å; V1029-D1031 VanDerWaalsContact O-N 3.08Å
1030S54.7Low60.9Low88 Ų8890 Ų9062%0.61546%0.456SS*.  trans-50.5112.9178.546.10000110.8E1028E1028-S1030 PolarHBondContact O-N 2.95Å
1031D62.5Low63.1Low62 Ų6284.1 Ų84.133%0.33243%0.428SS..  trans-53143.8176-76.9-31.8000110.7Q1021 V1029 R1039Q1021-D1031 PolarHBondContact NE2-OD1 3.46Å; V1029-D1031 PolarHBondContact O-N 3.3Å; V1029-D1031 VanDerWaalsContact O-N 3.08Å; D1031-R1039 IonicContact OD2-CZ 2.65Å; D1031-R1039 IonicContact OD2-NH1 3.06Å; D1031-R1039 PolarHBondContact OD2-NH1 3.16Å
1032S77.2Confident65.1Low25 Ų2585.4 Ų85.418%0.17543%0.429CS..  trans-65.6151.1174.5980000110.3D1009 L1034 L1035 Q1036D1009-S1032 WeakPolarHBondContact OD2-CB 3.17Å; D1009-S1032 PolarHBondContact OD2-OG 3.19Å; S1032-L1034 PolarHBondContact O-N 2.93Å; S1032-L1035 PolarHBondContact O-N 3.16Å; S1032-L1035 VanDerWaalsContact O-N 3.13Å; S1032-L1035 PolarHBondContact OG-N 3.21Å; S1032-Q1036 PolarHBondContact O-N 3.43Å
1033L81.2Confident67.2Low20 Ų2082.5 Ų82.511%0.10542%0.415CS..Hα-helixtrans-56.3-40.9-176.5176.264.1000111.5Y970 I1008 D1009 Q1036 L1037Y970-L1033 HydrophobicContact CD1-CD1 3.82Å; Y970-L1033 HydrophobicContact CD1-CD2 4.17Å; Y970-L1033 HydrophobicContact CE1-CD1 3.83Å; Y970-L1033 HydrophobicContact CE1-CD2 3.86Å; Y970-L1033 HydrophobicContact CE1-CG 4.3Å; I1008-L1033 HydrophobicContact CD1-CD2 4.18Å; D1009-L1033 PolarHBondContact OD2-N 3.03Å; L1033-Q1036 PolarHBondContact O-N 3.43Å; L1033-L1037 HydrophobicContact CD1-CD1 4.4Å; L1033-L1037 HydrophobicContact CD1-CG 4.49Å; L1033-L1037 HydrophobicContact CG-CD1 4.1Å; L1033-L1037 WeakPolarHBondContact O-CB 3.47Å; L1033-L1037 WeakPolarHBondContact O-CG 3.44Å; L1033-L1037 PolarHBondContact O-N 3.42Å
1034L84.3Confident69.3Low2 Ų275.3 Ų75.31%0.0138%0.382CS..Hα-helixtrans-63.3-45.1178.6-178.865.8000112.6L1002 W1006 D1009 L1013 S1032 Q1036 L1037 I1038 L1097L1002-L1034 HydrophobicContact CD2-CD1 3.91Å; W1006-L1034 HydrophobicContact CB-CD2 4.01Å; W1006-L1034 HydrophobicContact CD2-CD2 4.42Å; W1006-L1034 HydrophobicContact CE3-CD2 3.56Å; W1006-L1034 HydrophobicContact CZ3-CD2 4.41Å; D1009-L1034 WeakPolarHBondContact OD2-CB 3.32Å; D1009-L1034 PolarHBondContact OD2-N 2.95Å; L1013-L1034 HydrophobicContact CD1-CD2 4.35Å; S1032-L1034 PolarHBondContact O-N 2.93Å; L1034-Q1036 VanDerWaalsContact C-N 3.3Å; L1034-Q1036 PolarHBondContact O-N 3.21Å; L1034-L1037 PolarHBondContact O-N 3.47Å; L1034-I1038 HydrophobicContact CD1-CD1 4.11Å; L1034-I1038 HydrophobicContact CG-CD1 3.92Å; L1034-I1038 VanDerWaalsContact O-CG1 3.32Å; L1034-I1038 WeakPolarHBondContact O-CG1 3.27Å; L1034-I1038 PolarHBondContact O-N 2.89Å; L1034-L1097 HydrophobicContact CD2-CD1 3.25Å; L1034-L1097 HydrophobicContact CG-CD1 4.17Å
1035L82.2Confident71.8Confident23 Ų2368.2 Ų68.212%0.1235%0.35CS..Hα-helixtrans-66-37.2177.8-72.3171.1000111L1018 S1032 R1039 L1100L1018-L1035 HydrophobicContact CD2-CD1 4.22Å; L1018-L1035 HydrophobicContact CD2-CD2 4.17Å; S1032-L1035 PolarHBondContact O-N 3.16Å; S1032-L1035 VanDerWaalsContact O-N 3.13Å; S1032-L1035 PolarHBondContact OG-N 3.21Å; L1035-R1039 VanDerWaalsContact O-CB 3.29Å; L1035-R1039 WeakPolarHBondContact O-CB 3.37Å; L1035-R1039 PolarHBondContact O-N 3.07Å; L1035-L1100 HydrophobicContact CD2-CD1 3.87Å; L1035-L1100 HydrophobicContact CD2-CD2 4.12Å
1036Q84.5Confident74.2Confident51 Ų5165.6 Ų65.624%0.23833%0.327CS..Hα-helixtrans-62-48173.5-173175.92.600111.2S1032 L1033 L1034 I1038 R1039 E1040S1032-Q1036 PolarHBondContact O-N 3.43Å; L1033-Q1036 PolarHBondContact O-N 3.43Å; L1034-Q1036 VanDerWaalsContact C-N 3.3Å; L1034-Q1036 PolarHBondContact O-N 3.21Å; Q1036-I1038 PolarHBondContact O-N 2.9Å; Q1036-R1039 WeakPolarHBondContact O-CB 3.49Å; Q1036-R1039 PolarHBondContact O-N 2.94Å; Q1036-E1040 HydrophobicContact CG-CG 4.48Å; Q1036-E1040 WeakPolarHBondContact O-CG 3.21Å; Q1036-E1040 PolarHBondContact O-N 3.41Å
1037L85.9Confident76.6Confident11 Ų1165 Ų656%0.05831%0.313CS..Hα-helixtrans-58-48.8176.6-81.2165.9000112.4C973 A977 L1002 S1005 L1033 L1034 R1039 E1040 I1041C973-L1037 HydrophobicContact CB-CD1 4.34Å; C973-L1037 HydrophobicContact CB-CD2 3.99Å; A977-L1037 HydrophobicContact CB-CD2 3.4Å; L1002-L1037 HydrophobicContact CD2-CB 4.25Å; S1005-L1037 WeakPolarHBondContact OG-CD1 3.46Å; L1033-L1037 HydrophobicContact CD1-CD1 4.4Å; L1033-L1037 HydrophobicContact CD1-CG 4.49Å; L1033-L1037 HydrophobicContact CG-CD1 4.1Å; L1033-L1037 WeakPolarHBondContact O-CB 3.47Å; L1033-L1037 WeakPolarHBondContact O-CG 3.44Å; L1033-L1037 PolarHBondContact O-N 3.42Å; L1034-L1037 PolarHBondContact O-N 3.47Å; L1037-R1039 VanDerWaalsContact C-N 3.27Å; L1037-R1039 PolarHBondContact O-N 3.01Å; L1037-E1040 PolarHBondContact O-N 3.03Å; L1037-I1041 VanDerWaalsContact O-CG1 3.31Å; L1037-I1041 WeakPolarHBondContact O-CG1 3.3Å; L1037-I1041 PolarHBondContact O-N 3.4Å
1038I87Confident78.7Confident14 Ų1457.7 Ų57.77%0.07228%0.279CS..Hα-helixtrans-61.7-39177.8-67.6163000110.5L1002 L1034 Q1036 R1042 L1097 L1100 V1101L1002-I1038 HydrophobicContact CD2-CG1 4.28Å; L1034-I1038 HydrophobicContact CD1-CD1 4.11Å; L1034-I1038 HydrophobicContact CG-CD1 3.92Å; L1034-I1038 VanDerWaalsContact O-CG1 3.32Å; L1034-I1038 WeakPolarHBondContact O-CG1 3.27Å; L1034-I1038 PolarHBondContact O-N 2.89Å; Q1036-I1038 PolarHBondContact O-N 2.9Å; I1038-R1042 VanDerWaalsContact O-CB 3.26Å; I1038-R1042 WeakPolarHBondContact O-CB 3.28Å; I1038-R1042 PolarHBondContact O-N 3.48Å; I1038-L1097 HydrophobicContact CD1-CD1 4.42Å; I1038-L1100 HydrophobicContact CG2-CD2 4.17Å; I1038-V1101 HydrophobicContact CD1-CG2 3.7Å; I1038-V1101 HydrophobicContact CG1-CG2 4.35Å; I1038-V1101 HydrophobicContact CG2-CG2 4.32Å
1039R86.8Confident80.7Confident110 Ų11049 Ų4942%0.41524%0.239SC..Hα-helixtrans-65.3-46.6176.5-171.7178.874.8-159.8-1.5111.8D1031 L1035 Q1036 L1037 R1042 E1043D1031-R1039 IonicContact OD2-CZ 2.65Å; D1031-R1039 IonicContact OD2-NH1 3.06Å; D1031-R1039 PolarHBondContact OD2-NH1 3.16Å; L1035-R1039 VanDerWaalsContact O-CB 3.29Å; L1035-R1039 WeakPolarHBondContact O-CB 3.37Å; L1035-R1039 PolarHBondContact O-N 3.07Å; Q1036-R1039 WeakPolarHBondContact O-CB 3.49Å; Q1036-R1039 PolarHBondContact O-N 2.94Å; L1037-R1039 VanDerWaalsContact C-N 3.27Å; L1037-R1039 PolarHBondContact O-N 3.01Å; R1039-R1042 WeakPolarHBondContact O-CB 3.48Å; R1039-R1042 PolarHBondContact O-N 2.92Å; R1039-E1043 WeakPolarHBondContact O-CG 3.48Å; R1039-E1043 PolarHBondContact O-N 3.22Å
1040E86.6Confident82.4Confident49 Ų4948.3 Ų48.323%0.22923%0.232CC..Hα-helixtrans-63.5-43.7178.8-66.6-68.1159.700111.5A977 Q1036 L1037 R1042 E1043 Q1044A977-E1040 WeakPolarHBondContact O-CB 3.36Å; Q1036-E1040 HydrophobicContact CG-CG 4.48Å; Q1036-E1040 WeakPolarHBondContact O-CG 3.21Å; Q1036-E1040 PolarHBondContact O-N 3.41Å; L1037-E1040 PolarHBondContact O-N 3.03Å; E1040-R1042 VanDerWaalsContact C-N 3.3Å; E1040-R1042 PolarHBondContact O-N 2.9Å; E1040-E1043 PolarHBondContact O-N 2.86Å; E1040-Q1044 PolarHBondContact O-N 3.38Å
1041I88.6Confident83.6Confident4 Ų447.7 Ų47.72%0.02123%0.225CC..Hα-helixtrans-59-44.7173.3-67.4170.4000109.9A977 L1002 L1037 E1043 Q1044 V1045 V1076 V1080 L1105A977-I1041 HydrophobicContact CB-CD1 4.23Å; A977-I1041 HydrophobicContact CB-CG1 3.84Å; L1002-I1041 HydrophobicContact CD2-CD1 4.47Å; L1037-I1041 VanDerWaalsContact O-CG1 3.31Å; L1037-I1041 WeakPolarHBondContact O-CG1 3.3Å; L1037-I1041 PolarHBondContact O-N 3.4Å; I1041-E1043 PolarHBondContact O-N 3.15Å; I1041-Q1044 PolarHBondContact O-N 3.24Å; I1041-V1045 HydrophobicContact CG2-CG2 4.14Å; I1041-V1045 WeakPolarHBondContact O-CB 3.49Å; I1041-V1045 WeakPolarHBondContact O-CG2 3.44Å; I1041-V1045 PolarHBondContact O-N 3.02Å; I1041-V1076 HydrophobicContact CD1-CG1 4.44Å; I1041-V1076 HydrophobicContact CG2-CG1 3.95Å; I1041-V1080 HydrophobicContact CD1-CG2 4.26Å; I1041-L1105 HydrophobicContact CG2-CD1 4.16Å; I1041-L1105 HydrophobicContact CG2-CD2 4.23Å
1042R89Confident84.2Confident115 Ų11546 Ų4643%0.43422%0.215SC..Hα-helixtrans-60.3-46.1177.7-178.9-179.2168.2-169.8-4.2112.4I1038 R1039 E1040 Q1044 V1045 L1046 G1104 L1105I1038-R1042 VanDerWaalsContact O-CB 3.26Å; I1038-R1042 WeakPolarHBondContact O-CB 3.28Å; I1038-R1042 PolarHBondContact O-N 3.48Å; R1039-R1042 WeakPolarHBondContact O-CB 3.48Å; R1039-R1042 PolarHBondContact O-N 2.92Å; E1040-R1042 VanDerWaalsContact C-N 3.3Å; E1040-R1042 PolarHBondContact O-N 2.9Å; R1042-Q1044 VanDerWaalsContact C-N 3.32Å; R1042-Q1044 PolarHBondContact O-N 3.38Å; R1042-V1045 PolarHBondContact O-N 2.96Å; R1042-L1046 HydrophobicContact CG-CD1 3.97Å; R1042-L1046 HydrophobicContact CG-CG 4.38Å; R1042-L1046 WeakPolarHBondContact O-CB 3.25Å; R1042-L1046 VanDerWaalsContact O-CG 3.28Å; R1042-L1046 WeakPolarHBondContact O-CG 3.09Å; R1042-L1046 PolarHBondContact O-N 2.91Å; R1042-G1104 WeakPolarHBondContact CD-O 3.34Å; R1042-G1104 PolarHBondContact NE-O 3.2Å; R1042-L1105 HydrophobicContact CB-CD1 3.57Å; R1042-L1105 HydrophobicContact CG-CD1 4.09Å
1043E87.7Confident83.9Confident105 Ų10546.7 Ų46.749%0.49122%0.219SC..Hα-helixtrans-62.5-39.5178.1-72.1-59.6143.700111.6R1039 E1040 I1041 L1046 R1047R1039-E1043 WeakPolarHBondContact O-CG 3.48Å; R1039-E1043 PolarHBondContact O-N 3.22Å; E1040-E1043 PolarHBondContact O-N 2.86Å; I1041-E1043 PolarHBondContact O-N 3.15Å; E1043-L1046 PolarHBondContact O-N 3.09Å; E1043-R1047 WeakPolarHBondContact O-CB 3.35Å; E1043-R1047 PolarHBondContact O-N 3.41Å
1044Q87.1Confident83.2Confident4 Ų450.8 Ų50.82%0.01924%0.241CC..Hα-helixtrans-67.4-44.5175-73.2-165.4-1500112.7G978 P979 W986 E1040 I1041 R1042 L1046 R1047 I1048G978-Q1044 PolarHBondContact O-NE2 2.9Å; P979-Q1044 PolarHBondContact O-NE2 3.2Å; P979-Q1044 VanDerWaalsContact O-NE2 3.07Å; W986-Q1044 HydrophobicContact CH2-CB 3.84Å; W986-Q1044 HydrophobicContact CZ2-CB 4.48Å; E1040-Q1044 PolarHBondContact O-N 3.38Å; I1041-Q1044 PolarHBondContact O-N 3.24Å; R1042-Q1044 VanDerWaalsContact C-N 3.32Å; R1042-Q1044 PolarHBondContact O-N 3.38Å; Q1044-L1046 VanDerWaalsContact C-N 3.32Å; Q1044-L1046 PolarHBondContact O-N 2.71Å; Q1044-R1047 PolarHBondContact O-N 2.92Å; Q1044-I1048 WeakPolarHBondContact O-CG1 3.1Å; Q1044-I1048 PolarHBondContact O-N 3.41Å
1045V86.4Confident81.6Confident6 Ų655.2 Ų55.24%0.03626%0.264CS..Hα-helixtrans-59.3-45.4175.5171.20000110.3I1041 R1042 R1047 I1048 L1049 L1077 L1105 F1109I1041-V1045 HydrophobicContact CG2-CG2 4.14Å; I1041-V1045 WeakPolarHBondContact O-CB 3.49Å; I1041-V1045 WeakPolarHBondContact O-CG2 3.44Å; I1041-V1045 PolarHBondContact O-N 3.02Å; R1042-V1045 PolarHBondContact O-N 2.96Å; V1045-R1047 PolarHBondContact O-N 3.31Å; V1045-I1048 PolarHBondContact O-N 3.48Å; V1045-L1049 HydrophobicContact CG1-CD1 4.01Å; V1045-L1049 WeakPolarHBondContact O-CB 3.46Å; V1045-L1049 PolarHBondContact O-N 3.01Å; V1045-L1077 HydrophobicContact CG2-CD2 4.07Å; V1045-L1077 HydrophobicContact CG2-CG 4.41Å; V1045-L1105 HydrophobicContact CG2-CD1 4.4Å; V1045-F1109 HydrophobicContact CG1-CD2 3.64Å; V1045-F1109 HydrophobicContact CG1-CE2 4.13Å
1046L86.6Confident79.8Confident57 Ų5759.4 Ų59.430%0.29830%0.302SS..Hα-helixtrans-63.8-38.9176.7-74.3172.4000112.3R1042 E1043 Q1044 L1049 N1050R1042-L1046 HydrophobicContact CG-CD1 3.97Å; R1042-L1046 HydrophobicContact CG-CG 4.38Å; R1042-L1046 WeakPolarHBondContact O-CB 3.25Å; R1042-L1046 VanDerWaalsContact O-CG 3.28Å; R1042-L1046 WeakPolarHBondContact O-CG 3.09Å; R1042-L1046 PolarHBondContact O-N 2.91Å; E1043-L1046 PolarHBondContact O-N 3.09Å; Q1044-L1046 VanDerWaalsContact C-N 3.32Å; Q1044-L1046 PolarHBondContact O-N 2.71Å; L1046-L1049 PolarHBondContact O-N 3.25Å; L1046-N1050 WeakPolarHBondContact O-CB 3.43Å; L1046-N1050 VanDerWaalsContact O-CG 3.31Å; L1046-N1050 PolarHBondContact O-N 2.97Å; L1046-N1050 PolarHBondContact O-ND2 2.94Å
1047R84.7Confident77.8Confident142 Ų14260.6 Ų60.654%0.53632%0.316SS..Hα-helixtrans-62.9-45.2176-168.6-177-79.5167-2.2110.9E1043 Q1044 V1045 N1050 V1051E1043-R1047 WeakPolarHBondContact O-CB 3.35Å; E1043-R1047 PolarHBondContact O-N 3.41Å; Q1044-R1047 PolarHBondContact O-N 2.92Å; V1045-R1047 PolarHBondContact O-N 3.31Å; R1047-N1050 PolarHBondContact O-N 3.35Å; R1047-V1051 WeakPolarHBondContact O-CG2 3.19Å; R1047-V1051 PolarHBondContact O-N 3.48Å; R1047-V1051 VanDerWaalsContact O-N 3.12Å
1048I83.2Confident75.6Confident17 Ų1763.9 Ų63.99%0.08733%0.33CS..Hα-helixtrans-64.5-43.6176.1-65.8169.6000110.7W986 Q1044 V1045 N1050 V1051 L1052 C1073W986-I1048 HydrophobicContact CE3-CD1 4.4Å; W986-I1048 HydrophobicContact CZ3-CD1 3.69Å; Q1044-I1048 WeakPolarHBondContact O-CG1 3.1Å; Q1044-I1048 PolarHBondContact O-N 3.41Å; V1045-I1048 PolarHBondContact O-N 3.48Å; I1048-N1050 VanDerWaalsContact C-N 3.33Å; I1048-N1050 PolarHBondContact O-N 2.81Å; I1048-V1051 WeakPolarHBondContact O-CB 3.46Å; I1048-V1051 PolarHBondContact O-N 3.01Å; I1048-L1052 HydrophobicContact CG2-CD1 3.94Å; I1048-L1052 HydrophobicContact CG2-CG 4.47Å; I1048-L1052 WeakPolarHBondContact O-CG 3.47Å; I1048-L1052 PolarHBondContact O-N 3.3Å; I1048-C1073 HydrophobicContact CD1-CB 3.95Å; I1048-C1073 HydrophobicContact CG2-CB 4.46Å
1049L82.5Confident73.6Confident23 Ų2369 Ų6912%0.1237%0.367CS..Hα-helixtrans-58.2-44.7175.6-116.1136.7000112V1045 L1046 V1051 L1052 T1053 F1109 H1112V1045-L1049 HydrophobicContact CG1-CD1 4.01Å; V1045-L1049 WeakPolarHBondContact O-CB 3.46Å; V1045-L1049 PolarHBondContact O-N 3.01Å; L1046-L1049 PolarHBondContact O-N 3.25Å; L1049-V1051 VanDerWaalsContact C-N 3.31Å; L1049-V1051 PolarHBondContact O-N 3.38Å; L1049-L1052 CarbonylContact O-C 3.57Å; L1049-L1052 WeakPolarHBondContact O-CB 3.34Å; L1049-L1052 PolarHBondContact O-N 2.97Å; L1049-L1052 VanDerWaalsContact O-N 3.11Å; L1049-T1053 HydrophobicContact CD2-CG2 4.47Å; L1049-T1053 WeakPolarHBondContact O-CG2 3.42Å; L1049-T1053 PolarHBondContact O-N 3.3Å; L1049-T1053 PolarHBondContact O-OG1 3.44Å; L1049-T1053 VanDerWaalsContact O-OG1 3.14Å; L1049-F1109 HydrophobicContact CD1-CD2 3.48Å; L1049-F1109 VanDerWaalsContact CD1-CD2 3.48Å; L1049-F1109 HydrophobicContact CD1-CE2 3.9Å; L1049-H1112 HydrophobicContact CD2-CB 4.32Å; L1049-H1112 WeakPolarHBondContact CD2-CD2 3.32Å
1050N82.8Confident71.5Confident86 Ų8667.3 Ų67.346%0.4637%0.372SS..Hα-helixtrans-62.5-37.6177.4-79.1-25.4000112.3L1046 R1047 I1048 T1053 N1054L1046-N1050 WeakPolarHBondContact O-CB 3.43Å; L1046-N1050 VanDerWaalsContact O-CG 3.31Å; L1046-N1050 PolarHBondContact O-N 2.97Å; L1046-N1050 PolarHBondContact O-ND2 2.94Å; R1047-N1050 PolarHBondContact O-N 3.35Å; I1048-N1050 VanDerWaalsContact C-N 3.33Å; I1048-N1050 PolarHBondContact O-N 2.81Å; N1050-T1053 WeakPolarHBondContact CA-OG1 3.43Å; N1050-T1053 PolarHBondContact O-N 3.4Å; N1050-T1053 PolarHBondContact O-OG1 3.04Å; N1050-N1054 WeakPolarHBondContact O-CB 3.38Å; N1050-N1054 VanDerWaalsContact O-CG 3.28Å; N1050-N1054 PolarHBondContact O-N 3Å; N1050-N1054 PolarHBondContact O-ND2 3.1Å
1051V79.7Confident69.5Low76 Ų7667 Ų6746%0.46137%0.372SS..Hα-helixtrans-63.2-43.6172.81730000110.2R1047 I1048 L1049 T1053R1047-V1051 WeakPolarHBondContact O-CG2 3.19Å; R1047-V1051 PolarHBondContact O-N 3.48Å; R1047-V1051 VanDerWaalsContact O-N 3.12Å; I1048-V1051 WeakPolarHBondContact O-CB 3.46Å; I1048-V1051 PolarHBondContact O-N 3.01Å; L1049-V1051 VanDerWaalsContact C-N 3.31Å; L1049-V1051 PolarHBondContact O-N 3.38Å; V1051-T1053 VanDerWaalsContact C-N 3.33Å; V1051-T1053 PolarHBondContact O-N 3.47Å
1052L74.4Confident67.7Low26 Ų2675.6 Ų75.614%0.13641%0.412CS..Hα-helixtrans-68.6-27178.5-66.2166.4000113.6I1048 L1049 L1070 L1117 K1120I1048-L1052 HydrophobicContact CG2-CD1 3.94Å; I1048-L1052 HydrophobicContact CG2-CG 4.47Å; I1048-L1052 WeakPolarHBondContact O-CG 3.47Å; I1048-L1052 PolarHBondContact O-N 3.3Å; L1049-L1052 CarbonylContact O-C 3.57Å; L1049-L1052 WeakPolarHBondContact O-CB 3.34Å; L1049-L1052 PolarHBondContact O-N 2.97Å; L1049-L1052 VanDerWaalsContact O-N 3.11Å; L1052-L1070 HydrophobicContact CD1-CD1 4.04Å; L1052-L1117 HydrophobicContact CB-CD2 4.41Å; L1052-L1117 HydrophobicContact CD1-CD2 4.21Å; L1052-K1120 PolarHBondContact O-NZ 3.44Å
1053T71.2Confident66.3Low40 Ų4074.6 Ų74.625%0.24542%0.415CS..Hα-helixtrans-93.1-35.9-17856.30000114.7L1049 N1050 V1051 Y1116L1049-T1053 HydrophobicContact CD2-CG2 4.47Å; L1049-T1053 WeakPolarHBondContact O-CG2 3.42Å; L1049-T1053 PolarHBondContact O-N 3.3Å; L1049-T1053 PolarHBondContact O-OG1 3.44Å; L1049-T1053 VanDerWaalsContact O-OG1 3.14Å; N1050-T1053 WeakPolarHBondContact CA-OG1 3.43Å; N1050-T1053 PolarHBondContact O-N 3.4Å; N1050-T1053 PolarHBondContact O-OG1 3.04Å; V1051-T1053 VanDerWaalsContact C-N 3.33Å; V1051-T1053 PolarHBondContact O-N 3.47Å; T1053-Y1116 HydrophobicContact CG2-CE1 4.23Å
1054N66Low65.5Low106 Ų10673.9 Ų73.957%0.56742%0.422SS*.Hα-helixtrans-82.8-13.4-165.4-75.5-21.6000115.7N1050 A1056N1050-N1054 WeakPolarHBondContact O-CB 3.38Å; N1050-N1054 VanDerWaalsContact O-CG 3.28Å; N1050-N1054 PolarHBondContact O-N 3Å; N1050-N1054 PolarHBondContact O-ND2 3.1Å; N1054-A1056 PolarHBondContact O-N 2.9Å
1055D51.3Low65.1Low95 Ų9577.4 Ų77.451%0.50844%0.444SS..  trans-72.7107.1176.1-79.2-22.1000110.3F1058D1055-F1058 HydrophobicContact CB-CD2 3.74Å; D1055-F1058 HydrophobicContact CB-CE2 3.65Å; D1055-F1058 WeakPolarHBondContact O-CD2 3.19Å; D1055-F1058 VanDerWaalsContact O-CE2 3.25Å; D1055-F1058 WeakPolarHBondContact O-CE2 3.11Å
1056A44.8Very low64.9Low110 Ų11078.9 Ų78.991%0.90945%0.453SS*.SBendtrans-83.1-0.816800000111.9N1054N1054-A1056 PolarHBondContact O-N 2.9Å
1057S40.8Very low64.7Low76 Ų7677.4 Ų77.453%0.53145%0.445SS..  trans-112.661.1177.7540000111.6S1059S1057-S1059 PolarHBondContact O-N 3.31Å
1058F39.8Very low64.7Low81 Ų8173 Ų7336%0.35544%0.435SS..G310 helixtrans-77.223.7-174.4-108.6-117.1000115.3D1055 S1060 L1061 K1120D1055-F1058 HydrophobicContact CB-CD2 3.74Å; D1055-F1058 HydrophobicContact CB-CE2 3.65Å; D1055-F1058 WeakPolarHBondContact O-CD2 3.19Å; D1055-F1058 VanDerWaalsContact O-CE2 3.25Å; D1055-F1058 WeakPolarHBondContact O-CE2 3.11Å; F1058-S1060 VanDerWaalsContact C-N 3.31Å; F1058-L1061 HydrophobicContact CD1-CD1 3.27Å; F1058-L1061 HydrophobicContact CD2-CD1 4.35Å; F1058-L1061 HydrophobicContact CE1-CD1 2.99Å; F1058-L1061 HydrophobicContact CE1-CG 4.38Å; F1058-L1061 HydrophobicContact CE2-CD1 4.18Å; F1058-L1061 HydrophobicContact CG-CD1 3.98Å; F1058-L1061 HydrophobicContact CZ-CD1 3.49Å; F1058-L1061 VanDerWaalsContact CZ-CD1 3.49Å; F1058-K1120 HydrophobicContact CE1-CD 3.78Å; F1058-K1120 HydrophobicContact CE1-CG 4.32Å; F1058-K1120 HydrophobicContact CZ-CD 3.81Å
1059S45.1Very low64.9Low121 Ų12176 Ų7685%0.84645%0.45SS*.G310 helixtrans-83.2-3.2174.955.90000113.9S1057S1057-S1059 PolarHBondContact O-N 3.31Å
1060S44.2Very low65.2Low75 Ų7575 Ų7552%0.52445%0.445SS..G310 helixtrans-128.240.1-176.764.90000113.8F1058 Q1062F1058-S1060 VanDerWaalsContact C-N 3.31Å; S1060-Q1062 PolarHBondContact O-N 3.28Å
1061L44.4Very low65.5Low43 Ų4371.5 Ų71.523%0.22543%0.427CS..THydrogen-bonded Turntrans-74.731.8170.9-131.8113.3000113.1F1058 D1063 Y1124F1058-L1061 HydrophobicContact CD1-CD1 3.27Å; F1058-L1061 HydrophobicContact CD2-CD1 4.35Å; F1058-L1061 HydrophobicContact CE1-CD1 2.99Å; F1058-L1061 HydrophobicContact CE1-CG 4.38Å; F1058-L1061 HydrophobicContact CE2-CD1 4.18Å; F1058-L1061 HydrophobicContact CG-CD1 3.98Å; F1058-L1061 HydrophobicContact CZ-CD1 3.49Å; F1058-L1061 VanDerWaalsContact CZ-CD1 3.49Å; L1061-D1063 PolarHBondContact O-N 3.3Å; L1061-Y1124 HydrophobicContact CD2-CD2 4.32Å; L1061-Y1124 HydrophobicContact CD2-CE2 3.44Å; L1061-Y1124 VanDerWaalsContact CD2-CE2 3.44Å; L1061-Y1124 PolarHBondContact O-OH 2.87Å
1062Q51.2Low66.1Low184 Ų18468.6 Ų68.686%0.8641%0.409SS*.THydrogen-bonded Turntrans-79.7-2.9173.1-77.5-173.1-34.400112.7S1060 S1064S1060-Q1062 PolarHBondContact O-N 3.28Å; Q1062-S1064 PolarHBondContact O-N 3.33Å
1063D57.6Low66.9Low93 Ų9367.4 Ų67.450%0.49740%0.402SS..  trans-85.5102.2-172.2-71-11.4000111.3L1061 T1065 T1066L1061-D1063 PolarHBondContact O-N 3.3Å; D1063-T1065 PolarHBondContact O-N 2.78Å; D1063-T1066 PolarHBondContact O-N 2.76Å; D1063-T1066 PolarHBondContact O-OG1 2.92Å
1064S72.5Confident67.9Low91 Ų9165.6 Ų65.664%0.63639%0.391SS*.Hα-helixtrans-53.8-20.2176.784.20000113.4Q1062 I1067 S1068Q1062-S1064 PolarHBondContact O-N 3.33Å; S1064-I1067 PolarHBondContact O-N 3.33Å; S1064-S1068 PolarHBondContact O-N 3.32Å
1065T79Confident69.2Low78 Ų7860.6 Ų60.648%0.47937%0.365SS..Hα-helixtrans-63.4-37.5175.156.70000112.9D1063 S1068 M1069D1063-T1065 PolarHBondContact O-N 2.78Å; T1065-S1068 PolarHBondContact O-OG 3.45Å; T1065-S1068 VanDerWaalsContact O-OG 3.06Å; T1065-M1069 VanDerWaalsContact O-CG 3.26Å; T1065-M1069 WeakPolarHBondContact O-CG 3.21Å; T1065-M1069 PolarHBondContact O-N 2.91Å
1066T80.4Confident71.3Confident36 Ų3656.1 Ų56.122%0.22134%0.341CS..Hα-helixtrans-71.6-34.4179.458.10000112.1D1063 L1070D1063-T1066 PolarHBondContact O-N 2.76Å; D1063-T1066 PolarHBondContact O-OG1 2.92Å; T1066-L1070 PolarHBondContact O-N 3.46Å; T1066-L1070 VanDerWaalsContact O-N 3.15Å
1067I82.5Confident73.7Confident26 Ų2650.9 Ų50.913%0.13330%0.298CS..Hα-helixtrans-67.9-47.9175-62.2165.4000109.4S1064 M1069 L1070 V1071 Y1124 A1127S1064-I1067 PolarHBondContact O-N 3.33Å; I1067-M1069 VanDerWaalsContact C-N 3.27Å; I1067-M1069 PolarHBondContact O-N 2.96Å; I1067-L1070 PolarHBondContact O-N 3.36Å; I1067-V1071 HydrophobicContact CG2-CG2 4.25Å; I1067-V1071 WeakPolarHBondContact O-CG2 3.13Å; I1067-V1071 PolarHBondContact O-N 3.48Å; I1067-Y1124 HydrophobicContact CD1-CD1 3.17Å; I1067-Y1124 HydrophobicContact CD1-CD2 4.48Å; I1067-Y1124 HydrophobicContact CD1-CE1 3.55Å; I1067-Y1124 HydrophobicContact CD1-CG 3.69Å; I1067-Y1124 HydrophobicContact CG1-CD1 4.14Å; I1067-Y1124 HydrophobicContact CG1-CG 4.19Å; I1067-A1127 HydrophobicContact CG2-CB 4.32Å
1068S85.2Confident76.2Confident49 Ų4949 Ų4934%0.34328%0.279SS..Hα-helixtrans-61.7-37.5178.180.20000111.8S1064 T1065 L1070 V1071 N1072S1064-S1068 PolarHBondContact O-N 3.32Å; T1065-S1068 PolarHBondContact O-OG 3.45Å; T1065-S1068 VanDerWaalsContact O-OG 3.06Å; S1068-L1070 PolarHBondContact O-N 3.44Å; S1068-V1071 PolarHBondContact O-N 3.33Å; S1068-N1072 VanDerWaalsContact O-CB 3.25Å; S1068-N1072 WeakPolarHBondContact O-CB 3.05Å; S1068-N1072 PolarHBondContact O-N 2.88Å; S1068-N1072 PolarHBondContact O-ND2 3.28Å
1069M86.9Confident78.7Confident81 Ų8145.1 Ų45.140%0.39926%0.262SS..Hα-helixtrans-59.5-43.1172.6-76.5179.8-17900112.5T1065 I1067 C1073T1065-M1069 VanDerWaalsContact O-CG 3.26Å; T1065-M1069 WeakPolarHBondContact O-CG 3.21Å; T1065-M1069 PolarHBondContact O-N 2.91Å; I1067-M1069 VanDerWaalsContact C-N 3.27Å; I1067-M1069 PolarHBondContact O-N 2.96Å; M1069-C1073 WeakPolarHBondContact O-CB 3.16Å; M1069-C1073 PolarHBondContact O-N 3.01Å
1070L89Confident81Confident3 Ų339.5 Ų39.52%0.01622%0.223CC..Hα-helixtrans-67.5-46.6177.3178.463.2000111.6L1052 T1066 I1067 S1068 N1072 C1073 T1074 F1109 L1117 A1127L1052-L1070 HydrophobicContact CD1-CD1 4.04Å; T1066-L1070 PolarHBondContact O-N 3.46Å; T1066-L1070 VanDerWaalsContact O-N 3.15Å; I1067-L1070 PolarHBondContact O-N 3.36Å; S1068-L1070 PolarHBondContact O-N 3.44Å; L1070-N1072 VanDerWaalsContact C-N 3.33Å; L1070-N1072 PolarHBondContact O-N 3.22Å; L1070-C1073 WeakPolarHBondContact O-CB 3.32Å; L1070-C1073 PolarHBondContact O-N 3.01Å; L1070-T1074 HydrophobicContact CD1-CG2 4.21Å; L1070-T1074 WeakPolarHBondContact O-CG2 3.39Å; L1070-T1074 PolarHBondContact O-N 3.05Å; L1070-T1074 PolarHBondContact O-OG1 3.44Å; L1070-F1109 HydrophobicContact CD1-CZ 4.16Å; L1070-L1117 HydrophobicContact CD1-CD1 4.22Å; L1070-A1127 HydrophobicContact CD2-CB 3.94Å
1071V90.5Very high83.3Confident11 Ų1136 Ų367%0.06720%0.198CC..Hα-helixtrans-58-47.5178.2171.30000110.2T991 I1067 S1068 C1073 T1074 A1075 E1126T991-V1071 HydrophobicContact CG2-CG1 3.62Å; I1067-V1071 HydrophobicContact CG2-CG2 4.25Å; I1067-V1071 WeakPolarHBondContact O-CG2 3.13Å; I1067-V1071 PolarHBondContact O-N 3.48Å; S1068-V1071 PolarHBondContact O-N 3.33Å; V1071-C1073 PolarHBondContact O-N 3.48Å; V1071-T1074 PolarHBondContact O-N 3.43Å; V1071-T1074 PolarHBondContact O-OG1 2.83Å; V1071-A1075 PolarHBondContact O-N 2.83Å; V1071-E1126 HydrophobicContact CG2-CG 4.15Å
1072N90.9Very high85.5Confident16 Ų1637.6 Ų37.69%0.08620%0.201CC..Hα-helixtrans-63.3-42.6176.6-69.5-14.2000112.4W986 P987 S1068 L1070 T1074 A1075 V1076W986-N1072 HydrophobicContact CB-CB 4.02Å; W986-N1072 PolarHBondContact O-ND2 3.4Å; P987-N1072 WeakPolarHBondContact CA-ND2 3.47Å; S1068-N1072 VanDerWaalsContact O-CB 3.25Å; S1068-N1072 WeakPolarHBondContact O-CB 3.05Å; S1068-N1072 PolarHBondContact O-N 2.88Å; S1068-N1072 PolarHBondContact O-ND2 3.28Å; L1070-N1072 VanDerWaalsContact C-N 3.33Å; L1070-N1072 PolarHBondContact O-N 3.22Å; N1072-T1074 PolarHBondContact O-N 2.96Å; N1072-A1075 WeakPolarHBondContact O-CB 3.47Å; N1072-A1075 PolarHBondContact O-N 2.59Å; N1072-V1076 WeakPolarHBondContact O-CG2 3.4Å; N1072-V1076 PolarHBondContact O-N 2.96Å
1073C92.2Very high87.3Confident0 Ų028.9 Ų28.90%016%0.16CC..Hα-helixtrans-60.5-44.3176.1-177.70000111.7I1048 M1069 L1070 V1071 V1076 L1077I1048-C1073 HydrophobicContact CD1-CB 3.95Å; I1048-C1073 HydrophobicContact CG2-CB 4.46Å; M1069-C1073 WeakPolarHBondContact O-CB 3.16Å; M1069-C1073 PolarHBondContact O-N 3.01Å; L1070-C1073 WeakPolarHBondContact O-CB 3.32Å; L1070-C1073 PolarHBondContact O-N 3.01Å; V1071-C1073 PolarHBondContact O-N 3.48Å; C1073-V1076 PolarHBondContact O-N 3.49Å; C1073-L1077 WeakPolarHBondContact O-CG 3.46Å; C1073-L1077 PolarHBondContact O-N 2.91Å
1074T92.3Very high88.7Confident2 Ų224.6 Ų24.61%0.01214%0.137CC..Hα-helixtrans-66-36.7175.960.30000112.1L1070 V1071 N1072 V1076 L1077 R1078 F1109 S1130 L1131 L1134L1070-T1074 HydrophobicContact CD1-CG2 4.21Å; L1070-T1074 WeakPolarHBondContact O-CG2 3.39Å; L1070-T1074 PolarHBondContact O-N 3.05Å; L1070-T1074 PolarHBondContact O-OG1 3.44Å; V1071-T1074 PolarHBondContact O-N 3.43Å; V1071-T1074 PolarHBondContact O-OG1 2.83Å; N1072-T1074 PolarHBondContact O-N 2.96Å; T1074-V1076 PolarHBondContact O-N 3.49Å; T1074-L1077 PolarHBondContact O-N 3.27Å; T1074-R1078 WeakPolarHBondContact O-CB 3.47Å; T1074-R1078 WeakPolarHBondContact O-CG 3.46Å; T1074-R1078 PolarHBondContact O-N 3.32Å; T1074-F1109 HydrophobicContact CG2-CE1 4.18Å; T1074-F1109 HydrophobicContact CG2-CZ 4.14Å; T1074-S1130 VanDerWaalsContact OG1-CB 3.27Å; T1074-S1130 WeakPolarHBondContact OG1-CB 3.46Å; T1074-S1130 PolarHBondContact OG1-OG 3.32Å; T1074-L1131 HydrophobicContact CG2-CD2 3.75Å; T1074-L1131 HydrophobicContact CG2-CG 4.41Å; T1074-L1134 HydrophobicContact CG2-CD2 4.44Å
1075A93Very high89Confident2 Ų220.9 Ų20.92%0.01711%0.113CC..Hα-helixtrans-60.9-41.7173.700000112.1T991 L994 I995 V1071 N1072 R1078 G1079T991-A1075 HydrophobicContact CG2-CB 4.11Å; L994-A1075 HydrophobicContact CD2-CB 4.25Å; I995-A1075 HydrophobicContact CD1-CB 4.49Å; I995-A1075 HydrophobicContact CG1-CB 4.05Å; I995-A1075 WeakPolarHBondContact CG1-O 3.5Å; V1071-A1075 PolarHBondContact O-N 2.83Å; N1072-A1075 WeakPolarHBondContact O-CB 3.47Å; N1072-A1075 PolarHBondContact O-N 2.59Å; A1075-R1078 WeakPolarHBondContact O-CB 3.23Å; A1075-R1078 PolarHBondContact O-N 3.07Å; A1075-G1079 PolarHBondContact O-N 3.05Å
1076V94.3Very high89Confident1 Ų117.7 Ų17.71%0.0069%0.094CC..Hα-helixtrans-62.7-44.8173.7175.20000111.2W986 L994 V998 I1041 N1072 C1073 T1074 R1078 G1079 V1080W986-V1076 HydrophobicContact CD2-CG2 3.74Å; W986-V1076 HydrophobicContact CE3-CG2 4.1Å; W986-V1076 HydrophobicContact CG-CG2 4.22Å; W986-V1076 HydrophobicContact CH2-CG1 4.44Å; W986-V1076 HydrophobicContact CH2-CG2 4.15Å; W986-V1076 HydrophobicContact CZ2-CB 4.41Å; W986-V1076 HydrophobicContact CZ2-CG1 4.13Å; W986-V1076 HydrophobicContact CZ2-CG2 3.78Å; W986-V1076 HydrophobicContact CZ3-CG2 4.29Å; L994-V1076 HydrophobicContact CD1-CG2 4.47Å; L994-V1076 HydrophobicContact CD2-CG2 3.71Å; L994-V1076 HydrophobicContact CG-CG2 4.11Å; V998-V1076 HydrophobicContact CG1-CG1 4.3Å; V998-V1076 HydrophobicContact CG2-CG1 4.22Å; V998-V1076 HydrophobicContact CG2-CG2 4.3Å; I1041-V1076 HydrophobicContact CD1-CG1 4.44Å; I1041-V1076 HydrophobicContact CG2-CG1 3.95Å; N1072-V1076 WeakPolarHBondContact O-CG2 3.4Å; N1072-V1076 PolarHBondContact O-N 2.96Å; C1073-V1076 PolarHBondContact O-N 3.49Å; T1074-V1076 PolarHBondContact O-N 3.49Å; V1076-R1078 VanDerWaalsContact C-N 3.3Å; V1076-R1078 PolarHBondContact O-N 3.01Å; V1076-G1079 PolarHBondContact O-N 2.97Å; V1076-V1080 VanDerWaalsContact O-CG2 3.26Å; V1076-V1080 WeakPolarHBondContact O-CG2 3.4Å; V1076-V1080 PolarHBondContact O-N 3.11Å
1077L94.8Very high89.1Confident0 Ų016.2 Ų16.20%09%0.085CC..Hα-helixtrans-65.3-33.1177.6-68.2175.3000112.7V1045 C1073 T1074 V1080 A1081 L1105 L1106 F1109 L1134V1045-L1077 HydrophobicContact CG2-CD2 4.07Å; V1045-L1077 HydrophobicContact CG2-CG 4.41Å; C1073-L1077 WeakPolarHBondContact O-CG 3.46Å; C1073-L1077 PolarHBondContact O-N 2.91Å; T1074-L1077 PolarHBondContact O-N 3.27Å; L1077-V1080 PolarHBondContact O-N 3.28Å; L1077-A1081 PolarHBondContact O-N 3.12Å; L1077-L1105 HydrophobicContact CD2-CD1 4.42Å; L1077-L1105 HydrophobicContact CD2-CD2 3.57Å; L1077-L1105 HydrophobicContact CD2-CG 3.79Å; L1077-L1106 HydrophobicContact CB-CD2 4.31Å; L1077-L1106 HydrophobicContact CD2-CD2 4.24Å; L1077-F1109 HydrophobicContact CD1-CB 4.19Å; L1077-F1109 HydrophobicContact CD1-CD1 3.46Å; L1077-F1109 VanDerWaalsContact CD1-CD1 3.46Å; L1077-F1109 HydrophobicContact CD1-CD2 3.65Å; L1077-F1109 HydrophobicContact CD1-CE1 3.63Å; L1077-F1109 HydrophobicContact CD1-CE2 3.82Å; L1077-F1109 HydrophobicContact CD1-CG 3.48Å; L1077-F1109 VanDerWaalsContact CD1-CG 3.48Å; L1077-F1109 HydrophobicContact CD1-CZ 3.8Å; L1077-L1134 HydrophobicContact CB-CD1 3.64Å; L1077-L1134 HydrophobicContact CB-CD2 4.17Å; L1077-L1134 HydrophobicContact CD1-CD2 4.12Å
1078R94.4Very high88.8Confident36 Ų3615.4 Ų15.414%0.1368%0.082CC..Hα-helixtrans-62.9-46.2171.4-74.917270.7-163.5-2.7110.8I995 T1074 A1075 V1076 V1080 A1081 R1082 L1134 D1137I995-R1078 HydrophobicContact CD1-CB 4.31Å; I995-R1078 VanDerWaalsContact CD1-CZ 3.45Å; I995-R1078 HydrophobicContact CG1-CB 4.07Å; I995-R1078 HydrophobicContact CG2-CB 4.43Å; T1074-R1078 WeakPolarHBondContact O-CB 3.47Å; T1074-R1078 WeakPolarHBondContact O-CG 3.46Å; T1074-R1078 PolarHBondContact O-N 3.32Å; A1075-R1078 WeakPolarHBondContact O-CB 3.23Å; A1075-R1078 PolarHBondContact O-N 3.07Å; V1076-R1078 VanDerWaalsContact C-N 3.3Å; V1076-R1078 PolarHBondContact O-N 3.01Å; R1078-V1080 VanDerWaalsContact C-N 3.31Å; R1078-V1080 PolarHBondContact O-N 3.26Å; R1078-A1081 PolarHBondContact O-N 3.41Å; R1078-R1082 WeakPolarHBondContact O-CG 3.49Å; R1078-R1082 PolarHBondContact O-N 3.33Å; R1078-L1134 HydrophobicContact CB-CD1 4.5Å; R1078-L1134 HydrophobicContact CG-CB 3.97Å; R1078-L1134 HydrophobicContact CG-CD1 3.79Å; R1078-D1137 HydrophobicContact CG-CB 4.45Å; R1078-D1137 WeakPolarHBondContact CG-OD2 3.4Å; R1078-D1137 IonicContact CZ-OD2 3.3Å; R1078-D1137 IonicContact NE-OD2 3.54Å; R1078-D1137 PolarHBondContact NE-OD2 3.44Å; R1078-D1137 IonicContact NH2-OD2 3.59Å; R1078-D1137 PolarHBondContact NH2-OD2 3.06Å; R1078-D1137 VanDerWaalsContact NH2-OD2 3.09Å
1079G91.5Very high87.9Confident0 Ų015.7 Ų15.70%08%0.084CC..Hα-helixtrans-59.3-39.917300000112.9I995 A1075 V1076 R1082 A1083I995-G1079 VanDerWaalsContact O-CA 3.32Å; I995-G1079 WeakPolarHBondContact O-CA 3.42Å; A1075-G1079 PolarHBondContact O-N 3.05Å; V1076-G1079 PolarHBondContact O-N 2.97Å; G1079-R1082 PolarHBondContact O-N 3.43Å; G1079-A1083 WeakPolarHBondContact O-CB 3.45Å; G1079-A1083 PolarHBondContact O-N 3.4Å
1080V94Very high86.9Confident3 Ų315 Ų152%0.0188%0.082CC..Hα-helixtrans-63.5-45174.1175.90000111.4V998 L1002 I1041 V1076 L1077 R1078 R1082 A1083 I1084 V1101 L1105V998-V1080 HydrophobicContact CG1-CG2 4.02Å; L1002-V1080 HydrophobicContact CD1-CB 4.1Å; L1002-V1080 HydrophobicContact CD1-CG1 4.26Å; L1002-V1080 HydrophobicContact CD1-CG2 3.69Å; I1041-V1080 HydrophobicContact CD1-CG2 4.26Å; V1076-V1080 VanDerWaalsContact O-CG2 3.26Å; V1076-V1080 WeakPolarHBondContact O-CG2 3.4Å; V1076-V1080 PolarHBondContact O-N 3.11Å; L1077-V1080 PolarHBondContact O-N 3.28Å; R1078-V1080 VanDerWaalsContact C-N 3.31Å; R1078-V1080 PolarHBondContact O-N 3.26Å; V1080-R1082 PolarHBondContact O-N 3.35Å; V1080-A1083 WeakPolarHBondContact O-CB 3.4Å; V1080-A1083 PolarHBondContact O-N 2.96Å; V1080-I1084 HydrophobicContact CG1-CD1 4.14Å; V1080-I1084 VanDerWaalsContact O-CG1 3.29Å; V1080-I1084 WeakPolarHBondContact O-CG1 3.47Å; V1080-I1084 PolarHBondContact O-N 3.15Å; V1080-V1101 HydrophobicContact CG1-CG1 3.7Å; V1080-L1105 HydrophobicContact CB-CD2 4.41Å; V1080-L1105 HydrophobicContact CG1-CD2 3.83Å; V1080-L1105 HydrophobicContact CG2-CD2 4.21Å
1081A92Very high85.7Confident0 Ų016 Ų160%09%0.089CC..Hα-helixtrans-61.6-43178.700000112L1077 R1078 I1084 G1085 L1106 V1138 S1141 C1142L1077-A1081 PolarHBondContact O-N 3.12Å; R1078-A1081 PolarHBondContact O-N 3.41Å; A1081-I1084 PolarHBondContact O-N 3.37Å; A1081-G1085 PolarHBondContact O-N 2.88Å; A1081-G1085 VanDerWaalsContact O-N 3.15Å; A1081-L1106 HydrophobicContact CB-CD1 4.36Å; A1081-V1138 HydrophobicContact CB-CG2 3.72Å; A1081-S1141 VanDerWaalsContact O-CB 3.26Å; A1081-S1141 WeakPolarHBondContact O-CB 3.43Å; A1081-C1142 PolarHBondContact O-SG 3.03Å
1082R90.6Very high84.3Confident77 Ų7722.7 Ų22.729%0.29113%0.125SC..Hα-helixtrans-63.8-43.8175-68.4-178.8-177.7-170.3-3112E999 R1078 G1079 V1080 I1084 G1085 S1086 D1137E999-R1082 HydrophobicContact CG-CB 4.26Å; R1078-R1082 WeakPolarHBondContact O-CG 3.49Å; R1078-R1082 PolarHBondContact O-N 3.33Å; G1079-R1082 PolarHBondContact O-N 3.43Å; V1080-R1082 PolarHBondContact O-N 3.35Å; R1082-I1084 VanDerWaalsContact C-N 3.32Å; R1082-I1084 PolarHBondContact O-N 3.46Å; R1082-G1085 PolarHBondContact O-N 3.34Å; R1082-G1085 VanDerWaalsContact O-N 3.16Å; R1082-S1086 WeakPolarHBondContact O-CB 3.32Å; R1082-S1086 PolarHBondContact O-N 3.19Å; R1082-D1137 IonicContact CZ-OD1 3.64Å; R1082-D1137 IonicContact CZ-OD2 3.67Å; R1082-D1137 IonicContact NE-OD1 2.83Å; R1082-D1137 PolarHBondContact NE-OD1 3.32Å; R1082-D1137 IonicContact NE-OD2 3.69Å; R1082-D1137 PolarHBondContact NE-OD2 3.49Å; R1082-D1137 IonicContact NH2-OD1 3.55Å; R1082-D1137 PolarHBondContact NH2-OD1 3.12Å; R1082-D1137 IonicContact NH2-OD2 3.46Å; R1082-D1137 PolarHBondContact NH2-OD2 3.35Å
1083A88.9Confident82.9Confident1 Ų124.2 Ų24.21%0.00814%0.137CC..Hα-helixtrans-57.1-44.2175.100000112.3E999 L1002 G1079 V1080 G1085 S1086 I1087E999-A1083 HydrophobicContact CG-CB 4.28Å; L1002-A1083 HydrophobicContact CB-CB 3.76Å; L1002-A1083 HydrophobicContact CD1-CB 3.91Å; L1002-A1083 HydrophobicContact CG-CB 4.5Å; G1079-A1083 WeakPolarHBondContact O-CB 3.45Å; G1079-A1083 PolarHBondContact O-N 3.4Å; V1080-A1083 WeakPolarHBondContact O-CB 3.4Å; V1080-A1083 PolarHBondContact O-N 2.96Å; A1083-G1085 PolarHBondContact O-N 2.99Å; A1083-S1086 WeakPolarHBondContact O-CB 3.4Å; A1083-S1086 PolarHBondContact O-N 3.1Å; A1083-I1087 HydrophobicContact CB-CD1 4.42Å; A1083-I1087 WeakPolarHBondContact O-CB 3.26Å; A1083-I1087 WeakPolarHBondContact O-CD1 3.37Å; A1083-I1087 WeakPolarHBondContact O-CG1 3.28Å; A1083-I1087 PolarHBondContact O-N 3.23Å
1084I86.7Confident81.8Confident4 Ų424.4 Ų24.42%0.02114%0.138CC..Hα-helixtrans-62.1-45.3178-65.8166.1000110.7V1080 A1081 R1082 S1086 I1087 A1088 V1098 V1101 L1106V1080-I1084 HydrophobicContact CG1-CD1 4.14Å; V1080-I1084 VanDerWaalsContact O-CG1 3.29Å; V1080-I1084 WeakPolarHBondContact O-CG1 3.47Å; V1080-I1084 PolarHBondContact O-N 3.15Å; A1081-I1084 PolarHBondContact O-N 3.37Å; R1082-I1084 VanDerWaalsContact C-N 3.32Å; R1082-I1084 PolarHBondContact O-N 3.46Å; I1084-S1086 VanDerWaalsContact C-N 3.26Å; I1084-S1086 PolarHBondContact O-N 3.13Å; I1084-I1087 PolarHBondContact O-N 3.22Å; I1084-A1088 WeakPolarHBondContact O-CB 3.48Å; I1084-A1088 PolarHBondContact O-N 3.18Å; I1084-V1098 HydrophobicContact CG2-CB 4.26Å; I1084-V1098 HydrophobicContact CG2-CG1 3.98Å; I1084-V1098 HydrophobicContact CG2-CG2 3.66Å; I1084-V1101 HydrophobicContact CD1-CB 3.77Å; I1084-V1101 HydrophobicContact CD1-CG1 3.37Å; I1084-V1101 HydrophobicContact CD1-CG2 4.45Å; I1084-V1101 HydrophobicContact CG1-CB 4.47Å; I1084-V1101 HydrophobicContact CG1-CG1 4.28Å; I1084-L1106 HydrophobicContact CD1-CD1 3.58Å
1085G80Confident80.7Confident12 Ų1227.1 Ų27.112%0.12415%0.154CC..Hα-helixtrans-59-40.6177.800000112.5A1081 R1082 A1083 S1141 Y1145A1081-G1085 PolarHBondContact O-N 2.88Å; A1081-G1085 VanDerWaalsContact O-N 3.15Å; R1082-G1085 PolarHBondContact O-N 3.34Å; R1082-G1085 VanDerWaalsContact O-N 3.16Å; A1083-G1085 PolarHBondContact O-N 2.99Å; G1085-S1141 WeakPolarHBondContact CA-O 3.31Å; G1085-Y1145 PolarHBondContact O-OH 3.01Å
1086S79.3Confident79.7Confident12 Ų1229.5 Ų29.58%0.08417%0.167CC..Hα-helixtrans-68.6-39.5175.7-1760000113.2M753 M955 R1082 A1083 I1084 S1089 N1090M753-S1086 WeakPolarHBondContact CG-OG 3.27Å; M955-S1086 WeakPolarHBondContact CE-OG 3.47Å; R1082-S1086 WeakPolarHBondContact O-CB 3.32Å; R1082-S1086 PolarHBondContact O-N 3.19Å; A1083-S1086 WeakPolarHBondContact O-CB 3.4Å; A1083-S1086 PolarHBondContact O-N 3.1Å; I1084-S1086 VanDerWaalsContact C-N 3.26Å; I1084-S1086 PolarHBondContact O-N 3.13Å; S1086-S1089 PolarHBondContact O-OG 3.37Å; S1086-N1090 PolarHBondContact O-ND2 2.91Å
1087I81.6Confident79.1Confident4 Ų429.9 Ų29.92%0.02117%0.169CC..Hα-helixtrans-73.8-39.1179.1-70.9163.4000111.4W1006 A1083 I1084 S1089 N1090 L1097W1006-I1087 HydrophobicContact CB-CD1 3.85Å; W1006-I1087 HydrophobicContact CB-CG1 4.1Å; W1006-I1087 HydrophobicContact CD2-CG2 3.56Å; W1006-I1087 VanDerWaalsContact CE2-CG2 3.48Å; W1006-I1087 HydrophobicContact CE3-CG2 4.13Å; W1006-I1087 HydrophobicContact CG-CD1 4.16Å; W1006-I1087 HydrophobicContact CG-CG1 4.01Å; W1006-I1087 HydrophobicContact CG-CG2 3.77Å; W1006-I1087 HydrophobicContact CH2-CG2 4.45Å; W1006-I1087 HydrophobicContact CZ2-CG2 3.96Å; A1083-I1087 HydrophobicContact CB-CD1 4.42Å; A1083-I1087 WeakPolarHBondContact O-CB 3.26Å; A1083-I1087 WeakPolarHBondContact O-CD1 3.37Å; A1083-I1087 WeakPolarHBondContact O-CG1 3.28Å; A1083-I1087 PolarHBondContact O-N 3.23Å; I1084-I1087 PolarHBondContact O-N 3.22Å; I1087-S1089 VanDerWaalsContact C-N 3.35Å; I1087-S1089 PolarHBondContact O-N 2.81Å; I1087-N1090 WeakPolarHBondContact O-CB 3.42Å; I1087-N1090 PolarHBondContact O-N 3.46Å; I1087-N1090 VanDerWaalsContact O-N 3.16Å; I1087-L1097 HydrophobicContact CG2-CD2 4.44Å
1088A75.6Confident78.4Confident9 Ų930.1 Ų30.17%0.07417%0.17CC..Hα-helixtrans-69.8-31.1-172.400000113.2I1084 N1090 S1094 V1098 Y1145I1084-A1088 WeakPolarHBondContact O-CB 3.48Å; I1084-A1088 PolarHBondContact O-N 3.18Å; A1088-N1090 PolarHBondContact O-N 3.35Å; A1088-S1094 WeakPolarHBondContact CA-OG 3.34Å; A1088-S1094 PolarHBondContact O-OG 3.24Å; A1088-V1098 HydrophobicContact CB-CG2 4.04Å; A1088-Y1145 HydrophobicContact CB-CD1 3.6Å; A1088-Y1145 HydrophobicContact CB-CD2 3.81Å; A1088-Y1145 HydrophobicContact CB-CE1 3.48Å; A1088-Y1145 VanDerWaalsContact CB-CE1 3.48Å; A1088-Y1145 HydrophobicContact CB-CE2 3.7Å; A1088-Y1145 HydrophobicContact CB-CG 3.75Å
1089S68.2Low77.7Confident55 Ų5530 Ų3039%0.38518%0.175SC..THydrogen-bonded Turntrans-63.5-21.7173.764.80000113.2S1086 I1087 Y1145S1086-S1089 PolarHBondContact O-OG 3.37Å; I1087-S1089 VanDerWaalsContact C-N 3.35Å; I1087-S1089 PolarHBondContact O-N 2.81Å; S1089-Y1145 PolarHBondContact N-OH 3.37Å
1090N65.7Low77.3Confident68 Ų6833 Ų3336%0.36419%0.191SC..THydrogen-bonded Turntrans-95.6-12.7-168-77.5-49.9000115.9M753 M955 K1010 S1086 I1087 A1088M753-N1090 PolarHBondContact SD-ND2 3.24Å; M955-N1090 WeakPolarHBondContact CE-ND2 3.43Å; K1010-N1090 PolarHBondContact NZ-O 3.16Å; S1086-N1090 PolarHBondContact O-ND2 2.91Å; I1087-N1090 WeakPolarHBondContact O-CB 3.42Å; I1087-N1090 PolarHBondContact O-N 3.46Å; I1087-N1090 VanDerWaalsContact O-N 3.16Å; A1088-N1090 PolarHBondContact O-N 3.35Å
1091S64.1Low76.9Confident22 Ų2233 Ų3315%0.15419%0.191CC..  trans-169146.617857.40000114.5W1006 S1093 S1094W1006-S1091 WeakPolarHBondContact CZ2-OG 3.49Å; S1091-S1093 PolarHBondContact O-N 3.22Å; S1091-S1093 PolarHBondContact OG-OG 3.16Å; S1091-S1094 WeakPolarHBondContact O-CB 3.4Å; S1091-S1094 PolarHBondContact O-N 2.83Å; S1091-S1094 VanDerWaalsContact O-N 3.11Å; S1091-S1094 PolarHBondContact O-OG 3.42Å
1092N61Low76.7Confident153 Ų15333.2 Ų33.282%0.81819%0.191SC*.THydrogen-bonded Turntrans-64.9-24.7175.8-65.4-10.9000113.8S1094 T1095N1092-S1094 PolarHBondContact O-N 3.34Å; N1092-T1095 PolarHBondContact O-OG1 3.49Å
1093S60.5Low76.4Confident48 Ų4831.7 Ų31.734%0.33619%0.189SC..THydrogen-bonded Turntrans-71-8.617554.50000113.6S1091 T1095S1091-S1093 PolarHBondContact O-N 3.22Å; S1091-S1093 PolarHBondContact OG-OG 3.16Å; S1093-T1095 PolarHBondContact O-N 3.16Å
1094S69.6Low76.1Confident4 Ų432.5 Ų32.53%0.02820%0.198CC..Hα-helixtrans-67.6-21.6175.764.60000113.2A1088 S1091 N1092 D1096 L1097 V1098A1088-S1094 WeakPolarHBondContact CA-OG 3.34Å; A1088-S1094 PolarHBondContact O-OG 3.24Å; S1091-S1094 WeakPolarHBondContact O-CB 3.4Å; S1091-S1094 PolarHBondContact O-N 2.83Å; S1091-S1094 VanDerWaalsContact O-N 3.11Å; S1091-S1094 PolarHBondContact O-OG 3.42Å; N1092-S1094 PolarHBondContact O-N 3.34Å; S1094-D1096 VanDerWaalsContact C-N 3.32Å; S1094-D1096 PolarHBondContact O-N 2.95Å; S1094-L1097 CarbonylContact O-C 3.51Å; S1094-L1097 WeakPolarHBondContact O-CB 3.42Å; S1094-L1097 PolarHBondContact O-N 2.83Å; S1094-V1098 WeakPolarHBondContact O-CG2 3.27Å; S1094-V1098 PolarHBondContact O-N 3.21Å
1095T69.8Low76.2Confident58 Ų5832.7 Ų32.736%0.35620%0.199SC..Hα-helixtrans-56.9-43.1-177.448.70000112.5N1092 S1093 L1097 V1098 S1099N1092-T1095 PolarHBondContact O-OG1 3.49Å; S1093-T1095 PolarHBondContact O-N 3.16Å; T1095-L1097 VanDerWaalsContact C-N 3.34Å; T1095-L1097 PolarHBondContact O-N 3.08Å; T1095-V1098 PolarHBondContact O-N 3.25Å; T1095-S1099 WeakPolarHBondContact O-CB 3.41Å; T1095-S1099 PolarHBondContact O-N 3.1Å
1096D72Confident76.8Confident53 Ų5332.2 Ų32.228%0.28319%0.193SC..Hα-helixtrans-64-39.5176.7-68.2-27.7000111.8L1018 S1094 S1099 L1100L1018-D1096 HydrophobicContact CD1-CB 3.82Å; S1094-D1096 VanDerWaalsContact C-N 3.32Å; S1094-D1096 PolarHBondContact O-N 2.95Å; D1096-S1099 WeakPolarHBondContact O-CB 3.38Å; D1096-S1099 PolarHBondContact O-N 3.43Å; D1096-S1099 PolarHBondContact O-OG 2.93Å; D1096-L1100 WeakPolarHBondContact O-CB 3.42Å; D1096-L1100 PolarHBondContact O-N 3.24Å
1097L79.7Confident77.2Confident9 Ų931.6 Ų31.65%0.04719%0.189CC..Hα-helixtrans-68.4-44.6176.4-179133.7000111.8W1006 L1034 I1038 I1087 S1094 T1095 S1099 L1100 V1101W1006-L1097 HydrophobicContact CE3-CD1 3.63Å; W1006-L1097 HydrophobicContact CZ3-CB 4.05Å; W1006-L1097 HydrophobicContact CZ3-CD1 3.58Å; W1006-L1097 HydrophobicContact CZ3-CG 4.33Å; L1034-L1097 HydrophobicContact CD2-CD1 3.25Å; L1034-L1097 HydrophobicContact CG-CD1 4.17Å; I1038-L1097 HydrophobicContact CD1-CD1 4.42Å; I1087-L1097 HydrophobicContact CG2-CD2 4.44Å; S1094-L1097 CarbonylContact O-C 3.51Å; S1094-L1097 WeakPolarHBondContact O-CB 3.42Å; S1094-L1097 PolarHBondContact O-N 2.83Å; T1095-L1097 VanDerWaalsContact C-N 3.34Å; T1095-L1097 PolarHBondContact O-N 3.08Å; L1097-S1099 PolarHBondContact O-N 3.07Å; L1097-L1100 PolarHBondContact O-N 3.33Å; L1097-V1101 HydrophobicContact CD2-CG2 4.22Å; L1097-V1101 HydrophobicContact CG-CG2 4.3Å; L1097-V1101 WeakPolarHBondContact O-CG2 3.33Å; L1097-V1101 PolarHBondContact O-N 3.46Å
1098V81.3Confident77.6Confident4 Ų434.1 Ų34.12%0.02421%0.206CC..Hα-helixtrans-57.8-40.8173.5-175.80000109.1I1084 A1088 S1094 T1095 L1100 W1102 L1149I1084-V1098 HydrophobicContact CG2-CB 4.26Å; I1084-V1098 HydrophobicContact CG2-CG1 3.98Å; I1084-V1098 HydrophobicContact CG2-CG2 3.66Å; A1088-V1098 HydrophobicContact CB-CG2 4.04Å; S1094-V1098 WeakPolarHBondContact O-CG2 3.27Å; S1094-V1098 PolarHBondContact O-N 3.21Å; T1095-V1098 PolarHBondContact O-N 3.25Å; V1098-L1100 PolarHBondContact O-N 3.15Å; V1098-W1102 WeakPolarHBondContact O-CB 3.27Å; V1098-W1102 PolarHBondContact O-N 3.38Å; V1098-L1149 HydrophobicContact CB-CD1 3.94Å; V1098-L1149 HydrophobicContact CG1-CD1 3.44Å; V1098-L1149 VanDerWaalsContact CG1-CD1 3.44Å
1099S80.5Confident78.3Confident34 Ų3434 Ų3424%0.23820%0.203CC..Hα-helixtrans-59.7-44.8174.3101.60000112.4T1095 D1096 L1097 N1103T1095-S1099 WeakPolarHBondContact O-CB 3.41Å; T1095-S1099 PolarHBondContact O-N 3.1Å; D1096-S1099 WeakPolarHBondContact O-CB 3.38Å; D1096-S1099 PolarHBondContact O-N 3.43Å; D1096-S1099 PolarHBondContact O-OG 2.93Å; L1097-S1099 PolarHBondContact O-N 3.07Å; S1099-N1103 WeakPolarHBondContact O-CB 3.49Å; S1099-N1103 VanDerWaalsContact O-CG 3.24Å; S1099-N1103 PolarHBondContact O-N 3.47Å; S1099-N1103 PolarHBondContact O-ND2 3.02Å
1100L82.5Confident79.5Confident63 Ų6331.3 Ų31.333%0.3319%0.185SC..Hα-helixtrans-69.5-44.5-175-173.6146.7000110.6L1018 L1035 I1038 D1096 L1097 V1098 G1104L1018-L1100 HydrophobicContact CD2-CD1 4.09Å; L1035-L1100 HydrophobicContact CD2-CD1 3.87Å; L1035-L1100 HydrophobicContact CD2-CD2 4.12Å; I1038-L1100 HydrophobicContact CG2-CD2 4.17Å; D1096-L1100 WeakPolarHBondContact O-CB 3.42Å; D1096-L1100 PolarHBondContact O-N 3.24Å; L1097-L1100 PolarHBondContact O-N 3.33Å; V1098-L1100 PolarHBondContact O-N 3.15Å; L1100-G1104 WeakPolarHBondContact O-CA 3.49Å; L1100-G1104 PolarHBondContact O-N 3.13Å
1101V85.6Confident80.7Confident3 Ų329.8 Ų29.82%0.01818%0.18CC..Hα-helixtrans-72.2-39.3178.6-176.30000111.2I1038 V1080 I1084 L1097 L1105 L1106I1038-V1101 HydrophobicContact CD1-CG2 3.7Å; I1038-V1101 HydrophobicContact CG1-CG2 4.35Å; I1038-V1101 HydrophobicContact CG2-CG2 4.32Å; V1080-V1101 HydrophobicContact CG1-CG1 3.7Å; I1084-V1101 HydrophobicContact CD1-CB 3.77Å; I1084-V1101 HydrophobicContact CD1-CG1 3.37Å; I1084-V1101 HydrophobicContact CD1-CG2 4.45Å; I1084-V1101 HydrophobicContact CG1-CB 4.47Å; I1084-V1101 HydrophobicContact CG1-CG1 4.28Å; L1097-V1101 HydrophobicContact CD2-CG2 4.22Å; L1097-V1101 HydrophobicContact CG-CG2 4.3Å; L1097-V1101 WeakPolarHBondContact O-CG2 3.33Å; L1097-V1101 PolarHBondContact O-N 3.46Å; V1101-L1105 HydrophobicContact CG1-CB 4.2Å; V1101-L1105 HydrophobicContact CG1-CD2 4.19Å; V1101-L1105 WeakPolarHBondContact O-CA 3.36Å; V1101-L1105 VanDerWaalsContact O-CB 3.3Å; V1101-L1105 WeakPolarHBondContact O-CB 3.42Å; V1101-L1105 PolarHBondContact O-N 3.1Å; V1101-L1106 HydrophobicContact CG1-CD1 4.32Å; V1101-L1106 HydrophobicContact CG1-CG 4.35Å; V1101-L1106 PolarHBondContact O-N 3.46Å
1102W88.1Confident81.9Confident5 Ų531.1 Ų31.12%0.01918%0.183CC..Iπ-helixtrans-62.5-53175.2-179.9-105.1000111.7V1098 L1106 G1107 P1108 L1110 V1138 L1146 F1192 W1195V1098-W1102 WeakPolarHBondContact O-CB 3.27Å; V1098-W1102 PolarHBondContact O-N 3.38Å; W1102-L1106 HydrophobicContact CE3-CB 3.98Å; W1102-L1106 HydrophobicContact CZ3-CB 4.3Å; W1102-G1107 VanDerWaalsContact O-CA 3.3Å; W1102-G1107 WeakPolarHBondContact O-CA 3.39Å; W1102-G1107 PolarHBondContact O-N 3.11Å; W1102-P1108 WeakPolarHBondContact O-CD 3.32Å; W1102-L1110 HydrophobicContact CH2-CD1 3.88Å; W1102-L1110 HydrophobicContact CZ3-CD1 3.7Å; W1102-V1138 HydrophobicContact CZ3-CG1 4.03Å; W1102-L1146 HydrophobicContact CB-CD2 4.28Å; W1102-L1146 HydrophobicContact CD2-CD1 4.35Å; W1102-L1146 HydrophobicContact CD2-CD2 3.45Å; W1102-L1146 VanDerWaalsContact CD2-CD2 3.45Å; W1102-L1146 HydrophobicContact CE3-CD1 4.02Å; W1102-L1146 HydrophobicContact CE3-CD2 3.63Å; W1102-L1146 HydrophobicContact CE3-CG 4.46Å; W1102-L1146 HydrophobicContact CG-CD2 3.75Å; W1102-L1146 HydrophobicContact CH2-CD1 3.65Å; W1102-L1146 HydrophobicContact CZ2-CD1 3.99Å; W1102-L1146 HydrophobicContact CZ2-CD2 4.37Å; W1102-L1146 HydrophobicContact CZ3-CD1 3.66Å; W1102-L1146 HydrophobicContact CZ3-CD2 4.17Å; W1102-F1192 HydrophobicContact CH2-CB 3.77Å; W1102-F1192 AromaticContact CH2-CD2 3.83Å; W1102-F1192 HydrophobicContact CH2-CD2 3.83Å; W1102-F1192 HydrophobicContact CH2-CG 4.14Å; W1102-F1192 HydrophobicContact CZ2-CB 4.09Å; W1102-F1192 HydrophobicContact CZ3-CD2 4.48Å; W1102-W1195 HydrophobicContact CH2-CE3 4.41Å; W1102-W1195 AromaticContact CH2-CZ3 3.86Å; W1102-W1195 HydrophobicContact CH2-CZ3 3.86Å; W1102-W1195 HydrophobicContact CZ2-CE3 4.37Å; W1102-W1195 HydrophobicContact CZ2-CH2 4.25Å; W1102-W1195 AromaticContact CZ2-CZ3 3.53Å; W1102-W1195 HydrophobicContact CZ2-CZ3 3.53Å
1103N84.6Confident83.3Confident44 Ų4423.8 Ų23.824%0.23514%0.144CC..Iπ-helixtrans-74.2-29.5-175.9-66.1-37.2000112.7S1099 P1108 S1152S1099-N1103 WeakPolarHBondContact O-CB 3.49Å; S1099-N1103 VanDerWaalsContact O-CG 3.24Å; S1099-N1103 PolarHBondContact O-N 3.47Å; S1099-N1103 PolarHBondContact O-ND2 3.02Å; N1103-P1108 VanDerWaalsContact O-CG 3.25Å; N1103-P1108 WeakPolarHBondContact O-CG 3.49Å; N1103-S1152 VanDerWaalsContact CG-OG 3.3Å; N1103-S1152 PolarHBondContact ND2-OG 3.42Å; N1103-S1152 PolarHBondContact OD1-OG 3.37Å
1104G82.2Confident84.7Confident19 Ų1921.5 Ų21.520%0.19613%0.128CC..Iπ-helixtrans-94.2-25.3-175.200000115.6R1042 L1100R1042-G1104 WeakPolarHBondContact CD-O 3.34Å; R1042-G1104 PolarHBondContact NE-O 3.2Å; L1100-G1104 WeakPolarHBondContact O-CA 3.49Å; L1100-G1104 PolarHBondContact O-N 3.13Å
1105L88.7Confident85.6Confident7 Ų724.7 Ų24.74%0.03715%0.145CC..Iπ-helixtrans-131.3-67.4-170.2-165.486.2000112.7I1041 R1042 V1045 L1077 V1080 V1101 F1109I1041-L1105 HydrophobicContact CG2-CD1 4.16Å; I1041-L1105 HydrophobicContact CG2-CD2 4.23Å; R1042-L1105 HydrophobicContact CB-CD1 3.57Å; R1042-L1105 HydrophobicContact CG-CD1 4.09Å; V1045-L1105 HydrophobicContact CG2-CD1 4.4Å; L1077-L1105 HydrophobicContact CD2-CD1 4.42Å; L1077-L1105 HydrophobicContact CD2-CD2 3.57Å; L1077-L1105 HydrophobicContact CD2-CG 3.79Å; V1080-L1105 HydrophobicContact CB-CD2 4.41Å; V1080-L1105 HydrophobicContact CG1-CD2 3.83Å; V1080-L1105 HydrophobicContact CG2-CD2 4.21Å; V1101-L1105 HydrophobicContact CG1-CB 4.2Å; V1101-L1105 HydrophobicContact CG1-CD2 4.19Å; V1101-L1105 WeakPolarHBondContact O-CA 3.36Å; V1101-L1105 VanDerWaalsContact O-CB 3.3Å; V1101-L1105 WeakPolarHBondContact O-CB 3.42Å; V1101-L1105 PolarHBondContact O-N 3.1Å; L1105-F1109 WeakPolarHBondContact O-CB 3.31Å; L1105-F1109 PolarHBondContact O-N 3.22Å
1106L91.2Very high86.4Confident2 Ų226.1 Ų26.11%0.0114%0.144CC..Iπ-helixtrans-71.5-50.6-170-71.2174.1000112.5L1077 A1081 I1084 V1101 W1102 F1109 L1110 V1138L1077-L1106 HydrophobicContact CB-CD2 4.31Å; L1077-L1106 HydrophobicContact CD2-CD2 4.24Å; A1081-L1106 HydrophobicContact CB-CD1 4.36Å; I1084-L1106 HydrophobicContact CD1-CD1 3.58Å; V1101-L1106 HydrophobicContact CG1-CD1 4.32Å; V1101-L1106 HydrophobicContact CG1-CG 4.35Å; V1101-L1106 PolarHBondContact O-N 3.46Å; W1102-L1106 HydrophobicContact CE3-CB 3.98Å; W1102-L1106 HydrophobicContact CZ3-CB 4.3Å; L1106-F1109 PolarHBondContact O-N 3.25Å; L1106-L1110 HydrophobicContact CB-CD1 4.4Å; L1106-L1110 WeakPolarHBondContact O-CB 3.39Å; L1106-L1110 WeakPolarHBondContact O-CG 3.27Å; L1106-L1110 PolarHBondContact O-N 2.92Å; L1106-V1138 HydrophobicContact CD2-CG2 4.48Å
1107G88.8Confident87.1Confident0 Ų023.6 Ų23.60%013%0.131CC..Hα-helixtrans-58.1-51-177.900000113.4W1102 F1109 L1110 S1111 W1195W1102-G1107 VanDerWaalsContact O-CA 3.3Å; W1102-G1107 WeakPolarHBondContact O-CA 3.39Å; W1102-G1107 PolarHBondContact O-N 3.11Å; G1107-F1109 VanDerWaalsContact C-N 3.34Å; G1107-F1109 PolarHBondContact O-N 3.12Å; G1107-L1110 PolarHBondContact O-N 3.14Å; G1107-S1111 VanDerWaalsContact O-CB 3.3Å; G1107-S1111 WeakPolarHBondContact O-CB 3.38Å; G1107-S1111 PolarHBondContact O-N 3.13Å; G1107-W1195 WeakPolarHBondContact O-CH2 3.31Å
1108P89.1Confident87.4Confident57 Ų5723.2 Ų23.237%0.3713%0.129SC..Hα-helixtrans-58.2-42.8175.3-25.534.1000113.2W1102 N1103 H1112W1102-P1108 WeakPolarHBondContact O-CD 3.32Å; N1103-P1108 VanDerWaalsContact O-CG 3.25Å; N1103-P1108 WeakPolarHBondContact O-CG 3.49Å; P1108-H1112 WeakPolarHBondContact O-CB 3.33Å; P1108-H1112 PolarHBondContact O-N 3.34Å
1109F92Very high87.6Confident5 Ų525.7 Ų25.72%0.02214%0.142CC..Hα-helixtrans-66.9-45.8179.1-171.2-85.9000111.9V1045 L1049 L1070 T1074 L1077 L1105 L1106 G1107 S1111 H1112 S1113 L1117 L1131 L1134V1045-F1109 HydrophobicContact CG1-CD2 3.64Å; V1045-F1109 HydrophobicContact CG1-CE2 4.13Å; L1049-F1109 HydrophobicContact CD1-CD2 3.48Å; L1049-F1109 VanDerWaalsContact CD1-CD2 3.48Å; L1049-F1109 HydrophobicContact CD1-CE2 3.9Å; L1070-F1109 HydrophobicContact CD1-CZ 4.16Å; T1074-F1109 HydrophobicContact CG2-CE1 4.18Å; T1074-F1109 HydrophobicContact CG2-CZ 4.14Å; L1077-F1109 HydrophobicContact CD1-CB 4.19Å; L1077-F1109 HydrophobicContact CD1-CD1 3.46Å; L1077-F1109 VanDerWaalsContact CD1-CD1 3.46Å; L1077-F1109 HydrophobicContact CD1-CD2 3.65Å; L1077-F1109 HydrophobicContact CD1-CE1 3.63Å; L1077-F1109 HydrophobicContact CD1-CE2 3.82Å; L1077-F1109 HydrophobicContact CD1-CG 3.48Å; L1077-F1109 VanDerWaalsContact CD1-CG 3.48Å; L1077-F1109 HydrophobicContact CD1-CZ 3.8Å; L1105-F1109 WeakPolarHBondContact O-CB 3.31Å; L1105-F1109 PolarHBondContact O-N 3.22Å; L1106-F1109 PolarHBondContact O-N 3.25Å; G1107-F1109 VanDerWaalsContact C-N 3.34Å; G1107-F1109 PolarHBondContact O-N 3.12Å; F1109-S1111 PolarHBondContact O-N 2.87Å; F1109-H1112 CarbonylContact O-C 3.58Å; F1109-H1112 PolarHBondContact O-N 2.83Å; F1109-S1113 WeakPolarHBondContact O-CB 3.45Å; F1109-S1113 PolarHBondContact O-N 3.04Å; F1109-S1113 PolarHBondContact O-OG 3.25Å; F1109-S1113 VanDerWaalsContact O-OG 3.14Å; F1109-L1117 HydrophobicContact CZ-CD1 4.17Å; F1109-L1131 HydrophobicContact CE1-CD2 4.02Å; F1109-L1131 HydrophobicContact CZ-CD2 4.43Å; F1109-L1134 HydrophobicContact CD1-CD2 3.73Å; F1109-L1134 HydrophobicContact CE1-CD2 3.64Å
1110L92.4Very high87.7Confident0 Ų026.2 Ų26.20%014%0.14CC..Hα-helixtrans-63.9-39.6178.3-69.1169000112W1102 L1106 G1107 S1113 A1114 L1134 F1135 V1138 F1192 W1195W1102-L1110 HydrophobicContact CH2-CD1 3.88Å; W1102-L1110 HydrophobicContact CZ3-CD1 3.7Å; L1106-L1110 HydrophobicContact CB-CD1 4.4Å; L1106-L1110 WeakPolarHBondContact O-CB 3.39Å; L1106-L1110 WeakPolarHBondContact O-CG 3.27Å; L1106-L1110 PolarHBondContact O-N 2.92Å; G1107-L1110 PolarHBondContact O-N 3.14Å; L1110-S1113 VanDerWaalsContact CA-OG 3.27Å; L1110-S1113 WeakPolarHBondContact CA-OG 3.41Å; L1110-S1113 PolarHBondContact O-N 2.87Å; L1110-S1113 PolarHBondContact O-OG 2.75Å; L1110-A1114 WeakPolarHBondContact O-CB 3.26Å; L1110-A1114 PolarHBondContact O-N 3.47Å; L1110-L1134 HydrophobicContact CD2-CD2 4.06Å; L1110-L1134 HydrophobicContact CD2-CG 4.12Å; L1110-F1135 HydrophobicContact CB-CE2 4.47Å; L1110-F1135 HydrophobicContact CB-CZ 4.01Å; L1110-F1135 HydrophobicContact CD2-CD1 4.29Å; L1110-F1135 HydrophobicContact CD2-CD2 3.6Å; L1110-F1135 HydrophobicContact CD2-CE1 4.1Å; L1110-F1135 HydrophobicContact CD2-CE2 3.38Å; L1110-F1135 HydrophobicContact CD2-CG 4.06Å; L1110-F1135 HydrophobicContact CD2-CZ 3.64Å; L1110-F1135 HydrophobicContact CG-CZ 4.41Å; L1110-V1138 HydrophobicContact CD1-CG1 4.06Å; L1110-V1138 HydrophobicContact CD1-CG2 4.23Å; L1110-F1192 HydrophobicContact CD1-CD2 4.13Å; L1110-F1192 HydrophobicContact CD1-CE2 4.19Å; L1110-W1195 HydrophobicContact CB-CE3 3.99Å; L1110-W1195 HydrophobicContact CB-CZ3 4.28Å
1111S91.3Very high87.5Confident36 Ų3623.7 Ų23.725%0.25213%0.127SC..Hα-helixtrans-61.2-46.7172.5-179.30000111.1G1107 F1109 N1115G1107-S1111 VanDerWaalsContact O-CB 3.3Å; G1107-S1111 WeakPolarHBondContact O-CB 3.38Å; G1107-S1111 PolarHBondContact O-N 3.13Å; F1109-S1111 PolarHBondContact O-N 2.87Å; S1111-N1115 VanDerWaalsContact O-CB 3.26Å; S1111-N1115 WeakPolarHBondContact O-CB 3.22Å; S1111-N1115 PolarHBondContact O-N 3.32Å; S1111-N1115 PolarHBondContact O-ND2 3.27Å; S1111-N1115 PolarHBondContact OG-ND2 3.19Å
1112H89.4Confident87.3Confident49 Ų4926.6 Ų26.623%0.22714%0.141CC..Hα-helixtrans-67.9-36.2179.1-164.780.2000112.1L1049 P1108 F1109 Y1116 L1117L1049-H1112 HydrophobicContact CD2-CB 4.32Å; L1049-H1112 WeakPolarHBondContact CD2-CD2 3.32Å; P1108-H1112 WeakPolarHBondContact O-CB 3.33Å; P1108-H1112 PolarHBondContact O-N 3.34Å; F1109-H1112 CarbonylContact O-C 3.58Å; F1109-H1112 PolarHBondContact O-N 2.83Å; H1112-Y1116 AromaticContact CE1-CD1 3.65Å; H1112-Y1116 AromaticContact CE1-CG 3.98Å; H1112-Y1116 AromaticContact NE2-CD1 3.26Å; H1112-Y1116 VanDerWaalsContact NE2-CD1 3.26Å; H1112-Y1116 WeakPolarHBondContact NE2-CD1 3.32Å; H1112-Y1116 AromaticContact NE2-CG 3.94Å; H1112-Y1116 WeakPolarHBondContact O-CA 3.43Å; H1112-Y1116 VanDerWaalsContact O-CB 3.28Å; H1112-Y1116 WeakPolarHBondContact O-CB 3.45Å; H1112-Y1116 PolarHBondContact O-N 2.64Å; H1112-L1117 PolarHBondContact O-N 3.1Å; H1112-L1117 VanDerWaalsContact O-N 3.1Å
1113S89.6Confident86.9Confident0 Ų031 Ų310%016%0.164CC..Iπ-helixtrans-70.3-45.7179.460.30000112.3F1109 L1110 N1115 L1117 V1118 F1135F1109-S1113 WeakPolarHBondContact O-CB 3.45Å; F1109-S1113 PolarHBondContact O-N 3.04Å; F1109-S1113 PolarHBondContact O-OG 3.25Å; F1109-S1113 VanDerWaalsContact O-OG 3.14Å; L1110-S1113 VanDerWaalsContact CA-OG 3.27Å; L1110-S1113 WeakPolarHBondContact CA-OG 3.41Å; L1110-S1113 PolarHBondContact O-N 2.87Å; L1110-S1113 PolarHBondContact O-OG 2.75Å; S1113-N1115 PolarHBondContact O-N 3.25Å; S1113-L1117 PolarHBondContact O-N 3.08Å; S1113-V1118 PolarHBondContact O-N 3.14Å; S1113-F1135 WeakPolarHBondContact OG-CE2 3.27Å
1114A89.3Confident86.8Confident0 Ų031.8 Ų31.80%017%0.165CC..Iπ-helixtrans-63.4-40.6175.400000112.4L1110 F1135 W1195 V1198 L1199 H1202L1110-A1114 WeakPolarHBondContact O-CB 3.26Å; L1110-A1114 PolarHBondContact O-N 3.47Å; A1114-F1135 HydrophobicContact CB-CZ 4.07Å; A1114-W1195 HydrophobicContact CB-CB 4.04Å; A1114-V1198 HydrophobicContact CB-CG1 4.33Å; A1114-L1199 HydrophobicContact CB-CB 4.35Å; A1114-L1199 HydrophobicContact CB-CD1 4.4Å; A1114-H1202 PolarHBondContact O-ND1 2.75Å
1115N88.9Confident87.1Confident70 Ų7031.8 Ų31.837%0.37416%0.161SC..Iπ-helixtrans-86.8-26.5-175.6-69.4-56.5000114.4S1111 S1113 L1119S1111-N1115 VanDerWaalsContact O-CB 3.26Å; S1111-N1115 WeakPolarHBondContact O-CB 3.22Å; S1111-N1115 PolarHBondContact O-N 3.32Å; S1111-N1115 PolarHBondContact O-ND2 3.27Å; S1111-N1115 PolarHBondContact OG-ND2 3.19Å; S1113-N1115 PolarHBondContact O-N 3.25Å; N1115-L1119 WeakPolarHBondContact O-CD1 3.45Å
1116Y87.7Confident87Confident88 Ų8837.5 Ų37.535%0.34519%0.188SC..Iπ-helixtrans-134.5-51.5-169-167.9-106.1000114.4T1053 H1112 V1118 L1119 K1120T1053-Y1116 HydrophobicContact CG2-CE1 4.23Å; H1112-Y1116 AromaticContact CE1-CD1 3.65Å; H1112-Y1116 AromaticContact CE1-CG 3.98Å; H1112-Y1116 AromaticContact NE2-CD1 3.26Å; H1112-Y1116 VanDerWaalsContact NE2-CD1 3.26Å; H1112-Y1116 WeakPolarHBondContact NE2-CD1 3.32Å; H1112-Y1116 AromaticContact NE2-CG 3.94Å; H1112-Y1116 WeakPolarHBondContact O-CA 3.43Å; H1112-Y1116 VanDerWaalsContact O-CB 3.28Å; H1112-Y1116 WeakPolarHBondContact O-CB 3.45Å; H1112-Y1116 PolarHBondContact O-N 2.64Å; Y1116-V1118 PolarHBondContact O-N 2.82Å; Y1116-L1119 WeakPolarHBondContact O-CB 3.42Å; Y1116-L1119 PolarHBondContact O-N 2.78Å; Y1116-L1119 VanDerWaalsContact O-N 3.14Å; Y1116-K1120 HydrophobicContact CD1-CD 4.04Å; Y1116-K1120 HydrophobicContact CE1-CD 3.38Å; Y1116-K1120 VanDerWaalsContact CE1-CE 3.46Å; Y1116-K1120 HydrophobicContact CE1-CG 4.18Å; Y1116-K1120 PolarHBondContact O-N 2.91Å; Y1116-K1120 WeakPolarHBondContact OH-CE 3.07Å; Y1116-K1120 PolarHBondContact OH-NZ 3.36Å
1117L86.5Confident86.9Confident1 Ų137.5 Ų37.51%0.00519%0.188CC..Iπ-helixtrans-66.1-40.7-173.9-62172.5000112.8L1052 L1070 F1109 H1112 S1113 L1119 K1120 C1121 L1131L1052-L1117 HydrophobicContact CB-CD2 4.41Å; L1052-L1117 HydrophobicContact CD1-CD2 4.21Å; L1070-L1117 HydrophobicContact CD1-CD1 4.22Å; F1109-L1117 HydrophobicContact CZ-CD1 4.17Å; H1112-L1117 PolarHBondContact O-N 3.1Å; H1112-L1117 VanDerWaalsContact O-N 3.1Å; S1113-L1117 PolarHBondContact O-N 3.08Å; L1117-L1119 PolarHBondContact O-N 3.46Å; L1117-K1120 PolarHBondContact O-N 2.87Å; L1117-K1120 VanDerWaalsContact O-N 3.08Å; L1117-C1121 WeakPolarHBondContact O-CB 3.4Å; L1117-C1121 PolarHBondContact O-N 2.77Å; L1117-L1131 HydrophobicContact CB-CD1 4.08Å; L1117-L1131 HydrophobicContact CD1-CD2 4.49Å
1118V86.1Confident87.1Confident1 Ų137.6 Ų37.61%0.00619%0.189CC..Hα-helixtrans-58.8-35.7175.1166.60000111.6S1113 Y1116 H1122 L1128 L1131 F1132 L1199 H1202S1113-V1118 PolarHBondContact O-N 3.14Å; Y1116-V1118 PolarHBondContact O-N 2.82Å; V1118-H1122 PolarHBondContact O-N 2.83Å; V1118-L1128 HydrophobicContact CB-CD2 4.44Å; V1118-L1128 HydrophobicContact CG1-CD2 4.26Å; V1118-L1128 HydrophobicContact CG2-CD2 4.26Å; V1118-L1131 HydrophobicContact CG2-CD1 4.25Å; V1118-F1132 HydrophobicContact CG2-CE1 4.18Å; V1118-L1199 HydrophobicContact CG2-CD1 3.53Å; V1118-L1199 HydrophobicContact CG2-CG 4.4Å; V1118-H1202 HydrophobicContact CG1-CB 4.3Å
1119L85.2Confident87.3Confident55 Ų5537 Ų3729%0.28818%0.181SC..Hα-helixtrans-70.6-38.2177.1-66.9172.2000111.9N1115 Y1116 L1117 H1122 H1202 N1206N1115-L1119 WeakPolarHBondContact O-CD1 3.45Å; Y1116-L1119 WeakPolarHBondContact O-CB 3.42Å; Y1116-L1119 PolarHBondContact O-N 2.78Å; Y1116-L1119 VanDerWaalsContact O-N 3.14Å; L1117-L1119 PolarHBondContact O-N 3.46Å; L1119-H1122 PolarHBondContact O-ND1 2.82Å; L1119-H1202 HydrophobicContact CD2-CB 3.92Å; L1119-H1202 HydrophobicContact CG-CB 4.23Å; L1119-N1206 WeakPolarHBondContact CA-ND2 3.47Å; L1119-N1206 WeakPolarHBondContact CD2-ND2 3.46Å; L1119-N1206 PolarHBondContact O-ND2 3.45Å
1120K82.2Confident87.3Confident45 Ų4537.2 Ų37.220%0.19618%0.183CC..Hα-helixtrans-72.9-49.3177.9-92.5-169.6162.3174.30112.6L1052 F1058 Y1116 L1117 H1122L1052-K1120 PolarHBondContact O-NZ 3.44Å; F1058-K1120 HydrophobicContact CE1-CD 3.78Å; F1058-K1120 HydrophobicContact CE1-CG 4.32Å; F1058-K1120 HydrophobicContact CZ-CD 3.81Å; Y1116-K1120 HydrophobicContact CD1-CD 4.04Å; Y1116-K1120 HydrophobicContact CE1-CD 3.38Å; Y1116-K1120 VanDerWaalsContact CE1-CE 3.46Å; Y1116-K1120 HydrophobicContact CE1-CG 4.18Å; Y1116-K1120 PolarHBondContact O-N 2.91Å; Y1116-K1120 WeakPolarHBondContact OH-CE 3.07Å; Y1116-K1120 PolarHBondContact OH-NZ 3.36Å; L1117-K1120 PolarHBondContact O-N 2.87Å; L1117-K1120 VanDerWaalsContact O-N 3.08Å; K1120-H1122 PolarHBondContact O-N 3.12Å; K1120-H1122 PolarHBondContact O-ND1 3.35Å
1121C79Confident87.4Confident11 Ų1137.2 Ų37.27%0.07418%0.183CC..SBendtrans-81.410.3-172.7-61.60000114L1117 N1123 Y1124 A1127 L1128L1117-C1121 WeakPolarHBondContact O-CB 3.4Å; L1117-C1121 PolarHBondContact O-N 2.77Å; C1121-N1123 PolarHBondContact O-N 3.34Å; C1121-Y1124 PolarHBondContact O-N 3.11Å; C1121-A1127 HydrophobicContact CB-CB 4.11Å; C1121-L1128 HydrophobicContact CB-CD2 4.5Å
1122H80.9Confident87.6Confident64 Ų6435.5 Ų35.530%0.29617%0.171SC..THydrogen-bonded Turntrans-57.9-7.7-175.776.9-61.9000116.9V1118 L1119 K1120 N1206 K1210V1118-H1122 PolarHBondContact O-N 2.83Å; L1119-H1122 PolarHBondContact O-ND1 2.82Å; K1120-H1122 PolarHBondContact O-N 3.12Å; K1120-H1122 PolarHBondContact O-ND1 3.35Å; H1122-N1206 HydrophobicContact CB-CB 4.05Å; H1122-N1206 WeakPolarHBondContact CB-ND2 3.39Å; H1122-K1210 PolarHBondContact CD2-NZ 3.11Å; H1122-K1210 PolarHBondContact O-NZ 3.45Å
1123N78.8Confident87.9Confident97 Ų9734.1 Ų34.152%0.51917%0.167SC..THydrogen-bonded Turntrans-104.4-1.3175.9-71.7-17.1000113.2C1121 K1210C1121-N1123 PolarHBondContact O-N 3.34Å; N1123-K1210 WeakPolarHBondContact OD1-CE 3.32Å; N1123-K1210 PolarHBondContact OD1-NZ 3.41Å
1124Y84.4Confident88.2Confident61 Ų6134.1 Ų34.124%0.23917%0.167CC..  trans-124.998.6-172.7-53.4-76.5000110L1061 I1067 C1121 E1126 A1127 L1128L1061-Y1124 HydrophobicContact CD2-CD2 4.32Å; L1061-Y1124 HydrophobicContact CD2-CE2 3.44Å; L1061-Y1124 VanDerWaalsContact CD2-CE2 3.44Å; L1061-Y1124 PolarHBondContact O-OH 2.87Å; I1067-Y1124 HydrophobicContact CD1-CD1 3.17Å; I1067-Y1124 HydrophobicContact CD1-CD2 4.48Å; I1067-Y1124 HydrophobicContact CD1-CE1 3.55Å; I1067-Y1124 HydrophobicContact CD1-CG 3.69Å; I1067-Y1124 HydrophobicContact CG1-CD1 4.14Å; I1067-Y1124 HydrophobicContact CG1-CG 4.19Å; C1121-Y1124 PolarHBondContact O-N 3.11Å; Y1124-E1126 PolarHBondContact O-N 3.16Å; Y1124-A1127 PolarHBondContact O-N 2.96Å; Y1124-L1128 PolarHBondContact O-N 2.89Å; Y1124-L1128 VanDerWaalsContact O-N 3.15Å
1125S87.3Confident88.5Confident18 Ų1834.1 Ų34.113%0.12617%0.167CC..Hα-helixtrans-54.8-50.5-176.6172.50000112A1127 L1128 Q1129 D1220 E1224S1125-A1127 VanDerWaalsContact C-N 3.29Å; S1125-A1127 PolarHBondContact O-N 2.96Å; S1125-L1128 WeakPolarHBondContact O-CA 3.47Å; S1125-L1128 WeakPolarHBondContact O-CB 3.44Å; S1125-L1128 PolarHBondContact O-N 3.16Å; S1125-Q1129 WeakPolarHBondContact O-CG 3.26Å; S1125-Q1129 PolarHBondContact O-N 3.27Å; S1125-Q1129 PolarHBondContact OG-NE2 3.15Å; S1125-D1220 VanDerWaalsContact CB-OD1 3.32Å; S1125-D1220 WeakPolarHBondContact CB-OD1 3.32Å; S1125-D1220 WeakPolarHBondContact OG-CB 3.36Å; S1125-D1220 VanDerWaalsContact OG-CG 3.25Å; S1125-D1220 PolarHBondContact OG-OD1 3.2Å; S1125-E1224 VanDerWaalsContact CA-OE1 3.31Å; S1125-E1224 WeakPolarHBondContact CA-OE1 3.34Å
1126E87.7Confident88.7Confident128 Ų12831 Ų3160%0.59815%0.151SC*.Hα-helixtrans-57.1-39.6-178.9-159.1179.9-173.800113.1V1071 Y1124 S1130V1071-E1126 HydrophobicContact CG2-CG 4.15Å; Y1124-E1126 PolarHBondContact O-N 3.16Å; E1126-S1130 WeakPolarHBondContact O-CB 3.26Å; E1126-S1130 PolarHBondContact O-N 3.31Å; E1126-S1130 PolarHBondContact O-OG 2.74Å
1127A89.2Confident88.9Confident1 Ų127 Ų271%0.00814%0.135CC..Hα-helixtrans-66.2-42.6174.700000112I1067 L1070 C1121 Y1124 S1125 S1130 L1131I1067-A1127 HydrophobicContact CG2-CB 4.32Å; L1070-A1127 HydrophobicContact CD2-CB 3.94Å; C1121-A1127 HydrophobicContact CB-CB 4.11Å; Y1124-A1127 PolarHBondContact O-N 2.96Å; S1125-A1127 VanDerWaalsContact C-N 3.29Å; S1125-A1127 PolarHBondContact O-N 2.96Å; A1127-S1130 PolarHBondContact O-OG 2.73Å; A1127-L1131 WeakPolarHBondContact O-CG 3.41Å; A1127-L1131 PolarHBondContact O-N 3.45Å; A1127-L1131 VanDerWaalsContact O-N 3.11Å
1128L91.7Very high89.2Confident3 Ų326.9 Ų26.92%0.01614%0.135CC..Hα-helixtrans-66.8-46.3177.6-71.1174.6000111.7V1118 C1121 Y1124 S1125 S1130 L1131 F1132 Y1203 E1224V1118-L1128 HydrophobicContact CB-CD2 4.44Å; V1118-L1128 HydrophobicContact CG1-CD2 4.26Å; V1118-L1128 HydrophobicContact CG2-CD2 4.26Å; C1121-L1128 HydrophobicContact CB-CD2 4.5Å; Y1124-L1128 PolarHBondContact O-N 2.89Å; Y1124-L1128 VanDerWaalsContact O-N 3.15Å; S1125-L1128 WeakPolarHBondContact O-CA 3.47Å; S1125-L1128 WeakPolarHBondContact O-CB 3.44Å; S1125-L1128 PolarHBondContact O-N 3.16Å; L1128-S1130 VanDerWaalsContact C-N 3.29Å; L1128-S1130 PolarHBondContact O-N 3.21Å; L1128-L1131 WeakPolarHBondContact O-CB 3.07Å; L1128-L1131 PolarHBondContact O-N 3.19Å; L1128-L1131 VanDerWaalsContact O-N 3.16Å; L1128-F1132 HydrophobicContact CB-CE2 4.03Å; L1128-F1132 HydrophobicContact CB-CZ 4.08Å; L1128-F1132 HydrophobicContact CD2-CE1 4.49Å; L1128-F1132 HydrophobicContact CD2-CZ 4.16Å; L1128-F1132 WeakPolarHBondContact O-CD1 3.37Å; L1128-F1132 WeakPolarHBondContact O-CD2 3Å; L1128-F1132 WeakPolarHBondContact O-CG 3.04Å; L1128-F1132 PolarHBondContact O-N 3.27Å; L1128-Y1203 HydrophobicContact CD1-CD2 4.45Å; L1128-Y1203 HydrophobicContact CD1-CE2 4.19Å; L1128-E1224 HydrophobicContact CB-CG 4.44Å; L1128-E1224 VanDerWaalsContact CD1-OE1 3.27Å; L1128-E1224 WeakPolarHBondContact CD1-OE1 3.48Å
1129Q93.5Very high89.4Confident43 Ų4326.9 Ų26.920%0.20113%0.134CC..Hα-helixtrans-58.1-42177.2-67.2-176.413.800111.6S1125 F1132 S1133 E1224 L1227S1125-Q1129 WeakPolarHBondContact O-CG 3.26Å; S1125-Q1129 PolarHBondContact O-N 3.27Å; S1125-Q1129 PolarHBondContact OG-NE2 3.15Å; Q1129-F1132 PolarHBondContact O-N 3.31Å; Q1129-S1133 WeakPolarHBondContact O-CB 3.37Å; Q1129-S1133 PolarHBondContact O-N 3.04Å; Q1129-S1133 PolarHBondContact O-OG 3.24Å; Q1129-E1224 HydrophobicContact CG-CG 4.03Å; Q1129-L1227 HydrophobicContact CB-CD1 3.64Å; Q1129-L1227 HydrophobicContact CG-CD1 3.79Å
1130S92.3Very high89.5Confident11 Ų1128.8 Ų28.88%0.07714%0.142CC..Hα-helixtrans-65.9-39.8176.873.90000112.9T1074 E1126 A1127 L1128 S1133 L1134T1074-S1130 VanDerWaalsContact OG1-CB 3.27Å; T1074-S1130 WeakPolarHBondContact OG1-CB 3.46Å; T1074-S1130 PolarHBondContact OG1-OG 3.32Å; E1126-S1130 WeakPolarHBondContact O-CB 3.26Å; E1126-S1130 PolarHBondContact O-N 3.31Å; E1126-S1130 PolarHBondContact O-OG 2.74Å; A1127-S1130 PolarHBondContact O-OG 2.73Å; L1128-S1130 VanDerWaalsContact C-N 3.29Å; L1128-S1130 PolarHBondContact O-N 3.21Å; S1130-S1133 PolarHBondContact O-N 2.78Å; S1130-L1134 PolarHBondContact O-N 3.34Å
1131L94.5Very high89.6Confident0 Ų027.7 Ų27.70%014%0.14CC..Hα-helixtrans-64.2-43.9173.3-73.3173.8000111.9T1074 F1109 L1117 V1118 A1127 L1128 S1133 L1134 F1135T1074-L1131 HydrophobicContact CG2-CD2 3.75Å; T1074-L1131 HydrophobicContact CG2-CG 4.41Å; F1109-L1131 HydrophobicContact CE1-CD2 4.02Å; F1109-L1131 HydrophobicContact CZ-CD2 4.43Å; L1117-L1131 HydrophobicContact CB-CD1 4.08Å; L1117-L1131 HydrophobicContact CD1-CD2 4.49Å; V1118-L1131 HydrophobicContact CG2-CD1 4.25Å; A1127-L1131 WeakPolarHBondContact O-CG 3.41Å; A1127-L1131 PolarHBondContact O-N 3.45Å; A1127-L1131 VanDerWaalsContact O-N 3.11Å; L1128-L1131 WeakPolarHBondContact O-CB 3.07Å; L1128-L1131 PolarHBondContact O-N 3.19Å; L1128-L1131 VanDerWaalsContact O-N 3.16Å; L1131-S1133 VanDerWaalsContact C-N 3.34Å; L1131-L1134 WeakPolarHBondContact O-CB 3.45Å; L1131-L1134 PolarHBondContact O-N 2.92Å; L1131-F1135 WeakPolarHBondContact O-CD2 3.4Å; L1131-F1135 PolarHBondContact O-N 3.42Å; L1131-F1135 VanDerWaalsContact O-N 3.16Å
1132F95.6Very high89.9Confident0 Ų027.2 Ų27.20%014%0.137CC..Hα-helixtrans-66.3-40179-59-19.2000111.3V1118 L1128 Q1129 L1134 F1135 S1136 L1199 Y1203 E1224 L1227 L1228V1118-F1132 HydrophobicContact CG2-CE1 4.18Å; L1128-F1132 HydrophobicContact CB-CE2 4.03Å; L1128-F1132 HydrophobicContact CB-CZ 4.08Å; L1128-F1132 HydrophobicContact CD2-CE1 4.49Å; L1128-F1132 HydrophobicContact CD2-CZ 4.16Å; L1128-F1132 WeakPolarHBondContact O-CD1 3.37Å; L1128-F1132 WeakPolarHBondContact O-CD2 3Å; L1128-F1132 WeakPolarHBondContact O-CG 3.04Å; L1128-F1132 PolarHBondContact O-N 3.27Å; Q1129-F1132 PolarHBondContact O-N 3.31Å; F1132-L1134 VanDerWaalsContact C-N 3.3Å; F1132-L1134 PolarHBondContact O-N 3.42Å; F1132-F1135 PolarHBondContact O-N 2.99Å; F1132-S1136 WeakPolarHBondContact O-CB 3.4Å; F1132-S1136 PolarHBondContact O-N 2.81Å; F1132-L1199 HydrophobicContact CD1-CD1 4.33Å; F1132-L1199 HydrophobicContact CD1-CD2 3.8Å; F1132-L1199 HydrophobicContact CD1-CG 4.28Å; F1132-L1199 HydrophobicContact CE1-CD1 4.19Å; F1132-L1199 HydrophobicContact CE1-CD2 4.04Å; F1132-L1199 HydrophobicContact CE1-CG 4.07Å; F1132-Y1203 HydrophobicContact CE2-CD2 4.2Å; F1132-Y1203 HydrophobicContact CE2-CE2 4.2Å; F1132-Y1203 AromaticContact CZ-CD2 3.66Å; F1132-Y1203 HydrophobicContact CZ-CD2 3.66Å; F1132-Y1203 HydrophobicContact CZ-CE2 4.1Å; F1132-Y1203 HydrophobicContact CZ-CG 4.11Å; F1132-E1224 HydrophobicContact CD2-CB 4.43Å; F1132-E1224 HydrophobicContact CE2-CB 3.99Å; F1132-E1224 HydrophobicContact CE2-CG 4.14Å; F1132-L1227 HydrophobicContact CB-CB 4Å; F1132-L1227 HydrophobicContact CB-CD1 4.44Å; F1132-L1227 HydrophobicContact CD2-CB 4.38Å; F1132-L1228 HydrophobicContact CD1-CD2 3.84Å; F1132-L1228 HydrophobicContact CD1-CG 4.44Å; F1132-L1228 HydrophobicContact CD2-CD1 4.3Å; F1132-L1228 HydrophobicContact CD2-CD2 4.15Å; F1132-L1228 HydrophobicContact CD2-CG 3.85Å; F1132-L1228 HydrophobicContact CE1-CD2 3.98Å; F1132-L1228 HydrophobicContact CE1-CG 4.5Å; F1132-L1228 HydrophobicContact CE2-CD1 3.85Å; F1132-L1228 HydrophobicContact CE2-CD2 4.29Å; F1132-L1228 HydrophobicContact CE2-CG 3.92Å; F1132-L1228 HydrophobicContact CG-CD2 3.93Å; F1132-L1228 HydrophobicContact CG-CG 4.13Å; F1132-L1228 HydrophobicContact CZ-CD1 3.99Å; F1132-L1228 HydrophobicContact CZ-CD2 4.2Å; F1132-L1228 HydrophobicContact CZ-CG 4.25Å
1133S95.1Very high90Very high20 Ų2024.2 Ų24.214%0.1412%0.123CC..Hα-helixtrans-61.2-37.4173.8-59.70000112.2Q1129 S1130 L1131 S1136 D1137Q1129-S1133 WeakPolarHBondContact O-CB 3.37Å; Q1129-S1133 PolarHBondContact O-N 3.04Å; Q1129-S1133 PolarHBondContact O-OG 3.24Å; S1130-S1133 PolarHBondContact O-N 2.78Å; L1131-S1133 VanDerWaalsContact C-N 3.34Å; S1133-S1136 WeakPolarHBondContact O-CB 3.34Å; S1133-S1136 PolarHBondContact O-N 3.47Å; S1133-D1137 PolarHBondContact O-N 2.99Å
1134L95.8Very high90.1Very high0 Ų022.1 Ų22.10%011%0.111CC..Hα-helixtrans-61.6-47.517317565.3000112.3T1074 L1077 R1078 F1109 L1110 S1130 L1131 F1132 S1136 D1137 V1138T1074-L1134 HydrophobicContact CG2-CD2 4.44Å; L1077-L1134 HydrophobicContact CB-CD1 3.64Å; L1077-L1134 HydrophobicContact CB-CD2 4.17Å; L1077-L1134 HydrophobicContact CD1-CD2 4.12Å; R1078-L1134 HydrophobicContact CB-CD1 4.5Å; R1078-L1134 HydrophobicContact CG-CB 3.97Å; R1078-L1134 HydrophobicContact CG-CD1 3.79Å; F1109-L1134 HydrophobicContact CD1-CD2 3.73Å; F1109-L1134 HydrophobicContact CE1-CD2 3.64Å; L1110-L1134 HydrophobicContact CD2-CD2 4.06Å; L1110-L1134 HydrophobicContact CD2-CG 4.12Å; S1130-L1134 PolarHBondContact O-N 3.34Å; L1131-L1134 WeakPolarHBondContact O-CB 3.45Å; L1131-L1134 PolarHBondContact O-N 2.92Å; F1132-L1134 VanDerWaalsContact C-N 3.3Å; F1132-L1134 PolarHBondContact O-N 3.42Å; L1134-S1136 PolarHBondContact O-N 2.71Å; L1134-D1137 PolarHBondContact O-N 3.23Å; L1134-V1138 HydrophobicContact CD1-CG2 4.22Å; L1134-V1138 VanDerWaalsContact O-CG2 3.25Å; L1134-V1138 WeakPolarHBondContact O-CG2 3.19Å; L1134-V1138 PolarHBondContact O-N 3.19Å
1135F96.2Very high89.8Confident0 Ų022.1 Ų22.10%011%0.111CC..Hα-helixtrans-59.4-39.5174.3-87.1-103.6000111.2L1110 S1113 A1114 L1131 F1132 V1138 A1139 F1192 W1195 L1199 L1231L1110-F1135 HydrophobicContact CB-CE2 4.47Å; L1110-F1135 HydrophobicContact CB-CZ 4.01Å; L1110-F1135 HydrophobicContact CD2-CD1 4.29Å; L1110-F1135 HydrophobicContact CD2-CD2 3.6Å; L1110-F1135 HydrophobicContact CD2-CE1 4.1Å; L1110-F1135 HydrophobicContact CD2-CE2 3.38Å; L1110-F1135 HydrophobicContact CD2-CG 4.06Å; L1110-F1135 HydrophobicContact CD2-CZ 3.64Å; L1110-F1135 HydrophobicContact CG-CZ 4.41Å; S1113-F1135 WeakPolarHBondContact OG-CE2 3.27Å; A1114-F1135 HydrophobicContact CB-CZ 4.07Å; L1131-F1135 WeakPolarHBondContact O-CD2 3.4Å; L1131-F1135 PolarHBondContact O-N 3.42Å; L1131-F1135 VanDerWaalsContact O-N 3.16Å; F1132-F1135 PolarHBondContact O-N 2.99Å; F1135-V1138 PolarHBondContact O-N 3.01Å; F1135-A1139 WeakPolarHBondContact O-CB 3.43Å; F1135-A1139 PolarHBondContact O-N 3.3Å; F1135-F1192 AromaticContact CD1-CE2 3.78Å; F1135-F1192 HydrophobicContact CD1-CE2 3.78Å; F1135-F1192 HydrophobicContact CD1-CZ 4.25Å; F1135-F1192 HydrophobicContact CE1-CE2 4.23Å; F1135-W1195 HydrophobicContact CE1-CB 4.11Å; F1135-W1195 HydrophobicContact CZ-CB 4.46Å; F1135-L1199 HydrophobicContact CD1-CD2 4.39Å; F1135-L1199 HydrophobicContact CD2-CD1 4.1Å; F1135-L1199 HydrophobicContact CD2-CD2 4.3Å; F1135-L1199 HydrophobicContact CE2-CD1 3.69Å; F1135-L1199 HydrophobicContact CG-CD2 4.2Å; F1135-L1199 HydrophobicContact CZ-CD1 3.97Å; F1135-L1231 HydrophobicContact CB-CD1 3.92Å; F1135-L1231 HydrophobicContact CB-CD2 3.61Å; F1135-L1231 HydrophobicContact CB-CG 4.42Å; F1135-L1231 HydrophobicContact CD1-CD2 4.5Å; F1135-L1231 HydrophobicContact CG-CD2 4.35Å; F1135-L1231 WeakPolarHBondContact O-CD1 3.33Å
1136S93.8Very high89.4Confident5 Ų521.2 Ų21.24%0.03511%0.105CC..Hα-helixtrans-64.7-43.8-179.2-134.90000112.5F1132 S1133 L1134 A1139 E1140 R1234F1132-S1136 WeakPolarHBondContact O-CB 3.4Å; F1132-S1136 PolarHBondContact O-N 2.81Å; S1133-S1136 WeakPolarHBondContact O-CB 3.34Å; S1133-S1136 PolarHBondContact O-N 3.47Å; L1134-S1136 PolarHBondContact O-N 2.71Å; S1136-A1139 PolarHBondContact O-N 3.38Å; S1136-E1140 WeakPolarHBondContact O-CB 3.32Å; S1136-E1140 PolarHBondContact O-N 3.41Å; S1136-R1234 PolarHBondContact O-NH1 3.13Å; S1136-R1234 VanDerWaalsContact OG-CD 3.23Å; S1136-R1234 WeakPolarHBondContact OG-CD 3.49Å; S1136-R1234 PolarHBondContact OG-NE 2.92Å; S1136-R1234 PolarHBondContact OG-NH1 3.13Å
1137D91.8Very high88.7Confident2 Ų215.7 Ų15.71%0.0118%0.08CC..Hα-helixtrans-70.4-33.9176.9-77.5-27.3000111.7R1078 R1082 S1133 L1134 E1140 S1141 R1234R1078-D1137 HydrophobicContact CG-CB 4.45Å; R1078-D1137 WeakPolarHBondContact CG-OD2 3.4Å; R1078-D1137 IonicContact CZ-OD2 3.3Å; R1078-D1137 IonicContact NE-OD2 3.54Å; R1078-D1137 PolarHBondContact NE-OD2 3.44Å; R1078-D1137 IonicContact NH2-OD2 3.59Å; R1078-D1137 PolarHBondContact NH2-OD2 3.06Å; R1078-D1137 VanDerWaalsContact NH2-OD2 3.09Å; R1082-D1137 IonicContact CZ-OD1 3.64Å; R1082-D1137 IonicContact CZ-OD2 3.67Å; R1082-D1137 IonicContact NE-OD1 2.83Å; R1082-D1137 PolarHBondContact NE-OD1 3.32Å; R1082-D1137 IonicContact NE-OD2 3.69Å; R1082-D1137 PolarHBondContact NE-OD2 3.49Å; R1082-D1137 IonicContact NH2-OD1 3.55Å; R1082-D1137 PolarHBondContact NH2-OD1 3.12Å; R1082-D1137 IonicContact NH2-OD2 3.46Å; R1082-D1137 PolarHBondContact NH2-OD2 3.35Å; S1133-D1137 PolarHBondContact O-N 2.99Å; L1134-D1137 PolarHBondContact O-N 3.23Å; D1137-E1140 PolarHBondContact O-N 2.81Å; D1137-S1141 VanDerWaalsContact O-CB 3.23Å; D1137-S1141 WeakPolarHBondContact O-CB 3.43Å; D1137-S1141 PolarHBondContact O-N 2.79Å; D1137-S1141 PolarHBondContact O-OG 2.91Å; D1137-S1141 VanDerWaalsContact O-OG 3.13Å; D1137-R1234 IonicContact OD1-NH1 2.72Å
1138V93.1Very high87.6Confident0 Ų019.5 Ų19.50%011%0.106CC..Hα-helixtrans-67.7-40.1173.21730000111.1A1081 W1102 L1106 L1110 L1134 F1135 E1140 C1142 L1143 F1192A1081-V1138 HydrophobicContact CB-CG2 3.72Å; W1102-V1138 HydrophobicContact CZ3-CG1 4.03Å; L1106-V1138 HydrophobicContact CD2-CG2 4.48Å; L1110-V1138 HydrophobicContact CD1-CG1 4.06Å; L1110-V1138 HydrophobicContact CD1-CG2 4.23Å; L1134-V1138 HydrophobicContact CD1-CG2 4.22Å; L1134-V1138 VanDerWaalsContact O-CG2 3.25Å; L1134-V1138 WeakPolarHBondContact O-CG2 3.19Å; L1134-V1138 PolarHBondContact O-N 3.19Å; F1135-V1138 PolarHBondContact O-N 3.01Å; V1138-E1140 VanDerWaalsContact C-N 3.33Å; V1138-C1142 HydrophobicContact CG1-CB 4.07Å; V1138-C1142 WeakPolarHBondContact O-CA 3.48Å; V1138-C1142 VanDerWaalsContact O-CB 3.29Å; V1138-C1142 WeakPolarHBondContact O-CB 3.44Å; V1138-C1142 PolarHBondContact O-N 3.17Å; V1138-L1143 PolarHBondContact O-N 3.3Å; V1138-F1192 HydrophobicContact CB-CE2 4.02Å; V1138-F1192 HydrophobicContact CB-CZ 4.21Å; V1138-F1192 HydrophobicContact CG1-CD2 3.99Å; V1138-F1192 HydrophobicContact CG1-CE2 3.49Å; V1138-F1192 VanDerWaalsContact CG1-CE2 3.49Å; V1138-F1192 HydrophobicContact CG1-CZ 3.87Å
1139A90.4Very high86.5Confident0 Ų019.9 Ų19.90%011%0.108CC..Hα-helixtrans-61.6-43.3175.200000111.4F1135 S1136 L1143 F1192 L1231 R1234 V1235 H1238F1135-A1139 WeakPolarHBondContact O-CB 3.43Å; F1135-A1139 PolarHBondContact O-N 3.3Å; S1136-A1139 PolarHBondContact O-N 3.38Å; A1139-L1143 WeakPolarHBondContact O-CB 3.23Å; A1139-F1192 HydrophobicContact CB-CE1 4.02Å; A1139-F1192 HydrophobicContact CB-CZ 4.01Å; A1139-L1231 HydrophobicContact CB-CD1 3.82Å; A1139-R1234 HydrophobicContact CB-CB 4.29Å; A1139-V1235 HydrophobicContact CB-CG2 3.88Å; A1139-H1238 PolarHBondContact O-CD2 3.4Å; A1139-H1238 PolarHBondContact O-NE2 3.26Å
1140E86.6Confident85.1Confident95 Ų9521.7 Ų21.744%0.44412%0.124SC..Hα-helixtrans-72.2-44.1-179.8-176.2173.4-170.800112.9S1136 D1137 V1138 R1234S1136-E1140 WeakPolarHBondContact O-CB 3.32Å; S1136-E1140 PolarHBondContact O-N 3.41Å; D1137-E1140 PolarHBondContact O-N 2.81Å; V1138-E1140 VanDerWaalsContact C-N 3.33Å; E1140-R1234 IonicContact OE2-CZ 3.09Å; E1140-R1234 IonicContact OE2-NE 2.76Å; E1140-R1234 IonicContact OE2-NH1 3.14Å; E1140-R1234 PolarHBondContact OE2-NH1 3.17Å; E1140-R1234 IonicContact OE2-NH2 2.71Å; E1140-R1234 PolarHBondContact OE2-NH2 2.94Å
1141S84.1Confident83.4Confident22 Ų2222.3 Ų22.315%0.15413%0.129CC..Hα-helixtrans-96-29.2-169.5-55.60000113.9A1081 G1085 D1137 Y1145A1081-S1141 VanDerWaalsContact O-CB 3.26Å; A1081-S1141 WeakPolarHBondContact O-CB 3.43Å; G1085-S1141 WeakPolarHBondContact CA-O 3.31Å; D1137-S1141 VanDerWaalsContact O-CB 3.23Å; D1137-S1141 WeakPolarHBondContact O-CB 3.43Å; D1137-S1141 PolarHBondContact O-N 2.79Å; D1137-S1141 PolarHBondContact O-OG 2.91Å; D1137-S1141 VanDerWaalsContact O-OG 3.13Å; S1141-Y1145 WeakPolarHBondContact O-CD2 3.44Å; S1141-Y1145 VanDerWaalsContact O-CE2 3.3Å; S1141-Y1145 WeakPolarHBondContact O-CE2 3.47Å
1142C85.9Confident81.4Confident2 Ų225.2 Ų25.21%0.01415%0.149CC..THydrogen-bonded Turntrans-113.8-26.2-169-64.70000114.2A1081 V1138 I1144 Y1145 L1146A1081-C1142 PolarHBondContact O-SG 3.03Å; V1138-C1142 HydrophobicContact CG1-CB 4.07Å; V1138-C1142 WeakPolarHBondContact O-CA 3.48Å; V1138-C1142 VanDerWaalsContact O-CB 3.29Å; V1138-C1142 WeakPolarHBondContact O-CB 3.44Å; V1138-C1142 PolarHBondContact O-N 3.17Å; C1142-I1144 VanDerWaalsContact C-N 3.33Å; C1142-I1144 PolarHBondContact O-N 3.36Å; C1142-Y1145 PolarHBondContact O-N 2.99Å; C1142-L1146 WeakPolarHBondContact O-CG 3.37Å; C1142-L1146 PolarHBondContact O-N 2.88Å; C1142-L1146 VanDerWaalsContact O-N 3.16Å
1143L83.3Confident79.1Confident1 Ų127.4 Ų27.41%0.00516%0.16CC..THydrogen-bonded Turntrans-56.6-42-166.1-175.958.3000113.8V1138 A1139 Y1145 L1146 F1192 L1193 V1235 H1238 L1242 T1276V1138-L1143 PolarHBondContact O-N 3.3Å; A1139-L1143 WeakPolarHBondContact O-CB 3.23Å; L1143-Y1145 VanDerWaalsContact C-N 3.26Å; L1143-Y1145 PolarHBondContact O-N 3.18Å; L1143-L1146 PolarHBondContact O-N 3.06Å; L1143-F1192 HydrophobicContact CD1-CD1 3.72Å; L1143-F1192 HydrophobicContact CD1-CE1 4.15Å; L1143-L1193 HydrophobicContact CD1-CD2 4.5Å; L1143-V1235 HydrophobicContact CD2-CG1 4.47Å; L1143-V1235 HydrophobicContact CD2-CG2 4.44Å; L1143-H1238 HydrophobicContact CD2-CB 4.26Å; L1143-L1242 HydrophobicContact CD2-CD1 4.21Å; L1143-L1242 HydrophobicContact CG-CD1 4.33Å; L1143-T1276 HydrophobicContact CD2-CG2 4.44Å
1144I79Confident76.6Confident53 Ų5329.6 Ų29.627%0.27218%0.175SC..THydrogen-bonded Turntrans-58.6-40.3178-57.4168.4000111C1142 V1147 H1238 E1241C1142-I1144 VanDerWaalsContact C-N 3.33Å; C1142-I1144 PolarHBondContact O-N 3.36Å; I1144-V1147 WeakPolarHBondContact O-CB 3.41Å; I1144-V1147 WeakPolarHBondContact O-CG2 3.22Å; I1144-H1238 WeakPolarHBondContact CD1-ND1 3.18Å; I1144-H1238 WeakPolarHBondContact CG1-ND1 3.47Å; I1144-E1241 WeakPolarHBondContact CD1-OE2 3.44Å; I1144-E1241 WeakPolarHBondContact CG1-OE2 3.2Å
1145Y78.3Confident73.7Confident60 Ų6038 Ų3824%0.23522%0.215CC..G310 helixtrans-80-25.1-175.6-52.4-69.7000112.9G1085 A1088 S1089 S1141 C1142 L1143 V1147 S1148G1085-Y1145 PolarHBondContact O-OH 3.01Å; A1088-Y1145 HydrophobicContact CB-CD1 3.6Å; A1088-Y1145 HydrophobicContact CB-CD2 3.81Å; A1088-Y1145 HydrophobicContact CB-CE1 3.48Å; A1088-Y1145 VanDerWaalsContact CB-CE1 3.48Å; A1088-Y1145 HydrophobicContact CB-CE2 3.7Å; A1088-Y1145 HydrophobicContact CB-CG 3.75Å; S1089-Y1145 PolarHBondContact N-OH 3.37Å; S1141-Y1145 WeakPolarHBondContact O-CD2 3.44Å; S1141-Y1145 VanDerWaalsContact O-CE2 3.3Å; S1141-Y1145 WeakPolarHBondContact O-CE2 3.47Å; C1142-Y1145 PolarHBondContact O-N 2.99Å; L1143-Y1145 VanDerWaalsContact C-N 3.26Å; L1143-Y1145 PolarHBondContact O-N 3.18Å; Y1145-V1147 PolarHBondContact O-N 3.3Å; Y1145-V1147 VanDerWaalsContact O-N 3.15Å; Y1145-S1148 PolarHBondContact O-N 3.43Å; Y1145-S1148 PolarHBondContact O-OG 2.95Å
1146L79.5Confident70.8Confident0 Ų043.3 Ų43.30%024%0.242CC..G310 helixtrans-66.5-13.7176.2-65.1178.4000113.3W1102 C1142 L1143 L1149 A1188 S1189 F1192W1102-L1146 HydrophobicContact CB-CD2 4.28Å; W1102-L1146 HydrophobicContact CD2-CD1 4.35Å; W1102-L1146 HydrophobicContact CD2-CD2 3.45Å; W1102-L1146 VanDerWaalsContact CD2-CD2 3.45Å; W1102-L1146 HydrophobicContact CE3-CD1 4.02Å; W1102-L1146 HydrophobicContact CE3-CD2 3.63Å; W1102-L1146 HydrophobicContact CE3-CG 4.46Å; W1102-L1146 HydrophobicContact CG-CD2 3.75Å; W1102-L1146 HydrophobicContact CH2-CD1 3.65Å; W1102-L1146 HydrophobicContact CZ2-CD1 3.99Å; W1102-L1146 HydrophobicContact CZ2-CD2 4.37Å; W1102-L1146 HydrophobicContact CZ3-CD1 3.66Å; W1102-L1146 HydrophobicContact CZ3-CD2 4.17Å; C1142-L1146 WeakPolarHBondContact O-CG 3.37Å; C1142-L1146 PolarHBondContact O-N 2.88Å; C1142-L1146 VanDerWaalsContact O-N 3.16Å; L1143-L1146 PolarHBondContact O-N 3.06Å; L1146-L1149 HydrophobicContact CD2-CD1 4.13Å; L1146-A1188 HydrophobicContact CB-CB 4.14Å; L1146-A1188 HydrophobicContact CD2-CB 4.02Å; L1146-A1188 WeakPolarHBondContact O-CB 3.47Å; L1146-A1188 PolarHBondContact O-N 3.25Å; L1146-S1189 PolarHBondContact O-N 3.46Å; L1146-S1189 VanDerWaalsContact O-N 3.14Å; L1146-F1192 HydrophobicContact CD1-CB 4.18Å; L1146-F1192 HydrophobicContact CD1-CG 4.43Å
1147V72.5Confident67.9Low11 Ų1148.3 Ų48.37%0.06728%0.278CS..G310 helixtrans-68.1-35.9177.4179.80000113I1144 Y1145 L1149 C1187 L1242 A1247I1144-V1147 WeakPolarHBondContact O-CB 3.41Å; I1144-V1147 WeakPolarHBondContact O-CG2 3.22Å; Y1145-V1147 PolarHBondContact O-N 3.3Å; Y1145-V1147 VanDerWaalsContact O-N 3.15Å; V1147-L1149 VanDerWaalsContact C-N 3.31Å; V1147-C1187 WeakPolarHBondContact O-CB 3.41Å; V1147-C1187 PolarHBondContact O-SG 3.48Å; V1147-L1242 HydrophobicContact CG2-CD2 3.1Å; V1147-A1247 HydrophobicContact CB-CB 4.46Å; V1147-A1247 HydrophobicContact CG1-CB 3.12Å
1148S66.6Low64.8Low81 Ų8153.1 Ų53.157%0.56631%0.311SS*.G310 helixtrans-88.1-1.5-176.5510000113.2Y1145Y1145-S1148 PolarHBondContact O-N 3.43Å; Y1145-S1148 PolarHBondContact O-OG 2.95Å
1149L69.2Low61.6Low11 Ų1158.1 Ų58.16%0.05834%0.342CS..SBendtrans-99.7121.8-172.9-83.6158.5000112.5V1098 L1146 V1147 S1151 C1187 A1188V1098-L1149 HydrophobicContact CB-CD1 3.94Å; V1098-L1149 HydrophobicContact CG1-CD1 3.44Å; V1098-L1149 VanDerWaalsContact CG1-CD1 3.44Å; L1146-L1149 HydrophobicContact CD2-CD1 4.13Å; V1147-L1149 VanDerWaalsContact C-N 3.31Å; L1149-S1151 PolarHBondContact O-N 2.93Å; L1149-C1187 CarbonylContact O-C 3.35Å; L1149-C1187 VanDerWaalsContact O-CA 3.28Å; L1149-C1187 WeakPolarHBondContact O-CA 3.38Å; L1149-A1188 HydrophobicContact CB-CB 3.83Å; L1149-A1188 PolarHBondContact O-N 3.15Å
1150P62.7Low58.6Low81 Ų8162 Ų6253%0.52637%0.368SS..BIsolated β-bridgetrans-68.9131.1173.925.5-29.8000110.8S1152P1150-S1152 PolarHBondContact O-N 2.94Å; P1150-S1152 VanDerWaalsContact O-N 3.12Å
1151S56.7Low55.9Low25 Ų2565.5 Ų65.518%0.17539%0.39CS..  trans-73.1104.1-178.572.10000110.9L1149 L1153 P1186L1149-S1151 PolarHBondContact O-N 2.93Å; S1151-L1153 VanDerWaalsContact C-N 3.32Å; S1151-P1186 VanDerWaalsContact CB-O 3.28Å; S1151-P1186 WeakPolarHBondContact CB-O 3.48Å; S1151-P1186 PolarHBondContact N-O 3.2Å; S1151-P1186 WeakPolarHBondContact OG-CG 3.47Å; S1151-P1186 PolarHBondContact OG-O 3.5Å; S1151-P1186 VanDerWaalsContact OG-O 3.06Å
1152S52.2Low53.1Low61 Ų6171 Ų7143%0.42742%0.417SS..  trans-79.4-16.4171.154.50000113N1103 P1150 S1154N1103-S1152 VanDerWaalsContact CG-OG 3.3Å; N1103-S1152 PolarHBondContact ND2-OG 3.42Å; N1103-S1152 PolarHBondContact OD1-OG 3.37Å; P1150-S1152 PolarHBondContact O-N 2.94Å; P1150-S1152 VanDerWaalsContact O-N 3.12Å; S1152-S1154 VanDerWaalsContact C-N 3.34Å; S1152-S1154 PolarHBondContact O-N 2.97Å
1153L48.8Very low50.3Low46 Ų4678.1 Ų78.124%0.24145%0.454CS..G310 helixtrans-75.8-13.2-172.7-74.3160.1000114.9S1151 E1155 W1195S1151-L1153 VanDerWaalsContact C-N 3.32Å; L1153-E1155 VanDerWaalsContact C-N 3.26Å; L1153-E1155 PolarHBondContact O-N 2.73Å; L1153-W1195 HydrophobicContact CD1-CH2 4.26Å
1154S42.6Very low47.5Very low65 Ų6585.5 Ų85.546%0.45549%0.494SS..G310 helixtrans-70.8-17.9-179.9-172.70000113.8S1152S1152-S1154 VanDerWaalsContact C-N 3.34Å; S1152-S1154 PolarHBondContact O-N 2.97Å
1155E34.8Very low45.1Very low178 Ų17890.4 Ų90.483%0.83252%0.521SS*.G310 helixtrans-95.6-14.3-179.6-69.5-173.3164.900113.4L1153L1153-E1155 VanDerWaalsContact C-N 3.26Å; L1153-E1155 PolarHBondContact O-N 2.73Å
1156L35.7Very low42.7Very low110 Ų11092.5 Ų92.558%0.57654%0.544SS*.THydrogen-bonded Turntrans-101.2-2.5-172.4-89.1144.9000115.2S1158 V1159L1156-S1158 PolarHBondContact O-N 3.05Å; L1156-V1159 PolarHBondContact O-N 3.27Å
1157S31.3Very low40.1Very low111 Ų11198.9 Ų98.978%0.77658%0.584SS**THydrogen-bonded Turntrans-67.29.1178.251.20000115
1158S27.2Very low38Very low103 Ų103104.7 Ų104.772%0.7262%0.618SS**THydrogen-bonded Turntrans-119.6-0.6175.361.30000115.4L1156L1156-S1158 PolarHBondContact O-N 3.05Å
1159V27.1Very low36.2Very low104 Ų104106.3 Ų106.363%0.6363%0.625SS**SBendtrans-102.998.5176.4-1740000109.7L1156 L1161L1156-V1159 PolarHBondContact O-N 3.27Å; V1159-L1161 PolarHBondContact O-N 3.39Å
1160S27.6Very low34.3Very low81 Ų81115.3 Ų115.357%0.56667%0.666SS**  trans-34.5124.6161.948.40000112.2L1162S1160-L1162 PolarHBondContact O-N 3Å
1161L29.5Very low32.7Very low170 Ų170117.2 Ų117.289%0.8968%0.682SS**SBendtrans-63.514.9168.4-100.3153.7000114.2V1159V1159-L1161 PolarHBondContact O-N 3.39Å
1162L25.5Very low31.3Very low137 Ų137120.5 Ų120.572%0.71771%0.705SS**SBendtrans-148.586.1176.9-75.4167.5000108.5S1160S1160-L1162 PolarHBondContact O-N 3Å
1163N26Very low30.2Very low151 Ų151125.2 Ų125.281%0.80773%0.725SS**  trans-179.4113.9137.6-94.1-14.4000110.4D1165N1163-D1165 PolarHBondContact O-N 2.68Å
1164N25.2Very low29.3Very low157 Ų157132 Ų13284%0.8476%0.755SS**  trans-62.4107.1153.5-73.6-24.5000107
1165D27.3Very low28.9Very low155 Ų155136.4 Ų136.483%0.82977%0.772SS**  trans171.9109.7142.5-86.9-20.7000109.3N1163N1163-D1165 PolarHBondContact O-N 2.68Å
1166S28.4Very low28.7Very low105 Ų105135.3 Ų135.373%0.73477%0.771SS**  trans-167.6108140.143.90000111.6
1167T25.8Very low28.4Very low134 Ų134139.7 Ų139.782%0.82279%0.786SS**SBendtrans-71148.9130.449.10000106.6
1168V27.8Very low28.3Very low132 Ų132138.8 Ų138.880%0.879%0.785SS**  trans91.959.2177.7-1600000116.6
1169V28.8Very low28.3Very low115 Ų115141.2 Ų141.270%0.69779%0.79SS**  trans-15368145.2-168.70000110.1
1170Q29.7Very low28.5Very low200 Ų200146.2 Ų146.294%0.93580%0.798SS**  trans-125.811.6177.3-132.7175.61.800114
1171S27.8Very low28.5Very low121 Ų121149.9 Ų149.985%0.84681%0.811SS**SBendtrans-119.616.6-171.762.40000115.7
1172S29.1Very low28.4Very low95 Ų95149.6 Ų149.666%0.66481%0.81SS**SBendtrans-124.35.7-179.435.30000115
1173L28.1Very low28.8Very low160 Ų160147 Ų14784%0.83880%0.803SS**SBendtrans-99.3-0.1-172-125.8102.7000116.6
1174E29.5Very low29.6Very low188 Ų188146.3 Ų146.388%0.87980%0.804SS**SBendtrans-103.5-3.8-173.7-74.4-167.5154.400116.3
1175I34.7Very low30.7Very low157 Ų157143.5 Ų143.581%0.80579%0.793SS**SBendtrans-95.6-12.5-171.9-64.6177.1000114.5
1176N29.7Very low32.1Very low155 Ų155139.1 Ų139.183%0.82977%0.772SS**SBendtrans-10412.2-174-80.2-14.8000116.6A1178N1176-A1178 PolarHBondContact O-N 3.42Å
1177K30.4Very low34.1Very low202 Ų202135.8 Ų135.888%0.87875%0.749SS**THydrogen-bonded Turntrans-86.98.5-177.7-94-177.7177.9176.40116.6
1178A28.9Very low36.5Very low92 Ų92129.5 Ų129.576%0.7671%0.711SS**THydrogen-bonded Turntrans-112.9-1.1-173.900000116.5N1176N1176-A1178 PolarHBondContact O-N 3.42Å
1179N28.3Very low39.1Very low155 Ų155124.1 Ų124.183%0.82968%0.678SS**  trans-145.585.7178.9-91-17000111.2
1180R30.1Very low41.7Very low208 Ų208119.2 Ų119.279%0.78565%0.652SS**  trans-160.285.4160-106.9176.5-170.1-168.41.9109.1
1181N27Very low44.4Very low158 Ų158111.1 Ų111.185%0.84562%0.616SS**SBendtrans-79.7134152.1-70.2-11.8000106.2
1182D29.3Very low47.4Very low164 Ų164105.3 Ų105.388%0.87758%0.576SS**SBendtrans77.443.6168.2-49.1-24.6000119.5
1183C33.2Very low50.3Low84 Ų84101.1 Ų101.157%0.56855%0.546SS*.  trans-114.8101.9165.1-154.10000110.8T1185C1183-T1185 PolarHBondContact O-N 3.4Å
1184V41.8Very low53.3Low136 Ų13695.6 Ų95.682%0.82452%0.517SS*.PPolyproline II helixtrans-64.1124.2175.9-179.80000109.4
1185T48.1Very low56.3Low98 Ų9888.2 Ų88.260%0.60148%0.481SS*.PPolyproline II helixtrans-68129.4175.732.60000110.8C1183C1183-T1185 PolarHBondContact O-N 3.4Å
1186P57.2Low59.1Low62 Ų6280.9 Ų80.940%0.40344%0.444SS..PPolyproline II helixtrans-63.9135.1179.912.2-13.8000111.5S1151S1151-P1186 VanDerWaalsContact CB-O 3.28Å; S1151-P1186 WeakPolarHBondContact CB-O 3.48Å; S1151-P1186 PolarHBondContact N-O 3.2Å; S1151-P1186 WeakPolarHBondContact OG-CG 3.47Å; S1151-P1186 PolarHBondContact OG-O 3.5Å; S1151-P1186 VanDerWaalsContact OG-O 3.06Å
1187C70.3Confident62.1Low36 Ų3674 Ų7424%0.24341%0.407CS..BIsolated β-bridgetrans-82.8150.4179.6-57.90000111.7V1147 L1149 S1189 G1190 P1191V1147-C1187 WeakPolarHBondContact O-CB 3.41Å; V1147-C1187 PolarHBondContact O-SG 3.48Å; L1149-C1187 CarbonylContact O-C 3.35Å; L1149-C1187 VanDerWaalsContact O-CA 3.28Å; L1149-C1187 WeakPolarHBondContact O-CA 3.38Å; C1187-S1189 PolarHBondContact O-N 3.28Å; C1187-S1189 VanDerWaalsContact O-N 3.14Å; C1187-G1190 PolarHBondContact O-N 2.88Å; C1187-P1191 WeakPolarHBondContact O-CD 3.35Å
1188A77Confident65.1Low2 Ų265.8 Ų65.82%0.01737%0.374CS..THydrogen-bonded Turntrans-61.7-19.7-178.300000114.5L1146 L1149 G1190 P1191 F1192L1146-A1188 HydrophobicContact CB-CB 4.14Å; L1146-A1188 HydrophobicContact CD2-CB 4.02Å; L1146-A1188 WeakPolarHBondContact O-CB 3.47Å; L1146-A1188 PolarHBondContact O-N 3.25Å; L1149-A1188 HydrophobicContact CB-CB 3.83Å; L1149-A1188 PolarHBondContact O-N 3.15Å; A1188-G1190 VanDerWaalsContact C-N 3.3Å; A1188-G1190 PolarHBondContact O-N 3.01Å; A1188-P1191 WeakPolarHBondContact O-CD 3.4Å; A1188-F1192 PolarHBondContact O-N 3.45Å
1189S82.7Confident68.2Low18 Ų1861.4 Ų61.413%0.12634%0.338CS..Hα-helixtrans-62.7-35.4172.257.30000112.5L1146 C1187 F1192 L1193L1146-S1189 PolarHBondContact O-N 3.46Å; L1146-S1189 VanDerWaalsContact O-N 3.14Å; C1187-S1189 PolarHBondContact O-N 3.28Å; C1187-S1189 VanDerWaalsContact O-N 3.14Å; S1189-F1192 PolarHBondContact O-N 3.48Å; S1189-L1193 VanDerWaalsContact O-CG 3.32Å; S1189-L1193 WeakPolarHBondContact O-CG 3.43Å; S1189-L1193 PolarHBondContact O-N 2.86Å
1190G83.1Confident71.3Confident13 Ų1354 Ų5413%0.13430%0.299CS..Hα-helixtrans-59.5-54.1179.100000113.3C1187 A1188 F1192 L1193 N1194C1187-G1190 PolarHBondContact O-N 2.88Å; A1188-G1190 VanDerWaalsContact C-N 3.3Å; A1188-G1190 PolarHBondContact O-N 3.01Å; G1190-F1192 VanDerWaalsContact C-N 3.32Å; G1190-F1192 PolarHBondContact O-N 3.24Å; G1190-L1193 PolarHBondContact O-N 3.38Å; G1190-N1194 WeakPolarHBondContact O-CB 3.14Å; G1190-N1194 PolarHBondContact O-N 2.99Å
1191P85.9Confident74.3Confident29 Ų2949.4 Ų49.419%0.18828%0.284CS..Hα-helixtrans-53.1-44.2172.9-28.833.5000113.8C1187 A1188 N1194 W1195C1187-P1191 WeakPolarHBondContact O-CD 3.35Å; A1188-P1191 WeakPolarHBondContact O-CD 3.4Å; P1191-N1194 PolarHBondContact O-N 2.82Å; P1191-W1195 HydrophobicContact CB-CH2 4.15Å; P1191-W1195 HydrophobicContact CB-CZ2 4.12Å; P1191-W1195 HydrophobicContact CB-CZ3 4.46Å; P1191-W1195 VanDerWaalsContact O-CG 3.31Å; P1191-W1195 PolarHBondContact O-N 3.46Å
1192F91.3Very high77.5Confident0 Ų043.5 Ų43.50%025%0.251CS..Hα-helixtrans-61.5-50.2179176.9-106.4000112.1W1102 L1110 F1135 V1138 A1139 L1143 L1146 A1188 S1189 G1190 N1194 W1195 T1196 V1235W1102-F1192 HydrophobicContact CH2-CB 3.77Å; W1102-F1192 AromaticContact CH2-CD2 3.83Å; W1102-F1192 HydrophobicContact CH2-CD2 3.83Å; W1102-F1192 HydrophobicContact CH2-CG 4.14Å; W1102-F1192 HydrophobicContact CZ2-CB 4.09Å; W1102-F1192 HydrophobicContact CZ3-CD2 4.48Å; L1110-F1192 HydrophobicContact CD1-CD2 4.13Å; L1110-F1192 HydrophobicContact CD1-CE2 4.19Å; F1135-F1192 AromaticContact CD1-CE2 3.78Å; F1135-F1192 HydrophobicContact CD1-CE2 3.78Å; F1135-F1192 HydrophobicContact CD1-CZ 4.25Å; F1135-F1192 HydrophobicContact CE1-CE2 4.23Å; V1138-F1192 HydrophobicContact CB-CE2 4.02Å; V1138-F1192 HydrophobicContact CB-CZ 4.21Å; V1138-F1192 HydrophobicContact CG1-CD2 3.99Å; V1138-F1192 HydrophobicContact CG1-CE2 3.49Å; V1138-F1192 VanDerWaalsContact CG1-CE2 3.49Å; V1138-F1192 HydrophobicContact CG1-CZ 3.87Å; A1139-F1192 HydrophobicContact CB-CE1 4.02Å; A1139-F1192 HydrophobicContact CB-CZ 4.01Å; L1143-F1192 HydrophobicContact CD1-CD1 3.72Å; L1143-F1192 HydrophobicContact CD1-CE1 4.15Å; L1146-F1192 HydrophobicContact CD1-CB 4.18Å; L1146-F1192 HydrophobicContact CD1-CG 4.43Å; A1188-F1192 PolarHBondContact O-N 3.45Å; S1189-F1192 PolarHBondContact O-N 3.48Å; G1190-F1192 VanDerWaalsContact C-N 3.32Å; G1190-F1192 PolarHBondContact O-N 3.24Å; F1192-N1194 PolarHBondContact O-N 2.99Å; F1192-W1195 PolarHBondContact O-N 3.04Å; F1192-W1195 VanDerWaalsContact O-N 3.08Å; F1192-T1196 PolarHBondContact O-N 3.5Å; F1192-T1196 PolarHBondContact O-OG1 3.2Å; F1192-V1235 HydrophobicContact CE1-CG2 4.49Å
1193L89.8Confident80.5Confident7 Ų735.9 Ų35.94%0.03721%0.21CC..Hα-helixtrans-57.5-38.9177.1-67.7173.8000111.4L1143 S1189 G1190 T1196 V1197 V1235 I1274 T1276 A1279L1143-L1193 HydrophobicContact CD1-CD2 4.5Å; S1189-L1193 VanDerWaalsContact O-CG 3.32Å; S1189-L1193 WeakPolarHBondContact O-CG 3.43Å; S1189-L1193 PolarHBondContact O-N 2.86Å; G1190-L1193 PolarHBondContact O-N 3.38Å; L1193-T1196 PolarHBondContact O-N 2.85Å; L1193-V1197 WeakPolarHBondContact O-CG2 3.47Å; L1193-V1197 PolarHBondContact O-N 2.95Å; L1193-V1197 VanDerWaalsContact O-N 3.08Å; L1193-V1235 HydrophobicContact CD2-CG1 3.48Å; L1193-V1235 VanDerWaalsContact CD2-CG1 3.48Å; L1193-I1274 WeakPolarHBondContact CD1-O 3.31Å; L1193-T1276 HydrophobicContact CD1-CG2 3.99Å; L1193-T1276 HydrophobicContact CD2-CG2 3.68Å; L1193-T1276 HydrophobicContact CG-CG2 4.48Å; L1193-A1279 HydrophobicContact CB-CB 3.97Å; L1193-A1279 HydrophobicContact CD2-CB 4.15Å; L1193-A1279 HydrophobicContact CG-CB 4.45Å
1194N90.2Very high83.2Confident43 Ų4332.2 Ų32.223%0.2319%0.185CC..Hα-helixtrans-68-41177.6-15110.5000111.7G1190 P1191 F1192 T1196 V1197 V1198 F1271G1190-N1194 WeakPolarHBondContact O-CB 3.14Å; G1190-N1194 PolarHBondContact O-N 2.99Å; P1191-N1194 PolarHBondContact O-N 2.82Å; F1192-N1194 PolarHBondContact O-N 2.99Å; N1194-T1196 VanDerWaalsContact C-N 3.35Å; N1194-V1197 PolarHBondContact O-N 2.97Å; N1194-V1198 VanDerWaalsContact O-CG2 3.27Å; N1194-V1198 WeakPolarHBondContact O-CG2 3.38Å; N1194-V1198 PolarHBondContact O-N 3.46Å; N1194-F1271 WeakPolarHBondContact ND2-CE1 3.31Å
1195W92.7Very high85.5Confident33 Ų3332.9 Ų32.913%0.12518%0.177CC..Hα-helixtrans-64.3-37.5173.5-63.7-32.7000112.6W1102 G1107 L1110 A1114 F1135 L1153 P1191 F1192 V1197 V1198 L1199W1102-W1195 HydrophobicContact CH2-CE3 4.41Å; W1102-W1195 AromaticContact CH2-CZ3 3.86Å; W1102-W1195 HydrophobicContact CH2-CZ3 3.86Å; W1102-W1195 HydrophobicContact CZ2-CE3 4.37Å; W1102-W1195 HydrophobicContact CZ2-CH2 4.25Å; W1102-W1195 AromaticContact CZ2-CZ3 3.53Å; W1102-W1195 HydrophobicContact CZ2-CZ3 3.53Å; G1107-W1195 WeakPolarHBondContact O-CH2 3.31Å; L1110-W1195 HydrophobicContact CB-CE3 3.99Å; L1110-W1195 HydrophobicContact CB-CZ3 4.28Å; A1114-W1195 HydrophobicContact CB-CB 4.04Å; F1135-W1195 HydrophobicContact CE1-CB 4.11Å; F1135-W1195 HydrophobicContact CZ-CB 4.46Å; L1153-W1195 HydrophobicContact CD1-CH2 4.26Å; P1191-W1195 HydrophobicContact CB-CH2 4.15Å; P1191-W1195 HydrophobicContact CB-CZ2 4.12Å; P1191-W1195 HydrophobicContact CB-CZ3 4.46Å; P1191-W1195 VanDerWaalsContact O-CG 3.31Å; P1191-W1195 PolarHBondContact O-N 3.46Å; F1192-W1195 PolarHBondContact O-N 3.04Å; F1192-W1195 VanDerWaalsContact O-N 3.08Å; W1195-V1197 VanDerWaalsContact C-N 3.33Å; W1195-V1197 PolarHBondContact O-N 3.47Å; W1195-V1198 PolarHBondContact O-N 3.28Å; W1195-L1199 VanDerWaalsContact O-CB 3.27Å; W1195-L1199 WeakPolarHBondContact O-CB 3.24Å; W1195-L1199 PolarHBondContact O-N 3.08Å
1196T93.4Very high87.2Confident3 Ų330.3 Ų30.32%0.01816%0.16CC..Hα-helixtrans-60-42.8172.9-59.20000111.5F1192 L1193 N1194 L1199 C1200 L1231 L1232F1192-T1196 PolarHBondContact O-N 3.5Å; F1192-T1196 PolarHBondContact O-OG1 3.2Å; L1193-T1196 PolarHBondContact O-N 2.85Å; N1194-T1196 VanDerWaalsContact C-N 3.35Å; T1196-L1199 WeakPolarHBondContact O-CB 3.44Å; T1196-L1199 PolarHBondContact O-N 2.82Å; T1196-C1200 PolarHBondContact O-N 3.13Å; T1196-C1200 VanDerWaalsContact O-N 3.14Å; T1196-C1200 PolarHBondContact O-SG 3.18Å; T1196-C1200 VanDerWaalsContact O-SG 3.38Å; T1196-L1231 HydrophobicContact CG2-CD1 4.46Å; T1196-L1231 HydrophobicContact CG2-CD2 3.79Å; T1196-L1231 HydrophobicContact CG2-CG 4.02Å; T1196-L1232 HydrophobicContact CG2-CD2 4.03Å
1197V93.3Very high88.4Confident11 Ų1128.5 Ų28.57%0.06715%0.148CC..Hα-helixtrans-65.4-43.2174.5171.30000111.6L1193 N1194 W1195 L1199 C1200 K1201 A1279 I1282L1193-V1197 WeakPolarHBondContact O-CG2 3.47Å; L1193-V1197 PolarHBondContact O-N 2.95Å; L1193-V1197 VanDerWaalsContact O-N 3.08Å; N1194-V1197 PolarHBondContact O-N 2.97Å; W1195-V1197 VanDerWaalsContact C-N 3.33Å; W1195-V1197 PolarHBondContact O-N 3.47Å; V1197-L1199 VanDerWaalsContact C-N 3.31Å; V1197-L1199 PolarHBondContact O-N 3.48Å; V1197-C1200 PolarHBondContact O-N 2.96Å; V1197-K1201 WeakPolarHBondContact O-CB 3.29Å; V1197-K1201 PolarHBondContact O-N 3.33Å; V1197-A1279 HydrophobicContact CG2-CB 4.11Å; V1197-A1279 WeakPolarHBondContact CG2-O 3.46Å; V1197-I1282 HydrophobicContact CG1-CB 4.43Å; V1197-I1282 HydrophobicContact CG1-CG2 3.6Å; V1197-I1282 HydrophobicContact CG2-CB 4.44Å; V1197-I1282 HydrophobicContact CG2-CG2 4.46Å
1198V93Very high88.7Confident30 Ų3032.5 Ų32.518%0.18216%0.163CC..Hα-helixtrans-62.8-39.1177.1170.70000111.3A1114 N1194 W1195 K1201 H1202A1114-V1198 HydrophobicContact CB-CG1 4.33Å; N1194-V1198 VanDerWaalsContact O-CG2 3.27Å; N1194-V1198 WeakPolarHBondContact O-CG2 3.38Å; N1194-V1198 PolarHBondContact O-N 3.46Å; W1195-V1198 PolarHBondContact O-N 3.28Å; V1198-K1201 PolarHBondContact O-N 3.13Å; V1198-H1202 WeakPolarHBondContact O-CB 3.2Å; V1198-H1202 PolarHBondContact O-N 2.92Å
1199L94.4Very high88.4Confident0 Ų036.2 Ų36.20%020%0.201CC..Hα-helixtrans-57.9-53.3175.5-174.596.4000110.4A1114 V1118 F1132 F1135 W1195 T1196 V1197 K1201 H1202 Y1203 L1228 L1231A1114-L1199 HydrophobicContact CB-CB 4.35Å; A1114-L1199 HydrophobicContact CB-CD1 4.4Å; V1118-L1199 HydrophobicContact CG2-CD1 3.53Å; V1118-L1199 HydrophobicContact CG2-CG 4.4Å; F1132-L1199 HydrophobicContact CD1-CD1 4.33Å; F1132-L1199 HydrophobicContact CD1-CD2 3.8Å; F1132-L1199 HydrophobicContact CD1-CG 4.28Å; F1132-L1199 HydrophobicContact CE1-CD1 4.19Å; F1132-L1199 HydrophobicContact CE1-CD2 4.04Å; F1132-L1199 HydrophobicContact CE1-CG 4.07Å; F1135-L1199 HydrophobicContact CD1-CD2 4.39Å; F1135-L1199 HydrophobicContact CD2-CD1 4.1Å; F1135-L1199 HydrophobicContact CD2-CD2 4.3Å; F1135-L1199 HydrophobicContact CE2-CD1 3.69Å; F1135-L1199 HydrophobicContact CG-CD2 4.2Å; F1135-L1199 HydrophobicContact CZ-CD1 3.97Å; W1195-L1199 VanDerWaalsContact O-CB 3.27Å; W1195-L1199 WeakPolarHBondContact O-CB 3.24Å; W1195-L1199 PolarHBondContact O-N 3.08Å; T1196-L1199 WeakPolarHBondContact O-CB 3.44Å; T1196-L1199 PolarHBondContact O-N 2.82Å; V1197-L1199 VanDerWaalsContact C-N 3.31Å; V1197-L1199 PolarHBondContact O-N 3.48Å; L1199-K1201 VanDerWaalsContact C-N 3.32Å; L1199-K1201 PolarHBondContact O-N 3.42Å; L1199-H1202 PolarHBondContact O-N 3.19Å; L1199-Y1203 WeakPolarHBondContact O-CB 3.16Å; L1199-Y1203 PolarHBondContact O-N 2.81Å; L1199-L1228 HydrophobicContact CD2-CD2 3.61Å; L1199-L1228 HydrophobicContact CG-CD2 4.49Å; L1199-L1231 HydrophobicContact CD2-CD2 4.04Å
1200C94Very high87.8Confident0 Ų038.6 Ų38.60%021%0.209CC..Hα-helixtrans-57.3-45.6175.5-64.10000111.4T1196 V1197 H1202 Y1203 T1204 H1286 L1287T1196-C1200 PolarHBondContact O-N 3.13Å; T1196-C1200 VanDerWaalsContact O-N 3.14Å; T1196-C1200 PolarHBondContact O-SG 3.18Å; T1196-C1200 VanDerWaalsContact O-SG 3.38Å; V1197-C1200 PolarHBondContact O-N 2.96Å; C1200-H1202 PolarHBondContact O-N 2.88Å; C1200-Y1203 PolarHBondContact O-N 3.17Å; C1200-T1204 PolarHBondContact O-N 3.14Å; C1200-T1204 PolarHBondContact O-OG1 2.95Å; C1200-H1286 HydrophobicContact CB-CB 4.19Å; C1200-L1287 HydrophobicContact CB-CD2 4.12Å; C1200-L1287 HydrophobicContact CB-CG 4.25Å
1201K93.7Very high86.8Confident111 Ų11145.1 Ų45.148%0.48324%0.24SC..Hα-helixtrans-61-46.1179.7-179.2-177.8176.9-178.40112.9V1197 V1198 L1199 K1205V1197-K1201 WeakPolarHBondContact O-CB 3.29Å; V1197-K1201 PolarHBondContact O-N 3.33Å; V1198-K1201 PolarHBondContact O-N 3.13Å; L1199-K1201 VanDerWaalsContact C-N 3.32Å; L1199-K1201 PolarHBondContact O-N 3.42Å; K1201-K1205 WeakPolarHBondContact O-CB 3.44Å; K1201-K1205 PolarHBondContact O-N 2.91Å; K1201-K1205 VanDerWaalsContact O-N 3.1Å
1202H92.5Very high85.8Confident33 Ų3348.2 Ų48.215%0.15326%0.255CS..Hα-helixtrans-71.7-38-178.6-76.6169.5000112.3A1114 V1118 L1119 V1198 L1199 C1200 K1205 N1206A1114-H1202 PolarHBondContact O-ND1 2.75Å; V1118-H1202 HydrophobicContact CG1-CB 4.3Å; L1119-H1202 HydrophobicContact CD2-CB 3.92Å; L1119-H1202 HydrophobicContact CG-CB 4.23Å; V1198-H1202 WeakPolarHBondContact O-CB 3.2Å; V1198-H1202 PolarHBondContact O-N 2.92Å; L1199-H1202 PolarHBondContact O-N 3.19Å; C1200-H1202 PolarHBondContact O-N 2.88Å; H1202-K1205 PolarHBondContact O-N 2.83Å; H1202-N1206 PolarHBondContact O-N 3.17Å
1203Y93.6Very high84.6Confident5 Ų558 Ų582%0.0230%0.298CS..Hα-helixtrans-56.8-55.7171.5176.7-105.7000110.5L1128 F1132 L1199 C1200 K1205 N1206 T1207 E1224 L1225 L1228 L1287 L1290L1128-Y1203 HydrophobicContact CD1-CD2 4.45Å; L1128-Y1203 HydrophobicContact CD1-CE2 4.19Å; F1132-Y1203 HydrophobicContact CE2-CD2 4.2Å; F1132-Y1203 HydrophobicContact CE2-CE2 4.2Å; F1132-Y1203 AromaticContact CZ-CD2 3.66Å; F1132-Y1203 HydrophobicContact CZ-CD2 3.66Å; F1132-Y1203 HydrophobicContact CZ-CE2 4.1Å; F1132-Y1203 HydrophobicContact CZ-CG 4.11Å; L1199-Y1203 WeakPolarHBondContact O-CB 3.16Å; L1199-Y1203 PolarHBondContact O-N 2.81Å; C1200-Y1203 PolarHBondContact O-N 3.17Å; Y1203-K1205 VanDerWaalsContact C-N 3.3Å; Y1203-K1205 PolarHBondContact O-N 3.46Å; Y1203-N1206 PolarHBondContact O-N 3.13Å; Y1203-N1206 VanDerWaalsContact O-N 3.08Å; Y1203-T1207 PolarHBondContact O-N 2.85Å; Y1203-T1207 VanDerWaalsContact O-N 3.12Å; Y1203-T1207 PolarHBondContact O-OG1 3.41Å; Y1203-E1224 HydrophobicContact CE2-CB 4.36Å; Y1203-E1224 WeakPolarHBondContact CE2-OE2 3.2Å; Y1203-E1224 VanDerWaalsContact CZ-OE2 3.23Å; Y1203-E1224 WeakPolarHBondContact OH-CB 3.23Å; Y1203-E1224 PolarHBondContact OH-OE2 3.26Å; Y1203-L1225 HydrophobicContact CE1-CD2 4.13Å; Y1203-L1228 HydrophobicContact CD1-CD1 3.52Å; Y1203-L1228 HydrophobicContact CE1-CD1 3.83Å; Y1203-L1228 HydrophobicContact CG-CD1 3.95Å; Y1203-L1287 HydrophobicContact CD1-CD2 4.1Å; Y1203-L1290 HydrophobicContact CD1-CD1 3.89Å; Y1203-L1290 HydrophobicContact CE1-CD1 3.55Å
1204T90Very high83.5Confident7 Ų764.6 Ų64.64%0.04333%0.329CS..Hα-helixtrans-57.2-42.8-179.6-530000112.5C1200 N1206 T1207 Q1208 H1286 P1289 L1290C1200-T1204 PolarHBondContact O-N 3.14Å; C1200-T1204 PolarHBondContact O-OG1 2.95Å; T1204-N1206 PolarHBondContact O-N 3.44Å; T1204-T1207 PolarHBondContact O-N 3.46Å; T1204-Q1208 WeakPolarHBondContact O-CB 3.37Å; T1204-Q1208 PolarHBondContact O-N 3.38Å; T1204-H1286 VanDerWaalsContact CB-O 3.29Å; T1204-H1286 WeakPolarHBondContact CB-O 3.32Å; T1204-H1286 WeakPolarHBondContact CG2-O 3.4Å; T1204-H1286 PolarHBondContact OG1-O 3Å; T1204-P1289 HydrophobicContact CG2-CB 4.45Å; T1204-P1289 HydrophobicContact CG2-CG 4.41Å; T1204-L1290 HydrophobicContact CG2-CD1 4.18Å; T1204-L1290 HydrophobicContact CG2-CD2 4.41Å; T1204-L1290 HydrophobicContact CG2-CG 3.94Å
1205K89Confident82.5Confident149 Ų14967.2 Ų67.265%0.64836%0.357SS*.Hα-helixtrans-57.8-34.1-179.3-174.3-178.6175-171.90113.2K1201 H1202 Y1203K1201-K1205 WeakPolarHBondContact O-CB 3.44Å; K1201-K1205 PolarHBondContact O-N 2.91Å; K1201-K1205 VanDerWaalsContact O-N 3.1Å; H1202-K1205 PolarHBondContact O-N 2.83Å; Y1203-K1205 VanDerWaalsContact C-N 3.3Å; Y1203-K1205 PolarHBondContact O-N 3.46Å
1206N83.9Confident81.7Confident44 Ų4469.5 Ų69.524%0.23537%0.374CS..Hα-helixtrans-87.7-31.8-178.1-80.70.5000113.3L1119 H1122 H1202 Y1203 T1204L1119-N1206 WeakPolarHBondContact CA-ND2 3.47Å; L1119-N1206 WeakPolarHBondContact CD2-ND2 3.46Å; L1119-N1206 PolarHBondContact O-ND2 3.45Å; H1122-N1206 HydrophobicContact CB-CB 4.05Å; H1122-N1206 WeakPolarHBondContact CB-ND2 3.39Å; H1202-N1206 PolarHBondContact O-N 3.17Å; Y1203-N1206 PolarHBondContact O-N 3.13Å; Y1203-N1206 VanDerWaalsContact O-N 3.08Å; T1204-N1206 PolarHBondContact O-N 3.44Å
1207T82.3Confident81.1Confident25 Ų2569.8 Ų69.815%0.15338%0.377CS..Hα-helixtrans-83.1-25.1-179-36.30000111.6Y1203 T1204 G1209 K1210 Q1221 L1290Y1203-T1207 PolarHBondContact O-N 2.85Å; Y1203-T1207 VanDerWaalsContact O-N 3.12Å; Y1203-T1207 PolarHBondContact O-OG1 3.41Å; T1204-T1207 PolarHBondContact O-N 3.46Å; T1207-G1209 PolarHBondContact O-N 3.49Å; T1207-G1209 VanDerWaalsContact O-N 3.12Å; T1207-K1210 PolarHBondContact O-N 3.17Å; T1207-Q1221 HydrophobicContact CG2-CG 4.36Å; T1207-L1290 HydrophobicContact CG2-CD1 4.49Å; T1207-L1290 HydrophobicContact CG2-CD2 4.27Å
1208Q77.1Confident80.5Confident119 Ų11975 Ų7556%0.55640%0.401SS*.THydrogen-bonded Turntrans-67.9111.6-178.9-161.5172.223.500111.5T1204 L1290T1204-Q1208 WeakPolarHBondContact O-CB 3.37Å; T1204-Q1208 PolarHBondContact O-N 3.38Å; Q1208-L1290 HydrophobicContact CB-CD2 4.49Å
1209G70.1Confident80.1Confident80 Ų8078.4 Ų78.483%0.82542%0.418SS*.THydrogen-bonded Turntrans91.94.1179.500000115.2T1207T1207-G1209 PolarHBondContact O-N 3.49Å; T1207-G1209 VanDerWaalsContact O-N 3.12Å
1210K70.5Confident79.8Confident69 Ų6980.8 Ų80.830%0.343%0.43SS..  trans-74.6125.8170.3-115.3-179.2176.4-170.40109.9H1122 N1123 T1207H1122-K1210 PolarHBondContact CD2-NZ 3.11Å; H1122-K1210 PolarHBondContact O-NZ 3.45Å; N1123-K1210 WeakPolarHBondContact OD1-CE 3.32Å; N1123-K1210 PolarHBondContact OD1-NZ 3.41Å; T1207-K1210 PolarHBondContact O-N 3.17Å
1211L61.9Low79.6Confident150 Ų15083 Ų8379%0.78544%0.441SS*.  trans-104.3103.8169.7-74.4165.7000107.5
1212N65.7Low79.4Confident94 Ų9478.4 Ų78.450%0.50342%0.421SS..  trans-93.7134176.5-69.5-10.6000109.4A1217N1212-A1217 HydrophobicContact CB-CB 3.53Å
1213F65.9Low79.3Confident204 Ų20481.5 Ų81.590%0.89544%0.436SS*.  trans-100.3-2.3178.7-67.7-84.3000112.9
1214E66.9Low79.3Confident146 Ų14681.9 Ų81.968%0.68244%0.438SS*.SBendtrans-77137.4178.3-80.5174.4165.300110.9T1216 A1217E1214-T1216 VanDerWaalsContact C-N 3.26Å; E1214-T1216 PolarHBondContact O-N 3.19Å; E1214-A1217 HydrophobicContact CB-CB 4.11Å; E1214-A1217 WeakPolarHBondContact O-CB 3.3Å; E1214-A1217 PolarHBondContact O-N 3.3Å
1215A68.4Low79.5Confident99 Ų9981.6 Ų81.682%0.81844%0.436SS*.THydrogen-bonded Turntrans-62.9-30.3-173.500000113.4
1216T76.9Confident79.8Confident80 Ų8076.7 Ų76.749%0.49142%0.415SS..THydrogen-bonded Turntrans-91.3-8.6-179.360.60000113.4E1214 E1218 D1219 D1220E1214-T1216 VanDerWaalsContact C-N 3.26Å; E1214-T1216 PolarHBondContact O-N 3.19Å; T1216-E1218 PolarHBondContact O-N 2.95Å; T1216-D1219 PolarHBondContact O-N 3.03Å; T1216-D1219 VanDerWaalsContact O-N 3.16Å; T1216-D1220 WeakPolarHBondContact O-CB 3.3Å; T1216-D1220 PolarHBondContact O-N 3.33Å; T1216-D1220 PolarHBondContact OG1-OD2 2.79Å
1217A79.4Confident80.3Confident9 Ų976.4 Ų76.47%0.07441%0.413CS..Hα-helixtrans-66-27.4-170.400000113.3N1212 E1214 Q1221N1212-A1217 HydrophobicContact CB-CB 3.53Å; E1214-A1217 HydrophobicContact CB-CB 4.11Å; E1214-A1217 WeakPolarHBondContact O-CB 3.3Å; E1214-A1217 PolarHBondContact O-N 3.3Å; A1217-Q1221 WeakPolarHBondContact O-CB 3.4Å; A1217-Q1221 PolarHBondContact O-N 2.96Å
1218E81Confident81Confident122 Ų12275.2 Ų75.257%0.5741%0.406SS*.Hα-helixtrans-72.3-48.1174.8-156.5168.4-162.600110.1T1216 D1220 Q1221 I1222T1216-E1218 PolarHBondContact O-N 2.95Å; E1218-D1220 PolarHBondContact O-N 3.33Å; E1218-Q1221 WeakPolarHBondContact O-CB 3.46Å; E1218-Q1221 PolarHBondContact O-N 2.96Å; E1218-Q1221 VanDerWaalsContact O-N 3.16Å; E1218-I1222 HydrophobicContact CG-CD1 4.25Å; E1218-I1222 VanDerWaalsContact O-CD1 3.28Å; E1218-I1222 WeakPolarHBondContact O-CD1 3.39Å; E1218-I1222 VanDerWaalsContact O-CG1 3.29Å; E1218-I1222 WeakPolarHBondContact O-CG1 3.38Å; E1218-I1222 PolarHBondContact O-N 3.07Å
1219D85Confident81.9Confident101 Ų10169.5 Ų69.554%0.5438%0.38SS..Hα-helixtrans-58.8-44.9176.4-65.1-26.1000111.8T1216 Q1221 I1222 Q1223T1216-D1219 PolarHBondContact O-N 3.03Å; T1216-D1219 VanDerWaalsContact O-N 3.16Å; D1219-Q1221 VanDerWaalsContact C-N 3.35Å; D1219-Q1221 PolarHBondContact O-N 2.77Å; D1219-I1222 WeakPolarHBondContact O-CB 3.47Å; D1219-I1222 PolarHBondContact O-N 3.03Å; D1219-Q1223 PolarHBondContact O-N 3.41Å
1220D88.1Confident83Confident49 Ų4968.4 Ų68.426%0.26236%0.355SS..Hα-helixtrans-56.5-47.5174.5-82.1-46.7000111.8S1125 T1216 E1218 I1222 Q1223 E1224S1125-D1220 VanDerWaalsContact CB-OD1 3.32Å; S1125-D1220 WeakPolarHBondContact CB-OD1 3.32Å; S1125-D1220 WeakPolarHBondContact OG-CB 3.36Å; S1125-D1220 VanDerWaalsContact OG-CG 3.25Å; S1125-D1220 PolarHBondContact OG-OD1 3.2Å; T1216-D1220 WeakPolarHBondContact O-CB 3.3Å; T1216-D1220 PolarHBondContact O-N 3.33Å; T1216-D1220 PolarHBondContact OG1-OD2 2.79Å; E1218-D1220 PolarHBondContact O-N 3.33Å; D1220-I1222 VanDerWaalsContact C-N 3.33Å; D1220-I1222 PolarHBondContact O-N 3.39Å; D1220-Q1223 PolarHBondContact O-N 3.46Å; D1220-E1224 WeakPolarHBondContact O-CB 3.37Å; D1220-E1224 VanDerWaalsContact O-CG 3.27Å; D1220-E1224 WeakPolarHBondContact O-CG 3.44Å; D1220-E1224 PolarHBondContact O-N 3.42Å
1221Q89Confident84.2Confident46 Ų4665.1 Ų65.122%0.21534%0.341CS..Hα-helixtrans-64.9-37.5178.6-174.2-177.1-6.400111.8T1207 A1217 E1218 D1219 L1225T1207-Q1221 HydrophobicContact CG2-CG 4.36Å; A1217-Q1221 WeakPolarHBondContact O-CB 3.4Å; A1217-Q1221 PolarHBondContact O-N 2.96Å; E1218-Q1221 WeakPolarHBondContact O-CB 3.46Å; E1218-Q1221 PolarHBondContact O-N 2.96Å; E1218-Q1221 VanDerWaalsContact O-N 3.16Å; D1219-Q1221 VanDerWaalsContact C-N 3.35Å; D1219-Q1221 PolarHBondContact O-N 2.77Å; Q1221-L1225 HydrophobicContact CG-CD1 4.3Å; Q1221-L1225 WeakPolarHBondContact O-CB 3.41Å; Q1221-L1225 WeakPolarHBondContact O-CG 3.39Å; Q1221-L1225 PolarHBondContact O-N 3.29Å
1222I89.4Confident85.8Confident15 Ų1558 Ų588%0.07730%0.304CS..Hα-helixtrans-63-45176.4-71.3151.9000110.1E1218 D1219 D1220 L1225 Q1226 I1298 L1301E1218-I1222 HydrophobicContact CG-CD1 4.25Å; E1218-I1222 VanDerWaalsContact O-CD1 3.28Å; E1218-I1222 WeakPolarHBondContact O-CD1 3.39Å; E1218-I1222 VanDerWaalsContact O-CG1 3.29Å; E1218-I1222 WeakPolarHBondContact O-CG1 3.38Å; E1218-I1222 PolarHBondContact O-N 3.07Å; D1219-I1222 WeakPolarHBondContact O-CB 3.47Å; D1219-I1222 PolarHBondContact O-N 3.03Å; D1220-I1222 VanDerWaalsContact C-N 3.33Å; D1220-I1222 PolarHBondContact O-N 3.39Å; I1222-L1225 PolarHBondContact O-N 2.96Å; I1222-Q1226 WeakPolarHBondContact O-CB 3.31Å; I1222-Q1226 PolarHBondContact O-N 3.08Å; I1222-I1298 HydrophobicContact CB-CD1 4.37Å; I1222-I1298 HydrophobicContact CD1-CD1 3.1Å; I1222-I1298 HydrophobicContact CG1-CD1 3.78Å; I1222-I1298 HydrophobicContact CG2-CD1 3.84Å; I1222-I1298 HydrophobicContact CG2-CG2 4.37Å; I1222-L1301 HydrophobicContact CG2-CB 4.43Å; I1222-L1301 HydrophobicContact CG2-CD2 4.42Å
1223Q91.5Very high87Confident98 Ų9854 Ų5446%0.45828%0.282SS..Hα-helixtrans-67.4-40.2-179.3-146.3146.228.600111.8D1219 D1220 Q1226 L1227D1219-Q1223 PolarHBondContact O-N 3.41Å; D1220-Q1223 PolarHBondContact O-N 3.46Å; Q1223-Q1226 PolarHBondContact O-N 2.94Å; Q1223-L1227 WeakPolarHBondContact O-CG 3.38Å; Q1223-L1227 PolarHBondContact O-N 2.9Å
1224E94Very high88.1Confident14 Ų1447.9 Ų47.97%0.06525%0.253CS..Hα-helixtrans-59.2-46.9170.8-75.4172.9173.800112.6S1125 L1128 Q1129 F1132 Y1203 D1220 Q1226 L1227 L1228S1125-E1224 VanDerWaalsContact CA-OE1 3.31Å; S1125-E1224 WeakPolarHBondContact CA-OE1 3.34Å; L1128-E1224 HydrophobicContact CB-CG 4.44Å; L1128-E1224 VanDerWaalsContact CD1-OE1 3.27Å; L1128-E1224 WeakPolarHBondContact CD1-OE1 3.48Å; Q1129-E1224 HydrophobicContact CG-CG 4.03Å; F1132-E1224 HydrophobicContact CD2-CB 4.43Å; F1132-E1224 HydrophobicContact CE2-CB 3.99Å; F1132-E1224 HydrophobicContact CE2-CG 4.14Å; Y1203-E1224 HydrophobicContact CE2-CB 4.36Å; Y1203-E1224 WeakPolarHBondContact CE2-OE2 3.2Å; Y1203-E1224 VanDerWaalsContact CZ-OE2 3.23Å; Y1203-E1224 WeakPolarHBondContact OH-CB 3.23Å; Y1203-E1224 PolarHBondContact OH-OE2 3.26Å; D1220-E1224 WeakPolarHBondContact O-CB 3.37Å; D1220-E1224 VanDerWaalsContact O-CG 3.27Å; D1220-E1224 WeakPolarHBondContact O-CG 3.44Å; D1220-E1224 PolarHBondContact O-N 3.42Å; E1224-Q1226 VanDerWaalsContact C-N 3.33Å; E1224-Q1226 PolarHBondContact O-N 3.43Å; E1224-L1227 PolarHBondContact O-N 3.03Å; E1224-L1228 WeakPolarHBondContact O-CG 2.99Å; E1224-L1228 PolarHBondContact O-N 3.38Å; E1224-L1228 VanDerWaalsContact O-N 3.07Å
1225L94.2Very high89.2Confident0 Ų041 Ų410%022%0.221CC..Hα-helixtrans-62.5-41.2176.3-78.2170.2000111.4Y1203 Q1221 I1222 L1228 L1229 L1287 L1290 I1291 L1301Y1203-L1225 HydrophobicContact CE1-CD2 4.13Å; Q1221-L1225 HydrophobicContact CG-CD1 4.3Å; Q1221-L1225 WeakPolarHBondContact O-CB 3.41Å; Q1221-L1225 WeakPolarHBondContact O-CG 3.39Å; Q1221-L1225 PolarHBondContact O-N 3.29Å; I1222-L1225 PolarHBondContact O-N 2.96Å; L1225-L1228 PolarHBondContact O-N 3.13Å; L1225-L1229 WeakPolarHBondContact O-CG 3.49Å; L1225-L1229 PolarHBondContact O-N 2.99Å; L1225-L1287 HydrophobicContact CD2-CD2 4.39Å; L1225-L1290 HydrophobicContact CD1-CB 4.48Å; L1225-L1290 HydrophobicContact CD2-CB 4.23Å; L1225-L1290 HydrophobicContact CD2-CD1 4.22Å; L1225-I1291 HydrophobicContact CD2-CG1 4.5Å; L1225-L1301 HydrophobicContact CB-CD1 3.8Å
1226Q94.3Very high89.9Confident47 Ų4736.3 Ų36.322%0.2218%0.182CC..Hα-helixtrans-63-42.8178-167.3-174.4-5.900111.4I1222 Q1223 E1224 L1228 L1229 N1230 E1300 L1301I1222-Q1226 WeakPolarHBondContact O-CB 3.31Å; I1222-Q1226 PolarHBondContact O-N 3.08Å; Q1223-Q1226 PolarHBondContact O-N 2.94Å; E1224-Q1226 VanDerWaalsContact C-N 3.33Å; E1224-Q1226 PolarHBondContact O-N 3.43Å; Q1226-L1228 PolarHBondContact O-N 2.88Å; Q1226-L1229 PolarHBondContact O-N 3.34Å; Q1226-N1230 WeakPolarHBondContact O-CB 3.45Å; Q1226-N1230 VanDerWaalsContact O-CG 3.23Å; Q1226-N1230 PolarHBondContact O-N 2.96Å; Q1226-N1230 PolarHBondContact O-ND2 3.45Å; Q1226-E1300 VanDerWaalsContact NE2-CB 3.3Å; Q1226-L1301 HydrophobicContact CB-CD1 4.1Å
1227L95.1Very high90.1Very high37 Ų3739.2 Ų39.219%0.19419%0.185CC..Hα-helixtrans-61.5-42.2174.8-74.1170000112.3Q1129 F1132 Q1223 E1224 N1230 L1231Q1129-L1227 HydrophobicContact CB-CD1 3.64Å; Q1129-L1227 HydrophobicContact CG-CD1 3.79Å; F1132-L1227 HydrophobicContact CB-CB 4Å; F1132-L1227 HydrophobicContact CB-CD1 4.44Å; F1132-L1227 HydrophobicContact CD2-CB 4.38Å; Q1223-L1227 WeakPolarHBondContact O-CG 3.38Å; Q1223-L1227 PolarHBondContact O-N 2.9Å; E1224-L1227 PolarHBondContact O-N 3.03Å; L1227-N1230 PolarHBondContact O-N 2.89Å; L1227-L1231 WeakPolarHBondContact O-CB 3.38Å; L1227-L1231 PolarHBondContact O-N 3.36Å
1228L96.2Very high90.1Very high0 Ų040 Ų400%019%0.187CC..Hα-helixtrans-66.2-42176.7-72.6169.1000111.9F1132 L1199 Y1203 E1224 L1225 Q1226 L1231 L1232 L1287F1132-L1228 HydrophobicContact CD1-CD2 3.84Å; F1132-L1228 HydrophobicContact CD1-CG 4.44Å; F1132-L1228 HydrophobicContact CD2-CD1 4.3Å; F1132-L1228 HydrophobicContact CD2-CD2 4.15Å; F1132-L1228 HydrophobicContact CD2-CG 3.85Å; F1132-L1228 HydrophobicContact CE1-CD2 3.98Å; F1132-L1228 HydrophobicContact CE1-CG 4.5Å; F1132-L1228 HydrophobicContact CE2-CD1 3.85Å; F1132-L1228 HydrophobicContact CE2-CD2 4.29Å; F1132-L1228 HydrophobicContact CE2-CG 3.92Å; F1132-L1228 HydrophobicContact CG-CD2 3.93Å; F1132-L1228 HydrophobicContact CG-CG 4.13Å; F1132-L1228 HydrophobicContact CZ-CD1 3.99Å; F1132-L1228 HydrophobicContact CZ-CD2 4.2Å; F1132-L1228 HydrophobicContact CZ-CG 4.25Å; L1199-L1228 HydrophobicContact CD2-CD2 3.61Å; L1199-L1228 HydrophobicContact CG-CD2 4.49Å; Y1203-L1228 HydrophobicContact CD1-CD1 3.52Å; Y1203-L1228 HydrophobicContact CE1-CD1 3.83Å; Y1203-L1228 HydrophobicContact CG-CD1 3.95Å; E1224-L1228 WeakPolarHBondContact O-CG 2.99Å; E1224-L1228 PolarHBondContact O-N 3.38Å; E1224-L1228 VanDerWaalsContact O-N 3.07Å; L1225-L1228 PolarHBondContact O-N 3.13Å; Q1226-L1228 PolarHBondContact O-N 2.88Å; L1228-L1231 HydrophobicContact CD2-CD2 4.5Å; L1228-L1231 WeakPolarHBondContact O-CB 3.28Å; L1228-L1231 PolarHBondContact O-N 2.99Å; L1228-L1232 WeakPolarHBondContact O-CG 3.38Å; L1228-L1232 PolarHBondContact O-N 3.46Å; L1228-L1287 HydrophobicContact CB-CD1 3.89Å; L1228-L1287 HydrophobicContact CD1-CD2 3.87Å
1229L95.4Very high89.9Confident0 Ų034.5 Ų34.50%016%0.161CC..Hα-helixtrans-64.3-41175.1-69.9170.9000111.6L1225 Q1226 L1231 L1232 N1233 L1284 L1287 I1291 L1301 A1304 F1305 L1308L1225-L1229 WeakPolarHBondContact O-CG 3.49Å; L1225-L1229 PolarHBondContact O-N 2.99Å; Q1226-L1229 PolarHBondContact O-N 3.34Å; L1229-L1231 PolarHBondContact O-N 3.21Å; L1229-L1232 PolarHBondContact O-N 3.24Å; L1229-N1233 PolarHBondContact O-N 2.95Å; L1229-L1284 HydrophobicContact CD2-CD1 3.84Å; L1229-L1287 HydrophobicContact CD2-CD1 4.47Å; L1229-I1291 HydrophobicContact CD2-CD1 4.45Å; L1229-L1301 HydrophobicContact CD1-CD1 3.68Å; L1229-L1301 HydrophobicContact CD1-CG 4.45Å; L1229-A1304 HydrophobicContact CB-CB 4.05Å; L1229-A1304 HydrophobicContact CD1-CB 4.24Å; L1229-F1305 HydrophobicContact CD1-CB 4.04Å; L1229-F1305 HydrophobicContact CD2-CD2 4.47Å; L1229-L1308 HydrophobicContact CD2-CD2 3.67Å
1230N93.6Very high89Confident57 Ų5735.5 Ų35.531%0.30516%0.161SC..Hα-helixtrans-63.8-39.2175.4-75.4-21.4000112.4Q1226 L1227 N1233 R1234Q1226-N1230 WeakPolarHBondContact O-CB 3.45Å; Q1226-N1230 VanDerWaalsContact O-CG 3.23Å; Q1226-N1230 PolarHBondContact O-N 2.96Å; Q1226-N1230 PolarHBondContact O-ND2 3.45Å; L1227-N1230 PolarHBondContact O-N 2.89Å; N1230-N1233 WeakPolarHBondContact O-CB 3.43Å; N1230-N1233 PolarHBondContact O-N 3.37Å; N1230-R1234 WeakPolarHBondContact O-CG 3.42Å; N1230-R1234 PolarHBondContact O-N 3.27Å
1231L95.8Very high88Confident0 Ų037.5 Ų37.50%017%0.169CC..Hα-helixtrans-58.2-48.6171.5165.761.9000111.1F1135 A1139 T1196 L1199 L1227 L1228 L1229 N1233 R1234 V1235F1135-L1231 HydrophobicContact CB-CD1 3.92Å; F1135-L1231 HydrophobicContact CB-CD2 3.61Å; F1135-L1231 HydrophobicContact CB-CG 4.42Å; F1135-L1231 HydrophobicContact CD1-CD2 4.5Å; F1135-L1231 HydrophobicContact CG-CD2 4.35Å; F1135-L1231 WeakPolarHBondContact O-CD1 3.33Å; A1139-L1231 HydrophobicContact CB-CD1 3.82Å; T1196-L1231 HydrophobicContact CG2-CD1 4.46Å; T1196-L1231 HydrophobicContact CG2-CD2 3.79Å; T1196-L1231 HydrophobicContact CG2-CG 4.02Å; L1199-L1231 HydrophobicContact CD2-CD2 4.04Å; L1227-L1231 WeakPolarHBondContact O-CB 3.38Å; L1227-L1231 PolarHBondContact O-N 3.36Å; L1228-L1231 HydrophobicContact CD2-CD2 4.5Å; L1228-L1231 WeakPolarHBondContact O-CB 3.28Å; L1228-L1231 PolarHBondContact O-N 2.99Å; L1229-L1231 PolarHBondContact O-N 3.21Å; L1231-N1233 VanDerWaalsContact C-N 3.3Å; L1231-N1233 PolarHBondContact O-N 3.37Å; L1231-R1234 PolarHBondContact O-N 2.89Å; L1231-V1235 HydrophobicContact CD1-CG2 4.19Å; L1231-V1235 VanDerWaalsContact O-CG2 3.31Å; L1231-V1235 WeakPolarHBondContact O-CG2 3.29Å; L1231-V1235 PolarHBondContact O-N 3.06Å
1232L95.4Very high86.9Confident1 Ų135.7 Ų35.71%0.00516%0.161CC..Hα-helixtrans-64-36.3178.4-60.5173.8000111.7T1196 L1228 L1229 V1235 L1236 A1280 L1284 L1287 L1308T1196-L1232 HydrophobicContact CG2-CD2 4.03Å; L1228-L1232 WeakPolarHBondContact O-CG 3.38Å; L1228-L1232 PolarHBondContact O-N 3.46Å; L1229-L1232 PolarHBondContact O-N 3.24Å; L1232-V1235 PolarHBondContact O-N 3.11Å; L1232-L1236 PolarHBondContact O-N 2.83Å; L1232-A1280 HydrophobicContact CB-CB 4.5Å; L1232-L1284 HydrophobicContact CD1-CB 4.39Å; L1232-L1287 HydrophobicContact CD1-CD1 4.02Å; L1232-L1308 HydrophobicContact CB-CD1 3.68Å; L1232-L1308 HydrophobicContact CB-CD2 3.95Å; L1232-L1308 HydrophobicContact CD1-CD2 4.02Å
1233N91.5Very high85.6Confident10 Ų1039.5 Ų39.55%0.05317%0.174CC..Hα-helixtrans-62.8-47.2174-89.9-36000111.7L1229 N1230 L1231 V1235 L1236 Y1237 A1304 S1307 L1308L1229-N1233 PolarHBondContact O-N 2.95Å; N1230-N1233 WeakPolarHBondContact O-CB 3.43Å; N1230-N1233 PolarHBondContact O-N 3.37Å; L1231-N1233 VanDerWaalsContact C-N 3.3Å; L1231-N1233 PolarHBondContact O-N 3.37Å; N1233-V1235 VanDerWaalsContact C-N 3.32Å; N1233-V1235 PolarHBondContact O-N 3.18Å; N1233-L1236 CarbonylContact O-C 3.59Å; N1233-L1236 WeakPolarHBondContact O-CA 3.26Å; N1233-L1236 WeakPolarHBondContact O-CB 3.19Å; N1233-L1236 PolarHBondContact O-N 3.11Å; N1233-L1236 VanDerWaalsContact O-N 3.07Å; N1233-Y1237 HydrophobicContact CB-CE2 4.23Å; N1233-Y1237 WeakPolarHBondContact O-CD2 3.45Å; N1233-Y1237 PolarHBondContact O-N 3.47Å; N1233-A1304 PolarHBondContact ND2-O 2.92Å; N1233-S1307 PolarHBondContact ND2-OG 3.43Å; N1233-L1308 HydrophobicContact CB-CD1 4.33Å; N1233-L1308 WeakPolarHBondContact OD1-CA 3.07Å; N1233-L1308 VanDerWaalsContact OD1-CB 3.28Å; N1233-L1308 WeakPolarHBondContact OD1-CB 3.35Å; N1233-L1308 WeakPolarHBondContact OD1-CD1 3.32Å; N1233-L1308 PolarHBondContact OD1-N 3.2Å
1234R88.8Confident84Confident75 Ų7541.6 Ų41.628%0.28319%0.188SC..Hα-helixtrans-58.9-43.2175.7-72.1172.3-177-153.6-5.2112.3S1136 D1137 A1139 E1140 N1230 L1231 L1236 Y1237 H1238S1136-R1234 PolarHBondContact O-NH1 3.13Å; S1136-R1234 VanDerWaalsContact OG-CD 3.23Å; S1136-R1234 WeakPolarHBondContact OG-CD 3.49Å; S1136-R1234 PolarHBondContact OG-NE 2.92Å; S1136-R1234 PolarHBondContact OG-NH1 3.13Å; D1137-R1234 IonicContact OD1-NH1 2.72Å; A1139-R1234 HydrophobicContact CB-CB 4.29Å; E1140-R1234 IonicContact OE2-CZ 3.09Å; E1140-R1234 IonicContact OE2-NE 2.76Å; E1140-R1234 IonicContact OE2-NH1 3.14Å; E1140-R1234 PolarHBondContact OE2-NH1 3.17Å; E1140-R1234 IonicContact OE2-NH2 2.71Å; E1140-R1234 PolarHBondContact OE2-NH2 2.94Å; N1230-R1234 WeakPolarHBondContact O-CG 3.42Å; N1230-R1234 PolarHBondContact O-N 3.27Å; L1231-R1234 PolarHBondContact O-N 2.89Å; R1234-L1236 VanDerWaalsContact C-N 3.28Å; R1234-L1236 PolarHBondContact O-N 3.29Å; R1234-Y1237 PolarHBondContact O-N 3.46Å; R1234-H1238 PolarHBondContact O-CD2 2.89Å; R1234-H1238 VanDerWaalsContact O-CD2 3.28Å
1235V89.8Confident82.1Confident1 Ų144 Ų441%0.00621%0.206CC..Hα-helixtrans-59.4-40.6174.4170.90000111.2A1139 L1143 F1192 L1193 L1231 L1232 N1233 T1276A1139-V1235 HydrophobicContact CB-CG2 3.88Å; L1143-V1235 HydrophobicContact CD2-CG1 4.47Å; L1143-V1235 HydrophobicContact CD2-CG2 4.44Å; F1192-V1235 HydrophobicContact CE1-CG2 4.49Å; L1193-V1235 HydrophobicContact CD2-CG1 3.48Å; L1193-V1235 VanDerWaalsContact CD2-CG1 3.48Å; L1231-V1235 HydrophobicContact CD1-CG2 4.19Å; L1231-V1235 VanDerWaalsContact O-CG2 3.31Å; L1231-V1235 WeakPolarHBondContact O-CG2 3.29Å; L1231-V1235 PolarHBondContact O-N 3.06Å; L1232-V1235 PolarHBondContact O-N 3.11Å; N1233-V1235 VanDerWaalsContact C-N 3.32Å; N1233-V1235 PolarHBondContact O-N 3.18Å; V1235-T1276 HydrophobicContact CG1-CG2 3.54Å; V1235-T1276 WeakPolarHBondContact O-CG2 3.43Å
1236L84.5Confident79.8Confident0 Ų045.9 Ų45.90%023%0.225CC..Hα-helixtrans-70.3-36.3177.2-97.4152.2000113.9L1232 N1233 R1234 H1238 E1239 V1277 A1280 L1308 Y1311 A1312 L1315L1232-L1236 PolarHBondContact O-N 2.83Å; N1233-L1236 CarbonylContact O-C 3.59Å; N1233-L1236 WeakPolarHBondContact O-CA 3.26Å; N1233-L1236 WeakPolarHBondContact O-CB 3.19Å; N1233-L1236 PolarHBondContact O-N 3.11Å; N1233-L1236 VanDerWaalsContact O-N 3.07Å; R1234-L1236 VanDerWaalsContact C-N 3.28Å; R1234-L1236 PolarHBondContact O-N 3.29Å; L1236-H1238 PolarHBondContact O-N 2.89Å; L1236-E1239 WeakPolarHBondContact O-CB 3.46Å; L1236-E1239 PolarHBondContact O-N 3.25Å; L1236-V1277 HydrophobicContact CD2-CB 4.4Å; L1236-V1277 HydrophobicContact CD2-CG1 4.39Å; L1236-V1277 HydrophobicContact CD2-CG2 3.91Å; L1236-A1280 HydrophobicContact CD1-CB 3.4Å; L1236-A1280 VanDerWaalsContact CD1-CB 3.4Å; L1236-A1280 HydrophobicContact CG-CB 3.7Å; L1236-L1308 HydrophobicContact CD1-CD1 3.33Å; L1236-L1308 HydrophobicContact CD1-CG 4.33Å; L1236-Y1311 HydrophobicContact CB-CD1 4.15Å; L1236-Y1311 HydrophobicContact CB-CE1 4.4Å; L1236-Y1311 HydrophobicContact CD2-CD1 4.43Å; L1236-A1312 HydrophobicContact CD1-CB 4.07Å; L1236-A1312 HydrophobicContact CD2-CB 4.32Å; L1236-L1315 HydrophobicContact CD2-CD1 3.56Å
1237Y80.9Confident77.4Confident141 Ų14145.9 Ų45.955%0.55323%0.234SC*.Hα-helixtrans-59.3-31.9179.4-78.9-57.9000112.9N1233 R1234 E1239 Y1311N1233-Y1237 HydrophobicContact CB-CE2 4.23Å; N1233-Y1237 WeakPolarHBondContact O-CD2 3.45Å; N1233-Y1237 PolarHBondContact O-N 3.47Å; R1234-Y1237 PolarHBondContact O-N 3.46Å; Y1237-E1239 VanDerWaalsContact C-N 3.32Å; Y1237-E1239 PolarHBondContact O-N 2.9Å; Y1237-Y1311 HydrophobicContact CD1-CE1 4.12Å; Y1237-Y1311 HydrophobicContact CE1-CE1 4.45Å
1238H78.7Confident74.8Confident27 Ų2746.8 Ų46.813%0.12524%0.241CC..THydrogen-bonded Turntrans-80.9-3.9177.1-67.6-65.2000114.2A1139 L1143 I1144 R1234 L1236 F1240 E1241 L1242A1139-H1238 PolarHBondContact O-CD2 3.4Å; A1139-H1238 PolarHBondContact O-NE2 3.26Å; L1143-H1238 HydrophobicContact CD2-CB 4.26Å; I1144-H1238 WeakPolarHBondContact CD1-ND1 3.18Å; I1144-H1238 WeakPolarHBondContact CG1-ND1 3.47Å; R1234-H1238 PolarHBondContact O-CD2 2.89Å; R1234-H1238 VanDerWaalsContact O-CD2 3.28Å; L1236-H1238 PolarHBondContact O-N 2.89Å; H1238-F1240 PolarHBondContact O-N 2.83Å; H1238-F1240 VanDerWaalsContact O-N 3.13Å; H1238-E1241 IonicContact CE1-OE2 3.85Å; H1238-E1241 IonicContact CG-OE2 3.17Å; H1238-E1241 IonicContact ND1-OE2 2.82Å; H1238-E1241 PolarHBondContact ND1-OE2 2.97Å; H1238-E1241 PolarHBondContact O-N 2.8Å; H1238-E1241 VanDerWaalsContact O-N 3.1Å; H1238-L1242 HydrophobicContact CB-CD1 4.01Å; H1238-L1242 HydrophobicContact CB-CG 4.16Å; H1238-L1242 WeakPolarHBondContact O-CB 3.12Å; H1238-L1242 WeakPolarHBondContact O-CG 3.41Å; H1238-L1242 PolarHBondContact O-N 3.42Å
1239E76.8Confident71.8Confident5 Ų555.8 Ų55.82%0.02328%0.28CS..Hα-helixtrans-52.5-41.3-177174.767.7-174.500112.7L1236 Y1237 R1243 T1276 V1277 L1315L1236-E1239 WeakPolarHBondContact O-CB 3.46Å; L1236-E1239 PolarHBondContact O-N 3.25Å; Y1237-E1239 VanDerWaalsContact C-N 3.32Å; Y1237-E1239 PolarHBondContact O-N 2.9Å; E1239-R1243 VanDerWaalsContact CG-NH2 3.34Å; E1239-R1243 WeakPolarHBondContact O-CG 3.31Å; E1239-R1243 PolarHBondContact O-N 3.35Å; E1239-R1243 IonicContact OE1-CZ 3.59Å; E1239-R1243 IonicContact OE1-NE 2.68Å; E1239-R1243 PolarHBondContact OE1-NE 3.49Å; E1239-R1243 IonicContact OE1-NH2 3.24Å; E1239-R1243 PolarHBondContact OE1-NH2 3.44Å; E1239-T1276 WeakPolarHBondContact OE2-CB 3.35Å; E1239-T1276 PolarHBondContact OE2-OG1 3.17Å; E1239-V1277 HydrophobicContact CG-CG2 3.82Å; E1239-V1277 PolarHBondContact OE2-N 2.94Å; E1239-L1315 HydrophobicContact CB-CD1 4.25Å; E1239-L1315 HydrophobicContact CG-CD1 4.28Å
1240F66.8Low68.6Low122 Ų12261.7 Ų61.754%0.53531%0.311SS..Hα-helixtrans-67.5-44.5-179.4-121.7-83.2000112.1H1238 R1243 L1244 L1315H1238-F1240 PolarHBondContact O-N 2.83Å; H1238-F1240 VanDerWaalsContact O-N 3.13Å; F1240-R1243 PolarHBondContact O-N 2.86Å; F1240-L1244 HydrophobicContact CD1-CD1 4.49Å; F1240-L1244 WeakPolarHBondContact O-CG 3.31Å; F1240-L1244 PolarHBondContact O-N 3.46Å; F1240-L1315 HydrophobicContact CD2-CD2 4.34Å; F1240-L1315 HydrophobicContact CE2-CD2 4.49Å
1241E66.6Low65.6Low91 Ų9164 Ų6443%0.42533%0.331SS..Hα-helixtrans-66.5-39.5178.3-65177.8152.300111.7I1144 H1238 L1244 S1245I1144-E1241 WeakPolarHBondContact CD1-OE2 3.44Å; I1144-E1241 WeakPolarHBondContact CG1-OE2 3.2Å; H1238-E1241 IonicContact CE1-OE2 3.85Å; H1238-E1241 IonicContact CG-OE2 3.17Å; H1238-E1241 IonicContact ND1-OE2 2.82Å; H1238-E1241 PolarHBondContact ND1-OE2 2.97Å; H1238-E1241 PolarHBondContact O-N 2.8Å; H1238-E1241 VanDerWaalsContact O-N 3.1Å; E1241-L1244 PolarHBondContact O-N 3.35Å; E1241-S1245 PolarHBondContact O-N 2.86Å; E1241-S1245 PolarHBondContact O-OG 3.21Å
1242L65.6Low62.2Low9 Ų972.6 Ų72.65%0.04737%0.372CS..Hα-helixtrans-65.7-37.8176.8-66.1171.8000112L1143 V1147 H1238 S1245 T1276L1143-L1242 HydrophobicContact CD2-CD1 4.21Å; L1143-L1242 HydrophobicContact CG-CD1 4.33Å; V1147-L1242 HydrophobicContact CG2-CD2 3.1Å; H1238-L1242 HydrophobicContact CB-CD1 4.01Å; H1238-L1242 HydrophobicContact CB-CG 4.16Å; H1238-L1242 WeakPolarHBondContact O-CB 3.12Å; H1238-L1242 WeakPolarHBondContact O-CG 3.41Å; H1238-L1242 PolarHBondContact O-N 3.42Å; L1242-S1245 WeakPolarHBondContact CA-OG 3.47Å; L1242-S1245 PolarHBondContact O-OG 3.11Å; L1242-T1276 HydrophobicContact CD1-CG2 3.4Å; L1242-T1276 WeakPolarHBondContact CD1-OG1 3.49Å
1243R62.5Low58.9Low94 Ų9478 Ų7836%0.35540%0.404SS..Hα-helixtrans-66.5-42172.3-76.9-178.7-160159.64.9111.8E1239 F1240 S1245 G1246E1239-R1243 VanDerWaalsContact CG-NH2 3.34Å; E1239-R1243 WeakPolarHBondContact O-CG 3.31Å; E1239-R1243 PolarHBondContact O-N 3.35Å; E1239-R1243 IonicContact OE1-CZ 3.59Å; E1239-R1243 IonicContact OE1-NE 2.68Å; E1239-R1243 PolarHBondContact OE1-NE 3.49Å; E1239-R1243 IonicContact OE1-NH2 3.24Å; E1239-R1243 PolarHBondContact OE1-NH2 3.44Å; F1240-R1243 PolarHBondContact O-N 2.86Å; R1243-S1245 VanDerWaalsContact C-N 3.3Å; R1243-S1245 PolarHBondContact O-N 3.34Å; R1243-G1246 PolarHBondContact O-N 3.49Å
1244L56.8Low55.8Low143 Ų14384 Ų8475%0.74944%0.437SS*.Hα-helixtrans-65.5-32.5179.6-75.6165.9000112.6F1240 E1241 G1246F1240-L1244 HydrophobicContact CD1-CD1 4.49Å; F1240-L1244 WeakPolarHBondContact O-CG 3.31Å; F1240-L1244 PolarHBondContact O-N 3.46Å; E1241-L1244 PolarHBondContact O-N 3.35Å; L1244-G1246 PolarHBondContact O-N 3.25Å
1245S54.8Low52.8Low63 Ų6386.2 Ų86.244%0.44145%0.454SS..THydrogen-bonded Turntrans-77.32.8178.336.50000114.1E1241 L1242 R1243 A1247E1241-S1245 PolarHBondContact O-N 2.86Å; E1241-S1245 PolarHBondContact O-OG 3.21Å; L1242-S1245 WeakPolarHBondContact CA-OG 3.47Å; L1242-S1245 PolarHBondContact O-OG 3.11Å; R1243-S1245 VanDerWaalsContact C-N 3.3Å; R1243-S1245 PolarHBondContact O-N 3.34Å; S1245-A1247 VanDerWaalsContact C-N 3.34Å; S1245-A1247 PolarHBondContact O-N 3.43Å
1246G45.2Very low49.7Very low40 Ų4094 Ų9441%0.41249%0.49SS..THydrogen-bonded Turntrans80.74.2166.300000115.8R1243 L1244 V1248R1243-G1246 PolarHBondContact O-N 3.49Å; L1244-G1246 PolarHBondContact O-N 3.25Å; G1246-V1248 VanDerWaalsContact C-N 3.31Å; G1246-V1248 PolarHBondContact O-N 2.75Å
1247A45.1Very low46.9Very low48 Ų48100.7 Ų100.740%0.39753%0.525SS..  trans-83.5-3.4-178.500000115.3V1147 S1245V1147-A1247 HydrophobicContact CB-CB 4.46Å; V1147-A1247 HydrophobicContact CG1-CB 3.12Å; S1245-A1247 VanDerWaalsContact C-N 3.34Å; S1245-A1247 PolarHBondContact O-N 3.43Å
1248V39.1Very low44.2Very low56 Ų5698.5 Ų98.534%0.33953%0.526SS..  trans-116.774.8165.4-1710000107G1246 L1250G1246-V1248 VanDerWaalsContact C-N 3.31Å; G1246-V1248 PolarHBondContact O-N 2.75Å; V1248-L1250 PolarHBondContact O-N 2.87Å
1249F33.8Very low41.7Very low189 Ų189100.7 Ų100.783%0.82954%0.538SS*.  trans-62.399.5152.6-98.6-84.3000105.9S1251F1249-S1251 PolarHBondContact O-N 3.31Å
1250L29.2Very low39.1Very low123 Ų123108.7 Ų108.764%0.64458%0.575SS**  trans-39.8116.2147-71.2167.3000105.3V1248 Q1252V1248-L1250 PolarHBondContact O-N 2.87Å; L1250-Q1252 PolarHBondContact O-N 2.88Å
1251S29.6Very low37.1Very low105 Ų105107.5 Ų107.573%0.73458%0.58SS**  trans-58.783.8159.558.40000106.7F1249 V1253F1249-S1251 PolarHBondContact O-N 3.31Å; S1251-V1253 PolarHBondContact O-N 3.2Å
1252Q25.4Very low35Very low182 Ų182110.7 Ų110.785%0.8560%0.6SS**  trans-72.964.1146.9-77.8-175.1-16.300106.3L1250L1250-Q1252 PolarHBondContact O-N 2.88Å
1253V26Very low33Very low113 Ų113114.7 Ų114.769%0.68563%0.629SS**SBendtrans-117.798.8153.1-178.50000102.4S1251S1251-V1253 PolarHBondContact O-N 3.2Å
1254D25.8Very low31.3Very low138 Ų138117.7 Ų117.774%0.73865%0.65SS**SBendtrans31.4110.8155.4-57.5-34.7000117E1256D1254-E1256 PolarHBondContact O-N 3.49Å
1255N25.1Very low29.7Very low120 Ų120118.1 Ų118.164%0.64265%0.653SS**SBendtrans31.979.6142.5-73.4-28.1000115.8H1396N1255-H1396 PolarHBondContact OD1-NE2 3.44Å
1256E25.4Very low28.3Very low165 Ų165119.3 Ų119.377%0.77166%0.662SS**  trans170.991.3149.6-97.3164.5-157.800109.4D1254 V1258D1254-E1256 PolarHBondContact O-N 3.49Å; E1256-V1258 VanDerWaalsContact C-N 3.27Å; E1256-V1258 HydrophobicContact CB-CG2 4.32Å; E1256-V1258 PolarHBondContact O-N 3.29Å; E1256-V1258 VanDerWaalsContact O-N 3.13Å
1257L24.9Very low27.4Very low140 Ų140126.9 Ų126.973%0.73369%0.686SS**  trans-78.984.4160.6-95.5161.3000107.5I1259L1257-I1259 PolarHBondContact O-N 2.92Å; L1257-I1259 VanDerWaalsContact O-N 3.11Å
1258V25.3Very low26.4Very low95 Ų95131.5 Ų131.558%0.57670%0.704SS**  trans-65.5108.5171.3177.80000108.7E1256 Q1260E1256-V1258 VanDerWaalsContact C-N 3.27Å; E1256-V1258 HydrophobicContact CB-CG2 4.32Å; E1256-V1258 PolarHBondContact O-N 3.29Å; E1256-V1258 VanDerWaalsContact O-N 3.13Å; V1258-Q1260 HydrophobicContact CG1-CG 4.02Å
1259I25.4Very low25.8Very low74 Ų74133.3 Ų133.338%0.37972%0.72SS.*  trans-80.9109.6161.9-63.4171.5000106.1L1257 P1261 N1402L1257-I1259 PolarHBondContact O-N 2.92Å; L1257-I1259 VanDerWaalsContact O-N 3.11Å; I1259-P1261 VanDerWaalsContact O-CD 3.28Å; I1259-P1261 WeakPolarHBondContact O-CD 3.26Å; I1259-N1402 WeakPolarHBondContact CD1-ND2 3.45Å
1260Q23.4Very low25.7Very low172 Ų172130.6 Ų130.680%0.80472%0.719SS**  trans-91.2111.9160-79.3-172.71.200108.8V1258V1258-Q1260 HydrophobicContact CG1-CG 4.02Å
1261P24.6Very low26Very low97 Ų97131.2 Ų131.263%0.6372%0.716SS**  trans-82.4142.9158.533.8-27.2000109.1I1259I1259-P1261 VanDerWaalsContact O-CD 3.28Å; I1259-P1261 WeakPolarHBondContact O-CD 3.26Å
1262D22.9Very low26.6Very low158 Ų158131 Ų13185%0.84572%0.715SS**  trans6791.1157.5-53.4-27.3000119
1263S23.1Very low27.9Very low93 Ų93126 Ų12665%0.6570%0.704SS**  trans-143.19813668.30000111.3N1265S1263-N1265 PolarHBondContact O-N 3.41Å
1264I26.5Very low29.9Very low158 Ų158122 Ų12281%0.8168%0.679SS**  trans-58.1121.2154.6-63.5163.3000106
1265N23.5Very low32.2Very low152 Ų152116.9 Ų116.981%0.81365%0.654SS**  trans106.469.1178.2-53.8-28.3000116.4S1263S1263-N1265 PolarHBondContact O-N 3.41Å
1266S23.9Very low34.9Very low88 Ų88111.4 Ų111.462%0.61562%0.624SS**  trans-158121.3143.453.80000109.3D1268S1266-D1268 PolarHBondContact O-N 3.3Å; S1266-D1268 VanDerWaalsContact O-N 3.15Å
1267Q27.1Very low37.7Very low199 Ų199103.5 Ų103.593%0.9359%0.587SS**SBendtrans-73.910.9-180-79.1-176.8-41.400114.3
1268D23.9Very low40.7Very low144 Ų14496.9 Ų96.977%0.7755%0.553SS**  trans-114.368.3-179-65.1-31.6000110.5S1266 T1270S1266-D1268 PolarHBondContact O-N 3.3Å; S1266-D1268 VanDerWaalsContact O-N 3.15Å; D1268-T1270 PolarHBondContact O-N 3.47Å
1269S27.4Very low43.7Very low95 Ų9592.5 Ų92.566%0.66453%0.526SS*.  trans-82.396.3166.261.50000109F1271S1269-F1271 PolarHBondContact O-N 2.87Å; S1269-F1271 VanDerWaalsContact O-N 3.1Å
1270T30.6Very low46.9Very low132 Ų13289 Ų8981%0.8151%0.509SS*.  trans-56.3112.6163.347.70000108.5D1268 S1272D1268-T1270 PolarHBondContact O-N 3.47Å; T1270-S1272 PolarHBondContact O-N 3.29Å
1271F35.7Very low50.2Low135 Ų13581 Ų8159%0.59247%0.472SS*.  trans-56.493.7-178.2-76.1-97000111.3N1194 S1269 A1273N1194-F1271 WeakPolarHBondContact ND2-CE1 3.31Å; S1269-F1271 PolarHBondContact O-N 2.87Å; S1269-F1271 VanDerWaalsContact O-N 3.1Å; F1271-A1273 PolarHBondContact O-N 2.85Å
1272S42.8Very low53.4Low101 Ų10178 Ų7871%0.70645%0.45SS*.PPolyproline II helixtrans-75.7121.4166.374.20000108.2T1270 I1274T1270-S1272 PolarHBondContact O-N 3.29Å; S1272-I1274 PolarHBondContact O-N 3.32Å
1273A52.4Low56.7Low76 Ų7670.4 Ų70.463%0.62841%0.409SS*.PPolyproline II helixtrans-54.5124.8-179.500000111.1F1271F1271-A1273 PolarHBondContact O-N 2.85Å
1274I67.6Low60.1Low29 Ų2966.2 Ų66.215%0.14938%0.38CS..PPolyproline II helixtrans-83125.9179.1-56.8171.8000107.7L1193 S1272 D1278 A1279 I1282L1193-I1274 WeakPolarHBondContact CD1-O 3.31Å; S1272-I1274 PolarHBondContact O-N 3.32Å; I1274-D1278 HydrophobicContact CG2-CB 3.72Å; I1274-A1279 HydrophobicContact CG2-CB 3.99Å; I1274-I1282 HydrophobicContact CG2-CD1 4.33Å
1275P74.5Confident63.3Low32 Ų3258.7 Ų58.721%0.20834%0.341CS..PPolyproline II helixtrans-58.8150.5172.3-21.831.7000111.7V1277 D1278 A1279P1275-V1277 PolarHBondContact O-N 3.46Å; P1275-D1278 HydrophobicContact CB-CB 4.35Å; P1275-D1278 HydrophobicContact CG-CB 4.49Å; P1275-D1278 WeakPolarHBondContact CG-OD2 3.33Å; P1275-D1278 WeakPolarHBondContact O-CA 3.22Å; P1275-D1278 WeakPolarHBondContact O-CB 3.35Å; P1275-D1278 PolarHBondContact O-N 2.93Å; P1275-A1279 PolarHBondContact O-N 3.05Å
1276T81.6Confident66.6Low4 Ų453.7 Ų53.73%0.02531%0.313CS..Hα-helixtrans-58.2-45.3-174-3.20000113L1143 L1193 V1235 E1239 L1242 D1278 A1279 A1280L1143-T1276 HydrophobicContact CD2-CG2 4.44Å; L1193-T1276 HydrophobicContact CD1-CG2 3.99Å; L1193-T1276 HydrophobicContact CD2-CG2 3.68Å; L1193-T1276 HydrophobicContact CG-CG2 4.48Å; V1235-T1276 HydrophobicContact CG1-CG2 3.54Å; V1235-T1276 WeakPolarHBondContact O-CG2 3.43Å; E1239-T1276 WeakPolarHBondContact OE2-CB 3.35Å; E1239-T1276 PolarHBondContact OE2-OG1 3.17Å; L1242-T1276 HydrophobicContact CD1-CG2 3.4Å; L1242-T1276 WeakPolarHBondContact CD1-OG1 3.49Å; T1276-D1278 VanDerWaalsContact C-N 3.32Å; T1276-D1278 PolarHBondContact O-N 3.4Å; T1276-A1279 PolarHBondContact O-N 3.08Å; T1276-A1280 PolarHBondContact O-N 2.95Å
1277V85Confident70Confident0 Ų049.5 Ų49.50%028%0.283CS..Hα-helixtrans-59.1-42.4173.5-177.50000111.8L1236 E1239 P1275 A1279 A1280 V1281 L1315 R1316L1236-V1277 HydrophobicContact CD2-CB 4.4Å; L1236-V1277 HydrophobicContact CD2-CG1 4.39Å; L1236-V1277 HydrophobicContact CD2-CG2 3.91Å; E1239-V1277 HydrophobicContact CG-CG2 3.82Å; E1239-V1277 PolarHBondContact OE2-N 2.94Å; P1275-V1277 PolarHBondContact O-N 3.46Å; V1277-A1279 VanDerWaalsContact C-N 3.34Å; V1277-A1279 PolarHBondContact O-N 3.2Å; V1277-A1280 PolarHBondContact O-N 3.43Å; V1277-V1281 HydrophobicContact CG1-CG2 4.16Å; V1277-V1281 WeakPolarHBondContact O-CB 3.3Å; V1277-V1281 VanDerWaalsContact O-CG2 3.28Å; V1277-V1281 WeakPolarHBondContact O-CG2 3.4Å; V1277-V1281 PolarHBondContact O-N 2.89Å; V1277-L1315 HydrophobicContact CG2-CB 4.23Å; V1277-L1315 HydrophobicContact CG2-CD1 4.42Å; V1277-R1316 HydrophobicContact CG1-CB 4.08Å; V1277-R1316 HydrophobicContact CG2-CB 4.46Å
1278D87.4Confident73.1Confident0 Ų040.1 Ų40.10%024%0.239CC..Hα-helixtrans-67.9-37.8-178.5-68.7-10.9000110.8I1274 P1275 T1276 I1282 R1316 R1322I1274-D1278 HydrophobicContact CG2-CB 3.72Å; P1275-D1278 HydrophobicContact CB-CB 4.35Å; P1275-D1278 HydrophobicContact CG-CB 4.49Å; P1275-D1278 WeakPolarHBondContact CG-OD2 3.33Å; P1275-D1278 WeakPolarHBondContact O-CA 3.22Å; P1275-D1278 WeakPolarHBondContact O-CB 3.35Å; P1275-D1278 PolarHBondContact O-N 2.93Å; T1276-D1278 VanDerWaalsContact C-N 3.32Å; T1276-D1278 PolarHBondContact O-N 3.4Å; D1278-I1282 WeakPolarHBondContact O-CB 3.24Å; D1278-I1282 VanDerWaalsContact O-CD1 3.32Å; D1278-I1282 WeakPolarHBondContact O-CD1 3.4Å; D1278-I1282 WeakPolarHBondContact O-CG1 3.45Å; D1278-I1282 PolarHBondContact O-N 3.13Å; D1278-R1316 VanDerWaalsContact CG-NH2 3.27Å; D1278-R1316 IonicContact OD1-CZ 3.09Å; D1278-R1316 IonicContact OD1-NE 3.35Å; D1278-R1316 PolarHBondContact OD1-NE 3.37Å; D1278-R1316 IonicContact OD1-NH2 3.83Å; D1278-R1316 PolarHBondContact OD1-NH2 2.95Å; D1278-R1316 IonicContact OD2-CZ 3.66Å; D1278-R1316 IonicContact OD2-NH2 2.66Å; D1278-R1316 PolarHBondContact OD2-NH2 2.95Å; D1278-R1322 IonicContact OD2-CZ 3.36Å; D1278-R1322 IonicContact OD2-NE 3.41Å; D1278-R1322 PolarHBondContact OD2-NE 2.87Å; D1278-R1322 IonicContact OD2-NH2 3.44Å; D1278-R1322 PolarHBondContact OD2-NH2 3.41Å
1279A89.3Confident76.3Confident3 Ų336 Ų363%0.02522%0.221CC..Hα-helixtrans-63.5-44.6174.100000111.4L1193 V1197 I1274 P1275 T1276 V1277 I1282 G1283L1193-A1279 HydrophobicContact CB-CB 3.97Å; L1193-A1279 HydrophobicContact CD2-CB 4.15Å; L1193-A1279 HydrophobicContact CG-CB 4.45Å; V1197-A1279 HydrophobicContact CG2-CB 4.11Å; V1197-A1279 WeakPolarHBondContact CG2-O 3.46Å; I1274-A1279 HydrophobicContact CG2-CB 3.99Å; P1275-A1279 PolarHBondContact O-N 3.05Å; T1276-A1279 PolarHBondContact O-N 3.08Å; V1277-A1279 VanDerWaalsContact C-N 3.34Å; V1277-A1279 PolarHBondContact O-N 3.2Å; A1279-I1282 PolarHBondContact O-N 3.48Å; A1279-G1283 PolarHBondContact O-N 3.39Å
1280A92Very high79.2Confident1 Ų132 Ų321%0.00819%0.192CC..Hα-helixtrans-62.8-44.7177.300000112.3L1232 L1236 T1276 V1277 G1283 L1284L1232-A1280 HydrophobicContact CB-CB 4.5Å; L1236-A1280 HydrophobicContact CD1-CB 3.4Å; L1236-A1280 VanDerWaalsContact CD1-CB 3.4Å; L1236-A1280 HydrophobicContact CG-CB 3.7Å; T1276-A1280 PolarHBondContact O-N 2.95Å; V1277-A1280 PolarHBondContact O-N 3.43Å; A1280-G1283 PolarHBondContact O-N 3.49Å; A1280-L1284 WeakPolarHBondContact O-CB 3.25Å; A1280-L1284 PolarHBondContact O-N 3.35Å
1281V92.1Very high82.1Confident5 Ų525.9 Ų25.93%0.0315%0.154CC..Hα-helixtrans-66.3-43.91781720000111.6V1277 G1283 L1284 G1285 A1312 L1320 L1323V1277-V1281 HydrophobicContact CG1-CG2 4.16Å; V1277-V1281 WeakPolarHBondContact O-CB 3.3Å; V1277-V1281 VanDerWaalsContact O-CG2 3.28Å; V1277-V1281 WeakPolarHBondContact O-CG2 3.4Å; V1277-V1281 PolarHBondContact O-N 2.89Å; V1281-G1283 VanDerWaalsContact C-N 3.33Å; V1281-G1283 PolarHBondContact O-N 2.95Å; V1281-L1284 PolarHBondContact O-N 3.49Å; V1281-G1285 PolarHBondContact O-N 2.9Å; V1281-A1312 HydrophobicContact CG2-CB 4.17Å; V1281-L1320 HydrophobicContact CG1-CD2 3.96Å; V1281-L1323 HydrophobicContact CG1-CD1 4.09Å; V1281-L1323 HydrophobicContact CG1-CD2 4.12Å; V1281-L1323 HydrophobicContact CG1-CG 3.92Å; V1281-L1323 WeakPolarHBondContact O-CD2 3.4Å
1282I91.8Very high84.6Confident32 Ų3222 Ų2216%0.16414%0.141CC..Hα-helixtrans-63.5-41.9176.2-65.1161.9000110.4V1197 I1274 D1278 A1279 G1285 H1286 R1322V1197-I1282 HydrophobicContact CG1-CB 4.43Å; V1197-I1282 HydrophobicContact CG1-CG2 3.6Å; V1197-I1282 HydrophobicContact CG2-CB 4.44Å; V1197-I1282 HydrophobicContact CG2-CG2 4.46Å; I1274-I1282 HydrophobicContact CG2-CD1 4.33Å; D1278-I1282 WeakPolarHBondContact O-CB 3.24Å; D1278-I1282 VanDerWaalsContact O-CD1 3.32Å; D1278-I1282 WeakPolarHBondContact O-CD1 3.4Å; D1278-I1282 WeakPolarHBondContact O-CG1 3.45Å; D1278-I1282 PolarHBondContact O-N 3.13Å; A1279-I1282 PolarHBondContact O-N 3.48Å; I1282-G1285 WeakPolarHBondContact O-CA 3.13Å; I1282-G1285 PolarHBondContact O-N 2.94Å; I1282-G1285 VanDerWaalsContact O-N 3.15Å; I1282-H1286 PolarHBondContact O-CD2 2.91Å; I1282-H1286 VanDerWaalsContact O-CD2 3.31Å; I1282-H1286 PolarHBondContact O-N 3.19Å; I1282-R1322 HydrophobicContact CG1-CB 4.06Å
1283G92.5Very high86.7Confident0 Ų020.1 Ų20.10%012%0.121CC..Hα-helixtrans-57.1-50.7174.400000111.8A1279 A1280 V1281 G1285 H1286 L1287A1279-G1283 PolarHBondContact O-N 3.39Å; A1280-G1283 PolarHBondContact O-N 3.49Å; V1281-G1283 VanDerWaalsContact C-N 3.33Å; V1281-G1283 PolarHBondContact O-N 2.95Å; G1283-G1285 VanDerWaalsContact C-N 3.26Å; G1283-G1285 PolarHBondContact O-N 3.03Å; G1283-H1286 WeakPolarHBondContact O-CB 3.38Å; G1283-H1286 PolarHBondContact O-N 3.23Å; G1283-L1287 WeakPolarHBondContact O-CG 3.4Å; G1283-L1287 PolarHBondContact O-N 3.32Å
1284L94.6Very high88.2Confident5 Ų519.6 Ų19.63%0.02611%0.113CC..Hα-helixtrans-57.1-41.5173.6-178.860.1000111.6L1229 L1232 A1280 V1281 H1286 L1287 L1288 F1305 L1308L1229-L1284 HydrophobicContact CD2-CD1 3.84Å; L1232-L1284 HydrophobicContact CD1-CB 4.39Å; A1280-L1284 WeakPolarHBondContact O-CB 3.25Å; A1280-L1284 PolarHBondContact O-N 3.35Å; V1281-L1284 PolarHBondContact O-N 3.49Å; L1284-H1286 VanDerWaalsContact C-N 3.28Å; L1284-H1286 PolarHBondContact O-N 3.23Å; L1284-L1287 PolarHBondContact O-N 3.2Å; L1284-L1288 WeakPolarHBondContact O-CG 3.26Å; L1284-L1288 PolarHBondContact O-N 2.95Å; L1284-F1305 HydrophobicContact CD1-CD2 3.92Å; L1284-F1305 HydrophobicContact CD1-CE2 3.81Å; L1284-L1308 HydrophobicContact CB-CD2 4.32Å; L1284-L1308 HydrophobicContact CD1-CD2 3.95Å; L1284-L1308 HydrophobicContact CD2-CD2 4.17Å; L1284-L1308 HydrophobicContact CG-CD2 4.38Å
1285G92.7Very high89Confident0 Ų018.9 Ų18.90%011%0.11CC..Hα-helixtrans-51.6-45.7173.400000113.1V1281 I1282 G1283 L1287 Q1327V1281-G1285 PolarHBondContact O-N 2.9Å; I1282-G1285 WeakPolarHBondContact O-CA 3.13Å; I1282-G1285 PolarHBondContact O-N 2.94Å; I1282-G1285 VanDerWaalsContact O-N 3.15Å; G1283-G1285 VanDerWaalsContact C-N 3.26Å; G1283-G1285 PolarHBondContact O-N 3.03Å; G1285-L1287 VanDerWaalsContact C-N 3.33Å; G1285-Q1327 VanDerWaalsContact O-CD 3.3Å; G1285-Q1327 WeakPolarHBondContact O-CG 3.46Å; G1285-Q1327 PolarHBondContact O-NE2 3.41Å
1286H93.6Very high89.7Confident47 Ų4717.6 Ų17.622%0.21810%0.101CC..Hα-helixtrans-68-31.1176.9-70.5-52.9000113C1200 T1204 I1282 G1283 L1284 P1289C1200-H1286 HydrophobicContact CB-CB 4.19Å; T1204-H1286 VanDerWaalsContact CB-O 3.29Å; T1204-H1286 WeakPolarHBondContact CB-O 3.32Å; T1204-H1286 WeakPolarHBondContact CG2-O 3.4Å; T1204-H1286 PolarHBondContact OG1-O 3Å; I1282-H1286 PolarHBondContact O-CD2 2.91Å; I1282-H1286 VanDerWaalsContact O-CD2 3.31Å; I1282-H1286 PolarHBondContact O-N 3.19Å; G1283-H1286 WeakPolarHBondContact O-CB 3.38Å; G1283-H1286 PolarHBondContact O-N 3.23Å; L1284-H1286 VanDerWaalsContact C-N 3.28Å; L1284-H1286 PolarHBondContact O-N 3.23Å; H1286-P1289 VanDerWaalsContact O-CD 3.27Å; H1286-P1289 WeakPolarHBondContact O-CD 3.47Å
1287L94.7Very high89.8Confident0 Ų021.8 Ų21.80%013%0.127CC..Hα-helixtrans-82.4-26.9-179.2-59.7176.3000113.7C1200 Y1203 L1225 L1228 L1229 L1232 G1283 L1284 G1285 P1289 L1290 I1291C1200-L1287 HydrophobicContact CB-CD2 4.12Å; C1200-L1287 HydrophobicContact CB-CG 4.25Å; Y1203-L1287 HydrophobicContact CD1-CD2 4.1Å; L1225-L1287 HydrophobicContact CD2-CD2 4.39Å; L1228-L1287 HydrophobicContact CB-CD1 3.89Å; L1228-L1287 HydrophobicContact CD1-CD2 3.87Å; L1229-L1287 HydrophobicContact CD2-CD1 4.47Å; L1232-L1287 HydrophobicContact CD1-CD1 4.02Å; G1283-L1287 WeakPolarHBondContact O-CG 3.4Å; G1283-L1287 PolarHBondContact O-N 3.32Å; L1284-L1287 PolarHBondContact O-N 3.2Å; G1285-L1287 VanDerWaalsContact C-N 3.33Å; L1287-P1289 VanDerWaalsContact C-N 3.31Å; L1287-P1289 WeakPolarHBondContact O-CD 3.45Å; L1287-P1289 VanDerWaalsContact O-N 3.1Å; L1287-L1290 WeakPolarHBondContact O-CB 3.37Å; L1287-L1290 PolarHBondContact O-N 3.35Å; L1287-I1291 HydrophobicContact CB-CD1 4.42Å; L1287-I1291 PolarHBondContact O-N 3.26Å
1288L92.9Very high89.9Confident1 Ų123.9 Ų23.91%0.00514%0.137CC..THydrogen-bonded Turntrans-46.8-39.4-179.1-83.9168.8000115.9L1284 L1290 I1291 F1305 Q1327 F1331 L1334L1284-L1288 WeakPolarHBondContact O-CG 3.26Å; L1284-L1288 PolarHBondContact O-N 2.95Å; L1288-L1290 PolarHBondContact O-N 3.29Å; L1288-I1291 PolarHBondContact O-N 3.12Å; L1288-F1305 HydrophobicContact CD2-CE2 4.01Å; L1288-F1305 HydrophobicContact CD2-CZ 4.23Å; L1288-Q1327 HydrophobicContact CD1-CB 4.07Å; L1288-Q1327 WeakPolarHBondContact CD1-O 3.41Å; L1288-F1331 HydrophobicContact CD1-CB 3.97Å; L1288-F1331 HydrophobicContact CD2-CB 4.23Å; L1288-F1331 HydrophobicContact CD2-CD2 4.28Å; L1288-L1334 HydrophobicContact CD2-CD1 3.67Å
1289P90.2Very high89.8Confident58 Ų5828.1 Ų28.138%0.37717%0.165SC..THydrogen-bonded Turntrans-64.1-19.9177.4-21.634.2000114.9T1204 H1286 L1287T1204-P1289 HydrophobicContact CG2-CB 4.45Å; T1204-P1289 HydrophobicContact CG2-CG 4.41Å; H1286-P1289 VanDerWaalsContact O-CD 3.27Å; H1286-P1289 WeakPolarHBondContact O-CD 3.47Å; L1287-P1289 VanDerWaalsContact C-N 3.31Å; L1287-P1289 WeakPolarHBondContact O-CD 3.45Å; L1287-P1289 VanDerWaalsContact O-N 3.1Å
1290L89.8Confident89.6Confident12 Ų1233.3 Ų33.36%0.06319%0.189CC..THydrogen-bonded Turntrans-93.2-21.8177.1-60.6178.4000112.6Y1203 T1204 T1207 Q1208 L1225 L1287 L1288 T1292 N1295Y1203-L1290 HydrophobicContact CD1-CD1 3.89Å; Y1203-L1290 HydrophobicContact CE1-CD1 3.55Å; T1204-L1290 HydrophobicContact CG2-CD1 4.18Å; T1204-L1290 HydrophobicContact CG2-CD2 4.41Å; T1204-L1290 HydrophobicContact CG2-CG 3.94Å; T1207-L1290 HydrophobicContact CG2-CD1 4.49Å; T1207-L1290 HydrophobicContact CG2-CD2 4.27Å; Q1208-L1290 HydrophobicContact CB-CD2 4.49Å; L1225-L1290 HydrophobicContact CD1-CB 4.48Å; L1225-L1290 HydrophobicContact CD2-CB 4.23Å; L1225-L1290 HydrophobicContact CD2-CD1 4.22Å; L1287-L1290 WeakPolarHBondContact O-CB 3.37Å; L1287-L1290 PolarHBondContact O-N 3.35Å; L1288-L1290 PolarHBondContact O-N 3.29Å; L1290-T1292 PolarHBondContact O-N 3.37Å; L1290-N1295 PolarHBondContact O-ND2 3.47Å
1291I90.7Very high89.6Confident3 Ų333.2 Ų33.22%0.01519%0.188CC..  trans-85110.8-178.8-57.7175.3000108.4L1225 L1229 L1287 L1288 L1296 F1305 L1334L1225-I1291 HydrophobicContact CD2-CG1 4.5Å; L1229-I1291 HydrophobicContact CD2-CD1 4.45Å; L1287-I1291 HydrophobicContact CB-CD1 4.42Å; L1287-I1291 PolarHBondContact O-N 3.26Å; L1288-I1291 PolarHBondContact O-N 3.12Å; I1291-L1296 HydrophobicContact CG2-CD1 4.18Å; I1291-L1296 HydrophobicContact CG2-CD2 3.89Å; I1291-L1296 HydrophobicContact CG2-CG 3.87Å; I1291-F1305 HydrophobicContact CD1-CD2 3.71Å; I1291-F1305 HydrophobicContact CD1-CE2 4.01Å; I1291-L1334 HydrophobicContact CB-CD1 4.18Å; I1291-L1334 HydrophobicContact CG2-CD1 3.81Å
1292T87.7Confident89.5Confident52 Ų5233.5 Ų33.532%0.31919%0.191SC..  trans-106.5167.3178.260.30000111.3L1290 S1294 N1295 L1296L1290-T1292 PolarHBondContact O-N 3.37Å; T1292-S1294 PolarHBondContact O-N 3.2Å; T1292-S1294 PolarHBondContact OG1-OG 2.75Å; T1292-N1295 PolarHBondContact O-N 2.95Å; T1292-N1295 PolarHBondContact OG1-N 3.34Å; T1292-N1295 PolarHBondContact OG1-OD1 3.11Å; T1292-L1296 PolarHBondContact O-N 3.45Å
1293E87.2Confident89.3Confident62 Ų6236.3 Ų36.329%0.2920%0.203SC..THydrogen-bonded Turntrans-60.3-33.7173.7-66.5154.3-14600111.7R1333 L1334 F1337E1293-R1333 WeakPolarHBondContact OE1-CD 3.21Å; E1293-R1333 WeakPolarHBondContact OE1-CG 2.93Å; E1293-R1333 IonicContact OE1-NH1 2.79Å; E1293-R1333 PolarHBondContact OE1-NH1 3.47Å; E1293-L1334 HydrophobicContact CG-CD2 4.35Å; E1293-F1337 HydrophobicContact CB-CD2 3.75Å; E1293-F1337 HydrophobicContact CB-CE2 3.8Å; E1293-F1337 HydrophobicContact CB-CG 4.15Å; E1293-F1337 HydrophobicContact CB-CZ 4.27Å; E1293-F1337 HydrophobicContact CG-CB 4.09Å; E1293-F1337 HydrophobicContact CG-CD2 3.76Å; E1293-F1337 HydrophobicContact CG-CE2 4.34Å; E1293-F1337 HydrophobicContact CG-CG 3.91Å; E1293-F1337 WeakPolarHBondContact O-CE1 3.35Å; E1293-F1337 WeakPolarHBondContact O-CZ 3.43Å
1294S83.6Confident89.2Confident66 Ų6636.6 Ų36.646%0.46221%0.205SC..THydrogen-bonded Turntrans-67.2-41.1173.857.40000112.2T1292 L1296 T1297T1292-S1294 PolarHBondContact O-N 3.2Å; T1292-S1294 PolarHBondContact OG1-OG 2.75Å; S1294-L1296 VanDerWaalsContact C-N 3.29Å; S1294-L1296 PolarHBondContact O-N 3.48Å; S1294-T1297 PolarHBondContact O-N 3.44Å; S1294-T1297 VanDerWaalsContact O-N 3.15Å; S1294-T1297 PolarHBondContact O-OG1 2.73Å
1295N85.8Confident89.2Confident13 Ų1336.4 Ų36.47%0.0720%0.204CC..G310 helixtrans-68-34.5-178-62.112.1000111L1290 T1292 T1297 I1298 L1301L1290-N1295 PolarHBondContact O-ND2 3.47Å; T1292-N1295 PolarHBondContact O-N 2.95Å; T1292-N1295 PolarHBondContact OG1-N 3.34Å; T1292-N1295 PolarHBondContact OG1-OD1 3.11Å; N1295-T1297 PolarHBondContact O-N 3.03Å; N1295-I1298 WeakPolarHBondContact O-CB 3.49Å; N1295-I1298 PolarHBondContact O-N 3.42Å; N1295-L1301 HydrophobicContact CB-CD2 3.78Å
1296L87.9Confident89.3Confident6 Ų636.4 Ų36.43%0.03120%0.204CC..G310 helixtrans-74.2-0.7176.6-66.6-178.1000114.1I1291 T1292 S1294 I1298 C1302 F1305 Y1306 L1334 F1337I1291-L1296 HydrophobicContact CG2-CD1 4.18Å; I1291-L1296 HydrophobicContact CG2-CD2 3.89Å; I1291-L1296 HydrophobicContact CG2-CG 3.87Å; T1292-L1296 PolarHBondContact O-N 3.45Å; S1294-L1296 VanDerWaalsContact C-N 3.29Å; S1294-L1296 PolarHBondContact O-N 3.48Å; L1296-I1298 PolarHBondContact O-N 3.33Å; L1296-C1302 HydrophobicContact CD2-CB 4.46Å; L1296-C1302 WeakPolarHBondContact O-CB 3.44Å; L1296-F1305 HydrophobicContact CD1-CD1 4.3Å; L1296-F1305 HydrophobicContact CD1-CE1 4.4Å; L1296-F1305 HydrophobicContact CD2-CB 4.06Å; L1296-F1305 HydrophobicContact CD2-CD1 4.11Å; L1296-F1305 HydrophobicContact CD2-CG 4.17Å; L1296-Y1306 HydrophobicContact CD1-CE2 4.21Å; L1296-L1334 HydrophobicContact CD1-CB 4.14Å; L1296-L1334 HydrophobicContact CD1-CD1 4.43Å; L1296-L1334 HydrophobicContact CD1-CD2 3.73Å; L1296-L1334 HydrophobicContact CD1-CG 4.29Å; L1296-F1337 HydrophobicContact CB-CD1 4.13Å; L1296-F1337 HydrophobicContact CB-CE1 3.73Å; L1296-F1337 HydrophobicContact CD1-CD1 4.25Å
1297T84.9Confident89.1Confident92 Ų9235.6 Ų35.656%0.56420%0.204SC*.G310 helixtrans-73.7-11.4166.465.20000112.3S1294 N1295 F1337S1294-T1297 PolarHBondContact O-N 3.44Å; S1294-T1297 VanDerWaalsContact O-N 3.15Å; S1294-T1297 PolarHBondContact O-OG1 2.73Å; N1295-T1297 PolarHBondContact O-N 3.03Å; T1297-F1337 HydrophobicContact CG2-CZ 4.12Å
1298I87.1Confident89Confident43 Ų4335.7 Ų35.722%0.22120%0.204CC..SBendtrans-86.8120.5177.2-59.6176.5000109.3I1222 N1295 L1296 E1300 L1301 C1302I1222-I1298 HydrophobicContact CB-CD1 4.37Å; I1222-I1298 HydrophobicContact CD1-CD1 3.1Å; I1222-I1298 HydrophobicContact CG1-CD1 3.78Å; I1222-I1298 HydrophobicContact CG2-CD1 3.84Å; I1222-I1298 HydrophobicContact CG2-CG2 4.37Å; N1295-I1298 WeakPolarHBondContact O-CB 3.49Å; N1295-I1298 PolarHBondContact O-N 3.42Å; L1296-I1298 PolarHBondContact O-N 3.33Å; I1298-E1300 VanDerWaalsContact CG2-OE2 3.3Å; I1298-E1300 WeakPolarHBondContact CG2-OE2 3.25Å; I1298-E1300 PolarHBondContact O-N 3.32Å; I1298-L1301 HydrophobicContact CB-CB 4.47Å; I1298-L1301 PolarHBondContact O-N 2.97Å; I1298-C1302 VanDerWaalsContact O-CB 3.22Å; I1298-C1302 WeakPolarHBondContact O-CB 3.44Å; I1298-C1302 PolarHBondContact O-N 3.36Å
1299P84.7Confident89.1Confident90 Ų9035.8 Ų35.858%0.58421%0.205SC*.Hα-helixtrans-58.7-44.4-171.1-24.332.9000113.9L1301 C1302 Q1303P1299-L1301 PolarHBondContact O-N 3.45Å; P1299-C1302 PolarHBondContact O-N 3.17Å; P1299-Q1303 WeakPolarHBondContact O-CB 3.43Å; P1299-Q1303 PolarHBondContact O-N 3.28Å
1300E85.2Confident89Confident111 Ų11133.8 Ų33.852%0.51919%0.193SC..Hα-helixtrans-69.5-39.1-174-51.889.5176.900112.2Q1226 I1298 A1304Q1226-E1300 VanDerWaalsContact NE2-CB 3.3Å; I1298-E1300 VanDerWaalsContact CG2-OE2 3.3Å; I1298-E1300 WeakPolarHBondContact CG2-OE2 3.25Å; I1298-E1300 PolarHBondContact O-N 3.32Å; E1300-A1304 WeakPolarHBondContact O-CB 3.47Å; E1300-A1304 PolarHBondContact O-N 3.46Å
1301L91.1Very high89Confident0 Ų036.3 Ų36.30%020%0.202CC..Hα-helixtrans-68-41.5175.6-172.372.7000111.1I1222 L1225 Q1226 L1229 N1295 I1298 P1299 A1304 F1305I1222-L1301 HydrophobicContact CG2-CB 4.43Å; I1222-L1301 HydrophobicContact CG2-CD2 4.42Å; L1225-L1301 HydrophobicContact CB-CD1 3.8Å; Q1226-L1301 HydrophobicContact CB-CD1 4.1Å; L1229-L1301 HydrophobicContact CD1-CD1 3.68Å; L1229-L1301 HydrophobicContact CD1-CG 4.45Å; N1295-L1301 HydrophobicContact CB-CD2 3.78Å; I1298-L1301 HydrophobicContact CB-CB 4.47Å; I1298-L1301 PolarHBondContact O-N 2.97Å; P1299-L1301 PolarHBondContact O-N 3.45Å; L1301-A1304 PolarHBondContact O-N 2.98Å; L1301-F1305 WeakPolarHBondContact O-CB 3.49Å; L1301-F1305 PolarHBondContact O-N 3.39Å
1302C91.1Very high88.9Confident11 Ų1136.5 Ų36.57%0.07420%0.204CC..Hα-helixtrans-59.6-49.9176.9-170.80000111.4L1296 I1298 P1299 A1304 F1305 Y1306L1296-C1302 HydrophobicContact CD2-CB 4.46Å; L1296-C1302 WeakPolarHBondContact O-CB 3.44Å; I1298-C1302 VanDerWaalsContact O-CB 3.22Å; I1298-C1302 WeakPolarHBondContact O-CB 3.44Å; I1298-C1302 PolarHBondContact O-N 3.36Å; P1299-C1302 PolarHBondContact O-N 3.17Å; C1302-A1304 PolarHBondContact O-N 2.94Å; C1302-F1305 PolarHBondContact O-N 3.49Å; C1302-Y1306 VanDerWaalsContact O-CD2 3.29Å; C1302-Y1306 WeakPolarHBondContact O-CD2 3.4Å; C1302-Y1306 PolarHBondContact O-N 2.86Å; C1302-Y1306 VanDerWaalsContact SG-CD2 3.53Å; C1302-Y1306 VanDerWaalsContact SG-CE2 3.51Å
1303Q88Confident89Confident91 Ų9134.1 Ų34.143%0.42519%0.189SC..Hα-helixtrans-60.2-44.8176.9-164.797.6-1.600111.5P1299 F1305 S1307P1299-Q1303 WeakPolarHBondContact O-CB 3.43Å; P1299-Q1303 PolarHBondContact O-N 3.28Å; Q1303-F1305 PolarHBondContact O-N 3.24Å; Q1303-S1307 WeakPolarHBondContact O-CB 3.12Å; Q1303-S1307 PolarHBondContact O-N 3.41Å; Q1303-S1307 PolarHBondContact O-OG 2.91Å
1304A89.9Confident88.8Confident6 Ų637.7 Ų37.75%0.0521%0.206CC..Hα-helixtrans-62.9-41178.700000112.1L1229 N1233 E1300 L1301 C1302 S1307 L1308L1229-A1304 HydrophobicContact CB-CB 4.05Å; L1229-A1304 HydrophobicContact CD1-CB 4.24Å; N1233-A1304 PolarHBondContact ND2-O 2.92Å; E1300-A1304 WeakPolarHBondContact O-CB 3.47Å; E1300-A1304 PolarHBondContact O-N 3.46Å; L1301-A1304 PolarHBondContact O-N 2.98Å; C1302-A1304 PolarHBondContact O-N 2.94Å; A1304-S1307 PolarHBondContact O-OG 2.98Å; A1304-S1307 VanDerWaalsContact O-OG 3.1Å; A1304-L1308 VanDerWaalsContact O-CB 3.28Å; A1304-L1308 WeakPolarHBondContact O-CB 3.37Å; A1304-L1308 PolarHBondContact O-N 3.24Å
1305F95.2Very high88.7Confident0 Ų036 Ų360%019%0.192CC..Hα-helixtrans-69-51.5178.8173.6-99.1000112.7L1229 L1284 L1288 I1291 L1296 L1301 C1302 Q1303 L1308 A1309 F1331 L1334L1229-F1305 HydrophobicContact CD1-CB 4.04Å; L1229-F1305 HydrophobicContact CD2-CD2 4.47Å; L1284-F1305 HydrophobicContact CD1-CD2 3.92Å; L1284-F1305 HydrophobicContact CD1-CE2 3.81Å; L1288-F1305 HydrophobicContact CD2-CE2 4.01Å; L1288-F1305 HydrophobicContact CD2-CZ 4.23Å; I1291-F1305 HydrophobicContact CD1-CD2 3.71Å; I1291-F1305 HydrophobicContact CD1-CE2 4.01Å; L1296-F1305 HydrophobicContact CD1-CD1 4.3Å; L1296-F1305 HydrophobicContact CD1-CE1 4.4Å; L1296-F1305 HydrophobicContact CD2-CB 4.06Å; L1296-F1305 HydrophobicContact CD2-CD1 4.11Å; L1296-F1305 HydrophobicContact CD2-CG 4.17Å; L1301-F1305 WeakPolarHBondContact O-CB 3.49Å; L1301-F1305 PolarHBondContact O-N 3.39Å; C1302-F1305 PolarHBondContact O-N 3.49Å; Q1303-F1305 PolarHBondContact O-N 3.24Å; F1305-L1308 PolarHBondContact O-N 2.84Å; F1305-A1309 WeakPolarHBondContact O-CB 3.38Å; F1305-A1309 PolarHBondContact O-N 3.29Å; F1305-F1331 HydrophobicContact CZ-CD2 4.01Å; F1305-F1331 HydrophobicContact CZ-CE2 4.07Å; F1305-L1334 HydrophobicContact CE1-CB 4.26Å; F1305-L1334 HydrophobicContact CE1-CD1 4.41Å; F1305-L1334 HydrophobicContact CE2-CD1 4.26Å; F1305-L1334 HydrophobicContact CZ-CB 4.25Å; F1305-L1334 HydrophobicContact CZ-CD1 3.81Å
1306Y93.9Very high88.6Confident1 Ų138.8 Ų38.80%0.00420%0.201CC..Hα-helixtrans-74.3-30.4-176.1-72.9-68.3000112.9L1296 C1302 S1310 L1334 G1338 V1370 C1374 I1377L1296-Y1306 HydrophobicContact CD1-CE2 4.21Å; C1302-Y1306 VanDerWaalsContact O-CD2 3.29Å; C1302-Y1306 WeakPolarHBondContact O-CD2 3.4Å; C1302-Y1306 PolarHBondContact O-N 2.86Å; C1302-Y1306 VanDerWaalsContact SG-CD2 3.53Å; C1302-Y1306 VanDerWaalsContact SG-CE2 3.51Å; Y1306-S1310 WeakPolarHBondContact O-CB 3.33Å; Y1306-S1310 PolarHBondContact O-N 3.28Å; Y1306-L1334 PolarHBondContact OH-O 3.44Å; Y1306-G1338 WeakPolarHBondContact OH-CA 3.46Å; Y1306-G1338 PolarHBondContact OH-N 3.24Å; Y1306-V1370 HydrophobicContact CD2-CG1 3.45Å; Y1306-V1370 VanDerWaalsContact CD2-CG1 3.45Å; Y1306-V1370 HydrophobicContact CE2-CG1 3.52Å; Y1306-V1370 HydrophobicContact CG-CG1 4.06Å; Y1306-C1374 WeakPolarHBondContact CD1-SG 3.42Å; Y1306-C1374 WeakPolarHBondContact CE1-SG 3.46Å; Y1306-I1377 HydrophobicContact CD1-CD1 4.41Å
1307S90.5Very high88.4Confident30 Ų3039.4 Ų39.421%0.2121%0.206CC..Hα-helixtrans-63.4-45.5170.4610000111.7N1233 Q1303 A1304 S1310 Y1311N1233-S1307 PolarHBondContact ND2-OG 3.43Å; Q1303-S1307 WeakPolarHBondContact O-CB 3.12Å; Q1303-S1307 PolarHBondContact O-N 3.41Å; Q1303-S1307 PolarHBondContact O-OG 2.91Å; A1304-S1307 PolarHBondContact O-OG 2.98Å; A1304-S1307 VanDerWaalsContact O-OG 3.1Å; S1307-S1310 PolarHBondContact O-N 3.25Å; S1307-Y1311 VanDerWaalsContact O-CB 3.28Å; S1307-Y1311 WeakPolarHBondContact O-CB 3.48Å; S1307-Y1311 PolarHBondContact O-N 3.32Å
1308L92.6Very high88.2Confident2 Ų237.8 Ų37.81%0.0119%0.192CC..Hα-helixtrans-59.3-50.3175.8-179.774.4000111.3L1229 L1232 N1233 L1236 L1284 A1304 F1305 A1312L1229-L1308 HydrophobicContact CD2-CD2 3.67Å; L1232-L1308 HydrophobicContact CB-CD1 3.68Å; L1232-L1308 HydrophobicContact CB-CD2 3.95Å; L1232-L1308 HydrophobicContact CD1-CD2 4.02Å; N1233-L1308 HydrophobicContact CB-CD1 4.33Å; N1233-L1308 WeakPolarHBondContact OD1-CA 3.07Å; N1233-L1308 VanDerWaalsContact OD1-CB 3.28Å; N1233-L1308 WeakPolarHBondContact OD1-CB 3.35Å; N1233-L1308 WeakPolarHBondContact OD1-CD1 3.32Å; N1233-L1308 PolarHBondContact OD1-N 3.2Å; L1236-L1308 HydrophobicContact CD1-CD1 3.33Å; L1236-L1308 HydrophobicContact CD1-CG 4.33Å; L1284-L1308 HydrophobicContact CB-CD2 4.32Å; L1284-L1308 HydrophobicContact CD1-CD2 3.95Å; L1284-L1308 HydrophobicContact CD2-CD2 4.17Å; L1284-L1308 HydrophobicContact CG-CD2 4.38Å; A1304-L1308 VanDerWaalsContact O-CB 3.28Å; A1304-L1308 WeakPolarHBondContact O-CB 3.37Å; A1304-L1308 PolarHBondContact O-N 3.24Å; F1305-L1308 PolarHBondContact O-N 2.84Å; L1308-A1312 WeakPolarHBondContact O-CB 3.19Å; L1308-A1312 PolarHBondContact O-N 3.04Å
1309A93.2Very high88Confident2 Ų235.7 Ų35.72%0.01718%0.181CC..Hα-helixtrans-65.2-43.4-177.900000112.2F1305 C1313 F1331 I1377F1305-A1309 WeakPolarHBondContact O-CB 3.38Å; F1305-A1309 PolarHBondContact O-N 3.29Å; A1309-C1313 WeakPolarHBondContact O-CB 3.5Å; A1309-C1313 PolarHBondContact O-N 3.31Å; A1309-C1313 VanDerWaalsContact O-N 3.07Å; A1309-C1313 PolarHBondContact O-SG 2.73Å; A1309-F1331 HydrophobicContact CB-CE2 3.8Å; A1309-F1331 HydrophobicContact CB-CZ 4.01Å; A1309-I1377 HydrophobicContact CB-CD1 3.7Å
1310S90.1Very high88.1Confident17 Ų1731.7 Ų31.712%0.11916%0.155CC..Hα-helixtrans-59.5-55.2175.9170.90000111Y1306 S1307 A1312 C1313 E1314 I1377Y1306-S1310 WeakPolarHBondContact O-CB 3.33Å; Y1306-S1310 PolarHBondContact O-N 3.28Å; S1307-S1310 PolarHBondContact O-N 3.25Å; S1310-A1312 PolarHBondContact O-N 2.81Å; S1310-C1313 PolarHBondContact O-N 3.16Å; S1310-C1313 VanDerWaalsContact O-N 3.13Å; S1310-E1314 PolarHBondContact O-N 3.37Å; S1310-I1377 VanDerWaalsContact CA-CG1 3.48Å
1311Y88Confident88Confident64 Ų6428.6 Ų28.625%0.25114%0.141SC..Hα-helixtrans-65.7-38.3-175.9-166.8-126.5000112.5L1236 Y1237 S1307 C1313 E1314 L1315L1236-Y1311 HydrophobicContact CB-CD1 4.15Å; L1236-Y1311 HydrophobicContact CB-CE1 4.4Å; L1236-Y1311 HydrophobicContact CD2-CD1 4.43Å; Y1237-Y1311 HydrophobicContact CD1-CE1 4.12Å; Y1237-Y1311 HydrophobicContact CE1-CE1 4.45Å; S1307-Y1311 VanDerWaalsContact O-CB 3.28Å; S1307-Y1311 WeakPolarHBondContact O-CB 3.48Å; S1307-Y1311 PolarHBondContact O-N 3.32Å; Y1311-C1313 PolarHBondContact O-N 3.46Å; Y1311-E1314 PolarHBondContact O-N 3.28Å; Y1311-L1315 HydrophobicContact CD1-CD1 3.8Å; Y1311-L1315 HydrophobicContact CD2-CD1 4.48Å; Y1311-L1315 HydrophobicContact CE1-CD1 3.51Å; Y1311-L1315 HydrophobicContact CE1-CG 4.39Å; Y1311-L1315 HydrophobicContact CE2-CD1 4.23Å; Y1311-L1315 HydrophobicContact CE2-CG 4.26Å; Y1311-L1315 HydrophobicContact CG-CD1 4.28Å; Y1311-L1315 WeakPolarHBondContact O-CB 3.23Å; Y1311-L1315 WeakPolarHBondContact O-CG 3.43Å; Y1311-L1315 PolarHBondContact O-N 3.5Å
1312A89.3Confident87.8Confident7 Ų734.3 Ų34.36%0.05816%0.163CC..Hα-helixtrans-62.4-41.1173.900000112.4L1236 V1281 L1308 S1310 R1316L1236-A1312 HydrophobicContact CD1-CB 4.07Å; L1236-A1312 HydrophobicContact CD2-CB 4.32Å; V1281-A1312 HydrophobicContact CG2-CB 4.17Å; L1308-A1312 WeakPolarHBondContact O-CB 3.19Å; L1308-A1312 PolarHBondContact O-N 3.04Å; S1310-A1312 PolarHBondContact O-N 2.81Å; A1312-R1316 CarbonylContact O-C 3.59Å; A1312-R1316 PolarHBondContact O-N 3.16Å
1313C89.2Confident87.7Confident3 Ų333.9 Ų33.92%0.0216%0.16CC..Hα-helixtrans-71.7-33.5178.5-69.50000112.7A1309 S1310 Y1311 P1317 I1377A1309-C1313 WeakPolarHBondContact O-CB 3.5Å; A1309-C1313 PolarHBondContact O-N 3.31Å; A1309-C1313 VanDerWaalsContact O-N 3.07Å; A1309-C1313 PolarHBondContact O-SG 2.73Å; S1310-C1313 PolarHBondContact O-N 3.16Å; S1310-C1313 VanDerWaalsContact O-N 3.13Å; Y1311-C1313 PolarHBondContact O-N 3.46Å; C1313-P1317 WeakPolarHBondContact O-CD 3.37Å; C1313-I1377 HydrophobicContact CB-CG2 4.4Å
1314E84.2Confident87.9Confident136 Ų13633.2 Ų33.264%0.63616%0.162SC*.Hα-helixtrans-68.1-42.2174.4-168.8-179.4-177.600111.1S1310 Y1311S1310-E1314 PolarHBondContact O-N 3.37Å; Y1311-E1314 PolarHBondContact O-N 3.28Å
1315L81.6Confident87.9Confident32 Ų3236.5 Ų36.517%0.16818%0.179CC..Hα-helixtrans-70.9-48.6-180-76.8170.5000113.3L1236 E1239 F1240 V1277 Y1311L1236-L1315 HydrophobicContact CD2-CD1 3.56Å; E1239-L1315 HydrophobicContact CB-CD1 4.25Å; E1239-L1315 HydrophobicContact CG-CD1 4.28Å; F1240-L1315 HydrophobicContact CD2-CD2 4.34Å; F1240-L1315 HydrophobicContact CE2-CD2 4.49Å; V1277-L1315 HydrophobicContact CG2-CB 4.23Å; V1277-L1315 HydrophobicContact CG2-CD1 4.42Å; Y1311-L1315 HydrophobicContact CD1-CD1 3.8Å; Y1311-L1315 HydrophobicContact CD2-CD1 4.48Å; Y1311-L1315 HydrophobicContact CE1-CD1 3.51Å; Y1311-L1315 HydrophobicContact CE1-CG 4.39Å; Y1311-L1315 HydrophobicContact CE2-CD1 4.23Å; Y1311-L1315 HydrophobicContact CE2-CG 4.26Å; Y1311-L1315 HydrophobicContact CG-CD1 4.28Å; Y1311-L1315 WeakPolarHBondContact O-CB 3.23Å; Y1311-L1315 WeakPolarHBondContact O-CG 3.43Å; Y1311-L1315 PolarHBondContact O-N 3.5Å
1316R82.7Confident87.6Confident70 Ų7043 Ų4326%0.26421%0.213SC..  trans-160.488.8-178.1-163.7175.6110116-5.7112.3V1277 D1278 A1312 Q1318 G1319V1277-R1316 HydrophobicContact CG1-CB 4.08Å; V1277-R1316 HydrophobicContact CG2-CB 4.46Å; D1278-R1316 VanDerWaalsContact CG-NH2 3.27Å; D1278-R1316 IonicContact OD1-CZ 3.09Å; D1278-R1316 IonicContact OD1-NE 3.35Å; D1278-R1316 PolarHBondContact OD1-NE 3.37Å; D1278-R1316 IonicContact OD1-NH2 3.83Å; D1278-R1316 PolarHBondContact OD1-NH2 2.95Å; D1278-R1316 IonicContact OD2-CZ 3.66Å; D1278-R1316 IonicContact OD2-NH2 2.66Å; D1278-R1316 PolarHBondContact OD2-NH2 2.95Å; A1312-R1316 CarbonylContact O-C 3.59Å; A1312-R1316 PolarHBondContact O-N 3.16Å; R1316-Q1318 HydrophobicContact CG-CB 4.35Å; R1316-Q1318 PolarHBondContact O-N 3.45Å; R1316-Q1318 VanDerWaalsContact O-N 3.1Å; R1316-G1319 PolarHBondContact O-N 3.41Å
1317P83.3Confident87.5Confident19 Ų1944.3 Ų44.312%0.12322%0.22CC..G310 helixtrans-64.3-22.7-177.221.4-27.1000113.5C1313 G1319 L1320 L1381 H1384C1313-P1317 WeakPolarHBondContact O-CD 3.37Å; P1317-G1319 PolarHBondContact O-N 2.86Å; P1317-L1320 PolarHBondContact O-N 2.95Å; P1317-L1381 HydrophobicContact CB-CD2 3.82Å; P1317-H1384 HydrophobicContact CB-CB 4.23Å; P1317-H1384 HydrophobicContact CG-CB 3.6Å
1318Q82Confident87.6Confident58 Ų5842.9 Ų42.927%0.27121%0.21SC..G310 helixtrans-61.3-21.2174.5-67170.6-27.800113.7R1316 L1320 I1321 H1384R1316-Q1318 HydrophobicContact CG-CB 4.35Å; R1316-Q1318 PolarHBondContact O-N 3.45Å; R1316-Q1318 VanDerWaalsContact O-N 3.1Å; Q1318-L1320 PolarHBondContact O-N 3.44Å; Q1318-I1321 HydrophobicContact CB-CD1 4.32Å; Q1318-I1321 WeakPolarHBondContact O-CB 3.36Å; Q1318-I1321 WeakPolarHBondContact O-CG1 3.45Å; Q1318-I1321 PolarHBondContact O-N 3.35Å; Q1318-I1321 VanDerWaalsContact O-N 3.11Å; Q1318-H1384 VanDerWaalsContact CD-CE1 3.47Å; Q1318-H1384 VanDerWaalsContact CG-CE1 3.44Å; Q1318-H1384 WeakPolarHBondContact CG-CE1 3.26Å; Q1318-H1384 WeakPolarHBondContact CG-NE2 3.25Å; Q1318-H1384 PolarHBondContact NE2-CE1 3.47Å; Q1318-H1384 PolarHBondContact NE2-NE2 2.89Å; Q1318-H1384 VanDerWaalsContact NE2-NE2 3.19Å
1319G81.8Confident87.5Confident0 Ų045.8 Ų45.80%023%0.23CC..G310 helixtrans-57.2-31.6177.700000112.8R1316 P1317 I1321 R1322R1316-G1319 PolarHBondContact O-N 3.41Å; P1317-G1319 PolarHBondContact O-N 2.86Å; G1319-I1321 PolarHBondContact O-N 3.32Å; G1319-I1321 VanDerWaalsContact O-N 3.15Å; G1319-R1322 PolarHBondContact O-N 3.48Å
1320L86.8Confident87.4Confident6 Ų646.7 Ų46.73%0.03124%0.236CC..G310 helixtrans-63.8-18.5179.1-66179.4000113.8V1281 P1317 Q1318 R1322 L1323 L1328 F1331 L1381 L1406 I1410V1281-L1320 HydrophobicContact CG1-CD2 3.96Å; P1317-L1320 PolarHBondContact O-N 2.95Å; Q1318-L1320 PolarHBondContact O-N 3.44Å; L1320-R1322 PolarHBondContact O-N 3.36Å; L1320-R1322 VanDerWaalsContact O-N 3.15Å; L1320-L1323 HydrophobicContact CD2-CD1 3.71Å; L1320-L1323 WeakPolarHBondContact O-CB 3.11Å; L1320-L1323 PolarHBondContact O-N 3.31Å; L1320-L1328 HydrophobicContact CB-CD2 4.24Å; L1320-F1331 HydrophobicContact CD1-CE1 4.34Å; L1320-L1381 HydrophobicContact CD1-CD1 4.07Å; L1320-L1381 HydrophobicContact CD1-CD2 3.57Å; L1320-L1381 HydrophobicContact CD1-CG 4.39Å; L1320-L1406 HydrophobicContact CB-CD1 4.28Å; L1320-L1406 HydrophobicContact CB-CD2 3.78Å; L1320-L1406 HydrophobicContact CD1-CD2 4.01Å; L1320-I1410 HydrophobicContact CD1-CD1 4.27Å
1321I84.6Confident87.6Confident46 Ų4646 Ų4624%0.23623%0.231CC..G310 helixtrans-60.1-26.6177.6-63169.3000111.3Q1318 G1319 L1323 N1402 L1406Q1318-I1321 HydrophobicContact CB-CD1 4.32Å; Q1318-I1321 WeakPolarHBondContact O-CB 3.36Å; Q1318-I1321 WeakPolarHBondContact O-CG1 3.45Å; Q1318-I1321 PolarHBondContact O-N 3.35Å; Q1318-I1321 VanDerWaalsContact O-N 3.11Å; G1319-I1321 PolarHBondContact O-N 3.32Å; G1319-I1321 VanDerWaalsContact O-N 3.15Å; I1321-L1323 VanDerWaalsContact C-N 3.25Å; I1321-L1323 PolarHBondContact O-N 2.89Å; I1321-N1402 HydrophobicContact CD1-CB 3.99Å; I1321-N1402 HydrophobicContact CG1-CB 4.31Å; I1321-N1402 HydrophobicContact CG2-CB 4.29Å; I1321-L1406 HydrophobicContact CG1-CD1 3.56Å
1322R85.4Confident87.7Confident119 Ų11943.2 Ų43.245%0.44922%0.222SC..G310 helixtrans-72.9-14.1178.8-60.3-158.3-177.9-155.92.1113.9D1278 I1282 G1319 L1320D1278-R1322 IonicContact OD2-CZ 3.36Å; D1278-R1322 IonicContact OD2-NE 3.41Å; D1278-R1322 PolarHBondContact OD2-NE 2.87Å; D1278-R1322 IonicContact OD2-NH2 3.44Å; D1278-R1322 PolarHBondContact OD2-NH2 3.41Å; I1282-R1322 HydrophobicContact CG1-CB 4.06Å; G1319-R1322 PolarHBondContact O-N 3.48Å; L1320-R1322 PolarHBondContact O-N 3.36Å; L1320-R1322 VanDerWaalsContact O-N 3.15Å
1323L89.8Confident87.8Confident3 Ų348.3 Ų48.32%0.01624%0.24CC..SBendtrans-78.2147.1177.4-62.9-178.1000111.2V1281 L1320 I1321 Q1327 L1328 R1405V1281-L1323 HydrophobicContact CG1-CD1 4.09Å; V1281-L1323 HydrophobicContact CG1-CD2 4.12Å; V1281-L1323 HydrophobicContact CG1-CG 3.92Å; V1281-L1323 WeakPolarHBondContact O-CD2 3.4Å; L1320-L1323 HydrophobicContact CD2-CD1 3.71Å; L1320-L1323 WeakPolarHBondContact O-CB 3.11Å; L1320-L1323 PolarHBondContact O-N 3.31Å; I1321-L1323 VanDerWaalsContact C-N 3.25Å; I1321-L1323 PolarHBondContact O-N 2.89Å; L1323-Q1327 HydrophobicContact CB-CB 4.18Å; L1323-L1328 HydrophobicContact CB-CD1 4.47Å; L1323-L1328 HydrophobicContact CB-CD2 4.05Å; L1323-L1328 HydrophobicContact CB-CG 3.84Å; L1323-L1328 HydrophobicContact CD1-CD2 4.03Å; L1323-R1405 PolarHBondContact O-NH2 2.96Å
1324T91.3Very high88Confident77 Ų7748.2 Ų48.247%0.47224%0.239SC..  trans-71.6159.2171.761.20000111.1N1326 Q1327 L1328T1324-N1326 PolarHBondContact O-N 3.36Å; T1324-Q1327 WeakPolarHBondContact O-CB 3.27Å; T1324-Q1327 PolarHBondContact O-N 3.03Å; T1324-Q1327 VanDerWaalsContact OG1-CD 3.23Å; T1324-Q1327 VanDerWaalsContact OG1-CG 3.3Å; T1324-Q1327 WeakPolarHBondContact OG1-CG 3.41Å; T1324-Q1327 PolarHBondContact OG1-N 3.47Å; T1324-Q1327 PolarHBondContact OG1-OE1 3.41Å; T1324-L1328 PolarHBondContact O-N 3.04Å
1325D90.2Very high88.3Confident75 Ų7541.9 Ų41.940%0.40121%0.21SC..Hα-helixtrans-62.6-31.9-178.4-65.3-14.2000112.7L1328 S1329 R1405 V1409D1325-L1328 PolarHBondContact O-N 3.27Å; D1325-S1329 VanDerWaalsContact O-CB 3.29Å; D1325-S1329 WeakPolarHBondContact O-CB 3.13Å; D1325-S1329 PolarHBondContact O-N 3.46Å; D1325-R1405 IonicContact OD1-CZ 2.69Å; D1325-R1405 IonicContact OD1-NE 3.38Å; D1325-R1405 PolarHBondContact OD1-NE 3.35Å; D1325-R1405 IonicContact OD1-NH2 2.79Å; D1325-R1405 PolarHBondContact OD1-NH2 3.21Å; D1325-V1409 HydrophobicContact CB-CG1 4Å; D1325-V1409 HydrophobicContact CB-CG2 4.34Å; D1325-V1409 WeakPolarHBondContact O-CG1 3.48Å
1326N89.9Confident88.6Confident135 Ų13542.7 Ų42.772%0.72221%0.21SC*.Hα-helixtrans-66.7-36.4173.8-74.8-9.2000112.8T1324 S1330T1324-N1326 PolarHBondContact O-N 3.36Å; N1326-S1330 PolarHBondContact O-N 2.73Å; N1326-S1330 PolarHBondContact O-OG 3.49Å
1327Q92.1Very high88.9Confident30 Ų3040.2 Ų40.214%0.1420%0.201CC..Hα-helixtrans-70.3-46.6176.1-72.7164.7-31.100110.1G1285 L1288 L1323 T1324 S1329 S1330 F1331G1285-Q1327 VanDerWaalsContact O-CD 3.3Å; G1285-Q1327 WeakPolarHBondContact O-CG 3.46Å; G1285-Q1327 PolarHBondContact O-NE2 3.41Å; L1288-Q1327 HydrophobicContact CD1-CB 4.07Å; L1288-Q1327 WeakPolarHBondContact CD1-O 3.41Å; L1323-Q1327 HydrophobicContact CB-CB 4.18Å; T1324-Q1327 WeakPolarHBondContact O-CB 3.27Å; T1324-Q1327 PolarHBondContact O-N 3.03Å; T1324-Q1327 VanDerWaalsContact OG1-CD 3.23Å; T1324-Q1327 VanDerWaalsContact OG1-CG 3.3Å; T1324-Q1327 WeakPolarHBondContact OG1-CG 3.41Å; T1324-Q1327 PolarHBondContact OG1-N 3.47Å; T1324-Q1327 PolarHBondContact OG1-OE1 3.41Å; Q1327-S1329 VanDerWaalsContact C-N 3.31Å; Q1327-S1329 PolarHBondContact O-N 3.34Å; Q1327-S1330 PolarHBondContact O-N 3.08Å; Q1327-S1330 VanDerWaalsContact O-N 3.13Å; Q1327-F1331 WeakPolarHBondContact O-CB 3.38Å; Q1327-F1331 PolarHBondContact O-N 2.88Å
1328L91.3Very high89.1Confident0 Ų039.3 Ų39.30%020%0.196CC..Hα-helixtrans-60.5-40.2176-73169.4000112.2L1320 L1323 T1324 D1325 F1331 G1332 L1406 V1409 I1410L1320-L1328 HydrophobicContact CB-CD2 4.24Å; L1323-L1328 HydrophobicContact CB-CD1 4.47Å; L1323-L1328 HydrophobicContact CB-CD2 4.05Å; L1323-L1328 HydrophobicContact CB-CG 3.84Å; L1323-L1328 HydrophobicContact CD1-CD2 4.03Å; T1324-L1328 PolarHBondContact O-N 3.04Å; D1325-L1328 PolarHBondContact O-N 3.27Å; L1328-F1331 PolarHBondContact O-N 3.49Å; L1328-G1332 PolarHBondContact O-N 3.46Å; L1328-L1406 HydrophobicContact CD2-CD2 3.82Å; L1328-V1409 HydrophobicContact CB-CB 4.21Å; L1328-V1409 HydrophobicContact CB-CG1 3.53Å; L1328-V1409 HydrophobicContact CD1-CG1 4.5Å; L1328-I1410 HydrophobicContact CB-CG1 4.45Å; L1328-I1410 HydrophobicContact CD2-CD1 4.25Å; L1328-I1410 HydrophobicContact CD2-CG1 4.14Å
1329S91.6Very high89.3Confident62 Ų6236.8 Ų36.843%0.43418%0.184SC..Hα-helixtrans-62.1-43174.1167.40000111.6D1325 Q1327 G1332 R1333D1325-S1329 VanDerWaalsContact O-CB 3.29Å; D1325-S1329 WeakPolarHBondContact O-CB 3.13Å; D1325-S1329 PolarHBondContact O-N 3.46Å; Q1327-S1329 VanDerWaalsContact C-N 3.31Å; Q1327-S1329 PolarHBondContact O-N 3.34Å; S1329-G1332 PolarHBondContact O-N 2.94Å; S1329-R1333 PolarHBondContact O-N 3.11Å
1330S91.2Very high89.3Confident22 Ų2237.3 Ų37.315%0.15419%0.186CC..Hα-helixtrans-65.3-43.7176.4-62.50000111.4N1326 Q1327 G1332 R1333 L1334N1326-S1330 PolarHBondContact O-N 2.73Å; N1326-S1330 PolarHBondContact O-OG 3.49Å; Q1327-S1330 PolarHBondContact O-N 3.08Å; Q1327-S1330 VanDerWaalsContact O-N 3.13Å; S1330-G1332 PolarHBondContact O-N 2.67Å; S1330-R1333 WeakPolarHBondContact O-CB 3.37Å; S1330-R1333 PolarHBondContact O-N 2.79Å; S1330-L1334 WeakPolarHBondContact O-CG 3.47Å; S1330-L1334 PolarHBondContact O-N 3.2Å
1331F93.6Very high89Confident2 Ų237.6 Ų37.61%0.00919%0.191CC..Hα-helixtrans-59-45.9175.5-176.7-107.3000112.1L1288 F1305 A1309 L1320 Q1327 L1328 R1333 L1334 L1335 I1377 I1410L1288-F1331 HydrophobicContact CD1-CB 3.97Å; L1288-F1331 HydrophobicContact CD2-CB 4.23Å; L1288-F1331 HydrophobicContact CD2-CD2 4.28Å; F1305-F1331 HydrophobicContact CZ-CD2 4.01Å; F1305-F1331 HydrophobicContact CZ-CE2 4.07Å; A1309-F1331 HydrophobicContact CB-CE2 3.8Å; A1309-F1331 HydrophobicContact CB-CZ 4.01Å; L1320-F1331 HydrophobicContact CD1-CE1 4.34Å; Q1327-F1331 WeakPolarHBondContact O-CB 3.38Å; Q1327-F1331 PolarHBondContact O-N 2.88Å; L1328-F1331 PolarHBondContact O-N 3.49Å; F1331-R1333 VanDerWaalsContact C-N 3.34Å; F1331-R1333 PolarHBondContact O-N 3Å; F1331-L1334 PolarHBondContact O-N 3.23Å; F1331-L1335 HydrophobicContact CD1-CD1 3.84Å; F1331-L1335 HydrophobicContact CE1-CD1 3.38Å; F1331-L1335 HydrophobicContact CE1-CG 4.35Å; F1331-L1335 HydrophobicContact CZ-CD1 3.9Å; F1331-L1335 HydrophobicContact CZ-CG 4.47Å; F1331-L1335 WeakPolarHBondContact O-CB 3.42Å; F1331-L1335 PolarHBondContact O-N 3.41Å; F1331-I1377 HydrophobicContact CE1-CG2 4.37Å; F1331-I1377 HydrophobicContact CZ-CG2 4.28Å; F1331-I1410 HydrophobicContact CD1-CD1 4.36Å
1332G90.8Very high88.2Confident6 Ų640 Ų406%0.06221%0.207CC..Hα-helixtrans-61.6-38.5175.500000113.6L1328 S1329 S1330 L1335 R1336 I1410L1328-G1332 PolarHBondContact O-N 3.46Å; S1329-G1332 PolarHBondContact O-N 2.94Å; S1330-G1332 PolarHBondContact O-N 2.67Å; G1332-L1335 WeakPolarHBondContact O-CB 3.43Å; G1332-L1335 PolarHBondContact O-N 3.04Å; G1332-R1336 WeakPolarHBondContact O-CB 3.29Å; G1332-R1336 PolarHBondContact O-N 2.94Å; G1332-I1410 VanDerWaalsContact CA-O 3.31Å; G1332-I1410 WeakPolarHBondContact CA-O 3.45Å
1333R90.4Very high86.9Confident114 Ų11440.7 Ų40.743%0.4322%0.216SC..Hα-helixtrans-65-42.4174.1176.7170.951.5113.30.4112.3E1293 S1329 S1330 F1331 R1336 F1337E1293-R1333 WeakPolarHBondContact OE1-CD 3.21Å; E1293-R1333 WeakPolarHBondContact OE1-CG 2.93Å; E1293-R1333 IonicContact OE1-NH1 2.79Å; E1293-R1333 PolarHBondContact OE1-NH1 3.47Å; S1329-R1333 PolarHBondContact O-N 3.11Å; S1330-R1333 WeakPolarHBondContact O-CB 3.37Å; S1330-R1333 PolarHBondContact O-N 2.79Å; F1331-R1333 VanDerWaalsContact C-N 3.34Å; F1331-R1333 PolarHBondContact O-N 3Å; R1333-R1336 WeakPolarHBondContact O-CB 3.25Å; R1333-R1336 PolarHBondContact O-N 3.15Å; R1333-F1337 PolarHBondContact O-N 2.93Å
1334L92.5Very high85.4Confident0 Ų041.6 Ų41.60%022%0.219CC..Hα-helixtrans-66.7-43.3175.6-62.6173.7000111L1288 I1291 E1293 L1296 F1305 Y1306 S1330 F1331 R1336 F1337 G1338L1288-L1334 HydrophobicContact CD2-CD1 3.67Å; I1291-L1334 HydrophobicContact CB-CD1 4.18Å; I1291-L1334 HydrophobicContact CG2-CD1 3.81Å; E1293-L1334 HydrophobicContact CG-CD2 4.35Å; L1296-L1334 HydrophobicContact CD1-CB 4.14Å; L1296-L1334 HydrophobicContact CD1-CD1 4.43Å; L1296-L1334 HydrophobicContact CD1-CD2 3.73Å; L1296-L1334 HydrophobicContact CD1-CG 4.29Å; F1305-L1334 HydrophobicContact CE1-CB 4.26Å; F1305-L1334 HydrophobicContact CE1-CD1 4.41Å; F1305-L1334 HydrophobicContact CE2-CD1 4.26Å; F1305-L1334 HydrophobicContact CZ-CB 4.25Å; F1305-L1334 HydrophobicContact CZ-CD1 3.81Å; Y1306-L1334 PolarHBondContact OH-O 3.44Å; S1330-L1334 WeakPolarHBondContact O-CG 3.47Å; S1330-L1334 PolarHBondContact O-N 3.2Å; F1331-L1334 PolarHBondContact O-N 3.23Å; L1334-R1336 PolarHBondContact O-N 2.79Å; L1334-F1337 CarbonylContact O-C 3.39Å; L1334-F1337 WeakPolarHBondContact O-CA 3.4Å; L1334-F1337 VanDerWaalsContact O-CB 3.27Å; L1334-F1337 WeakPolarHBondContact O-CB 3.4Å; L1334-F1337 PolarHBondContact O-N 3.46Å; L1334-G1338 PolarHBondContact O-N 3.07Å
1335L91.1Very high83.4Confident4 Ų442.6 Ų42.62%0.02122%0.222CC..Hα-helixtrans-53.1-43.3171.6-105.1162.8000112.3F1331 G1332 G1338 I1339 C1374 I1377 I1378 I1410F1331-L1335 HydrophobicContact CD1-CD1 3.84Å; F1331-L1335 HydrophobicContact CE1-CD1 3.38Å; F1331-L1335 HydrophobicContact CE1-CG 4.35Å; F1331-L1335 HydrophobicContact CZ-CD1 3.9Å; F1331-L1335 HydrophobicContact CZ-CG 4.47Å; F1331-L1335 WeakPolarHBondContact O-CB 3.42Å; F1331-L1335 PolarHBondContact O-N 3.41Å; G1332-L1335 WeakPolarHBondContact O-CB 3.43Å; G1332-L1335 PolarHBondContact O-N 3.04Å; L1335-G1338 PolarHBondContact O-N 3.36Å; L1335-I1339 PolarHBondContact O-N 3.42Å; L1335-C1374 HydrophobicContact CD2-CB 3.79Å; L1335-I1377 HydrophobicContact CD1-CG2 3.96Å; L1335-I1377 HydrophobicContact CD2-CB 4.29Å; L1335-I1377 HydrophobicContact CD2-CD1 4.29Å; L1335-I1377 HydrophobicContact CD2-CG2 4.21Å; L1335-I1378 HydrophobicContact CD2-CG1 4.39Å; L1335-I1410 HydrophobicContact CD1-CG2 4.34Å
1336R89.3Confident81.3Confident48 Ų4845.9 Ų45.918%0.18124%0.235CC..Hα-helixtrans-65-41.6175.6-164.2177171.793.3-3.2111G1332 R1333 L1334 I1339 F1340 F1416 D1419G1332-R1336 WeakPolarHBondContact O-CB 3.29Å; G1332-R1336 PolarHBondContact O-N 2.94Å; R1333-R1336 WeakPolarHBondContact O-CB 3.25Å; R1333-R1336 PolarHBondContact O-N 3.15Å; L1334-R1336 PolarHBondContact O-N 2.79Å; R1336-I1339 PolarHBondContact O-N 3.39Å; R1336-F1340 HydrophobicContact CB-CD2 4.41Å; R1336-F1340 HydrophobicContact CG-CD2 3.47Å; R1336-F1340 VanDerWaalsContact CG-CD2 3.47Å; R1336-F1340 HydrophobicContact CG-CE2 3.8Å; R1336-F1340 WeakPolarHBondContact O-CB 3.37Å; R1336-F1340 WeakPolarHBondContact O-CD2 3.37Å; R1336-F1340 PolarHBondContact O-N 3.26Å; R1336-F1416 HydrophobicContact CB-CE2 4.36Å; R1336-F1416 HydrophobicContact CG-CE2 4.25Å; R1336-D1419 IonicContact CZ-OD1 3.11Å; R1336-D1419 IonicContact CZ-OD2 2.67Å; R1336-D1419 IonicContact NH1-OD1 3.36Å; R1336-D1419 PolarHBondContact NH1-OD1 2.84Å; R1336-D1419 IonicContact NH1-OD2 2.68Å; R1336-D1419 IonicContact NH2-OD1 2.81Å; R1336-D1419 PolarHBondContact NH2-OD1 3.29Å; R1336-D1419 IonicContact NH2-OD2 3.43Å; R1336-D1419 PolarHBondContact NH2-OD2 2.86Å
1337F88.3Confident79Confident18 Ų1843.2 Ų43.28%0.07923%0.227CC..Hα-helixtrans-59.6-44.8173.2177.3-98.2000112.6E1293 L1296 T1297 R1333 L1334 I1339 F1340 G1341 V1342E1293-F1337 HydrophobicContact CB-CD2 3.75Å; E1293-F1337 HydrophobicContact CB-CE2 3.8Å; E1293-F1337 HydrophobicContact CB-CG 4.15Å; E1293-F1337 HydrophobicContact CB-CZ 4.27Å; E1293-F1337 HydrophobicContact CG-CB 4.09Å; E1293-F1337 HydrophobicContact CG-CD2 3.76Å; E1293-F1337 HydrophobicContact CG-CE2 4.34Å; E1293-F1337 HydrophobicContact CG-CG 3.91Å; E1293-F1337 WeakPolarHBondContact O-CE1 3.35Å; E1293-F1337 WeakPolarHBondContact O-CZ 3.43Å; L1296-F1337 HydrophobicContact CB-CD1 4.13Å; L1296-F1337 HydrophobicContact CB-CE1 3.73Å; L1296-F1337 HydrophobicContact CD1-CD1 4.25Å; T1297-F1337 HydrophobicContact CG2-CZ 4.12Å; R1333-F1337 PolarHBondContact O-N 2.93Å; L1334-F1337 CarbonylContact O-C 3.39Å; L1334-F1337 WeakPolarHBondContact O-CA 3.4Å; L1334-F1337 VanDerWaalsContact O-CB 3.27Å; L1334-F1337 WeakPolarHBondContact O-CB 3.4Å; L1334-F1337 PolarHBondContact O-N 3.46Å; F1337-I1339 PolarHBondContact O-N 2.93Å; F1337-F1340 PolarHBondContact O-N 3.41Å; F1337-G1341 WeakPolarHBondContact O-CA 3.15Å; F1337-G1341 PolarHBondContact O-N 2.95Å; F1337-V1342 HydrophobicContact CE2-CB 4.41Å; F1337-V1342 HydrophobicContact CE2-CG2 3.58Å; F1337-V1342 HydrophobicContact CZ-CG2 4.13Å
1338G86.5Confident76.3Confident0 Ų047 Ų470%025%0.248CC..Hα-helixtrans-64.4-18.1178.700000115.1Y1306 L1334 L1335 V1366Y1306-G1338 WeakPolarHBondContact OH-CA 3.46Å; Y1306-G1338 PolarHBondContact OH-N 3.24Å; L1334-G1338 PolarHBondContact O-N 3.07Å; L1335-G1338 PolarHBondContact O-N 3.36Å; G1338-V1366 VanDerWaalsContact O-CG1 3.22Å; G1338-V1366 WeakPolarHBondContact O-CG1 3.34Å
1339I86.2Confident73.5Confident5 Ų554.9 Ų54.93%0.02628%0.284CS..Hα-helixtrans-98.6-43.2176.3-65.8166.7000111.4L1335 R1336 F1337 C1374 I1378 F1416 L1423L1335-I1339 PolarHBondContact O-N 3.42Å; R1336-I1339 PolarHBondContact O-N 3.39Å; F1337-I1339 PolarHBondContact O-N 2.93Å; I1339-C1374 HydrophobicContact CD1-CB 3.85Å; I1339-C1374 HydrophobicContact CG1-CB 3.51Å; I1339-I1378 HydrophobicContact CD1-CD1 3.55Å; I1339-F1416 HydrophobicContact CD1-CZ 3.81Å; I1339-L1423 HydrophobicContact CG2-CD1 3.49Å; I1339-L1423 VanDerWaalsContact CG2-CD1 3.49Å
1340F83.3Confident70.8Confident12 Ų1258.4 Ų58.45%0.05330%0.297CS..Hα-helixtrans-104.8-17-167.3-61.4-73000114.7R1336 F1337 F1344 F1416 D1419 L1420 L1423R1336-F1340 HydrophobicContact CB-CD2 4.41Å; R1336-F1340 HydrophobicContact CG-CD2 3.47Å; R1336-F1340 VanDerWaalsContact CG-CD2 3.47Å; R1336-F1340 HydrophobicContact CG-CE2 3.8Å; R1336-F1340 WeakPolarHBondContact O-CB 3.37Å; R1336-F1340 WeakPolarHBondContact O-CD2 3.37Å; R1336-F1340 PolarHBondContact O-N 3.26Å; F1337-F1340 PolarHBondContact O-N 3.41Å; F1340-F1344 HydrophobicContact CB-CB 3.56Å; F1340-F1344 HydrophobicContact CB-CD1 4.21Å; F1340-F1344 HydrophobicContact CB-CD2 3.9Å; F1340-F1344 HydrophobicContact CB-CG 3.62Å; F1340-F1344 HydrophobicContact CD1-CD1 4.21Å; F1340-F1344 AromaticContact CD1-CD2 3.6Å; F1340-F1344 HydrophobicContact CD1-CD2 3.6Å; F1340-F1344 HydrophobicContact CD1-CE1 4.21Å; F1340-F1344 AromaticContact CD1-CE2 3.57Å; F1340-F1344 HydrophobicContact CD1-CE2 3.57Å; F1340-F1344 AromaticContact CD1-CG 3.93Å; F1340-F1344 HydrophobicContact CD1-CG 3.93Å; F1340-F1344 AromaticContact CD1-CZ 3.9Å; F1340-F1344 HydrophobicContact CD1-CZ 3.9Å; F1340-F1344 HydrophobicContact CE1-CE1 4.47Å; F1340-F1344 HydrophobicContact CE1-CE2 4.05Å; F1340-F1344 HydrophobicContact CE1-CZ 4.04Å; F1340-F1344 HydrophobicContact CG-CB 4.41Å; F1340-F1344 HydrophobicContact CG-CD1 4.17Å; F1340-F1344 HydrophobicContact CG-CD2 4.06Å; F1340-F1344 HydrophobicContact CG-CE2 4.4Å; F1340-F1344 AromaticContact CG-CG 3.94Å; F1340-F1344 HydrophobicContact CG-CG 3.94Å; F1340-F1416 HydrophobicContact CE2-CD2 4.37Å; F1340-F1416 AromaticContact CE2-CE2 3.9Å; F1340-F1416 HydrophobicContact CE2-CE2 3.9Å; F1340-F1416 HydrophobicContact CE2-CZ 4.33Å; F1340-D1419 VanDerWaalsContact CE1-C 3.46Å; F1340-D1419 HydrophobicContact CE1-CB 3.73Å; F1340-D1419 WeakPolarHBondContact CE1-O 3.25Å; F1340-D1419 HydrophobicContact CE2-CB 4.08Å; F1340-D1419 HydrophobicContact CZ-CB 3.42Å; F1340-D1419 VanDerWaalsContact CZ-CB 3.42Å; F1340-L1420 HydrophobicContact CZ-CG 4.4Å; F1340-L1423 HydrophobicContact CD1-CD1 3.57Å; F1340-L1423 HydrophobicContact CD1-CG 4.26Å; F1340-L1423 HydrophobicContact CE1-CB 4.49Å; F1340-L1423 HydrophobicContact CE1-CD1 3.51Å; F1340-L1423 HydrophobicContact CE1-CG 4.23Å; F1340-L1423 HydrophobicContact CZ-CD1 4.43Å
1341G78.9Confident67.9Low12 Ų1267.7 Ų67.712%0.12434%0.335CS..  trans69.9-173.6-175.300000114.3F1337 E1343F1337-G1341 WeakPolarHBondContact O-CA 3.15Å; F1337-G1341 PolarHBondContact O-N 2.95Å; G1341-E1343 PolarHBondContact O-N 3.05Å
1342V68.3Low64.7Low96 Ų9672.1 Ų72.158%0.58237%0.366SS*.G310 helixtrans-64.1-36.5-173.8-176.40000112.8F1337 F1344F1337-V1342 HydrophobicContact CE2-CB 4.41Å; F1337-V1342 HydrophobicContact CE2-CG2 3.58Å; F1337-V1342 HydrophobicContact CZ-CG2 4.13Å; V1342-F1344 PolarHBondContact O-N 3.04Å
1343E58.2Low61.6Low133 Ų13376.9 Ų76.962%0.62140%0.398SS*.G310 helixtrans-80.4-15.3-165.3-65.3-170.8160.100114.6G1341 N1345 Q1346G1341-E1343 PolarHBondContact O-N 3.05Å; E1343-N1345 VanDerWaalsContact C-N 3.33Å; E1343-N1345 PolarHBondContact O-N 3.3Å; E1343-Q1346 PolarHBondContact O-N 3.18Å
1344F57.8Low58.5Low22 Ų2276.4 Ų76.410%0.09641%0.412CS..G310 helixtrans-70.5-26.4-166.8-161.8-85.3000114.2F1340 V1342 S1347 D1419 T1422F1340-F1344 HydrophobicContact CB-CB 3.56Å; F1340-F1344 HydrophobicContact CB-CD1 4.21Å; F1340-F1344 HydrophobicContact CB-CD2 3.9Å; F1340-F1344 HydrophobicContact CB-CG 3.62Å; F1340-F1344 HydrophobicContact CD1-CD1 4.21Å; F1340-F1344 AromaticContact CD1-CD2 3.6Å; F1340-F1344 HydrophobicContact CD1-CD2 3.6Å; F1340-F1344 HydrophobicContact CD1-CE1 4.21Å; F1340-F1344 AromaticContact CD1-CE2 3.57Å; F1340-F1344 HydrophobicContact CD1-CE2 3.57Å; F1340-F1344 AromaticContact CD1-CG 3.93Å; F1340-F1344 HydrophobicContact CD1-CG 3.93Å; F1340-F1344 AromaticContact CD1-CZ 3.9Å; F1340-F1344 HydrophobicContact CD1-CZ 3.9Å; F1340-F1344 HydrophobicContact CE1-CE1 4.47Å; F1340-F1344 HydrophobicContact CE1-CE2 4.05Å; F1340-F1344 HydrophobicContact CE1-CZ 4.04Å; F1340-F1344 HydrophobicContact CG-CB 4.41Å; F1340-F1344 HydrophobicContact CG-CD1 4.17Å; F1340-F1344 HydrophobicContact CG-CD2 4.06Å; F1340-F1344 HydrophobicContact CG-CE2 4.4Å; F1340-F1344 AromaticContact CG-CG 3.94Å; F1340-F1344 HydrophobicContact CG-CG 3.94Å; V1342-F1344 PolarHBondContact O-N 3.04Å; F1344-S1347 PolarHBondContact O-OG 2.71Å; F1344-D1419 HydrophobicContact CE1-CB 3.74Å; F1344-D1419 VanDerWaalsContact CE1-OD2 3.24Å; F1344-D1419 WeakPolarHBondContact CE1-OD2 3.25Å; F1344-D1419 HydrophobicContact CZ-CB 3.78Å; F1344-T1422 VanDerWaalsContact CZ-OG1 3.27Å; F1344-T1422 WeakPolarHBondContact CZ-OG1 3.41Å
1345N49.7Very low55.4Low98 Ų9883.2 Ų83.252%0.52445%0.454SS..G310 helixtrans-80-14.1-178.7-74.2-25.6000114E1343E1343-N1345 VanDerWaalsContact C-N 3.33Å; E1343-N1345 PolarHBondContact O-N 3.3Å
1346Q46.5Very low52.3Low145 Ų14588.9 Ų88.968%0.67849%0.494SS*.G310 helixtrans-79.4-20.6-176.5-70.7-1759.500113.8E1343 N1348E1343-Q1346 PolarHBondContact O-N 3.18Å; Q1346-N1348 PolarHBondContact O-N 2.68Å
1347S41.6Very low49.3Very low78 Ų7897.3 Ų97.355%0.54553%0.526SS..G310 helixtrans-73.7-27.2-173.856.70000114.3F1344 H1349F1344-S1347 PolarHBondContact O-OG 2.71Å; S1347-H1349 PolarHBondContact O-N 2.98Å
1348N36.3Very low46.5Very low109 Ų109101.9 Ų101.958%0.58356%0.56SS**G310 helixtrans-82.4-6.7-175.3-78.4-24.9000115.2Q1346Q1346-N1348 PolarHBondContact O-N 2.68Å
1349H32.5Very low43.6Very low167 Ų167106.8 Ų106.877%0.77359%0.594SS**G310 helixtrans-107.32.6-178.1-91-60.9000116S1347 K1351S1347-H1349 PolarHBondContact O-N 2.98Å; H1349-K1351 PolarHBondContact O-N 3.23Å; H1349-K1351 VanDerWaalsContact O-N 3.14Å
1350I33.1Very low40.9Very low135 Ų135111.8 Ų111.869%0.69263%0.63SS**  trans-93.779.7-177.8-52.3178.4000110.7
1351K31.1Very low38.2Very low218 Ų218115.9 Ų115.995%0.94866%0.659SS**  trans-115.915.2153.8-99.4-174.5-178.1176.70113H1349H1349-K1351 PolarHBondContact O-N 3.23Å; H1349-K1351 VanDerWaalsContact O-N 3.14Å
1352S25.4Very low35.9Very low95 Ų95120.9 Ų120.966%0.66469%0.692SS**SBendtrans-123.3122.9173.756.70000111.8
1353S26Very low34.3Very low106 Ų106120.4 Ų120.474%0.74170%0.698SS**  trans-45.9142.4176.248.70000115.3
1354S26.4Very low33.5Very low104 Ų104117.3 Ų117.373%0.72770%0.702SS**  trans59.795.8151.763.70000118
1355T26.7Very low33.3Very low142 Ų142121.3 Ų121.387%0.87173%0.731SS**  -162.7113.7127250000110.1R1357T1355-R1357 PolarHBondContact O-N 3.46Å
1356S26.4Very low34.1Very low123 Ų123118 Ų11886%0.8671%0.714SS**  trans-66.811116649.80000110.3
1357R27Very low35.4Very low225 Ų225116.1 Ų116.185%0.84971%0.709SS**  trans-139.495.9159.7-85.7-170173.6167.8-2.3110.6T1355T1355-R1357 PolarHBondContact O-N 3.46Å
1358S27.7Very low37.2Very low115 Ų115115.5 Ų115.580%0.80470%0.7SS**  18.2107.4126.359.80000118.1
1359S26.1Very low39.3Very low102 Ų102112.4 Ų112.471%0.71369%0.687SS**  trans-152.6119.1134.351.70000108.8C1361S1359-C1361 PolarHBondContact O-N 3.04Å
1360S29.1Very low41.9Very low111 Ų111104.7 Ų104.778%0.77665%0.651SS**  trans-66.7105.9167.447.40000109.1
1361C27.2Very low44.5Very low97 Ų9798.9 Ų98.966%0.65562%0.621SS**  trans-125.9115.5154.1-80.10000106S1359 A1363S1359-C1361 PolarHBondContact O-N 3.04Å; C1361-A1363 PolarHBondContact O-N 3.48Å
1362S30.6Very low47.2Very low117 Ų11790.7 Ų90.782%0.81859%0.587SS**  trans-47.8128.6157.943.90000107.7G1364S1362-G1364 PolarHBondContact O-N 3.3Å
1363A35.5Very low50.2Low86 Ų8687.9 Ų87.971%0.71156%0.563SS**  trans-34102.9-178.300000112.2C1361 C1365C1361-A1363 PolarHBondContact O-N 3.48Å; A1363-C1365 PolarHBondContact O-N 2.71Å
1364G41.5Very low53.3Low69 Ų6982.9 Ų82.971%0.71153%0.528SS*.  trans-71.273.9165.500000107.6S1362 V1366S1362-G1364 PolarHBondContact O-N 3.3Å; G1364-V1366 PolarHBondContact O-N 3.49Å
1365C53.2Low56.4Low105 Ų10577.9 Ų77.971%0.70949%0.493SS*.PPolyproline II helixtrans-70.4118.9172.4-146.60000106.4A1363 D1367A1363-C1365 PolarHBondContact O-N 2.71Å; C1365-D1367 PolarHBondContact O-N 2.89Å
1366V65.4Low59.2Low28 Ų2873.5 Ų73.517%0.1746%0.464CS..PPolyproline II helixtrans-61.9136.2176.5-174.70000108.2G1338 G1364 V1370 I1371G1338-V1366 VanDerWaalsContact O-CG1 3.22Å; G1338-V1366 WeakPolarHBondContact O-CG1 3.34Å; G1364-V1366 PolarHBondContact O-N 3.49Å; V1366-V1370 HydrophobicContact CG1-CB 3.93Å; V1366-V1370 HydrophobicContact CG1-CG1 3.75Å; V1366-I1371 HydrophobicContact CB-CD1 4.43Å; V1366-I1371 HydrophobicContact CB-CG1 4.25Å; V1366-I1371 HydrophobicContact CG1-CG1 4.23Å
1367D75.5Confident62.3Low106 Ų10667.6 Ų67.657%0.56742%0.423SS*.PPolyproline II helixtrans-59.4138.8-173.9-144.3-7.7000111C1365 S1369 V1370 I1371C1365-D1367 PolarHBondContact O-N 2.89Å; D1367-S1369 PolarHBondContact O-N 3.28Å; D1367-S1369 VanDerWaalsContact O-N 3.14Å; D1367-V1370 HydrophobicContact CB-CG2 4.31Å; D1367-V1370 WeakPolarHBondContact O-CB 3.33Å; D1367-V1370 PolarHBondContact O-N 2.83Å; D1367-I1371 PolarHBondContact O-N 3.37Å; D1367-I1371 VanDerWaalsContact O-N 3.16Å
1368N78.3Confident65.4Low65 Ų6557 Ų5735%0.34838%0.383SS..Hα-helixtrans-60.6-31.5-173.1-73.5-45.2000111.7V1370 I1371 Q1372 S1430 L1433N1368-V1370 VanDerWaalsContact C-N 3.34Å; N1368-V1370 PolarHBondContact O-N 3.37Å; N1368-I1371 PolarHBondContact O-N 3.27Å; N1368-Q1372 WeakPolarHBondContact O-CB 3.41Å; N1368-Q1372 PolarHBondContact O-N 3.08Å; N1368-S1430 WeakPolarHBondContact OD1-CB 3.3Å; N1368-L1433 HydrophobicContact CB-CD2 4.47Å; N1368-L1433 WeakPolarHBondContact O-CD2 3.33Å; N1368-L1433 WeakPolarHBondContact OD1-CD1 3.11Å
1369S81.5Confident68.4Low44 Ų4452.5 Ų52.531%0.30835%0.35SS..Hα-helixtrans-60.3-42175.460.70000112.3D1367 Q1372 Q1373D1367-S1369 PolarHBondContact O-N 3.28Å; D1367-S1369 VanDerWaalsContact O-N 3.14Å; S1369-Q1372 PolarHBondContact O-N 2.95Å; S1369-Q1373 WeakPolarHBondContact O-CG 3.48Å; S1369-Q1373 PolarHBondContact O-N 3.02Å
1370V87.2Confident71.3Confident5 Ų549 Ų493%0.0333%0.326CS..Hα-helixtrans-69.2-43.5178.81730000110.5Y1306 V1366 D1367 N1368 Q1372 Q1373 C1374Y1306-V1370 HydrophobicContact CD2-CG1 3.45Å; Y1306-V1370 VanDerWaalsContact CD2-CG1 3.45Å; Y1306-V1370 HydrophobicContact CE2-CG1 3.52Å; Y1306-V1370 HydrophobicContact CG-CG1 4.06Å; V1366-V1370 HydrophobicContact CG1-CB 3.93Å; V1366-V1370 HydrophobicContact CG1-CG1 3.75Å; D1367-V1370 HydrophobicContact CB-CG2 4.31Å; D1367-V1370 WeakPolarHBondContact O-CB 3.33Å; D1367-V1370 PolarHBondContact O-N 2.83Å; N1368-V1370 VanDerWaalsContact C-N 3.34Å; N1368-V1370 PolarHBondContact O-N 3.37Å; V1370-Q1372 VanDerWaalsContact C-N 3.26Å; V1370-Q1372 PolarHBondContact O-N 3.14Å; V1370-Q1373 PolarHBondContact O-N 3.31Å; V1370-C1374 PolarHBondContact O-N 3.14Å; V1370-C1374 PolarHBondContact O-SG 3.41Å
1371I87.7Confident74.2Confident13 Ų1344.6 Ų44.67%0.06729%0.293CS..Hα-helixtrans-59.1-43.7175.6-59.9172.7000109.7V1366 D1367 N1368 C1374 L1375 L1433V1366-I1371 HydrophobicContact CB-CD1 4.43Å; V1366-I1371 HydrophobicContact CB-CG1 4.25Å; V1366-I1371 HydrophobicContact CG1-CG1 4.23Å; D1367-I1371 PolarHBondContact O-N 3.37Å; D1367-I1371 VanDerWaalsContact O-N 3.16Å; N1368-I1371 PolarHBondContact O-N 3.27Å; I1371-C1374 WeakPolarHBondContact O-CB 3.12Å; I1371-C1374 PolarHBondContact O-N 2.97Å; I1371-L1375 HydrophobicContact CG2-CD1 3.98Å; I1371-L1375 HydrophobicContact CG2-CG 4.4Å; I1371-L1375 VanDerWaalsContact O-CG 3.27Å; I1371-L1375 WeakPolarHBondContact O-CG 3.07Å; I1371-L1375 PolarHBondContact O-N 2.89Å; I1371-L1433 HydrophobicContact CB-CD1 4.13Å; I1371-L1433 HydrophobicContact CB-CD2 4.26Å; I1371-L1433 HydrophobicContact CD1-CD1 4.09Å; I1371-L1433 HydrophobicContact CG2-CD1 3.84Å; I1371-L1433 HydrophobicContact CG2-CD2 4.21Å
1372Q85.9Confident77.2Confident47 Ų4740 Ų4022%0.2226%0.262CS..Hα-helixtrans-62.4-47177.3-173.4163-13.300112.2N1368 S1369 V1370 C1374 L1375 D1376 L1433N1368-Q1372 WeakPolarHBondContact O-CB 3.41Å; N1368-Q1372 PolarHBondContact O-N 3.08Å; S1369-Q1372 PolarHBondContact O-N 2.95Å; V1370-Q1372 VanDerWaalsContact C-N 3.26Å; V1370-Q1372 PolarHBondContact O-N 3.14Å; Q1372-C1374 VanDerWaalsContact C-N 3.3Å; Q1372-C1374 PolarHBondContact O-N 3.41Å; Q1372-L1375 PolarHBondContact O-N 3.38Å; Q1372-L1375 VanDerWaalsContact O-N 3.12Å; Q1372-D1376 PolarHBondContact O-N 3.12Å; Q1372-L1433 HydrophobicContact CB-CD2 3.91Å
1373Q88.5Confident79.9Confident36 Ų3635.3 Ų35.317%0.16823%0.228CC..Hα-helixtrans-59-40.7175.3-72.5173.8-0.800112.2S1369 V1370 D1376 I1377S1369-Q1373 WeakPolarHBondContact O-CG 3.48Å; S1369-Q1373 PolarHBondContact O-N 3.02Å; V1370-Q1373 PolarHBondContact O-N 3.31Å; Q1373-D1376 PolarHBondContact O-N 3.27Å; Q1373-I1377 VanDerWaalsContact O-CG1 3.27Å; Q1373-I1377 WeakPolarHBondContact O-CG1 3.23Å; Q1373-I1377 PolarHBondContact O-N 3.17Å
1374C92.1Very high82.2Confident0 Ų033 Ų330%020%0.202CC..Hα-helixtrans-62.2-43.3174.7-67.60000112.1Y1306 L1335 I1339 V1370 I1371 Q1372 I1377 I1378Y1306-C1374 WeakPolarHBondContact CD1-SG 3.42Å; Y1306-C1374 WeakPolarHBondContact CE1-SG 3.46Å; L1335-C1374 HydrophobicContact CD2-CB 3.79Å; I1339-C1374 HydrophobicContact CD1-CB 3.85Å; I1339-C1374 HydrophobicContact CG1-CB 3.51Å; V1370-C1374 PolarHBondContact O-N 3.14Å; V1370-C1374 PolarHBondContact O-SG 3.41Å; I1371-C1374 WeakPolarHBondContact O-CB 3.12Å; I1371-C1374 PolarHBondContact O-N 2.97Å; Q1372-C1374 VanDerWaalsContact C-N 3.3Å; Q1372-C1374 PolarHBondContact O-N 3.41Å; C1374-I1377 WeakPolarHBondContact O-CB 3.5Å; C1374-I1377 PolarHBondContact O-N 3.37Å; C1374-I1378 WeakPolarHBondContact O-CG1 3.4Å; C1374-I1378 PolarHBondContact O-N 3.41Å; C1374-I1378 VanDerWaalsContact O-N 3.13Å
1375L90.3Very high84.3Confident0 Ų030.3 Ų30.30%017%0.171CC..Hα-helixtrans-65.3-39.7176.2-68.7168.8000111.4I1371 Q1372 I1377 I1378 I1379 L1420 F1437 A1440I1371-L1375 HydrophobicContact CG2-CD1 3.98Å; I1371-L1375 HydrophobicContact CG2-CG 4.4Å; I1371-L1375 VanDerWaalsContact O-CG 3.27Å; I1371-L1375 WeakPolarHBondContact O-CG 3.07Å; I1371-L1375 PolarHBondContact O-N 2.89Å; Q1372-L1375 PolarHBondContact O-N 3.38Å; Q1372-L1375 VanDerWaalsContact O-N 3.12Å; L1375-I1377 VanDerWaalsContact C-N 3.34Å; L1375-I1377 PolarHBondContact O-N 2.88Å; L1375-I1378 WeakPolarHBondContact O-CB 3.37Å; L1375-I1378 PolarHBondContact O-N 3.39Å; L1375-I1378 VanDerWaalsContact O-N 3.13Å; L1375-I1379 VanDerWaalsContact O-CG1 3.24Å; L1375-I1379 WeakPolarHBondContact O-CG1 3.49Å; L1375-I1379 PolarHBondContact O-N 2.84Å; L1375-L1420 HydrophobicContact CD2-CD2 4.09Å; L1375-F1437 HydrophobicContact CD1-CD2 3.6Å; L1375-F1437 HydrophobicContact CD1-CE2 4.1Å; L1375-F1437 HydrophobicContact CD1-CG 4.36Å; L1375-F1437 HydrophobicContact CD2-CD2 4.37Å; L1375-A1440 HydrophobicContact CD2-CB 3.85Å
1376D87Confident85.8Confident49 Ų4925.3 Ų25.326%0.26214%0.137SC..Hα-helixtrans-65.9-36.3178-66.7-21.4000111.9Q1372 Q1373 I1379 S1380Q1372-D1376 PolarHBondContact O-N 3.12Å; Q1373-D1376 PolarHBondContact O-N 3.27Å; D1376-I1379 PolarHBondContact O-N 2.61Å; D1376-S1380 WeakPolarHBondContact O-CB 3.47Å; D1376-S1380 PolarHBondContact O-N 2.9Å; D1376-S1380 PolarHBondContact O-OG 3.06Å
1377I91.7Very high86.7Confident0 Ų026.6 Ų26.60%014%0.141CC..Hα-helixtrans-59.1-48.2169.6-68.7162.5000110.3Y1306 A1309 S1310 C1313 F1331 L1335 Q1373 C1374 L1375 S1380 L1381Y1306-I1377 HydrophobicContact CD1-CD1 4.41Å; A1309-I1377 HydrophobicContact CB-CD1 3.7Å; S1310-I1377 VanDerWaalsContact CA-CG1 3.48Å; C1313-I1377 HydrophobicContact CB-CG2 4.4Å; F1331-I1377 HydrophobicContact CE1-CG2 4.37Å; F1331-I1377 HydrophobicContact CZ-CG2 4.28Å; L1335-I1377 HydrophobicContact CD1-CG2 3.96Å; L1335-I1377 HydrophobicContact CD2-CB 4.29Å; L1335-I1377 HydrophobicContact CD2-CD1 4.29Å; L1335-I1377 HydrophobicContact CD2-CG2 4.21Å; Q1373-I1377 VanDerWaalsContact O-CG1 3.27Å; Q1373-I1377 WeakPolarHBondContact O-CG1 3.23Å; Q1373-I1377 PolarHBondContact O-N 3.17Å; C1374-I1377 WeakPolarHBondContact O-CB 3.5Å; C1374-I1377 PolarHBondContact O-N 3.37Å; L1375-I1377 VanDerWaalsContact C-N 3.34Å; L1375-I1377 PolarHBondContact O-N 2.88Å; I1377-S1380 PolarHBondContact O-N 3.2Å; I1377-L1381 HydrophobicContact CG2-CD1 3.82Å; I1377-L1381 WeakPolarHBondContact O-CB 3.35Å; I1377-L1381 WeakPolarHBondContact O-CG 3.25Å; I1377-L1381 PolarHBondContact O-N 3.15Å
1378I91.5Very high86.9Confident1 Ų122.1 Ų22.11%0.00512%0.117CC..Hα-helixtrans-63.1-45.9179.6-65.8162.2000110.4L1335 I1339 C1374 L1375 S1380 L1381 T1382 L1412 F1416 A1440 L1444L1335-I1378 HydrophobicContact CD2-CG1 4.39Å; I1339-I1378 HydrophobicContact CD1-CD1 3.55Å; C1374-I1378 WeakPolarHBondContact O-CG1 3.4Å; C1374-I1378 PolarHBondContact O-N 3.41Å; C1374-I1378 VanDerWaalsContact O-N 3.13Å; L1375-I1378 WeakPolarHBondContact O-CB 3.37Å; L1375-I1378 PolarHBondContact O-N 3.39Å; L1375-I1378 VanDerWaalsContact O-N 3.13Å; I1378-S1380 VanDerWaalsContact C-N 3.33Å; I1378-S1380 PolarHBondContact O-N 2.94Å; I1378-L1381 PolarHBondContact O-N 3.45Å; I1378-T1382 HydrophobicContact CG2-CG2 4.05Å; I1378-T1382 WeakPolarHBondContact O-CB 3.36Å; I1378-T1382 VanDerWaalsContact O-CG2 3.23Å; I1378-T1382 WeakPolarHBondContact O-CG2 3.38Å; I1378-T1382 PolarHBondContact O-N 2.88Å; I1378-T1382 PolarHBondContact O-OG1 2.97Å; I1378-L1412 HydrophobicContact CG1-CD2 4.11Å; I1378-L1412 HydrophobicContact CG2-CD2 4.22Å; I1378-F1416 HydrophobicContact CD1-CE1 3.72Å; I1378-F1416 HydrophobicContact CD1-CZ 3.67Å; I1378-A1440 HydrophobicContact CG2-CB 4.35Å; I1378-L1444 HydrophobicContact CG2-CD1 4.32Å; I1378-L1444 HydrophobicContact CG2-CG 4.41Å
1379I89.8Confident86.9Confident22 Ų2222.1 Ų22.111%0.11311%0.112CC..Hα-helixtrans-58-48.3178-68.2162.3000109.7L1375 D1376 L1381 T1382 D1383 A1440 N1443L1375-I1379 VanDerWaalsContact O-CG1 3.24Å; L1375-I1379 WeakPolarHBondContact O-CG1 3.49Å; L1375-I1379 PolarHBondContact O-N 2.84Å; D1376-I1379 PolarHBondContact O-N 2.61Å; I1379-L1381 PolarHBondContact O-N 3.34Å; I1379-T1382 PolarHBondContact O-N 3.42Å; I1379-T1382 PolarHBondContact O-OG1 3.48Å; I1379-T1382 VanDerWaalsContact O-OG1 3.1Å; I1379-D1383 VanDerWaalsContact O-CB 3.24Å; I1379-D1383 WeakPolarHBondContact O-CB 3.4Å; I1379-D1383 PolarHBondContact O-N 2.79Å; I1379-A1440 HydrophobicContact CD1-CB 4.47Å; I1379-A1440 HydrophobicContact CG1-CB 3.97Å; I1379-N1443 PolarHBondContact O-ND2 3.3Å
1380S88.8Confident86.6Confident29 Ų2922.3 Ų22.320%0.20311%0.114CC..Hα-helixtrans-61.3-44.9-179.6-60.60000112.4D1376 I1377 I1378 H1384D1376-S1380 WeakPolarHBondContact O-CB 3.47Å; D1376-S1380 PolarHBondContact O-N 2.9Å; D1376-S1380 PolarHBondContact O-OG 3.06Å; I1377-S1380 PolarHBondContact O-N 3.2Å; I1378-S1380 VanDerWaalsContact C-N 3.33Å; I1378-S1380 PolarHBondContact O-N 2.94Å; S1380-H1384 WeakPolarHBondContact O-CB 3.41Å; S1380-H1384 PolarHBondContact O-N 2.86Å; S1380-H1384 VanDerWaalsContact O-N 3.09Å
1381L89.7Confident85.9Confident17 Ų1729.3 Ų29.39%0.08914%0.14CC..Hα-helixtrans-66.8-45.1178.9-74.9168.8000112.6P1317 L1320 I1377 I1378 I1379 H1384 F1385 I1410P1317-L1381 HydrophobicContact CB-CD2 3.82Å; L1320-L1381 HydrophobicContact CD1-CD1 4.07Å; L1320-L1381 HydrophobicContact CD1-CD2 3.57Å; L1320-L1381 HydrophobicContact CD1-CG 4.39Å; I1377-L1381 HydrophobicContact CG2-CD1 3.82Å; I1377-L1381 WeakPolarHBondContact O-CB 3.35Å; I1377-L1381 WeakPolarHBondContact O-CG 3.25Å; I1377-L1381 PolarHBondContact O-N 3.15Å; I1378-L1381 PolarHBondContact O-N 3.45Å; I1379-L1381 PolarHBondContact O-N 3.34Å; L1381-H1384 WeakPolarHBondContact O-CB 3.38Å; L1381-H1384 PolarHBondContact O-N 2.93Å; L1381-F1385 PolarHBondContact O-N 3.44Å; L1381-I1410 HydrophobicContact CD1-CD1 4Å
1382T89Confident84.7Confident0 Ų030.7 Ų30.70%015%0.151CC..Hα-helixtrans-71.2-36.6-178.755.10000111.7I1378 I1379 H1384 F1385 L1386 L1412 N1443 L1444 L1447I1378-T1382 HydrophobicContact CG2-CG2 4.05Å; I1378-T1382 WeakPolarHBondContact O-CB 3.36Å; I1378-T1382 VanDerWaalsContact O-CG2 3.23Å; I1378-T1382 WeakPolarHBondContact O-CG2 3.38Å; I1378-T1382 PolarHBondContact O-N 2.88Å; I1378-T1382 PolarHBondContact O-OG1 2.97Å; I1379-T1382 PolarHBondContact O-N 3.42Å; I1379-T1382 PolarHBondContact O-OG1 3.48Å; I1379-T1382 VanDerWaalsContact O-OG1 3.1Å; T1382-H1384 VanDerWaalsContact C-N 3.32Å; T1382-H1384 PolarHBondContact O-N 3.01Å; T1382-F1385 PolarHBondContact O-N 2.93Å; T1382-L1386 WeakPolarHBondContact O-CB 3.25Å; T1382-L1386 VanDerWaalsContact O-CG 3.3Å; T1382-L1386 WeakPolarHBondContact O-CG 3.41Å; T1382-L1386 PolarHBondContact O-N 3.21Å; T1382-L1412 HydrophobicContact CG2-CD1 4.3Å; T1382-N1443 HydrophobicContact CG2-CB 4.49Å; T1382-N1443 WeakPolarHBondContact OG1-CB 3.33Å; T1382-N1443 PolarHBondContact OG1-ND2 3.23Å; T1382-L1444 HydrophobicContact CG2-CD2 4.05Å; T1382-L1444 HydrophobicContact CG2-CG 4.48Å; T1382-L1447 HydrophobicContact CG2-CD1 3.42Å; T1382-L1447 VanDerWaalsContact CG2-CD1 3.42Å
1383D87.4Confident83.5Confident19 Ų1938.7 Ų38.710%0.10218%0.179CC..Hα-helixtrans-61-42.9171.9-93.7-8.1000112I1379 F1385 L1386 E1387 N1443 K1520 R1526I1379-D1383 VanDerWaalsContact O-CB 3.24Å; I1379-D1383 WeakPolarHBondContact O-CB 3.4Å; I1379-D1383 PolarHBondContact O-N 2.79Å; D1383-F1385 VanDerWaalsContact C-N 3.35Å; D1383-L1386 PolarHBondContact O-N 3.35Å; D1383-E1387 WeakPolarHBondContact O-CB 3.5Å; D1383-E1387 PolarHBondContact O-N 2.87Å; D1383-N1443 PolarHBondContact OD1-ND2 2.88Å; D1383-K1520 VanDerWaalsContact CG-CE 3.49Å; D1383-R1526 IonicContact OD1-CZ 3.42Å; D1383-R1526 IonicContact OD1-NH2 3.69Å; D1383-R1526 PolarHBondContact OD1-NH2 2.99Å; D1383-R1526 IonicContact OD2-CZ 2.87Å; D1383-R1526 IonicContact OD2-NH1 3.12Å; D1383-R1526 PolarHBondContact OD2-NH1 3.23Å; D1383-R1526 VanDerWaalsContact OD2-NH1 3.16Å; D1383-R1526 IonicContact OD2-NH2 3.87Å; D1383-R1526 PolarHBondContact OD2-NH2 3.41Å
1384H84.8Confident81.6Confident38 Ų3841.3 Ų41.318%0.17620%0.201CC..Hα-helixtrans-61.8-44.4176.8-173.960.8000111.9P1317 Q1318 S1380 L1381 T1382 E1387 I1388P1317-H1384 HydrophobicContact CB-CB 4.23Å; P1317-H1384 HydrophobicContact CG-CB 3.6Å; Q1318-H1384 VanDerWaalsContact CD-CE1 3.47Å; Q1318-H1384 VanDerWaalsContact CG-CE1 3.44Å; Q1318-H1384 WeakPolarHBondContact CG-CE1 3.26Å; Q1318-H1384 WeakPolarHBondContact CG-NE2 3.25Å; Q1318-H1384 PolarHBondContact NE2-CE1 3.47Å; Q1318-H1384 PolarHBondContact NE2-NE2 2.89Å; Q1318-H1384 VanDerWaalsContact NE2-NE2 3.19Å; S1380-H1384 WeakPolarHBondContact O-CB 3.41Å; S1380-H1384 PolarHBondContact O-N 2.86Å; S1380-H1384 VanDerWaalsContact O-N 3.09Å; L1381-H1384 WeakPolarHBondContact O-CB 3.38Å; L1381-H1384 PolarHBondContact O-N 2.93Å; T1382-H1384 VanDerWaalsContact C-N 3.32Å; T1382-H1384 PolarHBondContact O-N 3.01Å; H1384-E1387 WeakPolarHBondContact O-CB 3.36Å; H1384-E1387 PolarHBondContact O-N 3.38Å; H1384-I1388 WeakPolarHBondContact NE2-CD1 3.42Å; H1384-I1388 WeakPolarHBondContact O-CG1 3.41Å; H1384-I1388 PolarHBondContact O-N 3.46Å
1385F84.8Confident79.5Confident12 Ų1252.3 Ų52.35%0.05324%0.242CC..Hα-helixtrans-63.9-46.2177.2-174-84.4000112.4L1381 T1382 D1383 E1387 I1388 R1389 A1403 I1404 I1407 L1447L1381-F1385 PolarHBondContact O-N 3.44Å; T1382-F1385 PolarHBondContact O-N 2.93Å; D1383-F1385 VanDerWaalsContact C-N 3.35Å; F1385-E1387 PolarHBondContact O-N 3.1Å; F1385-I1388 PolarHBondContact O-N 3.29Å; F1385-R1389 HydrophobicContact CD1-CB 4.49Å; F1385-R1389 HydrophobicContact CE1-CB 4.35Å; F1385-R1389 WeakPolarHBondContact O-CB 3.45Å; F1385-R1389 PolarHBondContact O-N 3.47Å; F1385-A1403 HydrophobicContact CD2-CB 3.3Å; F1385-A1403 VanDerWaalsContact CE2-C 3.44Å; F1385-A1403 HydrophobicContact CE2-CB 3.56Å; F1385-A1403 HydrophobicContact CG-CB 4.4Å; F1385-I1404 HydrophobicContact CE2-CG1 3.86Å; F1385-I1404 HydrophobicContact CZ-CG1 3.92Å; F1385-I1407 HydrophobicContact CB-CD1 3.9Å; F1385-I1407 HydrophobicContact CD1-CD1 3.83Å; F1385-I1407 HydrophobicContact CD2-CD1 3.23Å; F1385-I1407 HydrophobicContact CD2-CG1 4.03Å; F1385-I1407 HydrophobicContact CE1-CD1 4.1Å; F1385-I1407 HydrophobicContact CE2-CD1 3.63Å; F1385-I1407 HydrophobicContact CE2-CG1 4.46Å; F1385-I1407 HydrophobicContact CG-CD1 3.37Å; F1385-I1407 HydrophobicContact CG-CG1 4.47Å; F1385-I1407 HydrophobicContact CZ-CD1 4.04Å; F1385-L1447 HydrophobicContact CD1-CD2 3.18Å; F1385-L1447 HydrophobicContact CD1-CG 4.36Å; F1385-L1447 HydrophobicContact CE1-CD2 3.36Å; F1385-L1447 HydrophobicContact CG-CD2 3.93Å; F1385-L1447 HydrophobicContact CZ-CD2 4.27Å
1386L85.5Confident77.9Confident0 Ų055.8 Ų55.80%026%0.259CS..Hα-helixtrans-61.5-35.7178-71.2170.5000111.1T1382 D1383 S1390 N1443 H1446 K1520T1382-L1386 WeakPolarHBondContact O-CB 3.25Å; T1382-L1386 VanDerWaalsContact O-CG 3.3Å; T1382-L1386 WeakPolarHBondContact O-CG 3.41Å; T1382-L1386 PolarHBondContact O-N 3.21Å; D1383-L1386 PolarHBondContact O-N 3.35Å; L1386-S1390 WeakPolarHBondContact O-CB 3.4Å; L1386-S1390 PolarHBondContact O-N 2.94Å; L1386-N1443 HydrophobicContact CD1-CB 4.25Å; L1386-H1446 HydrophobicContact CD1-CB 4.07Å; L1386-H1446 HydrophobicContact CD2-CB 3.93Å; L1386-K1520 HydrophobicContact CB-CB 4.09Å
1387E84.3Confident77.1Confident56 Ų5658.7 Ų58.726%0.26228%0.278SS..Hα-helixtrans-65.1-46.9173.7-164.1168.9155.100112.1D1383 H1384 F1385 R1389 S1390 R1391 K1520D1383-E1387 WeakPolarHBondContact O-CB 3.5Å; D1383-E1387 PolarHBondContact O-N 2.87Å; H1384-E1387 WeakPolarHBondContact O-CB 3.36Å; H1384-E1387 PolarHBondContact O-N 3.38Å; F1385-E1387 PolarHBondContact O-N 3.1Å; E1387-R1389 PolarHBondContact O-N 3.37Å; E1387-S1390 PolarHBondContact O-N 3.48Å; E1387-S1390 PolarHBondContact O-OG 3.25Å; E1387-R1391 PolarHBondContact O-N 2.93Å; E1387-R1391 VanDerWaalsContact O-N 3.16Å; E1387-R1391 IonicContact OE1-CZ 2.75Å; E1387-R1391 IonicContact OE1-NH1 3.05Å; E1387-R1391 IonicContact OE1-NH2 2.97Å; E1387-R1391 PolarHBondContact OE1-NH2 3.42Å; E1387-K1520 HydrophobicContact CB-CD 4.36Å; E1387-K1520 IonicContact OE2-NZ 3.29Å; E1387-K1520 PolarHBondContact OE2-NZ 3.03Å
1388I79Confident76.3Confident12 Ų1263 Ų636%0.06230%0.298CS..Hα-helixtrans-60.4-47.4175-68.5171.5000110.8H1384 F1385 S1390 R1391 S1392 E1399 L1400 A1403H1384-I1388 WeakPolarHBondContact NE2-CD1 3.42Å; H1384-I1388 WeakPolarHBondContact O-CG1 3.41Å; H1384-I1388 PolarHBondContact O-N 3.46Å; F1385-I1388 PolarHBondContact O-N 3.29Å; I1388-S1390 VanDerWaalsContact C-N 3.28Å; I1388-S1390 PolarHBondContact O-N 3.15Å; I1388-R1391 PolarHBondContact O-N 3.26Å; I1388-S1392 WeakPolarHBondContact O-CB 3.21Å; I1388-S1392 PolarHBondContact O-N 3.31Å; I1388-E1399 HydrophobicContact CG2-CB 4.24Å; I1388-L1400 HydrophobicContact CG2-CD1 4.22Å; I1388-A1403 HydrophobicContact CD1-CB 4.09Å
1389R77.8Confident75.4Confident64 Ų6466.5 Ų66.524%0.24232%0.315CS..Hα-helixtrans-59.2-41.4-179.7-163.9177.4-170152.9-4.5110.9F1385 E1387 R1391 S1392 L1447 E1518F1385-R1389 HydrophobicContact CD1-CB 4.49Å; F1385-R1389 HydrophobicContact CE1-CB 4.35Å; F1385-R1389 WeakPolarHBondContact O-CB 3.45Å; F1385-R1389 PolarHBondContact O-N 3.47Å; E1387-R1389 PolarHBondContact O-N 3.37Å; R1389-R1391 VanDerWaalsContact C-N 3.34Å; R1389-R1391 PolarHBondContact O-N 3.32Å; R1389-S1392 PolarHBondContact O-N 3.13Å; R1389-S1392 PolarHBondContact O-OG 3.21Å; R1389-L1447 PolarHBondContact NH1-O 3.29Å; R1389-E1518 IonicContact CZ-OE1 3.1Å; R1389-E1518 VanDerWaalsContact CZ-OE1 3.32Å; R1389-E1518 IonicContact NE-OE1 3.86Å; R1389-E1518 PolarHBondContact NE-OE1 2.82Å; R1389-E1518 IonicContact NE-OE2 3.28Å; R1389-E1518 IonicContact NH2-OE1 3.23Å; R1389-E1518 PolarHBondContact NH2-OE1 3.37Å
1390S76.5Confident74.9Confident48 Ų4867.8 Ų67.834%0.33632%0.321SS..Hα-helixtrans-63-35.7175.877.90000113.4L1386 E1387 I1388L1386-S1390 WeakPolarHBondContact O-CB 3.4Å; L1386-S1390 PolarHBondContact O-N 2.94Å; E1387-S1390 PolarHBondContact O-N 3.48Å; E1387-S1390 PolarHBondContact O-OG 3.25Å; I1388-S1390 VanDerWaalsContact C-N 3.28Å; I1388-S1390 PolarHBondContact O-N 3.15Å
1391R72.4Confident74.6Confident152 Ų15272 Ų7257%0.57434%0.338SS*.Hα-helixtrans-78.3-30.2177.4-70.2-179.9179.7155.49.5113.5E1387 I1388 R1389 R1393 S1394E1387-R1391 PolarHBondContact O-N 2.93Å; E1387-R1391 VanDerWaalsContact O-N 3.16Å; E1387-R1391 IonicContact OE1-CZ 2.75Å; E1387-R1391 IonicContact OE1-NH1 3.05Å; E1387-R1391 IonicContact OE1-NH2 2.97Å; E1387-R1391 PolarHBondContact OE1-NH2 3.42Å; I1388-R1391 PolarHBondContact O-N 3.26Å; R1389-R1391 VanDerWaalsContact C-N 3.34Å; R1389-R1391 PolarHBondContact O-N 3.32Å; R1391-R1393 PolarHBondContact O-N 2.79Å; R1391-S1394 PolarHBondContact O-N 3.04Å; R1391-S1394 PolarHBondContact O-OG 3.4Å
1392S62.6Low74.3Confident43 Ų4372.5 Ų72.530%0.30134%0.34SS..G310 helixtrans-63.9-8.2-171.7700000115.7I1388 R1389 S1394I1388-S1392 WeakPolarHBondContact O-CB 3.21Å; I1388-S1392 PolarHBondContact O-N 3.31Å; R1389-S1392 PolarHBondContact O-N 3.13Å; R1389-S1392 PolarHBondContact O-OG 3.21Å; S1392-S1394 PolarHBondContact O-N 3.45Å; S1392-S1394 VanDerWaalsContact O-N 3.1Å
1393R59.6Low73.9Confident215 Ų21572.9 Ų72.981%0.81134%0.344SS*.G310 helixtrans-59.2-16.9164.8-72.8-176177.9-175.70.4112.8R1391R1391-R1393 PolarHBondContact O-N 2.79Å
1394S48.9Very low73.7Confident91 Ų9175.2 Ų75.264%0.63636%0.355SS*.G310 helixtrans-129.885.2170.560.10000112.1R1391 S1392R1391-S1394 PolarHBondContact O-N 3.04Å; R1391-S1394 PolarHBondContact O-OG 3.4Å; S1392-S1394 PolarHBondContact O-N 3.45Å; S1392-S1394 VanDerWaalsContact O-N 3.1Å
1395R47.7Very low73.8Confident230 Ų23077 Ų7787%0.86836%0.361SS*.SBendtrans84.430.6138.3-129.5-175.4-157.6-171.73.9122.9
1396H56.8Low73.8Confident74 Ų7477.3 Ų77.334%0.34336%0.362SS..  trans-139.3104.5165-72.8-52.6000113.4N1255N1255-H1396 PolarHBondContact OD1-NE2 3.44Å
1397V69.4Low73.7Confident110 Ų11078.4 Ų78.467%0.66737%0.368SS*.Hα-helixtrans-77.9-34.3-174.4177.60000112.6Q1401V1397-Q1401 PolarHBondContact O-N 3.39Å; V1397-Q1401 VanDerWaalsContact O-N 3.12Å
1398E75.3Confident73.8Confident90 Ų9080.9 Ų80.942%0.42138%0.383SS..Hα-helixtrans-68.7-45.3-177.1-96.4-177.714600113.4L1400 Q1401 N1402E1398-L1400 VanDerWaalsContact C-N 3.27Å; E1398-L1400 PolarHBondContact O-N 3.15Å; E1398-Q1401 PolarHBondContact O-N 3.48Å; E1398-Q1401 VanDerWaalsContact O-N 3.14Å; E1398-N1402 PolarHBondContact O-N 3.48Å; E1398-N1402 PolarHBondContact O-ND2 3.47Å; E1398-N1402 VanDerWaalsContact O-ND2 3.15Å
1399E73.9Confident74.2Confident75 Ų7582 Ų8235%0.3539%0.391SS..Hα-helixtrans-58.8-42.4178.7-75.8-170.5155.100111.4I1388 N1402 A1403I1388-E1399 HydrophobicContact CG2-CB 4.24Å; E1399-N1402 PolarHBondContact O-N 2.94Å; E1399-A1403 VanDerWaalsContact O-CB 3.29Å; E1399-A1403 WeakPolarHBondContact O-CB 3.3Å; E1399-A1403 PolarHBondContact O-N 3.45Å
1400L78.5Confident74.6Confident48 Ų4879.6 Ų79.625%0.25138%0.383SS..Hα-helixtrans-63.3-44.5176.6-163.387.9000111.1I1388 E1398 N1402 A1403 I1404I1388-L1400 HydrophobicContact CG2-CD1 4.22Å; E1398-L1400 VanDerWaalsContact C-N 3.27Å; E1398-L1400 PolarHBondContact O-N 3.15Å; L1400-N1402 PolarHBondContact O-N 2.97Å; L1400-A1403 PolarHBondContact O-N 3.43Å; L1400-I1404 HydrophobicContact CD2-CD1 4.13Å; L1400-I1404 HydrophobicContact CG-CD1 4.06Å; L1400-I1404 WeakPolarHBondContact O-CB 3.37Å; L1400-I1404 WeakPolarHBondContact O-CD1 3.4Å; L1400-I1404 WeakPolarHBondContact O-CG1 3.33Å; L1400-I1404 PolarHBondContact O-N 3.37Å
1401Q83.4Confident75Confident118 Ų11878.3 Ų78.355%0.55138%0.376SS*.Hα-helixtrans-61.8-42.9177.3-88.9179.2-41.200112.6V1397 E1398 I1404 R1405V1397-Q1401 PolarHBondContact O-N 3.39Å; V1397-Q1401 VanDerWaalsContact O-N 3.12Å; E1398-Q1401 PolarHBondContact O-N 3.48Å; E1398-Q1401 VanDerWaalsContact O-N 3.14Å; Q1401-I1404 PolarHBondContact O-N 3.43Å; Q1401-R1405 PolarHBondContact O-N 2.96Å
1402N82.1Confident75.5Confident27 Ų2771.6 Ų71.614%0.14435%0.352CS..Hα-helixtrans-65.2-41.1177.4-70.8-39.7000112I1259 I1321 E1398 E1399 L1400 I1404 R1405 L1406I1259-N1402 WeakPolarHBondContact CD1-ND2 3.45Å; I1321-N1402 HydrophobicContact CD1-CB 3.99Å; I1321-N1402 HydrophobicContact CG1-CB 4.31Å; I1321-N1402 HydrophobicContact CG2-CB 4.29Å; E1398-N1402 PolarHBondContact O-N 3.48Å; E1398-N1402 PolarHBondContact O-ND2 3.47Å; E1398-N1402 VanDerWaalsContact O-ND2 3.15Å; E1399-N1402 PolarHBondContact O-N 2.94Å; L1400-N1402 PolarHBondContact O-N 2.97Å; N1402-I1404 VanDerWaalsContact C-N 3.31Å; N1402-I1404 PolarHBondContact O-N 2.94Å; N1402-R1405 WeakPolarHBondContact O-CB 3.49Å; N1402-R1405 PolarHBondContact O-N 3.47Å; N1402-L1406 PolarHBondContact O-N 3.33Å
1403A81Confident76.4Confident8 Ų873.1 Ų73.17%0.06636%0.357CS..Hα-helixtrans-65.3-38.3177.400000110.8F1385 I1388 E1399 L1400 L1406 I1407F1385-A1403 HydrophobicContact CD2-CB 3.3Å; F1385-A1403 VanDerWaalsContact CE2-C 3.44Å; F1385-A1403 HydrophobicContact CE2-CB 3.56Å; F1385-A1403 HydrophobicContact CG-CB 4.4Å; I1388-A1403 HydrophobicContact CD1-CB 4.09Å; E1399-A1403 VanDerWaalsContact O-CB 3.29Å; E1399-A1403 WeakPolarHBondContact O-CB 3.3Å; E1399-A1403 PolarHBondContact O-N 3.45Å; L1400-A1403 PolarHBondContact O-N 3.43Å; A1403-L1406 WeakPolarHBondContact O-CB 3.46Å; A1403-L1406 PolarHBondContact O-N 3.39Å; A1403-I1407 PolarHBondContact O-N 3.15Å; A1403-I1407 VanDerWaalsContact O-N 3.15Å
1404I83.2Confident77.2Confident68 Ų6866.6 Ų66.635%0.34934%0.341SS..Hα-helixtrans-65.6-43.3175.3-70.4164.4000110.6F1385 L1400 Q1401 N1402 L1406 I1407 N1408F1385-I1404 HydrophobicContact CE2-CG1 3.86Å; F1385-I1404 HydrophobicContact CZ-CG1 3.92Å; L1400-I1404 HydrophobicContact CD2-CD1 4.13Å; L1400-I1404 HydrophobicContact CG-CD1 4.06Å; L1400-I1404 WeakPolarHBondContact O-CB 3.37Å; L1400-I1404 WeakPolarHBondContact O-CD1 3.4Å; L1400-I1404 WeakPolarHBondContact O-CG1 3.33Å; L1400-I1404 PolarHBondContact O-N 3.37Å; Q1401-I1404 PolarHBondContact O-N 3.43Å; N1402-I1404 VanDerWaalsContact C-N 3.31Å; N1402-I1404 PolarHBondContact O-N 2.94Å; I1404-L1406 VanDerWaalsContact C-N 3.34Å; I1404-L1406 PolarHBondContact O-N 3.39Å; I1404-I1407 PolarHBondContact O-N 2.91Å; I1404-N1408 WeakPolarHBondContact CG2-ND2 3.44Å; I1404-N1408 WeakPolarHBondContact O-CB 3.33Å; I1404-N1408 VanDerWaalsContact O-CG 3.29Å; I1404-N1408 PolarHBondContact O-N 3.47Å; I1404-N1408 PolarHBondContact O-ND2 3.14Å
1405R86.2Confident78.9Confident77 Ų7766.8 Ų66.829%0.29133%0.332SS..Hα-helixtrans-57.1-47.5174.4174.1-178.4148.6-131.6-14.2110.9L1323 D1325 Q1401 N1402 I1407 N1408 V1409L1323-R1405 PolarHBondContact O-NH2 2.96Å; D1325-R1405 IonicContact OD1-CZ 2.69Å; D1325-R1405 IonicContact OD1-NE 3.38Å; D1325-R1405 PolarHBondContact OD1-NE 3.35Å; D1325-R1405 IonicContact OD1-NH2 2.79Å; D1325-R1405 PolarHBondContact OD1-NH2 3.21Å; Q1401-R1405 PolarHBondContact O-N 2.96Å; N1402-R1405 WeakPolarHBondContact O-CB 3.49Å; N1402-R1405 PolarHBondContact O-N 3.47Å; R1405-I1407 PolarHBondContact O-N 3Å; R1405-N1408 PolarHBondContact O-N 2.83Å; R1405-V1409 HydrophobicContact CG-CG2 4.21Å; R1405-V1409 WeakPolarHBondContact O-CB 3.36Å; R1405-V1409 VanDerWaalsContact O-CG2 3.24Å; R1405-V1409 WeakPolarHBondContact O-CG2 3.37Å; R1405-V1409 PolarHBondContact O-N 3.03Å
1406L85Confident80.7Confident17 Ų1756.2 Ų56.29%0.08929%0.292CS..Hα-helixtrans-56.2-50.8179.2-111.4159.6000112.4L1320 I1321 L1328 N1402 A1403 I1404 N1408 I1410L1320-L1406 HydrophobicContact CB-CD1 4.28Å; L1320-L1406 HydrophobicContact CB-CD2 3.78Å; L1320-L1406 HydrophobicContact CD1-CD2 4.01Å; I1321-L1406 HydrophobicContact CG1-CD1 3.56Å; L1328-L1406 HydrophobicContact CD2-CD2 3.82Å; N1402-L1406 PolarHBondContact O-N 3.33Å; A1403-L1406 WeakPolarHBondContact O-CB 3.46Å; A1403-L1406 PolarHBondContact O-N 3.39Å; I1404-L1406 VanDerWaalsContact C-N 3.34Å; I1404-L1406 PolarHBondContact O-N 3.39Å; L1406-N1408 PolarHBondContact O-N 3.06Å; L1406-I1410 HydrophobicContact CD2-CD1 3.39Å; L1406-I1410 HydrophobicContact CD2-CG1 4.21Å; L1406-I1410 WeakPolarHBondContact O-CB 3.43Å; L1406-I1410 VanDerWaalsContact O-CG1 3.28Å; L1406-I1410 WeakPolarHBondContact O-CG1 3.17Å; L1406-I1410 PolarHBondContact O-N 3.16Å
1407I84.4Confident82.1Confident23 Ų2352.8 Ų52.812%0.11828%0.276CS..Hα-helixtrans-61.4-46.8179.5-71.2-175.8000111.5F1385 A1403 I1404 R1405 G1411 L1412 L1447F1385-I1407 HydrophobicContact CB-CD1 3.9Å; F1385-I1407 HydrophobicContact CD1-CD1 3.83Å; F1385-I1407 HydrophobicContact CD2-CD1 3.23Å; F1385-I1407 HydrophobicContact CD2-CG1 4.03Å; F1385-I1407 HydrophobicContact CE1-CD1 4.1Å; F1385-I1407 HydrophobicContact CE2-CD1 3.63Å; F1385-I1407 HydrophobicContact CE2-CG1 4.46Å; F1385-I1407 HydrophobicContact CG-CD1 3.37Å; F1385-I1407 HydrophobicContact CG-CG1 4.47Å; F1385-I1407 HydrophobicContact CZ-CD1 4.04Å; A1403-I1407 PolarHBondContact O-N 3.15Å; A1403-I1407 VanDerWaalsContact O-N 3.15Å; I1404-I1407 PolarHBondContact O-N 2.91Å; R1405-I1407 PolarHBondContact O-N 3Å; I1407-G1411 PolarHBondContact O-N 2.94Å; I1407-L1412 HydrophobicContact CG2-CB 4.17Å; I1407-L1412 PolarHBondContact O-N 3.31Å; I1407-L1412 VanDerWaalsContact O-N 3.12Å; I1407-L1447 HydrophobicContact CD1-CD1 4Å; I1407-L1447 HydrophobicContact CD1-CD2 3.37Å; I1407-L1447 HydrophobicContact CD1-CG 4.35Å
1408N86.5Confident82.8Confident108 Ų10848.7 Ų48.758%0.57825%0.252SS*.Hα-helixtrans-66.7-41.7-176.1-73.4-21.2000112.2I1404 R1405 L1406 G1411I1404-N1408 WeakPolarHBondContact CG2-ND2 3.44Å; I1404-N1408 WeakPolarHBondContact O-CB 3.33Å; I1404-N1408 VanDerWaalsContact O-CG 3.29Å; I1404-N1408 PolarHBondContact O-N 3.47Å; I1404-N1408 PolarHBondContact O-ND2 3.14Å; R1405-N1408 PolarHBondContact O-N 2.83Å; L1406-N1408 PolarHBondContact O-N 3.06Å; N1408-G1411 PolarHBondContact O-N 3.47Å
1409V87.9Confident83.2Confident37 Ų3744.6 Ų44.622%0.22423%0.234CC..Hα-helixtrans-79.5-37.1-174.9-1790000112.3D1325 L1328 R1405 G1411D1325-V1409 HydrophobicContact CB-CG1 4Å; D1325-V1409 HydrophobicContact CB-CG2 4.34Å; D1325-V1409 WeakPolarHBondContact O-CG1 3.48Å; L1328-V1409 HydrophobicContact CB-CB 4.21Å; L1328-V1409 HydrophobicContact CB-CG1 3.53Å; L1328-V1409 HydrophobicContact CD1-CG1 4.5Å; R1405-V1409 HydrophobicContact CG-CG2 4.21Å; R1405-V1409 WeakPolarHBondContact O-CB 3.36Å; R1405-V1409 VanDerWaalsContact O-CG2 3.24Å; R1405-V1409 WeakPolarHBondContact O-CG2 3.37Å; R1405-V1409 PolarHBondContact O-N 3.03Å; V1409-G1411 PolarHBondContact O-N 2.92Å
1410I86Confident83.7Confident13 Ų1341 Ų417%0.06722%0.217CC..Hα-helixtrans-64.6-25.2171.8-67.7177.5000110.5L1320 L1328 F1331 G1332 L1335 L1381 L1406 L1412L1320-I1410 HydrophobicContact CD1-CD1 4.27Å; L1328-I1410 HydrophobicContact CB-CG1 4.45Å; L1328-I1410 HydrophobicContact CD2-CD1 4.25Å; L1328-I1410 HydrophobicContact CD2-CG1 4.14Å; F1331-I1410 HydrophobicContact CD1-CD1 4.36Å; G1332-I1410 VanDerWaalsContact CA-O 3.31Å; G1332-I1410 WeakPolarHBondContact CA-O 3.45Å; L1335-I1410 HydrophobicContact CD1-CG2 4.34Å; L1381-I1410 HydrophobicContact CD1-CD1 4Å; L1406-I1410 HydrophobicContact CD2-CD1 3.39Å; L1406-I1410 HydrophobicContact CD2-CG1 4.21Å; L1406-I1410 WeakPolarHBondContact O-CB 3.43Å; L1406-I1410 VanDerWaalsContact O-CG1 3.28Å; L1406-I1410 WeakPolarHBondContact O-CG1 3.17Å; L1406-I1410 PolarHBondContact O-N 3.16Å; I1410-L1412 HydrophobicContact CG2-CD1 4.37Å; I1410-L1412 HydrophobicContact CG2-CG 3.97Å
1411G83.8Confident83.9Confident20 Ų2038.8 Ų38.821%0.20621%0.205CC..THydrogen-bonded Turntrans86.827.6178.700000113.2I1407 N1408 V1409 N1413 F1416I1407-G1411 PolarHBondContact O-N 2.94Å; N1408-G1411 PolarHBondContact O-N 3.47Å; V1409-G1411 PolarHBondContact O-N 2.92Å; G1411-N1413 PolarHBondContact O-N 2.93Å; G1411-N1413 PolarHBondContact O-OD1 3.26Å; G1411-F1416 WeakPolarHBondContact O-CB 3.21Å
1412L82.5Confident83.7Confident12 Ų1235 Ų356%0.06319%0.19CC..  trans-75.958.8170.3-64.8174.9000110.1I1378 T1382 I1407 I1410 F1416 L1444I1378-L1412 HydrophobicContact CG1-CD2 4.11Å; I1378-L1412 HydrophobicContact CG2-CD2 4.22Å; T1382-L1412 HydrophobicContact CG2-CD1 4.3Å; I1407-L1412 HydrophobicContact CG2-CB 4.17Å; I1407-L1412 PolarHBondContact O-N 3.31Å; I1407-L1412 VanDerWaalsContact O-N 3.12Å; I1410-L1412 HydrophobicContact CG2-CD1 4.37Å; I1410-L1412 HydrophobicContact CG2-CG 3.97Å; L1412-F1416 HydrophobicContact CD2-CD1 3.94Å; L1412-F1416 HydrophobicContact CD2-CE1 3.87Å; L1412-F1416 HydrophobicContact CD2-CG 4.45Å; L1412-F1416 HydrophobicContact CD2-CZ 4.33Å; L1412-L1444 HydrophobicContact CB-CD2 4.18Å; L1412-L1444 HydrophobicContact CD2-CD2 4.39Å
1413N81.7Confident83.4Confident75 Ų7534.5 Ų34.540%0.40119%0.187SC..SBendtrans-104-174.6-173.764.711.6000111.4G1411 Q1415 F1416 L1417G1411-N1413 PolarHBondContact O-N 2.93Å; G1411-N1413 PolarHBondContact O-OD1 3.26Å; N1413-Q1415 PolarHBondContact O-N 3.38Å; N1413-Q1415 WeakPolarHBondContact OD1-CA 3.44Å; N1413-Q1415 VanDerWaalsContact OD1-CB 3.25Å; N1413-Q1415 WeakPolarHBondContact OD1-CB 3.18Å; N1413-Q1415 PolarHBondContact OD1-N 3.21Å; N1413-Q1415 VanDerWaalsContact OD1-N 3.11Å; N1413-F1416 PolarHBondContact O-N 3.21Å; N1413-F1416 PolarHBondContact OD1-N 3.05Å; N1413-L1417 PolarHBondContact O-N 2.85Å; N1413-L1417 VanDerWaalsContact O-N 3.11Å
1414T77.7Confident82.9Confident78 Ų7834.2 Ų34.248%0.47919%0.185SC..Hα-helixtrans-61.2-30.3178.460.70000112.9S1418 A1451T1414-S1418 PolarHBondContact O-N 2.71Å; T1414-S1418 VanDerWaalsContact O-N 3.17Å; T1414-A1451 HydrophobicContact CG2-CB 3.15Å
1415Q83.3Confident82Confident94 Ų9433.3 Ų33.344%0.43918%0.182SC..Hα-helixtrans-65.1-52.9174.4-166.869.63100109.2N1413 L1417 S1418 D1419N1413-Q1415 PolarHBondContact O-N 3.38Å; N1413-Q1415 WeakPolarHBondContact OD1-CA 3.44Å; N1413-Q1415 VanDerWaalsContact OD1-CB 3.25Å; N1413-Q1415 WeakPolarHBondContact OD1-CB 3.18Å; N1413-Q1415 PolarHBondContact OD1-N 3.21Å; N1413-Q1415 VanDerWaalsContact OD1-N 3.11Å; Q1415-L1417 VanDerWaalsContact C-N 3.29Å; Q1415-L1417 PolarHBondContact O-N 3.4Å; Q1415-S1418 CarbonylContact O-C 3.59Å; Q1415-S1418 VanDerWaalsContact O-CA 3.27Å; Q1415-S1418 WeakPolarHBondContact O-CA 3.4Å; Q1415-S1418 WeakPolarHBondContact O-CB 3.26Å; Q1415-S1418 PolarHBondContact O-N 3.23Å; Q1415-D1419 VanDerWaalsContact O-CG 3.28Å; Q1415-D1419 PolarHBondContact O-N 3.31Å
1416F86Confident81Confident8 Ų833.9 Ų33.94%0.03519%0.187CC..Hα-helixtrans-56.7-40.4179.6-168.4-89.8000113.2R1336 I1339 F1340 I1378 G1411 L1412 N1413 S1418 D1419 L1420 L1444R1336-F1416 HydrophobicContact CB-CE2 4.36Å; R1336-F1416 HydrophobicContact CG-CE2 4.25Å; I1339-F1416 HydrophobicContact CD1-CZ 3.81Å; F1340-F1416 HydrophobicContact CE2-CD2 4.37Å; F1340-F1416 AromaticContact CE2-CE2 3.9Å; F1340-F1416 HydrophobicContact CE2-CE2 3.9Å; F1340-F1416 HydrophobicContact CE2-CZ 4.33Å; I1378-F1416 HydrophobicContact CD1-CE1 3.72Å; I1378-F1416 HydrophobicContact CD1-CZ 3.67Å; G1411-F1416 WeakPolarHBondContact O-CB 3.21Å; L1412-F1416 HydrophobicContact CD2-CD1 3.94Å; L1412-F1416 HydrophobicContact CD2-CE1 3.87Å; L1412-F1416 HydrophobicContact CD2-CG 4.45Å; L1412-F1416 HydrophobicContact CD2-CZ 4.33Å; N1413-F1416 PolarHBondContact O-N 3.21Å; N1413-F1416 PolarHBondContact OD1-N 3.05Å; F1416-S1418 VanDerWaalsContact C-N 3.31Å; F1416-S1418 PolarHBondContact O-N 3.14Å; F1416-D1419 WeakPolarHBondContact CA-OD1 3.5Å; F1416-D1419 PolarHBondContact N-OD1 3.34Å; F1416-D1419 PolarHBondContact O-N 3.47Å; F1416-L1420 HydrophobicContact CD1-CD1 3.77Å; F1416-L1420 HydrophobicContact CD1-CG 4.44Å; F1416-L1420 HydrophobicContact CE1-CD1 3.42Å; F1416-L1420 VanDerWaalsContact CE1-CD1 3.42Å; F1416-L1420 HydrophobicContact CE1-CG 4.06Å; F1416-L1420 HydrophobicContact CZ-CD1 4.39Å; F1416-L1420 PolarHBondContact O-N 3.29Å; F1416-L1444 HydrophobicContact CD1-CD1 4.13Å; F1416-L1444 HydrophobicContact CE1-CD1 4.32Å
1417L86.6Confident79.4Confident2 Ų241 Ų411%0.0122%0.219CC..Hα-helixtrans-57.4-44.6171-175.180.3000111.4N1413 Q1415 L1420 F1421 L1441 L1444 I1445 Y1452 L1455N1413-L1417 PolarHBondContact O-N 2.85Å; N1413-L1417 VanDerWaalsContact O-N 3.11Å; Q1415-L1417 VanDerWaalsContact C-N 3.29Å; Q1415-L1417 PolarHBondContact O-N 3.4Å; L1417-L1420 PolarHBondContact O-N 3.35Å; L1417-F1421 HydrophobicContact CD1-CE2 4.4Å; L1417-F1421 HydrophobicContact CG-CD2 4.31Å; L1417-F1421 HydrophobicContact CG-CE2 4.41Å; L1417-F1421 WeakPolarHBondContact O-CD2 3.45Å; L1417-F1421 PolarHBondContact O-N 2.93Å; L1417-L1441 HydrophobicContact CD1-CD2 3.79Å; L1417-L1444 HydrophobicContact CD1-CB 3.6Å; L1417-L1444 HydrophobicContact CD1-CD1 4.39Å; L1417-I1445 HydrophobicContact CD1-CG1 4.06Å; L1417-Y1452 HydrophobicContact CD2-CD2 4.49Å; L1417-L1455 HydrophobicContact CD2-CD1 3.97Å; L1417-L1455 HydrophobicContact CG-CD1 4.23Å
1418S83.9Confident78Confident24 Ų2444.6 Ų44.617%0.16825%0.247CC..Hα-helixtrans-62.3-44.9175-172.70000112.9T1414 Q1415 F1416 L1420 F1421 T1422T1414-S1418 PolarHBondContact O-N 2.71Å; T1414-S1418 VanDerWaalsContact O-N 3.17Å; Q1415-S1418 CarbonylContact O-C 3.59Å; Q1415-S1418 VanDerWaalsContact O-CA 3.27Å; Q1415-S1418 WeakPolarHBondContact O-CA 3.4Å; Q1415-S1418 WeakPolarHBondContact O-CB 3.26Å; Q1415-S1418 PolarHBondContact O-N 3.23Å; F1416-S1418 VanDerWaalsContact C-N 3.31Å; F1416-S1418 PolarHBondContact O-N 3.14Å; S1418-L1420 VanDerWaalsContact C-N 3.33Å; S1418-L1420 PolarHBondContact O-N 2.73Å; S1418-F1421 PolarHBondContact O-N 3Å; S1418-T1422 WeakPolarHBondContact O-CG2 3.18Å; S1418-T1422 PolarHBondContact O-N 3.24Å
1419D84.2Confident76.9Confident5 Ų540.5 Ų40.53%0.02722%0.224CC..Hα-helixtrans-64.1-42179.6-51.8113000110.4R1336 F1340 F1344 Q1415 F1416 F1421 T1422 L1423R1336-D1419 IonicContact CZ-OD1 3.11Å; R1336-D1419 IonicContact CZ-OD2 2.67Å; R1336-D1419 IonicContact NH1-OD1 3.36Å; R1336-D1419 PolarHBondContact NH1-OD1 2.84Å; R1336-D1419 IonicContact NH1-OD2 2.68Å; R1336-D1419 IonicContact NH2-OD1 2.81Å; R1336-D1419 PolarHBondContact NH2-OD1 3.29Å; R1336-D1419 IonicContact NH2-OD2 3.43Å; R1336-D1419 PolarHBondContact NH2-OD2 2.86Å; F1340-D1419 VanDerWaalsContact CE1-C 3.46Å; F1340-D1419 HydrophobicContact CE1-CB 3.73Å; F1340-D1419 WeakPolarHBondContact CE1-O 3.25Å; F1340-D1419 HydrophobicContact CE2-CB 4.08Å; F1340-D1419 HydrophobicContact CZ-CB 3.42Å; F1340-D1419 VanDerWaalsContact CZ-CB 3.42Å; F1344-D1419 HydrophobicContact CE1-CB 3.74Å; F1344-D1419 VanDerWaalsContact CE1-OD2 3.24Å; F1344-D1419 WeakPolarHBondContact CE1-OD2 3.25Å; F1344-D1419 HydrophobicContact CZ-CB 3.78Å; Q1415-D1419 VanDerWaalsContact O-CG 3.28Å; Q1415-D1419 PolarHBondContact O-N 3.31Å; F1416-D1419 WeakPolarHBondContact CA-OD1 3.5Å; F1416-D1419 PolarHBondContact N-OD1 3.34Å; F1416-D1419 PolarHBondContact O-N 3.47Å; D1419-F1421 VanDerWaalsContact C-N 3.33Å; D1419-F1421 PolarHBondContact O-N 3.45Å; D1419-T1422 WeakPolarHBondContact CA-OG1 3.42Å; D1419-T1422 PolarHBondContact O-N 2.94Å; D1419-T1422 VanDerWaalsContact O-N 3.09Å; D1419-T1422 PolarHBondContact O-OG1 3.44Å; D1419-L1423 PolarHBondContact O-N 3.14Å; D1419-L1423 VanDerWaalsContact O-N 3.14Å
1420L84.7Confident75.8Confident0 Ų040 Ų400%022%0.222CC..Hα-helixtrans-56.3-45.7173.1-96.9165.8000111.8F1340 L1375 F1416 L1417 S1418 T1422 L1423 F1437 L1441 L1444F1340-L1420 HydrophobicContact CZ-CG 4.4Å; L1375-L1420 HydrophobicContact CD2-CD2 4.09Å; F1416-L1420 HydrophobicContact CD1-CD1 3.77Å; F1416-L1420 HydrophobicContact CD1-CG 4.44Å; F1416-L1420 HydrophobicContact CE1-CD1 3.42Å; F1416-L1420 VanDerWaalsContact CE1-CD1 3.42Å; F1416-L1420 HydrophobicContact CE1-CG 4.06Å; F1416-L1420 HydrophobicContact CZ-CD1 4.39Å; F1416-L1420 PolarHBondContact O-N 3.29Å; L1417-L1420 PolarHBondContact O-N 3.35Å; S1418-L1420 VanDerWaalsContact C-N 3.33Å; S1418-L1420 PolarHBondContact O-N 2.73Å; L1420-T1422 VanDerWaalsContact C-N 3.33Å; L1420-T1422 PolarHBondContact O-N 3.44Å; L1420-L1423 VanDerWaalsContact O-CB 3.24Å; L1420-L1423 WeakPolarHBondContact O-CB 3.42Å; L1420-L1423 PolarHBondContact O-N 3.35Å; L1420-L1423 VanDerWaalsContact O-N 3.15Å; L1420-F1437 HydrophobicContact CB-CE1 4.34Å; L1420-F1437 HydrophobicContact CD2-CD1 3.94Å; L1420-F1437 HydrophobicContact CD2-CE1 3.2Å; L1420-F1437 HydrophobicContact CD2-CE2 4.13Å; L1420-F1437 HydrophobicContact CD2-CZ 3.32Å; L1420-F1437 HydrophobicContact CG-CE1 4.37Å; L1420-F1437 WeakPolarHBondContact O-CE1 3.32Å; L1420-L1441 HydrophobicContact CB-CD2 4.21Å; L1420-L1444 HydrophobicContact CD1-CD1 3.43Å; L1420-L1444 VanDerWaalsContact CD1-CD1 3.43Å
1421F82.6Confident74.8Confident1 Ų142 Ų420%0.00423%0.234CC..Hα-helixtrans-63-37.2175.5-94.2-74.6000112.7L1417 S1418 D1419 L1423 L1424 L1441 I1445 Y1452 W1459 F1476 L1479 F1536L1417-F1421 HydrophobicContact CD1-CE2 4.4Å; L1417-F1421 HydrophobicContact CG-CD2 4.31Å; L1417-F1421 HydrophobicContact CG-CE2 4.41Å; L1417-F1421 WeakPolarHBondContact O-CD2 3.45Å; L1417-F1421 PolarHBondContact O-N 2.93Å; S1418-F1421 PolarHBondContact O-N 3Å; D1419-F1421 VanDerWaalsContact C-N 3.33Å; D1419-F1421 PolarHBondContact O-N 3.45Å; F1421-L1423 PolarHBondContact O-N 2.96Å; F1421-L1424 HydrophobicContact CD1-CD1 3.78Å; F1421-L1424 HydrophobicContact CE1-CD1 4.12Å; F1421-L1424 VanDerWaalsContact O-CB 3.31Å; F1421-L1424 WeakPolarHBondContact O-CB 3.47Å; F1421-L1424 PolarHBondContact O-N 3.15Å; F1421-L1424 VanDerWaalsContact O-N 3.1Å; F1421-L1441 HydrophobicContact CD2-CD2 3.7Å; F1421-L1441 HydrophobicContact CE1-CD1 4.47Å; F1421-L1441 HydrophobicContact CE2-CD2 3.45Å; F1421-L1441 VanDerWaalsContact CE2-CD2 3.45Å; F1421-L1441 HydrophobicContact CG-CD2 4.45Å; F1421-L1441 HydrophobicContact CZ-CD1 4.31Å; F1421-L1441 HydrophobicContact CZ-CD2 4.01Å; F1421-I1445 HydrophobicContact CZ-CD1 4.48Å; F1421-Y1452 HydrophobicContact CE2-CD2 4.03Å; F1421-Y1452 AromaticContact CE2-CE2 3.89Å; F1421-Y1452 HydrophobicContact CE2-CE2 3.89Å; F1421-Y1452 HydrophobicContact CZ-CD2 4.33Å; F1421-Y1452 AromaticContact CZ-CE2 3.73Å; F1421-Y1452 HydrophobicContact CZ-CE2 3.73Å; F1421-W1459 HydrophobicContact CB-CH2 3.85Å; F1421-W1459 HydrophobicContact CB-CZ2 4.15Å; F1421-W1459 HydrophobicContact CB-CZ3 4.47Å; F1421-F1476 HydrophobicContact CE1-CE1 4.26Å; F1421-L1479 HydrophobicContact CZ-CD2 4.46Å; F1421-F1536 HydrophobicContact CD1-CE1 4.17Å; F1421-F1536 HydrophobicContact CD1-CZ 4.46Å; F1421-F1536 AromaticContact CE1-CE1 3.79Å; F1421-F1536 HydrophobicContact CE1-CE1 3.79Å; F1421-F1536 HydrophobicContact CE1-CZ 4.13Å
1422T78.3Confident73.9Confident38 Ų3845.8 Ų45.823%0.23325%0.25CC..Hα-helixtrans-66.5-22.2175.860.60000113.2F1344 S1418 D1419 L1420 L1424 T1425 K1426 W1459F1344-T1422 VanDerWaalsContact CZ-OG1 3.27Å; F1344-T1422 WeakPolarHBondContact CZ-OG1 3.41Å; S1418-T1422 WeakPolarHBondContact O-CG2 3.18Å; S1418-T1422 PolarHBondContact O-N 3.24Å; D1419-T1422 WeakPolarHBondContact CA-OG1 3.42Å; D1419-T1422 PolarHBondContact O-N 2.94Å; D1419-T1422 VanDerWaalsContact O-N 3.09Å; D1419-T1422 PolarHBondContact O-OG1 3.44Å; L1420-T1422 VanDerWaalsContact C-N 3.33Å; L1420-T1422 PolarHBondContact O-N 3.44Å; T1422-L1424 PolarHBondContact O-N 3.05Å; T1422-T1425 WeakPolarHBondContact CA-OG1 3.41Å; T1422-T1425 WeakPolarHBondContact O-CA 3.17Å; T1422-T1425 PolarHBondContact O-N 3.48Å; T1422-T1425 PolarHBondContact O-OG1 2.99Å; T1422-K1426 PolarHBondContact O-N 3.38Å; T1422-W1459 HydrophobicContact CG2-CZ2 4.01Å
1423L76.7Confident73.5Confident16 Ų1645.4 Ų45.48%0.08425%0.248CC..Hα-helixtrans-64.2-32.4173.2-128.4160.1000111.3I1339 F1340 D1419 L1420 F1421 T1425 K1426 F1437I1339-L1423 HydrophobicContact CG2-CD1 3.49Å; I1339-L1423 VanDerWaalsContact CG2-CD1 3.49Å; F1340-L1423 HydrophobicContact CD1-CD1 3.57Å; F1340-L1423 HydrophobicContact CD1-CG 4.26Å; F1340-L1423 HydrophobicContact CE1-CB 4.49Å; F1340-L1423 HydrophobicContact CE1-CD1 3.51Å; F1340-L1423 HydrophobicContact CE1-CG 4.23Å; F1340-L1423 HydrophobicContact CZ-CD1 4.43Å; D1419-L1423 PolarHBondContact O-N 3.14Å; D1419-L1423 VanDerWaalsContact O-N 3.14Å; L1420-L1423 VanDerWaalsContact O-CB 3.24Å; L1420-L1423 WeakPolarHBondContact O-CB 3.42Å; L1420-L1423 PolarHBondContact O-N 3.35Å; L1420-L1423 VanDerWaalsContact O-N 3.15Å; F1421-L1423 PolarHBondContact O-N 2.96Å; L1423-T1425 PolarHBondContact O-N 3.14Å; L1423-K1426 PolarHBondContact O-N 3.26Å; L1423-F1437 HydrophobicContact CB-CE1 4.34Å; L1423-F1437 HydrophobicContact CB-CZ 3.77Å; L1423-F1437 HydrophobicContact CD1-CE2 4.39Å; L1423-F1437 HydrophobicContact CD1-CZ 3.86Å; L1423-F1437 HydrophobicContact CD2-CZ 4.45Å; L1423-F1437 HydrophobicContact CG-CZ 4.23Å
1424L70.3Confident73.3Confident3 Ų342.2 Ų42.22%0.01623%0.231CC..THydrogen-bonded Turntrans-68.2-16.7172.9-54.6171000112.8F1421 T1422 Y1429 F1437 L1441 F1533 F1536 V1537F1421-L1424 HydrophobicContact CD1-CD1 3.78Å; F1421-L1424 HydrophobicContact CE1-CD1 4.12Å; F1421-L1424 VanDerWaalsContact O-CB 3.31Å; F1421-L1424 WeakPolarHBondContact O-CB 3.47Å; F1421-L1424 PolarHBondContact O-N 3.15Å; F1421-L1424 VanDerWaalsContact O-N 3.1Å; T1422-L1424 PolarHBondContact O-N 3.05Å; L1424-Y1429 HydrophobicContact CD2-CE1 3.9Å; L1424-F1437 HydrophobicContact CD2-CD1 4.15Å; L1424-F1437 HydrophobicContact CD2-CE1 4.22Å; L1424-F1437 HydrophobicContact CG-CE1 4.47Å; L1424-L1441 HydrophobicContact CD1-CD1 4.19Å; L1424-F1533 HydrophobicContact CD1-CE2 3.62Å; L1424-F1533 HydrophobicContact CD1-CZ 3.6Å; L1424-F1533 HydrophobicContact CD2-CE1 4.36Å; L1424-F1533 HydrophobicContact CD2-CE2 4.5Å; L1424-F1533 HydrophobicContact CD2-CZ 3.63Å; L1424-F1533 HydrophobicContact CG-CZ 4.25Å; L1424-F1536 HydrophobicContact CD1-CE1 4.33Å; L1424-V1537 HydrophobicContact CD1-CG2 4.43Å; L1424-V1537 HydrophobicContact CD2-CG2 4.04Å
1425T64.3Low73.2Confident48 Ų4840.5 Ų40.529%0.29422%0.224SC..THydrogen-bonded Turntrans-92.9-3.5176.363.20000114.2T1422 L1423 W1459 M1540 I1544T1422-T1425 WeakPolarHBondContact CA-OG1 3.41Å; T1422-T1425 WeakPolarHBondContact O-CA 3.17Å; T1422-T1425 PolarHBondContact O-N 3.48Å; T1422-T1425 PolarHBondContact O-OG1 2.99Å; L1423-T1425 PolarHBondContact O-N 3.14Å; T1425-W1459 HydrophobicContact CG2-CH2 3.8Å; T1425-W1459 HydrophobicContact CG2-CZ3 4.23Å; T1425-M1540 HydrophobicContact CG2-CE 4.31Å; T1425-I1544 WeakPolarHBondContact O-CD1 3.26Å
1426K64.8Low73.2Confident89 Ų8936.6 Ų36.639%0.38721%0.207SC..SBendtrans-75.8145.3173.6-75.5-172171.4-174.20111T1422 L1423 S1428T1422-K1426 PolarHBondContact O-N 3.38Å; L1423-K1426 PolarHBondContact O-N 3.26Å; K1426-S1428 PolarHBondContact O-N 2.87Å; K1426-S1428 VanDerWaalsContact O-N 3.09Å
1427E51.9Low73.2Confident166 Ų16636.2 Ų36.278%0.77621%0.206SC*.SBendtrans-60.3-20.5-175.3-72.8-173.6147.700114.4
1428S53.5Low73.2Confident100 Ų10036.1 Ų36.170%0.69921%0.205SC*.  trans-145.7108.8179.950.10000112K1426K1426-S1428 PolarHBondContact O-N 2.87Å; K1426-S1428 VanDerWaalsContact O-N 3.09Å
1429Y63.8Low73.4Confident21 Ų2135.9 Ų35.98%0.08220%0.203CC..  trans-131.1144161.891.6-93.4000109.7L1424 E1434 V1537 R1541L1424-Y1429 HydrophobicContact CD2-CE1 3.9Å; Y1429-E1434 HydrophobicContact CE2-CG 3.43Å; Y1429-E1434 VanDerWaalsContact CE2-CG 3.43Å; Y1429-E1434 WeakPolarHBondContact OH-CG 3.28Å; Y1429-E1434 PolarHBondContact OH-OE1 2.99Å; Y1429-V1537 HydrophobicContact CE1-CG1 3.99Å; Y1429-V1537 WeakPolarHBondContact OH-CG1 3.46Å; Y1429-R1541 VanDerWaalsContact CD1-NH2 3.29Å; Y1429-R1541 PolarHBondContact O-NH2 3.17Å
1430S64.3Low73.6Confident27 Ų2735.6 Ų35.619%0.18920%0.202CC..  trans-69130.2-176.4175.90000112N1368 N1432 L1433N1368-S1430 WeakPolarHBondContact OD1-CB 3.3Å; S1430-N1432 PolarHBondContact O-N 3.34Å; S1430-N1432 PolarHBondContact OG-N 2.91Å; S1430-L1433 WeakPolarHBondContact O-CB 3.16Å; S1430-L1433 PolarHBondContact O-N 3.29Å; S1430-L1433 VanDerWaalsContact O-N 3.07Å
1431V65.1Low73.8Confident54 Ų5435.6 Ų35.633%0.32720%0.202SC..G310 helixtrans-58.5-29.5176.3-179.40000111.5A225 L1433 E1434A225-V1431 HydrophobicContact CB-CG1 4.4Å; A225-V1431 HydrophobicContact CB-CG2 3.35Å; V1431-L1433 PolarHBondContact O-N 3.32Å; V1431-L1433 VanDerWaalsContact O-N 3.1Å; V1431-E1434 VanDerWaalsContact O-CB 3.31Å; V1431-E1434 WeakPolarHBondContact O-CB 3.32Å; V1431-E1434 WeakPolarHBondContact O-CG 3.32Å; V1431-E1434 PolarHBondContact O-N 3.39Å
1432N65.6Low74.1Confident100 Ų10035.6 Ų35.654%0.53520%0.202SC..G310 helixtrans-60.1-24.7178.8-64-18.5000112.5S1430S1430-N1432 PolarHBondContact O-N 3.34Å; S1430-N1432 PolarHBondContact OG-N 2.91Å
1433L74.1Confident74.6Confident4 Ų433.8 Ų33.82%0.02119%0.191CC..G310 helixtrans-82.2-15.5179.1-61.6174.1000113.1N1368 I1371 Q1372 S1430 V1431 A1435 S1436 F1437N1368-L1433 HydrophobicContact CB-CD2 4.47Å; N1368-L1433 WeakPolarHBondContact O-CD2 3.33Å; N1368-L1433 WeakPolarHBondContact OD1-CD1 3.11Å; I1371-L1433 HydrophobicContact CB-CD1 4.13Å; I1371-L1433 HydrophobicContact CB-CD2 4.26Å; I1371-L1433 HydrophobicContact CD1-CD1 4.09Å; I1371-L1433 HydrophobicContact CG2-CD1 3.84Å; I1371-L1433 HydrophobicContact CG2-CD2 4.21Å; Q1372-L1433 HydrophobicContact CB-CD2 3.91Å; S1430-L1433 WeakPolarHBondContact O-CB 3.16Å; S1430-L1433 PolarHBondContact O-N 3.29Å; S1430-L1433 VanDerWaalsContact O-N 3.07Å; V1431-L1433 PolarHBondContact O-N 3.32Å; V1431-L1433 VanDerWaalsContact O-N 3.1Å; L1433-A1435 VanDerWaalsContact C-N 3.27Å; L1433-A1435 PolarHBondContact O-N 2.96Å; L1433-S1436 PolarHBondContact O-N 3.49Å; L1433-F1437 HydrophobicContact CB-CD2 4.33Å; L1433-F1437 WeakPolarHBondContact O-CB 3.45Å; L1433-F1437 PolarHBondContact O-N 3.21Å
1434E77.2Confident75.1Confident8 Ų833.2 Ų33.24%0.03719%0.188CC..Hα-helixtrans-58.2-36.8-171.6-71.7-173155.600113.3Y1429 V1431 S1438 H1534Y1429-E1434 HydrophobicContact CE2-CG 3.43Å; Y1429-E1434 VanDerWaalsContact CE2-CG 3.43Å; Y1429-E1434 WeakPolarHBondContact OH-CG 3.28Å; Y1429-E1434 PolarHBondContact OH-OE1 2.99Å; V1431-E1434 VanDerWaalsContact O-CB 3.31Å; V1431-E1434 WeakPolarHBondContact O-CB 3.32Å; V1431-E1434 WeakPolarHBondContact O-CG 3.32Å; V1431-E1434 PolarHBondContact O-N 3.39Å; E1434-S1438 VanDerWaalsContact O-CB 3.24Å; E1434-S1438 WeakPolarHBondContact O-CB 3.14Å; E1434-S1438 PolarHBondContact O-N 2.88Å; E1434-S1438 PolarHBondContact O-OG 3.16Å; E1434-H1534 IonicContact OE2-CE1 2.73Å; E1434-H1534 PolarHBondContact OE2-CE1 3.31Å; E1434-H1534 IonicContact OE2-ND1 3.21Å; E1434-H1534 PolarHBondContact OE2-ND1 2.78Å
1435A76Confident75.9Confident42 Ų4233 Ų3335%0.34719%0.187SC..Hα-helixtrans-63.6-52.2177.600000111.7L1433 S1438 S1439L1433-A1435 VanDerWaalsContact C-N 3.27Å; L1433-A1435 PolarHBondContact O-N 2.96Å; A1435-S1438 PolarHBondContact O-N 2.79Å; A1435-S1438 PolarHBondContact O-OG 3.41Å; A1435-S1439 PolarHBondContact O-N 2.65Å; A1435-S1439 VanDerWaalsContact O-N 3.12Å
1436S82.7Confident77Confident12 Ų1230.9 Ų30.98%0.08417%0.174CC..Hα-helixtrans-66.1-39.5177.2-61.20000111.4L1433 S1438 S1439 A1440L1433-S1436 PolarHBondContact O-N 3.49Å; S1436-S1438 PolarHBondContact O-N 2.98Å; S1436-S1439 PolarHBondContact O-N 3.05Å; S1436-A1440 WeakPolarHBondContact O-CB 3.48Å; S1436-A1440 PolarHBondContact O-N 3.02Å
1437F86.4Confident77.8Confident1 Ų127.6 Ų27.60%0.00416%0.16CC..Hα-helixtrans-59.1-48.3175.3-121.5-88.4000111.8L1375 L1420 L1423 L1424 L1433 S1439 A1440 L1441 F1533L1375-F1437 HydrophobicContact CD1-CD2 3.6Å; L1375-F1437 HydrophobicContact CD1-CE2 4.1Å; L1375-F1437 HydrophobicContact CD1-CG 4.36Å; L1375-F1437 HydrophobicContact CD2-CD2 4.37Å; L1420-F1437 HydrophobicContact CB-CE1 4.34Å; L1420-F1437 HydrophobicContact CD2-CD1 3.94Å; L1420-F1437 HydrophobicContact CD2-CE1 3.2Å; L1420-F1437 HydrophobicContact CD2-CE2 4.13Å; L1420-F1437 HydrophobicContact CD2-CZ 3.32Å; L1420-F1437 HydrophobicContact CG-CE1 4.37Å; L1420-F1437 WeakPolarHBondContact O-CE1 3.32Å; L1423-F1437 HydrophobicContact CB-CE1 4.34Å; L1423-F1437 HydrophobicContact CB-CZ 3.77Å; L1423-F1437 HydrophobicContact CD1-CE2 4.39Å; L1423-F1437 HydrophobicContact CD1-CZ 3.86Å; L1423-F1437 HydrophobicContact CD2-CZ 4.45Å; L1423-F1437 HydrophobicContact CG-CZ 4.23Å; L1424-F1437 HydrophobicContact CD2-CD1 4.15Å; L1424-F1437 HydrophobicContact CD2-CE1 4.22Å; L1424-F1437 HydrophobicContact CG-CE1 4.47Å; L1433-F1437 HydrophobicContact CB-CD2 4.33Å; L1433-F1437 WeakPolarHBondContact O-CB 3.45Å; L1433-F1437 PolarHBondContact O-N 3.21Å; F1437-S1439 VanDerWaalsContact C-N 3.35Å; F1437-S1439 PolarHBondContact O-N 3.41Å; F1437-A1440 PolarHBondContact O-N 3.19Å; F1437-L1441 HydrophobicContact CD1-CD1 3.92Å; F1437-L1441 HydrophobicContact CD1-CG 4.46Å; F1437-L1441 WeakPolarHBondContact O-CB 3.49Å; F1437-L1441 PolarHBondContact O-N 3.09Å; F1437-F1533 HydrophobicContact CB-CE1 4.47Å
1438S86.9Confident79.3Confident0 Ų021.4 Ų21.40%014%0.135CC..Hα-helixtrans-62.8-42-179.774.80000111.5E1434 A1435 S1436 L1442 F1529 Q1530E1434-S1438 VanDerWaalsContact O-CB 3.24Å; E1434-S1438 WeakPolarHBondContact O-CB 3.14Å; E1434-S1438 PolarHBondContact O-N 2.88Å; E1434-S1438 PolarHBondContact O-OG 3.16Å; A1435-S1438 PolarHBondContact O-N 2.79Å; A1435-S1438 PolarHBondContact O-OG 3.41Å; S1436-S1438 PolarHBondContact O-N 2.98Å; S1438-L1442 VanDerWaalsContact O-CB 3.22Å; S1438-L1442 WeakPolarHBondContact O-CB 3.47Å; S1438-L1442 PolarHBondContact O-N 3.28Å; S1438-F1529 WeakPolarHBondContact O-CE1 3.43Å; S1438-Q1530 WeakPolarHBondContact OG-CG 3.44Å
1439S87.4Confident80.8Confident18 Ų1818.3 Ų18.313%0.12611%0.113CC..Hα-helixtrans-68.3-41.4177.8-76.40000112.2A1435 S1436 F1437 N1443A1435-S1439 PolarHBondContact O-N 2.65Å; A1435-S1439 VanDerWaalsContact O-N 3.12Å; S1436-S1439 PolarHBondContact O-N 3.05Å; F1437-S1439 VanDerWaalsContact C-N 3.35Å; F1437-S1439 PolarHBondContact O-N 3.41Å; S1439-N1443 WeakPolarHBondContact O-CB 3.45Å; S1439-N1443 PolarHBondContact O-N 3.41Å
1440A89.2Confident81.6Confident0 Ų023.1 Ų23.10%014%0.136CC..Hα-helixtrans-64.4-46.7176.500000111.5L1375 I1378 I1379 S1436 F1437 N1443 L1444L1375-A1440 HydrophobicContact CD2-CB 3.85Å; I1378-A1440 HydrophobicContact CG2-CB 4.35Å; I1379-A1440 HydrophobicContact CD1-CB 4.47Å; I1379-A1440 HydrophobicContact CG1-CB 3.97Å; S1436-A1440 WeakPolarHBondContact O-CB 3.48Å; S1436-A1440 PolarHBondContact O-N 3.02Å; F1437-A1440 PolarHBondContact O-N 3.19Å; A1440-N1443 PolarHBondContact O-N 2.88Å; A1440-L1444 WeakPolarHBondContact O-CB 3.33Å; A1440-L1444 WeakPolarHBondContact O-CG 3.29Å; A1440-L1444 PolarHBondContact O-N 2.98Å
1441L89.3Confident82.4Confident0 Ų022.6 Ų22.60%013%0.133CC..Hα-helixtrans-61.4-46.7175.7-85.4169.8000111.6L1417 L1420 F1421 L1424 F1437 N1443 L1444 I1445 F1533L1417-L1441 HydrophobicContact CD1-CD2 3.79Å; L1420-L1441 HydrophobicContact CB-CD2 4.21Å; F1421-L1441 HydrophobicContact CD2-CD2 3.7Å; F1421-L1441 HydrophobicContact CE1-CD1 4.47Å; F1421-L1441 HydrophobicContact CE2-CD2 3.45Å; F1421-L1441 VanDerWaalsContact CE2-CD2 3.45Å; F1421-L1441 HydrophobicContact CG-CD2 4.45Å; F1421-L1441 HydrophobicContact CZ-CD1 4.31Å; F1421-L1441 HydrophobicContact CZ-CD2 4.01Å; L1424-L1441 HydrophobicContact CD1-CD1 4.19Å; F1437-L1441 HydrophobicContact CD1-CD1 3.92Å; F1437-L1441 HydrophobicContact CD1-CG 4.46Å; F1437-L1441 WeakPolarHBondContact O-CB 3.49Å; F1437-L1441 PolarHBondContact O-N 3.09Å; L1441-N1443 VanDerWaalsContact C-N 3.31Å; L1441-N1443 PolarHBondContact O-N 3.49Å; L1441-L1444 PolarHBondContact O-N 3.19Å; L1441-I1445 WeakPolarHBondContact O-CB 3.5Å; L1441-I1445 WeakPolarHBondContact O-CD1 3.48Å; L1441-I1445 WeakPolarHBondContact O-CG1 3.47Å; L1441-I1445 PolarHBondContact O-N 2.79Å; L1441-F1533 HydrophobicContact CD1-CD2 4.39Å; L1441-F1533 HydrophobicContact CD1-CE2 3.43Å; L1441-F1533 VanDerWaalsContact CD1-CE2 3.43Å; L1441-F1533 HydrophobicContact CD1-CZ 3.76Å
1442L89.1Confident83.4Confident0 Ų020 Ų200%012%0.118CC..Hα-helixtrans-55.2-50177.7179.765000110.7S1438 L1444 I1445 H1446 F1516 P1521 R1526 F1529S1438-L1442 VanDerWaalsContact O-CB 3.22Å; S1438-L1442 WeakPolarHBondContact O-CB 3.47Å; S1438-L1442 PolarHBondContact O-N 3.28Å; L1442-L1444 PolarHBondContact O-N 3.41Å; L1442-I1445 PolarHBondContact O-N 3.42Å; L1442-H1446 PolarHBondContact O-CD2 3.17Å; L1442-H1446 VanDerWaalsContact O-CD2 3.25Å; L1442-H1446 PolarHBondContact O-N 2.69Å; L1442-F1516 HydrophobicContact CD1-CD1 4.06Å; L1442-F1516 HydrophobicContact CD1-CE1 3.7Å; L1442-P1521 HydrophobicContact CD2-CB 3.73Å; L1442-P1521 HydrophobicContact CD2-CG 3.89Å; L1442-P1521 HydrophobicContact CG-CB 4.38Å; L1442-P1521 HydrophobicContact CG-CG 4.26Å; L1442-R1526 HydrophobicContact CD2-CB 4.46Å; L1442-R1526 HydrophobicContact CD2-CG 3.7Å; L1442-F1529 HydrophobicContact CB-CD1 3.81Å; L1442-F1529 HydrophobicContact CB-CE1 3.91Å; L1442-F1529 HydrophobicContact CB-CG 4.3Å; L1442-F1529 HydrophobicContact CB-CZ 4.47Å; L1442-F1529 HydrophobicContact CD1-CB 4.09Å; L1442-F1529 HydrophobicContact CD1-CD1 4.11Å; L1442-F1529 HydrophobicContact CD1-CD2 3.79Å; L1442-F1529 HydrophobicContact CD1-CE2 4.22Å; L1442-F1529 HydrophobicContact CD1-CG 3.72Å; L1442-F1529 HydrophobicContact CD2-CB 4.2Å; L1442-F1529 HydrophobicContact CD2-CD1 4.44Å; L1442-F1529 HydrophobicContact CD2-CG 4.39Å; L1442-F1529 HydrophobicContact CG-CD1 4.34Å; L1442-F1529 HydrophobicContact CG-CG 4.35Å
1443N88Confident84.3Confident0 Ų015.5 Ų15.50%09%0.094CC..Hα-helixtrans-63-41.4-179.9-77.510.2000112.4I1379 T1382 D1383 L1386 S1439 A1440 L1441 H1446 L1447 P1521 R1526I1379-N1443 PolarHBondContact O-ND2 3.3Å; T1382-N1443 HydrophobicContact CG2-CB 4.49Å; T1382-N1443 WeakPolarHBondContact OG1-CB 3.33Å; T1382-N1443 PolarHBondContact OG1-ND2 3.23Å; D1383-N1443 PolarHBondContact OD1-ND2 2.88Å; L1386-N1443 HydrophobicContact CD1-CB 4.25Å; S1439-N1443 WeakPolarHBondContact O-CB 3.45Å; S1439-N1443 PolarHBondContact O-N 3.41Å; A1440-N1443 PolarHBondContact O-N 2.88Å; L1441-N1443 VanDerWaalsContact C-N 3.31Å; L1441-N1443 PolarHBondContact O-N 3.49Å; N1443-H1446 PolarHBondContact O-N 3.17Å; N1443-L1447 PolarHBondContact O-N 3.04Å; N1443-L1447 VanDerWaalsContact O-N 3.07Å; N1443-P1521 WeakPolarHBondContact OD1-CG 3.34Å; N1443-R1526 PolarHBondContact ND2-NH2 3.41Å; N1443-R1526 VanDerWaalsContact ND2-NH2 3.13Å; N1443-R1526 PolarHBondContact OD1-NH2 2.96Å
1444L87.6Confident84.8Confident4 Ų420.3 Ų20.32%0.02112%0.119CC..Hα-helixtrans-67.3-35.1176.5-72.7169.1000112.8I1378 T1382 L1412 F1416 L1417 L1420 A1440 L1441 L1442 L1447 S1448I1378-L1444 HydrophobicContact CG2-CD1 4.32Å; I1378-L1444 HydrophobicContact CG2-CG 4.41Å; T1382-L1444 HydrophobicContact CG2-CD2 4.05Å; T1382-L1444 HydrophobicContact CG2-CG 4.48Å; L1412-L1444 HydrophobicContact CB-CD2 4.18Å; L1412-L1444 HydrophobicContact CD2-CD2 4.39Å; F1416-L1444 HydrophobicContact CD1-CD1 4.13Å; F1416-L1444 HydrophobicContact CE1-CD1 4.32Å; L1417-L1444 HydrophobicContact CD1-CB 3.6Å; L1417-L1444 HydrophobicContact CD1-CD1 4.39Å; L1420-L1444 HydrophobicContact CD1-CD1 3.43Å; L1420-L1444 VanDerWaalsContact CD1-CD1 3.43Å; A1440-L1444 WeakPolarHBondContact O-CB 3.33Å; A1440-L1444 WeakPolarHBondContact O-CG 3.29Å; A1440-L1444 PolarHBondContact O-N 2.98Å; L1441-L1444 PolarHBondContact O-N 3.19Å; L1442-L1444 PolarHBondContact O-N 3.41Å; L1444-L1447 HydrophobicContact CD2-CD1 4.26Å; L1444-L1447 WeakPolarHBondContact O-CB 3.42Å; L1444-L1447 PolarHBondContact O-N 2.92Å; L1444-S1448 PolarHBondContact O-N 2.99Å
1445I87.6Confident85.1Confident0 Ų020.4 Ų20.40%012%0.12CC..Hα-helixtrans-67.4-43.4174.8-66.1163.7000110.2L1417 F1421 L1441 L1442 L1447 S1448 P1449 Y1452 F1516 F1529L1417-I1445 HydrophobicContact CD1-CG1 4.06Å; F1421-I1445 HydrophobicContact CZ-CD1 4.48Å; L1441-I1445 WeakPolarHBondContact O-CB 3.5Å; L1441-I1445 WeakPolarHBondContact O-CD1 3.48Å; L1441-I1445 WeakPolarHBondContact O-CG1 3.47Å; L1441-I1445 PolarHBondContact O-N 2.79Å; L1442-I1445 PolarHBondContact O-N 3.42Å; I1445-L1447 PolarHBondContact O-N 3.24Å; I1445-S1448 CarbonylContact O-C 3.55Å; I1445-S1448 VanDerWaalsContact O-C 3.25Å; I1445-S1448 PolarHBondContact O-N 3.06Å; I1445-P1449 WeakPolarHBondContact O-CA 3.46Å; I1445-P1449 WeakPolarHBondContact O-CD 3.35Å; I1445-P1449 VanDerWaalsContact O-N 3.11Å; I1445-Y1452 HydrophobicContact CD1-CD2 3.92Å; I1445-Y1452 HydrophobicContact CD1-CE2 3.96Å; I1445-Y1452 HydrophobicContact CD1-CG 4.37Å; I1445-Y1452 HydrophobicContact CG1-CD2 3.83Å; I1445-Y1452 HydrophobicContact CG1-CE2 4.39Å; I1445-Y1452 HydrophobicContact CG1-CG 4.01Å; I1445-Y1452 HydrophobicContact CG2-CD1 3.96Å; I1445-Y1452 HydrophobicContact CG2-CD2 4.5Å; I1445-Y1452 HydrophobicContact CG2-CG 3.88Å; I1445-F1516 HydrophobicContact CB-CD1 4.49Å; I1445-F1516 HydrophobicContact CB-CE1 4.49Å; I1445-F1516 HydrophobicContact CD1-CZ 4.38Å; I1445-F1516 HydrophobicContact CG2-CB 4.19Å; I1445-F1516 HydrophobicContact CG2-CD1 3.72Å; I1445-F1516 HydrophobicContact CG2-CD2 3.49Å; I1445-F1516 VanDerWaalsContact CG2-CD2 3.49Å; I1445-F1516 HydrophobicContact CG2-CE1 3.87Å; I1445-F1516 HydrophobicContact CG2-CE2 3.67Å; I1445-F1516 HydrophobicContact CG2-CG 3.54Å; I1445-F1516 HydrophobicContact CG2-CZ 3.88Å; I1445-F1529 HydrophobicContact CD1-CE2 4.43Å; I1445-F1529 HydrophobicContact CD1-CZ 4.07Å
1446H86.4Confident85.5Confident2 Ų218.4 Ų18.41%0.00910%0.104CC..Hα-helixtrans-61.1-30.5174.5-88.6-99.4000112.7L1386 L1442 N1443 Y1482 F1516 N1517 N1519L1386-H1446 HydrophobicContact CD1-CB 4.07Å; L1386-H1446 HydrophobicContact CD2-CB 3.93Å; L1442-H1446 PolarHBondContact O-CD2 3.17Å; L1442-H1446 VanDerWaalsContact O-CD2 3.25Å; L1442-H1446 PolarHBondContact O-N 2.69Å; N1443-H1446 PolarHBondContact O-N 3.17Å; H1446-Y1482 PolarHBondContact NE2-OH 3.47Å; H1446-F1516 AromaticContact CD2-CD1 3.7Å; H1446-F1516 AromaticContact NE2-CD1 3.61Å; H1446-N1517 PolarHBondContact CE1-O 2.8Å; H1446-N1517 PolarHBondContact CE1-OD1 3.01Å; H1446-N1517 PolarHBondContact ND1-O 2.85Å; H1446-N1519 PolarHBondContact ND1-O 3.12Å
1447L82.8Confident85.6Confident20 Ų2022.4 Ų22.411%0.10512%0.118CC..Hα-helixtrans-67.9-43.6175.8-93.3163.2000113.5T1382 F1385 R1389 I1407 N1443 L1444 I1445T1382-L1447 HydrophobicContact CG2-CD1 3.42Å; T1382-L1447 VanDerWaalsContact CG2-CD1 3.42Å; F1385-L1447 HydrophobicContact CD1-CD2 3.18Å; F1385-L1447 HydrophobicContact CD1-CG 4.36Å; F1385-L1447 HydrophobicContact CE1-CD2 3.36Å; F1385-L1447 HydrophobicContact CG-CD2 3.93Å; F1385-L1447 HydrophobicContact CZ-CD2 4.27Å; R1389-L1447 PolarHBondContact NH1-O 3.29Å; I1407-L1447 HydrophobicContact CD1-CD1 4Å; I1407-L1447 HydrophobicContact CD1-CD2 3.37Å; I1407-L1447 HydrophobicContact CD1-CG 4.35Å; N1443-L1447 PolarHBondContact O-N 3.04Å; N1443-L1447 VanDerWaalsContact O-N 3.07Å; L1444-L1447 HydrophobicContact CD2-CD1 4.26Å; L1444-L1447 WeakPolarHBondContact O-CB 3.42Å; L1444-L1447 PolarHBondContact O-N 2.92Å; I1445-L1447 PolarHBondContact O-N 3.24Å
1448S82Confident85.5Confident36 Ų3627.8 Ų27.825%0.25214%0.143SC..  trans-137.477.8-179.554.80000112.3L1444 I1445 E1450 A1451 Y1452L1444-S1448 PolarHBondContact O-N 2.99Å; I1445-S1448 CarbonylContact O-C 3.55Å; I1445-S1448 VanDerWaalsContact O-C 3.25Å; I1445-S1448 PolarHBondContact O-N 3.06Å; S1448-E1450 PolarHBondContact O-N 2.73Å; S1448-A1451 WeakPolarHBondContact O-CB 3.48Å; S1448-A1451 PolarHBondContact O-N 3.3Å; S1448-Y1452 PolarHBondContact O-N 3Å
1449P84.4Confident85.2Confident35 Ų3529.8 Ų29.823%0.22715%0.15CC..Hα-helixtrans-62.3-40.1-176.4-21.832000113I1445 A1451 Y1452 S1453 I1513I1445-P1449 WeakPolarHBondContact O-CA 3.46Å; I1445-P1449 WeakPolarHBondContact O-CD 3.35Å; I1445-P1449 VanDerWaalsContact O-N 3.11Å; P1449-A1451 VanDerWaalsContact C-N 3.31Å; P1449-A1451 PolarHBondContact O-N 3.05Å; P1449-Y1452 PolarHBondContact O-N 2.96Å; P1449-S1453 PolarHBondContact O-N 3.07Å; P1449-S1453 VanDerWaalsContact O-N 3.11Å; P1449-I1513 HydrophobicContact CB-CG2 3.44Å; P1449-I1513 VanDerWaalsContact CB-CG2 3.44Å; P1449-I1513 WeakPolarHBondContact O-CG2 3.32Å
1450E82.3Confident84.9Confident123 Ų12329.6 Ų29.658%0.57515%0.148SC*.Hα-helixtrans-62.1-38.9177.7-77.2-175.915900112.4S1448 S1453 N1454S1448-E1450 PolarHBondContact O-N 2.73Å; E1450-S1453 WeakPolarHBondContact O-CB 3.48Å; E1450-S1453 PolarHBondContact O-N 3.31Å; E1450-S1453 VanDerWaalsContact O-N 3.16Å; E1450-S1453 PolarHBondContact O-OG 3.07Å; E1450-N1454 PolarHBondContact O-N 2.91Å
1451A80.6Confident84.6Confident15 Ų1535 Ų3512%0.12418%0.177CC..Hα-helixtrans-63.7-44179.200000111.9T1414 S1448 P1449 S1453 N1454 L1455T1414-A1451 HydrophobicContact CG2-CB 3.15Å; S1448-A1451 WeakPolarHBondContact O-CB 3.48Å; S1448-A1451 PolarHBondContact O-N 3.3Å; P1449-A1451 VanDerWaalsContact C-N 3.31Å; P1449-A1451 PolarHBondContact O-N 3.05Å; A1451-S1453 VanDerWaalsContact C-N 3.3Å; A1451-S1453 PolarHBondContact O-N 2.93Å; A1451-N1454 PolarHBondContact O-N 3.16Å; A1451-L1455 WeakPolarHBondContact O-CB 3.22Å; A1451-L1455 PolarHBondContact O-N 2.98Å
1452Y85.2Confident84.1Confident1 Ų140.7 Ų40.70%0.00421%0.207CC..Hα-helixtrans-57-45.9172.2173-108.2000110.8L1417 F1421 I1445 S1448 P1449 N1454 L1455 V1456 F1476 L1479 Y1512 I1513 F1516L1417-Y1452 HydrophobicContact CD2-CD2 4.49Å; F1421-Y1452 HydrophobicContact CE2-CD2 4.03Å; F1421-Y1452 AromaticContact CE2-CE2 3.89Å; F1421-Y1452 HydrophobicContact CE2-CE2 3.89Å; F1421-Y1452 HydrophobicContact CZ-CD2 4.33Å; F1421-Y1452 AromaticContact CZ-CE2 3.73Å; F1421-Y1452 HydrophobicContact CZ-CE2 3.73Å; I1445-Y1452 HydrophobicContact CD1-CD2 3.92Å; I1445-Y1452 HydrophobicContact CD1-CE2 3.96Å; I1445-Y1452 HydrophobicContact CD1-CG 4.37Å; I1445-Y1452 HydrophobicContact CG1-CD2 3.83Å; I1445-Y1452 HydrophobicContact CG1-CE2 4.39Å; I1445-Y1452 HydrophobicContact CG1-CG 4.01Å; I1445-Y1452 HydrophobicContact CG2-CD1 3.96Å; I1445-Y1452 HydrophobicContact CG2-CD2 4.5Å; I1445-Y1452 HydrophobicContact CG2-CG 3.88Å; S1448-Y1452 PolarHBondContact O-N 3Å; P1449-Y1452 PolarHBondContact O-N 2.96Å; Y1452-N1454 VanDerWaalsContact C-N 3.33Å; Y1452-N1454 PolarHBondContact O-N 2.93Å; Y1452-L1455 WeakPolarHBondContact O-CB 3.34Å; Y1452-L1455 PolarHBondContact O-N 2.7Å; Y1452-V1456 HydrophobicContact CD1-CG2 4.34Å; Y1452-V1456 HydrophobicContact CD2-CG2 4.21Å; Y1452-V1456 HydrophobicContact CE1-CG2 3.91Å; Y1452-V1456 HydrophobicContact CE2-CG2 3.76Å; Y1452-V1456 HydrophobicContact CG-CG2 4.49Å; Y1452-V1456 WeakPolarHBondContact O-CG2 3.42Å; Y1452-V1456 PolarHBondContact O-N 2.88Å; Y1452-F1476 HydrophobicContact CE2-CD1 4.5Å; Y1452-F1476 HydrophobicContact CE2-CE1 4.41Å; Y1452-F1476 WeakPolarHBondContact OH-CD1 3.38Å; Y1452-L1479 HydrophobicContact CE2-CD2 4.43Å; Y1452-L1479 VanDerWaalsContact OH-CD2 3.23Å; Y1452-L1479 WeakPolarHBondContact OH-CD2 3Å; Y1452-Y1512 WeakPolarHBondContact CE1-O 3.3Å; Y1452-I1513 HydrophobicContact CD1-CG2 4.42Å; Y1452-F1516 HydrophobicContact CD1-CE2 4.19Å; Y1452-F1516 AromaticContact CE1-CE2 3.88Å; Y1452-F1516 HydrophobicContact CE1-CE2 3.88Å
1453S84.9Confident83.3Confident5 Ų542.3 Ų42.34%0.03522%0.218CC..Hα-helixtrans-60.9-40.8178.288.90000112.9P1449 E1450 A1451 L1455 V1456 Y1457 N1510P1449-S1453 PolarHBondContact O-N 3.07Å; P1449-S1453 VanDerWaalsContact O-N 3.11Å; E1450-S1453 WeakPolarHBondContact O-CB 3.48Å; E1450-S1453 PolarHBondContact O-N 3.31Å; E1450-S1453 VanDerWaalsContact O-N 3.16Å; E1450-S1453 PolarHBondContact O-OG 3.07Å; A1451-S1453 VanDerWaalsContact C-N 3.3Å; A1451-S1453 PolarHBondContact O-N 2.93Å; S1453-L1455 VanDerWaalsContact C-N 3.33Å; S1453-L1455 PolarHBondContact O-N 3.42Å; S1453-V1456 PolarHBondContact O-N 2.97Å; S1453-Y1457 WeakPolarHBondContact O-CD2 3.39Å; S1453-Y1457 PolarHBondContact O-N 3.32Å; S1453-N1510 WeakPolarHBondContact CB-ND2 3.43Å; S1453-N1510 PolarHBondContact OG-ND2 3.39Å
1454N85Confident82.6Confident104 Ų10451.8 Ų51.856%0.55626%0.262SS*.Hα-helixtrans-64.7-40.3177.7-72.9-24.3000111.3E1450 A1451 Y1452 Y1457 Q1458E1450-N1454 PolarHBondContact O-N 2.91Å; A1451-N1454 PolarHBondContact O-N 3.16Å; Y1452-N1454 VanDerWaalsContact C-N 3.33Å; Y1452-N1454 PolarHBondContact O-N 2.93Å; N1454-Y1457 PolarHBondContact O-N 2.89Å; N1454-Q1458 WeakPolarHBondContact O-CB 3.26Å; N1454-Q1458 PolarHBondContact O-N 3.09Å
1455L83.5Confident81.9Confident10 Ų1054.5 Ų54.55%0.05228%0.277CS..Hα-helixtrans-64.1-44.5177.7-152.1164000111.3L1417 A1451 Y1452 S1453 Q1458 W1459L1417-L1455 HydrophobicContact CD2-CD1 3.97Å; L1417-L1455 HydrophobicContact CG-CD1 4.23Å; A1451-L1455 WeakPolarHBondContact O-CB 3.22Å; A1451-L1455 PolarHBondContact O-N 2.98Å; Y1452-L1455 WeakPolarHBondContact O-CB 3.34Å; Y1452-L1455 PolarHBondContact O-N 2.7Å; S1453-L1455 VanDerWaalsContact C-N 3.33Å; S1453-L1455 PolarHBondContact O-N 3.42Å; L1455-Q1458 WeakPolarHBondContact O-CB 3.5Å; L1455-Q1458 PolarHBondContact O-N 3.12Å; L1455-W1459 HydrophobicContact CD2-CD2 4.31Å; L1455-W1459 HydrophobicContact CD2-CG 4.3Å; L1455-W1459 PolarHBondContact O-N 2.73Å
1456V84.9Confident81.3Confident0 Ų058.5 Ų58.50%030%0.303CS..Hα-helixtrans-57.2-50.8173169.40000110.6Y1452 S1453 Q1458 W1459 I1460 F1476 Y1512Y1452-V1456 HydrophobicContact CD1-CG2 4.34Å; Y1452-V1456 HydrophobicContact CD2-CG2 4.21Å; Y1452-V1456 HydrophobicContact CE1-CG2 3.91Å; Y1452-V1456 HydrophobicContact CE2-CG2 3.76Å; Y1452-V1456 HydrophobicContact CG-CG2 4.49Å; Y1452-V1456 WeakPolarHBondContact O-CG2 3.42Å; Y1452-V1456 PolarHBondContact O-N 2.88Å; S1453-V1456 PolarHBondContact O-N 2.97Å; V1456-Q1458 VanDerWaalsContact C-N 3.27Å; V1456-Q1458 PolarHBondContact O-N 3.27Å; V1456-W1459 PolarHBondContact O-N 2.9Å; V1456-I1460 HydrophobicContact CG1-CD1 3.6Å; V1456-I1460 HydrophobicContact CG1-CG1 4.43Å; V1456-I1460 VanDerWaalsContact O-CG1 3.25Å; V1456-I1460 WeakPolarHBondContact O-CG1 3.03Å; V1456-I1460 PolarHBondContact O-N 2.92Å; V1456-F1476 HydrophobicContact CB-CD2 4.35Å; V1456-F1476 HydrophobicContact CB-CG 4.36Å; V1456-F1476 HydrophobicContact CG1-CB 3.79Å; V1456-F1476 HydrophobicContact CG1-CD1 4.47Å; V1456-F1476 HydrophobicContact CG1-CD2 3.72Å; V1456-F1476 HydrophobicContact CG1-CE2 4.35Å; V1456-F1476 HydrophobicContact CG1-CG 3.78Å; V1456-F1476 HydrophobicContact CG2-CB 4.28Å; V1456-F1476 HydrophobicContact CG2-CD1 3.63Å; V1456-F1476 HydrophobicContact CG2-CD2 4.16Å; V1456-F1476 HydrophobicContact CG2-CE1 3.84Å; V1456-F1476 HydrophobicContact CG2-CE2 4.33Å; V1456-F1476 HydrophobicContact CG2-CG 3.79Å; V1456-F1476 HydrophobicContact CG2-CZ 4.19Å; V1456-Y1512 HydrophobicContact CG1-CD1 3.92Å; V1456-Y1512 HydrophobicContact CG1-CD2 4.19Å; V1456-Y1512 HydrophobicContact CG1-CE1 4.07Å; V1456-Y1512 HydrophobicContact CG1-CE2 4.35Å; V1456-Y1512 HydrophobicContact CG1-CG 3.98Å
1457Y85Confident80.6Confident97 Ų9763.9 Ų63.938%0.3833%0.33SS..Hα-helixtrans-61.2-36.8177-79.1-61.5000112.7S1453 N1454 N1461 N1510 Y1512S1453-Y1457 WeakPolarHBondContact O-CD2 3.39Å; S1453-Y1457 PolarHBondContact O-N 3.32Å; N1454-Y1457 PolarHBondContact O-N 2.89Å; Y1457-N1461 VanDerWaalsContact O-CB 3.26Å; Y1457-N1461 WeakPolarHBondContact O-CB 3.32Å; Y1457-N1461 PolarHBondContact O-N 3.25Å; Y1457-N1461 PolarHBondContact O-ND2 3.19Å; Y1457-N1510 PolarHBondContact OH-OD1 2.93Å; Y1457-Y1512 AromaticContact CE1-CE2 3.93Å; Y1457-Y1512 HydrophobicContact CE1-CE2 3.93Å; Y1457-Y1512 HydrophobicContact CE2-CD2 4.39Å; Y1457-Y1512 HydrophobicContact CE2-CE2 4.43Å; Y1457-Y1512 AromaticContact CZ-CE2 3.79Å
1458Q83.8Confident80.1Confident114 Ų11464 Ų6453%0.53333%0.331SS..Hα-helixtrans-67.1-42.5179.2-157.3176.712.800111.5N1454 L1455 V1456 N1461 N1462N1454-Q1458 WeakPolarHBondContact O-CB 3.26Å; N1454-Q1458 PolarHBondContact O-N 3.09Å; L1455-Q1458 WeakPolarHBondContact O-CB 3.5Å; L1455-Q1458 PolarHBondContact O-N 3.12Å; V1456-Q1458 VanDerWaalsContact C-N 3.27Å; V1456-Q1458 PolarHBondContact O-N 3.27Å; Q1458-N1461 PolarHBondContact O-N 2.96Å; Q1458-N1462 WeakPolarHBondContact O-CB 3.46Å; Q1458-N1462 PolarHBondContact O-N 3.41Å; Q1458-N1462 PolarHBondContact O-ND2 3.34Å; Q1458-N1462 PolarHBondContact O-OD1 2.94Å
1459W79.8Confident79.9Confident42 Ų4265.2 Ų65.216%0.15933%0.333CS..Hα-helixtrans-66.2-45176-8228.2000111.8F1421 T1422 T1425 L1455 V1456 N1461 N1462 C1463 L1472 F1476 M1540F1421-W1459 HydrophobicContact CB-CH2 3.85Å; F1421-W1459 HydrophobicContact CB-CZ2 4.15Å; F1421-W1459 HydrophobicContact CB-CZ3 4.47Å; T1422-W1459 HydrophobicContact CG2-CZ2 4.01Å; T1425-W1459 HydrophobicContact CG2-CH2 3.8Å; T1425-W1459 HydrophobicContact CG2-CZ3 4.23Å; L1455-W1459 HydrophobicContact CD2-CD2 4.31Å; L1455-W1459 HydrophobicContact CD2-CG 4.3Å; L1455-W1459 PolarHBondContact O-N 2.73Å; V1456-W1459 PolarHBondContact O-N 2.9Å; W1459-N1461 VanDerWaalsContact C-N 3.32Å; W1459-N1461 PolarHBondContact O-N 2.97Å; W1459-N1462 PolarHBondContact O-N 3.07Å; W1459-C1463 PolarHBondContact O-N 3.49Å; W1459-L1472 HydrophobicContact CB-CD2 4.5Å; W1459-F1476 HydrophobicContact CB-CE2 4.27Å; W1459-F1476 HydrophobicContact CE3-CE2 4.19Å; W1459-F1476 AromaticContact CE3-CZ 3.78Å; W1459-F1476 HydrophobicContact CE3-CZ 3.78Å; W1459-F1476 HydrophobicContact CZ3-CZ 4.39Å; W1459-M1540 HydrophobicContact CE3-CE 3.33Å; W1459-M1540 HydrophobicContact CH2-CE 4.13Å; W1459-M1540 HydrophobicContact CZ3-CE 3.04Å
1460I81.8Confident79.7Confident13 Ų1367.6 Ų67.67%0.06735%0.347CS..Hα-helixtrans-61.3-41.5177-66.1168.8000110.8V1456 N1462 Q1469 L1472 F1476 Y1512V1456-I1460 HydrophobicContact CG1-CD1 3.6Å; V1456-I1460 HydrophobicContact CG1-CG1 4.43Å; V1456-I1460 VanDerWaalsContact O-CG1 3.25Å; V1456-I1460 WeakPolarHBondContact O-CG1 3.03Å; V1456-I1460 PolarHBondContact O-N 2.92Å; I1460-N1462 VanDerWaalsContact C-N 3.34Å; I1460-N1462 PolarHBondContact O-N 3.16Å; I1460-Q1469 HydrophobicContact CG2-CG 3.57Å; I1460-Q1469 WeakPolarHBondContact O-CG 3.31Å; I1460-Q1469 PolarHBondContact O-NE2 3.43Å; I1460-L1472 HydrophobicContact CG1-CD2 4.2Å; I1460-F1476 HydrophobicContact CG1-CD2 4.46Å; I1460-Y1512 HydrophobicContact CD1-CE1 4.48Å
1461N82.4Confident79.4Confident114 Ų11465.8 Ų65.861%0.6133%0.334SS*.Hα-helixtrans-74-22.9-179.4-73-22.6000113.8Y1457 Q1458 W1459Y1457-N1461 VanDerWaalsContact O-CB 3.26Å; Y1457-N1461 WeakPolarHBondContact O-CB 3.32Å; Y1457-N1461 PolarHBondContact O-N 3.25Å; Y1457-N1461 PolarHBondContact O-ND2 3.19Å; Q1458-N1461 PolarHBondContact O-N 2.96Å; W1459-N1461 VanDerWaalsContact C-N 3.32Å; W1459-N1461 PolarHBondContact O-N 2.97Å
1462N79.7Confident79.4Confident119 Ų11965.4 Ų65.464%0.63633%0.33SS*.Hα-helixtrans-82.2-13.1179.3-74.8-10000113.2Q1458 W1459 I1460 E1464Q1458-N1462 WeakPolarHBondContact O-CB 3.46Å; Q1458-N1462 PolarHBondContact O-N 3.41Å; Q1458-N1462 PolarHBondContact O-ND2 3.34Å; Q1458-N1462 PolarHBondContact O-OD1 2.94Å; W1459-N1462 PolarHBondContact O-N 3.07Å; I1460-N1462 VanDerWaalsContact C-N 3.34Å; I1460-N1462 PolarHBondContact O-N 3.16Å; N1462-E1464 PolarHBondContact O-N 3.08Å
1463C72.1Confident79.3Confident35 Ų3566.5 Ų66.524%0.23634%0.338CS..  trans-75.8121.9175.6-71.10000111.3W1459 Q1469W1459-C1463 PolarHBondContact O-N 3.49Å; C1463-Q1469 HydrophobicContact CB-CB 4.26Å
1464E73.7Confident79.1Confident199 Ų19970.4 Ų70.493%0.9336%0.359SS*.SBendtrans-75.2-31.9177-66.2-169166.900112.9N1462N1462-E1464 PolarHBondContact O-N 3.08Å
1465D72.7Confident78.9Confident60 Ų6066 Ų6632%0.32134%0.337SS..  trans-86.4118.7-178.6-166.6-31.2000111.5I1467 I1468 Q1469D1465-I1467 PolarHBondContact O-N 2.78Å; D1465-I1467 PolarHBondContact OD1-N 2.88Å; D1465-I1468 HydrophobicContact CB-CB 4.25Å; D1465-I1468 HydrophobicContact CB-CD1 3.89Å; D1465-I1468 HydrophobicContact CB-CG1 4.17Å; D1465-I1468 PolarHBondContact O-N 3.34Å; D1465-Q1469 WeakPolarHBondContact O-CB 3.42Å; D1465-Q1469 PolarHBondContact O-N 3.02Å
1466P74.2Confident79Confident84 Ų8465.5 Ų65.555%0.54533%0.334SS..Hα-helixtrans-63.8-24.5-178.525.2-34.1000113.9T1470P1466-T1470 WeakPolarHBondContact O-CG2 3.31Å; P1466-T1470 PolarHBondContact O-N 3.33Å; P1466-T1470 VanDerWaalsContact O-N 3.12Å; P1466-T1470 PolarHBondContact O-OG1 3.37Å
1467I72.1Confident78.9Confident115 Ų11569 Ų6959%0.5935%0.349SS*.Hα-helixtrans-72.9-43.3177.7-59.4174.3000110D1465 Q1469 T1470 R1471D1465-I1467 PolarHBondContact O-N 2.78Å; D1465-I1467 PolarHBondContact OD1-N 2.88Å; I1467-Q1469 VanDerWaalsContact C-N 3.35Å; I1467-T1470 PolarHBondContact O-N 3.34Å; I1467-T1470 PolarHBondContact O-OG1 2.88Å; I1467-R1471 PolarHBondContact O-N 3.27Å
1468I71.9Confident78.6Confident22 Ų2270 Ų7011%0.11336%0.357CS..Hα-helixtrans-65-45.3175.1-66.4169000109.3D1465 T1470 R1471 L1472 F1543 F1546D1465-I1468 HydrophobicContact CB-CB 4.25Å; D1465-I1468 HydrophobicContact CB-CD1 3.89Å; D1465-I1468 HydrophobicContact CB-CG1 4.17Å; D1465-I1468 PolarHBondContact O-N 3.34Å; I1468-T1470 VanDerWaalsContact C-N 3.29Å; I1468-T1470 PolarHBondContact O-N 2.93Å; I1468-R1471 PolarHBondContact O-N 3.44Å; I1468-L1472 HydrophobicContact CG2-CD1 4.1Å; I1468-L1472 WeakPolarHBondContact O-CB 3.24Å; I1468-L1472 PolarHBondContact O-N 2.95Å; I1468-F1543 HydrophobicContact CB-CD1 4.13Å; I1468-F1543 HydrophobicContact CB-CE1 4.22Å; I1468-F1543 HydrophobicContact CD1-CD1 4.47Å; I1468-F1543 HydrophobicContact CG1-CD1 3.84Å; I1468-F1543 HydrophobicContact CG1-CE1 4.08Å; I1468-F1543 HydrophobicContact CG2-CB 4.46Å; I1468-F1543 HydrophobicContact CG2-CD1 3.5Å; I1468-F1543 HydrophobicContact CG2-CE1 3.85Å; I1468-F1543 HydrophobicContact CG2-CG 3.94Å; I1468-F1546 HydrophobicContact CD1-CB 3.65Å; I1468-F1546 HydrophobicContact CD1-CD1 4.12Å; I1468-F1546 HydrophobicContact CD1-CD2 4.15Å; I1468-F1546 HydrophobicContact CD1-CG 3.71Å
1469Q78.3Confident78.5Confident62 Ų6264.6 Ų64.629%0.2933%0.332SS..Hα-helixtrans-55-42.8179.1-170.9177.94700112.9I1460 C1463 D1465 I1467 S1473I1460-Q1469 HydrophobicContact CG2-CG 3.57Å; I1460-Q1469 WeakPolarHBondContact O-CG 3.31Å; I1460-Q1469 PolarHBondContact O-NE2 3.43Å; C1463-Q1469 HydrophobicContact CB-CB 4.26Å; D1465-Q1469 WeakPolarHBondContact O-CB 3.42Å; D1465-Q1469 PolarHBondContact O-N 3.02Å; I1467-Q1469 VanDerWaalsContact C-N 3.35Å; Q1469-S1473 WeakPolarHBondContact O-CB 3.45Å; Q1469-S1473 PolarHBondContact O-N 2.86Å
1470T79.2Confident78.4Confident85 Ų8562.6 Ų62.652%0.52133%0.325SS..Hα-helixtrans-69.3-47.1179.142.80000112.4P1466 I1467 I1468 L1472 S1473 D1474P1466-T1470 WeakPolarHBondContact O-CG2 3.31Å; P1466-T1470 PolarHBondContact O-N 3.33Å; P1466-T1470 VanDerWaalsContact O-N 3.12Å; P1466-T1470 PolarHBondContact O-OG1 3.37Å; I1467-T1470 PolarHBondContact O-N 3.34Å; I1467-T1470 PolarHBondContact O-OG1 2.88Å; I1468-T1470 VanDerWaalsContact C-N 3.29Å; I1468-T1470 PolarHBondContact O-N 2.93Å; T1470-L1472 VanDerWaalsContact C-N 3.35Å; T1470-L1472 PolarHBondContact O-N 3.21Å; T1470-S1473 WeakPolarHBondContact O-CB 3.35Å; T1470-S1473 PolarHBondContact O-N 3.16Å; T1470-D1474 PolarHBondContact O-N 3.28Å
1471R77.3Confident78.2Confident85 Ų8563.7 Ų63.732%0.32133%0.331SS..Hα-helixtrans-63.4-41177.2-70.4178.162.4-172.9-0.9112.5I1467 I1468 S1473 D1474 A1475 E1539 S1542 F1543I1467-R1471 PolarHBondContact O-N 3.27Å; I1468-R1471 PolarHBondContact O-N 3.44Å; R1471-S1473 VanDerWaalsContact C-N 3.32Å; R1471-S1473 PolarHBondContact O-N 3.04Å; R1471-D1474 PolarHBondContact O-N 3.35Å; R1471-A1475 WeakPolarHBondContact O-CB 3.48Å; R1471-A1475 PolarHBondContact O-N 3Å; R1471-E1539 IonicContact CZ-OE1 3.81Å; R1471-E1539 IonicContact CZ-OE2 3.65Å; R1471-E1539 VanDerWaalsContact CZ-OE2 3.29Å; R1471-E1539 IonicContact NE-OE2 2.78Å; R1471-E1539 PolarHBondContact NE-OE2 2.95Å; R1471-E1539 IonicContact NH2-OE1 2.78Å; R1471-E1539 PolarHBondContact NH2-OE1 2.96Å; R1471-E1539 IonicContact NH2-OE2 3.78Å; R1471-E1539 PolarHBondContact NH2-OE2 2.67Å; R1471-S1542 PolarHBondContact NH2-OG 3.13Å; R1471-F1543 HydrophobicContact CB-CE1 4.1Å; R1471-F1543 HydrophobicContact CB-CZ 3.49Å; R1471-F1543 VanDerWaalsContact CB-CZ 3.49Å; R1471-F1543 HydrophobicContact CG-CZ 4.46Å
1472L80.7Confident77.5Confident7 Ų758.8 Ų58.84%0.03730%0.303CS..Hα-helixtrans-67.3-36-179.9-153.5148.4000110.9W1459 I1460 I1468 T1470 F1476 M1540 F1543W1459-L1472 HydrophobicContact CB-CD2 4.5Å; I1460-L1472 HydrophobicContact CG1-CD2 4.2Å; I1468-L1472 HydrophobicContact CG2-CD1 4.1Å; I1468-L1472 WeakPolarHBondContact O-CB 3.24Å; I1468-L1472 PolarHBondContact O-N 2.95Å; T1470-L1472 VanDerWaalsContact C-N 3.35Å; T1470-L1472 PolarHBondContact O-N 3.21Å; L1472-F1476 HydrophobicContact CD2-CD2 3.65Å; L1472-F1476 HydrophobicContact CD2-CE2 3.34Å; L1472-F1476 HydrophobicContact CD2-CZ 4.47Å; L1472-F1476 WeakPolarHBondContact O-CD2 3.31Å; L1472-F1476 PolarHBondContact O-N 3.04Å; L1472-F1476 VanDerWaalsContact O-N 3.12Å; L1472-M1540 HydrophobicContact CD1-CE 4.3Å; L1472-M1540 HydrophobicContact CD1-SD 3.81Å; L1472-M1540 HydrophobicContact CG-SD 4.02Å; L1472-F1543 HydrophobicContact CB-CE2 4.19Å; L1472-F1543 HydrophobicContact CD1-CD2 3.86Å; L1472-F1543 HydrophobicContact CD1-CE2 4.23Å; L1472-F1543 HydrophobicContact CD1-CG 4.39Å; L1472-F1543 HydrophobicContact CG-CD2 4.35Å; L1472-F1543 HydrophobicContact CG-CE2 4.29Å
1473S83.2Confident76.6Confident25 Ų2556.3 Ų56.318%0.17530%0.295CS..Hα-helixtrans-61.5-46.7169.9-177.60000112.4Q1469 T1470 R1471 F1476 K1477 Y1512Q1469-S1473 WeakPolarHBondContact O-CB 3.45Å; Q1469-S1473 PolarHBondContact O-N 2.86Å; T1470-S1473 WeakPolarHBondContact O-CB 3.35Å; T1470-S1473 PolarHBondContact O-N 3.16Å; R1471-S1473 VanDerWaalsContact C-N 3.32Å; R1471-S1473 PolarHBondContact O-N 3.04Å; S1473-F1476 PolarHBondContact O-N 3.45Å; S1473-K1477 WeakPolarHBondContact O-CB 3.48Å; S1473-K1477 PolarHBondContact O-N 3.34Å; S1473-Y1512 PolarHBondContact OG-OH 2.63Å
1474D80.2Confident75.6Confident86 Ų8657.7 Ų57.746%0.4630%0.3SS..Hα-helixtrans-65.7-39.5178.3-78.8-23.3000112.2T1470 R1471 F1476 K1477 H1478T1470-D1474 PolarHBondContact O-N 3.28Å; R1471-D1474 PolarHBondContact O-N 3.35Å; D1474-F1476 PolarHBondContact O-N 3.36Å; D1474-K1477 VanDerWaalsContact O-CB 3.3Å; D1474-K1477 WeakPolarHBondContact O-CB 3.49Å; D1474-K1477 PolarHBondContact O-N 2.86Å; D1474-K1477 VanDerWaalsContact O-N 3.11Å; D1474-H1478 PolarHBondContact O-CD2 2.96Å; D1474-H1478 PolarHBondContact O-N 3.09Å
1475A80.2Confident74.1Confident11 Ų1153.9 Ų53.99%0.09129%0.286CS..Hα-helixtrans-59.2-47.5175.900000111.8R1471 K1477 H1478 L1479 F1536 E1539R1471-A1475 WeakPolarHBondContact O-CB 3.48Å; R1471-A1475 PolarHBondContact O-N 3Å; A1475-K1477 VanDerWaalsContact C-N 3.29Å; A1475-K1477 PolarHBondContact O-N 2.95Å; A1475-H1478 PolarHBondContact O-N 3.05Å; A1475-L1479 PolarHBondContact O-N 3.42Å; A1475-L1479 VanDerWaalsContact O-N 3.07Å; A1475-F1536 HydrophobicContact CB-CD2 3.97Å; A1475-F1536 HydrophobicContact CB-CE2 4.41Å; A1475-E1539 HydrophobicContact CB-CB 4.38Å
1476F85.4Confident72.6Confident0 Ų055.6 Ų55.60%030%0.295CS..Hα-helixtrans-65.3-33174.3-82.2-55.3000113.1F1421 Y1452 V1456 W1459 I1460 L1472 S1473 D1474 L1479 G1480 Y1512 F1536F1421-F1476 HydrophobicContact CE1-CE1 4.26Å; Y1452-F1476 HydrophobicContact CE2-CD1 4.5Å; Y1452-F1476 HydrophobicContact CE2-CE1 4.41Å; Y1452-F1476 WeakPolarHBondContact OH-CD1 3.38Å; V1456-F1476 HydrophobicContact CB-CD2 4.35Å; V1456-F1476 HydrophobicContact CB-CG 4.36Å; V1456-F1476 HydrophobicContact CG1-CB 3.79Å; V1456-F1476 HydrophobicContact CG1-CD1 4.47Å; V1456-F1476 HydrophobicContact CG1-CD2 3.72Å; V1456-F1476 HydrophobicContact CG1-CE2 4.35Å; V1456-F1476 HydrophobicContact CG1-CG 3.78Å; V1456-F1476 HydrophobicContact CG2-CB 4.28Å; V1456-F1476 HydrophobicContact CG2-CD1 3.63Å; V1456-F1476 HydrophobicContact CG2-CD2 4.16Å; V1456-F1476 HydrophobicContact CG2-CE1 3.84Å; V1456-F1476 HydrophobicContact CG2-CE2 4.33Å; V1456-F1476 HydrophobicContact CG2-CG 3.79Å; V1456-F1476 HydrophobicContact CG2-CZ 4.19Å; W1459-F1476 HydrophobicContact CB-CE2 4.27Å; W1459-F1476 HydrophobicContact CE3-CE2 4.19Å; W1459-F1476 AromaticContact CE3-CZ 3.78Å; W1459-F1476 HydrophobicContact CE3-CZ 3.78Å; W1459-F1476 HydrophobicContact CZ3-CZ 4.39Å; I1460-F1476 HydrophobicContact CG1-CD2 4.46Å; L1472-F1476 HydrophobicContact CD2-CD2 3.65Å; L1472-F1476 HydrophobicContact CD2-CE2 3.34Å; L1472-F1476 HydrophobicContact CD2-CZ 4.47Å; L1472-F1476 WeakPolarHBondContact O-CD2 3.31Å; L1472-F1476 PolarHBondContact O-N 3.04Å; L1472-F1476 VanDerWaalsContact O-N 3.12Å; S1473-F1476 PolarHBondContact O-N 3.45Å; D1474-F1476 PolarHBondContact O-N 3.36Å; F1476-L1479 PolarHBondContact O-N 2.98Å; F1476-G1480 PolarHBondContact O-N 3.27Å; F1476-Y1512 HydrophobicContact CB-CD1 4.02Å; F1476-Y1512 HydrophobicContact CB-CE1 4.19Å; F1476-F1536 HydrophobicContact CD1-CD2 4.25Å; F1476-F1536 AromaticContact CD1-CE2 3.45Å; F1476-F1536 HydrophobicContact CD1-CE2 3.45Å; F1476-F1536 VanDerWaalsContact CD1-CE2 3.45Å; F1476-F1536 AromaticContact CD1-CZ 3.94Å; F1476-F1536 HydrophobicContact CD1-CZ 3.94Å; F1476-F1536 HydrophobicContact CD2-CE2 4.31Å; F1476-F1536 HydrophobicContact CE1-CD2 4.44Å; F1476-F1536 HydrophobicContact CE1-CE1 4.4Å; F1476-F1536 AromaticContact CE1-CE2 3.35Å; F1476-F1536 HydrophobicContact CE1-CE2 3.35Å; F1476-F1536 AromaticContact CE1-CZ 3.32Å; F1476-F1536 HydrophobicContact CE1-CZ 3.32Å; F1476-F1536 HydrophobicContact CE2-CE2 4.24Å; F1476-F1536 HydrophobicContact CE2-CZ 4.43Å; F1476-F1536 AromaticContact CG-CE2 3.96Å; F1476-F1536 HydrophobicContact CG-CE2 3.96Å; F1476-F1536 AromaticContact CZ-CE2 3.78Å; F1476-F1536 HydrophobicContact CZ-CE2 3.78Å; F1476-F1536 AromaticContact CZ-CZ 3.62Å; F1476-F1536 HydrophobicContact CZ-CZ 3.62Å
1477K83Confident70.6Confident73 Ų7358 Ų5832%0.31730%0.304SS..Hα-helixtrans-64.8-41.1176.4-149.6179.7-171.7178.20111.3S1473 D1474 A1475 G1480 N1481 L1511 Y1512S1473-K1477 WeakPolarHBondContact O-CB 3.48Å; S1473-K1477 PolarHBondContact O-N 3.34Å; D1474-K1477 VanDerWaalsContact O-CB 3.3Å; D1474-K1477 WeakPolarHBondContact O-CB 3.49Å; D1474-K1477 PolarHBondContact O-N 2.86Å; D1474-K1477 VanDerWaalsContact O-N 3.11Å; A1475-K1477 VanDerWaalsContact C-N 3.29Å; A1475-K1477 PolarHBondContact O-N 2.95Å; K1477-G1480 PolarHBondContact O-N 3.43Å; K1477-N1481 VanDerWaalsContact O-CB 3.25Å; K1477-N1481 WeakPolarHBondContact O-CB 3.38Å; K1477-N1481 PolarHBondContact O-N 3.04Å; K1477-N1481 VanDerWaalsContact O-N 3.16Å; K1477-L1511 HydrophobicContact CG-CB 4.44Å; K1477-Y1512 HydrophobicContact CB-CD1 4.37Å; K1477-Y1512 HydrophobicContact CB-CE1 4.16Å; K1477-Y1512 HydrophobicContact CG-CE1 4.38Å
1478H79.7Confident68.7Low119 Ų11959.1 Ų59.155%0.55131%0.31SS*.Hα-helixtrans-63.8-44.3173.3-74.7-59.6000111.8D1474 A1475 G1480 N1481 Y1482 Y1532D1474-H1478 PolarHBondContact O-CD2 2.96Å; D1474-H1478 PolarHBondContact O-N 3.09Å; A1475-H1478 PolarHBondContact O-N 3.05Å; H1478-G1480 VanDerWaalsContact C-N 3.26Å; H1478-G1480 PolarHBondContact O-N 2.97Å; H1478-N1481 PolarHBondContact O-N 3.38Å; H1478-Y1482 PolarHBondContact O-N 3.19Å; H1478-Y1532 HydrophobicContact CB-CD1 4.31Å
1479L81.6Confident66.7Low1 Ų165.6 Ų65.61%0.00535%0.345CS..Hα-helixtrans-60.5-36.7177.1-153.199.8000112.4F1421 Y1452 A1475 F1476 Y1482 F1529 F1533 F1536F1421-L1479 HydrophobicContact CZ-CD2 4.46Å; Y1452-L1479 HydrophobicContact CE2-CD2 4.43Å; Y1452-L1479 VanDerWaalsContact OH-CD2 3.23Å; Y1452-L1479 WeakPolarHBondContact OH-CD2 3Å; A1475-L1479 PolarHBondContact O-N 3.42Å; A1475-L1479 VanDerWaalsContact O-N 3.07Å; F1476-L1479 PolarHBondContact O-N 2.98Å; L1479-Y1482 VanDerWaalsContact O-CD1 3.32Å; L1479-Y1482 WeakPolarHBondContact O-CD1 3.3Å; L1479-F1529 HydrophobicContact CD1-CE2 4.43Å; L1479-F1529 HydrophobicContact CD2-CE2 3.78Å; L1479-F1529 HydrophobicContact CD2-CZ 3.87Å; L1479-F1529 HydrophobicContact CG-CE2 3.77Å; L1479-F1529 HydrophobicContact CG-CZ 4.18Å; L1479-F1533 HydrophobicContact CD1-CB 4.24Å; L1479-F1533 HydrophobicContact CD1-CD2 4.17Å; L1479-F1536 HydrophobicContact CD1-CB 3.41Å; L1479-F1536 VanDerWaalsContact CD1-CB 3.41Å; L1479-F1536 HydrophobicContact CD1-CD1 4.26Å; L1479-F1536 HydrophobicContact CD1-CD2 4.32Å; L1479-F1536 HydrophobicContact CD1-CG 3.75Å
1480G77.8Confident64.3Low0 Ų069.5 Ų69.50%037%0.368CS..Hα-helixtrans-81.1-13.9-179.600000116.1F1476 K1477 H1478 Y1512 C1515F1476-G1480 PolarHBondContact O-N 3.27Å; K1477-G1480 PolarHBondContact O-N 3.43Å; H1478-G1480 VanDerWaalsContact C-N 3.26Å; H1478-G1480 PolarHBondContact O-N 2.97Å; G1480-Y1512 WeakPolarHBondContact CA-O 3.28Å; G1480-C1515 WeakPolarHBondContact O-CB 3.14Å; G1480-C1515 PolarHBondContact O-N 3.25Å
1481N75.8Confident61.8Low36 Ų3672.8 Ų72.819%0.19338%0.382CS..THydrogen-bonded Turntrans-124.328.1-171-130.411.1000112.9K1477 H1478 C1483 N1484 K1514 C1515K1477-N1481 VanDerWaalsContact O-CB 3.25Å; K1477-N1481 WeakPolarHBondContact O-CB 3.38Å; K1477-N1481 PolarHBondContact O-N 3.04Å; K1477-N1481 VanDerWaalsContact O-N 3.16Å; H1478-N1481 PolarHBondContact O-N 3.38Å; N1481-C1483 PolarHBondContact O-N 2.92Å; N1481-C1483 VanDerWaalsContact O-N 3.1Å; N1481-N1484 PolarHBondContact O-N 2.83Å; N1481-N1484 VanDerWaalsContact O-N 3.11Å; N1481-K1514 VanDerWaalsContact OD1-CB 3.31Å; N1481-K1514 WeakPolarHBondContact OD1-CB 3.03Å; N1481-K1514 WeakPolarHBondContact OD1-CD 3.35Å; N1481-C1515 VanDerWaalsContact C-SG 3.56Å; N1481-C1515 VanDerWaalsContact CA-SG 3.55Å
1482Y69.4Low59.4Low10 Ų1075 Ų754%0.03941%0.406CS..THydrogen-bonded Turntrans-59.2-21.5-174.562.5-85000114.9H1446 H1478 L1479 C1515 F1516 D1528 F1529 Y1532H1446-Y1482 PolarHBondContact NE2-OH 3.47Å; H1478-Y1482 PolarHBondContact O-N 3.19Å; L1479-Y1482 VanDerWaalsContact O-CD1 3.32Å; L1479-Y1482 WeakPolarHBondContact O-CD1 3.3Å; Y1482-C1515 HydrophobicContact CD1-CB 3.72Å; Y1482-C1515 HydrophobicContact CE1-CB 3.34Å; Y1482-C1515 HydrophobicContact CE2-CB 4.44Å; Y1482-C1515 HydrophobicContact CG-CB 4.4Å; Y1482-C1515 PolarHBondContact OH-O 3.42Å; Y1482-F1516 HydrophobicContact CD1-CE1 4.15Å; Y1482-F1516 HydrophobicContact CD1-CZ 4.24Å; Y1482-F1516 AromaticContact CE1-CD1 3.75Å; Y1482-F1516 HydrophobicContact CE1-CD1 3.75Å; Y1482-F1516 AromaticContact CE1-CE1 3.3Å; Y1482-F1516 HydrophobicContact CE1-CE1 3.3Å; Y1482-F1516 AromaticContact CE1-CZ 3.78Å; Y1482-F1516 HydrophobicContact CE1-CZ 3.78Å; Y1482-D1528 HydrophobicContact CD2-CB 4.24Å; Y1482-F1529 HydrophobicContact CD1-CD2 4.03Å; Y1482-F1529 HydrophobicContact CD2-CB 4.34Å; Y1482-F1529 HydrophobicContact CE1-CD2 4.14Å; Y1482-F1529 HydrophobicContact CE2-CB 4.42Å; Y1482-F1529 HydrophobicContact CG-CD2 4.46Å; Y1482-Y1532 VanDerWaalsContact CB-CD2 3.44Å
1483C60.7Low56.8Low67 Ų6781.6 Ų81.645%0.45344%0.441SS..THydrogen-bonded Turntrans-83-10.5178.6-58.10000114.3N1481 N1485 C1515N1481-C1483 PolarHBondContact O-N 2.92Å; N1481-C1483 VanDerWaalsContact O-N 3.1Å; C1483-N1485 PolarHBondContact O-N 3.06Å; C1483-C1515 HydrophobicContact CB-CB 4.23Å; C1483-C1515 WeakPolarHBondContact CB-SG 3.11Å; C1483-C1515 PolarHBondContact N-SG 2.98Å; C1483-C1515 VanDerWaalsContact N-SG 3.37Å
1484N50.8Low54Low64 Ų6486.5 Ų86.534%0.34247%0.47SS..  trans-102.363-162.8-14748.1000113.5N1481N1481-N1484 PolarHBondContact O-N 2.83Å; N1481-N1484 VanDerWaalsContact O-N 3.11Å
1485N42.9Very low51.6Low120 Ų12089 Ų8964%0.64248%0.482SS*.SBendtrans-114.81.9172.4-97.5-5.4000115C1483 Y1532C1483-N1485 PolarHBondContact O-N 3.06Å; N1485-Y1532 PolarHBondContact ND2-OH 2.9Å; N1485-Y1532 VanDerWaalsContact ND2-OH 3.11Å
1486N39.5Very low49Very low95 Ų9598 Ų9851%0.50852%0.522SS..SBendtrans-117.32.7-169.5-82.6-14.6000118.3
1487N33.3Very low46.2Very low136 Ų136101.6 Ų101.673%0.72755%0.548SS*.SBendtrans-131.50.4-172.9-84.8-19.3000119.6N1489N1487-N1489 PolarHBondContact O-N 3.38Å
1488D32.3Very low43.5Very low137 Ų137105.7 Ų105.773%0.73357%0.573SS**THydrogen-bonded Turntrans-91.719.9-171.6-74-14.5000116.2
1489N30.2Very low41Very low158 Ų158109.4 Ų109.485%0.84559%0.591SS**THydrogen-bonded Turntrans-113.86.6178.1-93-12.5000117N1487N1487-N1489 PolarHBondContact O-N 3.38Å
1490N28Very low38.3Very low145 Ų145117.8 Ų117.878%0.77563%0.63SS**SBendtrans-14091.3172.6-76.5-32.5000110
1491N27Very low36Very low153 Ų153126 Ų12682%0.81867%0.673SS**  trans164.965144.5-80.1-14.7000110.9D1493N1491-D1493 PolarHBondContact O-N 3.23Å
1492T26.7Very low33.9Very low132 Ų132131.8 Ų131.881%0.8170%0.702SS**  trans-8193.8144.847.60000106.1
1493D25.1Very low31.9Very low145 Ų145140 Ų14078%0.77574%0.738SS**SBendtrans151.681.4158.3-78.6-17.6000108.8N1491N1491-D1493 PolarHBondContact O-N 3.23Å
1494T25.3Very low30.4Very low129 Ų129144.7 Ų144.779%0.79176%0.758SS**  trans171.4134.1136.128.10000110.9
1495I28.8Very low29.4Very low139 Ų139149 Ų14971%0.71378%0.776SS**  trans125.476.5154.6-58.4158.5000112.7S1497I1495-S1497 WeakPolarHBondContact CG2-O 3.28Å
1496Q26.2Very low29.1Very low198 Ų198150.1 Ų150.193%0.92579%0.788SS**  -79.492.9129.9-76.7179.8-13.500107.3
1497S25.7Very low29.3Very low77 Ų77151.8 Ų151.854%0.53880%0.795SS.*  trans171.399.5158.325.40000108.1I1495I1495-S1497 WeakPolarHBondContact CG2-O 3.28Å
1498D26.6Very low30Very low159 Ų159152.8 Ų152.885%0.8580%0.796SS**  trans15967.7141.8-78.2-11.9000109.9Q1500D1498-Q1500 VanDerWaalsContact C-N 3.29Å; D1498-Q1500 PolarHBondContact O-N 3.36Å
1499Q27.5Very low31Very low197 Ų197153.7 Ų153.792%0.92180%0.801SS**  trans-84.575.6151.5-77.3-176.4-15.800108.1
1500Q26Very low32.7Very low176 Ų176148 Ų14882%0.82277%0.77SS**  trans-173.678.8161.1-109169.625.400110.9D1498D1498-Q1500 VanDerWaalsContact C-N 3.29Å; D1498-Q1500 PolarHBondContact O-N 3.36Å
1501L29.2Very low34.8Very low174 Ų174145 Ų14591%0.91175%0.754SS**  trans-164.675.2150.3-104.3153.4000108.7
1502I30.2Very low37.3Very low157 Ų157138.9 Ų138.981%0.80572%0.719SS**  trans-85.3103.8171.1-67.2163.8000106.5
1503K27.9Very low39.8Very low183 Ų183133.9 Ų133.980%0.79669%0.687SS**SBendtrans177.8-9.4130.4-98.6166.7-176.5-173.10120.9
1504D28.6Very low42.2Very low164 Ų164133.3 Ų133.388%0.87768%0.678SS**SBendtrans-120.135-172.7-71.4-20.7000116.5
1505Q31Very low44.5Very low154 Ų154127.8 Ų127.872%0.7265%0.645SS**  trans-122.971.3-176.9-75.3-174.1-17.300114.7
1506T36.6Very low46.9Very low144 Ų144121.8 Ų121.888%0.88361%0.613SS**SBendtrans-108.3-2.8166.942.50000114.5
1507I44.1Very low49.2Very low130 Ų130116.6 Ų116.667%0.66759%0.592SS**SBendtrans-112.8-16.2-174.2-58.9174.4000113.4
1508Q46.3Very low51.2Low158 Ų158117 Ų11774%0.73859%0.585SS**THydrogen-bonded Turntrans-92.1-0.5-170.1-91.9-176.7-19.300117.8
1509N54.2Low53.4Low156 Ų156113.3 Ų113.383%0.83457%0.565SS**THydrogen-bonded Turntrans-118.128.9-174.4-91.5-8000114.9L1511N1509-L1511 PolarHBondContact O-N 3.02Å
1510N66Low55.8Low39 Ų39107.5 Ų107.521%0.20954%0.537CS..  trans-88102.4176.3-155-14.1000110.2S1453 Y1457 Y1512 I1513S1453-N1510 WeakPolarHBondContact CB-ND2 3.43Å; S1453-N1510 PolarHBondContact OG-ND2 3.39Å; Y1457-N1510 PolarHBondContact OH-OD1 2.93Å; N1510-Y1512 PolarHBondContact O-N 3.28Å; N1510-I1513 HydrophobicContact CB-CD1 3.74Å; N1510-I1513 HydrophobicContact CB-CG1 3.82Å; N1510-I1513 PolarHBondContact O-N 2.96Å; N1510-I1513 VanDerWaalsContact O-N 3.1Å
1511L73Confident58.2Low82 Ų8299.8 Ų99.843%0.42950%0.502SS..THydrogen-bonded Turntrans-57.3-22.6-171.1-82.2153.4000114.2K1477 N1509K1477-L1511 HydrophobicContact CG-CB 4.44Å; N1509-L1511 PolarHBondContact O-N 3.02Å
1512Y79.3Confident60.7Low23 Ų2395.3 Ų95.39%0.0948%0.482CS..THydrogen-bonded Turntrans-84.6-10.4-178.1-52.9-70.8000114.1Y1452 V1456 Y1457 I1460 S1473 F1476 K1477 G1480 N1510Y1452-Y1512 WeakPolarHBondContact CE1-O 3.3Å; V1456-Y1512 HydrophobicContact CG1-CD1 3.92Å; V1456-Y1512 HydrophobicContact CG1-CD2 4.19Å; V1456-Y1512 HydrophobicContact CG1-CE1 4.07Å; V1456-Y1512 HydrophobicContact CG1-CE2 4.35Å; V1456-Y1512 HydrophobicContact CG1-CG 3.98Å; Y1457-Y1512 AromaticContact CE1-CE2 3.93Å; Y1457-Y1512 HydrophobicContact CE1-CE2 3.93Å; Y1457-Y1512 HydrophobicContact CE2-CD2 4.39Å; Y1457-Y1512 HydrophobicContact CE2-CE2 4.43Å; Y1457-Y1512 AromaticContact CZ-CE2 3.79Å; I1460-Y1512 HydrophobicContact CD1-CE1 4.48Å; S1473-Y1512 PolarHBondContact OG-OH 2.63Å; F1476-Y1512 HydrophobicContact CB-CD1 4.02Å; F1476-Y1512 HydrophobicContact CB-CE1 4.19Å; K1477-Y1512 HydrophobicContact CB-CD1 4.37Å; K1477-Y1512 HydrophobicContact CB-CE1 4.16Å; K1477-Y1512 HydrophobicContact CG-CE1 4.38Å; G1480-Y1512 WeakPolarHBondContact CA-O 3.28Å; N1510-Y1512 PolarHBondContact O-N 3.28Å
1513I79.4Confident62.6Low27 Ų2799 Ų9914%0.13849%0.486CS..SBendtrans-122.49.3-172-0.3167.2000114.2P1449 Y1452 N1510 C1515 F1516P1449-I1513 HydrophobicContact CB-CG2 3.44Å; P1449-I1513 VanDerWaalsContact CB-CG2 3.44Å; P1449-I1513 WeakPolarHBondContact O-CG2 3.32Å; Y1452-I1513 HydrophobicContact CD1-CG2 4.42Å; N1510-I1513 HydrophobicContact CB-CD1 3.74Å; N1510-I1513 HydrophobicContact CB-CG1 3.82Å; N1510-I1513 PolarHBondContact O-N 2.96Å; N1510-I1513 VanDerWaalsContact O-N 3.1Å; I1513-C1515 VanDerWaalsContact C-N 3.28Å; I1513-C1515 PolarHBondContact O-N 3.22Å; I1513-F1516 HydrophobicContact CG2-CB 4.28Å; I1513-F1516 HydrophobicContact CG2-CD2 3.76Å; I1513-F1516 PolarHBondContact O-N 2.86Å
1514K74.4Confident64.8Low134 Ų13493.8 Ų93.858%0.58347%0.473SS*.THydrogen-bonded Turntrans-61.4-33.2-167.8-141-176.9-175.8-173.20113.8N1481N1481-K1514 VanDerWaalsContact OD1-CB 3.31Å; N1481-K1514 WeakPolarHBondContact OD1-CB 3.03Å; N1481-K1514 WeakPolarHBondContact OD1-CD 3.35Å
1515C74.8Confident67.2Low13 Ų1387.3 Ų87.39%0.08844%0.439CS..THydrogen-bonded Turntrans-94.8-11-177.4-64.50000114G1480 N1481 Y1482 C1483 I1513G1480-C1515 WeakPolarHBondContact O-CB 3.14Å; G1480-C1515 PolarHBondContact O-N 3.25Å; N1481-C1515 VanDerWaalsContact C-SG 3.56Å; N1481-C1515 VanDerWaalsContact CA-SG 3.55Å; Y1482-C1515 HydrophobicContact CD1-CB 3.72Å; Y1482-C1515 HydrophobicContact CE1-CB 3.34Å; Y1482-C1515 HydrophobicContact CE2-CB 4.44Å; Y1482-C1515 HydrophobicContact CG-CB 4.4Å; Y1482-C1515 PolarHBondContact OH-O 3.42Å; C1483-C1515 HydrophobicContact CB-CB 4.23Å; C1483-C1515 WeakPolarHBondContact CB-SG 3.11Å; C1483-C1515 PolarHBondContact N-SG 2.98Å; C1483-C1515 VanDerWaalsContact N-SG 3.37Å; I1513-C1515 VanDerWaalsContact C-N 3.28Å; I1513-C1515 PolarHBondContact O-N 3.22Å
1516F77.4Confident69.5Low13 Ų1382.4 Ų82.46%0.05741%0.414CS..  trans-93.5124.9-179.3-51-66.7000110.1L1442 I1445 H1446 Y1452 Y1482 I1513 F1529L1442-F1516 HydrophobicContact CD1-CD1 4.06Å; L1442-F1516 HydrophobicContact CD1-CE1 3.7Å; I1445-F1516 HydrophobicContact CB-CD1 4.49Å; I1445-F1516 HydrophobicContact CB-CE1 4.49Å; I1445-F1516 HydrophobicContact CD1-CZ 4.38Å; I1445-F1516 HydrophobicContact CG2-CB 4.19Å; I1445-F1516 HydrophobicContact CG2-CD1 3.72Å; I1445-F1516 HydrophobicContact CG2-CD2 3.49Å; I1445-F1516 VanDerWaalsContact CG2-CD2 3.49Å; I1445-F1516 HydrophobicContact CG2-CE1 3.87Å; I1445-F1516 HydrophobicContact CG2-CE2 3.67Å; I1445-F1516 HydrophobicContact CG2-CG 3.54Å; I1445-F1516 HydrophobicContact CG2-CZ 3.88Å; H1446-F1516 AromaticContact CD2-CD1 3.7Å; H1446-F1516 AromaticContact NE2-CD1 3.61Å; Y1452-F1516 HydrophobicContact CD1-CE2 4.19Å; Y1452-F1516 AromaticContact CE1-CE2 3.88Å; Y1452-F1516 HydrophobicContact CE1-CE2 3.88Å; Y1482-F1516 HydrophobicContact CD1-CE1 4.15Å; Y1482-F1516 HydrophobicContact CD1-CZ 4.24Å; Y1482-F1516 AromaticContact CE1-CD1 3.75Å; Y1482-F1516 HydrophobicContact CE1-CD1 3.75Å; Y1482-F1516 AromaticContact CE1-CE1 3.3Å; Y1482-F1516 HydrophobicContact CE1-CE1 3.3Å; Y1482-F1516 AromaticContact CE1-CZ 3.78Å; Y1482-F1516 HydrophobicContact CE1-CZ 3.78Å; I1513-F1516 HydrophobicContact CG2-CB 4.28Å; I1513-F1516 HydrophobicContact CG2-CD2 3.76Å; I1513-F1516 PolarHBondContact O-N 2.86Å; F1516-F1529 HydrophobicContact CE1-CD2 4.04Å; F1516-F1529 AromaticContact CE1-CE2 3.87Å; F1516-F1529 HydrophobicContact CE1-CE2 3.87Å; F1516-F1529 HydrophobicContact CZ-CD2 4.27Å; F1516-F1529 AromaticContact CZ-CE2 3.82Å; F1516-F1529 HydrophobicContact CZ-CE2 3.82Å
1517N75.4Confident71.3Confident88 Ų8879.1 Ų79.147%0.47140%0.397SS..  trans-140.2169.6-175.239.918000110.2H1446 N1519H1446-N1517 PolarHBondContact CE1-O 2.8Å; H1446-N1517 PolarHBondContact CE1-OD1 3.01Å; H1446-N1517 PolarHBondContact ND1-O 2.85Å; N1517-N1519 PolarHBondContact O-N 3.18Å
1518E68.4Low72.8Confident87 Ų8776.3 Ų76.341%0.40738%0.383SS..SBendtrans-72.84.3-170.8-58.6-167.2144.500115.1R1389R1389-E1518 IonicContact CZ-OE1 3.1Å; R1389-E1518 VanDerWaalsContact CZ-OE1 3.32Å; R1389-E1518 IonicContact NE-OE1 3.86Å; R1389-E1518 PolarHBondContact NE-OE1 2.82Å; R1389-E1518 IonicContact NE-OE2 3.28Å; R1389-E1518 IonicContact NH2-OE1 3.23Å; R1389-E1518 PolarHBondContact NH2-OE1 3.37Å
1519N72.7Confident74.6Confident80 Ų8068.9 Ų68.943%0.42835%0.348SS..SBendtrans-90.6149-177.6-65.1-21.5000111.5H1446 N1517H1446-N1519 PolarHBondContact ND1-O 3.12Å; N1517-N1519 PolarHBondContact O-N 3.18Å
1520K77.7Confident75.8Confident76 Ų7664 Ų6433%0.3332%0.321SS..PPolyproline II helixtrans-59.2128.7171.9-174.2175.8-176.31720110.3D1383 L1386 E1387D1383-K1520 VanDerWaalsContact CG-CE 3.49Å; L1386-K1520 HydrophobicContact CB-CB 4.09Å; E1387-K1520 HydrophobicContact CB-CD 4.36Å; E1387-K1520 IonicContact OE2-NZ 3.29Å; E1387-K1520 PolarHBondContact OE2-NZ 3.03Å
1521P76.6Confident76.3Confident13 Ų1365.9 Ų65.98%0.08433%0.328CS..PPolyproline II helixtrans-65.4137.7179.124.1-31.2000111L1442 N1443 T1525 R1526L1442-P1521 HydrophobicContact CD2-CB 3.73Å; L1442-P1521 HydrophobicContact CD2-CG 3.89Å; L1442-P1521 HydrophobicContact CG-CB 4.38Å; L1442-P1521 HydrophobicContact CG-CG 4.26Å; N1443-P1521 WeakPolarHBondContact OD1-CG 3.34Å; P1521-T1525 WeakPolarHBondContact CA-OG1 3.49Å; P1521-T1525 WeakPolarHBondContact CB-OG1 3.36Å; P1521-R1526 HydrophobicContact CB-CG 4.44Å
1522T80.2Confident76.5Confident81 Ų8164 Ų6450%0.49732%0.316SS..PPolyproline II helixtrans-76164.7172.865.20000110.9S1524 T1525 R1526T1522-S1524 PolarHBondContact O-N 3.01Å; T1522-S1524 PolarHBondContact OG1-OG 3.46Å; T1522-S1524 VanDerWaalsContact OG1-OG 3.11Å; T1522-T1525 PolarHBondContact N-OG1 3.39Å; T1522-T1525 PolarHBondContact O-N 3.35Å; T1522-T1525 VanDerWaalsContact O-N 3.13Å; T1522-T1525 PolarHBondContact O-OG1 3.34Å; T1522-T1525 PolarHBondContact OG1-N 3.49Å; T1522-T1525 PolarHBondContact OG1-OG1 2.98Å; T1522-R1526 PolarHBondContact O-N 3.02Å
1523R71.8Confident76.6Confident234 Ų23462.9 Ų62.988%0.88331%0.311SS*.Hα-helixtrans-57.2-35176.9-145.5-179.6-170.3-177.43.5112.7S1527R1523-S1527 PolarHBondContact O-N 2.99Å
1524S73.8Confident76.2Confident74 Ų7464.6 Ų64.652%0.51732%0.319SS..Hα-helixtrans-68.2-47.8175.4700000111.3T1522 R1526 S1527 D1528T1522-S1524 PolarHBondContact O-N 3.01Å; T1522-S1524 PolarHBondContact OG1-OG 3.46Å; T1522-S1524 VanDerWaalsContact OG1-OG 3.11Å; S1524-R1526 VanDerWaalsContact C-N 3.25Å; S1524-R1526 PolarHBondContact O-N 3.18Å; S1524-S1527 WeakPolarHBondContact O-CB 3.34Å; S1524-S1527 PolarHBondContact O-N 3.08Å; S1524-D1528 PolarHBondContact O-N 3.32Å
1525T78.7Confident76.1Confident28 Ų2861.9 Ų61.917%0.17231%0.31CS..Hα-helixtrans-61.9-33.1179.551.40000112.8P1521 T1522 F1529P1521-T1525 WeakPolarHBondContact CA-OG1 3.49Å; P1521-T1525 WeakPolarHBondContact CB-OG1 3.36Å; T1522-T1525 PolarHBondContact N-OG1 3.39Å; T1522-T1525 PolarHBondContact O-N 3.35Å; T1522-T1525 VanDerWaalsContact O-N 3.13Å; T1522-T1525 PolarHBondContact O-OG1 3.34Å; T1522-T1525 PolarHBondContact OG1-N 3.49Å; T1522-T1525 PolarHBondContact OG1-OG1 2.98Å; T1525-F1529 WeakPolarHBondContact O-CB 3.45Å; T1525-F1529 PolarHBondContact O-N 3.1Å
1526R79.9Confident76.3Confident51 Ų5161.4 Ų61.419%0.19231%0.306CS..Hα-helixtrans-62.6-47171.9-84.8-174.6171.5154.87.4112.1D1383 L1442 N1443 P1521 T1522 S1524 D1528 F1529 Q1530D1383-R1526 IonicContact OD1-CZ 3.42Å; D1383-R1526 IonicContact OD1-NH2 3.69Å; D1383-R1526 PolarHBondContact OD1-NH2 2.99Å; D1383-R1526 IonicContact OD2-CZ 2.87Å; D1383-R1526 IonicContact OD2-NH1 3.12Å; D1383-R1526 PolarHBondContact OD2-NH1 3.23Å; D1383-R1526 VanDerWaalsContact OD2-NH1 3.16Å; D1383-R1526 IonicContact OD2-NH2 3.87Å; D1383-R1526 PolarHBondContact OD2-NH2 3.41Å; L1442-R1526 HydrophobicContact CD2-CB 4.46Å; L1442-R1526 HydrophobicContact CD2-CG 3.7Å; N1443-R1526 PolarHBondContact ND2-NH2 3.41Å; N1443-R1526 VanDerWaalsContact ND2-NH2 3.13Å; N1443-R1526 PolarHBondContact OD1-NH2 2.96Å; P1521-R1526 HydrophobicContact CB-CG 4.44Å; T1522-R1526 PolarHBondContact O-N 3.02Å; S1524-R1526 VanDerWaalsContact C-N 3.25Å; S1524-R1526 PolarHBondContact O-N 3.18Å; R1526-D1528 VanDerWaalsContact C-N 3.35Å; R1526-F1529 PolarHBondContact O-N 3.27Å; R1526-Q1530 VanDerWaalsContact O-CB 3.28Å; R1526-Q1530 WeakPolarHBondContact O-CB 3.46Å; R1526-Q1530 PolarHBondContact O-N 2.88Å
1527S72.5Confident76.1Confident74 Ų7460.9 Ų60.952%0.51730%0.304SS..Hα-helixtrans-62.7-42.4178.2-170.40000111.9R1523 S1524 Q1530 H1531R1523-S1527 PolarHBondContact O-N 2.99Å; S1524-S1527 WeakPolarHBondContact O-CB 3.34Å; S1524-S1527 PolarHBondContact O-N 3.08Å; S1527-Q1530 PolarHBondContact O-N 3.5Å; S1527-H1531 PolarHBondContact O-N 3.08Å; S1527-H1531 VanDerWaalsContact O-N 3.11Å
1528D76.9Confident75.6Confident72 Ų7257.9 Ų57.939%0.38529%0.289SS..Hα-helixtrans-64.8-50.2178.9-63.7-28.2000110.3Y1482 S1524 R1526 Q1530 H1531 Y1532Y1482-D1528 HydrophobicContact CD2-CB 4.24Å; S1524-D1528 PolarHBondContact O-N 3.32Å; R1526-D1528 VanDerWaalsContact C-N 3.35Å; D1528-Q1530 VanDerWaalsContact C-N 3.32Å; D1528-Q1530 PolarHBondContact O-N 2.97Å; D1528-H1531 WeakPolarHBondContact O-CB 3.43Å; D1528-H1531 PolarHBondContact O-N 2.77Å; D1528-Y1532 VanDerWaalsContact O-CD2 3.25Å; D1528-Y1532 WeakPolarHBondContact O-CD2 3.35Å; D1528-Y1532 PolarHBondContact O-N 2.99Å
1529F83.3Confident75.6Confident1 Ų156.4 Ų56.40%0.00428%0.282CS..Hα-helixtrans-58.9-43.4177-179.9-96.4000112S1438 L1442 I1445 L1479 Y1482 F1516 T1525 R1526 H1531 Y1532 F1533S1438-F1529 WeakPolarHBondContact O-CE1 3.43Å; L1442-F1529 HydrophobicContact CB-CD1 3.81Å; L1442-F1529 HydrophobicContact CB-CE1 3.91Å; L1442-F1529 HydrophobicContact CB-CG 4.3Å; L1442-F1529 HydrophobicContact CB-CZ 4.47Å; L1442-F1529 HydrophobicContact CD1-CB 4.09Å; L1442-F1529 HydrophobicContact CD1-CD1 4.11Å; L1442-F1529 HydrophobicContact CD1-CD2 3.79Å; L1442-F1529 HydrophobicContact CD1-CE2 4.22Å; L1442-F1529 HydrophobicContact CD1-CG 3.72Å; L1442-F1529 HydrophobicContact CD2-CB 4.2Å; L1442-F1529 HydrophobicContact CD2-CD1 4.44Å; L1442-F1529 HydrophobicContact CD2-CG 4.39Å; L1442-F1529 HydrophobicContact CG-CD1 4.34Å; L1442-F1529 HydrophobicContact CG-CG 4.35Å; I1445-F1529 HydrophobicContact CD1-CE2 4.43Å; I1445-F1529 HydrophobicContact CD1-CZ 4.07Å; L1479-F1529 HydrophobicContact CD1-CE2 4.43Å; L1479-F1529 HydrophobicContact CD2-CE2 3.78Å; L1479-F1529 HydrophobicContact CD2-CZ 3.87Å; L1479-F1529 HydrophobicContact CG-CE2 3.77Å; L1479-F1529 HydrophobicContact CG-CZ 4.18Å; Y1482-F1529 HydrophobicContact CD1-CD2 4.03Å; Y1482-F1529 HydrophobicContact CD2-CB 4.34Å; Y1482-F1529 HydrophobicContact CE1-CD2 4.14Å; Y1482-F1529 HydrophobicContact CE2-CB 4.42Å; Y1482-F1529 HydrophobicContact CG-CD2 4.46Å; F1516-F1529 HydrophobicContact CE1-CD2 4.04Å; F1516-F1529 AromaticContact CE1-CE2 3.87Å; F1516-F1529 HydrophobicContact CE1-CE2 3.87Å; F1516-F1529 HydrophobicContact CZ-CD2 4.27Å; F1516-F1529 AromaticContact CZ-CE2 3.82Å; F1516-F1529 HydrophobicContact CZ-CE2 3.82Å; T1525-F1529 WeakPolarHBondContact O-CB 3.45Å; T1525-F1529 PolarHBondContact O-N 3.1Å; R1526-F1529 PolarHBondContact O-N 3.27Å; F1529-H1531 VanDerWaalsContact C-N 3.29Å; F1529-H1531 PolarHBondContact O-N 3.04Å; F1529-Y1532 PolarHBondContact O-N 3Å; F1529-F1533 HydrophobicContact CD1-CB 4.45Å; F1529-F1533 HydrophobicContact CE1-CB 4.24Å; F1529-F1533 HydrophobicContact CE1-CD2 4.31Å; F1529-F1533 HydrophobicContact CE1-CG 4.49Å; F1529-F1533 HydrophobicContact CZ-CD2 4.48Å; F1529-F1533 VanDerWaalsContact O-CB 3.27Å; F1529-F1533 WeakPolarHBondContact O-CB 3.2Å; F1529-F1533 PolarHBondContact O-N 2.86Å
1530Q80.2Confident75.5Confident55 Ų5553.1 Ų53.126%0.25726%0.264SS..Hα-helixtrans-58.6-41.6177.8-177.1178-7.300111.7S1438 R1526 S1527 D1528 F1533 H1534S1438-Q1530 WeakPolarHBondContact OG-CG 3.44Å; R1526-Q1530 VanDerWaalsContact O-CB 3.28Å; R1526-Q1530 WeakPolarHBondContact O-CB 3.46Å; R1526-Q1530 PolarHBondContact O-N 2.88Å; S1527-Q1530 PolarHBondContact O-N 3.5Å; D1528-Q1530 VanDerWaalsContact C-N 3.32Å; D1528-Q1530 PolarHBondContact O-N 2.97Å; Q1530-F1533 WeakPolarHBondContact O-CB 3.21Å; Q1530-F1533 PolarHBondContact O-N 2.95Å; Q1530-H1534 PolarHBondContact O-CD2 3.46Å; Q1530-H1534 PolarHBondContact O-N 2.89Å
1531H75.3Confident74.8Confident77 Ų7752.1 Ų52.136%0.35626%0.258SS..Hα-helixtrans-60.4-48.5176.2-176.275.7000112.1S1527 D1528 F1529 F1533 H1534 L1535S1527-H1531 PolarHBondContact O-N 3.08Å; S1527-H1531 VanDerWaalsContact O-N 3.11Å; D1528-H1531 WeakPolarHBondContact O-CB 3.43Å; D1528-H1531 PolarHBondContact O-N 2.77Å; F1529-H1531 VanDerWaalsContact C-N 3.29Å; F1529-H1531 PolarHBondContact O-N 3.04Å; H1531-F1533 VanDerWaalsContact C-N 3.28Å; H1531-F1533 PolarHBondContact O-N 3.39Å; H1531-H1534 PolarHBondContact O-N 3.32Å; H1531-L1535 PolarHBondContact O-N 2.79Å
1532Y78Confident74.1Confident43 Ų4352.2 Ų52.217%0.16926%0.259CS..Hα-helixtrans-67-29.9176.1-74.9-76.6000112.8H1478 Y1482 N1485 D1528 F1529 L1535 F1536H1478-Y1532 HydrophobicContact CB-CD1 4.31Å; Y1482-Y1532 VanDerWaalsContact CB-CD2 3.44Å; N1485-Y1532 PolarHBondContact ND2-OH 2.9Å; N1485-Y1532 VanDerWaalsContact ND2-OH 3.11Å; D1528-Y1532 VanDerWaalsContact O-CD2 3.25Å; D1528-Y1532 WeakPolarHBondContact O-CD2 3.35Å; D1528-Y1532 PolarHBondContact O-N 2.99Å; F1529-Y1532 PolarHBondContact O-N 3Å; Y1532-L1535 HydrophobicContact CD1-CD1 4.34Å; Y1532-L1535 WeakPolarHBondContact O-CB 3.36Å; Y1532-L1535 PolarHBondContact O-N 3.25Å; Y1532-F1536 WeakPolarHBondContact O-CB 3.48Å; Y1532-F1536 PolarHBondContact O-N 3.29Å
1533F80.8Confident73.3Confident0 Ų049.2 Ų49.20%024%0.24CC..Hα-helixtrans-65.3-43.5174.8-178.1-101.2000112L1424 F1437 L1441 L1479 F1529 Q1530 H1531 L1535 F1536 V1537L1424-F1533 HydrophobicContact CD1-CE2 3.62Å; L1424-F1533 HydrophobicContact CD1-CZ 3.6Å; L1424-F1533 HydrophobicContact CD2-CE1 4.36Å; L1424-F1533 HydrophobicContact CD2-CE2 4.5Å; L1424-F1533 HydrophobicContact CD2-CZ 3.63Å; L1424-F1533 HydrophobicContact CG-CZ 4.25Å; F1437-F1533 HydrophobicContact CB-CE1 4.47Å; L1441-F1533 HydrophobicContact CD1-CD2 4.39Å; L1441-F1533 HydrophobicContact CD1-CE2 3.43Å; L1441-F1533 VanDerWaalsContact CD1-CE2 3.43Å; L1441-F1533 HydrophobicContact CD1-CZ 3.76Å; L1479-F1533 HydrophobicContact CD1-CB 4.24Å; L1479-F1533 HydrophobicContact CD1-CD2 4.17Å; F1529-F1533 HydrophobicContact CD1-CB 4.45Å; F1529-F1533 HydrophobicContact CE1-CB 4.24Å; F1529-F1533 HydrophobicContact CE1-CD2 4.31Å; F1529-F1533 HydrophobicContact CE1-CG 4.49Å; F1529-F1533 HydrophobicContact CZ-CD2 4.48Å; F1529-F1533 VanDerWaalsContact O-CB 3.27Å; F1529-F1533 WeakPolarHBondContact O-CB 3.2Å; F1529-F1533 PolarHBondContact O-N 2.86Å; Q1530-F1533 WeakPolarHBondContact O-CB 3.21Å; Q1530-F1533 PolarHBondContact O-N 2.95Å; H1531-F1533 VanDerWaalsContact C-N 3.28Å; H1531-F1533 PolarHBondContact O-N 3.39Å; F1533-L1535 VanDerWaalsContact C-N 3.31Å; F1533-L1535 PolarHBondContact O-N 3.29Å; F1533-F1536 WeakPolarHBondContact O-CB 3.49Å; F1533-F1536 PolarHBondContact O-N 3.16Å; F1533-F1536 VanDerWaalsContact O-N 3.12Å; F1533-V1537 HydrophobicContact CD1-CG2 4.08Å; F1533-V1537 HydrophobicContact CE1-CG2 3.67Å; F1533-V1537 HydrophobicContact CE2-CG2 4.16Å; F1533-V1537 HydrophobicContact CZ-CG2 3.72Å; F1533-V1537 WeakPolarHBondContact O-CG2 3.09Å; F1533-V1537 PolarHBondContact O-N 2.53Å
1534H72Confident72.5Confident63 Ų6340.9 Ų40.929%0.29221%0.212SC..Hα-helixtrans-59.2-41.7173.1-74.2-72.1000112.2E1434 Q1530 H1531 F1536 V1537 T1538E1434-H1534 IonicContact OE2-CE1 2.73Å; E1434-H1534 PolarHBondContact OE2-CE1 3.31Å; E1434-H1534 IonicContact OE2-ND1 3.21Å; E1434-H1534 PolarHBondContact OE2-ND1 2.78Å; Q1530-H1534 PolarHBondContact O-CD2 3.46Å; Q1530-H1534 PolarHBondContact O-N 2.89Å; H1531-H1534 PolarHBondContact O-N 3.32Å; H1534-F1536 VanDerWaalsContact C-N 3.33Å; H1534-F1536 PolarHBondContact O-N 3.07Å; H1534-V1537 PolarHBondContact O-N 2.88Å; H1534-T1538 WeakPolarHBondContact O-CG2 3.39Å; H1534-T1538 PolarHBondContact O-N 3.46Å; H1534-T1538 VanDerWaalsContact O-N 3.09Å; H1534-T1538 PolarHBondContact O-OG1 2.75Å
1535L72.1Confident71Confident76 Ų7639 Ų3940%0.39820%0.198SC..Hα-helixtrans-62.8-38.9174.5-74.7164.2000112.2H1531 Y1532 F1533 T1538 E1539H1531-L1535 PolarHBondContact O-N 2.79Å; Y1532-L1535 HydrophobicContact CD1-CD1 4.34Å; Y1532-L1535 WeakPolarHBondContact O-CB 3.36Å; Y1532-L1535 PolarHBondContact O-N 3.25Å; F1533-L1535 VanDerWaalsContact C-N 3.31Å; F1533-L1535 PolarHBondContact O-N 3.29Å; L1535-T1538 VanDerWaalsContact C-OG1 3.3Å; L1535-T1538 VanDerWaalsContact CA-OG1 3.29Å; L1535-T1538 WeakPolarHBondContact CA-OG1 3.28Å; L1535-T1538 PolarHBondContact O-OG1 3.44Å; L1535-E1539 PolarHBondContact O-N 2.81Å
1536F78.1Confident69Low4 Ų443 Ų432%0.01821%0.214CC..Hα-helixtrans-67.1-45.4176.4171.9-93.9000112.5F1421 L1424 A1475 F1476 L1479 Y1532 F1533 H1534 T1538 E1539 M1540F1421-F1536 HydrophobicContact CD1-CE1 4.17Å; F1421-F1536 HydrophobicContact CD1-CZ 4.46Å; F1421-F1536 AromaticContact CE1-CE1 3.79Å; F1421-F1536 HydrophobicContact CE1-CE1 3.79Å; F1421-F1536 HydrophobicContact CE1-CZ 4.13Å; L1424-F1536 HydrophobicContact CD1-CE1 4.33Å; A1475-F1536 HydrophobicContact CB-CD2 3.97Å; A1475-F1536 HydrophobicContact CB-CE2 4.41Å; F1476-F1536 HydrophobicContact CD1-CD2 4.25Å; F1476-F1536 AromaticContact CD1-CE2 3.45Å; F1476-F1536 HydrophobicContact CD1-CE2 3.45Å; F1476-F1536 VanDerWaalsContact CD1-CE2 3.45Å; F1476-F1536 AromaticContact CD1-CZ 3.94Å; F1476-F1536 HydrophobicContact CD1-CZ 3.94Å; F1476-F1536 HydrophobicContact CD2-CE2 4.31Å; F1476-F1536 HydrophobicContact CE1-CD2 4.44Å; F1476-F1536 HydrophobicContact CE1-CE1 4.4Å; F1476-F1536 AromaticContact CE1-CE2 3.35Å; F1476-F1536 HydrophobicContact CE1-CE2 3.35Å; F1476-F1536 AromaticContact CE1-CZ 3.32Å; F1476-F1536 HydrophobicContact CE1-CZ 3.32Å; F1476-F1536 HydrophobicContact CE2-CE2 4.24Å; F1476-F1536 HydrophobicContact CE2-CZ 4.43Å; F1476-F1536 AromaticContact CG-CE2 3.96Å; F1476-F1536 HydrophobicContact CG-CE2 3.96Å; F1476-F1536 AromaticContact CZ-CE2 3.78Å; F1476-F1536 HydrophobicContact CZ-CE2 3.78Å; F1476-F1536 AromaticContact CZ-CZ 3.62Å; F1476-F1536 HydrophobicContact CZ-CZ 3.62Å; L1479-F1536 HydrophobicContact CD1-CB 3.41Å; L1479-F1536 VanDerWaalsContact CD1-CB 3.41Å; L1479-F1536 HydrophobicContact CD1-CD1 4.26Å; L1479-F1536 HydrophobicContact CD1-CD2 4.32Å; L1479-F1536 HydrophobicContact CD1-CG 3.75Å; Y1532-F1536 WeakPolarHBondContact O-CB 3.48Å; Y1532-F1536 PolarHBondContact O-N 3.29Å; F1533-F1536 WeakPolarHBondContact O-CB 3.49Å; F1533-F1536 PolarHBondContact O-N 3.16Å; F1533-F1536 VanDerWaalsContact O-N 3.12Å; H1534-F1536 VanDerWaalsContact C-N 3.33Å; H1534-F1536 PolarHBondContact O-N 3.07Å; F1536-T1538 VanDerWaalsContact C-N 3.29Å; F1536-T1538 PolarHBondContact O-N 3.36Å; F1536-E1539 PolarHBondContact O-N 3.33Å; F1536-M1540 HydrophobicContact CD1-CG 4.31Å; F1536-M1540 HydrophobicContact CE1-CG 3.73Å; F1536-M1540 HydrophobicContact CE2-CG 3.96Å; F1536-M1540 HydrophobicContact CZ-CE 4.29Å; F1536-M1540 HydrophobicContact CZ-CG 3.53Å; F1536-M1540 HydrophobicContact CZ-SD 4.33Å; F1536-M1540 PolarHBondContact O-N 3.01Å
1537V73.7Confident66.9Low2 Ų247.1 Ų47.11%0.01227%0.272CS..Hα-helixtrans-60.3-42178.6169.70000110.9L1424 Y1429 F1533 H1534 M1540 R1541L1424-V1537 HydrophobicContact CD1-CG2 4.43Å; L1424-V1537 HydrophobicContact CD2-CG2 4.04Å; Y1429-V1537 HydrophobicContact CE1-CG1 3.99Å; Y1429-V1537 WeakPolarHBondContact OH-CG1 3.46Å; F1533-V1537 HydrophobicContact CD1-CG2 4.08Å; F1533-V1537 HydrophobicContact CE1-CG2 3.67Å; F1533-V1537 HydrophobicContact CE2-CG2 4.16Å; F1533-V1537 HydrophobicContact CZ-CG2 3.72Å; F1533-V1537 WeakPolarHBondContact O-CG2 3.09Å; F1533-V1537 PolarHBondContact O-N 2.53Å; H1534-V1537 PolarHBondContact O-N 2.88Å; V1537-M1540 PolarHBondContact O-N 2.81Å; V1537-R1541 HydrophobicContact CG1-CG 4.48Å; V1537-R1541 WeakPolarHBondContact O-CG 3.4Å; V1537-R1541 PolarHBondContact O-N 3.37Å
1538T64.7Low66.6Low24 Ų2445.8 Ų45.815%0.14726%0.259CS..Hα-helixtrans-64.8-41.9179.138.70000112.1N228 H1534 L1535 F1536 S1542N228-T1538 VanDerWaalsContact CA-CG2 3.5Å; N228-T1538 HydrophobicContact CB-CG2 3.79Å; N228-T1538 VanDerWaalsContact CG-CB 3.49Å; N228-T1538 PolarHBondContact ND2-O 3.46Å; N228-T1538 WeakPolarHBondContact OD1-CB 3.37Å; N228-T1538 VanDerWaalsContact OD1-CG2 3.22Å; N228-T1538 WeakPolarHBondContact OD1-CG2 3.3Å; H1534-T1538 WeakPolarHBondContact O-CG2 3.39Å; H1534-T1538 PolarHBondContact O-N 3.46Å; H1534-T1538 VanDerWaalsContact O-N 3.09Å; H1534-T1538 PolarHBondContact O-OG1 2.75Å; L1535-T1538 VanDerWaalsContact C-OG1 3.3Å; L1535-T1538 VanDerWaalsContact CA-OG1 3.29Å; L1535-T1538 WeakPolarHBondContact CA-OG1 3.28Å; L1535-T1538 PolarHBondContact O-OG1 3.44Å; F1536-T1538 VanDerWaalsContact C-N 3.29Å; F1536-T1538 PolarHBondContact O-N 3.36Å; T1538-S1542 PolarHBondContact O-N 3.29Å
1539E68.4Low66.1Low56 Ų5644.4 Ų44.426%0.26225%0.253SS..Hα-helixtrans-61.2-45.8170-86.9-68.5139.200112R1471 A1475 L1535 F1536 R1541 S1542 F1543R1471-E1539 IonicContact CZ-OE1 3.81Å; R1471-E1539 IonicContact CZ-OE2 3.65Å; R1471-E1539 VanDerWaalsContact CZ-OE2 3.29Å; R1471-E1539 IonicContact NE-OE2 2.78Å; R1471-E1539 PolarHBondContact NE-OE2 2.95Å; R1471-E1539 IonicContact NH2-OE1 2.78Å; R1471-E1539 PolarHBondContact NH2-OE1 2.96Å; R1471-E1539 IonicContact NH2-OE2 3.78Å; R1471-E1539 PolarHBondContact NH2-OE2 2.67Å; A1475-E1539 HydrophobicContact CB-CB 4.38Å; L1535-E1539 PolarHBondContact O-N 2.81Å; F1536-E1539 PolarHBondContact O-N 3.33Å; E1539-R1541 PolarHBondContact O-N 3.26Å; E1539-S1542 WeakPolarHBondContact O-CA 3.13Å; E1539-S1542 VanDerWaalsContact O-CB 3.3Å; E1539-S1542 WeakPolarHBondContact O-CB 3.29Å; E1539-S1542 PolarHBondContact O-N 3.14Å; E1539-S1542 PolarHBondContact O-OG 3.09Å; E1539-F1543 HydrophobicContact CB-CE2 4.36Å; E1539-F1543 VanDerWaalsContact O-CD2 3.28Å; E1539-F1543 WeakPolarHBondContact O-CD2 3.34Å; E1539-F1543 PolarHBondContact O-N 2.88Å; E1539-F1543 WeakPolarHBondContact OE2-CZ 3.49Å
1540M70.5Confident65.1Low11 Ų1146.8 Ų46.85%0.05427%0.267CS..Hα-helixtrans-62.1-40.5180-79.5-58.8-102.400113.7T1425 W1459 L1472 F1536 V1537 S1542 F1543 I1544T1425-M1540 HydrophobicContact CG2-CE 4.31Å; W1459-M1540 HydrophobicContact CE3-CE 3.33Å; W1459-M1540 HydrophobicContact CH2-CE 4.13Å; W1459-M1540 HydrophobicContact CZ3-CE 3.04Å; L1472-M1540 HydrophobicContact CD1-CE 4.3Å; L1472-M1540 HydrophobicContact CD1-SD 3.81Å; L1472-M1540 HydrophobicContact CG-SD 4.02Å; F1536-M1540 HydrophobicContact CD1-CG 4.31Å; F1536-M1540 HydrophobicContact CE1-CG 3.73Å; F1536-M1540 HydrophobicContact CE2-CG 3.96Å; F1536-M1540 HydrophobicContact CZ-CE 4.29Å; F1536-M1540 HydrophobicContact CZ-CG 3.53Å; F1536-M1540 HydrophobicContact CZ-SD 4.33Å; F1536-M1540 PolarHBondContact O-N 3.01Å; V1537-M1540 PolarHBondContact O-N 2.81Å; M1540-S1542 PolarHBondContact O-N 3.42Å; M1540-F1543 PolarHBondContact O-N 3.02Å; M1540-F1543 HydrophobicContact SD-CD2 3.85Å; M1540-I1544 PolarHBondContact O-N 3.49Å
1541R64.2Low64.2Low55 Ų5546.3 Ų46.321%0.20827%0.267CS..Hα-helixtrans-60.3-29.3173.4-76-177.9176.3179.90.2112.7Y1429 V1537 E1539 F1543Y1429-R1541 VanDerWaalsContact CD1-NH2 3.29Å; Y1429-R1541 PolarHBondContact O-NH2 3.17Å; V1537-R1541 HydrophobicContact CG1-CG 4.48Å; V1537-R1541 WeakPolarHBondContact O-CG 3.4Å; V1537-R1541 PolarHBondContact O-N 3.37Å; E1539-R1541 PolarHBondContact O-N 3.26Å; R1541-F1543 VanDerWaalsContact C-N 3.31Å; R1541-F1543 PolarHBondContact O-N 3.11Å
1542S61.2Low63.5Low15 Ų1544.4 Ų44.411%0.10526%0.262CS..Hα-helixtrans-69.2-27.817484.60000113.1R1471 T1538 E1539 M1540R1471-S1542 PolarHBondContact NH2-OG 3.13Å; T1538-S1542 PolarHBondContact O-N 3.29Å; E1539-S1542 WeakPolarHBondContact O-CA 3.13Å; E1539-S1542 VanDerWaalsContact O-CB 3.3Å; E1539-S1542 WeakPolarHBondContact O-CB 3.29Å; E1539-S1542 PolarHBondContact O-N 3.14Å; E1539-S1542 PolarHBondContact O-OG 3.09Å; M1540-S1542 PolarHBondContact O-N 3.42Å
1543F62.5Low62.6Low19 Ų1944.5 Ų44.58%0.08327%0.268CS..Hα-helixtrans-86.3-32.9-178.8-62-53.4000115I1468 R1471 L1472 E1539 M1540 R1541 C1545 F1546I1468-F1543 HydrophobicContact CB-CD1 4.13Å; I1468-F1543 HydrophobicContact CB-CE1 4.22Å; I1468-F1543 HydrophobicContact CD1-CD1 4.47Å; I1468-F1543 HydrophobicContact CG1-CD1 3.84Å; I1468-F1543 HydrophobicContact CG1-CE1 4.08Å; I1468-F1543 HydrophobicContact CG2-CB 4.46Å; I1468-F1543 HydrophobicContact CG2-CD1 3.5Å; I1468-F1543 HydrophobicContact CG2-CE1 3.85Å; I1468-F1543 HydrophobicContact CG2-CG 3.94Å; R1471-F1543 HydrophobicContact CB-CE1 4.1Å; R1471-F1543 HydrophobicContact CB-CZ 3.49Å; R1471-F1543 VanDerWaalsContact CB-CZ 3.49Å; R1471-F1543 HydrophobicContact CG-CZ 4.46Å; L1472-F1543 HydrophobicContact CB-CE2 4.19Å; L1472-F1543 HydrophobicContact CD1-CD2 3.86Å; L1472-F1543 HydrophobicContact CD1-CE2 4.23Å; L1472-F1543 HydrophobicContact CD1-CG 4.39Å; L1472-F1543 HydrophobicContact CG-CD2 4.35Å; L1472-F1543 HydrophobicContact CG-CE2 4.29Å; E1539-F1543 HydrophobicContact CB-CE2 4.36Å; E1539-F1543 VanDerWaalsContact O-CD2 3.28Å; E1539-F1543 WeakPolarHBondContact O-CD2 3.34Å; E1539-F1543 PolarHBondContact O-N 2.88Å; E1539-F1543 WeakPolarHBondContact OE2-CZ 3.49Å; M1540-F1543 PolarHBondContact O-N 3.02Å; M1540-F1543 HydrophobicContact SD-CD2 3.85Å; R1541-F1543 VanDerWaalsContact C-N 3.31Å; R1541-F1543 PolarHBondContact O-N 3.11Å; F1543-C1545 PolarHBondContact O-N 3.38Å; F1543-F1546 PolarHBondContact O-N 3.08Å
1544I56.4Low61.3Low58 Ų5847.6 Ų47.630%0.29729%0.287SS..G310 helixtrans-55.9-20.1177.6-62.4158000111.3T1425 M1540 F1546T1425-I1544 WeakPolarHBondContact O-CD1 3.26Å; M1540-I1544 PolarHBondContact O-N 3.49Å; I1544-F1546 VanDerWaalsContact C-N 3.33Å; I1544-F1546 PolarHBondContact O-N 2.7Å
1545C42.4Very low60.4Low35 Ų3546.5 Ų46.524%0.23629%0.286CS..G310 helixtrans-81.6-4.4177.3-640000115.4R70 F1543R70-C1545 WeakPolarHBondContact CD-SG 3.46Å; R70-C1545 HydrophobicContact CG-CB 4.33Å; F1543-C1545 PolarHBondContact O-N 3.38Å
1546F36.8Very low59.5Low112 Ų11244 Ų4449%0.49128%0.277SS..G310 helixtrans-93.4-1.1178.4-94.5-85.1000114.6I1468 F1543 I1544I1468-F1546 HydrophobicContact CD1-CB 3.65Å; I1468-F1546 HydrophobicContact CD1-CD1 4.12Å; I1468-F1546 HydrophobicContact CD1-CD2 4.15Å; I1468-F1546 HydrophobicContact CD1-CG 3.71Å; F1543-F1546 PolarHBondContact O-N 3.08Å; I1544-F1546 VanDerWaalsContact C-N 3.33Å; I1544-F1546 PolarHBondContact O-N 2.7Å
1547G34.8Very low57.8Low137 Ų13747.6 Ų47.6100%1.41230%0.301SS*.  trans114.70175.900000113.3

Retrieved 1,547 of 1,547 residues in 1352.3 ms (Link to these results)

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