A0A077ZA23_TRITR Loading...

1-phosphatidylinositol 4-kinase

AlphaFold DB , UniProt , Accession A0A077ZA23, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,887 aa.

>A0A077ZA23_TRITR|A0A077ZA23
MAVFDTLYSACTSFIGQNFVSLDTKIEIIRSLFLLLGFFRCFGRGCLADHLGLIRRMFPKTSAHEPLESKDSAVPTEAIIPYIILTKNSQRDFRASRDKIQESVHSQGESAIELFNEPYLSADFVYLGIEEFKSIFNQLYDLLNQPCLATLDEYWVESGYSKNLQRNSVSEVALLIMLSFLKDCALSIMDTNAADEMKQGRHLIRQALLFVSLALFGNVNSYHNQDLKSKKRENDKAKDSKTMAVAAGVCIELLVAIADEQGDLDDRLSLLILRYKLTERISGWHGHRLSSNQLILILALGNLAERFPSLSPAAVVPALSNFLMEPSPVLQRLFESSKLEEADRKTGKAVPSASKTSCKKNFEMVRGAVINNLCRGLRSGLKADSECVNACLASISTRLYTAIAVDQHSNLILENSIFTLGGIGVWFRELPAISSAVMQIFQQKFSNPASPLDALIVHQLSEMILAGCVNIYCEVMKMFNRITMESWLSGYGSSDETMMYRHASLAVINSYMNLAEHIEGESQKNDLLIRFLELFVQLGLEGKRISEKISSVALKASNNAGNLGVLIPAIAVLMKRMPLIVNPRPRLRRLFRDFWAYCVVLGFTVEDSGLWPQNWFDGVCTIAVTSPVLVFPDSLRLVIKGLAISSDSINPSDLQEFRNNLLSQLNHPPDVVPLVNKMDFAQCVYLLTILRLETLRVTNSQDSRAVHFMFDYLEEKCIRKDKSGMWTCLLAITLQVVQAYVTAADQKRSETVLKSDLEKHAQFLLFKFNAIFPEIRKCADRCLSLLVDKFPHVLWDKGVLKTMLSILQLLFESCNDATSRISSTISVPGFPLSISLTETMEERRKVRDDFAAKCQQILAEAVTWAPSIVRNHIQEYISELSIESSEFLSCHSGLAVTISSMLNWGNTGLQKLPYGDLPAASLFMSGIGLENFYLGEVKGTLSLLSASESAAELLTDRLTRNFNDACAQNDIPNLKKSLLRMCSLFILTPGVCRILLRTICFAPTKVFNVDIMELCVSCWNWILSSKEGIEAEFFQEFDFAWHAQATMRLGFFRQEPPPVDPLAVRSSKELTPNPPFVKPHKALVQFITESVNTAKFCNRNLVDIFFHFFLRSFSPSISVRTEQMVGCHSCEPACQFSRHVAAAGARFHLLTSALGLLQCNIAICGTAKCLLRRRIYAVALDYFAVHPQCPTQDIGSLREDIAWIMKFWQAIQTDKKYLNRDLFDNFEACAVGFSLDSDSKMKEGGSEYATISLPRTRNGSVNGYPHTLTSNSSTHQYLSSITSLSSYRKPQVTIDLCPLDDAENELFFKQALANVTDGSQFISIFENSLKEFLRKRNLLLLLVGNEVERLLAWYNPQGLPERIIPGEECVEQWRQKTFPDLVTENKVLRENVRVSWEICPDIAVYFPVRFKNADVVKSELSRMIRSNPLSVNHIPAALSYVASVSTVESVTSEMKYVPSWAPVSPAMALSFFSRPASEHPVAAQYAIRVLKSYPPSVLLYYIPQIVQAVRYDSLNYMSEFILSMASKSQLLAHQLIWNMQTNMYTDEDGKHKDPVLFERLSKLVSKIVTSLSGEAKRFHERQFNFFNEITSISAEIKPFPKGRERKDACMRALSRVKVVKGCYLPSDPEALVVDIDYSSATPMQSAAKAPFLARFKVRKYTVDEVEQICMSNSCSNATSDDSSSDDLYWQAAIFKVGDDVRQDMLALQIMQLCLNVARSIDLDVYLYPYRVVATAPGCGVIQCVPNSKSRDQLGRQTDFDFGFMFESSPGGNLGFEPDFKLSGEMVAIMGGKMESPSFRWFMDLCVRMYLAMRPHWESFLWLISLMLDTGLPCFRGRTIQLLRDRFAPQKSEKEAAQFMLQIVRNCFLNVRSKMYDQLQYFQNEIPY
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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
1M59.4Low67.9Low74 Ų7452.4 Ų52.437%0.36532%0.324SS..  0-700-65.9-47.3-66.200112.3V3 F4 D5 E131 I135M1-V3 VanDerWaalsContact C-N 3.33Å; M1-V3 PolarHBondContact O-N 2.87Å; M1-F4 WeakPolarHBondContact O-CA 3.26Å; M1-F4 VanDerWaalsContact O-CB 3.23Å; M1-F4 WeakPolarHBondContact O-CB 3.41Å; M1-F4 PolarHBondContact O-N 3.09Å; M1-D5 PolarHBondContact O-N 3.48Å; M1-E131 HydrophobicContact CG-CB 4.46Å; M1-E131 HydrophobicContact SD-CB 4.16Å; M1-I135 HydrophobicContact CE-CD1 4.33Å; M1-I135 HydrophobicContact CE-CG1 3.69Å; M1-I135 HydrophobicContact SD-CD1 3.5Å; M1-I135 VanDerWaalsContact SD-CD1 3.5Å; M1-I135 HydrophobicContact SD-CG1 3.57Å; M1-I135 VanDerWaalsContact SD-CG1 3.57Å
2A69.6Low68.2Low73 Ų7351.8 Ų51.860%0.60332%0.32SS*.Hα-helixtrans-46.9-46.1-175.300000115.4F4 D5 T6A2-F4 PolarHBondContact O-N 3.41Å; A2-D5 PolarHBondContact O-N 3.12Å; A2-T6 WeakPolarHBondContact O-CB 3.39Å; A2-T6 PolarHBondContact O-N 3.33Å; A2-T6 PolarHBondContact O-OG1 3.3Å
3V62.1Low68.5Low100 Ų10052.8 Ų52.861%0.60633%0.33SS*.Hα-helixtrans-61.5-41.4175.9178.90000112.3M1 T6 L7M1-V3 VanDerWaalsContact C-N 3.33Å; M1-V3 PolarHBondContact O-N 2.87Å; V3-T6 PolarHBondContact O-N 2.79Å; V3-L7 HydrophobicContact CG1-CD1 4.16Å; V3-L7 WeakPolarHBondContact O-CG 3.3Å; V3-L7 PolarHBondContact O-N 3.49Å
4F65.6Low68.2Low3 Ų353.4 Ų53.41%0.01333%0.326CS..Hα-helixtrans-64.7-49176.9-172.2-93.4000111.4M1 A2 T6 L7 Y8 L35 F38 F39 I135 Q138M1-F4 WeakPolarHBondContact O-CA 3.26Å; M1-F4 VanDerWaalsContact O-CB 3.23Å; M1-F4 WeakPolarHBondContact O-CB 3.41Å; M1-F4 PolarHBondContact O-N 3.09Å; A2-F4 PolarHBondContact O-N 3.41Å; F4-T6 VanDerWaalsContact C-N 3.27Å; F4-T6 PolarHBondContact O-N 2.94Å; F4-L7 PolarHBondContact O-N 3.15Å; F4-Y8 VanDerWaalsContact O-CB 3.29Å; F4-Y8 WeakPolarHBondContact O-CB 3.46Å; F4-Y8 PolarHBondContact O-N 2.95Å; F4-L35 HydrophobicContact CD2-CD1 4.11Å; F4-L35 HydrophobicContact CD2-CG 4.23Å; F4-L35 HydrophobicContact CE2-CD1 3.8Å; F4-L35 HydrophobicContact CE2-CD2 3.8Å; F4-L35 HydrophobicContact CE2-CG 3.6Å; F4-L35 HydrophobicContact CZ-CD1 4.17Å; F4-L35 HydrophobicContact CZ-CD2 3.9Å; F4-L35 HydrophobicContact CZ-CG 4.15Å; F4-F38 HydrophobicContact CD2-CD1 4.26Å; F4-F39 HydrophobicContact CD2-CE2 4.37Å; F4-F39 HydrophobicContact CD2-CZ 4.35Å; F4-F39 HydrophobicContact CE1-CZ 4.39Å; F4-F39 HydrophobicContact CE2-CD2 4.12Å; F4-F39 HydrophobicContact CE2-CE1 4.31Å; F4-F39 AromaticContact CE2-CE2 3.13Å; F4-F39 HydrophobicContact CE2-CE2 3.13Å; F4-F39 AromaticContact CE2-CZ 3.23Å; F4-F39 HydrophobicContact CE2-CZ 3.23Å; F4-F39 AromaticContact CZ-CE2 3.38Å; F4-F39 HydrophobicContact CZ-CE2 3.38Å; F4-F39 AromaticContact CZ-CZ 3.26Å; F4-F39 HydrophobicContact CZ-CZ 3.26Å; F4-I135 HydrophobicContact CD1-CG1 4.05Å; F4-I135 HydrophobicContact CD1-CG2 4.43Å; F4-I135 HydrophobicContact CE1-CB 4.24Å; F4-I135 HydrophobicContact CE1-CG1 4.25Å; F4-I135 HydrophobicContact CE1-CG2 3.94Å; F4-I135 HydrophobicContact CE2-CG2 4.13Å; F4-I135 HydrophobicContact CG-CG1 4.45Å; F4-I135 HydrophobicContact CZ-CG2 3.8Å; F4-Q138 VanDerWaalsContact CD1-OE1 3.29Å; F4-Q138 HydrophobicContact CE1-CB 4.08Å
5D72Confident67.7Low56 Ų5653.7 Ų53.730%0.29932%0.324SS..Hα-helixtrans-62.7-35.4178.2-66.1-51.8000111.5M1 A2 S9 Q138M1-D5 PolarHBondContact O-N 3.48Å; A2-D5 PolarHBondContact O-N 3.12Å; D5-S9 WeakPolarHBondContact O-CB 3.31Å; D5-S9 PolarHBondContact O-N 3.49Å; D5-Q138 PolarHBondContact OD1-NE2 2.97Å; D5-Q138 PolarHBondContact OD1-OE1 3.27Å
6T71.9Confident67.5Low94 Ų9454.7 Ų54.758%0.57735%0.348SS*.Hα-helixtrans-68.5-45.5177.3-48.10000111.2A2 V3 F4 S9 A10A2-T6 WeakPolarHBondContact O-CB 3.39Å; A2-T6 PolarHBondContact O-N 3.33Å; A2-T6 PolarHBondContact O-OG1 3.3Å; V3-T6 PolarHBondContact O-N 2.79Å; F4-T6 VanDerWaalsContact C-N 3.27Å; F4-T6 PolarHBondContact O-N 2.94Å; T6-S9 PolarHBondContact O-N 3.31Å; T6-A10 VanDerWaalsContact O-CB 3.31Å; T6-A10 WeakPolarHBondContact O-CB 3.18Å; T6-A10 PolarHBondContact O-N 3.33Å
7L66.6Low67.2Low38 Ų3857.6 Ų57.620%0.19936%0.356CS..Hα-helixtrans-66.6-41.4176.5-73.4170.7000111.8V3 F4 A10 C11 L35V3-L7 HydrophobicContact CG1-CD1 4.16Å; V3-L7 WeakPolarHBondContact O-CG 3.3Å; V3-L7 PolarHBondContact O-N 3.49Å; F4-L7 PolarHBondContact O-N 3.15Å; L7-A10 PolarHBondContact O-N 3.43Å; L7-C11 PolarHBondContact O-N 3.13Å; L7-C11 PolarHBondContact O-SG 3.3Å; L7-C11 VanDerWaalsContact O-SG 3.42Å; L7-L35 HydrophobicContact CB-CD1 3.49Å; L7-L35 VanDerWaalsContact CB-CD1 3.49Å
8Y72.2Confident67.1Low35 Ų3563.1 Ų63.114%0.13738%0.383CS..Hα-helixtrans-61.7-47.2173.9175.3-102.8000111.7F4 A10 C11 T12 Q138 D141 L142F4-Y8 VanDerWaalsContact O-CB 3.29Å; F4-Y8 WeakPolarHBondContact O-CB 3.46Å; F4-Y8 PolarHBondContact O-N 2.95Å; Y8-A10 VanDerWaalsContact C-N 3.32Å; Y8-A10 PolarHBondContact O-N 3.37Å; Y8-C11 PolarHBondContact O-N 3.07Å; Y8-T12 HydrophobicContact CD2-CG2 4.27Å; Y8-T12 HydrophobicContact CE1-CG2 4.07Å; Y8-T12 HydrophobicContact CE2-CG2 3.73Å; Y8-T12 PolarHBondContact O-N 3.46Å; Y8-T12 PolarHBondContact O-OG1 3.44Å; Y8-Q138 HydrophobicContact CD1-CB 4.26Å; Y8-Q138 HydrophobicContact CD1-CG 3.99Å; Y8-Q138 HydrophobicContact CD2-CB 3.76Å; Y8-Q138 HydrophobicContact CD2-CG 4.39Å; Y8-Q138 HydrophobicContact CE1-CB 4.17Å; Y8-Q138 HydrophobicContact CE1-CG 3.83Å; Y8-Q138 HydrophobicContact CE2-CB 3.68Å; Y8-Q138 HydrophobicContact CE2-CG 4.27Å; Y8-Q138 WeakPolarHBondContact CE2-O 3.28Å; Y8-Q138 HydrophobicContact CG-CB 4.06Å; Y8-Q138 HydrophobicContact CG-CG 4.27Å; Y8-D141 WeakPolarHBondContact OH-CB 3.48Å; Y8-L142 HydrophobicContact CD2-CD1 3.51Å; Y8-L142 HydrophobicContact CD2-CG 3.92Å; Y8-L142 HydrophobicContact CE2-CD1 3.86Å; Y8-L142 HydrophobicContact CE2-CG 3.75Å
9S73.8Confident66.9Low67 Ų6770.2 Ų70.247%0.46941%0.409SS..Hα-helixtrans-63.2-38.8177-171.80000111.4D5 T6 T12 S13D5-S9 WeakPolarHBondContact O-CB 3.31Å; D5-S9 PolarHBondContact O-N 3.49Å; T6-S9 PolarHBondContact O-N 3.31Å; S9-T12 WeakPolarHBondContact CA-OG1 3.4Å; S9-T12 PolarHBondContact O-N 3.02Å; S9-T12 PolarHBondContact O-OG1 3.15Å; S9-S13 VanDerWaalsContact O-CB 3.25Å; S9-S13 WeakPolarHBondContact O-CB 3.34Å; S9-S13 PolarHBondContact O-N 2.8Å; S9-S13 PolarHBondContact O-OG 3.4Å
10A67.9Low67.1Low34 Ų3467.5 Ų67.528%0.28139%0.393SS..Hα-helixtrans-63.8-43.3173.400000112T6 L7 Y8 T12 S13 F14T6-A10 VanDerWaalsContact O-CB 3.31Å; T6-A10 WeakPolarHBondContact O-CB 3.18Å; T6-A10 PolarHBondContact O-N 3.33Å; L7-A10 PolarHBondContact O-N 3.43Å; Y8-A10 VanDerWaalsContact C-N 3.32Å; Y8-A10 PolarHBondContact O-N 3.37Å; A10-T12 PolarHBondContact O-N 2.9Å; A10-S13 PolarHBondContact O-OG 3.29Å; A10-F14 VanDerWaalsContact O-CD2 3.25Å; A10-F14 WeakPolarHBondContact O-CD2 3.35Å
11C66.4Low67.7Low2 Ų267.1 Ų67.11%0.01439%0.394CS..Hα-helixtrans-64.5-40.5175.6-710000112.1L7 Y8 I15 L142L7-C11 PolarHBondContact O-N 3.13Å; L7-C11 PolarHBondContact O-SG 3.3Å; L7-C11 VanDerWaalsContact O-SG 3.42Å; Y8-C11 PolarHBondContact O-N 3.07Å; C11-I15 WeakPolarHBondContact O-CD1 3.46Å; C11-I15 VanDerWaalsContact O-CG1 3.29Å; C11-I15 WeakPolarHBondContact O-CG1 3.42Å; C11-L142 HydrophobicContact CB-CD2 3.9Å
12T71.3Confident68.3Low46 Ų4668 Ų6828%0.28240%0.4SS..Hα-helixtrans-80.9-32.1-176.150.80000114.8Y8 S9 A10 F14 I15Y8-T12 HydrophobicContact CD2-CG2 4.27Å; Y8-T12 HydrophobicContact CE1-CG2 4.07Å; Y8-T12 HydrophobicContact CE2-CG2 3.73Å; Y8-T12 PolarHBondContact O-N 3.46Å; Y8-T12 PolarHBondContact O-OG1 3.44Å; S9-T12 WeakPolarHBondContact CA-OG1 3.4Å; S9-T12 PolarHBondContact O-N 3.02Å; S9-T12 PolarHBondContact O-OG1 3.15Å; A10-T12 PolarHBondContact O-N 2.9Å; T12-F14 PolarHBondContact O-N 3.19Å; T12-I15 PolarHBondContact O-N 2.88Å
13S72.3Confident68.6Low64 Ų6470.5 Ų70.545%0.44840%0.403SS..Hα-helixtrans-64.9-21.9-177.565.60000114S9 A10S9-S13 VanDerWaalsContact O-CB 3.25Å; S9-S13 WeakPolarHBondContact O-CB 3.34Å; S9-S13 PolarHBondContact O-N 2.8Å; S9-S13 PolarHBondContact O-OG 3.4Å; A10-S13 PolarHBondContact O-OG 3.29Å
14F63.9Low69.2Low61 Ų6167.2 Ų67.227%0.26838%0.384SS..THydrogen-bonded Turntrans-98.4-13179.5-67.6-73.2000113.7A10 T12 G16 Q17 T24 I28A10-F14 VanDerWaalsContact O-CD2 3.25Å; A10-F14 WeakPolarHBondContact O-CD2 3.35Å; T12-F14 PolarHBondContact O-N 3.19Å; F14-G16 PolarHBondContact O-N 3.34Å; F14-Q17 PolarHBondContact O-N 3.03Å; F14-T24 HydrophobicContact CD1-CG2 4.2Å; F14-T24 HydrophobicContact CD2-CG2 4.43Å; F14-T24 HydrophobicContact CE1-CG2 3.98Å; F14-T24 HydrophobicContact CE2-CG2 4.25Å; F14-T24 HydrophobicContact CG-CG2 4.43Å; F14-T24 HydrophobicContact CZ-CG2 4.02Å; F14-I28 HydrophobicContact CB-CD1 3.42Å; F14-I28 VanDerWaalsContact CB-CD1 3.42Å; F14-I28 HydrophobicContact CB-CG1 4.32Å; F14-I28 HydrophobicContact CD2-CD1 4Å; F14-I28 HydrophobicContact CD2-CG1 4.13Å; F14-I28 HydrophobicContact CG-CD1 3.84Å; F14-I28 HydrophobicContact CG-CG1 4.47Å
15I61.3Low69.4Low59 Ų5968.6 Ų68.630%0.30339%0.39SS..THydrogen-bonded Turntrans-75.189.9175.2-63.3162.2000107.9C11 T12 C147C11-I15 WeakPolarHBondContact O-CD1 3.46Å; C11-I15 VanDerWaalsContact O-CG1 3.29Å; C11-I15 WeakPolarHBondContact O-CG1 3.42Å; T12-I15 PolarHBondContact O-N 2.88Å; I15-C147 WeakPolarHBondContact CD1-SG 3.18Å
16G63.7Low69.3Low69 Ų6967.1 Ų67.171%0.71138%0.381SS*.THydrogen-bonded Turntrans139.1-9.1-178.800000114.8F14F14-G16 PolarHBondContact O-N 3.34Å
17Q63Low69.3Low104 Ų10468.4 Ų68.449%0.48638%0.381SS..  trans-85.2123173.4-65.3-169.41.900110.4F14 F19 V20F14-Q17 PolarHBondContact O-N 3.03Å; Q17-F19 PolarHBondContact O-N 3.49Å; Q17-V20 HydrophobicContact CB-CG2 4.09Å
18N65.3Low69.4Low156 Ų15666.9 Ų66.983%0.83437%0.373SS*.SBendtrans-66.3-17.7-175.4-75.8-19.4000114.5
19F63.7Low69.2Low199 Ų19965.6 Ų65.687%0.87337%0.368SS*.  trans-134.898.2178.2-74.7-83.2000110.4Q17Q17-F19 PolarHBondContact O-N 3.49Å
20V70.9Confident68.9Low15 Ų1567.7 Ų67.79%0.09137%0.366CS..  trans-108.5127.5173.4-1760000107.7Q17 T24 K25 I28Q17-V20 HydrophobicContact CB-CG2 4.09Å; V20-T24 HydrophobicContact CG1-CG2 3.71Å; V20-K25 HydrophobicContact CB-CG 4.12Å; V20-K25 HydrophobicContact CG1-CG 3.84Å; V20-K25 VanDerWaalsContact O-CE 3.3Å; V20-K25 WeakPolarHBondContact O-CE 3.34Å; V20-I28 HydrophobicContact CG1-CD1 4.08Å
21S78.5Confident68.9Low61 Ų6167 Ų6743%0.42736%0.359SS..  trans-62.1152.8179.684.80000111.1D23 T24 K25S21-D23 PolarHBondContact O-N 3.39Å; S21-T24 PolarHBondContact O-N 2.94Å; S21-T24 VanDerWaalsContact O-N 3.09Å; S21-T24 PolarHBondContact OG-N 3.36Å; S21-T24 PolarHBondContact OG-OG1 3.39Å; S21-K25 PolarHBondContact O-N 3.29Å
22L72.5Confident69.1Low93 Ų9367.3 Ų67.349%0.48736%0.361SS..Hα-helixtrans-57-40.4179.4-173.670.2000111.7T24 K25 I26L22-T24 VanDerWaalsContact C-N 3.34Å; L22-T24 PolarHBondContact O-N 3.39Å; L22-K25 PolarHBondContact O-N 3.01Å; L22-I26 HydrophobicContact CG-CD1 4.07Å; L22-I26 VanDerWaalsContact O-CG1 3.31Å; L22-I26 WeakPolarHBondContact O-CG1 3.29Å; L22-I26 PolarHBondContact O-N 3.4Å
23D76.3Confident68.8Low125 Ų12566 Ų6667%0.66835%0.351SS*.Hα-helixtrans-60.6-43.9176.4-68.6-39.8000111.3S21 I26 E27S21-D23 PolarHBondContact O-N 3.39Å; D23-I26 PolarHBondContact O-N 3.3Å; D23-E27 WeakPolarHBondContact O-CB 3.42Å; D23-E27 PolarHBondContact O-N 3.48Å
24T73.4Confident68.3Low31 Ų3167.2 Ų67.219%0.1935%0.352CS..Hα-helixtrans-67.3-37.8176.7-42.70000111.9F14 V20 S21 L22 E27 I28F14-T24 HydrophobicContact CD1-CG2 4.2Å; F14-T24 HydrophobicContact CD2-CG2 4.43Å; F14-T24 HydrophobicContact CE1-CG2 3.98Å; F14-T24 HydrophobicContact CE2-CG2 4.25Å; F14-T24 HydrophobicContact CG-CG2 4.43Å; F14-T24 HydrophobicContact CZ-CG2 4.02Å; V20-T24 HydrophobicContact CG1-CG2 3.71Å; S21-T24 PolarHBondContact O-N 2.94Å; S21-T24 VanDerWaalsContact O-N 3.09Å; S21-T24 PolarHBondContact OG-N 3.36Å; S21-T24 PolarHBondContact OG-OG1 3.39Å; L22-T24 VanDerWaalsContact C-N 3.34Å; L22-T24 PolarHBondContact O-N 3.39Å; T24-E27 PolarHBondContact O-N 3.34Å; T24-I28 HydrophobicContact CG2-CD1 4.3Å; T24-I28 WeakPolarHBondContact O-CD1 3.38Å; T24-I28 VanDerWaalsContact O-CG1 3.24Å; T24-I28 WeakPolarHBondContact O-CG1 3.36Å; T24-I28 PolarHBondContact O-N 2.77Å
25K70.3Confident68.4Low32 Ų3264.4 Ų64.414%0.13934%0.34CS..Hα-helixtrans-61.1-44.9173.6-70.8178.1179.3175.70111.3V20 S21 L22 E27 I28 I29 Y154 E157V20-K25 HydrophobicContact CB-CG 4.12Å; V20-K25 HydrophobicContact CG1-CG 3.84Å; V20-K25 VanDerWaalsContact O-CE 3.3Å; V20-K25 WeakPolarHBondContact O-CE 3.34Å; S21-K25 PolarHBondContact O-N 3.29Å; L22-K25 PolarHBondContact O-N 3.01Å; K25-E27 VanDerWaalsContact C-N 3.3Å; K25-E27 PolarHBondContact O-N 3.13Å; K25-I28 PolarHBondContact O-N 3.08Å; K25-I29 WeakPolarHBondContact O-CD1 3.24Å; K25-I29 VanDerWaalsContact O-CG1 3.3Å; K25-I29 WeakPolarHBondContact O-CG1 3.39Å; K25-I29 PolarHBondContact O-N 3.13Å; K25-Y154 HydrophobicContact CB-CG 4.43Å; K25-Y154 HydrophobicContact CD-CD1 3.83Å; K25-Y154 HydrophobicContact CD-CE1 4.22Å; K25-Y154 HydrophobicContact CD-CG 4.08Å; K25-Y154 HydrophobicContact CG-CD1 4.2Å; K25-Y154 HydrophobicContact CG-CD2 4.17Å; K25-Y154 HydrophobicContact CG-CE1 4.49Å; K25-Y154 HydrophobicContact CG-CE2 4.44Å; K25-Y154 HydrophobicContact CG-CG 4.04Å; K25-E157 IonicContact NZ-OE1 2.59Å; K25-E157 IonicContact NZ-OE2 2.66Å; K25-E157 PolarHBondContact NZ-OE2 3.37Å
26I69.4Low68.5Low24 Ų2461.8 Ų61.812%0.12333%0.326CS..Hα-helixtrans-62.1-40.2174.7-67.9164.4000110.4L22 D23 I29 R30 Y160L22-I26 HydrophobicContact CG-CD1 4.07Å; L22-I26 VanDerWaalsContact O-CG1 3.31Å; L22-I26 WeakPolarHBondContact O-CG1 3.29Å; L22-I26 PolarHBondContact O-N 3.4Å; D23-I26 PolarHBondContact O-N 3.3Å; I26-I29 PolarHBondContact O-N 3.19Å; I26-R30 HydrophobicContact CG2-CG 4.48Å; I26-R30 WeakPolarHBondContact O-CB 3.16Å; I26-R30 VanDerWaalsContact O-CG 3.29Å; I26-R30 WeakPolarHBondContact O-CG 3.37Å; I26-R30 PolarHBondContact O-N 3.34Å; I26-Y160 HydrophobicContact CD1-CE2 3.94Å; I26-Y160 HydrophobicContact CG1-CE2 4.08Å; I26-Y160 HydrophobicContact CG2-CE2 4.31Å
27E72.2Confident68.2Low121 Ų12159.2 Ų59.257%0.56530%0.3SS*.Hα-helixtrans-68.6-36.3178.8-157.3172.5-151.900112.9D23 T24 K25 R30 S31D23-E27 WeakPolarHBondContact O-CB 3.42Å; D23-E27 PolarHBondContact O-N 3.48Å; T24-E27 PolarHBondContact O-N 3.34Å; K25-E27 VanDerWaalsContact C-N 3.3Å; K25-E27 PolarHBondContact O-N 3.13Å; E27-R30 PolarHBondContact O-N 3.31Å; E27-S31 WeakPolarHBondContact O-CB 3.42Å; E27-S31 PolarHBondContact O-N 2.86Å; E27-S31 PolarHBondContact O-OG 3.43Å
28I69.9Low68Low7 Ų758.4 Ų58.44%0.03630%0.295CS..Hα-helixtrans-64.4-46.7171.9-69160.4000110.2F14 V20 T24 K25 R30 S31 L32 L151F14-I28 HydrophobicContact CB-CD1 3.42Å; F14-I28 VanDerWaalsContact CB-CD1 3.42Å; F14-I28 HydrophobicContact CB-CG1 4.32Å; F14-I28 HydrophobicContact CD2-CD1 4Å; F14-I28 HydrophobicContact CD2-CG1 4.13Å; F14-I28 HydrophobicContact CG-CD1 3.84Å; F14-I28 HydrophobicContact CG-CG1 4.47Å; V20-I28 HydrophobicContact CG1-CD1 4.08Å; T24-I28 HydrophobicContact CG2-CD1 4.3Å; T24-I28 WeakPolarHBondContact O-CD1 3.38Å; T24-I28 VanDerWaalsContact O-CG1 3.24Å; T24-I28 WeakPolarHBondContact O-CG1 3.36Å; T24-I28 PolarHBondContact O-N 2.77Å; K25-I28 PolarHBondContact O-N 3.08Å; I28-R30 VanDerWaalsContact C-N 3.31Å; I28-R30 PolarHBondContact O-N 2.87Å; I28-S31 PolarHBondContact O-N 3.27Å; I28-L32 WeakPolarHBondContact O-CB 3.31Å; I28-L32 PolarHBondContact O-N 2.91Å; I28-L151 HydrophobicContact CG2-CD2 4.09Å
29I67.9Low67.5Low7 Ų751.2 Ų51.24%0.03626%0.256CS..Hα-helixtrans-60.6-43.1176.2-70.5162.4000110.2K25 I26 L32 F33 W155K25-I29 WeakPolarHBondContact O-CD1 3.24Å; K25-I29 VanDerWaalsContact O-CG1 3.3Å; K25-I29 WeakPolarHBondContact O-CG1 3.39Å; K25-I29 PolarHBondContact O-N 3.13Å; I26-I29 PolarHBondContact O-N 3.19Å; I29-L32 PolarHBondContact O-N 2.87Å; I29-F33 HydrophobicContact CG2-CD2 3.57Å; I29-F33 HydrophobicContact CG2-CE2 3.33Å; I29-F33 HydrophobicContact CG2-CZ 4.44Å; I29-F33 WeakPolarHBondContact O-CB 3.39Å; I29-F33 WeakPolarHBondContact O-CD2 3.43Å; I29-F33 WeakPolarHBondContact O-CG 3.16Å; I29-F33 PolarHBondContact O-N 2.94Å; I29-W155 HydrophobicContact CD1-CE3 4.15Å; I29-W155 HydrophobicContact CG2-CE3 3.73Å; I29-W155 HydrophobicContact CG2-CZ3 3.73Å
30R66.5Low67Low112 Ų11246 Ų4642%0.42323%0.231SC..Hα-helixtrans-62.3-43.6174.4-77.6176.2179.6178.72.6112I26 E27 I28 F33 L34I26-R30 HydrophobicContact CG2-CG 4.48Å; I26-R30 WeakPolarHBondContact O-CB 3.16Å; I26-R30 VanDerWaalsContact O-CG 3.29Å; I26-R30 WeakPolarHBondContact O-CG 3.37Å; I26-R30 PolarHBondContact O-N 3.34Å; E27-R30 PolarHBondContact O-N 3.31Å; I28-R30 VanDerWaalsContact C-N 3.31Å; I28-R30 PolarHBondContact O-N 2.87Å; R30-F33 PolarHBondContact O-N 2.99Å; R30-L34 WeakPolarHBondContact O-CB 3.33Å; R30-L34 PolarHBondContact O-N 3.45Å
31S68.2Low66Low20 Ų2048.7 Ų48.714%0.1425%0.249CC..Hα-helixtrans-64.5-41.8178.3-61.60000111.2E27 I28 L34 L35E27-S31 WeakPolarHBondContact O-CB 3.42Å; E27-S31 PolarHBondContact O-N 2.86Å; E27-S31 PolarHBondContact O-OG 3.43Å; I28-S31 PolarHBondContact O-N 3.27Å; S31-L34 WeakPolarHBondContact O-CB 3.27Å; S31-L34 PolarHBondContact O-N 2.96Å; S31-L35 WeakPolarHBondContact O-CB 3.13Å; S31-L35 PolarHBondContact O-N 3.2Å
32L69.6Low64.5Low8 Ų847.7 Ų47.74%0.04224%0.237CC..Hα-helixtrans-61.3-45.7173.2-172.687.7000110.8I28 I29 L35 L36 L142 L151 V169I28-L32 WeakPolarHBondContact O-CB 3.31Å; I28-L32 PolarHBondContact O-N 2.91Å; I29-L32 PolarHBondContact O-N 2.87Å; L32-L35 WeakPolarHBondContact O-CB 3.49Å; L32-L35 PolarHBondContact O-N 3.22Å; L32-L36 HydrophobicContact CD2-CD1 4.23Å; L32-L36 HydrophobicContact CG-CD1 4.13Å; L32-L36 WeakPolarHBondContact O-CB 3.23Å; L32-L36 VanDerWaalsContact O-CG 3.27Å; L32-L36 WeakPolarHBondContact O-CG 3.4Å; L32-L36 PolarHBondContact O-N 3.3Å; L32-L142 HydrophobicContact CD1-CD2 3.98Å; L32-L151 HydrophobicContact CD1-CD1 4.06Å; L32-L151 HydrophobicContact CD2-CD1 3.84Å; L32-L151 HydrophobicContact CD2-CD2 4.36Å; L32-V169 HydrophobicContact CD2-CG1 3.42Å; L32-V169 VanDerWaalsContact CD2-CG1 3.42Å
33F65.3Low63.2Low17 Ų1744.1 Ų44.18%0.07522%0.223CC..Hα-helixtrans-69-32.4177.5-75.1-50.3000113.4I29 R30 L36 G37 M57 F58 W155 V169 V172I29-F33 HydrophobicContact CG2-CD2 3.57Å; I29-F33 HydrophobicContact CG2-CE2 3.33Å; I29-F33 HydrophobicContact CG2-CZ 4.44Å; I29-F33 WeakPolarHBondContact O-CB 3.39Å; I29-F33 WeakPolarHBondContact O-CD2 3.43Å; I29-F33 WeakPolarHBondContact O-CG 3.16Å; I29-F33 PolarHBondContact O-N 2.94Å; R30-F33 PolarHBondContact O-N 2.99Å; F33-L36 HydrophobicContact CD1-CD1 3.95Å; F33-L36 HydrophobicContact CE1-CD1 4.32Å; F33-G37 PolarHBondContact O-N 3.23Å; F33-M57 HydrophobicContact CD1-CE 3.17Å; F33-M57 HydrophobicContact CE1-CE 3.35Å; F33-M57 HydrophobicContact CG-CE 4.06Å; F33-M57 HydrophobicContact CZ-CE 4.33Å; F33-F58 HydrophobicContact CB-CZ 4.11Å; F33-W155 HydrophobicContact CE2-CE3 4.3Å; F33-W155 HydrophobicContact CE2-CH2 4.28Å; F33-W155 AromaticContact CE2-CZ3 3.74Å; F33-W155 HydrophobicContact CE2-CZ3 3.74Å; F33-W155 HydrophobicContact CZ-CZ3 4.3Å; F33-V169 HydrophobicContact CZ-CG2 4.2Å; F33-V172 HydrophobicContact CE1-CG1 3.93Å
34L62.9Low61.5Low91 Ų9144.8 Ų44.848%0.47622%0.216SC..Hα-helixtrans-63.3-43.3168.7-93.4152.5000110.9R30 S31 G37 F38 F58R30-L34 WeakPolarHBondContact O-CB 3.33Å; R30-L34 PolarHBondContact O-N 3.45Å; S31-L34 WeakPolarHBondContact O-CB 3.27Å; S31-L34 PolarHBondContact O-N 2.96Å; L34-G37 PolarHBondContact O-N 3.08Å; L34-F38 WeakPolarHBondContact O-CB 3.34Å; L34-F38 PolarHBondContact O-N 3.44Å; L34-F58 HydrophobicContact CG-CZ 4.28Å
35L65.4Low59.8Low1 Ų146.9 Ų46.91%0.00524%0.244CC..Hα-helixtrans-64.6-45.2177.2-158.3120.1000111.2F4 L7 S31 L32 F38 F39 L142F4-L35 HydrophobicContact CD2-CD1 4.11Å; F4-L35 HydrophobicContact CD2-CG 4.23Å; F4-L35 HydrophobicContact CE2-CD1 3.8Å; F4-L35 HydrophobicContact CE2-CD2 3.8Å; F4-L35 HydrophobicContact CE2-CG 3.6Å; F4-L35 HydrophobicContact CZ-CD1 4.17Å; F4-L35 HydrophobicContact CZ-CD2 3.9Å; F4-L35 HydrophobicContact CZ-CG 4.15Å; L7-L35 HydrophobicContact CB-CD1 3.49Å; L7-L35 VanDerWaalsContact CB-CD1 3.49Å; S31-L35 WeakPolarHBondContact O-CB 3.13Å; S31-L35 PolarHBondContact O-N 3.2Å; L32-L35 WeakPolarHBondContact O-CB 3.49Å; L32-L35 PolarHBondContact O-N 3.22Å; L35-F38 WeakPolarHBondContact O-CB 3.36Å; L35-F38 PolarHBondContact O-N 3.05Å; L35-F39 HydrophobicContact CD2-CD2 4.29Å; L35-F39 HydrophobicContact CD2-CE2 3.79Å; L35-F39 HydrophobicContact CG-CE2 4.33Å; L35-F39 WeakPolarHBondContact O-CD2 3.5Å; L35-F39 PolarHBondContact O-N 3.36Å; L35-L142 HydrophobicContact CD2-CD1 3.74Å
36L63.3Low58.1Low5 Ų550.5 Ų50.53%0.02627%0.272CS..Hα-helixtrans-64.3-37.9173.8-70.6169.8000112.2L32 F33 F39 R40 A173 I176L32-L36 HydrophobicContact CD2-CD1 4.23Å; L32-L36 HydrophobicContact CG-CD1 4.13Å; L32-L36 WeakPolarHBondContact O-CB 3.23Å; L32-L36 VanDerWaalsContact O-CG 3.27Å; L32-L36 WeakPolarHBondContact O-CG 3.4Å; L32-L36 PolarHBondContact O-N 3.3Å; F33-L36 HydrophobicContact CD1-CD1 3.95Å; F33-L36 HydrophobicContact CE1-CD1 4.32Å; L36-F39 PolarHBondContact O-N 3.29Å; L36-R40 PolarHBondContact O-N 3.32Å; L36-R40 VanDerWaalsContact O-N 3.08Å; L36-A173 HydrophobicContact CD1-CB 4.09Å; L36-A173 HydrophobicContact CD2-CB 4.43Å; L36-I176 HydrophobicContact CB-CD1 4.23Å; L36-I176 HydrophobicContact CB-CG2 4.42Å; L36-I176 HydrophobicContact CD1-CD1 4.3Å; L36-I176 HydrophobicContact CD2-CG2 4.22Å
37G56.9Low56.3Low15 Ų1558.4 Ų58.416%0.15531%0.314CS..Hα-helixtrans-63.9-42.7173.400000112.2F33 L34 F39 R40 C41F33-G37 PolarHBondContact O-N 3.23Å; L34-G37 PolarHBondContact O-N 3.08Å; G37-F39 VanDerWaalsContact C-N 3.32Å; G37-F39 PolarHBondContact O-N 2.83Å; G37-R40 PolarHBondContact O-N 2.79Å; G37-C41 PolarHBondContact O-N 3.04Å
38F58.9Low54.4Low87 Ų8756.1 Ų56.138%0.38232%0.315SS..Hα-helixtrans-59.8-40.8174.2-165.1-96000111.4F4 L34 L35 C41 F42F4-F38 HydrophobicContact CD2-CD1 4.26Å; L34-F38 WeakPolarHBondContact O-CB 3.34Å; L34-F38 PolarHBondContact O-N 3.44Å; L35-F38 WeakPolarHBondContact O-CB 3.36Å; L35-F38 PolarHBondContact O-N 3.05Å; F38-C41 WeakPolarHBondContact O-CB 3.29Å; F38-C41 PolarHBondContact O-N 2.98Å; F38-F42 HydrophobicContact CD1-CD2 4.47Å; F38-F42 AromaticContact CD1-CE2 3.82Å; F38-F42 HydrophobicContact CD1-CE2 3.82Å; F38-F42 AromaticContact CE1-CE2 3.65Å; F38-F42 HydrophobicContact CE1-CE2 3.65Å; F38-F42 HydrophobicContact CE1-CZ 4.29Å
39F56.3Low52.6Low4 Ų461.9 Ų61.92%0.01835%0.346CS..Hα-helixtrans-65.4-39174.3-84.2-66.8000114.3F4 L35 L36 G37 C41 F42 I135 L139 F180F4-F39 HydrophobicContact CD2-CE2 4.37Å; F4-F39 HydrophobicContact CD2-CZ 4.35Å; F4-F39 HydrophobicContact CE1-CZ 4.39Å; F4-F39 HydrophobicContact CE2-CD2 4.12Å; F4-F39 HydrophobicContact CE2-CE1 4.31Å; F4-F39 AromaticContact CE2-CE2 3.13Å; F4-F39 HydrophobicContact CE2-CE2 3.13Å; F4-F39 AromaticContact CE2-CZ 3.23Å; F4-F39 HydrophobicContact CE2-CZ 3.23Å; F4-F39 AromaticContact CZ-CE2 3.38Å; F4-F39 HydrophobicContact CZ-CE2 3.38Å; F4-F39 AromaticContact CZ-CZ 3.26Å; F4-F39 HydrophobicContact CZ-CZ 3.26Å; L35-F39 HydrophobicContact CD2-CD2 4.29Å; L35-F39 HydrophobicContact CD2-CE2 3.79Å; L35-F39 HydrophobicContact CG-CE2 4.33Å; L35-F39 WeakPolarHBondContact O-CD2 3.5Å; L35-F39 PolarHBondContact O-N 3.36Å; L36-F39 PolarHBondContact O-N 3.29Å; G37-F39 VanDerWaalsContact C-N 3.32Å; G37-F39 PolarHBondContact O-N 2.83Å; F39-C41 PolarHBondContact O-N 3.37Å; F39-F42 HydrophobicContact CD1-CD2 4.14Å; F39-F42 HydrophobicContact CD1-CE2 4.41Å; F39-F42 WeakPolarHBondContact O-CB 3.32Å; F39-F42 PolarHBondContact O-N 2.81Å; F39-I135 HydrophobicContact CE1-CG2 3.21Å; F39-I135 HydrophobicContact CE2-CG2 4.46Å; F39-I135 HydrophobicContact CZ-CG2 3.16Å; F39-L139 HydrophobicContact CD1-CD1 3.78Å; F39-L139 HydrophobicContact CD2-CD1 3.77Å; F39-L139 HydrophobicContact CD2-CD2 4.07Å; F39-L139 HydrophobicContact CD2-CG 4.08Å; F39-L139 HydrophobicContact CE1-CD1 3.27Å; F39-L139 HydrophobicContact CE1-CG 4.2Å; F39-L139 HydrophobicContact CE2-CD1 3.23Å; F39-L139 HydrophobicContact CE2-CD2 3.67Å; F39-L139 HydrophobicContact CE2-CG 3.29Å; F39-L139 HydrophobicContact CG-CD1 4Å; F39-L139 HydrophobicContact CZ-CD1 2.96Å; F39-L139 HydrophobicContact CZ-CD2 4.26Å; F39-L139 HydrophobicContact CZ-CG 3.38Å; F39-F180 HydrophobicContact CD1-CE1 4.42Å; F39-F180 HydrophobicContact CD1-CZ 4.36Å
40R52.8Low51.1Low91 Ų9169.4 Ų69.434%0.34338%0.381SS..Hα-helixtrans-63.5-24.1176.9-162.5176.2172.6104.91.1111.7L36 G37 G43 L53 I54L36-R40 PolarHBondContact O-N 3.32Å; L36-R40 VanDerWaalsContact O-N 3.08Å; G37-R40 PolarHBondContact O-N 2.79Å; R40-G43 PolarHBondContact O-N 3.21Å; R40-L53 VanDerWaalsContact NH1-CD2 3.31Å; R40-I54 HydrophobicContact CB-CD1 4.4Å
41C48.6Very low49.5Very low71 Ų7169.8 Ų69.848%0.4839%0.39SS..Hα-helixtrans-70.6-26.4171.4-64.10000113.7G37 F38 F39 G43G37-C41 PolarHBondContact O-N 3.04Å; F38-C41 WeakPolarHBondContact O-CB 3.29Å; F38-C41 PolarHBondContact O-N 2.98Å; F39-C41 PolarHBondContact O-N 3.37Å; C41-G43 PolarHBondContact O-N 2.85Å
42F47Very low48.1Very low39 Ų3970.5 Ų70.517%0.17140%0.401CS..Hα-helixtrans-65.6-21.1174.3-82.8-96000113F38 F39 I83 L127 I135 F180F38-F42 HydrophobicContact CD1-CD2 4.47Å; F38-F42 AromaticContact CD1-CE2 3.82Å; F38-F42 HydrophobicContact CD1-CE2 3.82Å; F38-F42 AromaticContact CE1-CE2 3.65Å; F38-F42 HydrophobicContact CE1-CE2 3.65Å; F38-F42 HydrophobicContact CE1-CZ 4.29Å; F39-F42 HydrophobicContact CD1-CD2 4.14Å; F39-F42 HydrophobicContact CD1-CE2 4.41Å; F39-F42 WeakPolarHBondContact O-CB 3.32Å; F39-F42 PolarHBondContact O-N 2.81Å; F42-I83 HydrophobicContact CD1-CB 4.18Å; F42-I83 HydrophobicContact CD1-CD1 3.86Å; F42-I83 HydrophobicContact CD1-CG2 4.09Å; F42-I83 HydrophobicContact CD2-CD1 4.29Å; F42-I83 HydrophobicContact CE1-CB 4.19Å; F42-I83 HydrophobicContact CE1-CD1 3.47Å; F42-I83 VanDerWaalsContact CE1-CD1 3.47Å; F42-I83 HydrophobicContact CE1-CG1 4.41Å; F42-I83 HydrophobicContact CE1-CG2 3.75Å; F42-I83 HydrophobicContact CE2-CD1 3.95Å; F42-I83 HydrophobicContact CG-CD1 4.27Å; F42-I83 HydrophobicContact CZ-CD1 3.52Å; F42-L127 HydrophobicContact CE1-CD1 4.43Å; F42-L127 HydrophobicContact CE1-CD2 4.36Å; F42-L127 HydrophobicContact CZ-CD1 4.39Å; F42-I135 HydrophobicContact CZ-CD1 3.97Å; F42-F180 HydrophobicContact CB-CE2 3.55Å; F42-F180 HydrophobicContact CB-CZ 4.17Å
43G46.8Very low46.6Very low19 Ų1973.6 Ų73.620%0.19642%0.417CS..THydrogen-bonded Turntrans-94.9-1.7-17200000116.6R40 C41 G45R40-G43 PolarHBondContact O-N 3.21Å; C41-G43 PolarHBondContact O-N 2.85Å; G43-G45 PolarHBondContact O-N 3.33Å
44R39.9Very low45.3Very low139 Ų13975.6 Ų75.653%0.52543%0.428SS..  trans-79.168.6178.6-73.1-161.2-179.9-170.71.3112.2L51R44-L51 VanDerWaalsContact NH2-CD2 3.26Å
45G37.2Very low44.1Very low75 Ų7581.9 Ų81.977%0.77345%0.446SS*.  trans-105.821.6161.200000113G43G43-G45 PolarHBondContact O-N 3.33Å
46C35.4Very low43Very low107 Ų10791.6 Ų91.672%0.72348%0.482SS*.SBendtrans-133.5122.9-175.1-155.80000110.9A48C46-A48 PolarHBondContact O-N 2.8Å
47L32.1Very low42Very low191 Ų19192.8 Ų92.8100%149%0.488SS*.  trans-73.355.8-175.6-73.9162.4000112.8
48A31.6Very low41.1Very low72 Ų7296.2 Ų96.260%0.59550%0.499SS*.  trans-127.4121.7177.400000112.3C46 H50C46-A48 PolarHBondContact O-N 2.8Å; A48-H50 PolarHBondContact O-N 3.29Å
49D32.3Very low40.1Very low129 Ų12996.3 Ų96.369%0.6951%0.508SS*.  trans-9073.6-159.6-153.511.2000112.8
50H36.4Very low38.8Very low165 Ų165106.3 Ų106.376%0.76455%0.551SS**  trans-135.880.8177.2-58.3-47000112.8A48 G52A48-H50 PolarHBondContact O-N 3.29Å; H50-G52 PolarHBondContact O-N 2.9Å
51L32.7Very low37.9Very low119 Ų119106.6 Ų106.662%0.62356%0.564SS**  trans-70.431176.4-100.6154.5000115.3R44R44-L51 VanDerWaalsContact NH2-CD2 3.26Å
52G39.4Very low37.3Very low35 Ų35107.9 Ų107.936%0.36157%0.573SS.*  trans-90.2-29.4-166.100000118.7H50 R56H50-G52 PolarHBondContact O-N 2.9Å; G52-R56 VanDerWaalsContact O-CG 3.3Å; G52-R56 WeakPolarHBondContact O-CG 3.38Å; G52-R56 PolarHBondContact O-N 3.42Å
53L38.4Very low36.8Very low73 Ų73110.8 Ų110.838%0.38261%0.605SS.*Hα-helixtrans-83.2-47.7-165.9-155.580.1000114.2R40 R55 R56 M57R40-L53 VanDerWaalsContact NH1-CD2 3.31Å; L53-R55 VanDerWaalsContact C-N 3.28Å; L53-R55 PolarHBondContact O-N 3.36Å; L53-R56 PolarHBondContact O-N 3.47Å; L53-R56 VanDerWaalsContact O-N 3.08Å; L53-M57 WeakPolarHBondContact O-CG 3.45Å; L53-M57 PolarHBondContact O-N 2.93Å
54I38Very low36.1Very low60 Ų60117.8 Ų117.831%0.30863%0.632SS.*Hα-helixtrans-63-38.2-179.7-63.2177.5000110.4R40 R56 M57 F58R40-I54 HydrophobicContact CB-CD1 4.4Å; I54-R56 VanDerWaalsContact C-N 3.29Å; I54-R56 PolarHBondContact O-N 3.18Å; I54-M57 PolarHBondContact O-N 3.4Å; I54-M57 VanDerWaalsContact O-N 3.13Å; I54-F58 HydrophobicContact CG2-CD2 3.89Å; I54-F58 HydrophobicContact CG2-CE2 4.02Å; I54-F58 WeakPolarHBondContact O-CD2 3.3Å; I54-F58 PolarHBondContact O-N 2.81Å
55R36.5Very low35.7Very low222 Ų222119.2 Ų119.284%0.83865%0.645SS**Hα-helixtrans-66.9-29.2176.6-135.6-178.5-170.3-175.74.1112.9L53L53-R55 VanDerWaalsContact C-N 3.28Å; L53-R55 PolarHBondContact O-N 3.36Å
56R43.5Very low35.6Very low205 Ų205121.4 Ų121.477%0.77465%0.645SS**Hα-helixtrans-75.8-28.2171.8-77.7178.1-177.7176.21112.7G52 L53 I54G52-R56 VanDerWaalsContact O-CG 3.3Å; G52-R56 WeakPolarHBondContact O-CG 3.38Å; G52-R56 PolarHBondContact O-N 3.42Å; L53-R56 PolarHBondContact O-N 3.47Å; L53-R56 VanDerWaalsContact O-N 3.08Å; I54-R56 VanDerWaalsContact C-N 3.29Å; I54-R56 PolarHBondContact O-N 3.18Å
57M40.3Very low35.3Very low31 Ų31124.8 Ų124.815%0.15366%0.655CS.*Hα-helixtrans-76.6-24.7177.5-67177.978.400113.4F33 L53 I54 P59 V172 I176F33-M57 HydrophobicContact CD1-CE 3.17Å; F33-M57 HydrophobicContact CE1-CE 3.35Å; F33-M57 HydrophobicContact CG-CE 4.06Å; F33-M57 HydrophobicContact CZ-CE 4.33Å; L53-M57 WeakPolarHBondContact O-CG 3.45Å; L53-M57 PolarHBondContact O-N 2.93Å; I54-M57 PolarHBondContact O-N 3.4Å; I54-M57 VanDerWaalsContact O-N 3.13Å; M57-P59 WeakPolarHBondContact O-CD 3.35Å; M57-V172 HydrophobicContact CE-CG1 3.94Å; M57-I176 HydrophobicContact CE-CD1 3.88Å; M57-I176 HydrophobicContact SD-CD1 4.15Å
58F39.3Very low35.2Very low87 Ų87123.8 Ų123.838%0.38265%0.645SS.*  trans-118.282178.1-63.8-80000112.5F33 L34 I54 K60F33-F58 HydrophobicContact CB-CZ 4.11Å; L34-F58 HydrophobicContact CG-CZ 4.28Å; I54-F58 HydrophobicContact CG2-CD2 3.89Å; I54-F58 HydrophobicContact CG2-CE2 4.02Å; I54-F58 WeakPolarHBondContact O-CD2 3.3Å; I54-F58 PolarHBondContact O-N 2.81Å; F58-K60 PolarHBondContact O-N 3.45Å
59P37Very low35Very low88 Ų88125.4 Ų125.457%0.57165%0.653SS**PPolyproline II helixtrans-67.6130.3165.826.3-29.5000109.7M57 T61M57-P59 WeakPolarHBondContact O-CD 3.35Å; P59-T61 PolarHBondContact O-N 3.07Å; P59-T61 VanDerWaalsContact O-N 3.15Å
60K29.8Very low34.9Very low214 Ų214128 Ų12893%0.9366%0.658SS**PPolyproline II helixtrans-48121.4176.6-82.3-176.5172.8-176.20110.1F58 S62F58-K60 PolarHBondContact O-N 3.45Å; K60-S62 PolarHBondContact O-N 2.83Å
61T34.2Very low34.6Very low98 Ų98128.3 Ų128.360%0.60167%0.665SS**PPolyproline II helixtrans-69.3117.2174.944.30000110.3P59P59-T61 PolarHBondContact O-N 3.07Å; P59-T61 VanDerWaalsContact O-N 3.15Å
62S35.6Very low34.4Very low97 Ų97128 Ų12868%0.67867%0.673SS**  trans43.6113.6158.360.60000118.8K60 H64K60-S62 PolarHBondContact O-N 2.83Å; S62-H64 PolarHBondContact O-N 3.3Å; S62-H64 VanDerWaalsContact O-N 3.15Å
63A35.7Very low34.1Very low101 Ų101131 Ų13184%0.83569%0.694SS**  trans-54.3107.6161.500000111.7
64H33.3Very low33.7Very low165 Ų165133.1 Ų133.176%0.76471%0.71SS**  trans-136.6112.2157.4-84.9-69.9000109S62S62-H64 PolarHBondContact O-N 3.3Å; S62-H64 VanDerWaalsContact O-N 3.15Å
65E31Very low33.4Very low170 Ų170136.1 Ų136.179%0.79473%0.733SS**  trans49.8123.9160.6-66.9179.1167.100119.7L67E65-L67 PolarHBondContact O-N 3.37Å; E65-L67 VanDerWaalsContact O-N 3.09Å
66P34.9Very low33.2Very low121 Ų121131.1 Ų131.179%0.78673%0.728SS**  trans-69.8109.5175.830-29.5000108.6E68P66-E68 PolarHBondContact O-N 3.03Å
67L30.6Very low32.7Very low177 Ų177129.1 Ų129.193%0.92773%0.727SS**  trans-66.193.5163.7-104.197.7000108.1E65E65-L67 PolarHBondContact O-N 3.37Å; E65-L67 VanDerWaalsContact O-N 3.09Å
68E28.7Very low32.4Very low170 Ų170132.3 Ų132.379%0.79476%0.758SS**  trans-63143.7159.1-74.5-175.4158.800109.9P66P66-E68 PolarHBondContact O-N 3.03Å
69S28.3Very low32.1Very low107 Ų107132.1 Ų132.175%0.74876%0.76SS**  trans107.9118.2153.483.20000117.9
70K28.8Very low32.3Very low183 Ų183133.7 Ų133.780%0.79676%0.763SS**  trans85.495.8149.7-64.1179.7179.7-1790118.2S72K70-S72 PolarHBondContact O-N 3.45Å
71D30.3Very low32.5Very low171 Ų171126.3 Ų126.391%0.91474%0.737SS**  33.680.8122-63.7-29000116.5
72S28.7Very low32.8Very low113 Ų113127.7 Ų127.779%0.7973%0.732SS**  trans-154.1127.5143.861.90000108.4K70 V74K70-S72 PolarHBondContact O-N 3.45Å; S72-V74 PolarHBondContact O-N 2.81Å
73A33.4Very low33.3Very low98 Ų98125.3 Ų125.381%0.8171%0.711SS**  trans-20.4122.6179.600000115.9
74V30.5Very low33.7Very low117 Ų117123.8 Ų123.871%0.70969%0.688SS**  trans-47.8129.7159.3179.80000107.8S72 T76S72-V74 PolarHBondContact O-N 2.81Å; V74-T76 PolarHBondContact O-N 2.79Å
75P31.8Very low34.3Very low123 Ų123119.6 Ų119.680%0.79967%0.671SS**  trans-67.689.5165.627.5-29.1000107.5
76T32.9Very low35Very low118 Ų118112.8 Ų112.872%0.72464%0.641SS**  trans-49.7146153.413.70000109.1V74V74-T76 PolarHBondContact O-N 2.79Å
77E31.4Very low35.6Very low162 Ų162113.7 Ų113.776%0.75763%0.633SS**  trans90.266.8170.8-54.9175.1-169.300117.2I79E77-I79 VanDerWaalsContact C-N 3.27Å; E77-I79 HydrophobicContact CB-CG1 4.17Å; E77-I79 PolarHBondContact O-N 2.8Å; E77-I79 VanDerWaalsContact O-N 3.12Å
78A34.9Very low36.3Very low99 Ų99111.1 Ų111.182%0.81862%0.619SS**  trans-77.481.3152.400000109.3I80A78-I80 PolarHBondContact O-N 3.22Å
79I33.2Very low37Very low82 Ų82108.9 Ų108.942%0.42162%0.623SS.*  trans-64.8117.7174.7-59.1168.1000108.2E77 P81 D123E77-I79 VanDerWaalsContact C-N 3.27Å; E77-I79 HydrophobicContact CB-CG1 4.17Å; E77-I79 PolarHBondContact O-N 2.8Å; E77-I79 VanDerWaalsContact O-N 3.12Å; I79-P81 VanDerWaalsContact O-CD 3.26Å; I79-P81 WeakPolarHBondContact O-CD 3.39Å; I79-D123 HydrophobicContact CG2-CB 4.17Å
80I39.8Very low37.5Very low121 Ų121111.5 Ų111.562%0.62162%0.623SS**  trans-91.5106.2171.1-56.9174.5000107.3A78A78-I80 PolarHBondContact O-N 3.22Å
81P34.5Very low38.1Very low59 Ų59114 Ų11438%0.38363%0.628SS.*PPolyproline II helixtrans-72.3132.1-176.425.6-31.9000112.4I79 D123 V125I79-P81 VanDerWaalsContact O-CD 3.26Å; I79-P81 WeakPolarHBondContact O-CD 3.39Å; P81-D123 WeakPolarHBondContact CA-O 3.4Å; P81-V125 HydrophobicContact CB-CB 4.01Å; P81-V125 HydrophobicContact CB-CG2 3.3Å; P81-V125 HydrophobicContact CG-CG2 4.24Å
82Y41.5Very low38.7Very low128 Ų128113.2 Ų113.250%0.50262%0.623SS.*EExtended strand (participates in β ladder)trans-81.5117.7170.2-89-91.7000109.9A122 D123 F124 V125Y82-A122 HydrophobicContact CD2-CB 3.81Å; Y82-A122 HydrophobicContact CE2-CB 4.05Å; Y82-D123 PolarHBondContact N-O 3.23Å; Y82-D123 VanDerWaalsContact N-O 3.13Å; Y82-F124 HydrophobicContact CG-CE1 4.45Å; Y82-F124 CarbonylContact O-C 3.23Å; Y82-F124 VanDerWaalsContact O-CA 3.31Å; Y82-F124 WeakPolarHBondContact O-CA 3.18Å; Y82-V125 PolarHBondContact O-N 3.41Å
83I44.5Very low39.6Very low47 Ų47111.9 Ų111.924%0.24160%0.603CS.*EExtended strand (participates in β ladder)trans-91.7116.5-175.6-58.6174.5000112.1F42 V125 L127F42-I83 HydrophobicContact CD1-CB 4.18Å; F42-I83 HydrophobicContact CD1-CD1 3.86Å; F42-I83 HydrophobicContact CD1-CG2 4.09Å; F42-I83 HydrophobicContact CD2-CD1 4.29Å; F42-I83 HydrophobicContact CE1-CB 4.19Å; F42-I83 HydrophobicContact CE1-CD1 3.47Å; F42-I83 VanDerWaalsContact CE1-CD1 3.47Å; F42-I83 HydrophobicContact CE1-CG1 4.41Å; F42-I83 HydrophobicContact CE1-CG2 3.75Å; F42-I83 HydrophobicContact CE2-CD1 3.95Å; F42-I83 HydrophobicContact CG-CD1 4.27Å; F42-I83 HydrophobicContact CZ-CD1 3.52Å; I83-V125 CarbonylContact C-O 3.47Å; I83-V125 WeakPolarHBondContact CA-O 3.39Å; I83-V125 HydrophobicContact CG1-CB 4.18Å; I83-V125 HydrophobicContact CG1-CG1 4.35Å; I83-L127 HydrophobicContact CG2-CB 3.55Å; I83-L127 HydrophobicContact CG2-CD1 4.23Å; I83-L127 HydrophobicContact CG2-CG 4.42Å
84I45.2Very low40.2Very low68 Ų68117.8 Ų117.835%0.34961%0.605SS.*EExtended strand (participates in β ladder)trans-109125.5176.3-62.7175.4000110T86 F124 V125 Y126 L127I84-T86 HydrophobicContact CG2-CG2 4.34Å; I84-T86 PolarHBondContact O-N 3.45Å; I84-F124 HydrophobicContact CD1-CB 4.43Å; I84-F124 HydrophobicContact CD1-CD1 3.39Å; I84-F124 HydrophobicContact CD1-CE1 3.88Å; I84-F124 HydrophobicContact CD1-CG 4.13Å; I84-F124 HydrophobicContact CG1-CD1 4.07Å; I84-V125 PolarHBondContact N-O 3.23Å; I84-Y126 HydrophobicContact CB-CD1 3.64Å; I84-Y126 HydrophobicContact CB-CE1 3.8Å; I84-Y126 HydrophobicContact CD1-CE1 3.84Å; I84-Y126 HydrophobicContact CG1-CE1 4.37Å; I84-Y126 HydrophobicContact CG2-CD1 3.86Å; I84-Y126 HydrophobicContact CG2-CE1 3.89Å; I84-Y126 CarbonylContact O-C 3.53Å; I84-Y126 VanDerWaalsContact O-CA 3.24Å; I84-Y126 WeakPolarHBondContact O-CA 3.48Å; I84-L127 PolarHBondContact O-N 3.34Å
85L45.7Very low41Very low78 Ų78116.1 Ų116.141%0.40860%0.603SS.*EExtended strand (participates in β ladder)trans-73.3121.9178.4-68.9168000111.5L127 F132L85-L127 CarbonylContact C-O 3.53Å; L85-L127 VanDerWaalsContact CA-O 3.28Å; L85-L127 WeakPolarHBondContact CA-O 3.31Å; L85-L127 HydrophobicContact CD2-CB 4.42Å; L85-L127 HydrophobicContact CD2-CD2 4.44Å; L85-F132 HydrophobicContact CD1-CD2 4.45Å; L85-F132 HydrophobicContact CD2-CB 3.58Å; L85-F132 HydrophobicContact CD2-CD2 3.86Å; L85-F132 HydrophobicContact CD2-CG 3.79Å
86T45.8Very low41.7Very low26 Ų26113.4 Ų113.416%0.1659%0.587CS.*EExtended strand (participates in β ladder)trans-123.6159.2-178.9670000113.9I84 F93 Y126 L127 I129I84-T86 HydrophobicContact CG2-CG2 4.34Å; I84-T86 PolarHBondContact O-N 3.45Å; T86-F93 HydrophobicContact CG2-CE1 4.22Å; T86-F93 HydrophobicContact CG2-CZ 4.23Å; T86-Y126 HydrophobicContact CG2-CD1 3.26Å; T86-Y126 HydrophobicContact CG2-CE1 4.14Å; T86-Y126 HydrophobicContact CG2-CG 3.88Å; T86-L127 PolarHBondContact N-O 2.84Å; T86-I129 PolarHBondContact O-N 3.38Å
87K47.6Very low42.1Very low141 Ų141114.8 Ų114.861%0.61358%0.579SS**SBendtrans-81-36.5-176.7-104.1-176.1177.6175.90114.8I129K87-I129 HydrophobicContact CG-CD1 4.4Å
88N45.3Very low42.7Very low122 Ų122111.9 Ų111.965%0.65257%0.569SS**  trans-131129.2-163.5-72.6-7.8000112Q90N88-Q90 VanDerWaalsContact C-N 3.31Å; N88-Q90 PolarHBondContact O-N 2.85Å
89S43.7Very low43.3Very low124 Ų124114.9 Ų114.987%0.86756%0.563SS**  trans-80.711-177.553.10000115.5
90Q37.9Very low43.8Very low162 Ų162115.6 Ų115.676%0.75757%0.567SS**SBendtrans-141.3118-174-71.7-170.4-17.800116.7N88 D92N88-Q90 VanDerWaalsContact C-N 3.31Å; N88-Q90 PolarHBondContact O-N 2.85Å; Q90-D92 PolarHBondContact O-N 3.4Å
91R42.1Very low43.9Very low235 Ų235114.5 Ų114.589%0.88756%0.559SS**SBendtrans66.1-12.9139.6-77.9-172-179.2178.81.7127.2
92D42Very low44.3Very low154 Ų154118.7 Ų118.782%0.82457%0.574SS**  trans-106.339.7178.6-77.1-23.6000115.4Q90Q90-D92 PolarHBondContact O-N 3.4Å
93F48.4Very low44.3Very low85 Ų85115.6 Ų115.637%0.37357%0.571SS.*  trans-79.1-12.6-174.5-85.2-84.8000116.2T86 R97 Y126T86-F93 HydrophobicContact CG2-CE1 4.22Å; T86-F93 HydrophobicContact CG2-CZ 4.23Å; F93-R97 PolarHBondContact O-N 3.36Å; F93-Y126 HydrophobicContact CE1-CD1 4.42Å; F93-Y126 HydrophobicContact CE1-CE1 4.5Å; F93-Y126 HydrophobicContact CE1-CG 4.46Å
94R45.4Very low44.1Very low223 Ų223118.1 Ų118.184%0.84259%0.588SS**Hα-helixtrans-69-42.6-174.2-80.9-174.6176.2-179.2-1.6113.3S96 R97R94-S96 VanDerWaalsContact C-N 3.34Å; R94-S96 PolarHBondContact O-N 3.01Å; R94-R97 PolarHBondContact O-N 3.47Å
95A47.2Very low43.8Very low81 Ų81122 Ų12267%0.66961%0.605SS**Hα-helixtrans-72-25.2-176.800000114
96S47.6Very low43.4Very low66 Ų66122.8 Ų122.846%0.46262%0.617SS.*Hα-helixtrans-86-23.4177.6-163.20000113.1R94 I100R94-S96 VanDerWaalsContact C-N 3.34Å; R94-S96 PolarHBondContact O-N 3.01Å; S96-I100 WeakPolarHBondContact O-CG1 3.31Å; S96-I100 PolarHBondContact O-N 3.11Å
97R39.9Very low42.8Very low148 Ų148130 Ų13056%0.55865%0.648SS**Hα-helixtrans-63.7-46.7177.4-173.4177.4171.8158.30.1110.6F93 R94 K99 I100 Q101F93-R97 PolarHBondContact O-N 3.36Å; R94-R97 PolarHBondContact O-N 3.47Å; R97-K99 PolarHBondContact O-N 2.98Å; R97-I100 PolarHBondContact O-N 2.61Å; R97-Q101 WeakPolarHBondContact O-CB 3.24Å; R97-Q101 PolarHBondContact O-N 3.46Å
98D45.2Very low42Very low101 Ų101125.4 Ų125.454%0.5464%0.641SS.*Hα-helixtrans-66.9-40.1-176.4-62.2-18.4000112.3I100 Q101 E102D98-I100 PolarHBondContact O-N 2.89Å; D98-Q101 PolarHBondContact O-N 2.87Å; D98-E102 PolarHBondContact O-N 2.93Å
99K46.6Very low41.2Very low161 Ų161129.3 Ų129.370%0.766%0.656SS**Hα-helixtrans-66.3-38.2177.6-83.7-173.5174.6-178.80113.8R97 S103R97-K99 PolarHBondContact O-N 2.98Å; K99-S103 WeakPolarHBondContact O-CB 3.49Å; K99-S103 PolarHBondContact O-N 2.83Å
100I43.1Very low40.5Very low97 Ų97128.9 Ų128.950%0.49765%0.653SS.*Hα-helixtrans-71.2-39.6178-66.3171.2000109.1S96 R97 D98 S103 V104S96-I100 WeakPolarHBondContact O-CG1 3.31Å; S96-I100 PolarHBondContact O-N 3.11Å; R97-I100 PolarHBondContact O-N 2.61Å; D98-I100 PolarHBondContact O-N 2.89Å; I100-S103 PolarHBondContact O-N 3.21Å; I100-S103 PolarHBondContact O-OG 2.94Å; I100-V104 HydrophobicContact CG2-CG2 4.31Å; I100-V104 WeakPolarHBondContact O-CG2 3.49Å; I100-V104 PolarHBondContact O-N 2.91Å
101Q41.6Very low39.9Very low99 Ų99125.5 Ų125.546%0.46365%0.652SS.*Hα-helixtrans-67.7-37.7178.6-147.7164.9-12.500112.4R97 D98 H105R97-Q101 WeakPolarHBondContact O-CB 3.24Å; R97-Q101 PolarHBondContact O-N 3.46Å; D98-Q101 PolarHBondContact O-N 2.87Å; Q101-H105 PolarHBondContact O-N 3.25Å; Q101-H105 VanDerWaalsContact O-N 3.13Å
102E43.5Very low39.1Very low146 Ų146121.5 Ų121.568%0.68265%0.647SS**Hα-helixtrans-66.1-40.4171.4-79.8-176.5162.800112.5D98 V104 H105 S106D98-E102 PolarHBondContact O-N 2.93Å; E102-V104 VanDerWaalsContact C-N 3.34Å; E102-V104 PolarHBondContact O-N 3.37Å; E102-H105 PolarHBondContact O-N 3.09Å; E102-S106 PolarHBondContact O-N 3.46Å
103S42.4Very low38.3Very low63 Ų63123.5 Ų123.544%0.44165%0.652SS.*Hα-helixtrans-66.2-37.517976.10000112.5K99 I100 S106K99-S103 WeakPolarHBondContact O-CB 3.49Å; K99-S103 PolarHBondContact O-N 2.83Å; I100-S103 PolarHBondContact O-N 3.21Å; I100-S103 PolarHBondContact O-OG 2.94Å; S103-S106 PolarHBondContact O-N 2.74Å; S103-S106 PolarHBondContact O-OG 3.29Å
104V39.7Very low37.4Very low101 Ų101125.8 Ų125.861%0.61267%0.667SS**Hα-helixtrans-73.1-35.1-179.9175.20000110.9I100 E102 S106I100-V104 HydrophobicContact CG2-CG2 4.31Å; I100-V104 WeakPolarHBondContact O-CG2 3.49Å; I100-V104 PolarHBondContact O-N 2.91Å; E102-V104 VanDerWaalsContact C-N 3.34Å; E102-V104 PolarHBondContact O-N 3.37Å; V104-S106 VanDerWaalsContact C-N 3.29Å; V104-S106 PolarHBondContact O-N 2.83Å
105H38.8Very low36.7Very low149 Ų149123.3 Ų123.369%0.6966%0.662SS**Hα-helixtrans-66.4-29174.1-90-53.7000113.3Q101 E102 Q107Q101-H105 PolarHBondContact O-N 3.25Å; Q101-H105 VanDerWaalsContact O-N 3.13Å; E102-H105 PolarHBondContact O-N 3.09Å; H105-Q107 VanDerWaalsContact C-N 3.35Å; H105-Q107 PolarHBondContact O-N 3.22Å
106S37.6Very low35.9Very low95 Ų95127.5 Ų127.566%0.66467%0.674SS**Hα-helixtrans-75.5-15.8-178.3720000115.4E102 S103 V104E102-S106 PolarHBondContact O-N 3.46Å; S103-S106 PolarHBondContact O-N 2.74Å; S103-S106 PolarHBondContact O-OG 3.29Å; V104-S106 VanDerWaalsContact C-N 3.29Å; V104-S106 PolarHBondContact O-N 2.83Å
107Q33.3Very low34.9Very low176 Ų176131 Ų13182%0.82268%0.683SS**THydrogen-bonded Turntrans-108.514.9-179.2-69.3-170.8-13.500113.6H105H105-Q107 VanDerWaalsContact C-N 3.35Å; H105-Q107 PolarHBondContact O-N 3.22Å
108G29.6Very low34.6Very low45 Ų45129 Ų12946%0.46469%0.689SS.*  trans-92.6-0.5-172.800000117.6S110G108-S110 VanDerWaalsContact C-N 3.34Å; G108-S110 PolarHBondContact O-N 3.07Å
109E28.9Very low34.1Very low204 Ų204133.7 Ų133.795%0.95370%0.701SS**THydrogen-bonded Turntrans-8614.7-172.1-75.3-16816300116
110S29.4Very low33.2Very low116 Ų116133.1 Ų133.181%0.81170%0.704SS**THydrogen-bonded Turntrans-133.718.5172.293.60000116.3G108G108-S110 VanDerWaalsContact C-N 3.34Å; G108-S110 PolarHBondContact O-N 3.07Å
111A26.7Very low32.7Very low90 Ų90133.1 Ų133.174%0.74471%0.713SS**SBendtrans-107.6109.5171.900000109.9
112I24.9Very low32.8Very low151 Ų151130.7 Ų130.777%0.77471%0.71SS**  trans-50.5134.6-176.4-67.7161.8000112.4L114I112-L114 PolarHBondContact O-N 3.17Å
113E24.9Very low32.5Very low197 Ų197128.1 Ų128.192%0.92170%0.701SS**  trans-45.783.7178.4-60.9171.8148.800115.3
114L28.5Very low32.7Very low133 Ų133130.1 Ų130.170%0.69670%0.702SS**  trans-106.97.5178.7-96.9161.2000115.9I112I112-L114 PolarHBondContact O-N 3.17Å
115F31.3Very low33.1Very low170 Ų170128.2 Ų128.275%0.74669%0.69SS**  trans-137.682.5-179.3-66.1-77.7000113.1E117F115-E117 VanDerWaalsContact C-N 3.26Å; F115-E117 PolarHBondContact O-N 3.12Å
116N29.5Very low33.7Very low170 Ų170125.7 Ų125.791%0.90968%0.675SS**  trans-90.944.2165.3-99.8-14.7000111.9
117E27.1Very low34.6Very low139 Ų139121.8 Ų121.865%0.6565%0.647SS**  trans-129.293.7172.2-82.9-79.8168.500107.8F115 Y119F115-E117 VanDerWaalsContact C-N 3.26Å; F115-E117 PolarHBondContact O-N 3.12Å; E117-Y119 PolarHBondContact O-N 2.86Å
118P34.9Very low35.7Very low106 Ų106114.3 Ų114.369%0.68862%0.617SS**THydrogen-bonded Turntrans-7929.8-164.331.9-35.3000115.1
119Y32.9Very low37.1Very low200 Ų200114.2 Ų114.278%0.78461%0.605SS**THydrogen-bonded Turntrans-124.618.6-172.4-51.5-68.9000116E117E117-Y119 PolarHBondContact O-N 2.86Å
120L28.3Very low38.7Very low149 Ų149112.4 Ų112.478%0.7860%0.597SS**  trans-102.787173.7-80.8158.7000111.7
121S33.1Very low40.2Very low96 Ų96111 Ų11167%0.67158%0.578SS**  trans-85.2111.716661.40000110.2D123S121-D123 PolarHBondContact O-N 2.88Å
122A43.1Very low41.9Very low49 Ų49107.8 Ų107.841%0.40555%0.547SS..  trans-77.7114.5176.700000111.3Y82Y82-A122 HydrophobicContact CD2-CB 3.81Å; Y82-A122 HydrophobicContact CE2-CB 4.05Å
123D37.5Very low43.7Very low91 Ų91103.7 Ų103.749%0.48752%0.523SS..  trans-84.8123.3165.5-90.8-26.6000110I79 P81 Y82 S121I79-D123 HydrophobicContact CG2-CB 4.17Å; P81-D123 WeakPolarHBondContact CA-O 3.4Å; Y82-D123 PolarHBondContact N-O 3.23Å; Y82-D123 VanDerWaalsContact N-O 3.13Å; S121-D123 PolarHBondContact O-N 2.88Å
124F47.3Very low45.6Very low105 Ų10596.7 Ų96.746%0.46150%0.496SS..EExtended strand (participates in β ladder)trans-79.4124174.1-64.9-83.7000110Y82 I84 Y126Y82-F124 HydrophobicContact CG-CE1 4.45Å; Y82-F124 CarbonylContact O-C 3.23Å; Y82-F124 VanDerWaalsContact O-CA 3.31Å; Y82-F124 WeakPolarHBondContact O-CA 3.18Å; I84-F124 HydrophobicContact CD1-CB 4.43Å; I84-F124 HydrophobicContact CD1-CD1 3.39Å; I84-F124 HydrophobicContact CD1-CE1 3.88Å; I84-F124 HydrophobicContact CD1-CG 4.13Å; I84-F124 HydrophobicContact CG1-CD1 4.07Å; F124-Y126 HydrophobicContact CB-CE2 4.09Å
125V48.2Very low47.3Very low62 Ų6290.5 Ų90.538%0.37646%0.464SS..EExtended strand (participates in β ladder)trans-99.7111.3172.31710000108.8P81 Y82 I83 I84P81-V125 HydrophobicContact CB-CB 4.01Å; P81-V125 HydrophobicContact CB-CG2 3.3Å; P81-V125 HydrophobicContact CG-CG2 4.24Å; Y82-V125 PolarHBondContact O-N 3.41Å; I83-V125 CarbonylContact C-O 3.47Å; I83-V125 WeakPolarHBondContact CA-O 3.39Å; I83-V125 HydrophobicContact CG1-CB 4.18Å; I83-V125 HydrophobicContact CG1-CG1 4.35Å; I84-V125 PolarHBondContact N-O 3.23Å
126Y51.7Low48.8Very low95 Ų9583.7 Ų83.737%0.37343%0.434SS..EExtended strand (participates in β ladder)trans-84119.5178.7-63-79.8000110.3I84 T86 F93 F124I84-Y126 HydrophobicContact CB-CD1 3.64Å; I84-Y126 HydrophobicContact CB-CE1 3.8Å; I84-Y126 HydrophobicContact CD1-CE1 3.84Å; I84-Y126 HydrophobicContact CG1-CE1 4.37Å; I84-Y126 HydrophobicContact CG2-CD1 3.86Å; I84-Y126 HydrophobicContact CG2-CE1 3.89Å; I84-Y126 CarbonylContact O-C 3.53Å; I84-Y126 VanDerWaalsContact O-CA 3.24Å; I84-Y126 WeakPolarHBondContact O-CA 3.48Å; T86-Y126 HydrophobicContact CG2-CD1 3.26Å; T86-Y126 HydrophobicContact CG2-CE1 4.14Å; T86-Y126 HydrophobicContact CG2-CG 3.88Å; F93-Y126 HydrophobicContact CE1-CD1 4.42Å; F93-Y126 HydrophobicContact CE1-CE1 4.5Å; F93-Y126 HydrophobicContact CE1-CG 4.46Å; F124-Y126 HydrophobicContact CB-CE2 4.09Å
127L56.4Low50.5Low13 Ų1380.1 Ų80.17%0.06842%0.415CS..EExtended strand (participates in β ladder)trans-107.7131.2-179.1-151.3116.2000110F42 I83 I84 L85 T86 E131 F132 I135F42-L127 HydrophobicContact CE1-CD1 4.43Å; F42-L127 HydrophobicContact CE1-CD2 4.36Å; F42-L127 HydrophobicContact CZ-CD1 4.39Å; I83-L127 HydrophobicContact CG2-CB 3.55Å; I83-L127 HydrophobicContact CG2-CD1 4.23Å; I83-L127 HydrophobicContact CG2-CG 4.42Å; I84-L127 PolarHBondContact O-N 3.34Å; L85-L127 CarbonylContact C-O 3.53Å; L85-L127 VanDerWaalsContact CA-O 3.28Å; L85-L127 WeakPolarHBondContact CA-O 3.31Å; L85-L127 HydrophobicContact CD2-CB 4.42Å; L85-L127 HydrophobicContact CD2-CD2 4.44Å; T86-L127 PolarHBondContact N-O 2.84Å; L127-E131 HydrophobicContact CD2-CB 3.84Å; L127-E131 HydrophobicContact CG-CB 4.06Å; L127-F132 HydrophobicContact CD2-CB 3.92Å; L127-I135 HydrophobicContact CD1-CD1 4.35Å; L127-I135 HydrophobicContact CD2-CD1 3.87Å
128G56.5Low52.4Low19 Ų1975 Ų7520%0.19639%0.391CS..EExtended strand (participates in β ladder)trans-69149.4179.100000112.3E130 E131 F132G128-E130 PolarHBondContact O-N 3.45Å; G128-E131 PolarHBondContact N-OE2 3.31Å; G128-E131 WeakPolarHBondContact O-CB 3.34Å; G128-E131 PolarHBondContact O-N 3.4Å; G128-E131 VanDerWaalsContact O-N 3.07Å; G128-F132 PolarHBondContact O-N 2.97Å
129I58.8Low53.7Low43 Ų4370 Ų7022%0.22136%0.359CS..Hα-helixtrans-56.6-35.9176.2-66.8170.3000112T86 K87 K133 Q199T86-I129 PolarHBondContact O-N 3.38Å; K87-I129 HydrophobicContact CG-CD1 4.4Å; I129-K133 WeakPolarHBondContact O-CG 3.33Å; I129-K133 PolarHBondContact O-N 3.41Å; I129-Q199 HydrophobicContact CD1-CB 4.35Å
130E61.6Low55.1Low166 Ų16665.8 Ų65.878%0.77634%0.342SS*.Hα-helixtrans-70-37.3176.5-65.8-151.4156.400112.6G128 K133 S134G128-E130 PolarHBondContact O-N 3.45Å; E130-K133 PolarHBondContact O-N 3.41Å; E130-S134 PolarHBondContact O-N 3.34Å
131E62.1Low56.8Low88 Ų8862.7 Ų62.741%0.41133%0.327SS..Hα-helixtrans-64.6-43175-60.6174.9150.100110.2M1 L127 G128 K133 S134 I135M1-E131 HydrophobicContact CG-CB 4.46Å; M1-E131 HydrophobicContact SD-CB 4.16Å; L127-E131 HydrophobicContact CD2-CB 3.84Å; L127-E131 HydrophobicContact CG-CB 4.06Å; G128-E131 PolarHBondContact N-OE2 3.31Å; G128-E131 WeakPolarHBondContact O-CB 3.34Å; G128-E131 PolarHBondContact O-N 3.4Å; G128-E131 VanDerWaalsContact O-N 3.07Å; E131-K133 PolarHBondContact O-N 2.93Å; E131-S134 WeakPolarHBondContact O-CB 3.28Å; E131-S134 PolarHBondContact O-N 2.82Å; E131-I135 VanDerWaalsContact O-CG1 3.28Å; E131-I135 WeakPolarHBondContact O-CG1 3.27Å; E131-I135 PolarHBondContact O-N 3.48Å
132F61.2Low58.2Low22 Ų2258.4 Ų58.410%0.09630%0.296CS..Hα-helixtrans-61.5-42.4174.1-178.6-97.3000112.3L85 L127 G128 I135 F136 F180 L203L85-F132 HydrophobicContact CD1-CD2 4.45Å; L85-F132 HydrophobicContact CD2-CB 3.58Å; L85-F132 HydrophobicContact CD2-CD2 3.86Å; L85-F132 HydrophobicContact CD2-CG 3.79Å; L127-F132 HydrophobicContact CD2-CB 3.92Å; G128-F132 PolarHBondContact O-N 2.97Å; F132-I135 PolarHBondContact O-N 3.36Å; F132-F136 VanDerWaalsContact O-CB 3.31Å; F132-F136 WeakPolarHBondContact O-CB 3.45Å; F132-F136 PolarHBondContact O-N 3.46Å; F132-F180 HydrophobicContact CE2-CZ 4.25Å; F132-F180 HydrophobicContact CZ-CZ 4.48Å; F132-L203 HydrophobicContact CD1-CD1 4.05Å; F132-L203 HydrophobicContact CD1-CD2 4.15Å; F132-L203 HydrophobicContact CE1-CD1 4.2Å; F132-L203 HydrophobicContact CE1-CD2 3.97Å; F132-L203 HydrophobicContact CE1-CG 4.38Å
133K63Low58.9Low64 Ų6457.2 Ų57.228%0.27828%0.283SS..Hα-helixtrans-62.4-41.1174.2-80.3-178.1175.4-174.30112.2I129 E130 E131 F136 N137 L203 Q206I129-K133 WeakPolarHBondContact O-CG 3.33Å; I129-K133 PolarHBondContact O-N 3.41Å; E130-K133 PolarHBondContact O-N 3.41Å; E131-K133 PolarHBondContact O-N 2.93Å; K133-F136 PolarHBondContact O-N 3.07Å; K133-N137 WeakPolarHBondContact O-CB 3.46Å; K133-N137 VanDerWaalsContact O-CG 3.25Å; K133-N137 PolarHBondContact O-N 2.96Å; K133-N137 PolarHBondContact O-ND2 3.49Å; K133-L203 HydrophobicContact CG-CD1 4.11Å; K133-Q206 VanDerWaalsContact CE-OE1 3.26Å
134S64.9Low60.2Low50 Ų5057 Ų5735%0.3528%0.281SS..Hα-helixtrans-61.2-49.4176.7-170.20000111.3E130 E131 F136 N137 Q138E130-S134 PolarHBondContact O-N 3.34Å; E131-S134 WeakPolarHBondContact O-CB 3.28Å; E131-S134 PolarHBondContact O-N 2.82Å; S134-F136 VanDerWaalsContact C-N 3.3Å; S134-F136 PolarHBondContact O-N 3.23Å; S134-N137 PolarHBondContact O-N 3.22Å; S134-Q138 WeakPolarHBondContact O-CG 3.43Å; S134-Q138 PolarHBondContact O-N 3.47Å
135I63.7Low60.8Low3 Ų359.8 Ų59.82%0.01530%0.296CS..Hα-helixtrans-56.1-45.5174.9-70.2178000110.8M1 F4 F39 F42 L127 E131 F132 Q138 L139M1-I135 HydrophobicContact CE-CD1 4.33Å; M1-I135 HydrophobicContact CE-CG1 3.69Å; M1-I135 HydrophobicContact SD-CD1 3.5Å; M1-I135 VanDerWaalsContact SD-CD1 3.5Å; M1-I135 HydrophobicContact SD-CG1 3.57Å; M1-I135 VanDerWaalsContact SD-CG1 3.57Å; F4-I135 HydrophobicContact CD1-CG1 4.05Å; F4-I135 HydrophobicContact CD1-CG2 4.43Å; F4-I135 HydrophobicContact CE1-CB 4.24Å; F4-I135 HydrophobicContact CE1-CG1 4.25Å; F4-I135 HydrophobicContact CE1-CG2 3.94Å; F4-I135 HydrophobicContact CE2-CG2 4.13Å; F4-I135 HydrophobicContact CG-CG1 4.45Å; F4-I135 HydrophobicContact CZ-CG2 3.8Å; F39-I135 HydrophobicContact CE1-CG2 3.21Å; F39-I135 HydrophobicContact CE2-CG2 4.46Å; F39-I135 HydrophobicContact CZ-CG2 3.16Å; F42-I135 HydrophobicContact CZ-CD1 3.97Å; L127-I135 HydrophobicContact CD1-CD1 4.35Å; L127-I135 HydrophobicContact CD2-CD1 3.87Å; E131-I135 VanDerWaalsContact O-CG1 3.28Å; E131-I135 WeakPolarHBondContact O-CG1 3.27Å; E131-I135 PolarHBondContact O-N 3.48Å; F132-I135 PolarHBondContact O-N 3.36Å; I135-Q138 PolarHBondContact O-N 3.29Å; I135-L139 PolarHBondContact O-N 2.83Å
136F63Low61.4Low27 Ų2761 Ų6112%0.11831%0.305CS..Hα-helixtrans-67.7-38.3-178.7-166.1-92.1000112.8F132 K133 S134 L139 Y140 L181 F210F132-F136 VanDerWaalsContact O-CB 3.31Å; F132-F136 WeakPolarHBondContact O-CB 3.45Å; F132-F136 PolarHBondContact O-N 3.46Å; K133-F136 PolarHBondContact O-N 3.07Å; S134-F136 VanDerWaalsContact C-N 3.3Å; S134-F136 PolarHBondContact O-N 3.23Å; F136-L139 VanDerWaalsContact O-CB 3.32Å; F136-L139 WeakPolarHBondContact O-CB 3.28Å; F136-L139 PolarHBondContact O-N 3.45Å; F136-Y140 PolarHBondContact O-N 2.86Å; F136-L181 HydrophobicContact CE2-CD2 3.85Å; F136-L181 HydrophobicContact CZ-CD2 4.04Å; F136-F210 HydrophobicContact CE1-CB 4.2Å; F136-F210 HydrophobicContact CE1-CD1 4.11Å; F136-F210 HydrophobicContact CE1-CD2 4.36Å; F136-F210 AromaticContact CE1-CG 3.94Å; F136-F210 HydrophobicContact CE1-CG 3.94Å; F136-F210 HydrophobicContact CZ-CB 4.27Å; F136-F210 AromaticContact CZ-CD1 3.59Å; F136-F210 HydrophobicContact CZ-CD1 3.59Å; F136-F210 HydrophobicContact CZ-CE1 4.05Å; F136-F210 AromaticContact CZ-CG 3.89Å; F136-F210 HydrophobicContact CZ-CG 3.89Å
137N64.7Low61.9Low96 Ų9657.1 Ų57.151%0.51329%0.291SS..Hα-helixtrans-67.5-41.2175.5-73.2-17.4000111.7K133 S134 L139 Y140 D141K133-N137 WeakPolarHBondContact O-CB 3.46Å; K133-N137 VanDerWaalsContact O-CG 3.25Å; K133-N137 PolarHBondContact O-N 2.96Å; K133-N137 PolarHBondContact O-ND2 3.49Å; S134-N137 PolarHBondContact O-N 3.22Å; N137-L139 VanDerWaalsContact C-N 3.28Å; N137-L139 PolarHBondContact O-N 2.73Å; N137-Y140 VanDerWaalsContact O-CB 3.27Å; N137-Y140 WeakPolarHBondContact O-CB 3.29Å; N137-Y140 PolarHBondContact O-N 3.39Å; N137-Y140 VanDerWaalsContact O-N 3.11Å; N137-D141 PolarHBondContact O-N 2.97Å; N137-D141 VanDerWaalsContact O-N 3.09Å
138Q66.9Low62.3Low30 Ų3057.3 Ų57.314%0.1429%0.293CS..Hα-helixtrans-61.5-38.1173.6-73.3169.3-21.300111.2F4 D5 Y8 S134 I135 D141 L142F4-Q138 VanDerWaalsContact CD1-OE1 3.29Å; F4-Q138 HydrophobicContact CE1-CB 4.08Å; D5-Q138 PolarHBondContact OD1-NE2 2.97Å; D5-Q138 PolarHBondContact OD1-OE1 3.27Å; Y8-Q138 HydrophobicContact CD1-CB 4.26Å; Y8-Q138 HydrophobicContact CD1-CG 3.99Å; Y8-Q138 HydrophobicContact CD2-CB 3.76Å; Y8-Q138 HydrophobicContact CD2-CG 4.39Å; Y8-Q138 HydrophobicContact CE1-CB 4.17Å; Y8-Q138 HydrophobicContact CE1-CG 3.83Å; Y8-Q138 HydrophobicContact CE2-CB 3.68Å; Y8-Q138 HydrophobicContact CE2-CG 4.27Å; Y8-Q138 WeakPolarHBondContact CE2-O 3.28Å; Y8-Q138 HydrophobicContact CG-CB 4.06Å; Y8-Q138 HydrophobicContact CG-CG 4.27Å; S134-Q138 WeakPolarHBondContact O-CG 3.43Å; S134-Q138 PolarHBondContact O-N 3.47Å; I135-Q138 PolarHBondContact O-N 3.29Å; Q138-D141 PolarHBondContact O-N 2.96Å; Q138-L142 PolarHBondContact O-N 2.74Å; Q138-L142 VanDerWaalsContact O-N 3.15Å
139L62.9Low62.9Low3 Ų358.8 Ų58.82%0.01630%0.303CS..Hα-helixtrans-61.8-42.7170.5-102.8172000113.5F39 I135 F136 N137 D141 L142 L143 M177F39-L139 HydrophobicContact CD1-CD1 3.78Å; F39-L139 HydrophobicContact CD2-CD1 3.77Å; F39-L139 HydrophobicContact CD2-CD2 4.07Å; F39-L139 HydrophobicContact CD2-CG 4.08Å; F39-L139 HydrophobicContact CE1-CD1 3.27Å; F39-L139 HydrophobicContact CE1-CG 4.2Å; F39-L139 HydrophobicContact CE2-CD1 3.23Å; F39-L139 HydrophobicContact CE2-CD2 3.67Å; F39-L139 HydrophobicContact CE2-CG 3.29Å; F39-L139 HydrophobicContact CG-CD1 4Å; F39-L139 HydrophobicContact CZ-CD1 2.96Å; F39-L139 HydrophobicContact CZ-CD2 4.26Å; F39-L139 HydrophobicContact CZ-CG 3.38Å; I135-L139 PolarHBondContact O-N 2.83Å; F136-L139 VanDerWaalsContact O-CB 3.32Å; F136-L139 WeakPolarHBondContact O-CB 3.28Å; F136-L139 PolarHBondContact O-N 3.45Å; N137-L139 VanDerWaalsContact C-N 3.28Å; N137-L139 PolarHBondContact O-N 2.73Å; L139-D141 PolarHBondContact O-N 3.26Å; L139-L142 PolarHBondContact O-N 3.35Å; L139-L143 WeakPolarHBondContact O-CG 3.48Å; L139-L143 PolarHBondContact O-N 3.42Å; L139-M177 HydrophobicContact CB-CE 4.1Å; L139-M177 HydrophobicContact CD1-CE 3.98Å; L139-M177 HydrophobicContact CD1-SD 3.59Å; L139-M177 VanDerWaalsContact CD1-SD 3.59Å; L139-M177 HydrophobicContact CD2-CE 4.08Å; L139-M177 HydrophobicContact CD2-CG 4.38Å; L139-M177 HydrophobicContact CD2-SD 3.82Å; L139-M177 HydrophobicContact CG-CE 4.31Å; L139-M177 HydrophobicContact CG-SD 4.25Å
140Y62.3Low63.4Low110 Ų11058.6 Ų58.643%0.43130%0.304SS..Hα-helixtrans-55.6-44.7177.2-179.3-82.8000110.7F136 N137 L143 N144 F210F136-Y140 PolarHBondContact O-N 2.86Å; N137-Y140 VanDerWaalsContact O-CB 3.27Å; N137-Y140 WeakPolarHBondContact O-CB 3.29Å; N137-Y140 PolarHBondContact O-N 3.39Å; N137-Y140 VanDerWaalsContact O-N 3.11Å; Y140-L143 PolarHBondContact O-N 2.95Å; Y140-N144 PolarHBondContact O-N 3.4Å; Y140-F210 AromaticContact CD2-CD2 3.42Å; Y140-F210 HydrophobicContact CD2-CD2 3.42Å; Y140-F210 VanDerWaalsContact CD2-CD2 3.42Å; Y140-F210 AromaticContact CD2-CE2 3.17Å; Y140-F210 HydrophobicContact CD2-CE2 3.17Å; Y140-F210 HydrophobicContact CD2-CZ 4.32Å; Y140-F210 AromaticContact CE2-CD2 3.64Å; Y140-F210 HydrophobicContact CE2-CD2 3.64Å; Y140-F210 AromaticContact CE2-CE2 3.53Å; Y140-F210 HydrophobicContact CE2-CE2 3.53Å; Y140-F210 HydrophobicContact CG-CE2 4.27Å
141D65Low63.8Low85 Ų8550.9 Ų50.946%0.45527%0.268SS..Hα-helixtrans-66.2-39.9179.8-68.5-21.4000112.2Y8 N137 Q138 L139 L143 N144Y8-D141 WeakPolarHBondContact OH-CB 3.48Å; N137-D141 PolarHBondContact O-N 2.97Å; N137-D141 VanDerWaalsContact O-N 3.09Å; Q138-D141 PolarHBondContact O-N 2.96Å; L139-D141 PolarHBondContact O-N 3.26Å; D141-L143 VanDerWaalsContact C-N 3.34Å; D141-L143 PolarHBondContact O-N 2.81Å; D141-N144 WeakPolarHBondContact O-CB 3.41Å; D141-N144 PolarHBondContact O-N 2.92Å
142L61.2Low64.3Low5 Ų548.1 Ų48.13%0.02626%0.256CS..Hα-helixtrans-65.3-33.3173.6-89.9166.1000113.4Y8 C11 L32 L35 Q138 L139 N144 C147Y8-L142 HydrophobicContact CD2-CD1 3.51Å; Y8-L142 HydrophobicContact CD2-CG 3.92Å; Y8-L142 HydrophobicContact CE2-CD1 3.86Å; Y8-L142 HydrophobicContact CE2-CG 3.75Å; C11-L142 HydrophobicContact CB-CD2 3.9Å; L32-L142 HydrophobicContact CD1-CD2 3.98Å; L35-L142 HydrophobicContact CD2-CD1 3.74Å; Q138-L142 PolarHBondContact O-N 2.74Å; Q138-L142 VanDerWaalsContact O-N 3.15Å; L139-L142 PolarHBondContact O-N 3.35Å; L142-N144 VanDerWaalsContact C-N 3.26Å; L142-N144 PolarHBondContact O-N 3.25Å; L142-C147 PolarHBondContact O-SG 3.32Å; L142-C147 VanDerWaalsContact O-SG 3.33Å
143L59Low64.9Low25 Ų2553.3 Ų53.313%0.13128%0.28CS..THydrogen-bonded Turntrans-83.42.1179.1-73.1-170.7000114L139 Y140 D141 Q145 L148 A173 M177 F210L139-L143 WeakPolarHBondContact O-CG 3.48Å; L139-L143 PolarHBondContact O-N 3.42Å; Y140-L143 PolarHBondContact O-N 2.95Å; D141-L143 VanDerWaalsContact C-N 3.34Å; D141-L143 PolarHBondContact O-N 2.81Å; L143-Q145 PolarHBondContact O-N 3.5Å; L143-L148 HydrophobicContact CD2-CD1 4.39Å; L143-L148 HydrophobicContact CD2-CD2 4.07Å; L143-L148 WeakPolarHBondContact O-CD1 3.12Å; L143-A173 HydrophobicContact CD2-CB 4.09Å; L143-M177 HydrophobicContact CD1-CB 4.18Å; L143-M177 HydrophobicContact CD1-CE 3.19Å; L143-M177 HydrophobicContact CD1-CG 3.85Å; L143-M177 HydrophobicContact CD1-SD 4.31Å; L143-M177 HydrophobicContact CG-CE 4.19Å; L143-F210 HydrophobicContact CD1-CZ 4.19Å
144N63.7Low65.4Low86 Ų8651.3 Ų51.346%0.4627%0.271SS..SBendtrans-63.9140.2179.6-154.4-9.4000110.4Y140 D141 L142 P146 C147 L148Y140-N144 PolarHBondContact O-N 3.4Å; D141-N144 WeakPolarHBondContact O-CB 3.41Å; D141-N144 PolarHBondContact O-N 2.92Å; L142-N144 VanDerWaalsContact C-N 3.26Å; L142-N144 PolarHBondContact O-N 3.25Å; N144-P146 VanDerWaalsContact C-N 3.31Å; N144-P146 VanDerWaalsContact O-N 3.12Å; N144-C147 WeakPolarHBondContact O-CB 3.25Å; N144-C147 PolarHBondContact O-N 3.29Å; N144-L148 PolarHBondContact O-N 2.59Å; N144-L148 VanDerWaalsContact O-N 3.14Å
145Q59.7Low65.6Low164 Ų16449.6 Ų49.677%0.76626%0.257SS*.Hα-helixtrans-52.2-38.1-169.6-159.7-175.52.800114.4L143 A149L143-Q145 PolarHBondContact O-N 3.5Å; Q145-A149 WeakPolarHBondContact O-CB 3.25Å; Q145-A149 PolarHBondContact O-N 3.44Å; Q145-A149 VanDerWaalsContact O-N 3.09Å
146P61.2Low65.9Low88 Ų8854 Ų5457%0.57128%0.284SS*.Hα-helixtrans-64.7-42175.8-20.232.9000112.9N144 A149 T150N144-P146 VanDerWaalsContact C-N 3.31Å; N144-P146 VanDerWaalsContact O-N 3.12Å; P146-A149 PolarHBondContact O-N 2.84Å; P146-T150 PolarHBondContact O-N 2.91Å; P146-T150 VanDerWaalsContact O-N 3.09Å; P146-T150 PolarHBondContact O-OG1 3.47Å
147C62Low66.1Low12 Ų1258 Ų588%0.08130%0.303CS..Hα-helixtrans-65.9-44-178.7-178.60000111.2I15 L142 N144 A149 T150 L151I15-C147 WeakPolarHBondContact CD1-SG 3.18Å; L142-C147 PolarHBondContact O-SG 3.32Å; L142-C147 VanDerWaalsContact O-SG 3.33Å; N144-C147 WeakPolarHBondContact O-CB 3.25Å; N144-C147 PolarHBondContact O-N 3.29Å; C147-A149 PolarHBondContact O-N 3.21Å; C147-T150 PolarHBondContact O-N 2.83Å; C147-L151 WeakPolarHBondContact O-CG 3.3Å; C147-L151 PolarHBondContact O-N 2.82Å
148L65.4Low66.2Low18 Ų1854 Ų549%0.09428%0.283CS..Hα-helixtrans-61.7-41.8175.6-72-173.9000112.6L143 N144 L151 D152 A173L143-L148 HydrophobicContact CD2-CD1 4.39Å; L143-L148 HydrophobicContact CD2-CD2 4.07Å; L143-L148 WeakPolarHBondContact O-CD1 3.12Å; N144-L148 PolarHBondContact O-N 2.59Å; N144-L148 VanDerWaalsContact O-N 3.14Å; L148-L151 HydrophobicContact CD2-CD1 4.46Å; L148-L151 PolarHBondContact O-N 3.2Å; L148-D152 PolarHBondContact O-N 3.19Å; L148-A173 HydrophobicContact CD2-CB 4.44Å
149A68.4Low65.9Low50 Ų5055.2 Ų55.241%0.41330%0.303SS..Hα-helixtrans-63.3-42.1176.400000112Q145 P146 C147 D152 E153Q145-A149 WeakPolarHBondContact O-CB 3.25Å; Q145-A149 PolarHBondContact O-N 3.44Å; Q145-A149 VanDerWaalsContact O-N 3.09Å; P146-A149 PolarHBondContact O-N 2.84Å; C147-A149 PolarHBondContact O-N 3.21Å; A149-D152 PolarHBondContact O-N 2.73Å; A149-E153 PolarHBondContact O-N 3.13Å
150T70.6Confident65.6Low39 Ų3959.8 Ų59.824%0.23932%0.321CS..Hα-helixtrans-65.2-38.5175.9-46.10000112P146 C147 D152 E153 Y154P146-T150 PolarHBondContact O-N 2.91Å; P146-T150 VanDerWaalsContact O-N 3.09Å; P146-T150 PolarHBondContact O-OG1 3.47Å; C147-T150 PolarHBondContact O-N 2.83Å; T150-D152 VanDerWaalsContact C-N 3.34Å; T150-E153 PolarHBondContact O-N 3.44Å; T150-Y154 HydrophobicContact CG2-CD1 4.41Å; T150-Y154 HydrophobicContact CG2-CE1 3.8Å; T150-Y154 HydrophobicContact CG2-CE2 4.01Å; T150-Y154 WeakPolarHBondContact O-CD1 3.29Å; T150-Y154 PolarHBondContact O-N 3.23Å
151L69.6Low65.1Low3 Ų357.1 Ų57.12%0.01632%0.318CS..Hα-helixtrans-66.5-36.2175.5-73.4167.2000112.2I28 L32 C147 L148 Y154 W155 V169I28-L151 HydrophobicContact CG2-CD2 4.09Å; L32-L151 HydrophobicContact CD1-CD1 4.06Å; L32-L151 HydrophobicContact CD2-CD1 3.84Å; L32-L151 HydrophobicContact CD2-CD2 4.36Å; C147-L151 WeakPolarHBondContact O-CG 3.3Å; C147-L151 PolarHBondContact O-N 2.82Å; L148-L151 HydrophobicContact CD2-CD1 4.46Å; L148-L151 PolarHBondContact O-N 3.2Å; L151-Y154 PolarHBondContact O-N 2.91Å; L151-W155 VanDerWaalsContact O-CB 3.29Å; L151-W155 WeakPolarHBondContact O-CB 3.32Å; L151-W155 PolarHBondContact O-N 3.21Å; L151-V169 HydrophobicContact CB-CB 4.35Å; L151-V169 HydrophobicContact CB-CG1 4.03Å
152D72.2Confident64.4Low31 Ų3162.3 Ų62.317%0.16634%0.337CS..Hα-helixtrans-65.1-41.1173.9-69.2-22.5000111.6L148 A149 T150 W155 V156 S168 V169 S170L148-D152 PolarHBondContact O-N 3.19Å; A149-D152 PolarHBondContact O-N 2.73Å; T150-D152 VanDerWaalsContact C-N 3.34Å; D152-W155 WeakPolarHBondContact O-CB 3.48Å; D152-W155 PolarHBondContact O-N 2.97Å; D152-V156 VanDerWaalsContact O-CG2 3.28Å; D152-V156 WeakPolarHBondContact O-CG2 3.49Å; D152-V156 PolarHBondContact O-N 3.46Å; D152-S168 VanDerWaalsContact CG-CB 3.42Å; D152-S168 WeakPolarHBondContact OD1-CB 3.38Å; D152-S168 WeakPolarHBondContact OD2-CB 3.41Å; D152-V169 WeakPolarHBondContact OD1-CA 3.27Å; D152-V169 PolarHBondContact OD1-N 3.31Å; D152-S170 VanDerWaalsContact CG-OG 3.27Å; D152-S170 WeakPolarHBondContact OD1-CB 3.4Å; D152-S170 PolarHBondContact OD1-N 2.81Å; D152-S170 PolarHBondContact OD1-OG 2.91Å; D152-S170 WeakPolarHBondContact OD2-CB 3.19Å; D152-S170 PolarHBondContact OD2-OG 3.2Å
153E73.6Confident63.8Low130 Ų13068 Ų6861%0.60737%0.367SS*.Hα-helixtrans-61-48.3171.8-75.8-178.4166.200111.6A149 T150 W155 V156 E157A149-E153 PolarHBondContact O-N 3.13Å; T150-E153 PolarHBondContact O-N 3.44Å; E153-W155 VanDerWaalsContact C-N 3.25Å; E153-W155 PolarHBondContact O-N 2.89Å; E153-V156 PolarHBondContact O-N 2.88Å; E153-E157 WeakPolarHBondContact O-CG 3.32Å; E153-E157 PolarHBondContact O-N 2.83Å
154Y74.1Confident63.1Low22 Ų2268.9 Ų68.99%0.08637%0.372CS..Hα-helixtrans-61.4-35.5177.5-67.8-5.5000112.2K25 T150 L151 S158K25-Y154 HydrophobicContact CB-CG 4.43Å; K25-Y154 HydrophobicContact CD-CD1 3.83Å; K25-Y154 HydrophobicContact CD-CE1 4.22Å; K25-Y154 HydrophobicContact CD-CG 4.08Å; K25-Y154 HydrophobicContact CG-CD1 4.2Å; K25-Y154 HydrophobicContact CG-CD2 4.17Å; K25-Y154 HydrophobicContact CG-CE1 4.49Å; K25-Y154 HydrophobicContact CG-CE2 4.44Å; K25-Y154 HydrophobicContact CG-CG 4.04Å; T150-Y154 HydrophobicContact CG2-CD1 4.41Å; T150-Y154 HydrophobicContact CG2-CE1 3.8Å; T150-Y154 HydrophobicContact CG2-CE2 4.01Å; T150-Y154 WeakPolarHBondContact O-CD1 3.29Å; T150-Y154 PolarHBondContact O-N 3.23Å; L151-Y154 PolarHBondContact O-N 2.91Å; Y154-S158 WeakPolarHBondContact O-CB 3.36Å; Y154-S158 PolarHBondContact O-N 3.1Å
155W68.6Low62.2Low14 Ų1472.9 Ų72.95%0.05339%0.388CS..Hα-helixtrans-66.8-47.1176.7-178.8-110.8000112.1I29 F33 L151 D152 E153 E157 S158 L164 V169I29-W155 HydrophobicContact CD1-CE3 4.15Å; I29-W155 HydrophobicContact CG2-CE3 3.73Å; I29-W155 HydrophobicContact CG2-CZ3 3.73Å; F33-W155 HydrophobicContact CE2-CE3 4.3Å; F33-W155 HydrophobicContact CE2-CH2 4.28Å; F33-W155 AromaticContact CE2-CZ3 3.74Å; F33-W155 HydrophobicContact CE2-CZ3 3.74Å; F33-W155 HydrophobicContact CZ-CZ3 4.3Å; L151-W155 VanDerWaalsContact O-CB 3.29Å; L151-W155 WeakPolarHBondContact O-CB 3.32Å; L151-W155 PolarHBondContact O-N 3.21Å; D152-W155 WeakPolarHBondContact O-CB 3.48Å; D152-W155 PolarHBondContact O-N 2.97Å; E153-W155 VanDerWaalsContact C-N 3.25Å; E153-W155 PolarHBondContact O-N 2.89Å; W155-E157 VanDerWaalsContact C-N 3.3Å; W155-E157 PolarHBondContact O-N 3.46Å; W155-S158 PolarHBondContact O-N 3.09Å; W155-S158 PolarHBondContact O-OG 3.34Å; W155-L164 HydrophobicContact CH2-CD1 4.02Å; W155-L164 HydrophobicContact CZ2-CB 4.24Å; W155-L164 HydrophobicContact CZ2-CD1 4.22Å; W155-V169 HydrophobicContact CB-CB 4.43Å; W155-V169 HydrophobicContact CB-CG2 3.48Å; W155-V169 VanDerWaalsContact CB-CG2 3.48Å; W155-V169 HydrophobicContact CD2-CG2 3.56Å; W155-V169 HydrophobicContact CE3-CG2 3.69Å; W155-V169 HydrophobicContact CG-CG2 3.48Å; W155-V169 VanDerWaalsContact CG-CG2 3.48Å
156V69.1Low61.8Low95 Ų9568.5 Ų68.558%0.57636%0.364SS*.Hα-helixtrans-60.5-41.9176.31720000110.5D152 E153D152-V156 VanDerWaalsContact O-CG2 3.28Å; D152-V156 WeakPolarHBondContact O-CG2 3.49Å; D152-V156 PolarHBondContact O-N 3.46Å; E153-V156 PolarHBondContact O-N 2.88Å
157E68.9Low61.5Low112 Ų11271.3 Ų71.352%0.52338%0.375SS..Hα-helixtrans-69-31.7177.4-75.5-175.2160.500114.1K25 E153 W155 G159K25-E157 IonicContact NZ-OE1 2.59Å; K25-E157 IonicContact NZ-OE2 2.66Å; K25-E157 PolarHBondContact NZ-OE2 3.37Å; E153-E157 WeakPolarHBondContact O-CG 3.32Å; E153-E157 PolarHBondContact O-N 2.83Å; W155-E157 VanDerWaalsContact C-N 3.3Å; W155-E157 PolarHBondContact O-N 3.46Å; E157-G159 PolarHBondContact O-N 3.42Å; E157-G159 VanDerWaalsContact O-N 3.11Å
158S65.8Low61.4Low13 Ų1371.9 Ų71.99%0.09138%0.379CS..THydrogen-bonded Turntrans-65.9-13.1-176.775.30000114.6Y154 W155 Y160Y154-S158 WeakPolarHBondContact O-CB 3.36Å; Y154-S158 PolarHBondContact O-N 3.1Å; W155-S158 PolarHBondContact O-N 3.09Å; W155-S158 PolarHBondContact O-OG 3.34Å; S158-Y160 WeakPolarHBondContact O-CD2 3.36Å; S158-Y160 PolarHBondContact O-N 3.48Å; S158-Y160 PolarHBondContact OG-N 3.21Å
159G60.2Low61.3Low54 Ų5471.1 Ų71.156%0.55738%0.375SS*.SBendtrans73.7-4.7-177.600000115E157 S161E157-G159 PolarHBondContact O-N 3.42Å; E157-G159 VanDerWaalsContact O-N 3.11Å; G159-S161 VanDerWaalsContact C-N 3.26Å; G159-S161 PolarHBondContact O-N 2.96Å
160Y56.5Low61.1Low99 Ų9969.9 Ų69.939%0.38836%0.363SS..G310 helixtrans-77.5-3.3179.6-74.3-81000114.5I26 S158 K162 N163I26-Y160 HydrophobicContact CD1-CE2 3.94Å; I26-Y160 HydrophobicContact CG1-CE2 4.08Å; I26-Y160 HydrophobicContact CG2-CE2 4.31Å; S158-Y160 WeakPolarHBondContact O-CD2 3.36Å; S158-Y160 PolarHBondContact O-N 3.48Å; S158-Y160 PolarHBondContact OG-N 3.21Å; Y160-K162 PolarHBondContact O-N 3.09Å; Y160-N163 PolarHBondContact O-N 2.99Å
161S52.1Low60.6Low55 Ų5571 Ų7139%0.38537%0.365SS..G310 helixtrans-56.3-21.8-178.867.40000114G159G159-S161 VanDerWaalsContact C-N 3.26Å; G159-S161 PolarHBondContact O-N 2.96Å
162K51Low60.1Low193 Ų19371.2 Ų71.284%0.83937%0.367SS*.G310 helixtrans-75.1-18.4178-70.2-173.2177.1-179.20115.1Y160Y160-K162 PolarHBondContact O-N 3.09Å
163N48.9Very low59.7Low124 Ų12469.9 Ų69.966%0.66336%0.36SS*.THydrogen-bonded Turntrans-99.5-10-173.2-75.4-10.2000114.6Y160Y160-N163 PolarHBondContact O-N 2.99Å
164L42.6Very low59Low44 Ų4465.5 Ų65.523%0.2334%0.341CS..SBendtrans-117.6133168.9-95.599.5000109.8W155 R166 V172W155-L164 HydrophobicContact CH2-CD1 4.02Å; W155-L164 HydrophobicContact CZ2-CB 4.24Å; W155-L164 HydrophobicContact CZ2-CD1 4.22Å; L164-R166 PolarHBondContact O-N 2.83Å; L164-V172 HydrophobicContact CD2-CG2 4.3Å
165Q46.2Very low58.2Low171 Ų17165.9 Ų65.980%0.79934%0.344SS*.SBendtrans-63.97.2179.3-77.3-179-32.400115.4
166R50.7Low57.7Low71 Ų7165.7 Ų65.727%0.26834%0.344SS..SBendtrans-120.9137.8-175.7-66-170.8179.4164.40.7110.9L164 S168 V172 L175 A258L164-R166 PolarHBondContact O-N 2.83Å; R166-S168 VanDerWaalsContact C-N 3.31Å; R166-S168 PolarHBondContact O-N 3.26Å; R166-V172 HydrophobicContact CB-CG2 3.86Å; R166-V172 HydrophobicContact CG-CG2 4.49Å; R166-L175 VanDerWaalsContact CZ-CD1 3.47Å; R166-A258 PolarHBondContact NH2-O 2.83Å
167N54.1Low57.2Low148 Ų14861.5 Ų61.579%0.79132%0.318SS*.SBendtrans-79.9-8.5-164.9-73-25.2000114.2
168S61.8Low56.7Low24 Ų2456.9 Ų56.917%0.16830%0.297CS..  trans-151.6148.6-177.787.30000112.7D152 R166 S170 E171 V172D152-S168 VanDerWaalsContact CG-CB 3.42Å; D152-S168 WeakPolarHBondContact OD1-CB 3.38Å; D152-S168 WeakPolarHBondContact OD2-CB 3.41Å; R166-S168 VanDerWaalsContact C-N 3.31Å; R166-S168 PolarHBondContact O-N 3.26Å; S168-S170 PolarHBondContact O-N 3.5Å; S168-S170 PolarHBondContact OG-OG 2.82Å; S168-E171 PolarHBondContact O-N 2.83Å; S168-E171 VanDerWaalsContact OG-CB 3.28Å; S168-E171 WeakPolarHBondContact OG-CB 3.37Å; S168-E171 PolarHBondContact OG-N 2.89Å; S168-V172 PolarHBondContact O-N 3.43Å
169V63.1Low56.1Low1 Ų157.7 Ų57.71%0.00630%0.303CS..Hα-helixtrans-64.9-34.2173.6166.20000110.4L32 F33 L151 D152 W155 E171 V172 A173L32-V169 HydrophobicContact CD2-CG1 3.42Å; L32-V169 VanDerWaalsContact CD2-CG1 3.42Å; F33-V169 HydrophobicContact CZ-CG2 4.2Å; L151-V169 HydrophobicContact CB-CB 4.35Å; L151-V169 HydrophobicContact CB-CG1 4.03Å; D152-V169 WeakPolarHBondContact OD1-CA 3.27Å; D152-V169 PolarHBondContact OD1-N 3.31Å; W155-V169 HydrophobicContact CB-CB 4.43Å; W155-V169 HydrophobicContact CB-CG2 3.48Å; W155-V169 VanDerWaalsContact CB-CG2 3.48Å; W155-V169 HydrophobicContact CD2-CG2 3.56Å; W155-V169 HydrophobicContact CE3-CG2 3.69Å; W155-V169 HydrophobicContact CG-CG2 3.48Å; W155-V169 VanDerWaalsContact CG-CG2 3.48Å; V169-E171 VanDerWaalsContact C-N 3.34Å; V169-E171 PolarHBondContact O-N 2.88Å; V169-V172 PolarHBondContact O-N 2.81Å; V169-A173 VanDerWaalsContact O-CB 3.27Å; V169-A173 WeakPolarHBondContact O-CB 3.4Å; V169-A173 PolarHBondContact O-N 3.47Å
170S63.5Low56Low25 Ų2555.5 Ų55.518%0.17528%0.278CS..Hα-helixtrans-60.2-41.6176.464.60000112.6D152 S168 A173 L174D152-S170 VanDerWaalsContact CG-OG 3.27Å; D152-S170 WeakPolarHBondContact OD1-CB 3.4Å; D152-S170 PolarHBondContact OD1-N 2.81Å; D152-S170 PolarHBondContact OD1-OG 2.91Å; D152-S170 WeakPolarHBondContact OD2-CB 3.19Å; D152-S170 PolarHBondContact OD2-OG 3.2Å; S168-S170 PolarHBondContact O-N 3.5Å; S168-S170 PolarHBondContact OG-OG 2.82Å; S170-A173 PolarHBondContact O-N 3.36Å; S170-L174 WeakPolarHBondContact O-CB 3.16Å; S170-L174 PolarHBondContact O-N 2.97Å
171E59.2Low55.9Low61 Ų6151.3 Ų51.329%0.28526%0.262SS..Hα-helixtrans-67.7-42.1178.2-166.8172.5-139.400110.9S168 V169 L175S168-E171 PolarHBondContact O-N 2.83Å; S168-E171 VanDerWaalsContact OG-CB 3.28Å; S168-E171 WeakPolarHBondContact OG-CB 3.37Å; S168-E171 PolarHBondContact OG-N 2.89Å; V169-E171 VanDerWaalsContact C-N 3.34Å; V169-E171 PolarHBondContact O-N 2.88Å; E171-L175 HydrophobicContact CG-CD1 4.2Å; E171-L175 WeakPolarHBondContact O-CB 3.25Å; E171-L175 WeakPolarHBondContact O-CD1 3.2Å; E171-L175 PolarHBondContact O-N 3.04Å
172V60.1Low55.9Low9 Ų952.2 Ų52.26%0.05526%0.259CS..Hα-helixtrans-63.7-47.3174.8178.50000111.4F33 M57 L164 R166 S168 V169 L175 I176F33-V172 HydrophobicContact CE1-CG1 3.93Å; M57-V172 HydrophobicContact CE-CG1 3.94Å; L164-V172 HydrophobicContact CD2-CG2 4.3Å; R166-V172 HydrophobicContact CB-CG2 3.86Å; R166-V172 HydrophobicContact CG-CG2 4.49Å; S168-V172 PolarHBondContact O-N 3.43Å; V169-V172 PolarHBondContact O-N 2.81Å; V172-L175 PolarHBondContact O-N 3.37Å; V172-I176 HydrophobicContact CG1-CD1 3.81Å; V172-I176 HydrophobicContact CG1-CG1 4.5Å; V172-I176 WeakPolarHBondContact O-CG1 3.36Å; V172-I176 PolarHBondContact O-N 2.88Å
173A62.6Low55.9Low2 Ų245.7 Ų45.72%0.01723%0.233CC..Hα-helixtrans-63.5-44.7-179.900000111.6L36 L143 L148 V169 S170 L175 I176 M177L36-A173 HydrophobicContact CD1-CB 4.09Å; L36-A173 HydrophobicContact CD2-CB 4.43Å; L143-A173 HydrophobicContact CD2-CB 4.09Å; L148-A173 HydrophobicContact CD2-CB 4.44Å; V169-A173 VanDerWaalsContact O-CB 3.27Å; V169-A173 WeakPolarHBondContact O-CB 3.4Å; V169-A173 PolarHBondContact O-N 3.47Å; S170-A173 PolarHBondContact O-N 3.36Å; A173-L175 PolarHBondContact O-N 3.48Å; A173-I176 PolarHBondContact O-N 3.06Å; A173-M177 WeakPolarHBondContact O-CB 3.43Å; A173-M177 PolarHBondContact O-N 2.51Å
174L60.5Low56Low38 Ų3841.1 Ų41.120%0.19921%0.211CC..Hα-helixtrans-62.3-42.8177.5-158.891.7000111S170 M177 L178S170-L174 WeakPolarHBondContact O-CB 3.16Å; S170-L174 PolarHBondContact O-N 2.97Å; L174-M177 PolarHBondContact O-N 3.27Å; L174-L178 HydrophobicContact CD2-CD1 4.06Å; L174-L178 HydrophobicContact CG-CD1 4.2Å; L174-L178 WeakPolarHBondContact O-CB 3.28Å; L174-L178 VanDerWaalsContact O-CG 3.22Å; L174-L178 WeakPolarHBondContact O-CG 3.32Å; L174-L178 PolarHBondContact O-N 2.89Å
175L56.7Low56.4Low30 Ų3041.2 Ų41.216%0.15722%0.218CC..Hα-helixtrans-66.7-41.9178.1-91.9148.9000112.9R166 E171 V172 A173 M177 L178 S179 A258R166-L175 VanDerWaalsContact CZ-CD1 3.47Å; E171-L175 HydrophobicContact CG-CD1 4.2Å; E171-L175 WeakPolarHBondContact O-CB 3.25Å; E171-L175 WeakPolarHBondContact O-CD1 3.2Å; E171-L175 PolarHBondContact O-N 3.04Å; V172-L175 PolarHBondContact O-N 3.37Å; A173-L175 PolarHBondContact O-N 3.48Å; L175-M177 VanDerWaalsContact C-N 3.29Å; L175-M177 PolarHBondContact O-N 3Å; L175-L178 PolarHBondContact O-N 3.3Å; L175-S179 WeakPolarHBondContact O-CB 3.31Å; L175-S179 PolarHBondContact O-N 2.9Å; L175-A258 HydrophobicContact CD1-CB 3.97Å; L175-A258 HydrophobicContact CD2-CB 3.46Å; L175-A258 VanDerWaalsContact CD2-CB 3.46Å; L175-A258 HydrophobicContact CG-CB 4.38Å
176I58.9Low56.4Low11 Ų1136.5 Ų36.56%0.05620%0.198CC..Hα-helixtrans-61.8-42174.7-69.5169.4000110.1L36 M57 V172 A173 S179 F180L36-I176 HydrophobicContact CB-CD1 4.23Å; L36-I176 HydrophobicContact CB-CG2 4.42Å; L36-I176 HydrophobicContact CD1-CD1 4.3Å; L36-I176 HydrophobicContact CD2-CG2 4.22Å; M57-I176 HydrophobicContact CE-CD1 3.88Å; M57-I176 HydrophobicContact SD-CD1 4.15Å; V172-I176 HydrophobicContact CG1-CD1 3.81Å; V172-I176 HydrophobicContact CG1-CG1 4.5Å; V172-I176 WeakPolarHBondContact O-CG1 3.36Å; V172-I176 PolarHBondContact O-N 2.88Å; A173-I176 PolarHBondContact O-N 3.06Å; I176-S179 PolarHBondContact O-N 2.74Å; I176-F180 VanDerWaalsContact O-CB 3.31Å; I176-F180 WeakPolarHBondContact O-CB 3.22Å; I176-F180 PolarHBondContact O-N 3.33Å
177M58.9Low56.1Low6 Ų636.3 Ų36.33%0.0321%0.208CC..Hα-helixtrans-68.8-41.1177.8-86.1-83.7-80.700113.2L139 L143 A173 L174 L175 S179 F180 L181 F210L139-M177 HydrophobicContact CB-CE 4.1Å; L139-M177 HydrophobicContact CD1-CE 3.98Å; L139-M177 HydrophobicContact CD1-SD 3.59Å; L139-M177 VanDerWaalsContact CD1-SD 3.59Å; L139-M177 HydrophobicContact CD2-CE 4.08Å; L139-M177 HydrophobicContact CD2-CG 4.38Å; L139-M177 HydrophobicContact CD2-SD 3.82Å; L139-M177 HydrophobicContact CG-CE 4.31Å; L139-M177 HydrophobicContact CG-SD 4.25Å; L143-M177 HydrophobicContact CD1-CB 4.18Å; L143-M177 HydrophobicContact CD1-CE 3.19Å; L143-M177 HydrophobicContact CD1-CG 3.85Å; L143-M177 HydrophobicContact CD1-SD 4.31Å; L143-M177 HydrophobicContact CG-CE 4.19Å; A173-M177 WeakPolarHBondContact O-CB 3.43Å; A173-M177 PolarHBondContact O-N 2.51Å; L174-M177 PolarHBondContact O-N 3.27Å; L175-M177 VanDerWaalsContact C-N 3.29Å; L175-M177 PolarHBondContact O-N 3Å; M177-S179 VanDerWaalsContact C-N 3.34Å; M177-F180 PolarHBondContact O-N 3.39Å; M177-F180 HydrophobicContact SD-CD1 4.45Å; M177-L181 VanDerWaalsContact O-CB 3.31Å; M177-L181 WeakPolarHBondContact O-CB 3.37Å; M177-L181 VanDerWaalsContact O-CG 3.28Å; M177-L181 WeakPolarHBondContact O-CG 3.37Å; M177-L181 PolarHBondContact O-N 3.45Å; M177-F210 HydrophobicContact CE-CE1 4.07Å; M177-F210 HydrophobicContact CE-CZ 4.16Å
178L57.1Low55.7Low15 Ų1531.8 Ų31.88%0.07918%0.183CC..Hα-helixtrans-65.2-38.6174.5-72.7171.9000111.4L174 L175 K182 L215 I251 L254L174-L178 HydrophobicContact CD2-CD1 4.06Å; L174-L178 HydrophobicContact CG-CD1 4.2Å; L174-L178 WeakPolarHBondContact O-CB 3.28Å; L174-L178 VanDerWaalsContact O-CG 3.22Å; L174-L178 WeakPolarHBondContact O-CG 3.32Å; L174-L178 PolarHBondContact O-N 2.89Å; L175-L178 PolarHBondContact O-N 3.3Å; L178-K182 VanDerWaalsContact O-CB 3.32Å; L178-K182 WeakPolarHBondContact O-CB 3.22Å; L178-K182 PolarHBondContact O-N 3.04Å; L178-L215 HydrophobicContact CD2-CD2 4.48Å; L178-I251 HydrophobicContact CD2-CD1 4.37Å; L178-I251 HydrophobicContact CD2-CG1 4.25Å; L178-L254 HydrophobicContact CD1-CD1 4.37Å
179S54.4Low54.9Low30 Ų3036.8 Ų36.821%0.2121%0.205CC..Hα-helixtrans-64-47.6172.1-170.60000111.1L175 I176 M177 L181 K182 D183L175-S179 WeakPolarHBondContact O-CB 3.31Å; L175-S179 PolarHBondContact O-N 2.9Å; I176-S179 PolarHBondContact O-N 2.74Å; M177-S179 VanDerWaalsContact C-N 3.34Å; S179-L181 VanDerWaalsContact C-N 3.33Å; S179-L181 PolarHBondContact O-N 3.45Å; S179-K182 WeakPolarHBondContact O-CB 3.37Å; S179-K182 PolarHBondContact O-N 2.89Å; S179-D183 PolarHBondContact O-N 3.3Å
180F57Low54Low8 Ų843.1 Ų43.14%0.03524%0.239CC..Hα-helixtrans-59.9-42.5177.2172.7-110000112.1F39 F42 F132 I176 M177 D183 C184F39-F180 HydrophobicContact CD1-CE1 4.42Å; F39-F180 HydrophobicContact CD1-CZ 4.36Å; F42-F180 HydrophobicContact CB-CE2 3.55Å; F42-F180 HydrophobicContact CB-CZ 4.17Å; F132-F180 HydrophobicContact CE2-CZ 4.25Å; F132-F180 HydrophobicContact CZ-CZ 4.48Å; I176-F180 VanDerWaalsContact O-CB 3.31Å; I176-F180 WeakPolarHBondContact O-CB 3.22Å; I176-F180 PolarHBondContact O-N 3.33Å; M177-F180 PolarHBondContact O-N 3.39Å; M177-F180 HydrophobicContact SD-CD1 4.45Å; F180-D183 PolarHBondContact O-N 3.46Å; F180-C184 WeakPolarHBondContact CE2-SG 3.49Å; F180-C184 WeakPolarHBondContact CZ-SG 3.45Å; F180-C184 WeakPolarHBondContact O-CB 3.28Å; F180-C184 PolarHBondContact O-N 3.11Å; F180-C184 PolarHBondContact O-SG 3.26Å
181L54.2Low52.8Low11 Ų1145.7 Ų45.76%0.05825%0.254CS..Hα-helixtrans-68.6-37.5176.8-77.2166.3000112.4F136 M177 S179 D183 C184 A185 A207 F210 V211F136-L181 HydrophobicContact CE2-CD2 3.85Å; F136-L181 HydrophobicContact CZ-CD2 4.04Å; M177-L181 VanDerWaalsContact O-CB 3.31Å; M177-L181 WeakPolarHBondContact O-CB 3.37Å; M177-L181 VanDerWaalsContact O-CG 3.28Å; M177-L181 WeakPolarHBondContact O-CG 3.37Å; M177-L181 PolarHBondContact O-N 3.45Å; S179-L181 VanDerWaalsContact C-N 3.33Å; S179-L181 PolarHBondContact O-N 3.45Å; L181-D183 VanDerWaalsContact C-N 3.34Å; L181-C184 PolarHBondContact O-N 3.4Å; L181-A185 WeakPolarHBondContact O-CB 3.31Å; L181-A185 PolarHBondContact O-N 2.97Å; L181-A207 HydrophobicContact CD2-CB 4.39Å; L181-F210 HydrophobicContact CD1-CD1 3.73Å; L181-F210 HydrophobicContact CD1-CE1 3.68Å; L181-V211 HydrophobicContact CB-CG2 4.47Å; L181-V211 HydrophobicContact CD1-CG2 3.97Å
182K51.5Low51.9Low75 Ų7550.8 Ų50.833%0.32628%0.283SS..Hα-helixtrans-58-49.2169.8173.8-170.6170.6-173.30109.9L178 S179 A185 L186 I251L178-K182 VanDerWaalsContact O-CB 3.32Å; L178-K182 WeakPolarHBondContact O-CB 3.22Å; L178-K182 PolarHBondContact O-N 3.04Å; S179-K182 WeakPolarHBondContact O-CB 3.37Å; S179-K182 PolarHBondContact O-N 2.89Å; K182-A185 PolarHBondContact O-N 3.35Å; K182-L186 HydrophobicContact CD-CD1 4.39Å; K182-L186 HydrophobicContact CG-CD1 3.78Å; K182-L186 HydrophobicContact CG-CG 4.42Å; K182-L186 WeakPolarHBondContact O-CB 3.43Å; K182-L186 WeakPolarHBondContact O-CG 3.45Å; K182-L186 PolarHBondContact O-N 3.4Å; K182-I251 HydrophobicContact CB-CG2 4.34Å
183D51.8Low50.9Low55 Ų5553 Ų5329%0.29430%0.302SS..Hα-helixtrans-65.7-40.6-178.4-62.4-23.8000111.3S179 F180 L181 S187S179-D183 PolarHBondContact O-N 3.3Å; F180-D183 PolarHBondContact O-N 3.46Å; L181-D183 VanDerWaalsContact C-N 3.34Å; D183-S187 WeakPolarHBondContact O-CB 3.32Å; D183-S187 PolarHBondContact O-N 2.96Å
184C51.1Low49.9Very low29 Ų2955.3 Ų55.320%0.19632%0.321CS..Hα-helixtrans-62.9-44.9172.3-710000112F180 L181 I188F180-C184 WeakPolarHBondContact CE2-SG 3.49Å; F180-C184 WeakPolarHBondContact CZ-SG 3.45Å; F180-C184 WeakPolarHBondContact O-CB 3.28Å; F180-C184 PolarHBondContact O-N 3.11Å; F180-C184 PolarHBondContact O-SG 3.26Å; L181-C184 PolarHBondContact O-N 3.4Å; C184-I188 WeakPolarHBondContact O-CB 3.15Å; C184-I188 WeakPolarHBondContact O-CD1 3.2Å; C184-I188 WeakPolarHBondContact O-CG1 3.48Å; C184-I188 PolarHBondContact O-N 2.76Å
185A50.8Low49.3Very low45 Ų4560 Ų6037%0.37235%0.346SS..Hα-helixtrans-65.8-43.5179.700000111.4L181 K182 M189L181-A185 WeakPolarHBondContact O-CB 3.31Å; L181-A185 PolarHBondContact O-N 2.97Å; K182-A185 PolarHBondContact O-N 3.35Å; A185-M189 WeakPolarHBondContact O-CB 3.47Å; A185-M189 WeakPolarHBondContact O-CG 3.38Å; A185-M189 PolarHBondContact O-N 2.93Å
186L46.2Very low48.6Very low73 Ų7367.3 Ų67.338%0.38238%0.379SS..Hα-helixtrans-63.3-48.9174.9-75.4168.8000111.4K182 I188 M189 D190K182-L186 HydrophobicContact CD-CD1 4.39Å; K182-L186 HydrophobicContact CG-CD1 3.78Å; K182-L186 HydrophobicContact CG-CG 4.42Å; K182-L186 WeakPolarHBondContact O-CB 3.43Å; K182-L186 WeakPolarHBondContact O-CG 3.45Å; K182-L186 PolarHBondContact O-N 3.4Å; L186-I188 VanDerWaalsContact C-N 3.31Å; L186-I188 PolarHBondContact O-N 3.28Å; L186-M189 HydrophobicContact CD2-CE 3.77Å; L186-M189 HydrophobicContact CG-CE 4.37Å; L186-M189 PolarHBondContact O-N 3.49Å; L186-M189 VanDerWaalsContact O-N 3.09Å; L186-D190 PolarHBondContact O-N 3.3Å
187S45.4Very low47.8Very low67 Ų6771.7 Ų71.747%0.46940%0.401SS..Hα-helixtrans-57.3-43.2177.8172.50000112.3D183 D190 T191D183-S187 WeakPolarHBondContact O-CB 3.32Å; D183-S187 PolarHBondContact O-N 2.96Å; S187-D190 PolarHBondContact O-N 3.32Å; S187-T191 PolarHBondContact O-N 3.34Å
188I44.3Very low47.3Very low53 Ų5380.1 Ų80.127%0.27244%0.437SS..Hα-helixtrans-71.9-33.3178.3-64.4165.3000111.5C184 L186 T191 I204C184-I188 WeakPolarHBondContact O-CB 3.15Å; C184-I188 WeakPolarHBondContact O-CD1 3.2Å; C184-I188 WeakPolarHBondContact O-CG1 3.48Å; C184-I188 PolarHBondContact O-N 2.76Å; L186-I188 VanDerWaalsContact C-N 3.31Å; L186-I188 PolarHBondContact O-N 3.28Å; I188-T191 PolarHBondContact O-OG1 2.83Å; I188-T191 VanDerWaalsContact O-OG1 3.09Å; I188-I204 HydrophobicContact CD1-CG1 4.41Å; I188-I204 HydrophobicContact CG2-CD1 3.45Å; I188-I204 VanDerWaalsContact CG2-CD1 3.45Å; I188-I204 HydrophobicContact CG2-CG1 3.63Å
189M45.2Very low46.7Very low129 Ų12984.4 Ų84.464%0.63546%0.457SS*.Hα-helixtrans-68.9-34.7174.7-76.6-170.9-52.600112.9A185 L186A185-M189 WeakPolarHBondContact O-CB 3.47Å; A185-M189 WeakPolarHBondContact O-CG 3.38Å; A185-M189 PolarHBondContact O-N 2.93Å; L186-M189 HydrophobicContact CD2-CE 3.77Å; L186-M189 HydrophobicContact CG-CE 4.37Å; L186-M189 PolarHBondContact O-N 3.49Å; L186-M189 VanDerWaalsContact O-N 3.09Å
190D44.1Very low46.1Very low133 Ų13384.1 Ų84.171%0.71146%0.459SS*.Hα-helixtrans-77.8-26.7179.6-87.6-21.3000113.2L186 S187 N192L186-D190 PolarHBondContact O-N 3.3Å; S187-D190 PolarHBondContact O-N 3.32Å; D190-N192 PolarHBondContact O-N 3Å
191T39.3Very low45.7Very low80 Ų8090 Ų9049%0.49148%0.481SS..SBendtrans-72.396.9168.754.30000110S187 I188 A193S187-T191 PolarHBondContact O-N 3.34Å; I188-T191 PolarHBondContact O-OG1 2.83Å; I188-T191 VanDerWaalsContact O-OG1 3.09Å; T191-A193 PolarHBondContact O-N 3.38Å
192N40.4Very low45.3Very low168 Ų16894.2 Ų94.290%0.89850%0.5SS*.THydrogen-bonded Turntrans-5916.3174.7-83.6-34.7000115.3D190D190-N192 PolarHBondContact O-N 3Å
193A38.6Very low45Very low55 Ų5591.9 Ų91.946%0.45549%0.491SS..THydrogen-bonded Turntrans-99.117.8176.500000113.8T191 D195T191-A193 PolarHBondContact O-N 3.38Å; A193-D195 PolarHBondContact O-N 3.15Å
194A42Very low44.9Very low50 Ų5091.9 Ų91.941%0.41349%0.49SS..THydrogen-bonded Turntrans-66.9-13.4-178.400000114.8
195D46.6Very low45Very low137 Ų13797.4 Ų97.473%0.73351%0.507SS*.THydrogen-bonded Turntrans-76.8-33.2-179.3-88.9-27.9000113.8A193 R201A193-D195 PolarHBondContact O-N 3.15Å; D195-R201 PolarHBondContact O-NH2 3.33Å
196E43.4Very low45.1Very low183 Ų18399.2 Ų99.286%0.85551%0.508SS*.THydrogen-bonded Turntrans-93.4-13.5-176.2-65.9-161.6158.700114.9K198E196-K198 PolarHBondContact O-N 2.98Å
197M40.8Very low45.2Very low104 Ų10497.1 Ų97.151%0.51250%0.501SS..  trans-95.781.4-175.8-60.8-156.4-15600113Q199 G200 R201M197-Q199 PolarHBondContact O-N 3.31Å; M197-Q199 VanDerWaalsContact O-N 3.12Å; M197-G200 WeakPolarHBondContact O-CA 3.06Å; M197-G200 PolarHBondContact O-N 3.14Å; M197-R201 PolarHBondContact O-N 3.49Å; M197-R201 VanDerWaalsContact O-N 3.15Å
198K48.6Very low45.5Very low182 Ų18296 Ų9679%0.79149%0.489SS*.Hα-helixtrans-48.8-35.1170.5-91.2-177.4176.6176.90113.5E196 H202E196-K198 PolarHBondContact O-N 2.98Å; K198-H202 PolarHBondContact O-N 3.29Å
199Q45.3Very low45.8Very low106 Ų10698 Ų9850%0.49550%0.5SS..Hα-helixtrans-74.6-34.8175.7-78.5170.6-26.200112.9I129 M197 R201 H202 L203I129-Q199 HydrophobicContact CD1-CB 4.35Å; M197-Q199 PolarHBondContact O-N 3.31Å; M197-Q199 VanDerWaalsContact O-N 3.12Å; Q199-R201 PolarHBondContact O-N 3.21Å; Q199-H202 PolarHBondContact O-N 2.94Å; Q199-L203 PolarHBondContact O-N 3.35Å
200G42Very low46Very low23 Ų2393 Ų9324%0.23748%0.475CS..Hα-helixtrans-62.4-41.1174.500000112.1M197 H202 L203 I204M197-G200 WeakPolarHBondContact O-CA 3.06Å; M197-G200 PolarHBondContact O-N 3.14Å; G200-H202 VanDerWaalsContact C-N 3.34Å; G200-H202 PolarHBondContact O-N 3.09Å; G200-L203 PolarHBondContact O-N 3.03Å; G200-I204 VanDerWaalsContact O-CG1 3.28Å; G200-I204 WeakPolarHBondContact O-CG1 3.35Å; G200-I204 PolarHBondContact O-N 3.17Å
201R47.2Very low46.4Very low132 Ų13287.1 Ų87.150%0.49844%0.444SS..Hα-helixtrans-60.9-38.6172.7-78.9-172.1-107.3-167.7-6.7113.1D195 M197 Q199 R205D195-R201 PolarHBondContact O-NH2 3.33Å; M197-R201 PolarHBondContact O-N 3.49Å; M197-R201 VanDerWaalsContact O-N 3.15Å; Q199-R201 PolarHBondContact O-N 3.21Å; R201-R205 WeakPolarHBondContact O-CB 3.41Å; R201-R205 PolarHBondContact O-N 2.98Å
202H47.1Very low46.9Very low100 Ų10084.2 Ų84.246%0.46343%0.427SS..Hα-helixtrans-67.2-38.6175.8-167.5-27.4000111.4K198 Q199 G200 R205 Q206K198-H202 PolarHBondContact O-N 3.29Å; Q199-H202 PolarHBondContact O-N 2.94Å; G200-H202 VanDerWaalsContact C-N 3.34Å; G200-H202 PolarHBondContact O-N 3.09Å; H202-R205 PolarHBondContact O-N 2.82Å; H202-Q206 PolarHBondContact CE1-NE2 2.79Å; H202-Q206 WeakPolarHBondContact O-CB 3.34Å; H202-Q206 PolarHBondContact O-N 2.97Å
203L45.8Very low47.4Very low25 Ų2579.9 Ų79.913%0.13140%0.403CS..Hα-helixtrans-67.5-46.8177.2-16079.4000111.6F132 K133 Q199 G200 R205 Q206 A207F132-L203 HydrophobicContact CD1-CD1 4.05Å; F132-L203 HydrophobicContact CD1-CD2 4.15Å; F132-L203 HydrophobicContact CE1-CD1 4.2Å; F132-L203 HydrophobicContact CE1-CD2 3.97Å; F132-L203 HydrophobicContact CE1-CG 4.38Å; K133-L203 HydrophobicContact CG-CD1 4.11Å; Q199-L203 PolarHBondContact O-N 3.35Å; G200-L203 PolarHBondContact O-N 3.03Å; L203-R205 VanDerWaalsContact C-N 3.27Å; L203-R205 PolarHBondContact O-N 3.44Å; L203-Q206 PolarHBondContact O-N 3.24Å; L203-Q206 VanDerWaalsContact O-N 3.16Å; L203-A207 WeakPolarHBondContact O-CB 3.25Å; L203-A207 PolarHBondContact O-N 3.45Å
204I49.8Very low47.9Very low55 Ų5579 Ų7928%0.28240%0.396SS..Hα-helixtrans-55.6-45.4171.5-66.5165.2000109.8I188 G200 Q206 A207 L208I188-I204 HydrophobicContact CD1-CG1 4.41Å; I188-I204 HydrophobicContact CG2-CD1 3.45Å; I188-I204 VanDerWaalsContact CG2-CD1 3.45Å; I188-I204 HydrophobicContact CG2-CG1 3.63Å; G200-I204 VanDerWaalsContact O-CG1 3.28Å; G200-I204 WeakPolarHBondContact O-CG1 3.35Å; G200-I204 PolarHBondContact O-N 3.17Å; I204-Q206 PolarHBondContact O-N 2.85Å; I204-A207 PolarHBondContact O-N 3.29Å; I204-L208 HydrophobicContact CG2-CD1 3.53Å; I204-L208 HydrophobicContact CG2-CG 4.13Å; I204-L208 VanDerWaalsContact O-CB 3.22Å; I204-L208 WeakPolarHBondContact O-CB 3.4Å; I204-L208 VanDerWaalsContact O-CG 3.22Å; I204-L208 WeakPolarHBondContact O-CG 3.45Å; I204-L208 PolarHBondContact O-N 3.41Å
205R51.6Low48.2Very low145 Ų14577.7 Ų77.755%0.54738%0.382SS..Hα-helixtrans-64.3-40.7179-155.8179.3-160.1168.35.8111.5R201 H202 L203 L209R201-R205 WeakPolarHBondContact O-CB 3.41Å; R201-R205 PolarHBondContact O-N 2.98Å; H202-R205 PolarHBondContact O-N 2.82Å; L203-R205 VanDerWaalsContact C-N 3.27Å; L203-R205 PolarHBondContact O-N 3.44Å; R205-L209 WeakPolarHBondContact O-CB 3.4Å; R205-L209 PolarHBondContact O-N 2.79Å
206Q52.8Low48.5Very low83 Ų8372 Ų7239%0.38835%0.351SS..Hα-helixtrans-68.4-42.5175.6-83.5-177.5-36.300112.4K133 H202 L203 I204 L209 F210K133-Q206 VanDerWaalsContact CE-OE1 3.26Å; H202-Q206 PolarHBondContact CE1-NE2 2.79Å; H202-Q206 WeakPolarHBondContact O-CB 3.34Å; H202-Q206 PolarHBondContact O-N 2.97Å; L203-Q206 PolarHBondContact O-N 3.24Å; L203-Q206 VanDerWaalsContact O-N 3.16Å; I204-Q206 PolarHBondContact O-N 2.85Å; Q206-L209 PolarHBondContact O-N 3.46Å; Q206-F210 VanDerWaalsContact O-CB 3.27Å; Q206-F210 WeakPolarHBondContact O-CB 3.41Å; Q206-F210 PolarHBondContact O-N 2.89Å
207A48.6Very low48.7Very low29 Ų2965.8 Ų65.824%0.2434%0.336CS..Hα-helixtrans-65.2-41.5176.200000111.8L181 L203 I204 F210 V211L181-A207 HydrophobicContact CD2-CB 4.39Å; L203-A207 WeakPolarHBondContact O-CB 3.25Å; L203-A207 PolarHBondContact O-N 3.45Å; I204-A207 PolarHBondContact O-N 3.29Å; A207-F210 WeakPolarHBondContact O-CB 3.43Å; A207-F210 PolarHBondContact O-N 2.86Å; A207-V211 WeakPolarHBondContact O-CG2 3.42Å; A207-V211 PolarHBondContact O-N 3.26Å
208L51.2Low49Very low44 Ų4466.6 Ų66.623%0.2334%0.342CS..Hα-helixtrans-70.6-38.4173.8-72.5172.9000112.3I204 F210 V211 S212 A244I204-L208 HydrophobicContact CG2-CD1 3.53Å; I204-L208 HydrophobicContact CG2-CG 4.13Å; I204-L208 VanDerWaalsContact O-CB 3.22Å; I204-L208 WeakPolarHBondContact O-CB 3.4Å; I204-L208 VanDerWaalsContact O-CG 3.22Å; I204-L208 WeakPolarHBondContact O-CG 3.45Å; I204-L208 PolarHBondContact O-N 3.41Å; L208-F210 VanDerWaalsContact C-N 3.26Å; L208-F210 PolarHBondContact O-N 3.5Å; L208-V211 PolarHBondContact O-N 3.43Å; L208-S212 VanDerWaalsContact O-CB 3.24Å; L208-S212 WeakPolarHBondContact O-CB 3.32Å; L208-S212 PolarHBondContact O-N 3.37Å; L208-S212 PolarHBondContact O-OG 3.27Å; L208-A244 HydrophobicContact CD1-CB 3.8Å; L208-A244 HydrophobicContact CD2-CB 3.59Å; L208-A244 HydrophobicContact CG-CB 4.37Å
209L51.4Low48.7Very low96 Ų9659.9 Ų59.950%0.50332%0.316SS..Hα-helixtrans-61.5-42.4173.2-150.592.2000109.2R205 Q206 S212 L213R205-L209 WeakPolarHBondContact O-CB 3.4Å; R205-L209 PolarHBondContact O-N 2.79Å; Q206-L209 PolarHBondContact O-N 3.46Å; L209-S212 WeakPolarHBondContact CA-OG 3.5Å; L209-S212 CarbonylContact O-C 3.43Å; L209-S212 PolarHBondContact O-N 2.78Å; L209-S212 PolarHBondContact O-OG 3.24Å; L209-L213 HydrophobicContact CD2-CD1 3.72Å; L209-L213 HydrophobicContact CG-CD1 3.92Å; L209-L213 VanDerWaalsContact O-CB 3.29Å; L209-L213 WeakPolarHBondContact O-CB 3.29Å; L209-L213 WeakPolarHBondContact O-CD1 3.27Å; L209-L213 VanDerWaalsContact O-CG 3.32Å; L209-L213 WeakPolarHBondContact O-CG 3.2Å; L209-L213 PolarHBondContact O-N 2.9Å
210F50.3Low48.4Very low23 Ų2359.9 Ų59.910%0.10132%0.319CS..Hα-helixtrans-61.4-51.4174.5177.6-105000111.8F136 Y140 L143 M177 L181 Q206 A207 L208 S212 L213 A214F136-F210 HydrophobicContact CE1-CB 4.2Å; F136-F210 HydrophobicContact CE1-CD1 4.11Å; F136-F210 HydrophobicContact CE1-CD2 4.36Å; F136-F210 AromaticContact CE1-CG 3.94Å; F136-F210 HydrophobicContact CE1-CG 3.94Å; F136-F210 HydrophobicContact CZ-CB 4.27Å; F136-F210 AromaticContact CZ-CD1 3.59Å; F136-F210 HydrophobicContact CZ-CD1 3.59Å; F136-F210 HydrophobicContact CZ-CE1 4.05Å; F136-F210 AromaticContact CZ-CG 3.89Å; F136-F210 HydrophobicContact CZ-CG 3.89Å; Y140-F210 AromaticContact CD2-CD2 3.42Å; Y140-F210 HydrophobicContact CD2-CD2 3.42Å; Y140-F210 VanDerWaalsContact CD2-CD2 3.42Å; Y140-F210 AromaticContact CD2-CE2 3.17Å; Y140-F210 HydrophobicContact CD2-CE2 3.17Å; Y140-F210 HydrophobicContact CD2-CZ 4.32Å; Y140-F210 AromaticContact CE2-CD2 3.64Å; Y140-F210 HydrophobicContact CE2-CD2 3.64Å; Y140-F210 AromaticContact CE2-CE2 3.53Å; Y140-F210 HydrophobicContact CE2-CE2 3.53Å; Y140-F210 HydrophobicContact CG-CE2 4.27Å; L143-F210 HydrophobicContact CD1-CZ 4.19Å; M177-F210 HydrophobicContact CE-CE1 4.07Å; M177-F210 HydrophobicContact CE-CZ 4.16Å; L181-F210 HydrophobicContact CD1-CD1 3.73Å; L181-F210 HydrophobicContact CD1-CE1 3.68Å; Q206-F210 VanDerWaalsContact O-CB 3.27Å; Q206-F210 WeakPolarHBondContact O-CB 3.41Å; Q206-F210 PolarHBondContact O-N 2.89Å; A207-F210 WeakPolarHBondContact O-CB 3.43Å; A207-F210 PolarHBondContact O-N 2.86Å; L208-F210 VanDerWaalsContact C-N 3.26Å; L208-F210 PolarHBondContact O-N 3.5Å; F210-S212 PolarHBondContact O-N 3.31Å; F210-L213 PolarHBondContact O-N 3.49Å; F210-A214 HydrophobicContact CZ-CB 4.48Å; F210-A214 WeakPolarHBondContact O-CB 3.24Å; F210-A214 PolarHBondContact O-N 2.89Å
211V51.8Low48.5Very low10 Ų1062.6 Ų62.66%0.06134%0.335CS..Hα-helixtrans-55.8-40.5173.9170.80000110.5L181 A207 L208 L215 A247 I251L181-V211 HydrophobicContact CB-CG2 4.47Å; L181-V211 HydrophobicContact CD1-CG2 3.97Å; A207-V211 WeakPolarHBondContact O-CG2 3.42Å; A207-V211 PolarHBondContact O-N 3.26Å; L208-V211 PolarHBondContact O-N 3.43Å; V211-L215 HydrophobicContact CG1-CD1 3.68Å; V211-L215 HydrophobicContact CG1-CG 4.41Å; V211-L215 WeakPolarHBondContact O-CB 3.1Å; V211-L215 WeakPolarHBondContact O-CG 3.24Å; V211-L215 PolarHBondContact O-N 3.45Å; V211-A247 HydrophobicContact CG1-CB 3.87Å; V211-I251 HydrophobicContact CG1-CD1 3.87Å
212S50.8Low48.2Very low18 Ų1863.6 Ų63.613%0.12634%0.34CS..Hα-helixtrans-75.4-35-177.773.50000114.4L208 L209 F210 F216L208-S212 VanDerWaalsContact O-CB 3.24Å; L208-S212 WeakPolarHBondContact O-CB 3.32Å; L208-S212 PolarHBondContact O-N 3.37Å; L208-S212 PolarHBondContact O-OG 3.27Å; L209-S212 WeakPolarHBondContact CA-OG 3.5Å; L209-S212 CarbonylContact O-C 3.43Å; L209-S212 PolarHBondContact O-N 2.78Å; L209-S212 PolarHBondContact O-OG 3.24Å; F210-S212 PolarHBondContact O-N 3.31Å; S212-F216 CarbonylContact O-C 3.38Å; S212-F216 VanDerWaalsContact O-C 3.26Å; S212-F216 WeakPolarHBondContact O-CA 3.49Å; S212-F216 WeakPolarHBondContact O-CB 3.28Å; S212-F216 PolarHBondContact O-N 3.12Å
213L49.4Very low47.8Very low77 Ų7762.3 Ų62.340%0.40333%0.334SS..Hα-helixtrans-73.5-42.4174.3-78.3161000110.2L209 F210 G217L209-L213 HydrophobicContact CD2-CD1 3.72Å; L209-L213 HydrophobicContact CG-CD1 3.92Å; L209-L213 VanDerWaalsContact O-CB 3.29Å; L209-L213 WeakPolarHBondContact O-CB 3.29Å; L209-L213 WeakPolarHBondContact O-CD1 3.27Å; L209-L213 VanDerWaalsContact O-CG 3.32Å; L209-L213 WeakPolarHBondContact O-CG 3.2Å; L209-L213 PolarHBondContact O-N 2.9Å; F210-L213 PolarHBondContact O-N 3.49Å; L213-G217 WeakPolarHBondContact O-CA 3.42Å; L213-G217 PolarHBondContact O-N 2.91Å
214A49.3Very low47.5Very low37 Ų3766 Ų6631%0.30635%0.354SS..Hα-helixtrans-67.9-43.7179.100000111.7F210 R306F210-A214 HydrophobicContact CZ-CB 4.48Å; F210-A214 WeakPolarHBondContact O-CB 3.24Å; F210-A214 PolarHBondContact O-N 2.89Å; A214-R306 PolarHBondContact O-NH1 2.97Å; A214-R306 PolarHBondContact O-NH2 2.84Å
215L48.9Very low47.1Very low22 Ų2271.1 Ų71.112%0.11538%0.376CS..Hα-helixtrans-87-33.7179.2-68.6175.2000113.9L178 V211 I251 L254L178-L215 HydrophobicContact CD2-CD2 4.48Å; V211-L215 HydrophobicContact CG1-CD1 3.68Å; V211-L215 HydrophobicContact CG1-CG 4.41Å; V211-L215 WeakPolarHBondContact O-CB 3.1Å; V211-L215 WeakPolarHBondContact O-CG 3.24Å; V211-L215 PolarHBondContact O-N 3.45Å; L215-I251 HydrophobicContact CD1-CD1 4.42Å; L215-I251 HydrophobicContact CD1-CG1 4Å; L215-L254 HydrophobicContact CD2-CD1 4Å
216F52.2Low46.2Very low19 Ų1969.8 Ų69.88%0.08338%0.38CS..Hα-helixtrans-12834.6-165.7-42.8-72.3000114.3S212 N218 V219 A247 C250 A299 N302S212-F216 CarbonylContact O-C 3.38Å; S212-F216 VanDerWaalsContact O-C 3.26Å; S212-F216 WeakPolarHBondContact O-CA 3.49Å; S212-F216 WeakPolarHBondContact O-CB 3.28Å; S212-F216 PolarHBondContact O-N 3.12Å; F216-N218 PolarHBondContact O-N 3.29Å; F216-V219 HydrophobicContact CB-CB 4.26Å; F216-V219 HydrophobicContact CB-CG2 3.57Å; F216-V219 HydrophobicContact CG-CG2 4.37Å; F216-V219 PolarHBondContact O-N 3.15Å; F216-A247 HydrophobicContact CE2-CB 3.95Å; F216-A247 HydrophobicContact CZ-CB 4.35Å; F216-C250 HydrophobicContact CZ-CB 4.34Å; F216-A299 HydrophobicContact CD1-CB 4.46Å; F216-A299 HydrophobicContact CE1-CB 3.65Å; F216-A299 HydrophobicContact CZ-CB 4.41Å; F216-N302 WeakPolarHBondContact CA-ND2 3.47Å
217G48.1Very low45.3Very low52 Ų5271 Ų7154%0.53639%0.389SS..THydrogen-bonded Turntrans-39.8-14.3-172.400000119.5L213L213-G217 WeakPolarHBondContact O-CA 3.42Å; L213-G217 PolarHBondContact O-N 2.91Å
218N47.1Very low45Very low120 Ų12079 Ų7964%0.64242%0.418SS*.THydrogen-bonded Turntrans-106.20.5174.5-73.6-24.2000116.9F216 N220 S221F216-N218 PolarHBondContact O-N 3.29Å; N218-N220 PolarHBondContact O-N 3.37Å; N218-S221 PolarHBondContact O-N 2.92Å; N218-S221 PolarHBondContact O-OG 3.5Å
219V42.9Very low44.4Very low42 Ų4279.8 Ų79.826%0.25543%0.427SS..Hα-helixtrans-68.5-20.9-177.2172.10000113.2F216 S221 Y222 H223F216-V219 HydrophobicContact CB-CB 4.26Å; F216-V219 HydrophobicContact CB-CG2 3.57Å; F216-V219 HydrophobicContact CG-CG2 4.37Å; F216-V219 PolarHBondContact O-N 3.15Å; V219-S221 PolarHBondContact O-N 3.4Å; V219-S221 VanDerWaalsContact O-N 3.14Å; V219-Y222 PolarHBondContact O-N 3.17Å; V219-H223 PolarHBondContact O-N 2.86Å
220N39.2Very low43.7Very low105 Ų10585.6 Ų85.656%0.56145%0.449SS*.Hα-helixtrans-61.1-22.8176.4-85.3-15.8000113.8N218 N224N218-N220 PolarHBondContact O-N 3.37Å; N220-N224 WeakPolarHBondContact O-CB 3.39Å; N220-N224 PolarHBondContact O-N 2.86Å; N220-N224 PolarHBondContact O-ND2 3.4Å
221S43.3Very low43Very low80 Ų8091.5 Ų91.556%0.55947%0.474SS*.Hα-helixtrans-74.1-38177.672.40000112.7N218 V219N218-S221 PolarHBondContact O-N 2.92Å; N218-S221 PolarHBondContact O-OG 3.5Å; V219-S221 PolarHBondContact O-N 3.4Å; V219-S221 VanDerWaalsContact O-N 3.14Å
222Y41.4Very low42.5Very low153 Ų153101.1 Ų101.160%0.651%0.509SS*.Hα-helixtrans-77.6-33.8-179.8-86.4-85.4000112.5V219V219-Y222 PolarHBondContact O-N 3.17Å
223H39.2Very low42.2Very low73 Ų73108 Ų10834%0.33854%0.54SS..Hα-helixtrans-79.1-26.2179.9-112.5-27.5000114.3V219 Q225 D226 L227V219-H223 PolarHBondContact O-N 2.86Å; H223-Q225 PolarHBondContact O-N 3.16Å; H223-D226 PolarHBondContact O-N 2.82Å; H223-L227 PolarHBondContact O-N 3.33Å
224N39.2Very low41.9Very low103 Ų103111 Ų11155%0.55156%0.556SS**THydrogen-bonded Turntrans-68.4-20178.6-86.5-20.8000113.8N220N220-N224 WeakPolarHBondContact O-CB 3.39Å; N220-N224 PolarHBondContact O-N 2.86Å; N220-N224 PolarHBondContact O-ND2 3.4Å
225Q40Very low41.7Very low162 Ų162112.4 Ų112.476%0.75756%0.558SS**THydrogen-bonded Turntrans-71.4-29.2173.6-77.2-172.9-12.700112.7H223H223-Q225 PolarHBondContact O-N 3.16Å
226D34.3Very low41.2Very low117 Ų117115.9 Ų115.963%0.62657%0.573SS**THydrogen-bonded Turntrans-93.6-24.1-178.8-100.1-19.8000114.4H223 K228 S229H223-D226 PolarHBondContact O-N 2.82Å; D226-K228 PolarHBondContact O-N 3.04Å; D226-K228 VanDerWaalsContact O-N 3.15Å; D226-S229 PolarHBondContact O-N 3.33Å; D226-S229 VanDerWaalsContact O-N 3.07Å; D226-S229 PolarHBondContact O-OG 3.49Å
227L32.7Very low40.6Very low109 Ų109117.9 Ų117.957%0.57159%0.593SS**THydrogen-bonded Turntrans-70.1-6.3180-83167.9000114.7H223 S229H223-L227 PolarHBondContact O-N 3.33Å; L227-S229 PolarHBondContact O-N 3.45Å
228K42.9Very low40.4Very low196 Ų196120 Ų12085%0.85259%0.587SS**THydrogen-bonded Turntrans-68.8-9.9167-75.5-172177.4179.70112.8D226D226-K228 PolarHBondContact O-N 3.04Å; D226-K228 VanDerWaalsContact O-N 3.15Å
229S38.6Very low40.4Very low61 Ų61118 Ų11843%0.42758%0.576SS.*SBendtrans-91.8120172.870.30000111.6D226 L227 K231D226-S229 PolarHBondContact O-N 3.33Å; D226-S229 VanDerWaalsContact O-N 3.07Å; D226-S229 PolarHBondContact O-OG 3.49Å; L227-S229 PolarHBondContact O-N 3.45Å; S229-K231 PolarHBondContact O-N 3.09Å
230K37.4Very low40.5Very low219 Ų219118 Ų11895%0.95258%0.578SS**  trans-6767.9-179.6-72.4179.6174.41760112.7
231K34.9Very low40.8Very low147 Ų147120.3 Ų120.364%0.63958%0.583SS**  trans-90.7144.6174.8-79-178.5176.3173.30112.8S229S229-K231 PolarHBondContact O-N 3.09Å
232R41.8Very low41.1Very low212 Ų212118 Ų11880%0.857%0.565SS**  trans-62.7149.7-165.4-70.9178.2173.7177.1-2.4112.5N234 D235 K236R232-N234 PolarHBondContact O-N 3.37Å; R232-D235 PolarHBondContact O-N 2.95Å; R232-K236 PolarHBondContact O-N 2.94Å
233E42.7Very low41.4Very low162 Ų162113.3 Ų113.376%0.75755%0.55SS*.Hα-helixtrans-54.2-27.9-179.9-74.8-174.6135.600114.7D235 K236 A237E233-D235 VanDerWaalsContact C-N 3.33Å; E233-D235 PolarHBondContact O-N 2.94Å; E233-K236 WeakPolarHBondContact O-CB 3.44Å; E233-K236 PolarHBondContact O-N 3.09Å; E233-A237 PolarHBondContact O-N 2.85Å; E233-A237 VanDerWaalsContact O-N 3.16Å
234N44Very low41.9Very low141 Ų141111.1 Ų111.175%0.75454%0.544SS*.Hα-helixtrans-66.6-31.3174.9-83.6-2.4000113.3R232 K238R232-N234 PolarHBondContact O-N 3.37Å; N234-K238 PolarHBondContact O-N 3.31Å
235D44.8Very low42.4Very low66 Ų66109.3 Ų109.335%0.35354%0.537SS..Hα-helixtrans-73.5-35.3173.3-70.7-30.4000110.4R232 E233 A237 K238 D239R232-D235 PolarHBondContact O-N 2.95Å; E233-D235 VanDerWaalsContact C-N 3.33Å; E233-D235 PolarHBondContact O-N 2.94Å; D235-A237 VanDerWaalsContact C-N 3.32Å; D235-A237 PolarHBondContact O-N 2.91Å; D235-K238 CarbonylContact O-C 3.6Å; D235-K238 WeakPolarHBondContact O-CA 3.27Å; D235-K238 WeakPolarHBondContact O-CB 3.27Å; D235-K238 PolarHBondContact O-N 3.29Å; D235-D239 WeakPolarHBondContact O-CB 3.32Å; D235-D239 VanDerWaalsContact O-CG 3.24Å; D235-D239 PolarHBondContact O-N 2.78Å
236K38.6Very low42.9Very low95 Ų95102 Ų10241%0.41351%0.505SS..Hα-helixtrans-60.2-39.5174.4-63.6-175.8179.9178.40112.6R232 E233 K238 S240R232-K236 PolarHBondContact O-N 2.94Å; E233-K236 WeakPolarHBondContact O-CB 3.44Å; E233-K236 PolarHBondContact O-N 3.09Å; K236-K238 VanDerWaalsContact C-N 3.33Å; K236-S240 WeakPolarHBondContact O-CB 3.21Å; K236-S240 PolarHBondContact O-N 2.99Å; K236-S240 PolarHBondContact O-OG 2.72Å
237A39.7Very low43.7Very low61 Ų6196.7 Ų96.750%0.50448%0.477SS..Hα-helixtrans-67.1-36.5175.100000111.8E233 D235 K241E233-A237 PolarHBondContact O-N 2.85Å; E233-A237 VanDerWaalsContact O-N 3.16Å; D235-A237 VanDerWaalsContact C-N 3.32Å; D235-A237 PolarHBondContact O-N 2.91Å; A237-K241 PolarHBondContact O-N 3.18Å; A237-K241 VanDerWaalsContact O-N 3.11Å
238K44.6Very low44.7Very low97 Ų9793 Ų9342%0.42246%0.464SS..Hα-helixtrans-70.5-41.9178.3-159.6176.4179.7-176.80112.2N234 D235 K236 K241 T242N234-K238 PolarHBondContact O-N 3.31Å; D235-K238 CarbonylContact O-C 3.6Å; D235-K238 WeakPolarHBondContact O-CA 3.27Å; D235-K238 WeakPolarHBondContact O-CB 3.27Å; D235-K238 PolarHBondContact O-N 3.29Å; K236-K238 VanDerWaalsContact C-N 3.33Å; K238-K241 WeakPolarHBondContact O-CB 3.36Å; K238-K241 PolarHBondContact O-N 3.04Å; K238-T242 PolarHBondContact O-N 2.7Å; K238-T242 PolarHBondContact O-OG1 3.46Å; K238-T242 VanDerWaalsContact O-OG1 3.06Å
239D47.2Very low45.2Very low76 Ų7684.2 Ų84.241%0.40643%0.428SS..Hα-helixtrans-67.3-38.2175.9-66.5-19.4000111.6D235 K241 T242 M243D235-D239 WeakPolarHBondContact O-CB 3.32Å; D235-D239 VanDerWaalsContact O-CG 3.24Å; D235-D239 PolarHBondContact O-N 2.78Å; D239-K241 VanDerWaalsContact C-N 3.29Å; D239-K241 PolarHBondContact O-N 3.37Å; D239-T242 VanDerWaalsContact CA-OG1 3.28Å; D239-T242 WeakPolarHBondContact CA-OG1 3.46Å; D239-T242 PolarHBondContact O-N 3.07Å; D239-T242 PolarHBondContact O-OG1 2.94Å; D239-T242 VanDerWaalsContact O-OG1 3.05Å; D239-M243 PolarHBondContact O-N 3.41Å
240S43.7Very low45.9Very low42 Ų4281.8 Ų81.829%0.29441%0.41SS..Hα-helixtrans-62.7-38.1172.6-55.10000111.3K236 A244K236-S240 WeakPolarHBondContact O-CB 3.21Å; K236-S240 PolarHBondContact O-N 2.99Å; K236-S240 PolarHBondContact O-OG 2.72Å; S240-A244 WeakPolarHBondContact O-CB 3.32Å; S240-A244 PolarHBondContact O-N 3.31Å
241K46.1Very low46.7Very low154 Ų15472 Ų7267%0.6737%0.368SS*.Hα-helixtrans-67.7-40.9176.4-169.3175.3-177.3171.50111.6A237 K238 D239 A244 V245A237-K241 PolarHBondContact O-N 3.18Å; A237-K241 VanDerWaalsContact O-N 3.11Å; K238-K241 WeakPolarHBondContact O-CB 3.36Å; K238-K241 PolarHBondContact O-N 3.04Å; D239-K241 VanDerWaalsContact C-N 3.29Å; D239-K241 PolarHBondContact O-N 3.37Å; K241-A244 WeakPolarHBondContact O-CB 3.35Å; K241-A244 PolarHBondContact O-N 3.3Å; K241-V245 WeakPolarHBondContact O-CG2 3.27Å; K241-V245 PolarHBondContact O-N 2.95Å
242T48.9Very low47.5Very low31 Ų3169.3 Ų69.319%0.1936%0.358CS..Hα-helixtrans-70.3-37.5176.532.30000112.8K238 D239 A244 V245 A246 N292K238-T242 PolarHBondContact O-N 2.7Å; K238-T242 PolarHBondContact O-OG1 3.46Å; K238-T242 VanDerWaalsContact O-OG1 3.06Å; D239-T242 VanDerWaalsContact CA-OG1 3.28Å; D239-T242 WeakPolarHBondContact CA-OG1 3.46Å; D239-T242 PolarHBondContact O-N 3.07Å; D239-T242 PolarHBondContact O-OG1 2.94Å; D239-T242 VanDerWaalsContact O-OG1 3.05Å; T242-A244 VanDerWaalsContact C-N 3.34Å; T242-V245 PolarHBondContact O-N 3.36Å; T242-A246 WeakPolarHBondContact O-CB 3.25Å; T242-A246 PolarHBondContact O-N 3.2Å; T242-N292 VanDerWaalsContact CB-OD1 3.29Å; T242-N292 WeakPolarHBondContact CB-OD1 3.33Å; T242-N292 WeakPolarHBondContact CG2-OD1 3.17Å
243M49Very low48Very low55 Ų5560.2 Ų60.227%0.27133%0.325SS..Hα-helixtrans-59.5-43.5167.6-98-172.269.800111.9D239 A246 A247D239-M243 PolarHBondContact O-N 3.41Å; M243-A246 PolarHBondContact O-N 2.96Å; M243-A247 VanDerWaalsContact O-CB 3.26Å; M243-A247 WeakPolarHBondContact O-CB 3.25Å; M243-A247 PolarHBondContact O-N 3.22Å
244A48.9Very low48.5Very low27 Ų2753.3 Ų53.322%0.22329%0.293CS..Hα-helixtrans-63.4-42.1178.400000112.2L208 S240 K241 T242 G248L208-A244 HydrophobicContact CD1-CB 3.8Å; L208-A244 HydrophobicContact CD2-CB 3.59Å; L208-A244 HydrophobicContact CG-CB 4.37Å; S240-A244 WeakPolarHBondContact O-CB 3.32Å; S240-A244 PolarHBondContact O-N 3.31Å; K241-A244 WeakPolarHBondContact O-CB 3.35Å; K241-A244 PolarHBondContact O-N 3.3Å; T242-A244 VanDerWaalsContact C-N 3.34Å; A244-G248 PolarHBondContact O-N 3.28Å
245V49.7Very low48.8Very low65 Ų6548 Ų4839%0.39427%0.266SS..Hα-helixtrans-65.2-44.2175.7173.40000110.7K241 T242 G248 V249 W284K241-V245 WeakPolarHBondContact O-CG2 3.27Å; K241-V245 PolarHBondContact O-N 2.95Å; T242-V245 PolarHBondContact O-N 3.36Å; V245-G248 PolarHBondContact O-N 3.3Å; V245-V249 WeakPolarHBondContact O-CG2 3.15Å; V245-V249 PolarHBondContact O-N 3.47Å; V245-W284 HydrophobicContact CG1-CH2 3.86Å; V245-W284 HydrophobicContact CG1-CZ2 4.42Å
246A51.6Low49Very low10 Ų1046.3 Ų46.38%0.08326%0.261CS..Hα-helixtrans-64.5-44.9177.900000112T242 M243 G248 V249 C250 I295T242-A246 WeakPolarHBondContact O-CB 3.25Å; T242-A246 PolarHBondContact O-N 3.2Å; M243-A246 PolarHBondContact O-N 2.96Å; A246-G248 VanDerWaalsContact C-N 3.31Å; A246-G248 PolarHBondContact O-N 2.94Å; A246-V249 PolarHBondContact O-N 2.89Å; A246-C250 PolarHBondContact O-N 2.94Å; A246-C250 PolarHBondContact O-SG 3.39Å; A246-I295 HydrophobicContact CB-CB 4.19Å; A246-I295 HydrophobicContact CB-CG2 3.4Å; A246-I295 VanDerWaalsContact CB-CG2 3.4Å
247A50.9Low49.5Very low5 Ų542.6 Ų42.64%0.04125%0.246CC..Hα-helixtrans-59.8-42.6172.800000111.5V211 F216 M243 V249 C250 I251V211-A247 HydrophobicContact CG1-CB 3.87Å; F216-A247 HydrophobicContact CE2-CB 3.95Å; F216-A247 HydrophobicContact CZ-CB 4.35Å; M243-A247 VanDerWaalsContact O-CB 3.26Å; M243-A247 WeakPolarHBondContact O-CB 3.25Å; M243-A247 PolarHBondContact O-N 3.22Å; A247-V249 PolarHBondContact O-N 3.46Å; A247-C250 WeakPolarHBondContact O-CB 3.39Å; A247-C250 PolarHBondContact O-N 2.84Å; A247-I251 WeakPolarHBondContact O-CB 3.41Å; A247-I251 VanDerWaalsContact O-CG1 3.24Å; A247-I251 WeakPolarHBondContact O-CG1 3.32Å; A247-I251 PolarHBondContact O-N 2.57Å
248G51.9Low50Low30 Ų3040.5 Ų40.531%0.30923%0.228SC..Hα-helixtrans-60.2-42.2174.900000112.8A244 V245 A246 I251 E252A244-G248 PolarHBondContact O-N 3.28Å; V245-G248 PolarHBondContact O-N 3.3Å; A246-G248 VanDerWaalsContact C-N 3.31Å; A246-G248 PolarHBondContact O-N 2.94Å; G248-I251 PolarHBondContact O-N 3.44Å; G248-E252 PolarHBondContact O-N 3.47Å
249V53.5Low50Low13 Ų1341.8 Ų41.88%0.07924%0.24CC..Hα-helixtrans-65.9-40.2174.2173.30000111.3V245 A246 A247 I251 E252 L253 L296V245-V249 WeakPolarHBondContact O-CG2 3.15Å; V245-V249 PolarHBondContact O-N 3.47Å; A246-V249 PolarHBondContact O-N 2.89Å; A247-V249 PolarHBondContact O-N 3.46Å; V249-I251 VanDerWaalsContact C-N 3.33Å; V249-E252 PolarHBondContact O-N 2.98Å; V249-L253 HydrophobicContact CG1-CD1 4.1Å; V249-L253 HydrophobicContact CG1-CG 4.48Å; V249-L253 WeakPolarHBondContact O-CB 3.34Å; V249-L253 VanDerWaalsContact O-CG 3.27Å; V249-L253 WeakPolarHBondContact O-CG 3.38Å; V249-L253 PolarHBondContact O-N 3.48Å; V249-L296 HydrophobicContact CG1-CD1 3.85Å
250C54.1Low50Low9 Ų941.3 Ų41.36%0.06124%0.235CC..Hα-helixtrans-64.1-39.4174.1-62.70000112.1F216 A246 A247 L253 L254 A299F216-C250 HydrophobicContact CZ-CB 4.34Å; A246-C250 PolarHBondContact O-N 2.94Å; A246-C250 PolarHBondContact O-SG 3.39Å; A247-C250 WeakPolarHBondContact O-CB 3.39Å; A247-C250 PolarHBondContact O-N 2.84Å; C250-L253 PolarHBondContact O-N 2.9Å; C250-L254 WeakPolarHBondContact O-CB 3.44Å; C250-L254 VanDerWaalsContact O-CG 3.29Å; C250-L254 WeakPolarHBondContact O-CG 3.19Å; C250-L254 PolarHBondContact O-N 3.43Å; C250-A299 WeakPolarHBondContact SG-CB 3.29Å
251I53.4Low49.9Very low13 Ų1344.5 Ų44.57%0.06725%0.245CC..Hα-helixtrans-67-44.2174.8-67.6168.4000110.3L178 K182 V211 L215 A247 G248 V249 L253 L254 V255L178-I251 HydrophobicContact CD2-CD1 4.37Å; L178-I251 HydrophobicContact CD2-CG1 4.25Å; K182-I251 HydrophobicContact CB-CG2 4.34Å; V211-I251 HydrophobicContact CG1-CD1 3.87Å; L215-I251 HydrophobicContact CD1-CD1 4.42Å; L215-I251 HydrophobicContact CD1-CG1 4Å; A247-I251 WeakPolarHBondContact O-CB 3.41Å; A247-I251 VanDerWaalsContact O-CG1 3.24Å; A247-I251 WeakPolarHBondContact O-CG1 3.32Å; A247-I251 PolarHBondContact O-N 2.57Å; G248-I251 PolarHBondContact O-N 3.44Å; V249-I251 VanDerWaalsContact C-N 3.33Å; I251-L253 VanDerWaalsContact C-N 3.31Å; I251-L253 PolarHBondContact O-N 3.28Å; I251-L254 PolarHBondContact O-N 3.01Å; I251-V255 HydrophobicContact CG2-CG2 4.16Å; I251-V255 WeakPolarHBondContact O-CB 3.48Å; I251-V255 VanDerWaalsContact O-CG2 3.25Å; I251-V255 WeakPolarHBondContact O-CG2 3.43Å; I251-V255 PolarHBondContact O-N 2.8Å
252E52.3Low49.9Very low91 Ų9138.9 Ų38.943%0.42523%0.231SC..Hα-helixtrans-57.3-44.9173.6-82.7-169.8163.900111.5G248 V249 V255 A256 R280G248-E252 PolarHBondContact O-N 3.47Å; V249-E252 PolarHBondContact O-N 2.98Å; E252-V255 PolarHBondContact O-N 3.48Å; E252-A256 VanDerWaalsContact O-CB 3.27Å; E252-A256 WeakPolarHBondContact O-CB 3.34Å; E252-A256 PolarHBondContact O-N 3.48Å; E252-R280 IonicContact OE2-CZ 3.53Å; E252-R280 IonicContact OE2-NH1 2.98Å; E252-R280 PolarHBondContact OE2-NH1 3.22Å; E252-R280 IonicContact OE2-NH2 3.37Å; E252-R280 PolarHBondContact OE2-NH2 3.11Å
253L52.8Low49.4Very low22 Ų2244 Ų4412%0.11526%0.257CS..Hα-helixtrans-63-45.9176.6-74.5169.6000111V249 C250 I251 V255 A256 I257 L277V249-L253 HydrophobicContact CG1-CD1 4.1Å; V249-L253 HydrophobicContact CG1-CG 4.48Å; V249-L253 WeakPolarHBondContact O-CB 3.34Å; V249-L253 VanDerWaalsContact O-CG 3.27Å; V249-L253 WeakPolarHBondContact O-CG 3.38Å; V249-L253 PolarHBondContact O-N 3.48Å; C250-L253 PolarHBondContact O-N 2.9Å; I251-L253 VanDerWaalsContact C-N 3.31Å; I251-L253 PolarHBondContact O-N 3.28Å; L253-V255 PolarHBondContact O-N 3.17Å; L253-A256 PolarHBondContact O-N 3.2Å; L253-I257 WeakPolarHBondContact O-CB 3.26Å; L253-I257 VanDerWaalsContact O-CD1 3.24Å; L253-I257 WeakPolarHBondContact O-CD1 3.3Å; L253-I257 WeakPolarHBondContact O-CG1 3.49Å; L253-I257 PolarHBondContact O-N 3.38Å; L253-L277 HydrophobicContact CD1-CD1 4.34Å; L253-L277 HydrophobicContact CD2-CD1 3.64Å; L253-L277 HydrophobicContact CD2-CG 4.33Å
254L52.3Low48.8Very low17 Ų1748.6 Ų48.69%0.08928%0.282CS..Hα-helixtrans-62.6-40.3176.7-77168.9000112.6L178 L215 C250 I251 A258 L303 F307L178-L254 HydrophobicContact CD1-CD1 4.37Å; L215-L254 HydrophobicContact CD2-CD1 4Å; C250-L254 WeakPolarHBondContact O-CB 3.44Å; C250-L254 VanDerWaalsContact O-CG 3.29Å; C250-L254 WeakPolarHBondContact O-CG 3.19Å; C250-L254 PolarHBondContact O-N 3.43Å; I251-L254 PolarHBondContact O-N 3.01Å; L254-A258 WeakPolarHBondContact O-CB 3.45Å; L254-A258 PolarHBondContact O-N 3.12Å; L254-L303 HydrophobicContact CD1-CD1 4.42Å; L254-L303 HydrophobicContact CD2-CD1 3.64Å; L254-L303 HydrophobicContact CG-CD1 3.88Å; L254-F307 HydrophobicContact CD2-CD2 4Å; L254-F307 HydrophobicContact CD2-CE2 3.36Å; L254-F307 HydrophobicContact CD2-CZ 3.82Å
255V50.7Low48.4Very low29 Ų2954.6 Ų54.618%0.17631%0.31CS..Hα-helixtrans-68.5-43.5176.7171.70000110.6I251 E252 L253 I257 A258 D259I251-V255 HydrophobicContact CG2-CG2 4.16Å; I251-V255 WeakPolarHBondContact O-CB 3.48Å; I251-V255 VanDerWaalsContact O-CG2 3.25Å; I251-V255 WeakPolarHBondContact O-CG2 3.43Å; I251-V255 PolarHBondContact O-N 2.8Å; E252-V255 PolarHBondContact O-N 3.48Å; L253-V255 PolarHBondContact O-N 3.17Å; V255-I257 VanDerWaalsContact C-N 3.33Å; V255-I257 PolarHBondContact O-N 3.49Å; V255-A258 CarbonylContact O-C 3.58Å; V255-A258 PolarHBondContact O-N 2.87Å; V255-A258 VanDerWaalsContact O-N 3.1Å; V255-D259 PolarHBondContact O-N 3.41Å
256A50.1Low48.2Very low31 Ų3156.8 Ų56.826%0.25632%0.32SS..Hα-helixtrans-61.8-41.5175.400000111.7E252 L253 A258 E260E252-A256 VanDerWaalsContact O-CB 3.27Å; E252-A256 WeakPolarHBondContact O-CB 3.34Å; E252-A256 PolarHBondContact O-N 3.48Å; L253-A256 PolarHBondContact O-N 3.2Å; A256-A258 VanDerWaalsContact C-N 3.32Å; A256-A258 PolarHBondContact O-N 2.9Å; A256-E260 WeakPolarHBondContact O-CB 3.49Å; A256-E260 WeakPolarHBondContact O-CG 3.16Å; A256-E260 PolarHBondContact O-N 2.8Å; A256-E260 VanDerWaalsContact O-N 3.07Å
257I49.2Very low48.2Very low17 Ų1766.9 Ų66.99%0.08736%0.356CS..Hα-helixtrans-61.1-41.8172.4-68.3158.6000110.9L253 V255 Q261 L273 L310L253-I257 WeakPolarHBondContact O-CB 3.26Å; L253-I257 VanDerWaalsContact O-CD1 3.24Å; L253-I257 WeakPolarHBondContact O-CD1 3.3Å; L253-I257 WeakPolarHBondContact O-CG1 3.49Å; L253-I257 PolarHBondContact O-N 3.38Å; V255-I257 VanDerWaalsContact C-N 3.33Å; V255-I257 PolarHBondContact O-N 3.49Å; I257-Q261 PolarHBondContact O-N 2.79Å; I257-L273 HydrophobicContact CD1-CD1 4.39Å; I257-L273 HydrophobicContact CD1-CD2 4.22Å; I257-L273 HydrophobicContact CG1-CD1 3.65Å; I257-L273 HydrophobicContact CG1-CD2 3.69Å; I257-L273 HydrophobicContact CG1-CG 4.32Å; I257-L310 HydrophobicContact CD1-CD1 3.82Å; I257-L310 HydrophobicContact CG2-CD1 4.1Å; I257-L310 HydrophobicContact CG2-CD2 4.2Å
258A48.5Very low48Very low16 Ų1671.7 Ų71.713%0.13238%0.38CS..Hα-helixtrans-78.1-23.7-176.400000114.6R166 L175 L254 V255 A256R166-A258 PolarHBondContact NH2-O 2.83Å; L175-A258 HydrophobicContact CD1-CB 3.97Å; L175-A258 HydrophobicContact CD2-CB 3.46Å; L175-A258 VanDerWaalsContact CD2-CB 3.46Å; L175-A258 HydrophobicContact CG-CB 4.38Å; L254-A258 WeakPolarHBondContact O-CB 3.45Å; L254-A258 PolarHBondContact O-N 3.12Å; V255-A258 CarbonylContact O-C 3.58Å; V255-A258 PolarHBondContact O-N 2.87Å; V255-A258 VanDerWaalsContact O-N 3.1Å; A256-A258 VanDerWaalsContact C-N 3.32Å; A256-A258 PolarHBondContact O-N 2.9Å
259D45.3Very low47.9Very low124 Ų12472 Ų7266%0.66338%0.378SS*.Hα-helixtrans-81.5-35.9172-87.9-11.4000111.4V255V255-D259 PolarHBondContact O-N 3.41Å
260E46.9Very low47.9Very low66 Ų6675.5 Ų75.531%0.30840%0.395SS..Hα-helixtrans-85-13.3-175.8-72-178.5-175.100114.2A256 G262 K276A256-E260 WeakPolarHBondContact O-CB 3.49Å; A256-E260 WeakPolarHBondContact O-CG 3.16Å; A256-E260 PolarHBondContact O-N 2.8Å; A256-E260 VanDerWaalsContact O-N 3.07Å; E260-G262 PolarHBondContact O-N 3.39Å; E260-G262 VanDerWaalsContact O-N 3.12Å; E260-K276 IonicContact OE1-NZ 3.96Å
261Q42.1Very low47.8Very low110 Ų11080.5 Ų80.551%0.51442%0.421SS..THydrogen-bonded Turntrans-69.50.7172.1-84.7-170.6-1400114.5I257I257-Q261 PolarHBondContact O-N 2.79Å
262G44.9Very low47.9Very low35 Ų3583.1 Ų83.136%0.36143%0.434SS..THydrogen-bonded Turntrans-71.5-22.2176.300000115.6E260E260-G262 PolarHBondContact O-N 3.39Å; E260-G262 VanDerWaalsContact O-N 3.12Å
263D39Very low48.1Very low138 Ų13879.3 Ų79.374%0.73842%0.417SS*.SBendtrans-118.193.3176.2-91.1-32000109.3D265D263-D265 PolarHBondContact O-N 2.8Å
264L37.3Very low48.3Very low152 Ų15282.8 Ų82.880%0.79643%0.429SS*.  trans-80.512.4-168.6-128.5125000115.1
265D40.4Very low48.7Very low154 Ų15489.8 Ų89.882%0.82446%0.455SS*.  trans-130.874.1174.6-87.6-28.7000110.4D263D263-D265 PolarHBondContact O-N 2.8Å
266D45.9Very low49.2Very low111 Ų11192.7 Ų92.759%0.59447%0.465SS*.  trans-162.9126.8143.9-110.8-27.3000113.3L268 S269D266-L268 HydrophobicContact CB-CB 4.02Å; D266-L268 PolarHBondContact O-N 3.24Å; D266-S269 PolarHBondContact O-N 3.15Å
267R50.9Low49.8Very low221 Ų22191.4 Ų91.483%0.83445%0.454SS*.Hα-helixtrans-49.5-19.6165.1-95.4175.5165.8174.7-3.6112.6L271R267-L271 WeakPolarHBondContact O-CB 3.2Å; R267-L271 PolarHBondContact O-N 3.26Å
268L47.3Very low50.4Low106 Ų10692.5 Ų92.556%0.55546%0.462SS*.Hα-helixtrans-66.7-42.9-179.7-164.468.5000113.2D266 L271 I272D266-L268 HydrophobicContact CB-CB 4.02Å; D266-L268 PolarHBondContact O-N 3.24Å; L268-L271 CarbonylContact O-C 3.56Å; L268-L271 WeakPolarHBondContact O-CA 3.47Å; L268-L271 VanDerWaalsContact O-CB 3.32Å; L268-L271 WeakPolarHBondContact O-CB 3.48Å; L268-L271 PolarHBondContact O-N 2.85Å; L268-L271 VanDerWaalsContact O-N 3.13Å; L268-I272 HydrophobicContact CG-CD1 4.15Å; L268-I272 WeakPolarHBondContact O-CG1 3.22Å; L268-I272 PolarHBondContact O-N 3.39Å
269S49.6Very low51Low38 Ų3896.9 Ų96.927%0.26648%0.479SS..Hα-helixtrans-68-41.7-176.8-53.30000111.9D266 L271 I272 L273D266-S269 PolarHBondContact O-N 3.15Å; S269-L271 VanDerWaalsContact C-N 3.3Å; S269-L271 PolarHBondContact O-N 3.48Å; S269-I272 PolarHBondContact O-N 2.85Å; S269-L273 WeakPolarHBondContact O-CB 3.28Å; S269-L273 PolarHBondContact O-N 2.66Å
270L52.3Low51.7Low85 Ų8596.2 Ų96.245%0.44547%0.467SS..Hα-helixtrans-64-34.6171.1-83.7164.4000112.3R274 A313L270-R274 WeakPolarHBondContact O-CB 3.14Å; L270-R274 PolarHBondContact O-N 2.81Å; L270-A313 HydrophobicContact CD2-CB 3.91Å
271L51.6Low52.5Low115 Ų11593.5 Ų93.560%0.60246%0.455SS*.Hα-helixtrans-67.1-42174.2-126.1127.7000111.8R267 L268 S269 R274 Y275R267-L271 WeakPolarHBondContact O-CB 3.2Å; R267-L271 PolarHBondContact O-N 3.26Å; L268-L271 CarbonylContact O-C 3.56Å; L268-L271 WeakPolarHBondContact O-CA 3.47Å; L268-L271 VanDerWaalsContact O-CB 3.32Å; L268-L271 WeakPolarHBondContact O-CB 3.48Å; L268-L271 PolarHBondContact O-N 2.85Å; L268-L271 VanDerWaalsContact O-N 3.13Å; S269-L271 VanDerWaalsContact C-N 3.3Å; S269-L271 PolarHBondContact O-N 3.48Å; L271-R274 PolarHBondContact O-N 3.07Å; L271-Y275 WeakPolarHBondContact O-CB 3.16Å; L271-Y275 PolarHBondContact O-N 2.75Å
272I56.2Low53.2Low67 Ų6789.8 Ų89.834%0.34444%0.441SS..Hα-helixtrans-64.7-44.2175.9-68.9165.1000110.3L268 S269 Y275 K276L268-I272 HydrophobicContact CG-CD1 4.15Å; L268-I272 WeakPolarHBondContact O-CG1 3.22Å; L268-I272 PolarHBondContact O-N 3.39Å; S269-I272 PolarHBondContact O-N 2.85Å; I272-Y275 PolarHBondContact O-N 2.78Å; I272-K276 HydrophobicContact CG2-CD 3.96Å; I272-K276 HydrophobicContact CG2-CG 4.26Å; I272-K276 WeakPolarHBondContact O-CB 3.42Å; I272-K276 WeakPolarHBondContact O-CG 3.47Å; I272-K276 PolarHBondContact O-N 3.5Å
273L57Low53.7Low11 Ų1189.8 Ų89.86%0.05844%0.441CS..Hα-helixtrans-60.9-46.4176.1-173.476000111.1I257 S269 Y275 K276 L277 A314I257-L273 HydrophobicContact CD1-CD1 4.39Å; I257-L273 HydrophobicContact CD1-CD2 4.22Å; I257-L273 HydrophobicContact CG1-CD1 3.65Å; I257-L273 HydrophobicContact CG1-CD2 3.69Å; I257-L273 HydrophobicContact CG1-CG 4.32Å; S269-L273 WeakPolarHBondContact O-CB 3.28Å; S269-L273 PolarHBondContact O-N 2.66Å; L273-Y275 VanDerWaalsContact C-N 3.32Å; L273-Y275 PolarHBondContact O-N 3.34Å; L273-K276 PolarHBondContact O-N 3.41Å; L273-L277 HydrophobicContact CD1-CD1 4.38Å; L273-L277 HydrophobicContact CG-CD1 4.21Å; L273-L277 WeakPolarHBondContact O-CB 3.22Å; L273-L277 PolarHBondContact O-N 3.5Å; L273-A314 HydrophobicContact CD2-CB 4.23Å
274R57.1Low54.4Low95 Ų9587.3 Ų87.336%0.35842%0.422SS..Hα-helixtrans-60.2-41.4175.3-175.6178.2172-176.8-1.5111.4L270 L271 T278 P317 N321L270-R274 WeakPolarHBondContact O-CB 3.14Å; L270-R274 PolarHBondContact O-N 2.81Å; L271-R274 PolarHBondContact O-N 3.07Å; R274-T278 WeakPolarHBondContact O-CB 3.49Å; R274-T278 PolarHBondContact O-N 3.17Å; R274-T278 PolarHBondContact O-OG1 3.34Å; R274-P317 VanDerWaalsContact NE-CB 3.33Å; R274-N321 PolarHBondContact NH2-ND2 3.29Å
275Y61.2Low54.9Low164 Ų16486.8 Ų86.864%0.64342%0.415SS*.Hα-helixtrans-65.7-51.1177.1-169.1-92.4000111.6L271 I272 L273 L277 T278 E279L271-Y275 WeakPolarHBondContact O-CB 3.16Å; L271-Y275 PolarHBondContact O-N 2.75Å; I272-Y275 PolarHBondContact O-N 2.78Å; L273-Y275 VanDerWaalsContact C-N 3.32Å; L273-Y275 PolarHBondContact O-N 3.34Å; Y275-L277 VanDerWaalsContact C-N 3.33Å; Y275-L277 PolarHBondContact O-N 3.28Å; Y275-T278 PolarHBondContact O-N 2.66Å; Y275-E279 VanDerWaalsContact O-CB 3.27Å; Y275-E279 WeakPolarHBondContact O-CB 3.32Å; Y275-E279 PolarHBondContact O-N 3.43Å
276K61.2Low55.1Low91 Ų9180.8 Ų80.840%0.39639%0.39SS..Hα-helixtrans-59-39.9176.7-76.1177.8-178.3167.20112.4E260 I272 L273 R280E260-K276 IonicContact OE1-NZ 3.96Å; I272-K276 HydrophobicContact CG2-CD 3.96Å; I272-K276 HydrophobicContact CG2-CG 4.26Å; I272-K276 WeakPolarHBondContact O-CB 3.42Å; I272-K276 WeakPolarHBondContact O-CG 3.47Å; I272-K276 PolarHBondContact O-N 3.5Å; L273-K276 PolarHBondContact O-N 3.41Å; K276-R280 VanDerWaalsContact O-CB 3.25Å; K276-R280 WeakPolarHBondContact O-CB 3.2Å; K276-R280 VanDerWaalsContact O-CG 3.25Å; K276-R280 WeakPolarHBondContact O-CG 3.24Å; K276-R280 PolarHBondContact O-N 3.25Å
277L61.6Low55.3Low4 Ų484.9 Ų84.92%0.02140%0.404CS..Hα-helixtrans-63-50.6174.8-116.6100.5000110.8L253 L273 Y275 E279 R280 I281 L300 A318L253-L277 HydrophobicContact CD1-CD1 4.34Å; L253-L277 HydrophobicContact CD2-CD1 3.64Å; L253-L277 HydrophobicContact CD2-CG 4.33Å; L273-L277 HydrophobicContact CD1-CD1 4.38Å; L273-L277 HydrophobicContact CG-CD1 4.21Å; L273-L277 WeakPolarHBondContact O-CB 3.22Å; L273-L277 PolarHBondContact O-N 3.5Å; Y275-L277 VanDerWaalsContact C-N 3.33Å; Y275-L277 PolarHBondContact O-N 3.28Å; L277-E279 VanDerWaalsContact C-N 3.32Å; L277-E279 PolarHBondContact O-N 3.14Å; L277-R280 PolarHBondContact O-N 2.92Å; L277-I281 HydrophobicContact CD2-CD1 4.42Å; L277-I281 WeakPolarHBondContact O-CB 3.5Å; L277-I281 WeakPolarHBondContact O-CD1 3.09Å; L277-I281 WeakPolarHBondContact O-CG1 3.29Å; L277-I281 PolarHBondContact O-N 3.44Å; L277-L300 HydrophobicContact CD2-CD1 4.37Å; L277-L300 HydrophobicContact CD2-CD2 3.42Å; L277-L300 VanDerWaalsContact CD2-CD2 3.42Å; L277-L300 HydrophobicContact CG-CD2 4.43Å; L277-A318 HydrophobicContact CD2-CB 4.08Å
278T61.2Low55.2Low40 Ų4083 Ų8325%0.24540%0.397CS..Hα-helixtrans-63.4-41.4-178.6-51.90000110.5R274 Y275 S282R274-T278 WeakPolarHBondContact O-CB 3.49Å; R274-T278 PolarHBondContact O-N 3.17Å; R274-T278 PolarHBondContact O-OG1 3.34Å; Y275-T278 PolarHBondContact O-N 2.66Å; T278-S282 VanDerWaalsContact O-CB 3.26Å; T278-S282 WeakPolarHBondContact O-CB 3.4Å; T278-S282 PolarHBondContact O-N 3.43Å; T278-S282 PolarHBondContact O-OG 3.04Å
279E61.5Low55.4Low107 Ų10779.3 Ų79.350%0.538%0.378SS..Hα-helixtrans-65-44.2175.2-166.6-171.2-177.300111.7Y275 L277 S282 G283Y275-E279 VanDerWaalsContact O-CB 3.27Å; Y275-E279 WeakPolarHBondContact O-CB 3.32Å; Y275-E279 PolarHBondContact O-N 3.43Å; L277-E279 VanDerWaalsContact C-N 3.32Å; L277-E279 PolarHBondContact O-N 3.14Å; E279-S282 WeakPolarHBondContact CA-OG 3.35Å; E279-S282 PolarHBondContact O-N 3Å; E279-S282 PolarHBondContact O-OG 3.04Å; E279-G283 VanDerWaalsContact O-CA 3.32Å; E279-G283 WeakPolarHBondContact O-CA 3.26Å; E279-G283 PolarHBondContact O-N 3.46Å
280R61.4Low55.7Low110 Ų11079.5 Ų79.542%0.41538%0.379SS..Hα-helixtrans-67.3-37.6177.2-78-97.2-172.4136.31.5112.4E252 K276 L277 S282E252-R280 IonicContact OE2-CZ 3.53Å; E252-R280 IonicContact OE2-NH1 2.98Å; E252-R280 PolarHBondContact OE2-NH1 3.22Å; E252-R280 IonicContact OE2-NH2 3.37Å; E252-R280 PolarHBondContact OE2-NH2 3.11Å; K276-R280 VanDerWaalsContact O-CB 3.25Å; K276-R280 WeakPolarHBondContact O-CB 3.2Å; K276-R280 VanDerWaalsContact O-CG 3.25Å; K276-R280 WeakPolarHBondContact O-CG 3.24Å; K276-R280 PolarHBondContact O-N 3.25Å; L277-R280 PolarHBondContact O-N 2.92Å; R280-S282 VanDerWaalsContact C-N 3.32Å
281I62.2Low55.7Low9 Ų978.1 Ų78.15%0.04638%0.377CS..Hα-helixtrans-67.3-36.2175.6-64.6162.7000110.5L277 Q293 L296 L300 A318 F322L277-I281 HydrophobicContact CD2-CD1 4.42Å; L277-I281 WeakPolarHBondContact O-CB 3.5Å; L277-I281 WeakPolarHBondContact O-CD1 3.09Å; L277-I281 WeakPolarHBondContact O-CG1 3.29Å; L277-I281 PolarHBondContact O-N 3.44Å; I281-Q293 PolarHBondContact O-NE2 2.79Å; I281-L296 HydrophobicContact CG1-CD2 3.86Å; I281-L300 HydrophobicContact CD1-CD1 3.55Å; I281-L300 HydrophobicContact CG1-CD1 4.24Å; I281-A318 HydrophobicContact CD1-CB 4.28Å; I281-F322 HydrophobicContact CG2-CD2 3.34Å; I281-F322 HydrophobicContact CG2-CE2 3.56Å; I281-F322 HydrophobicContact CG2-CG 4.35Å
282S57.7Low55.8Low33 Ų3374.1 Ų74.123%0.23136%0.356CS..Hα-helixtrans-89.6-29.4-176.757.90000115.2T278 E279 R280 W284T278-S282 VanDerWaalsContact O-CB 3.26Å; T278-S282 WeakPolarHBondContact O-CB 3.4Å; T278-S282 PolarHBondContact O-N 3.43Å; T278-S282 PolarHBondContact O-OG 3.04Å; E279-S282 WeakPolarHBondContact CA-OG 3.35Å; E279-S282 PolarHBondContact O-N 3Å; E279-S282 PolarHBondContact O-OG 3.04Å; R280-S282 VanDerWaalsContact C-N 3.32Å; S282-W284 PolarHBondContact O-N 3.06Å
283G55.6Low56Low35 Ų3571.4 Ų71.436%0.36134%0.342SS..  trans-84.41.1-167.700000116.1E279 H285E279-G283 VanDerWaalsContact O-CA 3.32Å; E279-G283 WeakPolarHBondContact O-CA 3.26Å; E279-G283 PolarHBondContact O-N 3.46Å; G283-H285 PolarHBondContact O-N 3.26Å
284W54.1Low56.4Low86 Ų8672.7 Ų72.733%0.32635%0.349SS..  trans-75.192.7176-78.445.3000110.1V245 S282 G286 L289 N292V245-W284 HydrophobicContact CG1-CH2 3.86Å; V245-W284 HydrophobicContact CG1-CZ2 4.42Å; S282-W284 PolarHBondContact O-N 3.06Å; W284-G286 PolarHBondContact O-N 2.91Å; W284-L289 HydrophobicContact CB-CD2 3.96Å; W284-L289 WeakPolarHBondContact O-CD2 3.4Å; W284-N292 HydrophobicContact CE3-CB 4.18Å; W284-N292 HydrophobicContact CZ3-CB 3.74Å
285H46.6Very low56.7Low141 Ų14169.9 Ų69.965%0.65334%0.341SS*.  trans-90.693.3175.6-61.3-44.4000110.7G283G283-H285 PolarHBondContact O-N 3.26Å
286G45.9Very low56.8Low28 Ų2862.9 Ų62.929%0.28931%0.314SS..SBendtrans-178.6151.4174.200000115.8W284 R288 L289W284-G286 PolarHBondContact O-N 2.91Å; G286-R288 PolarHBondContact O-N 3.05Å; G286-L289 WeakPolarHBondContact O-CD1 2.93Å; G286-L289 WeakPolarHBondContact O-CG 3.17Å
287H48.3Very low57.1Low196 Ų19658.6 Ų58.691%0.90730%0.296SS*.THydrogen-bonded Turntrans-67.47.4-168.78.5-83.8000116.6
288R49.7Very low57.4Low181 Ų18160.1 Ų60.168%0.68330%0.304SS*.THydrogen-bonded Turntrans-111.827.6-176.7-64.5-173.4179.11773.7113.7G286G286-R288 PolarHBondContact O-N 3.05Å
289L51.5Low57.5Low29 Ų2958.5 Ų58.515%0.15229%0.294CS..Hα-helixtrans-74.6-33.9-156.3-95157.3000118.3W284 G286 S291 Q293 V329W284-L289 HydrophobicContact CB-CD2 3.96Å; W284-L289 WeakPolarHBondContact O-CD2 3.4Å; G286-L289 WeakPolarHBondContact O-CD1 2.93Å; G286-L289 WeakPolarHBondContact O-CG 3.17Å; L289-S291 PolarHBondContact O-N 3.42Å; L289-Q293 HydrophobicContact CD2-CG 3.84Å; L289-Q293 PolarHBondContact O-N 3.35Å; L289-V329 HydrophobicContact CB-CG1 4.38Å; L289-V329 HydrophobicContact CD1-CG1 3.99Å; L289-V329 HydrophobicContact CD1-CG2 3.94Å; L289-V329 HydrophobicContact CD2-CG1 4.07Å; L289-V329 HydrophobicContact CD2-CG2 3.96Å; L289-V329 HydrophobicContact CG-CG1 4.37Å
290S55.6Low58Low42 Ų4253.6 Ų53.629%0.29427%0.271SS..Hα-helixtrans-69.1-37.3-165.359.70000114.2L294S290-L294 WeakPolarHBondContact O-CB 3.29Å; S290-L294 PolarHBondContact O-N 3.33Å
291S53.5Low58.4Low57 Ų5748.4 Ų48.440%0.39925%0.252SS..Hα-helixtrans-75.8-42.5-178.5-1780000112.3L289 L294 I295L289-S291 PolarHBondContact O-N 3.42Å; S291-L294 PolarHBondContact O-N 2.87Å; S291-I295 WeakPolarHBondContact O-CG1 3.49Å; S291-I295 PolarHBondContact O-N 3.39Å
292N53.6Low58.5Low31 Ų3149 Ų4917%0.16626%0.255CS..Hα-helixtrans-70.1-40.3-175.5-67.7-11.5000112.9T242 W284 I295 L296T242-N292 VanDerWaalsContact CB-OD1 3.29Å; T242-N292 WeakPolarHBondContact CB-OD1 3.33Å; T242-N292 WeakPolarHBondContact CG2-OD1 3.17Å; W284-N292 HydrophobicContact CE3-CB 4.18Å; W284-N292 HydrophobicContact CZ3-CB 3.74Å; N292-I295 PolarHBondContact O-N 2.93Å; N292-L296 PolarHBondContact O-N 3.03Å; N292-L296 VanDerWaalsContact O-N 3.14Å
293Q60.7Low58.9Low9 Ų948.2 Ų48.24%0.04225%0.248CC..Hα-helixtrans-66.6-39.1176.1-75-173-3300111.9I281 L289 I295 L296 I297I281-Q293 PolarHBondContact O-NE2 2.79Å; L289-Q293 HydrophobicContact CD2-CG 3.84Å; L289-Q293 PolarHBondContact O-N 3.35Å; Q293-I295 VanDerWaalsContact C-N 3.31Å; Q293-I295 PolarHBondContact O-N 3.5Å; Q293-L296 PolarHBondContact O-N 3.2Å; Q293-I297 WeakPolarHBondContact O-CB 3.38Å; Q293-I297 WeakPolarHBondContact O-CD1 3.28Å; Q293-I297 VanDerWaalsContact O-CG1 3.24Å; Q293-I297 WeakPolarHBondContact O-CG1 3.47Å; Q293-I297 PolarHBondContact O-N 3.33Å
294L64.4Low59.7Low39 Ų3946.6 Ų46.620%0.20423%0.231CC..Hα-helixtrans-59.7-42.9177.1-168.473.1000111.3S290 S291 I297 L298 M364 A368S290-L294 WeakPolarHBondContact O-CB 3.29Å; S290-L294 PolarHBondContact O-N 3.33Å; S291-L294 PolarHBondContact O-N 2.87Å; L294-I297 PolarHBondContact O-N 2.87Å; L294-L298 HydrophobicContact CG-CD1 4.23Å; L294-L298 WeakPolarHBondContact O-CB 3.44Å; L294-L298 WeakPolarHBondContact O-CD1 3.41Å; L294-L298 WeakPolarHBondContact O-CG 3.37Å; L294-L298 PolarHBondContact O-N 2.99Å; L294-M364 HydrophobicContact CD2-CE 4.19Å; L294-A368 HydrophobicContact CD1-CB 3.31Å
295I62.6Low60.5Low35 Ų3546.6 Ų46.618%0.17924%0.235CC..Hα-helixtrans-65.1-42.5177.5-60.5165000111A246 S291 N292 Q293 L298 A299A246-I295 HydrophobicContact CB-CB 4.19Å; A246-I295 HydrophobicContact CB-CG2 3.4Å; A246-I295 VanDerWaalsContact CB-CG2 3.4Å; S291-I295 WeakPolarHBondContact O-CG1 3.49Å; S291-I295 PolarHBondContact O-N 3.39Å; N292-I295 PolarHBondContact O-N 2.93Å; Q293-I295 VanDerWaalsContact C-N 3.31Å; Q293-I295 PolarHBondContact O-N 3.5Å; I295-L298 PolarHBondContact O-N 3.09Å; I295-A299 WeakPolarHBondContact O-CB 3.43Å; I295-A299 PolarHBondContact O-N 2.65Å
296L64.1Low61.3Low17 Ų1745 Ų459%0.08922%0.223CC..Hα-helixtrans-63.4-43.7176.6-171.970.3000111.8V249 I281 N292 Q293 L298 A299 L300V249-L296 HydrophobicContact CG1-CD1 3.85Å; I281-L296 HydrophobicContact CG1-CD2 3.86Å; N292-L296 PolarHBondContact O-N 3.03Å; N292-L296 VanDerWaalsContact O-N 3.14Å; Q293-L296 PolarHBondContact O-N 3.2Å; L296-L298 PolarHBondContact O-N 3.02Å; L296-A299 WeakPolarHBondContact O-CB 3.41Å; L296-A299 PolarHBondContact O-N 3.16Å; L296-L300 WeakPolarHBondContact O-CG 3.33Å; L296-L300 PolarHBondContact O-N 3.29Å
297I68.8Low62.3Low2 Ų246 Ų461%0.0122%0.219CC..Hα-helixtrans-62.2-43.1177-69.2157.8000111Q293 L294 A299 L300 G301 L319 V365 V369 N372Q293-I297 WeakPolarHBondContact O-CB 3.38Å; Q293-I297 WeakPolarHBondContact O-CD1 3.28Å; Q293-I297 VanDerWaalsContact O-CG1 3.24Å; Q293-I297 WeakPolarHBondContact O-CG1 3.47Å; Q293-I297 PolarHBondContact O-N 3.33Å; L294-I297 PolarHBondContact O-N 2.87Å; I297-A299 VanDerWaalsContact C-N 3.3Å; I297-A299 PolarHBondContact O-N 3.31Å; I297-L300 PolarHBondContact O-N 3.49Å; I297-G301 PolarHBondContact O-N 3.25Å; I297-L319 HydrophobicContact CG2-CD2 4.39Å; I297-V365 HydrophobicContact CD1-CG1 4.27Å; I297-V369 HydrophobicContact CD1-CG2 3.46Å; I297-V369 VanDerWaalsContact CD1-CG2 3.46Å; I297-V369 HydrophobicContact CG1-CG2 4.05Å; I297-V369 HydrophobicContact CG2-CB 4.43Å; I297-V369 HydrophobicContact CG2-CG2 3.94Å; I297-N372 HydrophobicContact CG2-CB 4.13Å
298L66Low63.2Low36 Ų3638.4 Ų38.419%0.18819%0.188CC..Hα-helixtrans-62-39.5174.8-73.6166.3000111.8L294 I295 L296 G301 N302L294-L298 HydrophobicContact CG-CD1 4.23Å; L294-L298 WeakPolarHBondContact O-CB 3.44Å; L294-L298 WeakPolarHBondContact O-CD1 3.41Å; L294-L298 WeakPolarHBondContact O-CG 3.37Å; L294-L298 PolarHBondContact O-N 2.99Å; I295-L298 PolarHBondContact O-N 3.09Å; L296-L298 PolarHBondContact O-N 3.02Å; L298-G301 PolarHBondContact O-N 3.38Å; L298-N302 PolarHBondContact O-N 3.27Å
299A64.2Low64.1Low5 Ų533.5 Ų33.54%0.04118%0.181CC..Hα-helixtrans-66.2-36.5178.500000113F216 C250 I295 L296 I297 G301 N302 L303F216-A299 HydrophobicContact CD1-CB 4.46Å; F216-A299 HydrophobicContact CE1-CB 3.65Å; F216-A299 HydrophobicContact CZ-CB 4.41Å; C250-A299 WeakPolarHBondContact SG-CB 3.29Å; I295-A299 WeakPolarHBondContact O-CB 3.43Å; I295-A299 PolarHBondContact O-N 2.65Å; L296-A299 WeakPolarHBondContact O-CB 3.41Å; L296-A299 PolarHBondContact O-N 3.16Å; I297-A299 VanDerWaalsContact C-N 3.3Å; I297-A299 PolarHBondContact O-N 3.31Å; A299-G301 VanDerWaalsContact C-N 3.35Å; A299-G301 PolarHBondContact O-N 3.16Å; A299-N302 PolarHBondContact O-N 2.59Å; A299-L303 WeakPolarHBondContact O-CB 3.37Å; A299-L303 PolarHBondContact O-N 3.14Å
300L71Confident64.9Low5 Ų532.7 Ų32.73%0.02618%0.177CC..Hα-helixtrans-62.8-39.6175.5-70.2172.2000112.5L277 I281 L296 I297 L303 A304 V315 L319L277-L300 HydrophobicContact CD2-CD1 4.37Å; L277-L300 HydrophobicContact CD2-CD2 3.42Å; L277-L300 VanDerWaalsContact CD2-CD2 3.42Å; L277-L300 HydrophobicContact CG-CD2 4.43Å; I281-L300 HydrophobicContact CD1-CD1 3.55Å; I281-L300 HydrophobicContact CG1-CD1 4.24Å; L296-L300 WeakPolarHBondContact O-CG 3.33Å; L296-L300 PolarHBondContact O-N 3.29Å; I297-L300 PolarHBondContact O-N 3.49Å; L300-L303 WeakPolarHBondContact O-CB 3.38Å; L300-L303 PolarHBondContact O-N 2.89Å; L300-A304 PolarHBondContact O-N 3.33Å; L300-V315 HydrophobicContact CB-CG1 4.13Å; L300-L319 HydrophobicContact CD1-CD2 3.86Å; L300-L319 HydrophobicContact CD1-CG 4.49Å
301G70.1Confident66.1Low0 Ų030.7 Ų30.70%016%0.163CC..Hα-helixtrans-61.4-42.2173.600000112.7I297 L298 A299 A304 E305I297-G301 PolarHBondContact O-N 3.25Å; L298-G301 PolarHBondContact O-N 3.38Å; A299-G301 VanDerWaalsContact C-N 3.35Å; A299-G301 PolarHBondContact O-N 3.16Å; G301-A304 PolarHBondContact O-N 2.82Å; G301-E305 PolarHBondContact O-N 2.77Å; G301-E305 VanDerWaalsContact O-N 3.16Å
302N64.9Low67.2Low22 Ų2229.5 Ų29.512%0.11815%0.154CC..Hα-helixtrans-66.7-39.7175-70.36.7000112.3F216 L298 A299 A304 E305 R306 R375F216-N302 WeakPolarHBondContact CA-ND2 3.47Å; L298-N302 PolarHBondContact O-N 3.27Å; A299-N302 PolarHBondContact O-N 2.59Å; N302-A304 VanDerWaalsContact C-N 3.32Å; N302-A304 PolarHBondContact O-N 2.83Å; N302-E305 PolarHBondContact O-N 2.67Å; N302-R306 PolarHBondContact O-N 3.28Å; N302-R375 VanDerWaalsContact OD1-CZ 3.25Å; N302-R375 PolarHBondContact OD1-NH1 3.33Å; N302-R375 PolarHBondContact OD1-NH2 3.3Å
303L67Low67.9Low17 Ų1729.8 Ų29.89%0.08916%0.16CC..Hα-helixtrans-59.9-45.4177.3-166.399000110.4L254 A299 L300 E305 R306 F307 L310 V315L254-L303 HydrophobicContact CD1-CD1 4.42Å; L254-L303 HydrophobicContact CD2-CD1 3.64Å; L254-L303 HydrophobicContact CG-CD1 3.88Å; A299-L303 WeakPolarHBondContact O-CB 3.37Å; A299-L303 PolarHBondContact O-N 3.14Å; L300-L303 WeakPolarHBondContact O-CB 3.38Å; L300-L303 PolarHBondContact O-N 2.89Å; L303-E305 PolarHBondContact O-N 3.34Å; L303-R306 PolarHBondContact O-N 3.06Å; L303-F307 HydrophobicContact CD1-CD2 4.48Å; L303-F307 HydrophobicContact CG-CD2 4.37Å; L303-F307 PolarHBondContact O-N 2.87Å; L303-L310 HydrophobicContact CD2-CD1 4.45Å; L303-V315 HydrophobicContact CD2-CG2 4.07Å
304A71.1Confident68.5Low0 Ų029.5 Ų29.50%016%0.16CC..Hα-helixtrans-60.6-44.2176.200000112.2L300 G301 N302 R306 F307 P308 V315 S379L300-A304 PolarHBondContact O-N 3.33Å; G301-A304 PolarHBondContact O-N 2.82Å; N302-A304 VanDerWaalsContact C-N 3.32Å; N302-A304 PolarHBondContact O-N 2.83Å; A304-R306 VanDerWaalsContact C-N 3.28Å; A304-R306 PolarHBondContact O-N 2.62Å; A304-F307 CarbonylContact O-C 3.56Å; A304-P308 WeakPolarHBondContact O-CA 3.49Å; A304-V315 HydrophobicContact CB-CB 4.24Å; A304-V315 HydrophobicContact CB-CG1 4.04Å; A304-V315 HydrophobicContact CB-CG2 4.25Å; A304-S379 WeakPolarHBondContact O-CB 3.35Å; A304-S379 PolarHBondContact O-OG 2.8Å
305E71.1Confident69.2Low87 Ų8727.7 Ų27.741%0.40715%0.15SC..Hα-helixtrans-62.3-34.1178-77.3174.7-174.800113.3G301 N302 L303 R375 S379G301-E305 PolarHBondContact O-N 2.77Å; G301-E305 VanDerWaalsContact O-N 3.16Å; N302-E305 PolarHBondContact O-N 2.67Å; L303-E305 PolarHBondContact O-N 3.34Å; E305-R375 IonicContact OE1-CZ 2.82Å; E305-R375 IonicContact OE1-NE 3.75Å; E305-R375 PolarHBondContact OE1-NE 3.35Å; E305-R375 IonicContact OE1-NH2 3.94Å; E305-R375 PolarHBondContact OE1-NH2 3.05Å; E305-R375 VanDerWaalsContact OE1-NH2 3.08Å; E305-R375 IonicContact OE2-CZ 3.99Å; E305-R375 IonicContact OE2-NE 3.85Å; E305-R375 IonicContact OE2-NH2 2.83Å; E305-R375 PolarHBondContact OE2-NH2 2.75Å; E305-S379 WeakPolarHBondContact CA-OG 3.16Å
306R63.1Low70.2Confident108 Ų10826.4 Ų26.441%0.40814%0.144SC..Hα-helixtrans-86.1-31.7-177.5-160169.7-168154.80.7113.6A214 N302 L303 A304 P308A214-R306 PolarHBondContact O-NH1 2.97Å; A214-R306 PolarHBondContact O-NH2 2.84Å; N302-R306 PolarHBondContact O-N 3.28Å; L303-R306 PolarHBondContact O-N 3.06Å; A304-R306 VanDerWaalsContact C-N 3.28Å; A304-R306 PolarHBondContact O-N 2.62Å; R306-P308 WeakPolarHBondContact O-CD 3.13Å
307F67.3Low71.1Confident47 Ų4726.6 Ų26.621%0.20615%0.146CC..  trans-124.677.8177.8-57.9-79.7000109.7L254 L303 A304 S309 L310L254-F307 HydrophobicContact CD2-CD2 4Å; L254-F307 HydrophobicContact CD2-CE2 3.36Å; L254-F307 HydrophobicContact CD2-CZ 3.82Å; L303-F307 HydrophobicContact CD1-CD2 4.48Å; L303-F307 HydrophobicContact CG-CD2 4.37Å; L303-F307 PolarHBondContact O-N 2.87Å; A304-F307 CarbonylContact O-C 3.56Å; F307-S309 PolarHBondContact O-N 3.5Å; F307-S309 VanDerWaalsContact O-N 3.12Å; F307-L310 HydrophobicContact CB-CB 4.26Å; F307-L310 HydrophobicContact CB-CD1 3.61Å; F307-L310 HydrophobicContact CB-CG 3.97Å; F307-L310 HydrophobicContact CG-CD1 4.09Å; F307-L310 WeakPolarHBondContact O-CB 3.25Å; F307-L310 PolarHBondContact O-N 3.02Å
308P68.2Low71.5Confident38 Ų3826.6 Ų26.625%0.24715%0.146CC..THydrogen-bonded Turntrans-55.4-33.6-173.1-27.735.5000114.5A304 R306 L310 S311 P312 K382 A383A304-P308 WeakPolarHBondContact O-CA 3.49Å; R306-P308 WeakPolarHBondContact O-CD 3.13Å; P308-L310 VanDerWaalsContact C-N 3.32Å; P308-L310 PolarHBondContact O-N 3.43Å; P308-S311 VanDerWaalsContact O-CB 3.28Å; P308-S311 WeakPolarHBondContact O-CB 3.49Å; P308-S311 PolarHBondContact O-N 2.95Å; P308-P312 WeakPolarHBondContact O-CD 3.35Å; P308-K382 HydrophobicContact CB-CB 4.24Å; P308-K382 HydrophobicContact CG-CD 4.41Å; P308-A383 HydrophobicContact CB-CB 4.33Å
309S67.7Low72.4Confident77 Ų7724.9 Ų24.954%0.53814%0.138SC..THydrogen-bonded Turntrans-65.3-30.3178.153.20000113.7F307 S311F307-S309 PolarHBondContact O-N 3.5Å; F307-S309 VanDerWaalsContact O-N 3.12Å; S309-S311 VanDerWaalsContact C-N 3.29Å
310L68.2Low73.5Confident13 Ų1324.9 Ų24.97%0.06814%0.137CC..Hα-helixtrans-76.3-20.1175.9-65.2177.8000112.6I257 L303 F307 P308 A313 A314 V315I257-L310 HydrophobicContact CD1-CD1 3.82Å; I257-L310 HydrophobicContact CG2-CD1 4.1Å; I257-L310 HydrophobicContact CG2-CD2 4.2Å; L303-L310 HydrophobicContact CD2-CD1 4.45Å; F307-L310 HydrophobicContact CB-CB 4.26Å; F307-L310 HydrophobicContact CB-CD1 3.61Å; F307-L310 HydrophobicContact CB-CG 3.97Å; F307-L310 HydrophobicContact CG-CD1 4.09Å; F307-L310 WeakPolarHBondContact O-CB 3.25Å; F307-L310 PolarHBondContact O-N 3.02Å; P308-L310 VanDerWaalsContact C-N 3.32Å; P308-L310 PolarHBondContact O-N 3.43Å; L310-A313 PolarHBondContact O-N 2.94Å; L310-A314 PolarHBondContact O-N 3.03Å; L310-V315 PolarHBondContact O-N 2.85Å
311S80.6Confident74Confident0 Ų026.1 Ų26.10%014%0.144CC..Iπ-helixtrans-61.6-57.1-175.4-169.80000113.1P308 S309 A313 V315 V316 G376P308-S311 VanDerWaalsContact O-CB 3.28Å; P308-S311 WeakPolarHBondContact O-CB 3.49Å; P308-S311 PolarHBondContact O-N 2.95Å; S309-S311 VanDerWaalsContact C-N 3.29Å; S311-A313 VanDerWaalsContact C-N 3.31Å; S311-A313 PolarHBondContact O-N 2.91Å; S311-V315 PolarHBondContact O-N 2.69Å; S311-V316 WeakPolarHBondContact O-CB 3.24Å; S311-V316 WeakPolarHBondContact O-CG2 3.43Å; S311-V316 PolarHBondContact O-N 3.09Å; S311-G376 WeakPolarHBondContact OG-CA 3.16Å; S311-G376 PolarHBondContact OG-O 3.46Å
312P76.5Confident74.6Confident31 Ų3126.6 Ų26.620%0.20115%0.146CC..Iπ-helixtrans-67.5-31.8177.925.7-32.3000112.4P308 P317 A383 D384 C387P308-P312 WeakPolarHBondContact O-CD 3.35Å; P312-P317 WeakPolarHBondContact O-CD 3.36Å; P312-P317 VanDerWaalsContact O-CG 3.29Å; P312-P317 WeakPolarHBondContact O-CG 3.47Å; P312-A383 HydrophobicContact CG-CB 4.46Å; P312-D384 HydrophobicContact CB-CB 4.42Å; P312-D384 HydrophobicContact CG-CB 4.28Å; P312-C387 HydrophobicContact CB-CB 4.23Å
313A69.6Low75.6Confident37 Ų3725.6 Ų25.631%0.30614%0.14SC..Iπ-helixtrans-77.4-37.7-173.700000114L270 L310 S311L270-A313 HydrophobicContact CD2-CB 3.91Å; L310-A313 PolarHBondContact O-N 2.94Å; S311-A313 VanDerWaalsContact C-N 3.31Å; S311-A313 PolarHBondContact O-N 2.91Å
314A71.3Confident76.4Confident3 Ų325 Ų253%0.02514%0.137CC..Iπ-helixtrans-131.8-46.7-171.800000114.1L273 L310 A318L273-A314 HydrophobicContact CD2-CB 4.23Å; L310-A314 PolarHBondContact O-N 3.03Å; A314-A318 WeakPolarHBondContact O-CB 3.41Å; A314-A318 PolarHBondContact O-N 2.76Å
315V79.3Confident76.7Confident1 Ų130.5 Ų30.51%0.00616%0.163CC..Iπ-helixtrans-72.7-52.4-171-179.30000112.5L300 L303 A304 L310 S311 A318 L319L300-V315 HydrophobicContact CB-CG1 4.13Å; L303-V315 HydrophobicContact CD2-CG2 4.07Å; A304-V315 HydrophobicContact CB-CB 4.24Å; A304-V315 HydrophobicContact CB-CG1 4.04Å; A304-V315 HydrophobicContact CB-CG2 4.25Å; L310-V315 PolarHBondContact O-N 2.85Å; S311-V315 PolarHBondContact O-N 2.69Å; V315-A318 PolarHBondContact O-N 3.33Å; V315-L319 HydrophobicContact CG1-CD1 3.86Å; V315-L319 HydrophobicContact CG1-CG 4.38Å; V315-L319 WeakPolarHBondContact O-CG 3.49Å; V315-L319 PolarHBondContact O-N 3.06Å
316V85.2Confident76.7Confident9 Ų926.7 Ų26.76%0.05515%0.146CC..Hα-helixtrans-59.2-47.6179.5166.90000110.8S311 A318 S320 L373 L377 C391S311-V316 WeakPolarHBondContact O-CB 3.24Å; S311-V316 WeakPolarHBondContact O-CG2 3.43Å; S311-V316 PolarHBondContact O-N 3.09Å; V316-A318 PolarHBondContact O-N 3.11Å; V316-S320 WeakPolarHBondContact O-CB 3.32Å; V316-S320 PolarHBondContact O-N 2.89Å; V316-L373 HydrophobicContact CB-CD1 4.32Å; V316-L373 HydrophobicContact CG1-CD1 3.97Å; V316-L373 HydrophobicContact CG2-CD1 4.44Å; V316-L377 HydrophobicContact CB-CD2 4.42Å; V316-L377 HydrophobicContact CG1-CD2 3.62Å; V316-L377 HydrophobicContact CG1-CG 4.36Å; V316-L377 HydrophobicContact CG2-CD2 3.87Å; V316-L377 HydrophobicContact CG2-CG 4.11Å; V316-C391 HydrophobicContact CG1-CB 4.25Å
317P81.5Confident77.1Confident21 Ų2121.9 Ų21.914%0.13613%0.129CC..Hα-helixtrans-63.8-37.6176-21.532.2000114R274 P312 N321R274-P317 VanDerWaalsContact NE-CB 3.33Å; P312-P317 WeakPolarHBondContact O-CD 3.36Å; P312-P317 VanDerWaalsContact O-CG 3.29Å; P312-P317 WeakPolarHBondContact O-CG 3.47Å; P317-N321 WeakPolarHBondContact O-CB 3.3Å; P317-N321 PolarHBondContact O-N 3.4Å; P317-N321 PolarHBondContact O-OD1 3.32Å
318A78.3Confident77.2Confident1 Ų122.1 Ų22.11%0.00814%0.135CC..Hα-helixtrans-67.2-44.4179.400000112.4L277 I281 A314 V315 V316 F322L277-A318 HydrophobicContact CD2-CB 4.08Å; I281-A318 HydrophobicContact CD1-CB 4.28Å; A314-A318 WeakPolarHBondContact O-CB 3.41Å; A314-A318 PolarHBondContact O-N 2.76Å; V315-A318 PolarHBondContact O-N 3.33Å; V316-A318 PolarHBondContact O-N 3.11Å; A318-F322 WeakPolarHBondContact O-CB 2.98Å; A318-F322 PolarHBondContact O-N 3.31Å
319L85.2Confident77.3Confident1 Ų120.5 Ų20.51%0.00512%0.124CC..Hα-helixtrans-71.7-37.9178.2-66.5176.8000112I297 L300 V315 F322 V369 N372 L373I297-L319 HydrophobicContact CG2-CD2 4.39Å; L300-L319 HydrophobicContact CD1-CD2 3.86Å; L300-L319 HydrophobicContact CD1-CG 4.49Å; V315-L319 HydrophobicContact CG1-CD1 3.86Å; V315-L319 HydrophobicContact CG1-CG 4.38Å; V315-L319 WeakPolarHBondContact O-CG 3.49Å; V315-L319 PolarHBondContact O-N 3.06Å; L319-F322 WeakPolarHBondContact O-CB 3.03Å; L319-F322 PolarHBondContact O-N 2.93Å; L319-V369 HydrophobicContact CB-CG1 4.33Å; L319-V369 HydrophobicContact CD2-CG1 4.24Å; L319-N372 HydrophobicContact CD1-CB 4.14Å; L319-L373 HydrophobicContact CB-CB 4.17Å; L319-L373 HydrophobicContact CB-CD1 4.05Å; L319-L373 HydrophobicContact CD1-CB 4.36Å
320S86.6Confident77.7Confident4 Ų416.8 Ų16.83%0.02810%0.099CC..Hα-helixtrans-62.5-49.1172.9-174.80000110.5V316 F322 L323 M324V316-S320 WeakPolarHBondContact O-CB 3.32Å; V316-S320 PolarHBondContact O-N 2.89Å; S320-F322 VanDerWaalsContact C-N 3.3Å; S320-F322 PolarHBondContact O-N 2.87Å; S320-L323 PolarHBondContact O-N 2.94Å; S320-M324 VanDerWaalsContact O-CG 3.29Å; S320-M324 WeakPolarHBondContact O-CG 3.5Å; S320-M324 PolarHBondContact O-N 3.43Å
321N81.4Confident78.2Confident32 Ų3218.7 Ų18.717%0.17111%0.107CC..Hα-helixtrans-61-36.8176.8-74.84.7000112.1R274 P317 L323 M324 E325R274-N321 PolarHBondContact NH2-ND2 3.29Å; P317-N321 WeakPolarHBondContact O-CB 3.3Å; P317-N321 PolarHBondContact O-N 3.4Å; P317-N321 PolarHBondContact O-OD1 3.32Å; N321-L323 PolarHBondContact O-N 3.41Å; N321-L323 VanDerWaalsContact O-N 3.11Å; N321-M324 PolarHBondContact O-N 2.94Å; N321-E325 CarbonylContact O-C 3.42Å; N321-E325 VanDerWaalsContact O-CA 3.32Å; N321-E325 WeakPolarHBondContact O-CA 3.48Å; N321-E325 WeakPolarHBondContact O-CB 3.29Å; N321-E325 PolarHBondContact O-N 2.72Å; N321-E325 VanDerWaalsContact O-O 3.1Å
322F82.5Confident78Confident10 Ų1024.5 Ų24.54%0.04413%0.129CC..Hα-helixtrans-56.8-29.4175.9-175.5-91.5000113.7I281 A318 L319 S320 P326 S327 L330 V365 V369I281-F322 HydrophobicContact CG2-CD2 3.34Å; I281-F322 HydrophobicContact CG2-CE2 3.56Å; I281-F322 HydrophobicContact CG2-CG 4.35Å; A318-F322 WeakPolarHBondContact O-CB 2.98Å; A318-F322 PolarHBondContact O-N 3.31Å; L319-F322 WeakPolarHBondContact O-CB 3.03Å; L319-F322 PolarHBondContact O-N 2.93Å; S320-F322 VanDerWaalsContact C-N 3.3Å; S320-F322 PolarHBondContact O-N 2.87Å; F322-P326 WeakPolarHBondContact O-CA 3.4Å; F322-S327 WeakPolarHBondContact CE2-OG 3.4Å; F322-L330 HydrophobicContact CD1-CD2 4.34Å; F322-L330 HydrophobicContact CE1-CB 4.28Å; F322-L330 HydrophobicContact CE1-CD1 4.28Å; F322-L330 HydrophobicContact CE1-CD2 4.05Å; F322-L330 HydrophobicContact CE1-CG 4.45Å; F322-L330 HydrophobicContact CZ-CB 4.27Å; F322-V365 HydrophobicContact CE1-CG1 4.43Å; F322-V369 HydrophobicContact CD1-CB 4.48Å; F322-V369 HydrophobicContact CD1-CG1 4.05Å; F322-V369 HydrophobicContact CD1-CG2 3.75Å; F322-V369 HydrophobicContact CE1-CG2 3.75Å
323L85.4Confident78Confident0 Ų024.3 Ų24.30%013%0.126CC..Hα-helixtrans-93.2-39.4178.4-65.8176.5000112.7S320 N321 L330 R366 V369 I370 N415 T419S320-L323 PolarHBondContact O-N 2.94Å; N321-L323 PolarHBondContact O-N 3.41Å; N321-L323 VanDerWaalsContact O-N 3.11Å; L323-L330 HydrophobicContact CD2-CD2 4.14Å; L323-R366 HydrophobicContact CD2-CG 4.46Å; L323-V369 HydrophobicContact CD1-CB 4.43Å; L323-V369 HydrophobicContact CD1-CG1 3.76Å; L323-V369 HydrophobicContact CD2-CB 4.21Å; L323-V369 HydrophobicContact CD2-CG1 3.97Å; L323-V369 HydrophobicContact CG-CB 4.45Å; L323-V369 HydrophobicContact CG-CG1 3.69Å; L323-I370 HydrophobicContact CD1-CG1 3.8Å; L323-N415 HydrophobicContact CB-CB 4.32Å; L323-N415 PolarHBondContact O-ND2 3.49Å; L323-N415 VanDerWaalsContact O-ND2 3.14Å; L323-T419 HydrophobicContact CD1-CG2 4.32Å; L323-T419 WeakPolarHBondContact CD1-OG1 3.18Å
324M84Confident78.5Confident4 Ų423.5 Ų23.52%0.0212%0.116CC..Hα-helixtrans-86.6-21.4-174.6-56.2-49.2145.600113.7S320 N321 I395 R398 S416 T419S320-M324 VanDerWaalsContact O-CG 3.29Å; S320-M324 WeakPolarHBondContact O-CG 3.5Å; S320-M324 PolarHBondContact O-N 3.43Å; N321-M324 PolarHBondContact O-N 2.94Å; M324-I395 HydrophobicContact CE-CB 4.47Å; M324-I395 HydrophobicContact CE-CD1 4.18Å; M324-I395 HydrophobicContact CE-CG1 3.91Å; M324-I395 HydrophobicContact CE-CG2 3.84Å; M324-I395 HydrophobicContact SD-CG2 4.2Å; M324-R398 HydrophobicContact CB-CG 4.23Å; M324-R398 PolarHBondContact O-NH2 2.93Å; M324-S416 PolarHBondContact SD-OG 3.26Å; M324-T419 HydrophobicContact CE-CG2 4.27Å
325E78.3Confident78.9Confident116 Ų11627.4 Ų27.454%0.54213%0.134SC..THydrogen-bonded Turntrans-122.975.1166.2-70177.8-178.100106.7N321 S327N321-E325 CarbonylContact O-C 3.42Å; N321-E325 VanDerWaalsContact O-CA 3.32Å; N321-E325 WeakPolarHBondContact O-CA 3.48Å; N321-E325 WeakPolarHBondContact O-CB 3.29Å; N321-E325 PolarHBondContact O-N 2.72Å; N321-E325 VanDerWaalsContact O-O 3.1Å; E325-S327 PolarHBondContact O-N 2.88Å
326P71.5Confident78.8Confident8 Ų828.9 Ų28.95%0.05214%0.144CC..THydrogen-bonded Turntrans-56.2119.3-166.319.1-31000109.8F322 L330 Q331 L411 I412F322-P326 WeakPolarHBondContact O-CA 3.4Å; P326-L330 HydrophobicContact CB-CD2 4.03Å; P326-Q331 HydrophobicContact CB-CG 4.07Å; P326-Q331 HydrophobicContact CG-CG 4.29Å; P326-Q331 PolarHBondContact O-NE2 3.37Å; P326-L411 HydrophobicContact CB-CD2 3.77Å; P326-L411 HydrophobicContact CB-CG 4.38Å; P326-L411 HydrophobicContact CG-CD2 4.04Å; P326-L411 HydrophobicContact CG-CG 4.45Å; P326-I412 HydrophobicContact CG-CD1 4.39Å; P326-I412 HydrophobicContact CG-CG1 3.8Å
327S70.5Confident78.4Confident7 Ų728.9 Ų28.95%0.04914%0.144CC..  trans-57.6156.1-177.580.10000110.7F322 E325 V329 L330 Q331F322-S327 WeakPolarHBondContact CE2-OG 3.4Å; E325-S327 PolarHBondContact O-N 2.88Å; S327-V329 PolarHBondContact O-N 3.44Å; S327-V329 PolarHBondContact OG-N 3.39Å; S327-L330 PolarHBondContact O-N 3.49Å; S327-L330 PolarHBondContact OG-N 3.41Å; S327-Q331 PolarHBondContact O-N 3.29Å
328P69.5Low78.1Confident51 Ų5132.3 Ų32.333%0.33116%0.157SC..Hα-helixtrans-53.5-27.3177.2-25.933.7000113R332P328-R332 VanDerWaalsContact O-CG 3.24Å; P328-R332 WeakPolarHBondContact O-CG 3.38Å; P328-R332 PolarHBondContact O-N 3.41Å; P328-R332 VanDerWaalsContact O-N 3.09Å
329V69.8Low77.9Confident4 Ų437.5 Ų37.52%0.02418%0.184CC..Hα-helixtrans-74.6-43.5176.8-1770000111.9L289 S327 Q331 R332 L333L289-V329 HydrophobicContact CB-CG1 4.38Å; L289-V329 HydrophobicContact CD1-CG1 3.99Å; L289-V329 HydrophobicContact CD1-CG2 3.94Å; L289-V329 HydrophobicContact CD2-CG1 4.07Å; L289-V329 HydrophobicContact CD2-CG2 3.96Å; L289-V329 HydrophobicContact CG-CG1 4.37Å; S327-V329 PolarHBondContact O-N 3.44Å; S327-V329 PolarHBondContact OG-N 3.39Å; V329-Q331 VanDerWaalsContact C-N 3.31Å; V329-R332 PolarHBondContact O-N 3.49Å; V329-L333 HydrophobicContact CG1-CD1 4.36Å; V329-L333 WeakPolarHBondContact O-CG 3.46Å; V329-L333 PolarHBondContact O-N 3.46Å
330L76.6Confident77.1Confident0 Ų039 Ų390%019%0.191CC..Hα-helixtrans-64.9-39.1176.6-169.565.7000110.7F322 L323 P326 S327 L333 F334 F362 V365F322-L330 HydrophobicContact CD1-CD2 4.34Å; F322-L330 HydrophobicContact CE1-CB 4.28Å; F322-L330 HydrophobicContact CE1-CD1 4.28Å; F322-L330 HydrophobicContact CE1-CD2 4.05Å; F322-L330 HydrophobicContact CE1-CG 4.45Å; F322-L330 HydrophobicContact CZ-CB 4.27Å; L323-L330 HydrophobicContact CD2-CD2 4.14Å; P326-L330 HydrophobicContact CB-CD2 4.03Å; S327-L330 PolarHBondContact O-N 3.49Å; S327-L330 PolarHBondContact OG-N 3.41Å; L330-L333 PolarHBondContact O-N 2.87Å; L330-F334 WeakPolarHBondContact O-CB 3.35Å; L330-F334 PolarHBondContact O-N 2.89Å; L330-F362 HydrophobicContact CD1-CD2 3.85Å; L330-F362 HydrophobicContact CD1-CE2 3.57Å; L330-F362 HydrophobicContact CG-CE2 4.02Å; L330-V365 HydrophobicContact CD1-CG1 4.49Å
331Q78.3Confident76Confident53 Ų5342.5 Ų42.525%0.24821%0.207CC..Hα-helixtrans-60.4-48.9173.9-68.9175.5-9.700111.8P326 S327 V329 L333 F334 E335 H408 L411P326-Q331 HydrophobicContact CB-CG 4.07Å; P326-Q331 HydrophobicContact CG-CG 4.29Å; P326-Q331 PolarHBondContact O-NE2 3.37Å; S327-Q331 PolarHBondContact O-N 3.29Å; V329-Q331 VanDerWaalsContact C-N 3.31Å; Q331-L333 PolarHBondContact O-N 3.47Å; Q331-F334 WeakPolarHBondContact O-CB 3.24Å; Q331-F334 PolarHBondContact O-N 3.24Å; Q331-E335 WeakPolarHBondContact O-CG 3.34Å; Q331-E335 PolarHBondContact O-N 2.85Å; Q331-H408 PolarHBondContact NE2-CD2 3.29Å; Q331-L411 HydrophobicContact CG-CD2 4.46Å
332R75.7Confident75.2Confident122 Ų12243.1 Ų43.146%0.4622%0.217SC..Hα-helixtrans-61.4-41.4176.6-74.4176.3-151.6163.13.1113P328 V329 F334 E335 S336P328-R332 VanDerWaalsContact O-CG 3.24Å; P328-R332 WeakPolarHBondContact O-CG 3.38Å; P328-R332 PolarHBondContact O-N 3.41Å; P328-R332 VanDerWaalsContact O-N 3.09Å; V329-R332 PolarHBondContact O-N 3.49Å; R332-F334 VanDerWaalsContact C-N 3.33Å; R332-E335 PolarHBondContact O-N 3.1Å; R332-S336 WeakPolarHBondContact O-CB 3.32Å; R332-S336 PolarHBondContact O-N 3.2Å; R332-S336 PolarHBondContact O-OG 2.94Å
333L76.7Confident74.3Confident26 Ų2647.4 Ų47.414%0.13624%0.24CC..Hα-helixtrans-63.5-42.6176.2-75.8174.8000110.6V329 L330 Q331 S336 S337 F362 V365V329-L333 HydrophobicContact CG1-CD1 4.36Å; V329-L333 WeakPolarHBondContact O-CG 3.46Å; V329-L333 PolarHBondContact O-N 3.46Å; L330-L333 PolarHBondContact O-N 2.87Å; Q331-L333 PolarHBondContact O-N 3.47Å; L333-S336 WeakPolarHBondContact CA-OG 3.28Å; L333-S336 PolarHBondContact O-N 3.39Å; L333-S336 PolarHBondContact O-OG 2.83Å; L333-S337 PolarHBondContact O-N 3.28Å; L333-F362 HydrophobicContact CB-CB 4.11Å; L333-F362 HydrophobicContact CB-CD2 3.92Å; L333-F362 HydrophobicContact CB-CG 4.48Å; L333-V365 HydrophobicContact CD1-CG2 4.37Å
334F80.6Confident73Confident20 Ų2056.3 Ų56.39%0.08827%0.273CS..Hα-helixtrans-62.3-48.1174.9177.9-109.4000112.4L330 Q331 R332 S336 S337 K338 F362 L411L330-F334 WeakPolarHBondContact O-CB 3.35Å; L330-F334 PolarHBondContact O-N 2.89Å; Q331-F334 WeakPolarHBondContact O-CB 3.24Å; Q331-F334 PolarHBondContact O-N 3.24Å; R332-F334 VanDerWaalsContact C-N 3.33Å; F334-S336 VanDerWaalsContact C-N 3.33Å; F334-S336 PolarHBondContact O-N 3.47Å; F334-S337 WeakPolarHBondContact O-CA 3.32Å; F334-S337 WeakPolarHBondContact O-CB 3.46Å; F334-S337 PolarHBondContact O-N 2.85Å; F334-S337 VanDerWaalsContact O-N 3.08Å; F334-S337 PolarHBondContact O-OG 3.3Å; F334-K338 HydrophobicContact CD1-CG 4.43Å; F334-K338 HydrophobicContact CE1-CG 4.13Å; F334-K338 HydrophobicContact CE2-CG 4.37Å; F334-K338 HydrophobicContact CZ-CD 4.27Å; F334-K338 HydrophobicContact CZ-CG 4.14Å; F334-K338 PolarHBondContact O-N 2.93Å; F334-F362 HydrophobicContact CB-CD2 4.15Å; F334-F362 HydrophobicContact CB-CE2 3.75Å; F334-F362 HydrophobicContact CB-CZ 4.15Å; F334-F362 HydrophobicContact CD2-CE1 4.03Å; F334-F362 HydrophobicContact CD2-CE2 4.21Å; F334-F362 AromaticContact CD2-CZ 3.72Å; F334-F362 HydrophobicContact CD2-CZ 3.72Å; F334-F362 HydrophobicContact CG-CE2 4.45Å; F334-F362 HydrophobicContact CG-CZ 4.39Å; F334-L411 HydrophobicContact CB-CD1 4.33Å; F334-L411 HydrophobicContact CB-CD2 3.98Å; F334-L411 HydrophobicContact CD1-CB 4.24Å; F334-L411 HydrophobicContact CD1-CD1 4.46Å; F334-L411 HydrophobicContact CD1-CD2 4.01Å; F334-L411 HydrophobicContact CD1-CG 4.47Å; F334-L411 HydrophobicContact CD2-CD1 3.71Å; F334-L411 HydrophobicContact CE1-CB 4Å; F334-L411 HydrophobicContact CE2-CB 4.45Å; F334-L411 HydrophobicContact CE2-CD1 3.97Å; F334-L411 HydrophobicContact CG-CD1 3.93Å; F334-L411 HydrophobicContact CG-CD2 3.96Å; F334-L411 HydrophobicContact CG-CG 4.37Å; F334-L411 HydrophobicContact CZ-CB 4.07Å; F334-L411 HydrophobicContact CZ-CD1 4.43Å
335E79.9Confident71.8Confident86 Ų8665 Ų6540%0.40231%0.311SS..Hα-helixtrans-58.4-43.8176-73.3171.9176.100112.1Q331 R332 S337 K338 L339 H408Q331-E335 WeakPolarHBondContact O-CG 3.34Å; Q331-E335 PolarHBondContact O-N 2.85Å; R332-E335 PolarHBondContact O-N 3.1Å; E335-S337 VanDerWaalsContact C-N 3.28Å; E335-S337 PolarHBondContact O-N 3.33Å; E335-K338 PolarHBondContact O-N 3.19Å; E335-L339 PolarHBondContact O-N 2.95Å; E335-H408 IonicContact OE1-CE1 2.76Å; E335-H408 PolarHBondContact OE1-CE1 2.79Å; E335-H408 VanDerWaalsContact OE1-CE1 3.29Å; E335-H408 IonicContact OE1-NE2 2.82Å
336S77.3Confident70.9Confident31 Ų3163.9 Ų63.922%0.21731%0.313CS..Hα-helixtrans-64-33.9175.8690000112.4R332 L333 F334 E340 C358R332-S336 WeakPolarHBondContact O-CB 3.32Å; R332-S336 PolarHBondContact O-N 3.2Å; R332-S336 PolarHBondContact O-OG 2.94Å; L333-S336 WeakPolarHBondContact CA-OG 3.28Å; L333-S336 PolarHBondContact O-N 3.39Å; L333-S336 PolarHBondContact O-OG 2.83Å; F334-S336 VanDerWaalsContact C-N 3.33Å; F334-S336 PolarHBondContact O-N 3.47Å; S336-E340 PolarHBondContact O-N 2.81Å; S336-E340 VanDerWaalsContact O-N 3.08Å; S336-C358 WeakPolarHBondContact OG-CB 3.48Å
337S76.4Confident69.7Low9 Ų966.7 Ų66.76%0.06334%0.342CS..Hα-helixtrans-69.3-38.1173.581.90000112.7L333 F334 E335 E340 E341L333-S337 PolarHBondContact O-N 3.28Å; F334-S337 WeakPolarHBondContact O-CA 3.32Å; F334-S337 WeakPolarHBondContact O-CB 3.46Å; F334-S337 PolarHBondContact O-N 2.85Å; F334-S337 VanDerWaalsContact O-N 3.08Å; F334-S337 PolarHBondContact O-OG 3.3Å; E335-S337 VanDerWaalsContact C-N 3.28Å; E335-S337 PolarHBondContact O-N 3.33Å; S337-E340 PolarHBondContact O-N 3.15Å; S337-E341 PolarHBondContact O-N 3.44Å; S337-E341 VanDerWaalsContact O-N 3.12Å
338K75.9Confident68.4Low93 Ų9374.8 Ų74.840%0.40438%0.377SS..Hα-helixtrans-67.3-39.3175.7-74.1-90.5-177.1-178.60111.7F334 E335 E341 A342F334-K338 HydrophobicContact CD1-CG 4.43Å; F334-K338 HydrophobicContact CE1-CG 4.13Å; F334-K338 HydrophobicContact CE2-CG 4.37Å; F334-K338 HydrophobicContact CZ-CD 4.27Å; F334-K338 HydrophobicContact CZ-CG 4.14Å; F334-K338 PolarHBondContact O-N 2.93Å; E335-K338 PolarHBondContact O-N 3.19Å; K338-E341 PolarHBondContact O-N 3.44Å; K338-A342 WeakPolarHBondContact O-CB 3.21Å; K338-A342 PolarHBondContact O-N 3.03Å
339L73.7Confident66.9Low111 Ų11176.5 Ų76.558%0.58140%0.396SS*.Hα-helixtrans-62.7-44.4173.5-81.1159000111.6E335 E341 A342 D343E335-L339 PolarHBondContact O-N 2.95Å; L339-E341 VanDerWaalsContact C-N 3.28Å; L339-E341 PolarHBondContact O-N 3.44Å; L339-A342 PolarHBondContact O-N 2.93Å; L339-D343 WeakPolarHBondContact O-CB 3.43Å; L339-D343 PolarHBondContact O-N 3.27Å
340E68.2Low65.2Low32 Ų3282.4 Ų82.415%0.1543%0.431CS..Hα-helixtrans-58.9-37.9173.5-81.6-179.717500112.2S336 S337 R344 C358 K359S336-E340 PolarHBondContact O-N 2.81Å; S336-E340 VanDerWaalsContact O-N 3.08Å; S337-E340 PolarHBondContact O-N 3.15Å; E340-R344 WeakPolarHBondContact O-CG 3.32Å; E340-R344 PolarHBondContact O-N 2.95Å; E340-C358 WeakPolarHBondContact OE1-CB 3.36Å; E340-C358 PolarHBondContact OE1-N 3.08Å; E340-K359 PolarHBondContact OE2-N 3.05Å
341E64.4Low63.4Low77 Ų7788.2 Ų88.236%0.3647%0.469SS..Hα-helixtrans-71-38175.2-77.9-174.3168.300113.4S337 K338 L339 R344 K345 K359S337-E341 PolarHBondContact O-N 3.44Å; S337-E341 VanDerWaalsContact O-N 3.12Å; K338-E341 PolarHBondContact O-N 3.44Å; L339-E341 VanDerWaalsContact C-N 3.28Å; L339-E341 PolarHBondContact O-N 3.44Å; E341-R344 PolarHBondContact O-N 3.3Å; E341-K345 PolarHBondContact O-N 2.93Å; E341-K359 IonicContact OE1-NZ 3.46Å; E341-K359 PolarHBondContact OE1-NZ 3.46Å
342A63.7Low61.4Low46 Ų4690.1 Ų90.138%0.3849%0.488SS..Hα-helixtrans-68.6-39.5177.200000112.2K338 L339 R344 K345 T346K338-A342 WeakPolarHBondContact O-CB 3.21Å; K338-A342 PolarHBondContact O-N 3.03Å; L339-A342 PolarHBondContact O-N 2.93Å; A342-R344 VanDerWaalsContact C-N 3.33Å; A342-R344 PolarHBondContact O-N 3.45Å; A342-K345 PolarHBondContact O-N 3.07Å; A342-K345 VanDerWaalsContact O-N 3.14Å; A342-T346 PolarHBondContact O-N 3.22Å; A342-T346 PolarHBondContact O-OG1 3.01Å; A342-T346 VanDerWaalsContact O-OG1 3.07Å
343D63Low59.8Low99 Ų9989.1 Ų89.153%0.52951%0.506SS..Hα-helixtrans-64.2-37.4175.1-79.8-15.4000111.4L339 K345 T346 G347L339-D343 WeakPolarHBondContact O-CB 3.43Å; L339-D343 PolarHBondContact O-N 3.27Å; D343-K345 VanDerWaalsContact C-N 3.3Å; D343-K345 PolarHBondContact O-N 3.48Å; D343-T346 PolarHBondContact O-N 2.99Å; D343-G347 PolarHBondContact O-N 2.99Å
344R58.9Low58.1Low187 Ų18793.1 Ų93.171%0.70654%0.536SS*.Hα-helixtrans-64.3-32.5172.8-75.7-179.9-171-172.84.1113E340 E341 A342E340-R344 WeakPolarHBondContact O-CG 3.32Å; E340-R344 PolarHBondContact O-N 2.95Å; E341-R344 PolarHBondContact O-N 3.3Å; A342-R344 VanDerWaalsContact C-N 3.33Å; A342-R344 PolarHBondContact O-N 3.45Å
345K59.6Low56.2Low187 Ų187100 Ų10081%0.81357%0.566SS**Hα-helixtrans-80.1-27.6178.1-74.4-177.5178.7179.40113.7E341 A342 D343E341-K345 PolarHBondContact O-N 2.93Å; A342-K345 PolarHBondContact O-N 3.07Å; A342-K345 VanDerWaalsContact O-N 3.14Å; D343-K345 VanDerWaalsContact C-N 3.3Å; D343-K345 PolarHBondContact O-N 3.48Å
346T57.7Low54.6Low93 Ų93101.4 Ų101.457%0.57158%0.58SS**Hα-helixtrans-93.41.9-177.153.50000114.5A342 D343 K348A342-T346 PolarHBondContact O-N 3.22Å; A342-T346 PolarHBondContact O-OG1 3.01Å; A342-T346 VanDerWaalsContact O-OG1 3.07Å; D343-T346 PolarHBondContact O-N 2.99Å; T346-K348 PolarHBondContact O-N 3.39Å
347G46.8Very low53.8Low66 Ų66102.6 Ų102.668%0.6859%0.589SS**  trans65.88.6164.400000116.2D343 A349D343-G347 PolarHBondContact O-N 2.99Å; G347-A349 PolarHBondContact O-N 3.5Å; G347-A349 VanDerWaalsContact O-N 3.12Å
348K44.6Very low53.2Low177 Ų177104.1 Ų104.177%0.7760%0.599SS**  trans-76.599.8175-76.4-175.2176.9178.10109.9T346 V350T346-K348 PolarHBondContact O-N 3.39Å; K348-V350 PolarHBondContact O-N 3.25Å
349A36.8Very low53Low88 Ų88102.8 Ų102.873%0.72759%0.593SS**  trans-68.210917600000110.9G347G347-A349 PolarHBondContact O-N 3.5Å; G347-A349 VanDerWaalsContact O-N 3.12Å
350V35.3Very low52.8Low128 Ų128104.9 Ų104.978%0.77660%0.598SS**  trans-115.8141.3163.9179.20000107.7K348K348-V350 PolarHBondContact O-N 3.25Å
351P38.9Very low52.8Low121 Ų121104.9 Ų104.979%0.78660%0.599SS**  trans-71151.5-157.9-1630.6000115.1
352S36.1Very low53.5Low94 Ų94101.5 Ų101.566%0.65758%0.583SS**SBendtrans-57132.9178.238.80000114.4
353A41.9Very low54.2Low101 Ų101103.6 Ų103.684%0.83559%0.585SS**SBendtrans162.2-12.1131.600000114.5
354S41.1Very low54.8Low109 Ų109102.9 Ų102.976%0.76258%0.579SS**SBendtrans-132.212.6-173.775.70000117.6
355K40.8Very low55.7Low166 Ų16694 Ų9472%0.72255%0.546SS*.  trans-122.625.5-178.9-72.2-169.2178.2-177.60115.4S357K355-S357 PolarHBondContact O-N 3.26Å
356T45Very low56.9Low114 Ų11486.1 Ų86.170%0.69951%0.511SS*.SBendtrans-82.913.5171.5-5.90000113.3
357S61.5Low58.1Low56 Ų5683 Ų8339%0.39250%0.498SS..  trans-105.5-26.3-161.7-171.60000115.4K355 N361K355-S357 PolarHBondContact O-N 3.26Å; S357-N361 WeakPolarHBondContact O-CB 3.45Å; S357-N361 PolarHBondContact O-N 3.14Å; S357-N361 PolarHBondContact O-ND2 3.23Å; S357-N361 VanDerWaalsContact O-ND2 3.14Å; S357-N361 PolarHBondContact O-OD1 3.24Å; S357-N361 PolarHBondContact OG-ND2 3.34Å
358C64.2Low59.6Low42 Ų4280.6 Ų80.628%0.28447%0.471SS..Hα-helixtrans-77.2-47.8-166.4-77.60000113.6S336 E340 K360 N361 F362S336-C358 WeakPolarHBondContact OG-CB 3.48Å; E340-C358 WeakPolarHBondContact OE1-CB 3.36Å; E340-C358 PolarHBondContact OE1-N 3.08Å; C358-K360 PolarHBondContact O-N 2.78Å; C358-N361 PolarHBondContact O-N 2.97Å; C358-F362 PolarHBondContact O-N 3.29Å
359K70.3Confident61.6Low65 Ų6572.2 Ų72.228%0.28343%0.434SS..Hα-helixtrans-58.9-45.6176.1-176.8170.51791700112.7E340 E341 N361 F362 E363E340-K359 PolarHBondContact OE2-N 3.05Å; E341-K359 IonicContact OE1-NZ 3.46Å; E341-K359 PolarHBondContact OE1-NZ 3.46Å; K359-N361 VanDerWaalsContact C-N 3.35Å; K359-N361 PolarHBondContact O-N 2.79Å; K359-F362 PolarHBondContact O-N 2.95Å; K359-E363 WeakPolarHBondContact CE-OE1 3.44Å; K359-E363 PolarHBondContact O-N 2.71Å
360K69.8Low64Low155 Ų15568.6 Ų68.667%0.67440%0.403SS*.Hα-helixtrans-62.9-40.9178-168.4177.7-179.1179.80111.7C358 M364C358-K360 PolarHBondContact O-N 2.78Å; K360-M364 WeakPolarHBondContact O-CB 3.33Å; K360-M364 PolarHBondContact O-N 3.21Å
361N68.7Low66.2Low32 Ų3265.3 Ų65.317%0.17138%0.381CS..Hα-helixtrans-65.4-41.6176.4-72.7-10.8000112.1S357 C358 K359 M364 V365S357-N361 WeakPolarHBondContact O-CB 3.45Å; S357-N361 PolarHBondContact O-N 3.14Å; S357-N361 PolarHBondContact O-ND2 3.23Å; S357-N361 VanDerWaalsContact O-ND2 3.14Å; S357-N361 PolarHBondContact O-OD1 3.24Å; S357-N361 PolarHBondContact OG-ND2 3.34Å; C358-N361 PolarHBondContact O-N 2.97Å; K359-N361 VanDerWaalsContact C-N 3.35Å; K359-N361 PolarHBondContact O-N 2.79Å; N361-M364 PolarHBondContact O-N 3.19Å; N361-V365 VanDerWaalsContact O-CG2 3.31Å; N361-V365 WeakPolarHBondContact O-CG2 3.36Å; N361-V365 PolarHBondContact O-N 3.42Å
362F78.9Confident68.4Low6 Ų659.7 Ų59.73%0.02634%0.344CS..Hα-helixtrans-59.4-51.3175.7170.4-105.9000111.3L330 L333 F334 C358 K359 M364 V365 R366 L411L330-F362 HydrophobicContact CD1-CD2 3.85Å; L330-F362 HydrophobicContact CD1-CE2 3.57Å; L330-F362 HydrophobicContact CG-CE2 4.02Å; L333-F362 HydrophobicContact CB-CB 4.11Å; L333-F362 HydrophobicContact CB-CD2 3.92Å; L333-F362 HydrophobicContact CB-CG 4.48Å; F334-F362 HydrophobicContact CB-CD2 4.15Å; F334-F362 HydrophobicContact CB-CE2 3.75Å; F334-F362 HydrophobicContact CB-CZ 4.15Å; F334-F362 HydrophobicContact CD2-CE1 4.03Å; F334-F362 HydrophobicContact CD2-CE2 4.21Å; F334-F362 AromaticContact CD2-CZ 3.72Å; F334-F362 HydrophobicContact CD2-CZ 3.72Å; F334-F362 HydrophobicContact CG-CE2 4.45Å; F334-F362 HydrophobicContact CG-CZ 4.39Å; C358-F362 PolarHBondContact O-N 3.29Å; K359-F362 PolarHBondContact O-N 2.95Å; F362-M364 VanDerWaalsContact C-N 3.33Å; F362-M364 PolarHBondContact O-N 2.75Å; F362-V365 PolarHBondContact O-N 3Å; F362-R366 WeakPolarHBondContact O-CB 3.4Å; F362-R366 PolarHBondContact O-N 3.2Å; F362-L411 HydrophobicContact CE2-CD1 4.14Å; F362-L411 HydrophobicContact CZ-CD1 3.7Å
363E78.5Confident70.9Confident89 Ų8955.2 Ų55.242%0.41631%0.313SS..Hα-helixtrans-63.4-38.7179.1-72175.2178.400111.9K359 R366 G367K359-E363 WeakPolarHBondContact CE-OE1 3.44Å; K359-E363 PolarHBondContact O-N 2.71Å; E363-R366 PolarHBondContact O-N 3.38Å; E363-G367 PolarHBondContact O-N 3.49Å
364M74.6Confident73.1Confident84 Ų8450.4 Ų50.441%0.41427%0.273SS..Hα-helixtrans-64-45.5176.4-174178.972.200112.2L294 K360 N361 F362 A368L294-M364 HydrophobicContact CD2-CE 4.19Å; K360-M364 WeakPolarHBondContact O-CB 3.33Å; K360-M364 PolarHBondContact O-N 3.21Å; N361-M364 PolarHBondContact O-N 3.19Å; F362-M364 VanDerWaalsContact C-N 3.33Å; F362-M364 PolarHBondContact O-N 2.75Å; M364-A368 VanDerWaalsContact O-CB 3.32Å; M364-A368 WeakPolarHBondContact O-CB 3.44Å; M364-A368 PolarHBondContact O-N 3.13Å
365V78.4Confident75.2Confident0 Ų047 Ų470%024%0.244CC..Hα-helixtrans-64.6-46.8176.5171.50000110.1I297 F322 L330 L333 N361 F362 G367 A368 V369I297-V365 HydrophobicContact CD1-CG1 4.27Å; F322-V365 HydrophobicContact CE1-CG1 4.43Å; L330-V365 HydrophobicContact CD1-CG1 4.49Å; L333-V365 HydrophobicContact CD1-CG2 4.37Å; N361-V365 VanDerWaalsContact O-CG2 3.31Å; N361-V365 WeakPolarHBondContact O-CG2 3.36Å; N361-V365 PolarHBondContact O-N 3.42Å; F362-V365 PolarHBondContact O-N 3Å; V365-G367 PolarHBondContact O-N 3.41Å; V365-A368 PolarHBondContact O-N 2.93Å; V365-V369 HydrophobicContact CG1-CG2 4.46Å; V365-V369 VanDerWaalsContact O-CG2 3.32Å; V365-V369 WeakPolarHBondContact O-CG2 3.39Å; V365-V369 PolarHBondContact O-N 3.46Å
366R85.5Confident77.3Confident23 Ų2339 Ų399%0.08721%0.209CC..Hα-helixtrans-57.2-48.7177.1-177.217365.7-176.40.5111.6L323 F362 E363 A368 V369 I370 N415 F418L323-R366 HydrophobicContact CD2-CG 4.46Å; F362-R366 WeakPolarHBondContact O-CB 3.4Å; F362-R366 PolarHBondContact O-N 3.2Å; E363-R366 PolarHBondContact O-N 3.38Å; R366-A368 PolarHBondContact O-N 2.83Å; R366-V369 PolarHBondContact O-N 3.19Å; R366-I370 HydrophobicContact CG-CD1 4Å; R366-I370 WeakPolarHBondContact O-CG1 3.48Å; R366-I370 PolarHBondContact O-N 2.91Å; R366-N415 WeakPolarHBondContact CD-OD1 3.33Å; R366-F418 VanDerWaalsContact NH1-CE2 3.3Å
367G81.7Confident79.3Confident28 Ų2833.6 Ų33.629%0.28918%0.176SC..Hα-helixtrans-62.4-41177.800000113E363 V365 I370 N371E363-G367 PolarHBondContact O-N 3.49Å; V365-G367 PolarHBondContact O-N 3.41Å; G367-I370 PolarHBondContact O-N 3.26Å; G367-N371 WeakPolarHBondContact O-CB 3.28Å; G367-N371 PolarHBondContact O-N 3.3Å
368A79.7Confident80.4Confident15 Ų1536.7 Ų36.712%0.12418%0.179CC..Hα-helixtrans-65.2-38.8176.900000112.8L294 M364 V365 R366 N372L294-A368 HydrophobicContact CD1-CB 3.31Å; M364-A368 VanDerWaalsContact O-CB 3.32Å; M364-A368 WeakPolarHBondContact O-CB 3.44Å; M364-A368 PolarHBondContact O-N 3.13Å; V365-A368 PolarHBondContact O-N 2.93Å; R366-A368 PolarHBondContact O-N 2.83Å; A368-N372 PolarHBondContact O-N 2.91Å; A368-N372 PolarHBondContact O-ND2 3.29Å
369V85.2Confident81.3Confident0 Ų034.9 Ų34.90%017%0.167CC..Hα-helixtrans-64.4-47.1174.7178.70000110.6I297 L319 F322 L323 V365 R366 N371 N372 L373I297-V369 HydrophobicContact CD1-CG2 3.46Å; I297-V369 VanDerWaalsContact CD1-CG2 3.46Å; I297-V369 HydrophobicContact CG1-CG2 4.05Å; I297-V369 HydrophobicContact CG2-CB 4.43Å; I297-V369 HydrophobicContact CG2-CG2 3.94Å; L319-V369 HydrophobicContact CB-CG1 4.33Å; L319-V369 HydrophobicContact CD2-CG1 4.24Å; F322-V369 HydrophobicContact CD1-CB 4.48Å; F322-V369 HydrophobicContact CD1-CG1 4.05Å; F322-V369 HydrophobicContact CD1-CG2 3.75Å; F322-V369 HydrophobicContact CE1-CG2 3.75Å; L323-V369 HydrophobicContact CD1-CB 4.43Å; L323-V369 HydrophobicContact CD1-CG1 3.76Å; L323-V369 HydrophobicContact CD2-CB 4.21Å; L323-V369 HydrophobicContact CD2-CG1 3.97Å; L323-V369 HydrophobicContact CG-CB 4.45Å; L323-V369 HydrophobicContact CG-CG1 3.69Å; V365-V369 HydrophobicContact CG1-CG2 4.46Å; V365-V369 VanDerWaalsContact O-CG2 3.32Å; V365-V369 WeakPolarHBondContact O-CG2 3.39Å; V365-V369 PolarHBondContact O-N 3.46Å; R366-V369 PolarHBondContact O-N 3.19Å; V369-N371 PolarHBondContact O-N 3.13Å; V369-N372 PolarHBondContact O-N 3.1Å; V369-L373 VanDerWaalsContact O-CB 3.32Å; V369-L373 WeakPolarHBondContact O-CB 3.39Å; V369-L373 PolarHBondContact O-N 2.92Å
370I87.1Confident81.8Confident13 Ų1331.8 Ų31.87%0.06715%0.153CC..Hα-helixtrans-59.3-46.8178.4-66.6167.4000110.5L323 R366 G367 N372 L373 C374 F418L323-I370 HydrophobicContact CD1-CG1 3.8Å; R366-I370 HydrophobicContact CG-CD1 4Å; R366-I370 WeakPolarHBondContact O-CG1 3.48Å; R366-I370 PolarHBondContact O-N 2.91Å; G367-I370 PolarHBondContact O-N 3.26Å; I370-N372 PolarHBondContact O-N 3.4Å; I370-L373 WeakPolarHBondContact O-CB 3.42Å; I370-L373 PolarHBondContact O-N 3.14Å; I370-C374 PolarHBondContact O-N 3.45Å; I370-C374 PolarHBondContact O-SG 3.35Å; I370-F418 HydrophobicContact CD1-CB 3.88Å
371N83.5Confident82.3Confident59 Ų5927 Ų2732%0.31614%0.135SC..Hα-helixtrans-61.2-44.5178.4-76.2-12.6000112.4G367 V369 L373 C374 R375 W426G367-N371 WeakPolarHBondContact O-CB 3.28Å; G367-N371 PolarHBondContact O-N 3.3Å; V369-N371 PolarHBondContact O-N 3.13Å; N371-L373 VanDerWaalsContact C-N 3.35Å; N371-C374 WeakPolarHBondContact O-CB 3.45Å; N371-C374 PolarHBondContact O-N 2.83Å; N371-R375 WeakPolarHBondContact O-CG 3.36Å; N371-R375 PolarHBondContact O-N 3.46Å; N371-W426 HydrophobicContact CB-CH2 4.35Å; N371-W426 HydrophobicContact CB-CZ3 3.99Å; N371-W426 WeakPolarHBondContact OD1-CZ3 3.45Å
372N84.4Confident82.7Confident3 Ų333.2 Ų33.22%0.01616%0.16CC..Hα-helixtrans-74.2-26.8179.5-72.3-73.4000112.7I297 L319 A368 V369 I370 R375 G376I297-N372 HydrophobicContact CG2-CB 4.13Å; L319-N372 HydrophobicContact CD1-CB 4.14Å; A368-N372 PolarHBondContact O-N 2.91Å; A368-N372 PolarHBondContact O-ND2 3.29Å; V369-N372 PolarHBondContact O-N 3.1Å; I370-N372 PolarHBondContact O-N 3.4Å; N372-R375 PolarHBondContact O-N 3.19Å; N372-R375 PolarHBondContact OD1-NH1 3.48Å; N372-G376 PolarHBondContact O-N 3.16Å
373L88.5Confident82.6Confident0 Ų035.5 Ų35.50%018%0.18CC..Hα-helixtrans-63-45.8167.3176.564.6000110.3V316 L319 V369 I370 N371 R375 G376 L377 T419V316-L373 HydrophobicContact CB-CD1 4.32Å; V316-L373 HydrophobicContact CG1-CD1 3.97Å; V316-L373 HydrophobicContact CG2-CD1 4.44Å; L319-L373 HydrophobicContact CB-CB 4.17Å; L319-L373 HydrophobicContact CB-CD1 4.05Å; L319-L373 HydrophobicContact CD1-CB 4.36Å; V369-L373 VanDerWaalsContact O-CB 3.32Å; V369-L373 WeakPolarHBondContact O-CB 3.39Å; V369-L373 PolarHBondContact O-N 2.92Å; I370-L373 WeakPolarHBondContact O-CB 3.42Å; I370-L373 PolarHBondContact O-N 3.14Å; N371-L373 VanDerWaalsContact C-N 3.35Å; L373-R375 PolarHBondContact O-N 2.72Å; L373-G376 CarbonylContact O-C 3.36Å; L373-G376 WeakPolarHBondContact O-CA 3.44Å; L373-G376 PolarHBondContact O-N 3.21Å; L373-G376 VanDerWaalsContact O-N 3.15Å; L373-L377 HydrophobicContact CD1-CG 4.47Å; L373-L377 HydrophobicContact CG-CD1 4.28Å; L373-L377 WeakPolarHBondContact O-CG 3.37Å; L373-L377 PolarHBondContact O-N 2.89Å; L373-T419 HydrophobicContact CD2-CG2 3.5Å
374C88.7Confident82.5Confident0 Ų034.2 Ų34.20%018%0.176CC..Hα-helixtrans-62.2-40.2175.5-66.80000112.4I370 N371 G376 L377 R378 W426 F427I370-C374 PolarHBondContact O-N 3.45Å; I370-C374 PolarHBondContact O-SG 3.35Å; N371-C374 WeakPolarHBondContact O-CB 3.45Å; N371-C374 PolarHBondContact O-N 2.83Å; C374-G376 VanDerWaalsContact C-N 3.34Å; C374-L377 PolarHBondContact O-N 2.97Å; C374-R378 WeakPolarHBondContact O-CB 3.35Å; C374-R378 PolarHBondContact O-N 2.61Å; C374-W426 HydrophobicContact CB-CB 3.85Å; C374-W426 HydrophobicContact CB-CD2 3.73Å; C374-W426 HydrophobicContact CB-CE3 4.35Å; C374-W426 HydrophobicContact CB-CG 3.47Å; C374-W426 VanDerWaalsContact CB-CG 3.47Å; C374-F427 HydrophobicContact CB-CE2 4.27Å; C374-F427 WeakPolarHBondContact O-CZ 3.41Å
375R84.7Confident82.6Confident36 Ų3634.9 Ų34.914%0.13619%0.189CC..Hα-helixtrans-60.8-44.3171.6-68174.270.2-161.87.5111.7N302 E305 N371 N372 L373 R378 S379 W426N302-R375 VanDerWaalsContact OD1-CZ 3.25Å; N302-R375 PolarHBondContact OD1-NH1 3.33Å; N302-R375 PolarHBondContact OD1-NH2 3.3Å; E305-R375 IonicContact OE1-CZ 2.82Å; E305-R375 IonicContact OE1-NE 3.75Å; E305-R375 PolarHBondContact OE1-NE 3.35Å; E305-R375 IonicContact OE1-NH2 3.94Å; E305-R375 PolarHBondContact OE1-NH2 3.05Å; E305-R375 VanDerWaalsContact OE1-NH2 3.08Å; E305-R375 IonicContact OE2-CZ 3.99Å; E305-R375 IonicContact OE2-NE 3.85Å; E305-R375 IonicContact OE2-NH2 2.83Å; E305-R375 PolarHBondContact OE2-NH2 2.75Å; N371-R375 WeakPolarHBondContact O-CG 3.36Å; N371-R375 PolarHBondContact O-N 3.46Å; N372-R375 PolarHBondContact O-N 3.19Å; N372-R375 PolarHBondContact OD1-NH1 3.48Å; L373-R375 PolarHBondContact O-N 2.72Å; R375-R378 PolarHBondContact O-N 2.94Å; R375-S379 PolarHBondContact O-N 2.93Å; R375-W426 HydrophobicContact CG-CH2 4.43Å; R375-W426 HydrophobicContact CG-CZ2 3.8Å
376G83.5Confident82.7Confident0 Ų041.2 Ų41.20%022%0.219CC..Hα-helixtrans-55-55.417300000111.6S311 N372 L373 C374 R378 S379 G380S311-G376 WeakPolarHBondContact OG-CA 3.16Å; S311-G376 PolarHBondContact OG-O 3.46Å; N372-G376 PolarHBondContact O-N 3.16Å; L373-G376 CarbonylContact O-C 3.36Å; L373-G376 WeakPolarHBondContact O-CA 3.44Å; L373-G376 PolarHBondContact O-N 3.21Å; L373-G376 VanDerWaalsContact O-N 3.15Å; C374-G376 VanDerWaalsContact C-N 3.34Å; G376-R378 VanDerWaalsContact C-N 3.3Å; G376-R378 PolarHBondContact O-N 2.92Å; G376-S379 PolarHBondContact O-N 3.43Å; G376-S379 VanDerWaalsContact O-N 3.14Å; G376-G380 PolarHBondContact O-N 3.31Å
377L87.4Confident82.6Confident0 Ų040.4 Ų40.40%022%0.217CC..Hα-helixtrans-56.2-41.4177.9-72.6173000112.6V316 L373 C374 S379 G380 L381 V388 C391 I423 F427V316-L377 HydrophobicContact CB-CD2 4.42Å; V316-L377 HydrophobicContact CG1-CD2 3.62Å; V316-L377 HydrophobicContact CG1-CG 4.36Å; V316-L377 HydrophobicContact CG2-CD2 3.87Å; V316-L377 HydrophobicContact CG2-CG 4.11Å; L373-L377 HydrophobicContact CD1-CG 4.47Å; L373-L377 HydrophobicContact CG-CD1 4.28Å; L373-L377 WeakPolarHBondContact O-CG 3.37Å; L373-L377 PolarHBondContact O-N 2.89Å; C374-L377 PolarHBondContact O-N 2.97Å; L377-S379 PolarHBondContact O-N 3.25Å; L377-G380 PolarHBondContact O-N 2.88Å; L377-L381 PolarHBondContact O-N 3.09Å; L377-V388 HydrophobicContact CB-CG2 4.24Å; L377-V388 HydrophobicContact CD2-CG2 4.32Å; L377-C391 HydrophobicContact CD2-CB 3.72Å; L377-I423 HydrophobicContact CD1-CD1 3.93Å; L377-I423 HydrophobicContact CD1-CG1 4.02Å; L377-F427 HydrophobicContact CB-CE2 3.97Å; L377-F427 HydrophobicContact CB-CZ 3.72Å; L377-F427 HydrophobicContact CD1-CE2 4.32Å
378R85.7Confident82.8Confident120 Ų12039.3 Ų39.345%0.45320%0.204SC..Hα-helixtrans-66.3-38.5178.8-172.4176.2-115.8-177.70.7112.1C374 R375 G376 F427 E429C374-R378 WeakPolarHBondContact O-CB 3.35Å; C374-R378 PolarHBondContact O-N 2.61Å; R375-R378 PolarHBondContact O-N 2.94Å; G376-R378 VanDerWaalsContact C-N 3.3Å; G376-R378 PolarHBondContact O-N 2.92Å; R378-F427 HydrophobicContact CB-CE1 3.74Å; R378-F427 HydrophobicContact CB-CZ 3.87Å; R378-F427 HydrophobicContact CG-CE1 4.15Å; R378-E429 IonicContact CZ-OE1 3.36Å; R378-E429 IonicContact NE-OE1 2.75Å; R378-E429 VanDerWaalsContact NH2-CD 3.26Å; R378-E429 IonicContact NH2-OE1 2.78Å; R378-E429 PolarHBondContact NH2-OE1 2.93Å; R378-E429 IonicContact NH2-OE2 3.08Å
379S81.8Confident83Confident4 Ų443.2 Ų43.23%0.02822%0.223CC..Hα-helixtrans-71.5-40.3173-163.40000111.7A304 E305 R375 G376 L377 L381 K382A304-S379 WeakPolarHBondContact O-CB 3.35Å; A304-S379 PolarHBondContact O-OG 2.8Å; E305-S379 WeakPolarHBondContact CA-OG 3.16Å; R375-S379 PolarHBondContact O-N 2.93Å; G376-S379 PolarHBondContact O-N 3.43Å; G376-S379 VanDerWaalsContact O-N 3.14Å; L377-S379 PolarHBondContact O-N 3.25Å; S379-L381 VanDerWaalsContact C-N 3.29Å; S379-L381 PolarHBondContact O-N 3.44Å; S379-K382 VanDerWaalsContact O-CB 3.25Å; S379-K382 WeakPolarHBondContact O-CB 3.47Å; S379-K382 PolarHBondContact O-N 3.38Å
380G81.1Confident82.9Confident0 Ų045.9 Ų45.90%025%0.245CC..Hα-helixtrans-62-34.117900000113G376 L377 K382 A383 D384G376-G380 PolarHBondContact O-N 3.31Å; L377-G380 PolarHBondContact O-N 2.88Å; G380-K382 PolarHBondContact O-N 3.35Å; G380-A383 PolarHBondContact O-N 2.78Å; G380-D384 PolarHBondContact O-N 3.02Å
381L81Confident82.9Confident56 Ų5645.6 Ų45.629%0.29324%0.244SC..THydrogen-bonded Turntrans-53.3-25.3170.4-89.5156000113.7L377 S379 D384 V388 F427 L430L377-L381 PolarHBondContact O-N 3.09Å; S379-L381 VanDerWaalsContact C-N 3.29Å; S379-L381 PolarHBondContact O-N 3.44Å; L381-D384 WeakPolarHBondContact CA-O 3.36Å; L381-V388 HydrophobicContact CD1-CG2 3.67Å; L381-V388 HydrophobicContact CD2-CG2 4.15Å; L381-V388 HydrophobicContact CG-CG2 3.78Å; L381-F427 HydrophobicContact CD1-CD1 4.43Å; L381-F427 HydrophobicContact CD1-CE1 3.75Å; L381-F427 HydrophobicContact CD1-CZ 4.33Å; L381-L430 HydrophobicContact CD1-CD1 4.31Å
382K77.5Confident83.1Confident162 Ų16243 Ų4370%0.70423%0.23SC*.THydrogen-bonded Turntrans-77.2-24.2175.4-57.5178.6178.9177.60113.1P308 S379 G380P308-K382 HydrophobicContact CB-CB 4.24Å; P308-K382 HydrophobicContact CG-CD 4.41Å; S379-K382 VanDerWaalsContact O-CB 3.25Å; S379-K382 WeakPolarHBondContact O-CB 3.47Å; S379-K382 PolarHBondContact O-N 3.38Å; G380-K382 PolarHBondContact O-N 3.35Å
383A75.5Confident83.1Confident54 Ų5445.5 Ų45.545%0.44625%0.251SS..THydrogen-bonded Turntrans-103.3-35.3-177.500000112.5P308 P312 G380P308-A383 HydrophobicContact CB-CB 4.33Å; P312-A383 HydrophobicContact CG-CB 4.46Å; G380-A383 PolarHBondContact O-N 2.78Å
384D77.4Confident82.9Confident61 Ų6148.2 Ų48.233%0.32627%0.27SS..  trans-142.4116.2179.8173.714.6000109.7P312 G380 L381 E386 C387P312-D384 HydrophobicContact CB-CB 4.42Å; P312-D384 HydrophobicContact CG-CB 4.28Å; G380-D384 PolarHBondContact O-N 3.02Å; L381-D384 WeakPolarHBondContact CA-O 3.36Å; D384-E386 PolarHBondContact O-N 3.3Å; D384-E386 PolarHBondContact OD1-N 3.26Å; D384-C387 HydrophobicContact CB-CB 4.23Å; D384-C387 WeakPolarHBondContact O-CB 3.16Å; D384-C387 PolarHBondContact O-N 2.92Å; D384-C387 PolarHBondContact OD2-N 3.2Å
385S76.4Confident82.9Confident98 Ų9848.2 Ų48.269%0.68527%0.27SS*.THydrogen-bonded Turntrans-66.4-22.2178.851.80000113.5
386E80.5Confident82.8Confident134 Ų13447.4 Ų47.463%0.62627%0.27SS*.THydrogen-bonded Turntrans-90.8-6.8-179.8-64.6-164.7166.600113.5D384 V388 N389 A390D384-E386 PolarHBondContact O-N 3.3Å; D384-E386 PolarHBondContact OD1-N 3.26Å; E386-V388 VanDerWaalsContact C-N 3.26Å; E386-V388 PolarHBondContact O-N 3.37Å; E386-V388 VanDerWaalsContact O-N 3.09Å; E386-N389 PolarHBondContact O-N 2.66Å; E386-A390 PolarHBondContact O-N 3.27Å
387C83.1Confident82.8Confident6 Ų651.3 Ų51.34%0.04129%0.294CS..Hα-helixtrans-51-40.8-174.6178.30000113.7P312 D384 C391P312-C387 HydrophobicContact CB-CB 4.23Å; D384-C387 HydrophobicContact CB-CB 4.23Å; D384-C387 WeakPolarHBondContact O-CB 3.16Å; D384-C387 PolarHBondContact O-N 2.92Å; D384-C387 PolarHBondContact OD2-N 3.2Å; C387-C391 WeakPolarHBondContact O-CB 3.31Å; C387-C391 PolarHBondContact O-N 3.39Å; C387-C391 VanDerWaalsContact O-N 3.1Å
388V86.1Confident82.6Confident4 Ų454.8 Ų54.82%0.02431%0.307CS..Hα-helixtrans-70.7-45.9178.3179.80000111.4L377 L381 E386 A390 C391 L392 I433L377-V388 HydrophobicContact CB-CG2 4.24Å; L377-V388 HydrophobicContact CD2-CG2 4.32Å; L381-V388 HydrophobicContact CD1-CG2 3.67Å; L381-V388 HydrophobicContact CD2-CG2 4.15Å; L381-V388 HydrophobicContact CG-CG2 3.78Å; E386-V388 VanDerWaalsContact C-N 3.26Å; E386-V388 PolarHBondContact O-N 3.37Å; E386-V388 VanDerWaalsContact O-N 3.09Å; V388-A390 VanDerWaalsContact C-N 3.32Å; V388-A390 PolarHBondContact O-N 3.2Å; V388-C391 PolarHBondContact O-N 2.74Å; V388-L392 HydrophobicContact CG1-CD1 4.08Å; V388-L392 HydrophobicContact CG1-CG 4.24Å; V388-L392 WeakPolarHBondContact O-CG 3.33Å; V388-L392 PolarHBondContact O-N 2.97Å; V388-I433 HydrophobicContact CB-CD1 4.43Å; V388-I433 HydrophobicContact CG1-CD1 3.84Å; V388-I433 HydrophobicContact CG1-CG1 3.98Å; V388-I433 HydrophobicContact CG1-CG2 4.2Å; V388-I433 HydrophobicContact CG2-CD1 4.33Å
389N83.3Confident82.4Confident97 Ų9749.1 Ų49.152%0.51929%0.286SS..Hα-helixtrans-63.9-39.8179.7-70.1-25.3000111.3E386 L392 A393E386-N389 PolarHBondContact O-N 2.66Å; N389-L392 PolarHBondContact O-N 3.41Å; N389-A393 WeakPolarHBondContact O-CB 3.27Å; N389-A393 PolarHBondContact O-N 3.42Å
390A83Confident82.2Confident56 Ų5653 Ų5346%0.46330%0.3SS..Hα-helixtrans-61.7-43.3173.800000111.7E386 V388 A393 S394E386-A390 PolarHBondContact O-N 3.27Å; V388-A390 VanDerWaalsContact C-N 3.32Å; V388-A390 PolarHBondContact O-N 3.2Å; A390-A393 PolarHBondContact O-N 2.92Å; A390-S394 WeakPolarHBondContact O-CB 3.32Å; A390-S394 PolarHBondContact O-N 3.46Å
391C87.4Confident82Confident7 Ų756.7 Ų56.75%0.04732%0.323CS..Hα-helixtrans-64.9-44.7175.8-171.30000111.9V316 L377 C387 V388 A393 S394 I395V316-C391 HydrophobicContact CG1-CB 4.25Å; L377-C391 HydrophobicContact CD2-CB 3.72Å; C387-C391 WeakPolarHBondContact O-CB 3.31Å; C387-C391 PolarHBondContact O-N 3.39Å; C387-C391 VanDerWaalsContact O-N 3.1Å; V388-C391 PolarHBondContact O-N 2.74Å; C391-A393 PolarHBondContact O-N 2.63Å; C391-S394 PolarHBondContact O-N 3.08Å; C391-I395 VanDerWaalsContact O-CG1 3.28Å; C391-I395 WeakPolarHBondContact O-CG1 3.34Å; C391-I395 PolarHBondContact O-N 2.89Å
392L87.6Confident81.3Confident6 Ų655 Ų553%0.03132%0.318CS..Hα-helixtrans-60.8-44176.3-71177.2000111.5V388 N389 I395 S396 L420 I423 I433 A436 V437 I440V388-L392 HydrophobicContact CG1-CD1 4.08Å; V388-L392 HydrophobicContact CG1-CG 4.24Å; V388-L392 WeakPolarHBondContact O-CG 3.33Å; V388-L392 PolarHBondContact O-N 2.97Å; N389-L392 PolarHBondContact O-N 3.41Å; L392-I395 PolarHBondContact O-N 3.35Å; L392-S396 WeakPolarHBondContact O-CB 3.45Å; L392-S396 PolarHBondContact O-N 3.49Å; L392-L420 HydrophobicContact CD2-CD2 3.5Å; L392-I423 HydrophobicContact CD2-CD1 4.25Å; L392-I423 HydrophobicContact CD2-CG2 4.22Å; L392-I433 HydrophobicContact CD1-CG2 4.49Å; L392-A436 HydrophobicContact CD1-CB 4.02Å; L392-V437 HydrophobicContact CD2-CG2 3.85Å; L392-I440 HydrophobicContact CB-CD1 4.27Å
393A84.7Confident80.2Confident55 Ų5553.4 Ų53.446%0.45532%0.315SS..Hα-helixtrans-62.7-41.9176.300000111.8N389 A390 C391 S396 T397N389-A393 WeakPolarHBondContact O-CB 3.27Å; N389-A393 PolarHBondContact O-N 3.42Å; A390-A393 PolarHBondContact O-N 2.92Å; C391-A393 PolarHBondContact O-N 2.63Å; A393-S396 PolarHBondContact O-N 2.88Å; A393-T397 WeakPolarHBondContact O-CB 3.49Å; A393-T397 PolarHBondContact O-N 3.48Å; A393-T397 PolarHBondContact O-OG1 3.31Å
394S84.3Confident79.3Confident56 Ų5655.1 Ų55.139%0.39233%0.33SS..Hα-helixtrans-62.3-47.2176-175.70000112.1A390 C391 T397 R398A390-S394 WeakPolarHBondContact O-CB 3.32Å; A390-S394 PolarHBondContact O-N 3.46Å; C391-S394 PolarHBondContact O-N 3.08Å; S394-T397 PolarHBondContact O-N 3.42Å; S394-R398 WeakPolarHBondContact O-CG 3.43Å; S394-R398 PolarHBondContact O-N 3.33Å; S394-R398 VanDerWaalsContact O-N 3.16Å
395I87.9Confident78.4Confident0 Ų058.6 Ų58.60%035%0.353CS..Hα-helixtrans-67.7-42.4179.5-63170000110.3M324 C391 L392 T397 R398 L399 T419 L420 I423M324-I395 HydrophobicContact CE-CB 4.47Å; M324-I395 HydrophobicContact CE-CD1 4.18Å; M324-I395 HydrophobicContact CE-CG1 3.91Å; M324-I395 HydrophobicContact CE-CG2 3.84Å; M324-I395 HydrophobicContact SD-CG2 4.2Å; C391-I395 VanDerWaalsContact O-CG1 3.28Å; C391-I395 WeakPolarHBondContact O-CG1 3.34Å; C391-I395 PolarHBondContact O-N 2.89Å; L392-I395 PolarHBondContact O-N 3.35Å; I395-T397 VanDerWaalsContact C-N 3.35Å; I395-T397 PolarHBondContact O-N 3.07Å; I395-R398 PolarHBondContact O-N 3.14Å; I395-L399 PolarHBondContact O-N 3.01Å; I395-T419 HydrophobicContact CD1-CG2 3.7Å; I395-L420 HydrophobicContact CB-CD2 4.39Å; I395-L420 HydrophobicContact CG2-CD1 4.17Å; I395-L420 HydrophobicContact CG2-CD2 4.06Å; I395-L420 HydrophobicContact CG2-CG 3.84Å; I395-I423 HydrophobicContact CD1-CD1 4.06Å
396S84.2Confident77.5Confident20 Ų2058.8 Ų58.814%0.1435%0.346CS..Hα-helixtrans-57.3-47.5174.8-177.60000111.2L392 A393 R398 L399 Y400L392-S396 WeakPolarHBondContact O-CB 3.45Å; L392-S396 PolarHBondContact O-N 3.49Å; A393-S396 PolarHBondContact O-N 2.88Å; S396-R398 VanDerWaalsContact C-N 3.29Å; S396-R398 PolarHBondContact O-N 3.02Å; S396-L399 WeakPolarHBondContact O-CB 3.23Å; S396-L399 PolarHBondContact O-N 3.45Å; S396-L399 VanDerWaalsContact O-N 3.1Å; S396-Y400 WeakPolarHBondContact O-CD2 3.37Å; S396-Y400 PolarHBondContact O-N 3.44Å; S396-Y400 VanDerWaalsContact O-N 3.13Å
397T83.8Confident76.8Confident82 Ų8261.4 Ų61.450%0.50336%0.358SS..Hα-helixtrans-57.7-42177.2-55.10000111.5A393 S394 I395 Y400 T401A393-T397 WeakPolarHBondContact O-CB 3.49Å; A393-T397 PolarHBondContact O-N 3.48Å; A393-T397 PolarHBondContact O-OG1 3.31Å; S394-T397 PolarHBondContact O-N 3.42Å; I395-T397 VanDerWaalsContact C-N 3.35Å; I395-T397 PolarHBondContact O-N 3.07Å; T397-Y400 PolarHBondContact O-N 3.26Å; T397-T401 HydrophobicContact CG2-CG2 4.13Å; T397-T401 WeakPolarHBondContact O-CB 3.32Å; T397-T401 VanDerWaalsContact O-CG2 3.3Å; T397-T401 WeakPolarHBondContact O-CG2 3.38Å; T397-T401 PolarHBondContact O-N 3.49Å; T397-T401 PolarHBondContact O-OG1 3.36Å
398R81.7Confident76.2Confident72 Ų7262.8 Ų62.827%0.27236%0.364SS..Hα-helixtrans-67.8-38176.4-68.4-67.4-71.7164.7-8.4112.8M324 S394 I395 S396 Y400 T401 A402M324-R398 HydrophobicContact CB-CG 4.23Å; M324-R398 PolarHBondContact O-NH2 2.93Å; S394-R398 WeakPolarHBondContact O-CG 3.43Å; S394-R398 PolarHBondContact O-N 3.33Å; S394-R398 VanDerWaalsContact O-N 3.16Å; I395-R398 PolarHBondContact O-N 3.14Å; S396-R398 VanDerWaalsContact C-N 3.29Å; S396-R398 PolarHBondContact O-N 3.02Å; R398-Y400 PolarHBondContact O-N 3.18Å; R398-T401 WeakPolarHBondContact CA-OG1 3.42Å; R398-T401 PolarHBondContact O-N 3.28Å; R398-A402 WeakPolarHBondContact O-CB 3.36Å; R398-A402 PolarHBondContact O-N 3.36Å; R398-A402 VanDerWaalsContact O-N 3.13Å
399L81.7Confident75.7Confident1 Ų163.6 Ų63.61%0.00537%0.37CS..Hα-helixtrans-60.1-31.5175.2-173.969.5000112.6I395 S396 L413 I417 L420 I440 K444I395-L399 PolarHBondContact O-N 3.01Å; S396-L399 WeakPolarHBondContact O-CB 3.23Å; S396-L399 PolarHBondContact O-N 3.45Å; S396-L399 VanDerWaalsContact O-N 3.1Å; L399-L413 HydrophobicContact CD1-CD2 3.9Å; L399-L413 VanDerWaalsContact O-CD2 3.28Å; L399-L413 WeakPolarHBondContact O-CD2 3.33Å; L399-I417 HydrophobicContact CD1-CD1 4.45Å; L399-I417 HydrophobicContact CD1-CG1 4.02Å; L399-L420 HydrophobicContact CD2-CD1 4.22Å; L399-I440 HydrophobicContact CD2-CG2 4.15Å; L399-K444 HydrophobicContact CD2-CB 4.13Å; L399-K444 HydrophobicContact CD2-CD 4.47Å; L399-K444 HydrophobicContact CD2-CG 3.95Å; L399-K444 HydrophobicContact CG-CD 4.31Å; L399-K444 HydrophobicContact CG-CG 4.21Å
400Y78.6Confident75.5Confident86 Ų8663.3 Ų63.334%0.33737%0.368SS..Hα-helixtrans-92.3-31177.2-71-73.1000114.4S396 T397 R398 Q443 K444S396-Y400 WeakPolarHBondContact O-CD2 3.37Å; S396-Y400 PolarHBondContact O-N 3.44Å; S396-Y400 VanDerWaalsContact O-N 3.13Å; T397-Y400 PolarHBondContact O-N 3.26Å; R398-Y400 PolarHBondContact O-N 3.18Å; Y400-Q443 VanDerWaalsContact OH-C 3.31Å; Y400-Q443 WeakPolarHBondContact OH-CB 3.5Å; Y400-K444 HydrophobicContact CD1-CD 4.41Å; Y400-K444 HydrophobicContact CE1-CD 3.96Å; Y400-K444 PolarHBondContact OH-N 3.11Å
401T75.3Confident75.5Confident77 Ų7760.6 Ų60.647%0.47235%0.346SS..Hα-helixtrans-88.4-14.8-175.352.10000114.7T397 R398 I403T397-T401 HydrophobicContact CG2-CG2 4.13Å; T397-T401 WeakPolarHBondContact O-CB 3.32Å; T397-T401 VanDerWaalsContact O-CG2 3.3Å; T397-T401 WeakPolarHBondContact O-CG2 3.38Å; T397-T401 PolarHBondContact O-N 3.49Å; T397-T401 PolarHBondContact O-OG1 3.36Å; R398-T401 WeakPolarHBondContact CA-OG1 3.42Å; R398-T401 PolarHBondContact O-N 3.28Å; T401-I403 PolarHBondContact O-N 2.96Å
402A67.4Low75.3Confident22 Ų2260.6 Ų60.618%0.18235%0.345CS..  trans-70.271.3175.800000111.5R398 I412 L413R398-A402 WeakPolarHBondContact O-CB 3.36Å; R398-A402 PolarHBondContact O-N 3.36Å; R398-A402 VanDerWaalsContact O-N 3.13Å; A402-I412 HydrophobicContact CB-CG2 4.39Å; A402-L413 HydrophobicContact CB-CD2 4.01Å; A402-L413 HydrophobicContact CB-CG 4.3Å
403I55.3Low75.2Confident127 Ų12761.1 Ų61.165%0.65135%0.348SS*.  trans-95.1117.2179.3-62.5172.5000109.2T401 V405T401-I403 PolarHBondContact O-N 2.96Å; I403-V405 VanDerWaalsContact C-N 3.25Å; I403-V405 PolarHBondContact O-N 3.14Å
404A56.1Low75.3Confident91 Ų9160.4 Ų60.475%0.75234%0.335SS*.SBendtrans40.7-715400000123.2
405V57.5Low75.5Confident134 Ų13457.7 Ų57.781%0.81232%0.317SS*.SBendtrans-91.6-26.5-174.5-175.90000112.8I403I403-V405 VanDerWaalsContact C-N 3.25Å; I403-V405 PolarHBondContact O-N 3.14Å
406D57.4Low75.5Confident101 Ų10157.7 Ų57.754%0.5432%0.317SS..  trans-95132.3-177.6-83.5-32.1000113.3H408 S409D406-H408 PolarHBondContact O-N 3.4Å; D406-S409 VanDerWaalsContact O-CB 3.28Å; D406-S409 WeakPolarHBondContact O-CB 3.46Å; D406-S409 PolarHBondContact O-N 3.2Å; D406-S409 PolarHBondContact O-OG 2.84Å
407Q65.7Low75.8Confident190 Ų19056.8 Ų56.889%0.88831%0.31SS*.THydrogen-bonded Turntrans-56.5-20.2170.8-75.2-177.3-6.400113
408H71.4Confident76Confident34 Ų3454.6 Ų54.616%0.15729%0.294CS..THydrogen-bonded Turntrans-107.811.5177.9-54-61.4000114Q331 E335 D406 N410 L411 I412Q331-H408 PolarHBondContact NE2-CD2 3.29Å; E335-H408 IonicContact OE1-CE1 2.76Å; E335-H408 PolarHBondContact OE1-CE1 2.79Å; E335-H408 VanDerWaalsContact OE1-CE1 3.29Å; E335-H408 IonicContact OE1-NE2 2.82Å; D406-H408 PolarHBondContact O-N 3.4Å; H408-N410 PolarHBondContact O-N 3.43Å; H408-L411 HydrophobicContact CB-CB 4.48Å; H408-L411 WeakPolarHBondContact O-CB 3.43Å; H408-L411 PolarHBondContact O-N 2.91Å; H408-I412 PolarHBondContact O-N 3.43Å
409S75.7Confident76.4Confident21 Ų2151.1 Ų51.115%0.14728%0.281CS..Hα-helixtrans-49.5-43.5178.147.40000112.9D406 L411 I412 L413D406-S409 VanDerWaalsContact O-CB 3.28Å; D406-S409 WeakPolarHBondContact O-CB 3.46Å; D406-S409 PolarHBondContact O-N 3.2Å; D406-S409 PolarHBondContact O-OG 2.84Å; S409-L411 PolarHBondContact O-N 2.97Å; S409-I412 PolarHBondContact O-N 2.86Å; S409-L413 WeakPolarHBondContact O-CG 3.46Å; S409-L413 PolarHBondContact O-N 3.33Å; S409-L413 VanDerWaalsContact O-N 3.07Å
410N78.1Confident76.8Confident91 Ų9151.1 Ų51.149%0.48728%0.281SS..Hα-helixtrans-61.6-38.9176.4-75.3-33000113.4H408 I412 L413 E414H408-N410 PolarHBondContact O-N 3.43Å; N410-I412 VanDerWaalsContact C-N 3.34Å; N410-I412 PolarHBondContact O-N 3.47Å; N410-L413 PolarHBondContact O-N 2.87Å; N410-E414 WeakPolarHBondContact O-CB 3.5Å; N410-E414 VanDerWaalsContact O-CG 3.29Å; N410-E414 WeakPolarHBondContact O-CG 3.28Å; N410-E414 PolarHBondContact O-N 3.37Å
411L83.6Confident77.3Confident0 Ų047 Ų470%026%0.264CS..Hα-helixtrans-63.7-41.3177.3172.461.4000111.2P326 Q331 F334 F362 H408 S409 E414 N415P326-L411 HydrophobicContact CB-CD2 3.77Å; P326-L411 HydrophobicContact CB-CG 4.38Å; P326-L411 HydrophobicContact CG-CD2 4.04Å; P326-L411 HydrophobicContact CG-CG 4.45Å; Q331-L411 HydrophobicContact CG-CD2 4.46Å; F334-L411 HydrophobicContact CB-CD1 4.33Å; F334-L411 HydrophobicContact CB-CD2 3.98Å; F334-L411 HydrophobicContact CD1-CB 4.24Å; F334-L411 HydrophobicContact CD1-CD1 4.46Å; F334-L411 HydrophobicContact CD1-CD2 4.01Å; F334-L411 HydrophobicContact CD1-CG 4.47Å; F334-L411 HydrophobicContact CD2-CD1 3.71Å; F334-L411 HydrophobicContact CE1-CB 4Å; F334-L411 HydrophobicContact CE2-CB 4.45Å; F334-L411 HydrophobicContact CE2-CD1 3.97Å; F334-L411 HydrophobicContact CG-CD1 3.93Å; F334-L411 HydrophobicContact CG-CD2 3.96Å; F334-L411 HydrophobicContact CG-CG 4.37Å; F334-L411 HydrophobicContact CZ-CB 4.07Å; F334-L411 HydrophobicContact CZ-CD1 4.43Å; F362-L411 HydrophobicContact CE2-CD1 4.14Å; F362-L411 HydrophobicContact CZ-CD1 3.7Å; H408-L411 HydrophobicContact CB-CB 4.48Å; H408-L411 WeakPolarHBondContact O-CB 3.43Å; H408-L411 PolarHBondContact O-N 2.91Å; S409-L411 PolarHBondContact O-N 2.97Å; L411-E414 PolarHBondContact O-N 3.39Å; L411-N415 VanDerWaalsContact O-CB 3.28Å; L411-N415 WeakPolarHBondContact O-CB 3.29Å; L411-N415 PolarHBondContact O-N 3.38Å; L411-N415 PolarHBondContact O-ND2 2.88Å
412I83.6Confident77.9Confident6 Ų644.1 Ų44.13%0.03125%0.25CC..Hα-helixtrans-62.9-45.4177.8-62.4169.6000110.1P326 A402 H408 S409 N410 N415 S416P326-I412 HydrophobicContact CG-CD1 4.39Å; P326-I412 HydrophobicContact CG-CG1 3.8Å; A402-I412 HydrophobicContact CB-CG2 4.39Å; H408-I412 PolarHBondContact O-N 3.43Å; S409-I412 PolarHBondContact O-N 2.86Å; N410-I412 VanDerWaalsContact C-N 3.34Å; N410-I412 PolarHBondContact O-N 3.47Å; I412-N415 PolarHBondContact O-N 2.93Å; I412-S416 WeakPolarHBondContact O-CB 3.2Å; I412-S416 PolarHBondContact O-N 2.97Å; I412-S416 PolarHBondContact O-OG 2.97Å
413L84.9Confident78.9Confident18 Ų1843 Ų439%0.09424%0.241CC..Hα-helixtrans-64.3-44.9178.6-66.4170.8000111.8L399 A402 S409 N410 S416 I417 L452L399-L413 HydrophobicContact CD1-CD2 3.9Å; L399-L413 VanDerWaalsContact O-CD2 3.28Å; L399-L413 WeakPolarHBondContact O-CD2 3.33Å; A402-L413 HydrophobicContact CB-CD2 4.01Å; A402-L413 HydrophobicContact CB-CG 4.3Å; S409-L413 WeakPolarHBondContact O-CG 3.46Å; S409-L413 PolarHBondContact O-N 3.33Å; S409-L413 VanDerWaalsContact O-N 3.07Å; N410-L413 PolarHBondContact O-N 2.87Å; L413-S416 WeakPolarHBondContact O-CB 3.18Å; L413-S416 PolarHBondContact O-N 3.03Å; L413-I417 WeakPolarHBondContact O-CG1 3.1Å; L413-I417 PolarHBondContact O-N 3.36Å; L413-I417 VanDerWaalsContact O-N 3.11Å; L413-L452 HydrophobicContact CB-CD1 3.63Å; L413-L452 HydrophobicContact CB-CD2 4.18Å; L413-L452 HydrophobicContact CD1-CD1 3.72Å; L413-L452 HydrophobicContact CG-CD1 4.18Å
414E87.1Confident80.4Confident39 Ų3937 Ų3718%0.18221%0.21CC..Hα-helixtrans-60.2-49.9174.7-72.8-178.9-161.300111.4N410 L411 S416 I417 F418 L452 L455N410-E414 WeakPolarHBondContact O-CB 3.5Å; N410-E414 VanDerWaalsContact O-CG 3.29Å; N410-E414 WeakPolarHBondContact O-CG 3.28Å; N410-E414 PolarHBondContact O-N 3.37Å; L411-E414 PolarHBondContact O-N 3.39Å; E414-S416 VanDerWaalsContact C-N 3.29Å; E414-S416 PolarHBondContact O-N 3.45Å; E414-I417 PolarHBondContact O-N 3.48Å; E414-F418 HydrophobicContact CB-CD2 4.47Å; E414-F418 HydrophobicContact CB-CE2 4.42Å; E414-F418 WeakPolarHBondContact O-CD2 3.28Å; E414-F418 PolarHBondContact O-N 3.26Å; E414-L452 HydrophobicContact CG-CD2 3.84Å; E414-L455 HydrophobicContact CB-CD1 4.29Å; E414-L455 HydrophobicContact CG-CD1 3.69Å
415N87.6Confident81.9Confident0 Ų035 Ų350%019%0.188CC..Hα-helixtrans-59.5-40.4178.3-75.3-12.2000111.8L323 R366 L411 I412 I417 F418 T419L323-N415 HydrophobicContact CB-CB 4.32Å; L323-N415 PolarHBondContact O-ND2 3.49Å; L323-N415 VanDerWaalsContact O-ND2 3.14Å; R366-N415 WeakPolarHBondContact CD-OD1 3.33Å; L411-N415 VanDerWaalsContact O-CB 3.28Å; L411-N415 WeakPolarHBondContact O-CB 3.29Å; L411-N415 PolarHBondContact O-N 3.38Å; L411-N415 PolarHBondContact O-ND2 2.88Å; I412-N415 PolarHBondContact O-N 2.93Å; N415-I417 PolarHBondContact O-N 3.39Å; N415-F418 PolarHBondContact O-N 3.14Å; N415-T419 VanDerWaalsContact O-CB 3.27Å; N415-T419 WeakPolarHBondContact O-CB 3.33Å; N415-T419 PolarHBondContact O-N 3.48Å; N415-T419 PolarHBondContact O-OG1 3.02Å
416S89.2Confident83.2Confident0 Ų032.7 Ų32.70%017%0.165CC..Hα-helixtrans-58.4-47.4175.9-59.80000111.1M324 I412 L413 E414 T419 L420M324-S416 PolarHBondContact SD-OG 3.26Å; I412-S416 WeakPolarHBondContact O-CB 3.2Å; I412-S416 PolarHBondContact O-N 2.97Å; I412-S416 PolarHBondContact O-OG 2.97Å; L413-S416 WeakPolarHBondContact O-CB 3.18Å; L413-S416 PolarHBondContact O-N 3.03Å; E414-S416 VanDerWaalsContact C-N 3.29Å; E414-S416 PolarHBondContact O-N 3.45Å; S416-T419 PolarHBondContact O-N 2.98Å; S416-L420 WeakPolarHBondContact O-CB 3.42Å; S416-L420 VanDerWaalsContact O-CG 3.29Å; S416-L420 WeakPolarHBondContact O-CG 3.13Å; S416-L420 PolarHBondContact O-N 3.39Å
417I89.6Confident84.6Confident0 Ų028 Ų280%014%0.14CC..Hα-helixtrans-65.5-47.5179.8-67.3163.6000111.4L399 L413 E414 N415 T419 L420 G421 F441 L452 L455 I456 Q459L399-I417 HydrophobicContact CD1-CD1 4.45Å; L399-I417 HydrophobicContact CD1-CG1 4.02Å; L413-I417 WeakPolarHBondContact O-CG1 3.1Å; L413-I417 PolarHBondContact O-N 3.36Å; L413-I417 VanDerWaalsContact O-N 3.11Å; E414-I417 PolarHBondContact O-N 3.48Å; N415-I417 PolarHBondContact O-N 3.39Å; I417-T419 VanDerWaalsContact C-N 3.29Å; I417-T419 PolarHBondContact O-N 3.36Å; I417-L420 PolarHBondContact O-N 2.86Å; I417-G421 PolarHBondContact O-N 2.92Å; I417-F441 HydrophobicContact CB-CE1 4.33Å; I417-F441 HydrophobicContact CG1-CE1 4.34Å; I417-F441 HydrophobicContact CG2-CE1 3.94Å; I417-F441 HydrophobicContact CG2-CZ 4.13Å; I417-L452 HydrophobicContact CD1-CB 3.74Å; I417-L452 HydrophobicContact CD1-CD2 4.17Å; I417-L452 HydrophobicContact CD1-CG 4.36Å; I417-L455 HydrophobicContact CG2-CB 4.03Å; I417-I456 HydrophobicContact CD1-CD1 4.36Å; I417-I456 HydrophobicContact CD1-CG1 3.93Å; I417-I456 HydrophobicContact CG1-CG1 4.16Å; I417-I456 HydrophobicContact CG2-CG1 4.03Å; I417-Q459 HydrophobicContact CG2-CG 3.95Å
418F89.7Confident85.3Confident36 Ų3625.8 Ų25.816%0.15812%0.124CC..Hα-helixtrans-62.2-36.8176.9-76.7-65.2000112.5R366 I370 E414 N415 G422 L455 Q459R366-F418 VanDerWaalsContact NH1-CE2 3.3Å; I370-F418 HydrophobicContact CD1-CB 3.88Å; E414-F418 HydrophobicContact CB-CD2 4.47Å; E414-F418 HydrophobicContact CB-CE2 4.42Å; E414-F418 WeakPolarHBondContact O-CD2 3.28Å; E414-F418 PolarHBondContact O-N 3.26Å; N415-F418 PolarHBondContact O-N 3.14Å; F418-G422 PolarHBondContact O-N 2.97Å; F418-L455 HydrophobicContact CE2-CD1 4.24Å; F418-L455 HydrophobicContact CE2-CD2 4.29Å; F418-L455 HydrophobicContact CZ-CD2 3.78Å; F418-Q459 HydrophobicContact CD1-CG 4.49Å
419T89.3Confident85.8Confident0 Ų028.4 Ų28.40%014%0.136CC..Hα-helixtrans-68.4-45.8178.5-53.10000110.9L323 M324 L373 I395 N415 S416 I417 G422 I423L323-T419 HydrophobicContact CD1-CG2 4.32Å; L323-T419 WeakPolarHBondContact CD1-OG1 3.18Å; M324-T419 HydrophobicContact CE-CG2 4.27Å; L373-T419 HydrophobicContact CD2-CG2 3.5Å; I395-T419 HydrophobicContact CD1-CG2 3.7Å; N415-T419 VanDerWaalsContact O-CB 3.27Å; N415-T419 WeakPolarHBondContact O-CB 3.33Å; N415-T419 PolarHBondContact O-N 3.48Å; N415-T419 PolarHBondContact O-OG1 3.02Å; S416-T419 PolarHBondContact O-N 2.98Å; I417-T419 VanDerWaalsContact C-N 3.29Å; I417-T419 PolarHBondContact O-N 3.36Å; T419-G422 PolarHBondContact O-N 2.94Å; T419-I423 HydrophobicContact CG2-CD1 4.02Å; T419-I423 WeakPolarHBondContact O-CB 3.18Å; T419-I423 VanDerWaalsContact O-CG1 3.23Å; T419-I423 WeakPolarHBondContact O-CG1 3.48Å; T419-I423 PolarHBondContact O-N 3.17Å
420L90.6Very high86.2Confident0 Ų030.6 Ų30.60%015%0.146CC..Hα-helixtrans-60.2-45.7175.3-72.3171000111.6L392 I395 L399 S416 I417 I423 G424 V437 I440 F441L392-L420 HydrophobicContact CD2-CD2 3.5Å; I395-L420 HydrophobicContact CB-CD2 4.39Å; I395-L420 HydrophobicContact CG2-CD1 4.17Å; I395-L420 HydrophobicContact CG2-CD2 4.06Å; I395-L420 HydrophobicContact CG2-CG 3.84Å; L399-L420 HydrophobicContact CD2-CD1 4.22Å; S416-L420 WeakPolarHBondContact O-CB 3.42Å; S416-L420 VanDerWaalsContact O-CG 3.29Å; S416-L420 WeakPolarHBondContact O-CG 3.13Å; S416-L420 PolarHBondContact O-N 3.39Å; I417-L420 PolarHBondContact O-N 2.86Å; L420-I423 PolarHBondContact O-N 2.94Å; L420-G424 PolarHBondContact O-N 3.42Å; L420-V437 HydrophobicContact CB-CG1 4.21Å; L420-V437 WeakPolarHBondContact O-CG1 3.39Å; L420-I440 HydrophobicContact CD1-CG2 3.77Å; L420-I440 HydrophobicContact CD2-CD1 4.17Å; L420-F441 HydrophobicContact CB-CE1 3.8Å; L420-F441 HydrophobicContact CB-CZ 3.63Å; L420-F441 HydrophobicContact CD1-CD1 4.42Å; L420-F441 HydrophobicContact CD1-CE1 3.88Å
421G88.7Confident86.4Confident0 Ų029.7 Ų29.70%015%0.145CC..Hα-helixtrans-60.8-46.3175.600000112.6I417 I423 G424 V425I417-G421 PolarHBondContact O-N 2.92Å; G421-I423 PolarHBondContact O-N 3.37Å; G421-G424 WeakPolarHBondContact O-CA 3.4Å; G421-G424 PolarHBondContact O-N 3.15Å; G421-G424 VanDerWaalsContact O-N 3.14Å; G421-V425 WeakPolarHBondContact O-CG2 3.29Å; G421-V425 PolarHBondContact O-N 3.07Å
422G86.7Confident86.3Confident16 Ų1633.4 Ų33.417%0.16518%0.175CC..Hα-helixtrans-62.5-39.4176.500000113.7F418 T419 G424 V425 W426F418-G422 PolarHBondContact O-N 2.97Å; T419-G422 PolarHBondContact O-N 2.94Å; G422-G424 VanDerWaalsContact C-N 3.35Å; G422-V425 PolarHBondContact O-N 3.45Å; G422-W426 VanDerWaalsContact O-CB 3.32Å; G422-W426 WeakPolarHBondContact O-CB 3.34Å; G422-W426 PolarHBondContact O-N 3.19Å
423I88.5Confident86.4Confident0 Ų033.6 Ų33.60%018%0.176CC..Hα-helixtrans-61.6-46.1171.8-69.8166.8000109.7L377 L392 I395 T419 L420 G421 V425 W426 F427 I433L377-I423 HydrophobicContact CD1-CD1 3.93Å; L377-I423 HydrophobicContact CD1-CG1 4.02Å; L392-I423 HydrophobicContact CD2-CD1 4.25Å; L392-I423 HydrophobicContact CD2-CG2 4.22Å; I395-I423 HydrophobicContact CD1-CD1 4.06Å; T419-I423 HydrophobicContact CG2-CD1 4.02Å; T419-I423 WeakPolarHBondContact O-CB 3.18Å; T419-I423 VanDerWaalsContact O-CG1 3.23Å; T419-I423 WeakPolarHBondContact O-CG1 3.48Å; T419-I423 PolarHBondContact O-N 3.17Å; L420-I423 PolarHBondContact O-N 2.94Å; G421-I423 PolarHBondContact O-N 3.37Å; I423-V425 PolarHBondContact O-N 3.07Å; I423-W426 PolarHBondContact O-N 2.99Å; I423-F427 HydrophobicContact CG2-CD2 3.93Å; I423-F427 HydrophobicContact CG2-CE2 4.37Å; I423-F427 WeakPolarHBondContact O-CD2 3.48Å; I423-F427 PolarHBondContact O-N 2.85Å; I423-F427 VanDerWaalsContact O-N 3.09Å; I423-I433 HydrophobicContact CG2-CG2 3.77Å
424G87.8Confident86.6Confident0 Ų032.8 Ų32.80%017%0.172CC..Hα-helixtrans-56.4-45.6176.400000113.5L420 G421 G422 C468L420-G424 PolarHBondContact O-N 3.42Å; G421-G424 WeakPolarHBondContact O-CA 3.4Å; G421-G424 PolarHBondContact O-N 3.15Å; G421-G424 VanDerWaalsContact O-N 3.14Å; G422-G424 VanDerWaalsContact C-N 3.35Å; G424-C468 PolarHBondContact O-SG 3.42Å
425V87.5Confident86.6Confident49 Ų4933.2 Ų33.230%0.29718%0.179SC..Hα-helixtrans-66.7-45.5178.1165.50000112G421 G422 I423 E462 M463 A466G421-V425 WeakPolarHBondContact O-CG2 3.29Å; G421-V425 PolarHBondContact O-N 3.07Å; G422-V425 PolarHBondContact O-N 3.45Å; I423-V425 PolarHBondContact O-N 3.07Å; V425-E462 HydrophobicContact CG2-CB 4.3Å; V425-M463 HydrophobicContact CG2-CG 4.02Å; V425-A466 HydrophobicContact CB-CB 4.12Å; V425-A466 HydrophobicContact CG1-CB 3.7Å; V425-A466 HydrophobicContact CG2-CB 3.99Å
426W84Confident86.6Confident85 Ų8534.4 Ų34.432%0.32219%0.189SC..Hα-helixtrans-70.4-34.1-173.8-162.7-81000113.1N371 C374 R375 G422 I423N371-W426 HydrophobicContact CB-CH2 4.35Å; N371-W426 HydrophobicContact CB-CZ3 3.99Å; N371-W426 WeakPolarHBondContact OD1-CZ3 3.45Å; C374-W426 HydrophobicContact CB-CB 3.85Å; C374-W426 HydrophobicContact CB-CD2 3.73Å; C374-W426 HydrophobicContact CB-CE3 4.35Å; C374-W426 HydrophobicContact CB-CG 3.47Å; C374-W426 VanDerWaalsContact CB-CG 3.47Å; R375-W426 HydrophobicContact CG-CH2 4.43Å; R375-W426 HydrophobicContact CG-CZ2 3.8Å; G422-W426 VanDerWaalsContact O-CB 3.32Å; G422-W426 WeakPolarHBondContact O-CB 3.34Å; G422-W426 PolarHBondContact O-N 3.19Å; I423-W426 PolarHBondContact O-N 2.99Å
427F87.1Confident86.6Confident2 Ų234.4 Ų34.41%0.00919%0.189CC..THydrogen-bonded Turntrans-101.335.4179.5-67-77.6000112.7C374 L377 R378 L381 I423 E429 L430 I433C374-F427 HydrophobicContact CB-CE2 4.27Å; C374-F427 WeakPolarHBondContact O-CZ 3.41Å; L377-F427 HydrophobicContact CB-CE2 3.97Å; L377-F427 HydrophobicContact CB-CZ 3.72Å; L377-F427 HydrophobicContact CD1-CE2 4.32Å; R378-F427 HydrophobicContact CB-CE1 3.74Å; R378-F427 HydrophobicContact CB-CZ 3.87Å; R378-F427 HydrophobicContact CG-CE1 4.15Å; L381-F427 HydrophobicContact CD1-CD1 4.43Å; L381-F427 HydrophobicContact CD1-CE1 3.75Å; L381-F427 HydrophobicContact CD1-CZ 4.33Å; I423-F427 HydrophobicContact CG2-CD2 3.93Å; I423-F427 HydrophobicContact CG2-CE2 4.37Å; I423-F427 WeakPolarHBondContact O-CD2 3.48Å; I423-F427 PolarHBondContact O-N 2.85Å; I423-F427 VanDerWaalsContact O-N 3.09Å; F427-E429 PolarHBondContact O-N 2.96Å; F427-L430 HydrophobicContact CD1-CD1 3.96Å; F427-L430 PolarHBondContact O-N 3.06Å; F427-I433 HydrophobicContact CB-CB 4.42Å; F427-I433 HydrophobicContact CB-CD1 3.82Å; F427-I433 HydrophobicContact CB-CG2 4.19Å; F427-I433 HydrophobicContact CD1-CD1 4.16Å; F427-I433 HydrophobicContact CD2-CD1 4.48Å; F427-I433 HydrophobicContact CG-CD1 3.92Å
428R81.8Confident86.6Confident145 Ų14534.8 Ų34.855%0.54719%0.191SC..THydrogen-bonded Turntrans-53.7-28.1179.961.9177.6-180-176.6-0.6114.2L430 A466R428-L430 VanDerWaalsContact C-N 3.26Å; R428-L430 PolarHBondContact O-N 2.96Å; R428-A466 WeakPolarHBondContact CD-O 3.48Å; R428-A466 PolarHBondContact NH1-O 3.05Å
429E80.6Confident86.6Confident89 Ų8938.7 Ų38.742%0.41621%0.21SC..THydrogen-bonded Turntrans-76.1-7.2177.267.3-72.6165.500114.6R378 F427 P431R378-E429 IonicContact CZ-OE1 3.36Å; R378-E429 IonicContact NE-OE1 2.75Å; R378-E429 VanDerWaalsContact NH2-CD 3.26Å; R378-E429 IonicContact NH2-OE1 2.78Å; R378-E429 PolarHBondContact NH2-OE1 2.93Å; R378-E429 IonicContact NH2-OE2 3.08Å; F427-E429 PolarHBondContact O-N 2.96Å; E429-P431 WeakPolarHBondContact O-CD 3.43Å
430L84.2Confident86.6Confident67 Ų6739.5 Ų39.535%0.35121%0.214SC..  trans-11690.1-179.9-65.4177.9000110.5L381 F427 R428 A432 I433L381-L430 HydrophobicContact CD1-CD1 4.31Å; F427-L430 HydrophobicContact CD1-CD1 3.96Å; F427-L430 PolarHBondContact O-N 3.06Å; R428-L430 VanDerWaalsContact C-N 3.26Å; R428-L430 PolarHBondContact O-N 2.96Å; L430-A432 PolarHBondContact O-N 3.06Å; L430-I433 HydrophobicContact CB-CD1 3.79Å; L430-I433 HydrophobicContact CB-CG1 4.2Å; L430-I433 HydrophobicContact CD1-CD1 3.54Å; L430-I433 HydrophobicContact CG-CD1 4.31Å; L430-I433 PolarHBondContact O-N 3.44Å
431P82.6Confident86.6Confident72 Ų7239.5 Ų39.547%0.46821%0.214SC..Hα-helixtrans-58.2-27.1-174.4-25.733.8000114.8E429 I433 S434 S435 N470E429-P431 WeakPolarHBondContact O-CD 3.43Å; P431-I433 VanDerWaalsContact C-N 3.3Å; P431-I433 PolarHBondContact O-N 2.91Å; P431-S434 PolarHBondContact O-OG 3.22Å; P431-S435 WeakPolarHBondContact O-CB 3.39Å; P431-S435 PolarHBondContact O-N 3.29Å; P431-S435 PolarHBondContact O-OG 3Å; P431-N470 HydrophobicContact CB-CB 4.25Å; P431-N470 PolarHBondContact O-ND2 3.27Å
432A82.5Confident86.6Confident78 Ų7843.4 Ų43.465%0.64523%0.232SC*.Hα-helixtrans-62.4-37.9177.300000112L430 A436L430-A432 PolarHBondContact O-N 3.06Å; A432-A436 WeakPolarHBondContact O-CB 2.94Å; A432-A436 PolarHBondContact O-N 3.42Å
433I85.1Confident86.5Confident10 Ų1048.2 Ų48.25%0.05125%0.25CS..Hα-helixtrans-73.1-48.1-177.5-63.7171.9000110.3V388 L392 I423 F427 L430 P431 S435 A436 V437V388-I433 HydrophobicContact CB-CD1 4.43Å; V388-I433 HydrophobicContact CG1-CD1 3.84Å; V388-I433 HydrophobicContact CG1-CG1 3.98Å; V388-I433 HydrophobicContact CG1-CG2 4.2Å; V388-I433 HydrophobicContact CG2-CD1 4.33Å; L392-I433 HydrophobicContact CD1-CG2 4.49Å; I423-I433 HydrophobicContact CG2-CG2 3.77Å; F427-I433 HydrophobicContact CB-CB 4.42Å; F427-I433 HydrophobicContact CB-CD1 3.82Å; F427-I433 HydrophobicContact CB-CG2 4.19Å; F427-I433 HydrophobicContact CD1-CD1 4.16Å; F427-I433 HydrophobicContact CD2-CD1 4.48Å; F427-I433 HydrophobicContact CG-CD1 3.92Å; L430-I433 HydrophobicContact CB-CD1 3.79Å; L430-I433 HydrophobicContact CB-CG1 4.2Å; L430-I433 HydrophobicContact CD1-CD1 3.54Å; L430-I433 HydrophobicContact CG-CD1 4.31Å; L430-I433 PolarHBondContact O-N 3.44Å; P431-I433 VanDerWaalsContact C-N 3.3Å; P431-I433 PolarHBondContact O-N 2.91Å; I433-S435 VanDerWaalsContact C-N 3.29Å; I433-S435 PolarHBondContact O-N 2.91Å; I433-A436 PolarHBondContact O-N 3.12Å; I433-A436 VanDerWaalsContact O-N 3.17Å; I433-V437 WeakPolarHBondContact O-CG2 3.49Å; I433-V437 PolarHBondContact O-N 3.38Å
434S87.8Confident86.3Confident0 Ų049.4 Ų49.40%026%0.256CS..Hα-helixtrans-63.5-35.8178.256.50000112P431 M438 N470P431-S434 PolarHBondContact O-OG 3.22Å; S434-M438 WeakPolarHBondContact O-CB 3.33Å; S434-M438 PolarHBondContact O-N 3.26Å; S434-N470 PolarHBondContact OG-ND2 3.36Å; S434-N470 PolarHBondContact OG-OD1 2.93Å
435S87.8Confident86.2Confident48 Ų4850.1 Ų50.134%0.33626%0.259SS..Hα-helixtrans-64.9-42171.9-66.40000112.7P431 I433 M438 Q439 N470P431-S435 WeakPolarHBondContact O-CB 3.39Å; P431-S435 PolarHBondContact O-N 3.29Å; P431-S435 PolarHBondContact O-OG 3Å; I433-S435 VanDerWaalsContact C-N 3.29Å; I433-S435 PolarHBondContact O-N 2.91Å; S435-M438 PolarHBondContact O-N 3.09Å; S435-Q439 WeakPolarHBondContact O-CG 3.39Å; S435-Q439 PolarHBondContact O-N 3.31Å; S435-N470 PolarHBondContact OG-ND2 3.08Å
436A87.2Confident85.8Confident26 Ų2648.3 Ų48.322%0.21525%0.248CC..Hα-helixtrans-64.8-43.6177.200000111.8L392 A432 I433 M438 Q439 I440L392-A436 HydrophobicContact CD1-CB 4.02Å; A432-A436 WeakPolarHBondContact O-CB 2.94Å; A432-A436 PolarHBondContact O-N 3.42Å; I433-A436 PolarHBondContact O-N 3.12Å; I433-A436 VanDerWaalsContact O-N 3.17Å; A436-M438 VanDerWaalsContact C-N 3.34Å; A436-M438 PolarHBondContact O-N 3.21Å; A436-Q439 PolarHBondContact O-N 3.38Å; A436-I440 WeakPolarHBondContact O-CG1 3.09Å; A436-I440 PolarHBondContact O-N 3.07Å
437V90.5Very high85.4Confident0 Ų049.3 Ų49.30%026%0.26CS..Hα-helixtrans-60.3-44.5174.21710000111L392 L420 I433 Q439 I440 F441 M463L392-V437 HydrophobicContact CD2-CG2 3.85Å; L420-V437 HydrophobicContact CB-CG1 4.21Å; L420-V437 WeakPolarHBondContact O-CG1 3.39Å; I433-V437 WeakPolarHBondContact O-CG2 3.49Å; I433-V437 PolarHBondContact O-N 3.38Å; V437-Q439 VanDerWaalsContact C-N 3.35Å; V437-Q439 PolarHBondContact O-N 3.32Å; V437-I440 PolarHBondContact O-N 3.36Å; V437-F441 HydrophobicContact CG1-CD2 3.83Å; V437-F441 HydrophobicContact CG1-CE2 3.55Å; V437-F441 HydrophobicContact CG1-CZ 4.14Å; V437-F441 PolarHBondContact O-N 3.28Å; V437-M463 HydrophobicContact CB-CE 4.16Å; V437-M463 HydrophobicContact CG1-CE 3.92Å; V437-M463 HydrophobicContact CG1-SD 3.92Å
438M88.8Confident84.8Confident7 Ų754 Ų543%0.03429%0.29CS..Hα-helixtrans-58.8-44.3175.7-178.863.517900111.9S434 S435 A436 I440 F441 Q442 L460 I471 E474 V475 M478S434-M438 WeakPolarHBondContact O-CB 3.33Å; S434-M438 PolarHBondContact O-N 3.26Å; S435-M438 PolarHBondContact O-N 3.09Å; A436-M438 VanDerWaalsContact C-N 3.34Å; A436-M438 PolarHBondContact O-N 3.21Å; M438-I440 PolarHBondContact O-N 2.95Å; M438-F441 PolarHBondContact O-N 3.45Å; M438-Q442 HydrophobicContact CE-CG 3.91Å; M438-Q442 HydrophobicContact CG-CG 4.47Å; M438-Q442 WeakPolarHBondContact O-CB 3.49Å; M438-Q442 WeakPolarHBondContact O-CG 3.41Å; M438-Q442 PolarHBondContact O-N 2.88Å; M438-Q442 HydrophobicContact SD-CG 4.38Å; M438-L460 HydrophobicContact SD-CD1 4.11Å; M438-L460 HydrophobicContact SD-CD2 3.39Å; M438-L460 WeakPolarHBondContact SD-CD2 3.29Å; M438-L460 HydrophobicContact SD-CG 4.4Å; M438-I471 HydrophobicContact CB-CG2 3.97Å; M438-I471 HydrophobicContact CG-CG2 4.35Å; M438-E474 HydrophobicContact CE-CB 4.06Å; M438-V475 HydrophobicContact CE-CB 4.4Å; M438-V475 HydrophobicContact CE-CG2 3.63Å; M438-V475 HydrophobicContact SD-CG2 3.7Å; M438-M478 HydrophobicContact CE-SD 4.4Å
439Q89.2Confident84.3Confident118 Ų11849.9 Ų49.955%0.55129%0.288SS*.Hα-helixtrans-62.2-42.3177-75.2179.4-3.100112.3S435 A436 V437 Q442 Q443S435-Q439 WeakPolarHBondContact O-CG 3.39Å; S435-Q439 PolarHBondContact O-N 3.31Å; A436-Q439 PolarHBondContact O-N 3.38Å; V437-Q439 VanDerWaalsContact C-N 3.35Å; V437-Q439 PolarHBondContact O-N 3.32Å; Q439-Q442 PolarHBondContact O-N 3.05Å; Q439-Q443 WeakPolarHBondContact O-CG 3.48Å; Q439-Q443 PolarHBondContact O-N 3.24Å
440I89.4Confident84.2Confident17 Ų1746.7 Ų46.79%0.08728%0.275CS..Hα-helixtrans-61.6-46.1176.6-65.8164000110.3L392 L399 L420 A436 V437 M438 Q443 K444L392-I440 HydrophobicContact CB-CD1 4.27Å; L399-I440 HydrophobicContact CD2-CG2 4.15Å; L420-I440 HydrophobicContact CD1-CG2 3.77Å; L420-I440 HydrophobicContact CD2-CD1 4.17Å; A436-I440 WeakPolarHBondContact O-CG1 3.09Å; A436-I440 PolarHBondContact O-N 3.07Å; V437-I440 PolarHBondContact O-N 3.36Å; M438-I440 PolarHBondContact O-N 2.95Å; I440-Q443 PolarHBondContact O-N 3.23Å; I440-K444 PolarHBondContact O-N 2.91Å; I440-K444 VanDerWaalsContact O-N 3.14Å
441F91.6Very high83.8Confident1 Ų149 Ų490%0.00429%0.294CS..Hα-helixtrans-63-43.2176.8-76.1-25000112.7I417 L420 V437 M438 Q443 K444 F445 I456 Q459 L460 M463I417-F441 HydrophobicContact CB-CE1 4.33Å; I417-F441 HydrophobicContact CG1-CE1 4.34Å; I417-F441 HydrophobicContact CG2-CE1 3.94Å; I417-F441 HydrophobicContact CG2-CZ 4.13Å; L420-F441 HydrophobicContact CB-CE1 3.8Å; L420-F441 HydrophobicContact CB-CZ 3.63Å; L420-F441 HydrophobicContact CD1-CD1 4.42Å; L420-F441 HydrophobicContact CD1-CE1 3.88Å; V437-F441 HydrophobicContact CG1-CD2 3.83Å; V437-F441 HydrophobicContact CG1-CE2 3.55Å; V437-F441 HydrophobicContact CG1-CZ 4.14Å; V437-F441 PolarHBondContact O-N 3.28Å; M438-F441 PolarHBondContact O-N 3.45Å; F441-Q443 VanDerWaalsContact C-N 3.35Å; F441-Q443 PolarHBondContact O-N 3.01Å; F441-K444 PolarHBondContact O-N 3.49Å; F441-F445 VanDerWaalsContact O-CB 3.31Å; F441-F445 WeakPolarHBondContact O-CB 3.37Å; F441-F445 PolarHBondContact O-N 2.96Å; F441-I456 HydrophobicContact CB-CG2 3.66Å; F441-I456 HydrophobicContact CD1-CD1 4.4Å; F441-I456 HydrophobicContact CD1-CG1 4.05Å; F441-I456 HydrophobicContact CD1-CG2 4.06Å; F441-I456 HydrophobicContact CD2-CG2 4.21Å; F441-I456 HydrophobicContact CE1-CG1 4.38Å; F441-I456 HydrophobicContact CG-CG2 3.74Å; F441-Q459 HydrophobicContact CE2-CB 4.12Å; F441-Q459 HydrophobicContact CZ-CB 4.21Å; F441-L460 HydrophobicContact CD2-CD2 3.75Å; F441-L460 HydrophobicContact CD2-CG 4.08Å; F441-L460 HydrophobicContact CE2-CD2 4.41Å; F441-M463 HydrophobicContact CE2-SD 4.33Å
442Q87.1Confident83.8Confident81 Ų8146.2 Ų46.238%0.37928%0.275SS..Hα-helixtrans-61.9-39.5176.8-77.8179.8-36.600112.9M438 Q439M438-Q442 HydrophobicContact CE-CG 3.91Å; M438-Q442 HydrophobicContact CG-CG 4.47Å; M438-Q442 WeakPolarHBondContact O-CB 3.49Å; M438-Q442 WeakPolarHBondContact O-CG 3.41Å; M438-Q442 PolarHBondContact O-N 2.88Å; M438-Q442 HydrophobicContact SD-CG 4.38Å; Q439-Q442 PolarHBondContact O-N 3.05Å
443Q85.7Confident84.1Confident117 Ų11742.5 Ų42.555%0.54725%0.245SC..Hα-helixtrans-68.2-35.5178.1-72.4175.3-3.100112.2Y400 Q439 I440 F441 N447Y400-Q443 VanDerWaalsContact OH-C 3.31Å; Y400-Q443 WeakPolarHBondContact OH-CB 3.5Å; Q439-Q443 WeakPolarHBondContact O-CG 3.48Å; Q439-Q443 PolarHBondContact O-N 3.24Å; I440-Q443 PolarHBondContact O-N 3.23Å; F441-Q443 VanDerWaalsContact C-N 3.35Å; F441-Q443 PolarHBondContact O-N 3.01Å; Q443-N447 PolarHBondContact O-ND2 2.87Å
444K84.5Confident84.2Confident25 Ų2543.7 Ų43.711%0.10926%0.256CS..Hα-helixtrans-80.1-34.1-179.4-177.159-177.8169.60113.3L399 Y400 I440 F441 S446 N447 I456L399-K444 HydrophobicContact CD2-CB 4.13Å; L399-K444 HydrophobicContact CD2-CD 4.47Å; L399-K444 HydrophobicContact CD2-CG 3.95Å; L399-K444 HydrophobicContact CG-CD 4.31Å; L399-K444 HydrophobicContact CG-CG 4.21Å; Y400-K444 HydrophobicContact CD1-CD 4.41Å; Y400-K444 HydrophobicContact CE1-CD 3.96Å; Y400-K444 PolarHBondContact OH-N 3.11Å; I440-K444 PolarHBondContact O-N 2.91Å; I440-K444 VanDerWaalsContact O-N 3.14Å; F441-K444 PolarHBondContact O-N 3.49Å; K444-S446 PolarHBondContact O-N 2.87Å; K444-N447 PolarHBondContact NZ-O 3.28Å; K444-N447 PolarHBondContact O-N 3.45Å; K444-N447 VanDerWaalsContact O-N 3.09Å; K444-I456 HydrophobicContact CB-CD1 4.44Å; K444-I456 HydrophobicContact CG-CD1 4.25Å
445F85.5Confident84.2Confident16 Ų1645.5 Ų45.57%0.0727%0.265CS..THydrogen-bonded Turntrans-56.6125.8-175.4-169.7-98.1000111.4F441 N447 D453 I456 V457 I482 Y500 A503F441-F445 VanDerWaalsContact O-CB 3.31Å; F441-F445 WeakPolarHBondContact O-CB 3.37Å; F441-F445 PolarHBondContact O-N 2.96Å; F445-N447 PolarHBondContact O-N 3.36Å; F445-D453 HydrophobicContact CD2-CB 3.87Å; F445-D453 HydrophobicContact CE2-CB 3.59Å; F445-D453 HydrophobicContact CZ-CB 4.35Å; F445-I456 HydrophobicContact CD2-CB 4.47Å; F445-I456 HydrophobicContact CD2-CG2 4.28Å; F445-V457 HydrophobicContact CE2-CG2 3.81Å; F445-V457 HydrophobicContact CZ-CG2 4.37Å; F445-I482 HydrophobicContact CE1-CD1 3.69Å; F445-I482 HydrophobicContact CE1-CG1 3.96Å; F445-I482 HydrophobicContact CE2-CD1 4.26Å; F445-I482 HydrophobicContact CZ-CD1 3.37Å; F445-I482 HydrophobicContact CZ-CG1 3.98Å; F445-Y500 HydrophobicContact CD1-CD1 4.43Å; F445-Y500 AromaticContact CD1-CE1 3.97Å; F445-Y500 HydrophobicContact CD1-CE1 3.97Å; F445-Y500 AromaticContact CE1-CD1 3.56Å; F445-Y500 HydrophobicContact CE1-CD1 3.56Å; F445-Y500 AromaticContact CE1-CE1 3.5Å; F445-Y500 HydrophobicContact CE1-CE1 3.5Å; F445-Y500 VanDerWaalsContact CE1-CE1 3.5Å; F445-Y500 HydrophobicContact CZ-CD1 4.27Å; F445-A503 HydrophobicContact CE2-CB 4.28Å; F445-A503 HydrophobicContact CZ-CB 3.87Å
446S79.5Confident84.2Confident10 Ų1043.2 Ų43.27%0.0725%0.249CC..THydrogen-bonded Turntrans61.314.2-176.9-670000117.2K444 P448 A449 D453 Y500K444-S446 PolarHBondContact O-N 2.87Å; S446-P448 CarbonylContact O-C 3.55Å; S446-P448 WeakPolarHBondContact O-CA 3.35Å; S446-A449 PolarHBondContact O-N 3.49Å; S446-D453 PolarHBondContact N-OD1 2.92Å; S446-Y500 VanDerWaalsContact OG-CD1 3.3Å; S446-Y500 WeakPolarHBondContact OG-CD1 3.31Å; S446-Y500 WeakPolarHBondContact OG-CE1 3.38Å
447N75.1Confident84.4Confident107 Ų10742 Ų4257%0.57224%0.239SC*.THydrogen-bonded Turntrans-121.382.9177.2-73.9-36.7000112.7Q443 K444 F445Q443-N447 PolarHBondContact O-ND2 2.87Å; K444-N447 PolarHBondContact NZ-O 3.28Å; K444-N447 PolarHBondContact O-N 3.45Å; K444-N447 VanDerWaalsContact O-N 3.09Å; F445-N447 PolarHBondContact O-N 3.36Å
448P74.2Confident84.3Confident99 Ų9945.5 Ų45.564%0.64326%0.255SS*.THydrogen-bonded Turncis-80.1164.1-13.533.8-34.3000112.3S446 S450S446-P448 CarbonylContact O-C 3.55Å; S446-P448 WeakPolarHBondContact O-CA 3.35Å; P448-S450 PolarHBondContact O-N 3.3Å
449A71.6Confident84.4Confident60 Ų6045.9 Ų45.950%0.49626%0.257SS..  trans-52.9122.9174.100000111.5S446S446-A449 PolarHBondContact O-N 3.49Å
450S78Confident84.5Confident22 Ų2240.3 Ų40.315%0.15423%0.231CC..  trans-147.8158.8-172.376.60000112P448 L452 D453 H502P448-S450 PolarHBondContact O-N 3.3Å; S450-L452 PolarHBondContact O-N 3.38Å; S450-L452 WeakPolarHBondContact OG-CB 3.35Å; S450-L452 PolarHBondContact OG-N 3.28Å; S450-D453 PolarHBondContact N-OD2 2.93Å; S450-D453 VanDerWaalsContact O-CB 3.29Å; S450-D453 WeakPolarHBondContact O-CB 3.46Å; S450-D453 PolarHBondContact O-N 3.24Å; S450-D453 VanDerWaalsContact O-OD2 3.14Å; S450-H502 PolarHBondContact O-CD2 3.41Å
451P76.7Confident84.5Confident115 Ų11539.5 Ų39.575%0.74723%0.227SC*.THydrogen-bonded Turntrans-60.8-14.8174.223-32.4000113.7D453 A454P451-D453 PolarHBondContact O-N 3.09Å; P451-A454 PolarHBondContact O-N 3.45Å
452L82.8Confident84.3Confident13 Ų1342.5 Ų42.57%0.06824%0.241CC..Hα-helixtrans-67.7-24174.2-59.6168.7000112.6L413 E414 I417 S450 A454 L455 I456L413-L452 HydrophobicContact CB-CD1 3.63Å; L413-L452 HydrophobicContact CB-CD2 4.18Å; L413-L452 HydrophobicContact CD1-CD1 3.72Å; L413-L452 HydrophobicContact CG-CD1 4.18Å; E414-L452 HydrophobicContact CG-CD2 3.84Å; I417-L452 HydrophobicContact CD1-CB 3.74Å; I417-L452 HydrophobicContact CD1-CD2 4.17Å; I417-L452 HydrophobicContact CD1-CG 4.36Å; S450-L452 PolarHBondContact O-N 3.38Å; S450-L452 WeakPolarHBondContact OG-CB 3.35Å; S450-L452 PolarHBondContact OG-N 3.28Å; L452-A454 PolarHBondContact O-N 3.3Å; L452-L455 HydrophobicContact CD2-CD1 4.21Å; L452-L455 WeakPolarHBondContact O-CA 3.39Å; L452-L455 WeakPolarHBondContact O-CB 3.25Å; L452-L455 PolarHBondContact O-N 3.25Å; L452-I456 PolarHBondContact O-N 3.14Å; L452-I456 VanDerWaalsContact O-N 3.07Å
453D87.8Confident84.5Confident1 Ų138.6 Ų38.61%0.00522%0.223CC..Hα-helixtrans-59.3-32.5177.9-67.4-31.8000111.4F445 S446 S450 P451 L455 I456 V457 H502 A503F445-D453 HydrophobicContact CD2-CB 3.87Å; F445-D453 HydrophobicContact CE2-CB 3.59Å; F445-D453 HydrophobicContact CZ-CB 4.35Å; S446-D453 PolarHBondContact N-OD1 2.92Å; S450-D453 PolarHBondContact N-OD2 2.93Å; S450-D453 VanDerWaalsContact O-CB 3.29Å; S450-D453 WeakPolarHBondContact O-CB 3.46Å; S450-D453 PolarHBondContact O-N 3.24Å; S450-D453 VanDerWaalsContact O-OD2 3.14Å; P451-D453 PolarHBondContact O-N 3.09Å; D453-L455 VanDerWaalsContact C-N 3.35Å; D453-L455 PolarHBondContact O-N 3.42Å; D453-I456 PolarHBondContact O-N 3.47Å; D453-V457 WeakPolarHBondContact O-CG2 3.39Å; D453-V457 PolarHBondContact O-N 2.86Å; D453-H502 IonicContact OD2-CD2 2.79Å; D453-H502 PolarHBondContact OD2-CD2 3.33Å; D453-H502 IonicContact OD2-CE1 3.29Å; D453-H502 IonicContact OD2-NE2 3.95Å; D453-H502 PolarHBondContact OD2-NE2 3.39Å; D453-A503 HydrophobicContact CB-CB 4.4Å
454A87.2Confident84.5Confident34 Ų3433.8 Ų33.828%0.28120%0.201SC..Hα-helixtrans-64.4-37.7173.500000112.6P451 L452 V457 H458 A506P451-A454 PolarHBondContact O-N 3.45Å; L452-A454 PolarHBondContact O-N 3.3Å; A454-V457 PolarHBondContact O-N 3.23Å; A454-H458 PolarHBondContact O-N 3.07Å; A454-A506 HydrophobicContact CB-CB 3.59Å
455L87.2Confident84.6Confident39 Ų3935 Ų3520%0.20421%0.208CC..Hα-helixtrans-69.7-39.5176.4-65.3176.1000111.3E414 I417 F418 L452 D453 V457 H458 Q459E414-L455 HydrophobicContact CB-CD1 4.29Å; E414-L455 HydrophobicContact CG-CD1 3.69Å; I417-L455 HydrophobicContact CG2-CB 4.03Å; F418-L455 HydrophobicContact CE2-CD1 4.24Å; F418-L455 HydrophobicContact CE2-CD2 4.29Å; F418-L455 HydrophobicContact CZ-CD2 3.78Å; L452-L455 HydrophobicContact CD2-CD1 4.21Å; L452-L455 WeakPolarHBondContact O-CA 3.39Å; L452-L455 WeakPolarHBondContact O-CB 3.25Å; L452-L455 PolarHBondContact O-N 3.25Å; D453-L455 VanDerWaalsContact C-N 3.35Å; D453-L455 PolarHBondContact O-N 3.42Å; L455-V457 VanDerWaalsContact C-N 3.34Å; L455-V457 PolarHBondContact O-N 3.41Å; L455-H458 PolarHBondContact O-N 3.41Å; L455-Q459 WeakPolarHBondContact O-CG 3.48Å; L455-Q459 PolarHBondContact O-N 3.01Å
456I89.6Confident84.5Confident0 Ų035 Ų350%021%0.211CC..Hα-helixtrans-58.6-48.7174.4-65.8174.7000110I417 F441 K444 F445 L452 D453 H458 Q459 L460I417-I456 HydrophobicContact CD1-CD1 4.36Å; I417-I456 HydrophobicContact CD1-CG1 3.93Å; I417-I456 HydrophobicContact CG1-CG1 4.16Å; I417-I456 HydrophobicContact CG2-CG1 4.03Å; F441-I456 HydrophobicContact CB-CG2 3.66Å; F441-I456 HydrophobicContact CD1-CD1 4.4Å; F441-I456 HydrophobicContact CD1-CG1 4.05Å; F441-I456 HydrophobicContact CD1-CG2 4.06Å; F441-I456 HydrophobicContact CD2-CG2 4.21Å; F441-I456 HydrophobicContact CE1-CG1 4.38Å; F441-I456 HydrophobicContact CG-CG2 3.74Å; K444-I456 HydrophobicContact CB-CD1 4.44Å; K444-I456 HydrophobicContact CG-CD1 4.25Å; F445-I456 HydrophobicContact CD2-CB 4.47Å; F445-I456 HydrophobicContact CD2-CG2 4.28Å; L452-I456 PolarHBondContact O-N 3.14Å; L452-I456 VanDerWaalsContact O-N 3.07Å; D453-I456 PolarHBondContact O-N 3.47Å; I456-H458 VanDerWaalsContact C-N 3.29Å; I456-H458 PolarHBondContact O-N 2.7Å; I456-Q459 PolarHBondContact O-N 3.41Å; I456-L460 HydrophobicContact CG2-CD1 4.05Å; I456-L460 HydrophobicContact CG2-CG 4.44Å; I456-L460 WeakPolarHBondContact O-CG 3.21Å; I456-L460 PolarHBondContact O-N 3.2Å
457V90.2Very high84.6Confident0 Ų036.2 Ų36.20%023%0.225CC..Hα-helixtrans-58.5-41177.1165.50000111.9F445 D453 A454 L455 S461 M478 F479 I482 A506 V507 S510F445-V457 HydrophobicContact CE2-CG2 3.81Å; F445-V457 HydrophobicContact CZ-CG2 4.37Å; D453-V457 WeakPolarHBondContact O-CG2 3.39Å; D453-V457 PolarHBondContact O-N 2.86Å; A454-V457 PolarHBondContact O-N 3.23Å; L455-V457 VanDerWaalsContact C-N 3.34Å; L455-V457 PolarHBondContact O-N 3.41Å; V457-S461 PolarHBondContact O-N 3.25Å; V457-M478 HydrophobicContact CG2-CE 4.48Å; V457-F479 HydrophobicContact CB-CE1 4.28Å; V457-F479 HydrophobicContact CG1-CE1 3.83Å; V457-F479 HydrophobicContact CG1-CZ 3.88Å; V457-F479 HydrophobicContact CG2-CE1 4.15Å; V457-I482 HydrophobicContact CG2-CD1 4.48Å; V457-A506 HydrophobicContact CB-CB 4.27Å; V457-A506 HydrophobicContact CG1-CB 4.04Å; V457-V507 HydrophobicContact CG1-CB 4.36Å; V457-V507 HydrophobicContact CG1-CG2 3.74Å; V457-V507 HydrophobicContact CG2-CG2 3.96Å; V457-S510 WeakPolarHBondContact CG1-OG 3.37Å; V457-S510 PolarHBondContact O-OG 3.45Å
458H88.7Confident85Confident74 Ų7431.1 Ų31.134%0.34320%0.198SC..Hα-helixtrans-66.4-47.2176.1-177.951000111.8A454 L455 I456 L460 S461 E462A454-H458 PolarHBondContact O-N 3.07Å; L455-H458 PolarHBondContact O-N 3.41Å; I456-H458 VanDerWaalsContact C-N 3.29Å; I456-H458 PolarHBondContact O-N 2.7Å; H458-L460 VanDerWaalsContact C-N 3.32Å; H458-L460 PolarHBondContact O-N 3.48Å; H458-S461 WeakPolarHBondContact O-CB 3.16Å; H458-S461 PolarHBondContact O-N 3.04Å; H458-S461 PolarHBondContact O-OG 3.5Å; H458-E462 IonicContact CE1-OE1 3.72Å; H458-E462 PolarHBondContact CE1-OE1 3.24Å; H458-E462 PolarHBondContact O-N 3.03Å
459Q91.3Very high85.2Confident15 Ų1531.3 Ų31.37%0.0720%0.197CC..Hα-helixtrans-62.3-37.2178.7-67.9-50.8-70.100112.8I417 F418 F441 L455 I456 S461 E462 M463I417-Q459 HydrophobicContact CG2-CG 3.95Å; F418-Q459 HydrophobicContact CD1-CG 4.49Å; F441-Q459 HydrophobicContact CE2-CB 4.12Å; F441-Q459 HydrophobicContact CZ-CB 4.21Å; L455-Q459 WeakPolarHBondContact O-CG 3.48Å; L455-Q459 PolarHBondContact O-N 3.01Å; I456-Q459 PolarHBondContact O-N 3.41Å; Q459-S461 VanDerWaalsContact C-N 3.3Å; Q459-S461 PolarHBondContact O-N 3.41Å; Q459-E462 PolarHBondContact O-N 2.72Å; Q459-M463 WeakPolarHBondContact O-CG 3.42Å; Q459-M463 PolarHBondContact O-N 2.96Å
460L90.7Very high85.8Confident0 Ų031.5 Ų31.50%019%0.19CC..Hα-helixtrans-63.6-36.1173.3-71.5174.7000112.5M438 F441 I456 H458 M463 I464 V475 M478 F479M438-L460 HydrophobicContact SD-CD1 4.11Å; M438-L460 HydrophobicContact SD-CD2 3.39Å; M438-L460 WeakPolarHBondContact SD-CD2 3.29Å; M438-L460 HydrophobicContact SD-CG 4.4Å; F441-L460 HydrophobicContact CD2-CD2 3.75Å; F441-L460 HydrophobicContact CD2-CG 4.08Å; F441-L460 HydrophobicContact CE2-CD2 4.41Å; I456-L460 HydrophobicContact CG2-CD1 4.05Å; I456-L460 HydrophobicContact CG2-CG 4.44Å; I456-L460 WeakPolarHBondContact O-CG 3.21Å; I456-L460 PolarHBondContact O-N 3.2Å; H458-L460 VanDerWaalsContact C-N 3.32Å; H458-L460 PolarHBondContact O-N 3.48Å; L460-M463 HydrophobicContact CD2-SD 4.14Å; L460-M463 PolarHBondContact O-N 3.18Å; L460-I464 WeakPolarHBondContact O-CG1 3.39Å; L460-I464 PolarHBondContact O-N 3.42Å; L460-V475 HydrophobicContact CB-CG1 4.02Å; L460-V475 HydrophobicContact CB-CG2 4.22Å; L460-V475 HydrophobicContact CD1-CG2 4.42Å; L460-V475 HydrophobicContact CD2-CG2 3.99Å; L460-V475 HydrophobicContact CG-CG2 4.45Å; L460-M478 HydrophobicContact CD1-CE 3.34Å; L460-M478 HydrophobicContact CD1-SD 4.29Å; L460-F479 HydrophobicContact CB-CZ 4.31Å
461S88.9Confident86.2Confident0 Ų030.6 Ų30.60%018%0.183CC..Hα-helixtrans-65.5-41.6174.177.70000112V457 H458 Q459 M463 I464 L465V457-S461 PolarHBondContact O-N 3.25Å; H458-S461 WeakPolarHBondContact O-CB 3.16Å; H458-S461 PolarHBondContact O-N 3.04Å; H458-S461 PolarHBondContact O-OG 3.5Å; Q459-S461 VanDerWaalsContact C-N 3.3Å; Q459-S461 PolarHBondContact O-N 3.41Å; S461-M463 PolarHBondContact O-N 3.37Å; S461-I464 WeakPolarHBondContact O-CB 3.3Å; S461-I464 PolarHBondContact O-N 3.04Å; S461-L465 WeakPolarHBondContact O-CG 3.35Å; S461-L465 PolarHBondContact O-N 2.94Å
462E88Confident86.6Confident64 Ų6426.5 Ų26.530%0.29915%0.153SC..Hα-helixtrans-64.8-39176.4-66.7-59.8129.600111.9V425 H458 Q459 I464 L465 A466 N513V425-E462 HydrophobicContact CG2-CB 4.3Å; H458-E462 IonicContact CE1-OE1 3.72Å; H458-E462 PolarHBondContact CE1-OE1 3.24Å; H458-E462 PolarHBondContact O-N 3.03Å; Q459-E462 PolarHBondContact O-N 2.72Å; E462-I464 VanDerWaalsContact C-N 3.31Å; E462-I464 PolarHBondContact O-N 3.49Å; E462-L465 PolarHBondContact O-N 3.03Å; E462-A466 WeakPolarHBondContact O-CB 3.34Å; E462-A466 PolarHBondContact O-N 2.9Å; E462-N513 PolarHBondContact OE1-ND2 3.34Å
463M90.8Very high86.8Confident0 Ų028.7 Ų28.70%017%0.169CC..Hα-helixtrans-62-37.5174.5-70.617271.800112.4V425 V437 F441 Q459 L460 S461 G467 C468 I471V425-M463 HydrophobicContact CG2-CG 4.02Å; V437-M463 HydrophobicContact CB-CE 4.16Å; V437-M463 HydrophobicContact CG1-CE 3.92Å; V437-M463 HydrophobicContact CG1-SD 3.92Å; F441-M463 HydrophobicContact CE2-SD 4.33Å; Q459-M463 WeakPolarHBondContact O-CG 3.42Å; Q459-M463 PolarHBondContact O-N 2.96Å; L460-M463 HydrophobicContact CD2-SD 4.14Å; L460-M463 PolarHBondContact O-N 3.18Å; S461-M463 PolarHBondContact O-N 3.37Å; M463-G467 PolarHBondContact O-N 3.18Å; M463-C468 HydrophobicContact CB-CB 4.49Å; M463-C468 VanDerWaalsContact O-CB 3.25Å; M463-C468 WeakPolarHBondContact O-CB 3.42Å; M463-C468 PolarHBondContact O-N 3.29Å; M463-C468 VanDerWaalsContact O-N 3.09Å; M463-C468 PolarHBondContact O-SG 3.5Å; M463-I471 HydrophobicContact CB-CD1 3.74Å; M463-I471 HydrophobicContact CE-CD1 3.59Å; M463-I471 HydrophobicContact SD-CD1 4.2Å
464I87.1Confident86.6Confident16 Ų1632.4 Ų32.48%0.08219%0.186CC..Hα-helixtrans-64.3-49.7173.4-69.7169.2000110.2L460 S461 E462 A466 G467 Y472 V475 L514L460-I464 WeakPolarHBondContact O-CG1 3.39Å; L460-I464 PolarHBondContact O-N 3.42Å; S461-I464 WeakPolarHBondContact O-CB 3.3Å; S461-I464 PolarHBondContact O-N 3.04Å; E462-I464 VanDerWaalsContact C-N 3.31Å; E462-I464 PolarHBondContact O-N 3.49Å; I464-A466 PolarHBondContact O-N 3.47Å; I464-G467 WeakPolarHBondContact O-CA 3.37Å; I464-G467 PolarHBondContact O-N 2.63Å; I464-Y472 HydrophobicContact CD1-CD2 4Å; I464-Y472 HydrophobicContact CG1-CD2 4.16Å; I464-Y472 HydrophobicContact CG2-CD2 3.69Å; I464-Y472 HydrophobicContact CG2-CE2 4.16Å; I464-V475 HydrophobicContact CD1-CB 3.87Å; I464-V475 HydrophobicContact CD1-CG1 3.57Å; I464-V475 HydrophobicContact CD1-CG2 4.42Å; I464-L514 HydrophobicContact CB-CD2 4Å; I464-L514 HydrophobicContact CD1-CD1 4.47Å; I464-L514 HydrophobicContact CD1-CD2 4.5Å; I464-L514 HydrophobicContact CG2-CD2 3.64Å
465L85.4Confident86.7Confident49 Ų4930.8 Ų30.826%0.25717%0.173SC..Hα-helixtrans-61.2-32.8-179.7-69.4176.2000112.5S461 E462 G467 L514 H517S461-L465 WeakPolarHBondContact O-CG 3.35Å; S461-L465 PolarHBondContact O-N 2.94Å; E462-L465 PolarHBondContact O-N 3.03Å; L465-G467 PolarHBondContact O-N 3.04Å; L465-L514 HydrophobicContact CD2-CD2 3.94Å; L465-L514 HydrophobicContact CG-CD2 4Å; L465-H517 HydrophobicContact CD1-CB 3.84Å; L465-H517 HydrophobicContact CD2-CB 3.63Å; L465-H517 HydrophobicContact CG-CB 4.36Å
466A84.7Confident86.8Confident16 Ų1629 Ų2913%0.13216%0.163CC..THydrogen-bonded Turntrans-68.1-18.617400000113.7V425 R428 E462 I464V425-A466 HydrophobicContact CB-CB 4.12Å; V425-A466 HydrophobicContact CG1-CB 3.7Å; V425-A466 HydrophobicContact CG2-CB 3.99Å; R428-A466 WeakPolarHBondContact CD-O 3.48Å; R428-A466 PolarHBondContact NH1-O 3.05Å; E462-A466 WeakPolarHBondContact O-CB 3.34Å; E462-A466 PolarHBondContact O-N 2.9Å; I464-A466 PolarHBondContact O-N 3.47Å
467G81Confident86.6Confident36 Ų3634.7 Ų34.737%0.37119%0.188SC..THydrogen-bonded Turntrans107.720.7177.200000115.5M463 I464 L465 V469M463-G467 PolarHBondContact O-N 3.18Å; I464-G467 WeakPolarHBondContact O-CA 3.37Å; I464-G467 PolarHBondContact O-N 2.63Å; L465-G467 PolarHBondContact O-N 3.04Å; G467-V469 VanDerWaalsContact C-N 3.31Å; G467-V469 WeakPolarHBondContact O-CG2 3.44Å; G467-V469 PolarHBondContact O-N 3.2Å
468C84.3Confident86.5Confident1 Ų135.9 Ų35.91%0.00719%0.194CC..  trans-75.677177.4-59.40000112G424 M463 N470 I471G424-C468 PolarHBondContact O-SG 3.42Å; M463-C468 HydrophobicContact CB-CB 4.49Å; M463-C468 VanDerWaalsContact O-CB 3.25Å; M463-C468 WeakPolarHBondContact O-CB 3.42Å; M463-C468 PolarHBondContact O-N 3.29Å; M463-C468 VanDerWaalsContact O-N 3.09Å; M463-C468 PolarHBondContact O-SG 3.5Å; C468-N470 VanDerWaalsContact C-N 3.27Å; C468-N470 PolarHBondContact O-N 3.48Å; C468-I471 HydrophobicContact CB-CD1 4.05Å; C468-I471 HydrophobicContact CB-CG1 3.84Å; C468-I471 WeakPolarHBondContact O-CG1 3.48Å; C468-I471 PolarHBondContact O-N 2.93Å
469V78.1Confident86.6Confident103 Ų10332.3 Ų32.362%0.62418%0.178SC*.Hα-helixtrans-64-29.6-172.1-166.60000113.2G467 I471 Y472G467-V469 VanDerWaalsContact C-N 3.31Å; G467-V469 WeakPolarHBondContact O-CG2 3.44Å; G467-V469 PolarHBondContact O-N 3.2Å; V469-I471 VanDerWaalsContact C-N 3.28Å; V469-I471 PolarHBondContact O-N 2.72Å; V469-Y472 WeakPolarHBondContact O-CB 3.44Å; V469-Y472 PolarHBondContact O-N 2.92Å
470N82.8Confident86.3Confident63 Ų6333.1 Ų33.134%0.33718%0.182SC..Hα-helixtrans-65.4-26.7-177.262-56.6000114P431 S434 S435 C468P431-N470 HydrophobicContact CB-CB 4.25Å; P431-N470 PolarHBondContact O-ND2 3.27Å; S434-N470 PolarHBondContact OG-ND2 3.36Å; S434-N470 PolarHBondContact OG-OD1 2.93Å; S435-N470 PolarHBondContact OG-ND2 3.08Å; C468-N470 VanDerWaalsContact C-N 3.27Å; C468-N470 PolarHBondContact O-N 3.48Å
471I87.1Confident86Confident4 Ų439.7 Ų39.72%0.02121%0.207CC..Hα-helixtrans-96.3-15.5179.263.4162.4000113M438 M463 C468 V469 C473 E474 V475M438-I471 HydrophobicContact CB-CG2 3.97Å; M438-I471 HydrophobicContact CG-CG2 4.35Å; M463-I471 HydrophobicContact CB-CD1 3.74Å; M463-I471 HydrophobicContact CE-CD1 3.59Å; M463-I471 HydrophobicContact SD-CD1 4.2Å; C468-I471 HydrophobicContact CB-CD1 4.05Å; C468-I471 HydrophobicContact CB-CG1 3.84Å; C468-I471 WeakPolarHBondContact O-CG1 3.48Å; C468-I471 PolarHBondContact O-N 2.93Å; V469-I471 VanDerWaalsContact C-N 3.28Å; V469-I471 PolarHBondContact O-N 2.72Å; I471-C473 VanDerWaalsContact C-N 3.34Å; I471-C473 PolarHBondContact O-N 3.22Å; I471-E474 PolarHBondContact O-N 3.36Å; I471-V475 HydrophobicContact CB-CG2 4.31Å; I471-V475 HydrophobicContact CD1-CG2 4.1Å; I471-V475 HydrophobicContact CG1-CG2 4.35Å; I471-V475 WeakPolarHBondContact O-CG2 3.25Å; I471-V475 PolarHBondContact O-N 3.02Å
472Y85.5Confident85.8Confident28 Ų2839.8 Ų39.811%0.1121%0.207CC..Hα-helixtrans-53.5-47.1-171173.2-101.2000112.7I464 V469 E474 V475 M476 D526I464-Y472 HydrophobicContact CD1-CD2 4Å; I464-Y472 HydrophobicContact CG1-CD2 4.16Å; I464-Y472 HydrophobicContact CG2-CD2 3.69Å; I464-Y472 HydrophobicContact CG2-CE2 4.16Å; V469-Y472 WeakPolarHBondContact O-CB 3.44Å; V469-Y472 PolarHBondContact O-N 2.92Å; Y472-E474 PolarHBondContact O-N 3.04Å; Y472-V475 PolarHBondContact O-N 2.99Å; Y472-M476 HydrophobicContact CD2-CG 4.14Å; Y472-M476 HydrophobicContact CE1-CG 4.33Å; Y472-M476 HydrophobicContact CE2-CG 3.84Å; Y472-M476 HydrophobicContact CE2-SD 4.34Å; Y472-M476 WeakPolarHBondContact O-CB 3.46Å; Y472-M476 VanDerWaalsContact O-CG 3.25Å; Y472-M476 WeakPolarHBondContact O-CG 3.47Å; Y472-M476 PolarHBondContact O-N 3.23Å; Y472-D526 WeakPolarHBondContact CE1-OD2 3.29Å; Y472-D526 PolarHBondContact OH-OD2 3.13Å
473C85.6Confident85.6Confident60 Ų6037.5 Ų37.541%0.40520%0.198SC..Hα-helixtrans-61.8-40.5178.3-78.40000113I471 K477I471-C473 VanDerWaalsContact C-N 3.34Å; I471-C473 PolarHBondContact O-N 3.22Å; C473-K477 VanDerWaalsContact O-CG 3.25Å; C473-K477 WeakPolarHBondContact O-CG 3.46Å; C473-K477 PolarHBondContact O-N 3.41Å
474E85.2Confident84.9Confident79 Ų7939.3 Ų39.337%0.36921%0.207SC..Hα-helixtrans-73.8-40.3-178.4-66.8-54.5124.700111.8M438 I471 Y472 K477 M478M438-E474 HydrophobicContact CE-CB 4.06Å; I471-E474 PolarHBondContact O-N 3.36Å; Y472-E474 PolarHBondContact O-N 3.04Å; E474-K477 PolarHBondContact O-N 3.24Å; E474-K477 IonicContact OE1-NZ 3.68Å; E474-K477 PolarHBondContact OE1-NZ 3.3Å; E474-M478 WeakPolarHBondContact O-CB 3.36Å; E474-M478 PolarHBondContact O-N 3.42Å
475V89.3Confident84.5Confident0 Ų041.5 Ų41.50%022%0.217CC..Hα-helixtrans-63.3-45.1174.1176.30000110.6M438 L460 I464 I471 Y472 K477 M478 F479M438-V475 HydrophobicContact CE-CB 4.4Å; M438-V475 HydrophobicContact CE-CG2 3.63Å; M438-V475 HydrophobicContact SD-CG2 3.7Å; L460-V475 HydrophobicContact CB-CG1 4.02Å; L460-V475 HydrophobicContact CB-CG2 4.22Å; L460-V475 HydrophobicContact CD1-CG2 4.42Å; L460-V475 HydrophobicContact CD2-CG2 3.99Å; L460-V475 HydrophobicContact CG-CG2 4.45Å; I464-V475 HydrophobicContact CD1-CB 3.87Å; I464-V475 HydrophobicContact CD1-CG1 3.57Å; I464-V475 HydrophobicContact CD1-CG2 4.42Å; I471-V475 HydrophobicContact CB-CG2 4.31Å; I471-V475 HydrophobicContact CD1-CG2 4.1Å; I471-V475 HydrophobicContact CG1-CG2 4.35Å; I471-V475 WeakPolarHBondContact O-CG2 3.25Å; I471-V475 PolarHBondContact O-N 3.02Å; Y472-V475 PolarHBondContact O-N 2.99Å; V475-K477 VanDerWaalsContact C-N 3.35Å; V475-K477 PolarHBondContact O-N 3.12Å; V475-M478 CarbonylContact O-C 3.5Å; V475-M478 WeakPolarHBondContact O-CB 3.47Å; V475-M478 PolarHBondContact O-N 3.32Å; V475-M478 VanDerWaalsContact O-N 3.12Å; V475-F479 HydrophobicContact CG1-CD1 4.1Å; V475-F479 HydrophobicContact CG1-CD2 4.13Å; V475-F479 HydrophobicContact CG1-CE1 3.72Å; V475-F479 HydrophobicContact CG1-CE2 3.76Å; V475-F479 HydrophobicContact CG1-CG 4.3Å; V475-F479 HydrophobicContact CG1-CZ 3.53Å; V475-F479 WeakPolarHBondContact O-CG 3.49Å; V475-F479 PolarHBondContact O-N 3.1Å
476M88.2Confident84.1Confident0 Ų040 Ų400%021%0.21CC..Hα-helixtrans-65.1-37.3178.1-69.8-56.3-66.800112.3Y472 M478 F479 N480 Y511 L514 L527 R530Y472-M476 HydrophobicContact CD2-CG 4.14Å; Y472-M476 HydrophobicContact CE1-CG 4.33Å; Y472-M476 HydrophobicContact CE2-CG 3.84Å; Y472-M476 HydrophobicContact CE2-SD 4.34Å; Y472-M476 WeakPolarHBondContact O-CB 3.46Å; Y472-M476 VanDerWaalsContact O-CG 3.25Å; Y472-M476 WeakPolarHBondContact O-CG 3.47Å; Y472-M476 PolarHBondContact O-N 3.23Å; M476-M478 VanDerWaalsContact C-N 3.33Å; M476-F479 PolarHBondContact O-N 3.38Å; M476-F479 HydrophobicContact SD-CD2 4.46Å; M476-N480 VanDerWaalsContact O-CB 3.31Å; M476-N480 WeakPolarHBondContact O-CB 3.39Å; M476-N480 PolarHBondContact O-N 3.21Å; M476-N480 PolarHBondContact O-OD1 3.08Å; M476-Y511 HydrophobicContact CE-CE1 3.84Å; M476-Y511 HydrophobicContact SD-CE1 4.34Å; M476-L514 HydrophobicContact SD-CD1 4.33Å; M476-L527 HydrophobicContact CE-CD1 3.85Å; M476-R530 HydrophobicContact CE-CB 4.32Å
477K86.2Confident83.4Confident121 Ų12139.9 Ų39.953%0.52621%0.206SC..Hα-helixtrans-61.2-43.1170.8-75.9171.1-172.4171.70111.3C473 E474 V475 N480 R481C473-K477 VanDerWaalsContact O-CG 3.25Å; C473-K477 WeakPolarHBondContact O-CG 3.46Å; C473-K477 PolarHBondContact O-N 3.41Å; E474-K477 PolarHBondContact O-N 3.24Å; E474-K477 IonicContact OE1-NZ 3.68Å; E474-K477 PolarHBondContact OE1-NZ 3.3Å; V475-K477 VanDerWaalsContact C-N 3.35Å; V475-K477 PolarHBondContact O-N 3.12Å; K477-N480 PolarHBondContact O-N 3.42Å; K477-R481 WeakPolarHBondContact O-CB 3.49Å; K477-R481 PolarHBondContact O-N 3.2Å
478M87.5Confident82.7Confident24 Ų2441.2 Ų41.212%0.11821%0.205CC..Hα-helixtrans-62.9-47.7177.7-167.3-175.983.100111.5M438 V457 L460 E474 V475 M476 N480 R481 I482M438-M478 HydrophobicContact CE-SD 4.4Å; V457-M478 HydrophobicContact CG2-CE 4.48Å; L460-M478 HydrophobicContact CD1-CE 3.34Å; L460-M478 HydrophobicContact CD1-SD 4.29Å; E474-M478 WeakPolarHBondContact O-CB 3.36Å; E474-M478 PolarHBondContact O-N 3.42Å; V475-M478 CarbonylContact O-C 3.5Å; V475-M478 WeakPolarHBondContact O-CB 3.47Å; V475-M478 PolarHBondContact O-N 3.32Å; V475-M478 VanDerWaalsContact O-N 3.12Å; M476-M478 VanDerWaalsContact C-N 3.33Å; M478-N480 PolarHBondContact O-N 3.35Å; M478-R481 WeakPolarHBondContact O-CB 3.29Å; M478-R481 PolarHBondContact O-N 3.07Å; M478-I482 HydrophobicContact CE-CD1 4.09Å; M478-I482 HydrophobicContact CG-CD1 3.98Å; M478-I482 WeakPolarHBondContact O-CD1 3.33Å; M478-I482 VanDerWaalsContact O-CG1 3.29Å; M478-I482 WeakPolarHBondContact O-CG1 3.49Å; M478-I482 PolarHBondContact O-N 3.35Å
479F91Very high81.8Confident0 Ų041.3 Ų41.30%021%0.206CC..Hα-helixtrans-63.3-42.2178-72.43.1000111.8V457 L460 V475 M476 R481 I482 T483 V507 Y511 L514V457-F479 HydrophobicContact CB-CE1 4.28Å; V457-F479 HydrophobicContact CG1-CE1 3.83Å; V457-F479 HydrophobicContact CG1-CZ 3.88Å; V457-F479 HydrophobicContact CG2-CE1 4.15Å; L460-F479 HydrophobicContact CB-CZ 4.31Å; V475-F479 HydrophobicContact CG1-CD1 4.1Å; V475-F479 HydrophobicContact CG1-CD2 4.13Å; V475-F479 HydrophobicContact CG1-CE1 3.72Å; V475-F479 HydrophobicContact CG1-CE2 3.76Å; V475-F479 HydrophobicContact CG1-CG 4.3Å; V475-F479 HydrophobicContact CG1-CZ 3.53Å; V475-F479 WeakPolarHBondContact O-CG 3.49Å; V475-F479 PolarHBondContact O-N 3.1Å; M476-F479 PolarHBondContact O-N 3.38Å; M476-F479 HydrophobicContact SD-CD2 4.46Å; F479-R481 VanDerWaalsContact C-N 3.33Å; F479-R481 PolarHBondContact O-N 2.73Å; F479-I482 PolarHBondContact O-N 2.81Å; F479-T483 WeakPolarHBondContact O-CB 3.42Å; F479-T483 PolarHBondContact O-N 2.89Å; F479-T483 PolarHBondContact O-OG1 3.22Å; F479-V507 HydrophobicContact CB-CG1 3.67Å; F479-V507 HydrophobicContact CD1-CG1 4.31Å; F479-V507 HydrophobicContact CD1-CG2 4.09Å; F479-V507 HydrophobicContact CD2-CG1 4.23Å; F479-V507 HydrophobicContact CG-CG1 3.84Å; F479-V507 HydrophobicContact CG-CG2 4.45Å; F479-Y511 VanDerWaalsContact C-OH 3.26Å; F479-Y511 HydrophobicContact CB-CE1 3.79Å; F479-Y511 WeakPolarHBondContact CB-OH 3.11Å; F479-Y511 HydrophobicContact CD2-CD1 4.18Å; F479-Y511 AromaticContact CD2-CE1 3.78Å; F479-Y511 HydrophobicContact CD2-CE1 3.78Å; F479-Y511 HydrophobicContact CG-CE1 4.29Å; F479-Y511 PolarHBondContact O-OH 3.44Å; F479-L514 HydrophobicContact CE2-CD1 4.36Å
480N85.2Confident80.8Confident31 Ų3138.3 Ų38.317%0.16620%0.196CC..Hα-helixtrans-62.7-41.2174.9-74.76000111.3M476 K477 M478 T483 M484 Y511 L534M476-N480 VanDerWaalsContact O-CB 3.31Å; M476-N480 WeakPolarHBondContact O-CB 3.39Å; M476-N480 PolarHBondContact O-N 3.21Å; M476-N480 PolarHBondContact O-OD1 3.08Å; K477-N480 PolarHBondContact O-N 3.42Å; M478-N480 PolarHBondContact O-N 3.35Å; N480-T483 PolarHBondContact O-N 3.49Å; N480-M484 WeakPolarHBondContact O-CB 3.35Å; N480-M484 VanDerWaalsContact O-CG 3.26Å; N480-M484 WeakPolarHBondContact O-CG 3.46Å; N480-M484 PolarHBondContact O-N 2.91Å; N480-Y511 PolarHBondContact N-OH 2.86Å; N480-Y511 PolarHBondContact OD1-OH 2.82Å; N480-L534 HydrophobicContact CB-CD1 4.43Å
481R83.7Confident79.5Confident138 Ų13837 Ų3752%0.52119%0.186SC..Hα-helixtrans-63.3-48.4176.5-176.7-178.9177.8-170.2-4.8111.8K477 M478 F479 T483 M484 E485K477-R481 WeakPolarHBondContact O-CB 3.49Å; K477-R481 PolarHBondContact O-N 3.2Å; M478-R481 WeakPolarHBondContact O-CB 3.29Å; M478-R481 PolarHBondContact O-N 3.07Å; F479-R481 VanDerWaalsContact C-N 3.33Å; F479-R481 PolarHBondContact O-N 2.73Å; R481-T483 VanDerWaalsContact C-N 3.31Å; R481-T483 PolarHBondContact O-N 3.41Å; R481-M484 PolarHBondContact O-N 3.2Å; R481-E485 HydrophobicContact CG-CG 4.34Å; R481-E485 VanDerWaalsContact CG-OE1 3.27Å; R481-E485 WeakPolarHBondContact CG-OE1 3.45Å; R481-E485 IonicContact CZ-OE1 3.92Å; R481-E485 IonicContact NE-OE1 3.67Å; R481-E485 PolarHBondContact NE-OE1 3.35Å; R481-E485 IonicContact NH2-OE1 3.29Å; R481-E485 PolarHBondContact NH2-OE1 3.49Å; R481-E485 WeakPolarHBondContact O-CB 3.4Å; R481-E485 WeakPolarHBondContact O-CG 3.45Å; R481-E485 PolarHBondContact O-N 3.48Å
482I85.1Confident77.8Confident2 Ų238.5 Ų38.51%0.0120%0.203CC..Hα-helixtrans-58.2-46.8177-69.1159.8000110.1F445 V457 M478 F479 S486 Y500 A503 V507F445-I482 HydrophobicContact CE1-CD1 3.69Å; F445-I482 HydrophobicContact CE1-CG1 3.96Å; F445-I482 HydrophobicContact CE2-CD1 4.26Å; F445-I482 HydrophobicContact CZ-CD1 3.37Å; F445-I482 HydrophobicContact CZ-CG1 3.98Å; V457-I482 HydrophobicContact CG2-CD1 4.48Å; M478-I482 HydrophobicContact CE-CD1 4.09Å; M478-I482 HydrophobicContact CG-CD1 3.98Å; M478-I482 WeakPolarHBondContact O-CD1 3.33Å; M478-I482 VanDerWaalsContact O-CG1 3.29Å; M478-I482 WeakPolarHBondContact O-CG1 3.49Å; M478-I482 PolarHBondContact O-N 3.35Å; F479-I482 PolarHBondContact O-N 2.81Å; I482-S486 WeakPolarHBondContact O-CB 3.35Å; I482-S486 PolarHBondContact O-N 2.89Å; I482-Y500 HydrophobicContact CG1-CD1 4.4Å; I482-Y500 HydrophobicContact CG1-CG 4.33Å; I482-A503 HydrophobicContact CG2-CB 4.4Å; I482-V507 HydrophobicContact CB-CG2 4.13Å; I482-V507 HydrophobicContact CD1-CG2 3.88Å; I482-V507 HydrophobicContact CG2-CB 4.47Å; I482-V507 HydrophobicContact CG2-CG2 3.69Å
483T83.6Confident76.1Confident16 Ų1643.6 Ų43.610%0.09824%0.243CC..Hα-helixtrans-62.4-49.1179.6-53.30000110.7F479 N480 R481 W487 L534 L538F479-T483 WeakPolarHBondContact O-CB 3.42Å; F479-T483 PolarHBondContact O-N 2.89Å; F479-T483 PolarHBondContact O-OG1 3.22Å; N480-T483 PolarHBondContact O-N 3.49Å; R481-T483 VanDerWaalsContact C-N 3.31Å; R481-T483 PolarHBondContact O-N 3.41Å; T483-W487 WeakPolarHBondContact O-CB 3.31Å; T483-W487 PolarHBondContact O-N 2.86Å; T483-W487 VanDerWaalsContact O-N 3.13Å; T483-L534 HydrophobicContact CG2-CD1 4.43Å; T483-L534 HydrophobicContact CG2-CD2 4.23Å; T483-L538 HydrophobicContact CG2-CD1 4.23Å
484M77.5Confident74.3Confident39 Ų3943.8 Ų43.819%0.19225%0.245CC..Hα-helixtrans-64.1-46.9179.7-74.4-72.8-80.400112.8N480 R481 W487 L488 L534 L538 E541N480-M484 WeakPolarHBondContact O-CB 3.35Å; N480-M484 VanDerWaalsContact O-CG 3.26Å; N480-M484 WeakPolarHBondContact O-CG 3.46Å; N480-M484 PolarHBondContact O-N 2.91Å; R481-M484 PolarHBondContact O-N 3.2Å; M484-W487 WeakPolarHBondContact O-CB 3.25Å; M484-W487 PolarHBondContact O-N 3.34Å; M484-L488 VanDerWaalsContact O-CG 3.28Å; M484-L488 WeakPolarHBondContact O-CG 3.23Å; M484-L488 PolarHBondContact O-N 3.12Å; M484-L534 HydrophobicContact CG-CD1 4.29Å; M484-L538 HydrophobicContact CG-CD2 4.5Å; M484-L538 HydrophobicContact SD-CD2 3.5Å; M484-L538 WeakPolarHBondContact SD-CD2 3.05Å; M484-L538 HydrophobicContact SD-CG 3.98Å; M484-E541 HydrophobicContact CE-CB 4.27Å; M484-E541 HydrophobicContact CE-CG 4.33Å
485E77.5Confident72.8Confident61 Ų6147 Ų4729%0.28526%0.264SS..Hα-helixtrans-73.3-39.4-177-70.8-173.2-152.400112.5R481 W487 L488 S489 Y500R481-E485 HydrophobicContact CG-CG 4.34Å; R481-E485 VanDerWaalsContact CG-OE1 3.27Å; R481-E485 WeakPolarHBondContact CG-OE1 3.45Å; R481-E485 IonicContact CZ-OE1 3.92Å; R481-E485 IonicContact NE-OE1 3.67Å; R481-E485 PolarHBondContact NE-OE1 3.35Å; R481-E485 IonicContact NH2-OE1 3.29Å; R481-E485 PolarHBondContact NH2-OE1 3.49Å; R481-E485 WeakPolarHBondContact O-CB 3.4Å; R481-E485 WeakPolarHBondContact O-CG 3.45Å; R481-E485 PolarHBondContact O-N 3.48Å; E485-W487 PolarHBondContact O-N 3.35Å; E485-L488 PolarHBondContact O-N 2.83Å; E485-S489 PolarHBondContact O-N 3.32Å; E485-S489 VanDerWaalsContact O-N 3.15Å; E485-Y500 HydrophobicContact CB-CD2 3.99Å; E485-Y500 WeakPolarHBondContact OE2-CD2 3.35Å; E485-Y500 WeakPolarHBondContact OE2-CE2 3.5Å
486S77.2Confident70.9Confident18 Ų1855.4 Ų55.413%0.12630%0.304CS..Hα-helixtrans-60.2-30.8172.1-179.60000111.8I482 R501 S504I482-S486 WeakPolarHBondContact O-CB 3.35Å; I482-S486 PolarHBondContact O-N 2.89Å; S486-R501 WeakPolarHBondContact OG-CA 3.33Å; S486-S504 WeakPolarHBondContact OG-CB 3.08Å
487W70.5Confident69.1Low13 Ų1358.7 Ų58.75%0.04932%0.324CS..Hα-helixtrans-76.4-44.5179.9-170.886.7000112.7T483 M484 E485 S489 G490 L538 E541 I545 N559 N562T483-W487 WeakPolarHBondContact O-CB 3.31Å; T483-W487 PolarHBondContact O-N 2.86Å; T483-W487 VanDerWaalsContact O-N 3.13Å; M484-W487 WeakPolarHBondContact O-CB 3.25Å; M484-W487 PolarHBondContact O-N 3.34Å; E485-W487 PolarHBondContact O-N 3.35Å; W487-S489 PolarHBondContact O-N 2.95Å; W487-G490 PolarHBondContact O-N 3.03Å; W487-L538 HydrophobicContact CB-CD2 4Å; W487-L538 HydrophobicContact CD2-CD2 3.65Å; W487-L538 HydrophobicContact CE3-CD2 4.03Å; W487-L538 HydrophobicContact CG-CD2 3.65Å; W487-L538 WeakPolarHBondContact CH2-O 3.48Å; W487-L538 HydrophobicContact CZ2-CB 4.44Å; W487-E541 HydrophobicContact CZ3-CB 3.89Å; W487-E541 HydrophobicContact CZ3-CG 4.28Å; W487-I545 HydrophobicContact CZ3-CD1 4.08Å; W487-N559 WeakPolarHBondContact CH2-OD1 3.24Å; W487-N559 WeakPolarHBondContact CZ2-OD1 3.14Å; W487-N562 HydrophobicContact CG-CB 4.49Å; W487-N562 PolarHBondContact NE1-ND2 2.89Å
488L66.5Low67.5Low64 Ų6457.2 Ų57.234%0.33532%0.32SS..Hα-helixtrans-59.4-34175-71.2172.1000112.5M484 E485 G490 Y491 E541 I545M484-L488 VanDerWaalsContact O-CG 3.28Å; M484-L488 WeakPolarHBondContact O-CG 3.23Å; M484-L488 PolarHBondContact O-N 3.12Å; E485-L488 PolarHBondContact O-N 2.83Å; L488-G490 PolarHBondContact O-N 3.15Å; L488-G490 VanDerWaalsContact O-N 3.15Å; L488-Y491 PolarHBondContact O-N 3.34Å; L488-Y491 VanDerWaalsContact O-N 3.07Å; L488-E541 HydrophobicContact CD2-CG 3.81Å; L488-I545 HydrophobicContact CD2-CD1 3.31Å; L488-I545 HydrophobicContact CD2-CG1 4.35Å
489S63.7Low66.3Low4 Ų460.7 Ų60.73%0.02834%0.337CS..THydrogen-bonded Turntrans-59.6-23.2177.7177.70000113.8E485 W487 Y491E485-S489 PolarHBondContact O-N 3.32Å; E485-S489 VanDerWaalsContact O-N 3.15Å; W487-S489 PolarHBondContact O-N 2.95Å; S489-Y491 PolarHBondContact O-N 3.44Å
490G58.4Low65.6Low40 Ų4061.8 Ų61.841%0.41234%0.341SS..THydrogen-bonded Turntrans-65.3-14.4174.600000114.8W487 L488W487-G490 PolarHBondContact O-N 3.03Å; L488-G490 PolarHBondContact O-N 3.15Å; L488-G490 VanDerWaalsContact O-N 3.15Å
491Y55.5Low65.1Low35 Ų3567 Ų6714%0.13736%0.358CS..THydrogen-bonded Turntrans-114.6-18.9-174.5-68.1-75.4000115L488 S489 I545 I549 K555 N559L488-Y491 PolarHBondContact O-N 3.34Å; L488-Y491 VanDerWaalsContact O-N 3.07Å; S489-Y491 PolarHBondContact O-N 3.44Å; Y491-I545 VanDerWaalsContact CB-CG2 3.49Å; Y491-I545 HydrophobicContact CD1-CG2 3.63Å; Y491-I545 HydrophobicContact CD2-CD1 3.89Å; Y491-I545 HydrophobicContact CD2-CG2 3.95Å; Y491-I545 HydrophobicContact CE1-CG2 4.4Å; Y491-I545 HydrophobicContact CE2-CD1 4.49Å; Y491-I545 HydrophobicContact CG-CB 4.46Å; Y491-I545 HydrophobicContact CG-CD1 4.39Å; Y491-I545 HydrophobicContact CG-CG2 3.4Å; Y491-I549 HydrophobicContact CD1-CD1 4.47Å; Y491-K555 HydrophobicContact CE1-CB 4.46Å; Y491-K555 PolarHBondContact OH-O 3.48Å; Y491-N559 WeakPolarHBondContact CE2-OD1 3.4Å; Y491-N559 WeakPolarHBondContact OH-CB 3.17Å; Y491-N559 PolarHBondContact OH-N 3.01Å; Y491-N559 PolarHBondContact OH-ND2 3.48Å; Y491-N559 PolarHBondContact OH-OD1 3.38Å
492G51.8Low64.8Low36 Ų3664.2 Ų64.237%0.37135%0.351SS..  trans-91.2133.1-179.100000112.5S494G492-S494 VanDerWaalsContact C-N 3.32Å
493S48.7Very low64.7Low135 Ų13564.1 Ų64.194%0.94435%0.351SS*.  trans-88.41217555.90000114
494S49.1Very low64.7Low64 Ų6464.6 Ų64.645%0.44835%0.354SS..  trans-102.6120.8176.156.10000111.4G492 E496 T497G492-S494 VanDerWaalsContact C-N 3.32Å; S494-E496 PolarHBondContact O-N 3.37Å; S494-T497 PolarHBondContact O-N 3.44Å; S494-T497 PolarHBondContact O-OG1 2.94Å; S494-T497 PolarHBondContact OG-OG1 2.98Å
495D51.8Low64.9Low145 Ų14568 Ų6878%0.77537%0.373SS*.G310 helixtrans-53.3-24.5177.6-84.2-28.8000113.4T497D495-T497 PolarHBondContact O-N 3.38Å
496E50.2Low65.3Low178 Ų17865.8 Ų65.883%0.83237%0.365SS*.G310 helixtrans-70.1-13.7178.9-68.6-174.4162.200114.4S494S494-E496 PolarHBondContact O-N 3.37Å
497T49.8Very low65.9Low69 Ų6965 Ų6542%0.42336%0.36SS..G310 helixtrans-97.15.4-18049.80000115S494 D495 M499S494-T497 PolarHBondContact O-N 3.44Å; S494-T497 PolarHBondContact O-OG1 2.94Å; S494-T497 PolarHBondContact OG-OG1 2.98Å; D495-T497 PolarHBondContact O-N 3.38Å; T497-M499 VanDerWaalsContact C-N 3.26Å; T497-M499 PolarHBondContact O-N 2.96Å; T497-M499 VanDerWaalsContact O-N 3.16Å
498M53.7Low66.6Low89 Ų8966 Ų6644%0.43837%0.366SS..  trans-80.220.6-178.3-67.9-145163.900115.8Y500M498-Y500 PolarHBondContact O-N 3.42Å
499M62.7Low67.5Low97 Ų9767.4 Ų67.448%0.47837%0.373SS..THydrogen-bonded Turntrans-58.2-29.6-160-77.7-153.480.900117.8T497 H502T497-M499 VanDerWaalsContact C-N 3.26Å; T497-M499 PolarHBondContact O-N 2.96Å; T497-M499 VanDerWaalsContact O-N 3.16Å; M499-H502 PolarHBondContact O-CE1 2.87Å
500Y75.6Confident68.8Low24 Ų2467.3 Ų67.39%0.09437%0.373CS..THydrogen-bonded Turntrans-129.612.5-170.2-57.5-66.2000116.3F445 S446 I482 E485 M498 H502 A503 S504F445-Y500 HydrophobicContact CD1-CD1 4.43Å; F445-Y500 AromaticContact CD1-CE1 3.97Å; F445-Y500 HydrophobicContact CD1-CE1 3.97Å; F445-Y500 AromaticContact CE1-CD1 3.56Å; F445-Y500 HydrophobicContact CE1-CD1 3.56Å; F445-Y500 AromaticContact CE1-CE1 3.5Å; F445-Y500 HydrophobicContact CE1-CE1 3.5Å; F445-Y500 VanDerWaalsContact CE1-CE1 3.5Å; F445-Y500 HydrophobicContact CZ-CD1 4.27Å; S446-Y500 VanDerWaalsContact OG-CD1 3.3Å; S446-Y500 WeakPolarHBondContact OG-CD1 3.31Å; S446-Y500 WeakPolarHBondContact OG-CE1 3.38Å; I482-Y500 HydrophobicContact CG1-CD1 4.4Å; I482-Y500 HydrophobicContact CG1-CG 4.33Å; E485-Y500 HydrophobicContact CB-CD2 3.99Å; E485-Y500 WeakPolarHBondContact OE2-CD2 3.35Å; E485-Y500 WeakPolarHBondContact OE2-CE2 3.5Å; M498-Y500 PolarHBondContact O-N 3.42Å; Y500-H502 PolarHBondContact O-N 2.91Å; Y500-A503 PolarHBondContact O-N 3.02Å; Y500-A503 VanDerWaalsContact O-N 3.08Å; Y500-S504 PolarHBondContact O-N 3.16Å
501R74.1Confident70.3Confident140 Ų14065.4 Ų65.453%0.52835%0.353SS..THydrogen-bonded Turntrans-59.7-34.3-174.8-161.7175.4-174.9146.80.2113S486 A503 S504S486-R501 WeakPolarHBondContact OG-CA 3.33Å; R501-A503 VanDerWaalsContact C-N 3.31Å; R501-A503 PolarHBondContact O-N 3.47Å; R501-S504 PolarHBondContact O-OG 2.88Å
502H78.5Confident71.9Confident79 Ų7966.2 Ų66.237%0.36636%0.359SS..THydrogen-bonded Turntrans-65.9-26.417864.4-64.9000114.1S450 D453 M499 Y500S450-H502 PolarHBondContact O-CD2 3.41Å; D453-H502 IonicContact OD2-CD2 2.79Å; D453-H502 PolarHBondContact OD2-CD2 3.33Å; D453-H502 IonicContact OD2-CE1 3.29Å; D453-H502 IonicContact OD2-NE2 3.95Å; D453-H502 PolarHBondContact OD2-NE2 3.39Å; M499-H502 PolarHBondContact O-CE1 2.87Å; Y500-H502 PolarHBondContact O-N 2.91Å
503A83.3Confident73.7Confident0 Ų065.8 Ų65.80%035%0.348CS..THydrogen-bonded Turntrans-97.6-14-178.300000113.8F445 D453 I482 Y500 R501 L505 A506 V507F445-A503 HydrophobicContact CE2-CB 4.28Å; F445-A503 HydrophobicContact CZ-CB 3.87Å; D453-A503 HydrophobicContact CB-CB 4.4Å; I482-A503 HydrophobicContact CG2-CB 4.4Å; Y500-A503 PolarHBondContact O-N 3.02Å; Y500-A503 VanDerWaalsContact O-N 3.08Å; R501-A503 VanDerWaalsContact C-N 3.31Å; R501-A503 PolarHBondContact O-N 3.47Å; A503-L505 PolarHBondContact O-N 3.03Å; A503-A506 WeakPolarHBondContact O-CB 3.27Å; A503-A506 PolarHBondContact O-N 2.92Å; A503-A506 VanDerWaalsContact O-N 3.07Å; A503-V507 PolarHBondContact O-N 3.07Å; A503-V507 VanDerWaalsContact O-N 3.1Å
504S82Confident75.6Confident26 Ų2659.4 Ų59.418%0.18230%0.303CS..Hα-helixtrans-52.3-50.4-175.562.80000114.2S486 Y500 R501 A506 V507 I508S486-S504 WeakPolarHBondContact OG-CB 3.08Å; Y500-S504 PolarHBondContact O-N 3.16Å; R501-S504 PolarHBondContact O-OG 2.88Å; S504-A506 VanDerWaalsContact C-N 3.27Å; S504-A506 PolarHBondContact O-N 2.76Å; S504-V507 PolarHBondContact O-N 3.27Å; S504-V507 VanDerWaalsContact O-N 3.13Å; S504-I508 PolarHBondContact O-N 3.07Å
505L83Confident77.5Confident110 Ų11056.3 Ų56.358%0.57628%0.282SS*.Hα-helixtrans-62.7-35.5179.4-177.663.3000112A503 V507 I508 N509A503-L505 PolarHBondContact O-N 3.03Å; L505-V507 VanDerWaalsContact C-N 3.35Å; L505-I508 PolarHBondContact O-N 3.36Å; L505-N509 WeakPolarHBondContact O-CB 3.45Å; L505-N509 VanDerWaalsContact O-CG 3.26Å; L505-N509 PolarHBondContact O-N 3.13Å; L505-N509 PolarHBondContact O-ND2 2.86Å
506A85.6Confident79.4Confident16 Ų1654.4 Ų54.413%0.13227%0.269CS..Hα-helixtrans-65.9-39.8176.200000111.2A454 V457 A503 S504 N509 S510A454-A506 HydrophobicContact CB-CB 3.59Å; V457-A506 HydrophobicContact CB-CB 4.27Å; V457-A506 HydrophobicContact CG1-CB 4.04Å; A503-A506 WeakPolarHBondContact O-CB 3.27Å; A503-A506 PolarHBondContact O-N 2.92Å; A503-A506 VanDerWaalsContact O-N 3.07Å; S504-A506 VanDerWaalsContact C-N 3.27Å; S504-A506 PolarHBondContact O-N 2.76Å; A506-N509 PolarHBondContact O-N 3.16Å; A506-S510 WeakPolarHBondContact O-CB 3.49Å; A506-S510 PolarHBondContact O-N 3.34Å; A506-S510 PolarHBondContact O-OG 2.95Å
507V89.2Confident81.2Confident0 Ų050.2 Ų50.20%025%0.249CC..Hα-helixtrans-65.1-41.9175.9173.80000111.3V457 F479 I482 A503 S504 L505 S510 Y511V457-V507 HydrophobicContact CG1-CB 4.36Å; V457-V507 HydrophobicContact CG1-CG2 3.74Å; V457-V507 HydrophobicContact CG2-CG2 3.96Å; F479-V507 HydrophobicContact CB-CG1 3.67Å; F479-V507 HydrophobicContact CD1-CG1 4.31Å; F479-V507 HydrophobicContact CD1-CG2 4.09Å; F479-V507 HydrophobicContact CD2-CG1 4.23Å; F479-V507 HydrophobicContact CG-CG1 3.84Å; F479-V507 HydrophobicContact CG-CG2 4.45Å; I482-V507 HydrophobicContact CB-CG2 4.13Å; I482-V507 HydrophobicContact CD1-CG2 3.88Å; I482-V507 HydrophobicContact CG2-CB 4.47Å; I482-V507 HydrophobicContact CG2-CG2 3.69Å; A503-V507 PolarHBondContact O-N 3.07Å; A503-V507 VanDerWaalsContact O-N 3.1Å; S504-V507 PolarHBondContact O-N 3.27Å; S504-V507 VanDerWaalsContact O-N 3.13Å; L505-V507 VanDerWaalsContact C-N 3.35Å; V507-S510 CarbonylContact O-C 3.57Å; V507-S510 WeakPolarHBondContact O-CB 3.4Å; V507-S510 PolarHBondContact O-N 3.43Å; V507-Y511 HydrophobicContact CG1-CD2 4.1Å; V507-Y511 HydrophobicContact CG1-CE1 4.39Å; V507-Y511 HydrophobicContact CG1-CE2 3.65Å; V507-Y511 PolarHBondContact O-N 3.15Å
508I85.4Confident83Confident36 Ų3647.2 Ų47.219%0.18523%0.23CC..Hα-helixtrans-59.8-47.2174.4-71.7153.8000111S504 L505 S510 Y511 M512 V565S504-I508 PolarHBondContact O-N 3.07Å; L505-I508 PolarHBondContact O-N 3.36Å; I508-S510 VanDerWaalsContact C-N 3.29Å; I508-S510 PolarHBondContact O-N 3.48Å; I508-Y511 WeakPolarHBondContact O-CB 3.46Å; I508-Y511 PolarHBondContact O-N 3.24Å; I508-Y511 VanDerWaalsContact O-N 3.15Å; I508-M512 PolarHBondContact O-N 3.03Å; I508-V565 HydrophobicContact CB-CG1 4.28Å; I508-V565 HydrophobicContact CD1-CB 4.45Å; I508-V565 HydrophobicContact CD1-CG1 3.52Å; I508-V565 HydrophobicContact CG1-CG1 3.85Å; I508-V565 HydrophobicContact CG2-CG1 3.47Å; I508-V565 VanDerWaalsContact CG2-CG1 3.47Å
509N86.3Confident84.3Confident92 Ų9250.1 Ų50.149%0.49224%0.242SC..Hα-helixtrans-62.7-37.4176.5-70.7-17.3000111.5L505 A506 M512 N513L505-N509 WeakPolarHBondContact O-CB 3.45Å; L505-N509 VanDerWaalsContact O-CG 3.26Å; L505-N509 PolarHBondContact O-N 3.13Å; L505-N509 PolarHBondContact O-ND2 2.86Å; A506-N509 PolarHBondContact O-N 3.16Å; N509-M512 WeakPolarHBondContact O-CB 3.37Å; N509-M512 PolarHBondContact O-N 2.93Å; N509-N513 WeakPolarHBondContact O-CB 3.43Å; N509-N513 PolarHBondContact O-N 3.45Å
510S89.2Confident85.1Confident3 Ų347.4 Ų47.42%0.02124%0.24CC..Hα-helixtrans-65.6-38.7172.8-72.40000112.3V457 A506 V507 I508 N513 L514V457-S510 WeakPolarHBondContact CG1-OG 3.37Å; V457-S510 PolarHBondContact O-OG 3.45Å; A506-S510 WeakPolarHBondContact O-CB 3.49Å; A506-S510 PolarHBondContact O-N 3.34Å; A506-S510 PolarHBondContact O-OG 2.95Å; V507-S510 CarbonylContact O-C 3.57Å; V507-S510 WeakPolarHBondContact O-CB 3.4Å; V507-S510 PolarHBondContact O-N 3.43Å; I508-S510 VanDerWaalsContact C-N 3.29Å; I508-S510 PolarHBondContact O-N 3.48Å; S510-N513 PolarHBondContact O-N 2.91Å; S510-L514 WeakPolarHBondContact O-CB 3.26Å; S510-L514 VanDerWaalsContact O-CG 3.23Å; S510-L514 WeakPolarHBondContact O-CG 3.33Å; S510-L514 PolarHBondContact O-N 2.94Å
511Y91.8Very high85.3Confident0 Ų052.8 Ų52.80%027%0.266CS..Hα-helixtrans-62.7-41.5172.4-70.8-34.4000112.1M476 F479 N480 V507 I508 L514 A515 F531 L534 L566M476-Y511 HydrophobicContact CE-CE1 3.84Å; M476-Y511 HydrophobicContact SD-CE1 4.34Å; F479-Y511 VanDerWaalsContact C-OH 3.26Å; F479-Y511 HydrophobicContact CB-CE1 3.79Å; F479-Y511 WeakPolarHBondContact CB-OH 3.11Å; F479-Y511 HydrophobicContact CD2-CD1 4.18Å; F479-Y511 AromaticContact CD2-CE1 3.78Å; F479-Y511 HydrophobicContact CD2-CE1 3.78Å; F479-Y511 HydrophobicContact CG-CE1 4.29Å; F479-Y511 PolarHBondContact O-OH 3.44Å; N480-Y511 PolarHBondContact N-OH 2.86Å; N480-Y511 PolarHBondContact OD1-OH 2.82Å; V507-Y511 HydrophobicContact CG1-CD2 4.1Å; V507-Y511 HydrophobicContact CG1-CE1 4.39Å; V507-Y511 HydrophobicContact CG1-CE2 3.65Å; V507-Y511 PolarHBondContact O-N 3.15Å; I508-Y511 WeakPolarHBondContact O-CB 3.46Å; I508-Y511 PolarHBondContact O-N 3.24Å; I508-Y511 VanDerWaalsContact O-N 3.15Å; Y511-L514 PolarHBondContact O-N 3.15Å; Y511-A515 WeakPolarHBondContact O-CB 3.46Å; Y511-A515 PolarHBondContact O-N 3.4Å; Y511-F531 AromaticContact CD1-CE1 3.5Å; Y511-F531 HydrophobicContact CD1-CE1 3.5Å; Y511-F531 VanDerWaalsContact CD1-CE1 3.5Å; Y511-F531 HydrophobicContact CD1-CZ 4.11Å; Y511-F531 HydrophobicContact CD2-CE1 4.49Å; Y511-F531 HydrophobicContact CE1-CE1 4.01Å; Y511-F531 AromaticContact CG-CE1 3.75Å; Y511-F531 HydrophobicContact CG-CE1 3.75Å; Y511-F531 HydrophobicContact CG-CZ 4.2Å; Y511-L534 HydrophobicContact CE2-CD2 3.73Å; Y511-L534 WeakPolarHBondContact OH-CD2 3.48Å; Y511-L566 HydrophobicContact CD2-CD2 3.91Å; Y511-L566 HydrophobicContact CE2-CD2 4.21Å
512M88.6Confident85.6Confident51 Ų5150.6 Ų50.625%0.25127%0.272SS..Hα-helixtrans-59.8-47.6172.6-70.8-63.5-57.300111.4I508 N509 L514 A515 E516 P568 A569 V572I508-M512 PolarHBondContact O-N 3.03Å; N509-M512 WeakPolarHBondContact O-CB 3.37Å; N509-M512 PolarHBondContact O-N 2.93Å; M512-L514 VanDerWaalsContact C-N 3.35Å; M512-L514 PolarHBondContact O-N 3.47Å; M512-A515 WeakPolarHBondContact O-CB 3.43Å; M512-A515 PolarHBondContact O-N 2.77Å; M512-E516 WeakPolarHBondContact O-CB 3.33Å; M512-E516 PolarHBondContact O-N 2.88Å; M512-P568 HydrophobicContact CE-CB 4.12Å; M512-P568 VanDerWaalsContact SD-C 3.54Å; M512-P568 HydrophobicContact SD-CB 3.82Å; M512-A569 HydrophobicContact CG-CB 4.37Å; M512-A569 WeakPolarHBondContact SD-CA 3.2Å; M512-A569 HydrophobicContact SD-CB 3.55Å; M512-A569 VanDerWaalsContact SD-CB 3.55Å; M512-A569 PolarHBondContact SD-N 2.87Å; M512-V572 HydrophobicContact CE-CB 4.5Å; M512-V572 HydrophobicContact CE-CG2 3.73Å
513N88.1Confident85.8Confident28 Ų2850.8 Ų50.815%0.1527%0.273CS..Hα-helixtrans-61.2-43.1179.1-167.829.8000111.7E462 N509 S510 E516 H517E462-N513 PolarHBondContact OE1-ND2 3.34Å; N509-N513 WeakPolarHBondContact O-CB 3.43Å; N509-N513 PolarHBondContact O-N 3.45Å; S510-N513 PolarHBondContact O-N 2.91Å; N513-E516 PolarHBondContact O-N 3.42Å; N513-H517 WeakPolarHBondContact O-CB 3.33Å; N513-H517 PolarHBondContact O-N 2.87Å; N513-H517 PolarHBondContact O-ND1 2.84Å; N513-H517 VanDerWaalsContact O-ND1 3.15Å; N513-H517 PolarHBondContact OD1-CE1 3.47Å; N513-H517 PolarHBondContact OD1-ND1 2.92Å
514L89.2Confident85.9Confident0 Ų052.6 Ų52.60%028%0.28CS..Hα-helixtrans-63.2-44.5174.5-71.5171.8000111.4I464 L465 M476 F479 S510 Y511 M512 E516 H517 I518 L527I464-L514 HydrophobicContact CB-CD2 4Å; I464-L514 HydrophobicContact CD1-CD1 4.47Å; I464-L514 HydrophobicContact CD1-CD2 4.5Å; I464-L514 HydrophobicContact CG2-CD2 3.64Å; L465-L514 HydrophobicContact CD2-CD2 3.94Å; L465-L514 HydrophobicContact CG-CD2 4Å; M476-L514 HydrophobicContact SD-CD1 4.33Å; F479-L514 HydrophobicContact CE2-CD1 4.36Å; S510-L514 WeakPolarHBondContact O-CB 3.26Å; S510-L514 VanDerWaalsContact O-CG 3.23Å; S510-L514 WeakPolarHBondContact O-CG 3.33Å; S510-L514 PolarHBondContact O-N 2.94Å; Y511-L514 PolarHBondContact O-N 3.15Å; M512-L514 VanDerWaalsContact C-N 3.35Å; M512-L514 PolarHBondContact O-N 3.47Å; L514-E516 VanDerWaalsContact C-N 3.29Å; L514-E516 PolarHBondContact O-N 2.89Å; L514-H517 PolarHBondContact O-N 3.24Å; L514-I518 WeakPolarHBondContact O-CB 3.39Å; L514-I518 VanDerWaalsContact O-CG2 3.24Å; L514-I518 WeakPolarHBondContact O-CG2 3.41Å; L514-I518 PolarHBondContact O-N 3.43Å; L514-L527 HydrophobicContact CB-CD2 4.16Å
515A90.2Very high86.1Confident0 Ų053.9 Ų53.90%029%0.286CS..Hα-helixtrans-58.8-41.1176.900000112.4Y511 M512 F531 A569 V572 L573 R576Y511-A515 WeakPolarHBondContact O-CB 3.46Å; Y511-A515 PolarHBondContact O-N 3.4Å; M512-A515 WeakPolarHBondContact O-CB 3.43Å; M512-A515 PolarHBondContact O-N 2.77Å; A515-F531 HydrophobicContact CB-CE2 4.17Å; A515-A569 WeakPolarHBondContact CB-O 3.37Å; A515-V572 HydrophobicContact CB-CB 4.21Å; A515-V572 HydrophobicContact CB-CG1 4.08Å; A515-L573 HydrophobicContact CB-CB 3.94Å; A515-R576 PolarHBondContact O-NH1 3.37Å
516E90.2Very high86.3Confident105 Ų10551.2 Ų51.249%0.49127%0.272SS..Hα-helixtrans-73.8-38.2-177.5-171.2168.9-163.100113.1M512 N513 L514 V572 R576M512-E516 WeakPolarHBondContact O-CB 3.33Å; M512-E516 PolarHBondContact O-N 2.88Å; N513-E516 PolarHBondContact O-N 3.42Å; L514-E516 VanDerWaalsContact C-N 3.29Å; L514-E516 PolarHBondContact O-N 2.89Å; E516-V572 HydrophobicContact CB-CG1 3.91Å; E516-V572 HydrophobicContact CG-CG1 4.45Å; E516-R576 PolarHBondContact O-NE 2.98Å; E516-R576 VanDerWaalsContact O-NE 3.16Å; E516-R576 PolarHBondContact O-NH1 3.21Å; E516-R576 PolarHBondContact O-NH2 3.35Å
517H88.2Confident86.5Confident90 Ų9050.5 Ų50.542%0.41727%0.266SS..Hα-helixtrans-111.3-11.6-168.4-61.7101.5000115.3L465 N513 L514 E519L465-H517 HydrophobicContact CD1-CB 3.84Å; L465-H517 HydrophobicContact CD2-CB 3.63Å; L465-H517 HydrophobicContact CG-CB 4.36Å; N513-H517 WeakPolarHBondContact O-CB 3.33Å; N513-H517 PolarHBondContact O-N 2.87Å; N513-H517 PolarHBondContact O-ND1 2.84Å; N513-H517 VanDerWaalsContact O-ND1 3.15Å; N513-H517 PolarHBondContact OD1-CE1 3.47Å; N513-H517 PolarHBondContact OD1-ND1 2.92Å; L514-H517 PolarHBondContact O-N 3.24Å; H517-E519 PolarHBondContact O-N 3.49Å
518I87.3Confident86.6Confident6 Ų650.5 Ų50.53%0.03127%0.266CS..  trans-63.4136.4179.9-157.6164.3000111.3L514 Q523 K524 L527 L573 R576L514-I518 WeakPolarHBondContact O-CB 3.39Å; L514-I518 VanDerWaalsContact O-CG2 3.24Å; L514-I518 WeakPolarHBondContact O-CG2 3.41Å; L514-I518 PolarHBondContact O-N 3.43Å; I518-Q523 HydrophobicContact CD1-CB 3.96Å; I518-Q523 HydrophobicContact CG1-CB 4.06Å; I518-K524 HydrophobicContact CG2-CG 3.86Å; I518-K524 WeakPolarHBondContact O-CE 3.35Å; I518-L527 HydrophobicContact CD1-CB 4.39Å; I518-L527 HydrophobicContact CD1-CD2 4.02Å; I518-L527 HydrophobicContact CG2-CD2 3.97Å; I518-L573 HydrophobicContact CG2-CD1 3.92Å; I518-R576 PolarHBondContact O-NH1 3.18Å; I518-R576 PolarHBondContact O-NH2 3.03Å
519E82.3Confident86.8Confident149 Ų14950 Ų5070%0.69626%0.263SS*.  trans-118.2147.6-176.7-63.1-167.8161.800111.2H517 Q523H517-E519 PolarHBondContact O-N 3.49Å; E519-Q523 PolarHBondContact O-OE1 2.89Å
520G79.5Confident87Confident41 Ų4148.1 Ų48.142%0.42325%0.249SC..SBendtrans95.5133.4-176.800000114.2S522 Q523 K524G520-S522 PolarHBondContact O-N 2.92Å; G520-Q523 PolarHBondContact O-N 3.48Å; G520-K524 WeakPolarHBondContact O-CG 3.1Å; G520-K524 PolarHBondContact O-N 2.93Å
521E80.1Confident87.2Confident137 Ų13748 Ų4864%0.6425%0.248SC*.Hα-helixtrans-67.3-36.5-173.5-169.4177.8-177.900112.9N525E521-N525 WeakPolarHBondContact O-CB 3.5Å; E521-N525 PolarHBondContact O-N 3.4Å; E521-N525 PolarHBondContact O-ND2 2.99Å
522S79.1Confident87.1Confident93 Ų9348 Ų4865%0.6525%0.248SC*.Hα-helixtrans-65.5-40.8176.957.20000112.4G520 N525 D526G520-S522 PolarHBondContact O-N 2.92Å; S522-N525 PolarHBondContact O-N 3.24Å; S522-D526 PolarHBondContact O-N 3.07Å
523Q82.6Confident87.2Confident84 Ų8447.6 Ų47.639%0.39325%0.246SC..Hα-helixtrans-71.8-43.3179.4-64.8-176.7-100111.6I518 E519 G520 N525 D526 L527I518-Q523 HydrophobicContact CD1-CB 3.96Å; I518-Q523 HydrophobicContact CG1-CB 4.06Å; E519-Q523 PolarHBondContact O-OE1 2.89Å; G520-Q523 PolarHBondContact O-N 3.48Å; Q523-N525 VanDerWaalsContact C-N 3.29Å; Q523-N525 PolarHBondContact O-N 3.5Å; Q523-D526 PolarHBondContact O-N 3.48Å; Q523-L527 WeakPolarHBondContact O-CB 3.41Å; Q523-L527 PolarHBondContact O-N 2.93Å
524K86.6Confident87.3Confident37 Ų3746.2 Ų46.216%0.16124%0.239CC..Hα-helixtrans-57-43.8172.3-73.5177.7176.9-177.60111.7I518 G520 L527 L528 L573 R576 M577I518-K524 HydrophobicContact CG2-CG 3.86Å; I518-K524 WeakPolarHBondContact O-CE 3.35Å; G520-K524 WeakPolarHBondContact O-CG 3.1Å; G520-K524 PolarHBondContact O-N 2.93Å; K524-L527 PolarHBondContact O-N 2.88Å; K524-L528 WeakPolarHBondContact O-CB 3.28Å; K524-L528 PolarHBondContact O-N 3.1Å; K524-L573 HydrophobicContact CB-CD1 4.14Å; K524-L573 HydrophobicContact CG-CD1 3.97Å; K524-R576 PolarHBondContact NZ-O 3.39Å; K524-M577 HydrophobicContact CB-CG 4.26Å; K524-M577 HydrophobicContact CB-SD 3.89Å; K524-M577 HydrophobicContact CD-CG 4.11Å
525N86Confident87.3Confident54 Ų5446.2 Ų46.229%0.28924%0.239SC..Hα-helixtrans-65.3-41.4176.7-81.7-50.7000113E521 S522 Q523 L528 I529E521-N525 WeakPolarHBondContact O-CB 3.5Å; E521-N525 PolarHBondContact O-N 3.4Å; E521-N525 PolarHBondContact O-ND2 2.99Å; S522-N525 PolarHBondContact O-N 3.24Å; Q523-N525 VanDerWaalsContact C-N 3.29Å; Q523-N525 PolarHBondContact O-N 3.5Å; N525-L528 PolarHBondContact O-N 3.49Å; N525-I529 WeakPolarHBondContact O-CG1 3.2Å; N525-I529 PolarHBondContact O-N 3.27Å
526D86Confident87.1Confident54 Ų5446.8 Ų46.829%0.28924%0.242SC..Hα-helixtrans-65-43.8176-175.670.3000111.7Y472 S522 Q523 L528 I529 R530Y472-D526 WeakPolarHBondContact CE1-OD2 3.29Å; Y472-D526 PolarHBondContact OH-OD2 3.13Å; S522-D526 PolarHBondContact O-N 3.07Å; Q523-D526 PolarHBondContact O-N 3.48Å; D526-L528 PolarHBondContact O-N 3.38Å; D526-I529 PolarHBondContact O-N 3.21Å; D526-R530 WeakPolarHBondContact O-CG 3.36Å; D526-R530 PolarHBondContact O-N 3.18Å; D526-R530 IonicContact OD1-NE 2.7Å; D526-R530 IonicContact OD2-CZ 3.64Å; D526-R530 IonicContact OD2-NE 2.72Å; D526-R530 PolarHBondContact OD2-NE 3.15Å; D526-R530 IonicContact OD2-NH2 2.66Å
527L89.8Confident86.7Confident0 Ų046 Ų460%024%0.238CC..Hα-helixtrans-62.7-42177.1-172.463.8000111.6M476 L514 I518 Q523 K524 I529 R530 F531 L573M476-L527 HydrophobicContact CE-CD1 3.85Å; L514-L527 HydrophobicContact CB-CD2 4.16Å; I518-L527 HydrophobicContact CD1-CB 4.39Å; I518-L527 HydrophobicContact CD1-CD2 4.02Å; I518-L527 HydrophobicContact CG2-CD2 3.97Å; Q523-L527 WeakPolarHBondContact O-CB 3.41Å; Q523-L527 PolarHBondContact O-N 2.93Å; K524-L527 PolarHBondContact O-N 2.88Å; L527-I529 PolarHBondContact O-N 3.49Å; L527-R530 PolarHBondContact O-N 3.02Å; L527-F531 HydrophobicContact CD1-CD1 4.19Å; L527-F531 HydrophobicContact CD1-CE1 3.6Å; L527-F531 HydrophobicContact CD1-CE2 4.15Å; L527-F531 HydrophobicContact CD1-CZ 3.59Å; L527-F531 HydrophobicContact CD2-CE2 3.9Å; L527-F531 HydrophobicContact CD2-CZ 3.88Å; L527-F531 HydrophobicContact CG-CD2 4.18Å; L527-F531 HydrophobicContact CG-CE1 4.1Å; L527-F531 HydrophobicContact CG-CE2 3.72Å; L527-F531 HydrophobicContact CG-CZ 3.68Å; L527-F531 WeakPolarHBondContact O-CG 3.3Å; L527-F531 PolarHBondContact O-N 3.36Å; L527-L573 HydrophobicContact CB-CD2 4.05Å; L527-L573 HydrophobicContact CD2-CD1 4.28Å; L527-L573 HydrophobicContact CD2-CD2 4.01Å; L527-L573 HydrophobicContact CG-CD2 3.96Å
528L91.9Very high86.4Confident0 Ų041.8 Ų41.80%022%0.219CC..Hα-helixtrans-58.7-47.7174.5177.868.2000111.4K524 N525 D526 R530 F531 L532 I570 L573 M574 M577 I580 L587 F591K524-L528 WeakPolarHBondContact O-CB 3.28Å; K524-L528 PolarHBondContact O-N 3.1Å; N525-L528 PolarHBondContact O-N 3.49Å; D526-L528 PolarHBondContact O-N 3.38Å; L528-R530 VanDerWaalsContact C-N 3.29Å; L528-R530 PolarHBondContact O-N 3.25Å; L528-F531 PolarHBondContact O-N 3.18Å; L528-L532 HydrophobicContact CD1-CD1 4Å; L528-L532 HydrophobicContact CD1-CG 4.17Å; L528-L532 HydrophobicContact CG-CD1 3.98Å; L528-L532 HydrophobicContact CG-CG 4.48Å; L528-L532 WeakPolarHBondContact O-CG 3.17Å; L528-L532 PolarHBondContact O-N 3.46Å; L528-I570 HydrophobicContact CD1-CG2 4.27Å; L528-L573 HydrophobicContact CB-CD2 3.97Å; L528-M574 HydrophobicContact CD1-CG 3.83Å; L528-M574 HydrophobicContact CD1-SD 3.91Å; L528-M577 HydrophobicContact CB-CE 4.17Å; L528-M577 HydrophobicContact CD1-CE 4.1Å; L528-M577 HydrophobicContact CD2-CE 3.74Å; L528-M577 HydrophobicContact CD2-SD 4.49Å; L528-M577 HydrophobicContact CG-CE 4.2Å; L528-I580 HydrophobicContact CD2-CD1 3.89Å; L528-L587 HydrophobicContact CD2-CD1 3.96Å; L528-L587 HydrophobicContact CD2-CD2 4.33Å; L528-L587 HydrophobicContact CG-CD1 4.3Å; L528-F591 HydrophobicContact CD1-CZ 4.42Å; L528-F591 HydrophobicContact CD2-CE2 4.15Å; L528-F591 HydrophobicContact CD2-CZ 4.01Å
529I90.5Very high86Confident27 Ų2741.8 Ų41.814%0.13822%0.221CC..Hα-helixtrans-58.5-44.8177.7-71.2167.2000110.1N525 D526 L527 L532 E533 L587 L590N525-I529 WeakPolarHBondContact O-CG1 3.2Å; N525-I529 PolarHBondContact O-N 3.27Å; D526-I529 PolarHBondContact O-N 3.21Å; L527-I529 PolarHBondContact O-N 3.49Å; I529-L532 PolarHBondContact O-N 3.32Å; I529-E533 HydrophobicContact CG2-CG 4.43Å; I529-E533 VanDerWaalsContact O-CB 3.3Å; I529-E533 WeakPolarHBondContact O-CB 3.23Å; I529-E533 VanDerWaalsContact O-CG 3.27Å; I529-E533 WeakPolarHBondContact O-CG 3.35Å; I529-E533 PolarHBondContact O-N 3.07Å; I529-L587 HydrophobicContact CG1-CD1 4.03Å; I529-L590 HydrophobicContact CG2-CD1 4Å
530R89.6Confident85.8Confident51 Ų5138.1 Ų38.119%0.19221%0.205CC..Hα-helixtrans-64.8-42.3178.9-70.8176.2-174.6-85.7-0.4112.9M476 D526 L527 L528 E533 L534M476-R530 HydrophobicContact CE-CB 4.32Å; D526-R530 WeakPolarHBondContact O-CG 3.36Å; D526-R530 PolarHBondContact O-N 3.18Å; D526-R530 IonicContact OD1-NE 2.7Å; D526-R530 IonicContact OD2-CZ 3.64Å; D526-R530 IonicContact OD2-NE 2.72Å; D526-R530 PolarHBondContact OD2-NE 3.15Å; D526-R530 IonicContact OD2-NH2 2.66Å; L527-R530 PolarHBondContact O-N 3.02Å; L528-R530 VanDerWaalsContact C-N 3.29Å; L528-R530 PolarHBondContact O-N 3.25Å; R530-E533 PolarHBondContact O-N 2.99Å; R530-L534 VanDerWaalsContact O-CB 3.3Å; R530-L534 WeakPolarHBondContact O-CB 3.27Å; R530-L534 PolarHBondContact O-N 3.2Å
531F92.5Very high85.4Confident1 Ų138.4 Ų38.40%0.00420%0.196CC..Hα-helixtrans-65-44.7177.5-72.6-14.9000112.1Y511 A515 L527 L528 E533 L534 F535 A569 I570 L573Y511-F531 AromaticContact CD1-CE1 3.5Å; Y511-F531 HydrophobicContact CD1-CE1 3.5Å; Y511-F531 VanDerWaalsContact CD1-CE1 3.5Å; Y511-F531 HydrophobicContact CD1-CZ 4.11Å; Y511-F531 HydrophobicContact CD2-CE1 4.49Å; Y511-F531 HydrophobicContact CE1-CE1 4.01Å; Y511-F531 AromaticContact CG-CE1 3.75Å; Y511-F531 HydrophobicContact CG-CE1 3.75Å; Y511-F531 HydrophobicContact CG-CZ 4.2Å; A515-F531 HydrophobicContact CB-CE2 4.17Å; L527-F531 HydrophobicContact CD1-CD1 4.19Å; L527-F531 HydrophobicContact CD1-CE1 3.6Å; L527-F531 HydrophobicContact CD1-CE2 4.15Å; L527-F531 HydrophobicContact CD1-CZ 3.59Å; L527-F531 HydrophobicContact CD2-CE2 3.9Å; L527-F531 HydrophobicContact CD2-CZ 3.88Å; L527-F531 HydrophobicContact CG-CD2 4.18Å; L527-F531 HydrophobicContact CG-CE1 4.1Å; L527-F531 HydrophobicContact CG-CE2 3.72Å; L527-F531 HydrophobicContact CG-CZ 3.68Å; L527-F531 WeakPolarHBondContact O-CG 3.3Å; L527-F531 PolarHBondContact O-N 3.36Å; L528-F531 PolarHBondContact O-N 3.18Å; F531-E533 VanDerWaalsContact C-N 3.33Å; F531-L534 PolarHBondContact O-N 3.18Å; F531-F535 WeakPolarHBondContact O-CB 3.3Å; F531-F535 PolarHBondContact O-N 3.48Å; F531-A569 HydrophobicContact CE2-CB 4.26Å; F531-I570 HydrophobicContact CB-CD1 4.34Å; F531-I570 HydrophobicContact CB-CG1 3.8Å; F531-I570 HydrophobicContact CD2-CG1 4.17Å; F531-I570 HydrophobicContact CG-CG1 4.36Å; F531-L573 HydrophobicContact CD2-CD2 4.01Å; F531-L573 HydrophobicContact CE2-CD2 4.12Å
532L91.8Very high84.8Confident0 Ų031.9 Ų31.90%017%0.166CC..Hα-helixtrans-66.6-37.3176.3-65.6172.5000111.5L528 I529 F535 V536 I570 L587 L590 F591 F594L528-L532 HydrophobicContact CD1-CD1 4Å; L528-L532 HydrophobicContact CD1-CG 4.17Å; L528-L532 HydrophobicContact CG-CD1 3.98Å; L528-L532 HydrophobicContact CG-CG 4.48Å; L528-L532 WeakPolarHBondContact O-CG 3.17Å; L528-L532 PolarHBondContact O-N 3.46Å; I529-L532 PolarHBondContact O-N 3.32Å; L532-F535 PolarHBondContact O-N 2.9Å; L532-V536 WeakPolarHBondContact O-CB 3.3Å; L532-V536 VanDerWaalsContact O-CG2 3.27Å; L532-V536 WeakPolarHBondContact O-CG2 3.18Å; L532-V536 PolarHBondContact O-N 3.48Å; L532-I570 HydrophobicContact CD2-CD1 4.36Å; L532-L587 HydrophobicContact CD1-CD1 3.67Å; L532-L590 HydrophobicContact CB-CB 3.9Å; L532-L590 HydrophobicContact CB-CD1 4.26Å; L532-L590 HydrophobicContact CB-CG 4.48Å; L532-L590 HydrophobicContact CD1-CB 4.16Å; L532-F591 HydrophobicContact CD1-CD1 4.23Å; L532-F591 HydrophobicContact CD1-CD2 4.14Å; L532-F591 HydrophobicContact CD1-CE1 4.07Å; L532-F591 HydrophobicContact CD1-CE2 3.99Å; L532-F591 HydrophobicContact CD1-CG 4.26Å; L532-F591 HydrophobicContact CD1-CZ 3.95Å; L532-F594 HydrophobicContact CD2-CB 3.94Å; L532-F594 HydrophobicContact CD2-CD2 3.86Å; L532-F594 HydrophobicContact CD2-CG 3.83Å
533E90Very high84.1Confident42 Ų4229.3 Ų29.320%0.19614%0.142CC..Hα-helixtrans-63.2-46.3173.9-82.5176.3174.800112.3I529 R530 F531 F535 V536 Q537 R586 L590I529-E533 HydrophobicContact CG2-CG 4.43Å; I529-E533 VanDerWaalsContact O-CB 3.3Å; I529-E533 WeakPolarHBondContact O-CB 3.23Å; I529-E533 VanDerWaalsContact O-CG 3.27Å; I529-E533 WeakPolarHBondContact O-CG 3.35Å; I529-E533 PolarHBondContact O-N 3.07Å; R530-E533 PolarHBondContact O-N 2.99Å; F531-E533 VanDerWaalsContact C-N 3.33Å; E533-F535 VanDerWaalsContact C-N 3.32Å; E533-F535 PolarHBondContact O-N 3.41Å; E533-V536 PolarHBondContact O-N 3.28Å; E533-Q537 VanDerWaalsContact O-CB 3.23Å; E533-Q537 WeakPolarHBondContact O-CB 3.3Å; E533-Q537 WeakPolarHBondContact O-CG 3.36Å; E533-Q537 PolarHBondContact O-N 3.13Å; E533-R586 IonicContact OE1-CZ 3.69Å; E533-R586 IonicContact OE1-NE 3.79Å; E533-R586 PolarHBondContact OE1-NE 3.18Å; E533-R586 IonicContact OE1-NH2 3.8Å; E533-R586 PolarHBondContact OE1-NH2 3.15Å; E533-R586 IonicContact OE2-CZ 3.54Å; E533-R586 IonicContact OE2-NH2 2.95Å; E533-R586 PolarHBondContact OE2-NH2 3.48Å; E533-L590 HydrophobicContact CB-CD2 4.45Å; E533-L590 HydrophobicContact CG-CD1 3.69Å; E533-L590 HydrophobicContact CG-CD2 3.55Å; E533-L590 HydrophobicContact CG-CG 4.26Å
534L89Confident83.2Confident0 Ų032.5 Ų32.50%015%0.151CC..Hα-helixtrans-60.4-44.8176.1-178.561.7000110.6N480 T483 M484 Y511 R530 F531 V536 Q537 L538 L566N480-L534 HydrophobicContact CB-CD1 4.43Å; T483-L534 HydrophobicContact CG2-CD1 4.43Å; T483-L534 HydrophobicContact CG2-CD2 4.23Å; M484-L534 HydrophobicContact CG-CD1 4.29Å; Y511-L534 HydrophobicContact CE2-CD2 3.73Å; Y511-L534 WeakPolarHBondContact OH-CD2 3.48Å; R530-L534 VanDerWaalsContact O-CB 3.3Å; R530-L534 WeakPolarHBondContact O-CB 3.27Å; R530-L534 PolarHBondContact O-N 3.2Å; F531-L534 PolarHBondContact O-N 3.18Å; L534-V536 PolarHBondContact O-N 3.3Å; L534-Q537 PolarHBondContact O-N 3.1Å; L534-L538 HydrophobicContact CD1-CD1 4.21Å; L534-L538 HydrophobicContact CD1-CG 4.28Å; L534-L538 HydrophobicContact CG-CD1 4.02Å; L534-L538 WeakPolarHBondContact O-CB 3.03Å; L534-L538 WeakPolarHBondContact O-CG 3.39Å; L534-L538 PolarHBondContact O-N 3.4Å; L534-L566 HydrophobicContact CD2-CD1 3.98Å; L534-L566 HydrophobicContact CD2-CD2 4.26Å; L534-L566 HydrophobicContact CG-CD1 3.96Å
535F89.7Confident81.9Confident0 Ų031.8 Ų31.80%015%0.149CC..Hα-helixtrans-59.1-47.8176.5-170.5-82.8000111.9F531 L532 E533 G539 L563 L566 I567 I570 F594 Y597 F603F531-F535 WeakPolarHBondContact O-CB 3.3Å; F531-F535 PolarHBondContact O-N 3.48Å; L532-F535 PolarHBondContact O-N 2.9Å; E533-F535 VanDerWaalsContact C-N 3.32Å; E533-F535 PolarHBondContact O-N 3.41Å; F535-G539 PolarHBondContact O-N 2.8Å; F535-L563 HydrophobicContact CD1-CD2 4.27Å; F535-L563 HydrophobicContact CD2-CD2 4.13Å; F535-L563 HydrophobicContact CE1-CD2 4.35Å; F535-L563 HydrophobicContact CE2-CB 3.9Å; F535-L563 HydrophobicContact CE2-CD2 4.21Å; F535-L563 WeakPolarHBondContact CE2-O 3.47Å; F535-L563 HydrophobicContact CG-CD2 4.17Å; F535-L563 HydrophobicContact CZ-CB 4.09Å; F535-L563 HydrophobicContact CZ-CD2 4.32Å; F535-L563 WeakPolarHBondContact O-CD2 3.25Å; F535-L566 HydrophobicContact CB-CD1 4.43Å; F535-L566 HydrophobicContact CD2-CB 4.23Å; F535-L566 HydrophobicContact CD2-CD1 4.47Å; F535-I567 HydrophobicContact CE2-CD1 4.49Å; F535-I567 HydrophobicContact CE2-CG1 3.99Å; F535-I570 HydrophobicContact CD2-CD1 4.39Å; F535-F594 AromaticContact CD1-CD2 3.59Å; F535-F594 HydrophobicContact CD1-CD2 3.59Å; F535-F594 HydrophobicContact CD1-CE2 4.3Å; F535-F594 HydrophobicContact CD1-CG 4.5Å; F535-F594 HydrophobicContact CD2-CD2 4.22Å; F535-F594 HydrophobicContact CD2-CE2 4.2Å; F535-F594 AromaticContact CE1-CD2 3.61Å; F535-F594 HydrophobicContact CE1-CD2 3.61Å; F535-F594 HydrophobicContact CE1-CE2 4.08Å; F535-F594 HydrophobicContact CE1-CG 4.47Å; F535-F594 HydrophobicContact CE2-CD2 4.23Å; F535-F594 AromaticContact CE2-CE2 3.98Å; F535-F594 HydrophobicContact CE2-CE2 3.98Å; F535-F594 AromaticContact CG-CD2 3.9Å; F535-F594 HydrophobicContact CG-CD2 3.9Å; F535-F594 HydrophobicContact CG-CE2 4.35Å; F535-F594 AromaticContact CZ-CD2 3.94Å; F535-F594 HydrophobicContact CZ-CD2 3.94Å; F535-F594 AromaticContact CZ-CE2 3.92Å; F535-F594 HydrophobicContact CZ-CE2 3.92Å; F535-Y597 HydrophobicContact CE1-CG 4.49Å; F535-F603 HydrophobicContact CZ-CE2 4.32Å
536V86.1Confident80.5Confident12 Ų1232.6 Ų32.67%0.07316%0.158CC..Hα-helixtrans-69.1-38.7179.61730000111.8L532 E533 L534 G539 L540 L590 D593 Y597 A643L532-V536 WeakPolarHBondContact O-CB 3.3Å; L532-V536 VanDerWaalsContact O-CG2 3.27Å; L532-V536 WeakPolarHBondContact O-CG2 3.18Å; L532-V536 PolarHBondContact O-N 3.48Å; E533-V536 PolarHBondContact O-N 3.28Å; L534-V536 PolarHBondContact O-N 3.3Å; V536-G539 PolarHBondContact O-N 2.95Å; V536-L540 HydrophobicContact CG1-CD1 4.15Å; V536-L540 HydrophobicContact CG1-CG 4.5Å; V536-L540 WeakPolarHBondContact O-CG 3.37Å; V536-L540 PolarHBondContact O-N 3.31Å; V536-L590 HydrophobicContact CG2-CD2 4.33Å; V536-D593 HydrophobicContact CG1-CB 4.11Å; V536-D593 HydrophobicContact CG2-CB 3.7Å; V536-Y597 HydrophobicContact CG1-CE2 4.43Å; V536-A643 HydrophobicContact CG1-CB 4.4Å
537Q83.2Confident79.1Confident88 Ų8835.5 Ų35.541%0.41117%0.17SC..Hα-helixtrans-63.4-45.1176.1-77.8174.85.800111.7E533 L534 G539 L540 E541E533-Q537 VanDerWaalsContact O-CB 3.23Å; E533-Q537 WeakPolarHBondContact O-CB 3.3Å; E533-Q537 WeakPolarHBondContact O-CG 3.36Å; E533-Q537 PolarHBondContact O-N 3.13Å; L534-Q537 PolarHBondContact O-N 3.1Å; Q537-G539 VanDerWaalsContact C-N 3.32Å; Q537-G539 PolarHBondContact O-N 3.34Å; Q537-L540 PolarHBondContact O-N 3.39Å; Q537-E541 WeakPolarHBondContact O-CB 3.34Å; Q537-E541 PolarHBondContact O-N 3.45Å
538L81.6Confident77.4Confident1 Ų144.1 Ų44.11%0.00521%0.208CC..Hα-helixtrans-58.3-46.5172.5-72167.7000109.8T483 M484 W487 L534 L540 E541 G542 L563 L566T483-L538 HydrophobicContact CG2-CD1 4.23Å; M484-L538 HydrophobicContact CG-CD2 4.5Å; M484-L538 HydrophobicContact SD-CD2 3.5Å; M484-L538 WeakPolarHBondContact SD-CD2 3.05Å; M484-L538 HydrophobicContact SD-CG 3.98Å; W487-L538 HydrophobicContact CB-CD2 4Å; W487-L538 HydrophobicContact CD2-CD2 3.65Å; W487-L538 HydrophobicContact CE3-CD2 4.03Å; W487-L538 HydrophobicContact CG-CD2 3.65Å; W487-L538 WeakPolarHBondContact CH2-O 3.48Å; W487-L538 HydrophobicContact CZ2-CB 4.44Å; L534-L538 HydrophobicContact CD1-CD1 4.21Å; L534-L538 HydrophobicContact CD1-CG 4.28Å; L534-L538 HydrophobicContact CG-CD1 4.02Å; L534-L538 WeakPolarHBondContact O-CB 3.03Å; L534-L538 WeakPolarHBondContact O-CG 3.39Å; L534-L538 PolarHBondContact O-N 3.4Å; L538-L540 PolarHBondContact O-N 2.85Å; L538-E541 PolarHBondContact O-N 3.33Å; L538-G542 PolarHBondContact O-N 3.41Å; L538-L563 HydrophobicContact CB-CD2 3.55Å; L538-L563 HydrophobicContact CD1-CD2 4.48Å; L538-L566 HydrophobicContact CD1-CD1 3.66Å
539G78.4Confident75.1Confident7 Ų746.7 Ų46.77%0.07222%0.221CC..Hα-helixtrans-57-45.3176.800000113.7F535 V536 Q537 G542 K543F535-G539 PolarHBondContact O-N 2.8Å; V536-G539 PolarHBondContact O-N 2.95Å; Q537-G539 VanDerWaalsContact C-N 3.32Å; Q537-G539 PolarHBondContact O-N 3.34Å; G539-G542 PolarHBondContact O-N 3.4Å; G539-K543 PolarHBondContact O-N 3.5Å
540L77.8Confident73Confident72 Ų7251.2 Ų51.238%0.37726%0.255SS..Hα-helixtrans-66.6-42.9179.8-75.1170.2000112.8V536 Q537 L538 G542 K543 R544 Y597 A643V536-L540 HydrophobicContact CG1-CD1 4.15Å; V536-L540 HydrophobicContact CG1-CG 4.5Å; V536-L540 WeakPolarHBondContact O-CG 3.37Å; V536-L540 PolarHBondContact O-N 3.31Å; Q537-L540 PolarHBondContact O-N 3.39Å; L538-L540 PolarHBondContact O-N 2.85Å; L540-G542 VanDerWaalsContact C-N 3.28Å; L540-G542 PolarHBondContact O-N 2.87Å; L540-K543 WeakPolarHBondContact O-CB 3.3Å; L540-K543 PolarHBondContact O-N 2.99Å; L540-R544 PolarHBondContact O-N 3.15Å; L540-Y597 PolarHBondContact N-OH 3.16Å; L540-A643 HydrophobicContact CD2-CB 3.99Å; L540-A643 HydrophobicContact CG-CB 4.44Å
541E72Confident70.9Confident46 Ų4651.5 Ų51.522%0.21527%0.265CS..Hα-helixtrans-70-31.2-178.6-161.860.9-15600111.1M484 W487 L488 Q537 L538 K543 R544 I545M484-E541 HydrophobicContact CE-CB 4.27Å; M484-E541 HydrophobicContact CE-CG 4.33Å; W487-E541 HydrophobicContact CZ3-CB 3.89Å; W487-E541 HydrophobicContact CZ3-CG 4.28Å; L488-E541 HydrophobicContact CD2-CG 3.81Å; Q537-E541 WeakPolarHBondContact O-CB 3.34Å; Q537-E541 PolarHBondContact O-N 3.45Å; L538-E541 PolarHBondContact O-N 3.33Å; E541-K543 VanDerWaalsContact C-N 3.33Å; E541-K543 PolarHBondContact O-N 2.86Å; E541-R544 WeakPolarHBondContact O-CB 2.89Å; E541-R544 PolarHBondContact O-N 2.96Å; E541-R544 IonicContact OE2-CZ 3.83Å; E541-R544 IonicContact OE2-NH1 3.48Å; E541-R544 PolarHBondContact OE2-NH1 2.89Å; E541-I545 WeakPolarHBondContact O-CD1 3.33Å; E541-I545 VanDerWaalsContact O-CG1 3.3Å; E541-I545 WeakPolarHBondContact O-CG1 3.36Å; E541-I545 PolarHBondContact O-N 3.32Å; E541-I545 VanDerWaalsContact O-N 3.14Å
542G67.1Low68.5Low1 Ų157 Ų571%0.0130%0.299CS..Hα-helixtrans-68.4-36.417700000112.8L538 G539 L540 I545 S546 N559L538-G542 PolarHBondContact O-N 3.41Å; G539-G542 PolarHBondContact O-N 3.4Å; L540-G542 VanDerWaalsContact C-N 3.28Å; L540-G542 PolarHBondContact O-N 2.87Å; G542-I545 PolarHBondContact O-N 3.02Å; G542-S546 VanDerWaalsContact O-CB 3.26Å; G542-S546 WeakPolarHBondContact O-CB 3.48Å; G542-S546 PolarHBondContact O-N 3.08Å; G542-N559 WeakPolarHBondContact CA-ND2 3.36Å; G542-N559 PolarHBondContact O-ND2 2.93Å; G542-N559 VanDerWaalsContact O-ND2 3.15Å
543K63Low66.2Low38 Ų3861.4 Ų61.417%0.16534%0.335CS..Hα-helixtrans-61.3-49.3171.2-176.2172.8178.1158.80111.1G539 L540 E541 I545 S546 E547 S645 S648G539-K543 PolarHBondContact O-N 3.5Å; L540-K543 WeakPolarHBondContact O-CB 3.3Å; L540-K543 PolarHBondContact O-N 2.99Å; E541-K543 VanDerWaalsContact C-N 3.33Å; E541-K543 PolarHBondContact O-N 2.86Å; K543-I545 PolarHBondContact O-N 3.33Å; K543-S546 WeakPolarHBondContact O-CB 3.49Å; K543-S546 PolarHBondContact O-N 3.13Å; K543-S546 VanDerWaalsContact O-N 3.15Å; K543-E547 WeakPolarHBondContact CE-OE1 3.17Å; K543-E547 IonicContact NZ-OE1 3.38Å; K543-E547 WeakPolarHBondContact O-CG 3.03Å; K543-E547 PolarHBondContact O-N 2.93Å; K543-S645 PolarHBondContact NZ-O 2.63Å; K543-S645 PolarHBondContact NZ-OG 2.7Å; K543-S648 WeakPolarHBondContact CE-OG 3.32Å; K543-S648 PolarHBondContact NZ-OG 3.14Å
544R65.1Low63.8Low152 Ų15266.9 Ų66.957%0.57437%0.365SS*.Hα-helixtrans-56.8-35.8178.2-77.3-178.7-177.8158.9-3.4113.1L540 E541L540-R544 PolarHBondContact O-N 3.15Å; E541-R544 WeakPolarHBondContact O-CB 2.89Å; E541-R544 PolarHBondContact O-N 2.96Å; E541-R544 IonicContact OE2-CZ 3.83Å; E541-R544 IonicContact OE2-NH1 3.48Å; E541-R544 PolarHBondContact OE2-NH1 2.89Å
545I58Low61.5Low21 Ų2170.4 Ų70.411%0.10838%0.38CS..Hα-helixtrans-77.9-41178.7-61162.3000111W487 L488 Y491 E541 G542 K543 E547 K548 I549W487-I545 HydrophobicContact CZ3-CD1 4.08Å; L488-I545 HydrophobicContact CD2-CD1 3.31Å; L488-I545 HydrophobicContact CD2-CG1 4.35Å; Y491-I545 VanDerWaalsContact CB-CG2 3.49Å; Y491-I545 HydrophobicContact CD1-CG2 3.63Å; Y491-I545 HydrophobicContact CD2-CD1 3.89Å; Y491-I545 HydrophobicContact CD2-CG2 3.95Å; Y491-I545 HydrophobicContact CE1-CG2 4.4Å; Y491-I545 HydrophobicContact CE2-CD1 4.49Å; Y491-I545 HydrophobicContact CG-CB 4.46Å; Y491-I545 HydrophobicContact CG-CD1 4.39Å; Y491-I545 HydrophobicContact CG-CG2 3.4Å; E541-I545 WeakPolarHBondContact O-CD1 3.33Å; E541-I545 VanDerWaalsContact O-CG1 3.3Å; E541-I545 WeakPolarHBondContact O-CG1 3.36Å; E541-I545 PolarHBondContact O-N 3.32Å; E541-I545 VanDerWaalsContact O-N 3.14Å; G542-I545 PolarHBondContact O-N 3.02Å; K543-I545 PolarHBondContact O-N 3.33Å; I545-E547 VanDerWaalsContact C-N 3.3Å; I545-E547 PolarHBondContact O-N 3.42Å; I545-K548 PolarHBondContact O-N 3.44Å; I545-K548 VanDerWaalsContact O-N 3.1Å; I545-I549 HydrophobicContact CG2-CD1 3.75Å; I545-I549 WeakPolarHBondContact O-CG1 3.36Å; I545-I549 PolarHBondContact O-N 3.24Å
546S56.8Low59.4Low71 Ų7173.1 Ų73.150%0.49740%0.402SS..Hα-helixtrans-54.6-45.2172.8137.60000111.6G542 K543 K548 I549G542-S546 VanDerWaalsContact O-CB 3.26Å; G542-S546 WeakPolarHBondContact O-CB 3.48Å; G542-S546 PolarHBondContact O-N 3.08Å; K543-S546 WeakPolarHBondContact O-CB 3.49Å; K543-S546 PolarHBondContact O-N 3.13Å; K543-S546 VanDerWaalsContact O-N 3.15Å; S546-K548 PolarHBondContact O-N 3.19Å; S546-I549 PolarHBondContact O-N 3.46Å
547E56.6Low57.8Low115 Ų11575.7 Ų75.754%0.53742%0.421SS..Hα-helixtrans-64.4-26.9178.3-73.5173.7176.800113.3K543 I545K543-E547 WeakPolarHBondContact CE-OE1 3.17Å; K543-E547 IonicContact NZ-OE1 3.38Å; K543-E547 WeakPolarHBondContact O-CG 3.03Å; K543-E547 PolarHBondContact O-N 2.93Å; I545-E547 VanDerWaalsContact C-N 3.3Å; I545-E547 PolarHBondContact O-N 3.42Å
548K54.2Low56.7Low182 Ų18275.9 Ų75.979%0.79142%0.424SS*.Hα-helixtrans-83.3-17.8177-74.3-179.4179.8178.40113.8I545 S546I545-K548 PolarHBondContact O-N 3.44Å; I545-K548 VanDerWaalsContact O-N 3.1Å; S546-K548 PolarHBondContact O-N 3.19Å
549I44.9Very low55.9Low53 Ų5376.8 Ų76.827%0.27243%0.429SS..SBendtrans-126.896.9-169.4-51.7174.5000109.9Y491 I545 S546 S551 K555Y491-I549 HydrophobicContact CD1-CD1 4.47Å; I545-I549 HydrophobicContact CG2-CD1 3.75Å; I545-I549 WeakPolarHBondContact O-CG1 3.36Å; I545-I549 PolarHBondContact O-N 3.24Å; S546-I549 PolarHBondContact O-N 3.46Å; I549-S551 PolarHBondContact O-N 3.46Å; I549-K555 HydrophobicContact CG2-CD 4.3Å
550S44.9Very low55.3Low122 Ų12276.5 Ų76.585%0.85343%0.427SS*.  trans-67.121.6-166.670.70000118
551S45.7Very low55Low58 Ų5873.9 Ų73.941%0.40642%0.416SS..  trans-110.996-179.5700000111I549 K555I549-S551 PolarHBondContact O-N 3.46Å; S551-K555 WeakPolarHBondContact OG-CD 3.44Å; S551-K555 VanDerWaalsContact OG-CE 3.3Å; S551-K555 WeakPolarHBondContact OG-CE 3.38Å; S551-K555 PolarHBondContact OG-NZ 3.25Å
552V42.9Very low55Low117 Ų11774.7 Ų74.771%0.70942%0.423SS*.  trans-83.9-25.8-152.4175.90000116
553A42.9Very low55.7Low92 Ų9274.9 Ų74.976%0.7642%0.423SS*.THydrogen-bonded Turntrans-92.9-43-167.600000115.9
554L39.1Very low56.7Low157 Ų15773 Ų7382%0.82242%0.415SS*.THydrogen-bonded Turntrans-81.4-15.5-175.2-13485.7000113.7
555K42.1Very low57.7Low74 Ų7468 Ų6832%0.32240%0.401SS..Hα-helixtrans-93.8-22.7-171.6-73.8-178.8179.5160.30114.6Y491 I549 S551 S557 N558 N559Y491-K555 HydrophobicContact CE1-CB 4.46Å; Y491-K555 PolarHBondContact OH-O 3.48Å; I549-K555 HydrophobicContact CG2-CD 4.3Å; S551-K555 WeakPolarHBondContact OG-CD 3.44Å; S551-K555 VanDerWaalsContact OG-CE 3.3Å; S551-K555 WeakPolarHBondContact OG-CE 3.38Å; S551-K555 PolarHBondContact OG-NZ 3.25Å; K555-S557 PolarHBondContact O-N 3.03Å; K555-N558 PolarHBondContact O-N 3.47Å; K555-N559 PolarHBondContact O-N 3.14Å
556A45.6Very low59.1Low56 Ų5667.2 Ų67.246%0.46340%0.397SS..Hα-helixtrans-62.7-34.2173.100000111.9N559 A560A556-N559 PolarHBondContact O-N 3.19Å; A556-A560 WeakPolarHBondContact O-CB 3.47Å; A556-A560 PolarHBondContact O-N 3.09Å; A556-A560 VanDerWaalsContact O-N 3.08Å
557S52.8Low60.8Low66 Ų6663.8 Ų63.846%0.46237%0.373SS..Hα-helixtrans-63.9-40.4177.8-179.70000113K555 A560 G561 W611K555-S557 PolarHBondContact O-N 3.03Å; S557-A560 PolarHBondContact O-N 3.01Å; S557-G561 PolarHBondContact O-N 3.25Å; S557-W611 WeakPolarHBondContact O-CH2 3.43Å
558N60.2Low62.4Low92 Ų9259.5 Ų59.549%0.49236%0.355SS..Hα-helixtrans-66.9-42.3177-81.3-3.5000112.4K555 G561 N562K555-N558 PolarHBondContact O-N 3.47Å; N558-G561 PolarHBondContact O-N 3.21Å; N558-N562 VanDerWaalsContact O-CG 3.26Å; N558-N562 PolarHBondContact O-N 3.35Å; N558-N562 VanDerWaalsContact O-N 3.13Å; N558-N562 PolarHBondContact O-ND2 2.95Å
559N63.2Low64.1Low20 Ų2051 Ų5111%0.10732%0.319CS..Hα-helixtrans-60-46.2175.7-97.8-13.2000111.7W487 Y491 G542 K555 A556 L563W487-N559 WeakPolarHBondContact CH2-OD1 3.24Å; W487-N559 WeakPolarHBondContact CZ2-OD1 3.14Å; Y491-N559 WeakPolarHBondContact CE2-OD1 3.4Å; Y491-N559 WeakPolarHBondContact OH-CB 3.17Å; Y491-N559 PolarHBondContact OH-N 3.01Å; Y491-N559 PolarHBondContact OH-ND2 3.48Å; Y491-N559 PolarHBondContact OH-OD1 3.38Å; G542-N559 WeakPolarHBondContact CA-ND2 3.36Å; G542-N559 PolarHBondContact O-ND2 2.93Å; G542-N559 VanDerWaalsContact O-ND2 3.15Å; K555-N559 PolarHBondContact O-N 3.14Å; A556-N559 PolarHBondContact O-N 3.19Å; N559-L563 PolarHBondContact O-N 3.04Å
560A65.9Low66.4Low2 Ų248.4 Ų48.42%0.01731%0.306CS..Hα-helixtrans-69.6-42.7178.800000112.1A556 S557 N562 L563 G564 L601 F603 W611A556-A560 WeakPolarHBondContact O-CB 3.47Å; A556-A560 PolarHBondContact O-N 3.09Å; A556-A560 VanDerWaalsContact O-N 3.08Å; S557-A560 PolarHBondContact O-N 3.01Å; A560-N562 PolarHBondContact O-N 3.35Å; A560-L563 PolarHBondContact O-N 3.3Å; A560-L563 VanDerWaalsContact O-N 3.09Å; A560-G564 PolarHBondContact O-N 2.8Å; A560-L601 HydrophobicContact CB-CB 4.07Å; A560-L601 HydrophobicContact CB-CD1 3.98Å; A560-L601 HydrophobicContact CB-CD2 4.14Å; A560-L601 HydrophobicContact CB-CG 4.27Å; A560-F603 HydrophobicContact CB-CE1 4.37Å; A560-F603 HydrophobicContact CB-CZ 3.9Å; A560-F603 WeakPolarHBondContact O-CZ 3.43Å; A560-W611 HydrophobicContact CB-CH2 3.19Å; A560-W611 HydrophobicContact CB-CZ2 3.28Å; A560-W611 HydrophobicContact CB-CZ3 4.1Å
561G71.4Confident68.7Low16 Ų1642.9 Ų42.917%0.16527%0.267CS..Hα-helixtrans-52-43.9174.900000112.1S557 N558 G564 V565 W615S557-G561 PolarHBondContact O-N 3.25Å; N558-G561 PolarHBondContact O-N 3.21Å; G561-G564 PolarHBondContact O-N 3.48Å; G561-V565 WeakPolarHBondContact O-CG2 3.4Å; G561-W615 WeakPolarHBondContact O-CH2 3.47Å
562N73.4Confident70.9Confident64 Ų6442.1 Ų42.134%0.34226%0.26SS..Hα-helixtrans-72.2-34.4179.5-69.7-24.9000114.8W487 N558 A560 G564W487-N562 HydrophobicContact CG-CB 4.49Å; W487-N562 PolarHBondContact NE1-ND2 2.89Å; N558-N562 VanDerWaalsContact O-CG 3.26Å; N558-N562 PolarHBondContact O-N 3.35Å; N558-N562 VanDerWaalsContact O-N 3.13Å; N558-N562 PolarHBondContact O-ND2 2.95Å; A560-N562 PolarHBondContact O-N 3.35Å; N562-G564 VanDerWaalsContact C-N 3.35Å
563L81.5Confident73.3Confident4 Ų436.5 Ų36.52%0.02123%0.226CC..Hα-helixtrans-65.5-41.6173.2-76.8168.7000111F535 L538 N559 A560 V565 L566 L601 F603F535-L563 HydrophobicContact CD1-CD2 4.27Å; F535-L563 HydrophobicContact CD2-CD2 4.13Å; F535-L563 HydrophobicContact CE1-CD2 4.35Å; F535-L563 HydrophobicContact CE2-CB 3.9Å; F535-L563 HydrophobicContact CE2-CD2 4.21Å; F535-L563 WeakPolarHBondContact CE2-O 3.47Å; F535-L563 HydrophobicContact CG-CD2 4.17Å; F535-L563 HydrophobicContact CZ-CB 4.09Å; F535-L563 HydrophobicContact CZ-CD2 4.32Å; F535-L563 WeakPolarHBondContact O-CD2 3.25Å; L538-L563 HydrophobicContact CB-CD2 3.55Å; L538-L563 HydrophobicContact CD1-CD2 4.48Å; N559-L563 PolarHBondContact O-N 3.04Å; A560-L563 PolarHBondContact O-N 3.3Å; A560-L563 VanDerWaalsContact O-N 3.09Å; L563-V565 PolarHBondContact O-N 3.13Å; L563-L566 PolarHBondContact O-N 3.05Å; L563-L566 VanDerWaalsContact O-N 3.15Å; L563-L601 HydrophobicContact CD1-CD1 3.42Å; L563-L601 VanDerWaalsContact CD1-CD1 3.42Å; L563-F603 HydrophobicContact CB-CE2 4.29Å; L563-F603 HydrophobicContact CB-CZ 4.33Å
564G83.7Confident75.6Confident0 Ų032.1 Ų32.10%019%0.19CC..Hα-helixtrans-59.3-29.4-176.700000114.1A560 G561 N562 L566 I567 P568A560-G564 PolarHBondContact O-N 2.8Å; G561-G564 PolarHBondContact O-N 3.48Å; N562-G564 VanDerWaalsContact C-N 3.35Å; G564-L566 PolarHBondContact O-N 3.22Å; G564-I567 WeakPolarHBondContact O-CB 3.27Å; G564-I567 PolarHBondContact O-N 3.48Å; G564-P568 VanDerWaalsContact O-CD 3.32Å; G564-P568 WeakPolarHBondContact O-CD 3.07Å
565V85.2Confident77.9Confident45 Ų4532.5 Ų32.527%0.27319%0.185SC..THydrogen-bonded Turntrans-62.3-24.6178.7-171.60000113.4I508 G561 L563 W615I508-V565 HydrophobicContact CB-CG1 4.28Å; I508-V565 HydrophobicContact CD1-CB 4.45Å; I508-V565 HydrophobicContact CD1-CG1 3.52Å; I508-V565 HydrophobicContact CG1-CG1 3.85Å; I508-V565 HydrophobicContact CG2-CG1 3.47Å; I508-V565 VanDerWaalsContact CG2-CG1 3.47Å; G561-V565 WeakPolarHBondContact O-CG2 3.4Å; L563-V565 PolarHBondContact O-N 3.13Å; V565-W615 HydrophobicContact CG2-CH2 4.44Å; V565-W615 HydrophobicContact CG2-CZ2 3.99Å
566L88.6Confident80.2Confident5 Ų533 Ų333%0.02618%0.184CC..THydrogen-bonded Turntrans-82.6-18.7176.4-68176.1000113.3Y511 L534 F535 L538 L563 G564 A569 I570Y511-L566 HydrophobicContact CD2-CD2 3.91Å; Y511-L566 HydrophobicContact CE2-CD2 4.21Å; L534-L566 HydrophobicContact CD2-CD1 3.98Å; L534-L566 HydrophobicContact CD2-CD2 4.26Å; L534-L566 HydrophobicContact CG-CD1 3.96Å; F535-L566 HydrophobicContact CB-CD1 4.43Å; F535-L566 HydrophobicContact CD2-CB 4.23Å; F535-L566 HydrophobicContact CD2-CD1 4.47Å; L538-L566 HydrophobicContact CD1-CD1 3.66Å; L563-L566 PolarHBondContact O-N 3.05Å; L563-L566 VanDerWaalsContact O-N 3.15Å; G564-L566 PolarHBondContact O-N 3.22Å; L566-A569 PolarHBondContact O-N 2.92Å; L566-I570 HydrophobicContact CB-CD1 4.49Å; L566-I570 WeakPolarHBondContact O-CG1 3.48Å; L566-I570 PolarHBondContact O-N 3.15Å; L566-I570 VanDerWaalsContact O-N 3.1Å
567I92.6Very high82.2Confident0 Ų031.2 Ų31.20%017%0.167CC..Hα-helixtrans-59.7-47.2-175.9-64175.2000111.8F535 G564 A569 I570 A571 F603 W615 V619 I622F535-I567 HydrophobicContact CE2-CD1 4.49Å; F535-I567 HydrophobicContact CE2-CG1 3.99Å; G564-I567 WeakPolarHBondContact O-CB 3.27Å; G564-I567 PolarHBondContact O-N 3.48Å; I567-A569 VanDerWaalsContact C-N 3.28Å; I567-A569 PolarHBondContact O-N 2.91Å; I567-I570 PolarHBondContact O-N 3.13Å; I567-A571 WeakPolarHBondContact O-CB 3.42Å; I567-A571 PolarHBondContact O-N 2.88Å; I567-F603 HydrophobicContact CD1-CB 4.12Å; I567-F603 HydrophobicContact CD1-CD1 4.23Å; I567-F603 HydrophobicContact CD1-CD2 3.67Å; I567-F603 HydrophobicContact CD1-CE2 4.17Å; I567-F603 HydrophobicContact CD1-CG 3.76Å; I567-W615 WeakPolarHBondContact CG2-O 3.44Å; I567-V619 HydrophobicContact CD1-CG2 3.96Å; I567-V619 HydrophobicContact CG2-CG2 3.83Å; I567-I622 HydrophobicContact CG2-CD1 4.01Å
568P90.5Very high83.6Confident25 Ų2532.2 Ų32.216%0.16217%0.172CC..Hα-helixtrans-58-37.6176.4-2736.4000113.6M512 G564 A571 V572M512-P568 HydrophobicContact CE-CB 4.12Å; M512-P568 VanDerWaalsContact SD-C 3.54Å; M512-P568 HydrophobicContact SD-CB 3.82Å; G564-P568 VanDerWaalsContact O-CD 3.32Å; G564-P568 WeakPolarHBondContact O-CD 3.07Å; P568-A571 PolarHBondContact O-N 3.27Å; P568-V572 WeakPolarHBondContact O-CG2 3.38Å; P568-V572 PolarHBondContact O-N 2.95Å
569A89.6Confident84.5Confident2 Ų230.2 Ų30.22%0.01716%0.161CC..Hα-helixtrans-68.2-43.2-18000000111.2M512 A515 F531 L566 I567 A571 L573M512-A569 HydrophobicContact CG-CB 4.37Å; M512-A569 WeakPolarHBondContact SD-CA 3.2Å; M512-A569 HydrophobicContact SD-CB 3.55Å; M512-A569 VanDerWaalsContact SD-CB 3.55Å; M512-A569 PolarHBondContact SD-N 2.87Å; A515-A569 WeakPolarHBondContact CB-O 3.37Å; F531-A569 HydrophobicContact CE2-CB 4.26Å; L566-A569 PolarHBondContact O-N 2.92Å; I567-A569 VanDerWaalsContact C-N 3.28Å; I567-A569 PolarHBondContact O-N 2.91Å; A569-A571 VanDerWaalsContact C-N 3.33Å; A569-L573 PolarHBondContact O-N 3.43Å; A569-L573 VanDerWaalsContact O-N 3.16Å
570I93.1Very high85.5Confident0 Ų030.3 Ų30.30%016%0.161CC..Hα-helixtrans-62.5-43.9174.5-62.1165.9000110L528 F531 L532 F535 L566 I567 L573 M574 F594 I622L528-I570 HydrophobicContact CD1-CG2 4.27Å; F531-I570 HydrophobicContact CB-CD1 4.34Å; F531-I570 HydrophobicContact CB-CG1 3.8Å; F531-I570 HydrophobicContact CD2-CG1 4.17Å; F531-I570 HydrophobicContact CG-CG1 4.36Å; L532-I570 HydrophobicContact CD2-CD1 4.36Å; F535-I570 HydrophobicContact CD2-CD1 4.39Å; L566-I570 HydrophobicContact CB-CD1 4.49Å; L566-I570 WeakPolarHBondContact O-CG1 3.48Å; L566-I570 PolarHBondContact O-N 3.15Å; L566-I570 VanDerWaalsContact O-N 3.1Å; I567-I570 PolarHBondContact O-N 3.13Å; I570-L573 PolarHBondContact O-N 3.5Å; I570-M574 HydrophobicContact CG2-CG 4.13Å; I570-M574 HydrophobicContact CG2-SD 3.69Å; I570-M574 VanDerWaalsContact O-CB 3.3Å; I570-M574 WeakPolarHBondContact O-CB 3.49Å; I570-M574 VanDerWaalsContact O-CG 3.3Å; I570-M574 WeakPolarHBondContact O-CG 3.31Å; I570-M574 PolarHBondContact O-N 3.19Å; I570-F594 HydrophobicContact CD1-CD2 4.49Å; I570-F594 HydrophobicContact CD1-CE2 4.05Å; I570-I622 HydrophobicContact CB-CD1 3.88Å; I570-I622 HydrophobicContact CG2-CD1 3.61Å; I570-I622 HydrophobicContact CG2-CG1 3.97Å
571A93.2Very high85.9Confident6 Ų635 Ų355%0.0519%0.189CC..Hα-helixtrans-61.7-46-179.900000112.8I567 P568 A569 L573 M574 K575 G618 T621 I622I567-A571 WeakPolarHBondContact O-CB 3.42Å; I567-A571 PolarHBondContact O-N 2.88Å; P568-A571 PolarHBondContact O-N 3.27Å; A569-A571 VanDerWaalsContact C-N 3.33Å; A571-L573 VanDerWaalsContact C-N 3.33Å; A571-L573 PolarHBondContact O-N 3.27Å; A571-M574 PolarHBondContact O-N 3.45Å; A571-K575 WeakPolarHBondContact O-CB 3.4Å; A571-K575 PolarHBondContact O-N 2.98Å; A571-G618 WeakPolarHBondContact CB-O 3.35Å; A571-T621 HydrophobicContact CB-CG2 4.31Å; A571-I622 HydrophobicContact CB-CD1 4.2Å; A571-I622 HydrophobicContact CB-CG1 4.02Å
572V92.1Very high86.1Confident41 Ų4141 Ų4125%0.24822%0.218CC..Hα-helixtrans-60.7-43.1176.7169.30000111.2M512 A515 E516 P568M512-V572 HydrophobicContact CE-CB 4.5Å; M512-V572 HydrophobicContact CE-CG2 3.73Å; A515-V572 HydrophobicContact CB-CB 4.21Å; A515-V572 HydrophobicContact CB-CG1 4.08Å; E516-V572 HydrophobicContact CB-CG1 3.91Å; E516-V572 HydrophobicContact CG-CG1 4.45Å; P568-V572 WeakPolarHBondContact O-CG2 3.38Å; P568-V572 PolarHBondContact O-N 2.95Å
573L92.5Very high86.5Confident0 Ų038.3 Ų38.30%020%0.204CC..Hα-helixtrans-64.7-46.8177.1-177.861.1000111.5A515 I518 K524 L527 L528 F531 A569 I570 A571 R576 M577A515-L573 HydrophobicContact CB-CB 3.94Å; I518-L573 HydrophobicContact CG2-CD1 3.92Å; K524-L573 HydrophobicContact CB-CD1 4.14Å; K524-L573 HydrophobicContact CG-CD1 3.97Å; L527-L573 HydrophobicContact CB-CD2 4.05Å; L527-L573 HydrophobicContact CD2-CD1 4.28Å; L527-L573 HydrophobicContact CD2-CD2 4.01Å; L527-L573 HydrophobicContact CG-CD2 3.96Å; L528-L573 HydrophobicContact CB-CD2 3.97Å; F531-L573 HydrophobicContact CD2-CD2 4.01Å; F531-L573 HydrophobicContact CE2-CD2 4.12Å; A569-L573 PolarHBondContact O-N 3.43Å; A569-L573 VanDerWaalsContact O-N 3.16Å; I570-L573 PolarHBondContact O-N 3.5Å; A571-L573 VanDerWaalsContact C-N 3.33Å; A571-L573 PolarHBondContact O-N 3.27Å; L573-R576 PolarHBondContact O-N 3.47Å; L573-R576 VanDerWaalsContact O-N 3.15Å; L573-M577 HydrophobicContact CD2-CE 4.5Å; L573-M577 HydrophobicContact CG-CE 3.97Å
574M91.1Very high86.6Confident0 Ų047.7 Ų47.70%024%0.239CC..Hα-helixtrans-67.2-35.5-177.4-75.8-168.763.600112.9L528 I570 A571 R576 M577 F591 I622 T625L528-M574 HydrophobicContact CD1-CG 3.83Å; L528-M574 HydrophobicContact CD1-SD 3.91Å; I570-M574 HydrophobicContact CG2-CG 4.13Å; I570-M574 HydrophobicContact CG2-SD 3.69Å; I570-M574 VanDerWaalsContact O-CB 3.3Å; I570-M574 WeakPolarHBondContact O-CB 3.49Å; I570-M574 VanDerWaalsContact O-CG 3.3Å; I570-M574 WeakPolarHBondContact O-CG 3.31Å; I570-M574 PolarHBondContact O-N 3.19Å; A571-M574 PolarHBondContact O-N 3.45Å; M574-R576 PolarHBondContact O-N 3.22Å; M574-R576 VanDerWaalsContact O-N 3.14Å; M574-M577 HydrophobicContact CB-CE 4.3Å; M574-M577 HydrophobicContact CG-CE 3.69Å; M574-M577 PolarHBondContact O-N 3.14Å; M574-F591 HydrophobicContact CE-CE1 3.71Å; M574-F591 HydrophobicContact CE-CZ 3.7Å; M574-F591 HydrophobicContact SD-CE1 3.87Å; M574-F591 HydrophobicContact SD-CZ 3.97Å; M574-I622 HydrophobicContact CE-CB 4.49Å; M574-I622 HydrophobicContact CE-CG2 3.9Å; M574-I622 WeakPolarHBondContact CE-O 3.3Å; M574-I622 HydrophobicContact SD-CB 4.18Å; M574-I622 HydrophobicContact SD-CG1 3.98Å; M574-I622 HydrophobicContact SD-CG2 3.64Å; M574-T625 WeakPolarHBondContact CE-OG1 3.18Å
575K88.8Confident86.4Confident165 Ų16552.2 Ų52.272%0.71727%0.268SS*.Hα-helixtrans-58.9-25.8173-169.5174.6-180178.10113.1A571 T621A571-K575 WeakPolarHBondContact O-CB 3.4Å; A571-K575 PolarHBondContact O-N 2.98Å; K575-T621 HydrophobicContact CB-CG2 3.86Å; K575-T621 HydrophobicContact CD-CG2 4.39Å; K575-T621 HydrophobicContact CG-CG2 4.3Å
576R90.5Very high86.4Confident83 Ų8356.9 Ų56.931%0.31328%0.281SS..THydrogen-bonded Turntrans-95.610.6179.1-61.7173.367.5-131.23.6113.2A515 E516 I518 K524 L573 M574A515-R576 PolarHBondContact O-NH1 3.37Å; E516-R576 PolarHBondContact O-NE 2.98Å; E516-R576 VanDerWaalsContact O-NE 3.16Å; E516-R576 PolarHBondContact O-NH1 3.21Å; E516-R576 PolarHBondContact O-NH2 3.35Å; I518-R576 PolarHBondContact O-NH1 3.18Å; I518-R576 PolarHBondContact O-NH2 3.03Å; K524-R576 PolarHBondContact NZ-O 3.39Å; L573-R576 PolarHBondContact O-N 3.47Å; L573-R576 VanDerWaalsContact O-N 3.15Å; M574-R576 PolarHBondContact O-N 3.22Å; M574-R576 VanDerWaalsContact O-N 3.14Å
577M87Confident86.3Confident19 Ų1957.1 Ų57.19%0.09428%0.282CS..SBendtrans-118149178.7-72.1-168.7-67.200111.4K524 L528 L573 M574K524-M577 HydrophobicContact CB-CG 4.26Å; K524-M577 HydrophobicContact CB-SD 3.89Å; K524-M577 HydrophobicContact CD-CG 4.11Å; L528-M577 HydrophobicContact CB-CE 4.17Å; L528-M577 HydrophobicContact CD1-CE 4.1Å; L528-M577 HydrophobicContact CD2-CE 3.74Å; L528-M577 HydrophobicContact CD2-SD 4.49Å; L528-M577 HydrophobicContact CG-CE 4.2Å; L573-M577 HydrophobicContact CD2-CE 4.5Å; L573-M577 HydrophobicContact CG-CE 3.97Å; M574-M577 HydrophobicContact CB-CE 4.3Å; M574-M577 HydrophobicContact CG-CE 3.69Å; M574-M577 PolarHBondContact O-N 3.14Å
578P81.2Confident85.9Confident88 Ų8859.2 Ų59.257%0.57129%0.29SS*.  trans-68.4163.6170.931-35000111I580P578-I580 PolarHBondContact O-N 2.99Å
579L80.3Confident85.6Confident49 Ų4965.2 Ų65.226%0.25731%0.31SS..  trans-57.4128.6175.5-179.166.9000111.4V581 V624 F708L579-V581 HydrophobicContact CD2-CG2 4.36Å; L579-V581 HydrophobicContact CG-CG2 4.37Å; L579-V581 PolarHBondContact O-N 3.06Å; L579-V624 WeakPolarHBondContact CD1-O 3.34Å; L579-F708 HydrophobicContact CD2-CE1 4.49Å; L579-F708 HydrophobicContact CD2-CE2 3.97Å; L579-F708 HydrophobicContact CD2-CZ 3.5Å; L579-F708 VanDerWaalsContact CD2-CZ 3.5Å
580I82.8Confident85.6Confident23 Ų2365.9 Ų65.912%0.11831%0.313CS..  trans-86.496.1-176.9-54.7174.1000109.4L528 P578 P583 L587 F591 T625 P627L528-I580 HydrophobicContact CD2-CD1 3.89Å; P578-I580 PolarHBondContact O-N 2.99Å; I580-P583 HydrophobicContact CG2-CB 3.83Å; I580-P583 HydrophobicContact CG2-CG 4.37Å; I580-L587 HydrophobicContact CG2-CD2 4.47Å; I580-F591 HydrophobicContact CD1-CE2 3.87Å; I580-F591 HydrophobicContact CD1-CZ 3.97Å; I580-T625 PolarHBondContact N-O 3.29Å; I580-P627 HydrophobicContact CB-CB 4.36Å; I580-P627 HydrophobicContact CG2-CB 4.23Å; I580-P627 WeakPolarHBondContact O-CA 3.28Å; I580-P627 WeakPolarHBondContact O-CB 3.45Å
581V75.3Confident85.6Confident99 Ų9965.9 Ų65.960%0.631%0.313SS*.SBendtrans-83.2-39.8-177.7-176.30000112.3L579 P583L579-V581 HydrophobicContact CD2-CG2 4.36Å; L579-V581 HydrophobicContact CG-CG2 4.37Å; L579-V581 PolarHBondContact O-N 3.06Å; V581-P583 WeakPolarHBondContact O-CD 3.49Å
582N75.7Confident85.3Confident142 Ų14266.3 Ų66.376%0.75931%0.313SS*.SBendtrans-128.773.5-175.6-78.8-44.8000112.3
583P82.3Confident85.1Confident8 Ų865.1 Ų65.15%0.05231%0.305CS..  trans-66.9142.8179.329.6-36.1000111I580 V581 L587 R588 P627I580-P583 HydrophobicContact CG2-CB 3.83Å; I580-P583 HydrophobicContact CG2-CG 4.37Å; V581-P583 WeakPolarHBondContact O-CD 3.49Å; P583-L587 HydrophobicContact CB-CB 4.19Å; P583-L587 HydrophobicContact CB-CD2 4.01Å; P583-L587 HydrophobicContact CB-CG 4.12Å; P583-R588 HydrophobicContact CB-CB 4.4Å; P583-R588 HydrophobicContact CG-CB 4.02Å; P583-R588 HydrophobicContact CG-CG 4.09Å; P583-R588 PolarHBondContact O-NH2 3.25Å; P583-P627 HydrophobicContact CB-CB 4.43Å; P583-P627 HydrophobicContact CB-CG 4.39Å; P583-P627 HydrophobicContact CG-CB 3.61Å; P583-P627 HydrophobicContact CG-CG 3.88Å
584R81.8Confident85.1Confident201 Ų20165.1 Ų65.176%0.75831%0.305SS*.  trans-53.9149.3168-66.5-179179.9175.20.1109.9R586 L587 R588R584-R586 PolarHBondContact O-N 3.27Å; R584-L587 PolarHBondContact O-N 3.19Å; R584-R588 PolarHBondContact O-N 2.97Å
585P80.3Confident85.2Confident95 Ų9565.1 Ų65.162%0.61731%0.305SS*.Hα-helixtrans-52.2-37.1-175.6-28.934.8000114.6R589P585-R589 WeakPolarHBondContact O-CG 3.44Å; P585-R589 PolarHBondContact O-N 2.88Å
586R84.8Confident85.1Confident143 Ų14357.2 Ų57.254%0.5427%0.271SS..Hα-helixtrans-61.8-51.7175.5-178.9177.1175.9-175.5-2.6112E533 R584 R588 R589 L590E533-R586 IonicContact OE1-CZ 3.69Å; E533-R586 IonicContact OE1-NE 3.79Å; E533-R586 PolarHBondContact OE1-NE 3.18Å; E533-R586 IonicContact OE1-NH2 3.8Å; E533-R586 PolarHBondContact OE1-NH2 3.15Å; E533-R586 IonicContact OE2-CZ 3.54Å; E533-R586 IonicContact OE2-NH2 2.95Å; E533-R586 PolarHBondContact OE2-NH2 3.48Å; R584-R586 PolarHBondContact O-N 3.27Å; R586-R588 VanDerWaalsContact C-N 3.29Å; R586-R588 PolarHBondContact O-N 3.02Å; R586-R589 PolarHBondContact O-N 3.05Å; R586-L590 HydrophobicContact CG-CD1 4.37Å; R586-L590 WeakPolarHBondContact O-CG 3.47Å; R586-L590 PolarHBondContact O-N 3.3Å; R586-L590 VanDerWaalsContact O-N 3.14Å
587L87Confident84.9Confident10 Ų1054 Ų545%0.05226%0.259CS..Hα-helixtrans-63.3-37.5-179.6-177.959.8000111.6L528 I529 L532 I580 P583 R584 R589 L590 F591L528-L587 HydrophobicContact CD2-CD1 3.96Å; L528-L587 HydrophobicContact CD2-CD2 4.33Å; L528-L587 HydrophobicContact CG-CD1 4.3Å; I529-L587 HydrophobicContact CG1-CD1 4.03Å; L532-L587 HydrophobicContact CD1-CD1 3.67Å; I580-L587 HydrophobicContact CG2-CD2 4.47Å; P583-L587 HydrophobicContact CB-CB 4.19Å; P583-L587 HydrophobicContact CB-CD2 4.01Å; P583-L587 HydrophobicContact CB-CG 4.12Å; R584-L587 PolarHBondContact O-N 3.19Å; L587-R589 PolarHBondContact O-N 3.02Å; L587-L590 PolarHBondContact O-N 2.88Å; L587-F591 HydrophobicContact CD1-CD2 3.87Å; L587-F591 HydrophobicContact CD1-CE2 3.62Å; L587-F591 HydrophobicContact CD2-CE2 4.18Å; L587-F591 HydrophobicContact CG-CD2 3.85Å; L587-F591 HydrophobicContact CG-CE2 3.75Å; L587-F591 WeakPolarHBondContact O-CD2 3.42Å; L587-F591 PolarHBondContact O-N 3.01Å
588R85Confident84.9Confident44 Ų4453 Ų5317%0.16625%0.254CS..Hα-helixtrans-61.7-41.7176-160.1-177.2-57.3-160.1-0.8112.6P583 R584 R586 R592 V630 F631P583-R588 HydrophobicContact CB-CB 4.4Å; P583-R588 HydrophobicContact CG-CB 4.02Å; P583-R588 HydrophobicContact CG-CG 4.09Å; P583-R588 PolarHBondContact O-NH2 3.25Å; R584-R588 PolarHBondContact O-N 2.97Å; R586-R588 VanDerWaalsContact C-N 3.29Å; R586-R588 PolarHBondContact O-N 3.02Å; R588-R592 PolarHBondContact O-N 2.68Å; R588-R592 VanDerWaalsContact O-N 3.16Å; R588-V630 VanDerWaalsContact CD-O 3.28Å; R588-V630 WeakPolarHBondContact CD-O 3.46Å; R588-V630 PolarHBondContact NH1-O 2.69Å; R588-F631 HydrophobicContact CB-CE1 4.19Å; R588-F631 HydrophobicContact CG-CD1 4.24Å; R588-F631 HydrophobicContact CG-CE1 3.61Å; R588-F631 HydrophobicContact CG-CZ 3.82Å
589R84.3Confident85.1Confident152 Ų15249.3 Ų49.357%0.57423%0.23SC*.Hα-helixtrans-63.5-43.9175.1-70.6174.5-172.4176.92.3111.3P585 R586 L587 R592 D593P585-R589 WeakPolarHBondContact O-CG 3.44Å; P585-R589 PolarHBondContact O-N 2.88Å; R586-R589 PolarHBondContact O-N 3.05Å; L587-R589 PolarHBondContact O-N 3.02Å; R589-R592 WeakPolarHBondContact O-CB 3.38Å; R589-R592 PolarHBondContact O-N 2.88Å; R589-D593 PolarHBondContact O-N 3.41Å
590L89.8Confident85.2Confident15 Ų1549 Ų498%0.07923%0.23CC..Hα-helixtrans-62.1-44.7178.8-69.5171.3000112.6I529 L532 E533 V536 R586 L587 R592 D593 F594I529-L590 HydrophobicContact CG2-CD1 4Å; L532-L590 HydrophobicContact CB-CB 3.9Å; L532-L590 HydrophobicContact CB-CD1 4.26Å; L532-L590 HydrophobicContact CB-CG 4.48Å; L532-L590 HydrophobicContact CD1-CB 4.16Å; E533-L590 HydrophobicContact CB-CD2 4.45Å; E533-L590 HydrophobicContact CG-CD1 3.69Å; E533-L590 HydrophobicContact CG-CD2 3.55Å; E533-L590 HydrophobicContact CG-CG 4.26Å; V536-L590 HydrophobicContact CG2-CD2 4.33Å; R586-L590 HydrophobicContact CG-CD1 4.37Å; R586-L590 WeakPolarHBondContact O-CG 3.47Å; R586-L590 PolarHBondContact O-N 3.3Å; R586-L590 VanDerWaalsContact O-N 3.14Å; L587-L590 PolarHBondContact O-N 2.88Å; L590-R592 PolarHBondContact O-N 3.42Å; L590-D593 PolarHBondContact O-N 3.39Å; L590-F594 VanDerWaalsContact O-CB 3.27Å; L590-F594 WeakPolarHBondContact O-CB 3.48Å; L590-F594 PolarHBondContact O-N 3.18Å
591F91.4Very high85.1Confident0 Ų049.9 Ų49.90%024%0.235CC..Hα-helixtrans-62.2-42.3175.4-88.6-65.6000112.6L528 L532 M574 I580 L587 D593 F594 W595 P627 L629L528-F591 HydrophobicContact CD1-CZ 4.42Å; L528-F591 HydrophobicContact CD2-CE2 4.15Å; L528-F591 HydrophobicContact CD2-CZ 4.01Å; L532-F591 HydrophobicContact CD1-CD1 4.23Å; L532-F591 HydrophobicContact CD1-CD2 4.14Å; L532-F591 HydrophobicContact CD1-CE1 4.07Å; L532-F591 HydrophobicContact CD1-CE2 3.99Å; L532-F591 HydrophobicContact CD1-CG 4.26Å; L532-F591 HydrophobicContact CD1-CZ 3.95Å; M574-F591 HydrophobicContact CE-CE1 3.71Å; M574-F591 HydrophobicContact CE-CZ 3.7Å; M574-F591 HydrophobicContact SD-CE1 3.87Å; M574-F591 HydrophobicContact SD-CZ 3.97Å; I580-F591 HydrophobicContact CD1-CE2 3.87Å; I580-F591 HydrophobicContact CD1-CZ 3.97Å; L587-F591 HydrophobicContact CD1-CD2 3.87Å; L587-F591 HydrophobicContact CD1-CE2 3.62Å; L587-F591 HydrophobicContact CD2-CE2 4.18Å; L587-F591 HydrophobicContact CG-CD2 3.85Å; L587-F591 HydrophobicContact CG-CE2 3.75Å; L587-F591 WeakPolarHBondContact O-CD2 3.42Å; L587-F591 PolarHBondContact O-N 3.01Å; F591-D593 VanDerWaalsContact C-N 3.33Å; F591-D593 PolarHBondContact O-N 3.42Å; F591-F594 PolarHBondContact O-N 3.41Å; F591-W595 WeakPolarHBondContact O-CB 3.49Å; F591-W595 PolarHBondContact O-N 3.1Å; F591-P627 HydrophobicContact CB-CG 4.27Å; F591-P627 HydrophobicContact CD2-CG 3.56Å; F591-P627 HydrophobicContact CE2-CG 4.01Å; F591-P627 HydrophobicContact CG-CG 3.95Å; F591-L629 HydrophobicContact CB-CD2 4.01Å
592R88.2Confident85.5Confident16 Ų1645.9 Ų45.96%0.0621%0.213CC..Hα-helixtrans-57.5-48.2175.2175.2-154.565.2-172-8.9111.1R588 R589 L590 W595 A596 F631 V638 G641 L642R588-R592 PolarHBondContact O-N 2.68Å; R588-R592 VanDerWaalsContact O-N 3.16Å; R589-R592 WeakPolarHBondContact O-CB 3.38Å; R589-R592 PolarHBondContact O-N 2.88Å; L590-R592 PolarHBondContact O-N 3.42Å; R592-W595 PolarHBondContact O-N 3.2Å; R592-A596 WeakPolarHBondContact O-CB 3.26Å; R592-A596 PolarHBondContact O-N 2.71Å; R592-F631 HydrophobicContact CB-CE2 4.36Å; R592-F631 HydrophobicContact CB-CZ 3.89Å; R592-F631 HydrophobicContact CG-CE2 4.41Å; R592-F631 HydrophobicContact CG-CZ 4.27Å; R592-V638 PolarHBondContact NH1-O 2.7Å; R592-G641 PolarHBondContact NH1-O 3.08Å; R592-G641 PolarHBondContact NH2-O 3.38Å; R592-L642 HydrophobicContact CG-CD2 4.02Å
593D87.8Confident86Confident15 Ų1539.2 Ų39.28%0.0818%0.177CC..Hα-helixtrans-70.1-40.3-177.4-63.7-27.7000111.5V536 R589 L590 F591 W595 A596 Y597 A643V536-D593 HydrophobicContact CG1-CB 4.11Å; V536-D593 HydrophobicContact CG2-CB 3.7Å; R589-D593 PolarHBondContact O-N 3.41Å; L590-D593 PolarHBondContact O-N 3.39Å; F591-D593 VanDerWaalsContact C-N 3.33Å; F591-D593 PolarHBondContact O-N 3.42Å; D593-W595 PolarHBondContact O-N 3.3Å; D593-A596 PolarHBondContact O-N 2.59Å; D593-Y597 WeakPolarHBondContact O-CD2 3.21Å; D593-Y597 PolarHBondContact O-N 2.8Å; D593-A643 HydrophobicContact CB-CB 4.04Å; D593-A643 PolarHBondContact OD1-N 3.39Å
594F92Very high86.2Confident0 Ų039.1 Ų39.10%018%0.176CC..Hα-helixtrans-54.5-52.6172168.3-94.9000111.8L532 F535 I570 L590 F591 A596 Y597 C598 I622L532-F594 HydrophobicContact CD2-CB 3.94Å; L532-F594 HydrophobicContact CD2-CD2 3.86Å; L532-F594 HydrophobicContact CD2-CG 3.83Å; F535-F594 AromaticContact CD1-CD2 3.59Å; F535-F594 HydrophobicContact CD1-CD2 3.59Å; F535-F594 HydrophobicContact CD1-CE2 4.3Å; F535-F594 HydrophobicContact CD1-CG 4.5Å; F535-F594 HydrophobicContact CD2-CD2 4.22Å; F535-F594 HydrophobicContact CD2-CE2 4.2Å; F535-F594 AromaticContact CE1-CD2 3.61Å; F535-F594 HydrophobicContact CE1-CD2 3.61Å; F535-F594 HydrophobicContact CE1-CE2 4.08Å; F535-F594 HydrophobicContact CE1-CG 4.47Å; F535-F594 HydrophobicContact CE2-CD2 4.23Å; F535-F594 AromaticContact CE2-CE2 3.98Å; F535-F594 HydrophobicContact CE2-CE2 3.98Å; F535-F594 AromaticContact CG-CD2 3.9Å; F535-F594 HydrophobicContact CG-CD2 3.9Å; F535-F594 HydrophobicContact CG-CE2 4.35Å; F535-F594 AromaticContact CZ-CD2 3.94Å; F535-F594 HydrophobicContact CZ-CD2 3.94Å; F535-F594 AromaticContact CZ-CE2 3.92Å; F535-F594 HydrophobicContact CZ-CE2 3.92Å; I570-F594 HydrophobicContact CD1-CD2 4.49Å; I570-F594 HydrophobicContact CD1-CE2 4.05Å; L590-F594 VanDerWaalsContact O-CB 3.27Å; L590-F594 WeakPolarHBondContact O-CB 3.48Å; L590-F594 PolarHBondContact O-N 3.18Å; F591-F594 PolarHBondContact O-N 3.41Å; F594-A596 PolarHBondContact O-N 3.25Å; F594-Y597 PolarHBondContact O-N 3.46Å; F594-C598 WeakPolarHBondContact CZ-SG 3.49Å; F594-C598 PolarHBondContact O-N 3.22Å; F594-C598 PolarHBondContact O-SG 3.15Å; F594-I622 HydrophobicContact CE1-CD1 4.45Å; F594-I622 HydrophobicContact CE1-CG2 3.74Å; F594-I622 HydrophobicContact CZ-CD1 3.79Å; F594-I622 HydrophobicContact CZ-CG2 4.18Å
595W92Very high86.2Confident0 Ų032 Ų320%016%0.155CC..Hα-helixtrans-67.4-37.5-178.5-82.5108.5000112.5F591 R592 D593 Y597 C598 V599 T604 V619 I622 A623 S626 L629 T688 L692 L695F591-W595 WeakPolarHBondContact O-CB 3.49Å; F591-W595 PolarHBondContact O-N 3.1Å; R592-W595 PolarHBondContact O-N 3.2Å; D593-W595 PolarHBondContact O-N 3.3Å; W595-Y597 VanDerWaalsContact C-N 3.34Å; W595-Y597 PolarHBondContact O-N 3.08Å; W595-C598 HydrophobicContact CE3-CB 4.49Å; W595-C598 PolarHBondContact O-N 3.43Å; W595-V599 WeakPolarHBondContact O-CG2 3.4Å; W595-V599 PolarHBondContact O-N 3.15Å; W595-T604 HydrophobicContact CE3-CG2 4.31Å; W595-T604 HydrophobicContact CZ3-CG2 3.94Å; W595-V619 HydrophobicContact CH2-CG1 3.53Å; W595-V619 HydrophobicContact CZ3-CG1 3.56Å; W595-I622 HydrophobicContact CZ2-CG2 3.92Å; W595-A623 HydrophobicContact CH2-CB 3.76Å; W595-A623 HydrophobicContact CZ2-CB 4Å; W595-S626 PolarHBondContact NE1-OG 3.17Å; W595-S626 VanDerWaalsContact NE1-OG 3.11Å; W595-L629 HydrophobicContact CB-CD1 4.43Å; W595-T688 HydrophobicContact CB-CG2 3.49Å; W595-T688 VanDerWaalsContact CB-CG2 3.49Å; W595-T688 HydrophobicContact CG-CG2 4.42Å; W595-L692 HydrophobicContact CD2-CB 4.22Å; W595-L692 HydrophobicContact CD2-CD1 4.23Å; W595-L692 HydrophobicContact CE3-CB 4.17Å; W595-L692 HydrophobicContact CH2-CD1 3.87Å; W595-L692 HydrophobicContact CZ2-CD1 3.36Å; W595-L692 HydrophobicContact CZ2-CG 4.47Å; W595-L692 HydrophobicContact CZ3-CB 4.32Å; W595-L692 HydrophobicContact CZ3-CD1 4.46Å; W595-L695 HydrophobicContact CH2-CD1 4.47Å; W595-L695 HydrophobicContact CZ3-CD1 4.28Å
596A86.9Confident86.1Confident0 Ų033.2 Ų33.20%015%0.153CC..Hα-helixtrans-59.5-44.2174.100000111.7R592 D593 F594 V599 V600 L642 I644 V684R592-A596 WeakPolarHBondContact O-CB 3.26Å; R592-A596 PolarHBondContact O-N 2.71Å; D593-A596 PolarHBondContact O-N 2.59Å; F594-A596 PolarHBondContact O-N 3.25Å; A596-V599 PolarHBondContact O-N 2.91Å; A596-V600 WeakPolarHBondContact O-CB 3.49Å; A596-V600 WeakPolarHBondContact O-CG2 3.36Å; A596-V600 PolarHBondContact O-N 3.44Å; A596-L642 HydrophobicContact CB-CD2 3.6Å; A596-I644 HydrophobicContact CB-CD1 4.17Å; A596-V684 HydrophobicContact CB-CG1 3.91Å
597Y86.6Confident85.6Confident14 Ų1432.7 Ų32.76%0.05516%0.161CC..Hα-helixtrans-63.6-42.8173.1-80.9-61.7000112.2F535 V536 L540 D593 F594 W595 V599 V600 L601 A643 I644F535-Y597 HydrophobicContact CE1-CG 4.49Å; V536-Y597 HydrophobicContact CG1-CE2 4.43Å; L540-Y597 PolarHBondContact N-OH 3.16Å; D593-Y597 WeakPolarHBondContact O-CD2 3.21Å; D593-Y597 PolarHBondContact O-N 2.8Å; F594-Y597 PolarHBondContact O-N 3.46Å; W595-Y597 VanDerWaalsContact C-N 3.34Å; W595-Y597 PolarHBondContact O-N 3.08Å; Y597-V599 VanDerWaalsContact C-N 3.26Å; Y597-V599 PolarHBondContact O-N 3.22Å; Y597-V600 PolarHBondContact O-N 3.24Å; Y597-L601 HydrophobicContact CD1-CD1 4.47Å; Y597-L601 VanDerWaalsContact O-CB 3.31Å; Y597-L601 WeakPolarHBondContact O-CB 3.46Å; Y597-L601 VanDerWaalsContact O-CG 3.32Å; Y597-L601 WeakPolarHBondContact O-CG 3.44Å; Y597-L601 PolarHBondContact O-N 2.92Å; Y597-A643 HydrophobicContact CE2-CB 3.87Å; Y597-I644 HydrophobicContact CD1-CD1 3.82Å; Y597-I644 HydrophobicContact CD1-CG1 4.05Å; Y597-I644 HydrophobicContact CE1-CD1 4.04Å; Y597-I644 HydrophobicContact CE1-CG1 3.75Å; Y597-I644 HydrophobicContact CG-CD1 4.28Å
598C88.1Confident84.8Confident0 Ų034.2 Ų34.20%017%0.172CC..Hα-helixtrans-61.7-35.2178.7-66.70000113.1F594 W595 G602 F603 T604F594-C598 WeakPolarHBondContact CZ-SG 3.49Å; F594-C598 PolarHBondContact O-N 3.22Å; F594-C598 PolarHBondContact O-SG 3.15Å; W595-C598 HydrophobicContact CE3-CB 4.49Å; W595-C598 PolarHBondContact O-N 3.43Å; C598-G602 PolarHBondContact O-N 3.26Å; C598-F603 HydrophobicContact CB-CB 4.28Å; C598-F603 HydrophobicContact CB-CD2 4.28Å; C598-F603 PolarHBondContact O-N 3.23Å; C598-T604 HydrophobicContact CB-CG2 4.03Å
599V85.3Confident84.1Confident10 Ų1035.8 Ų35.86%0.06120%0.202CC..Hα-helixtrans-73.2-49.3175.2167.40000111.8W595 A596 Y597 L601 G602 T604 L687 R691W595-V599 WeakPolarHBondContact O-CG2 3.4Å; W595-V599 PolarHBondContact O-N 3.15Å; A596-V599 PolarHBondContact O-N 2.91Å; Y597-V599 VanDerWaalsContact C-N 3.26Å; Y597-V599 PolarHBondContact O-N 3.22Å; V599-L601 VanDerWaalsContact C-N 3.31Å; V599-L601 PolarHBondContact O-N 3.39Å; V599-G602 PolarHBondContact O-N 3.19Å; V599-T604 HydrophobicContact CG2-CG2 4.09Å; V599-L687 HydrophobicContact CG1-CB 3.94Å; V599-L687 HydrophobicContact CG1-CD2 3.38Å; V599-L687 HydrophobicContact CG1-CG 3.49Å; V599-L687 VanDerWaalsContact CG1-CG 3.49Å; V599-R691 HydrophobicContact CG2-CB 3.96Å; V599-R691 HydrophobicContact CG2-CG 3.99Å
600V81.3Confident83.4Confident42 Ų4234.3 Ų34.326%0.25521%0.205SC..Hα-helixtrans-65.4-35-177169.80000112.1A596 Y597 I644 F657 F680 V684A596-V600 WeakPolarHBondContact O-CB 3.49Å; A596-V600 WeakPolarHBondContact O-CG2 3.36Å; A596-V600 PolarHBondContact O-N 3.44Å; Y597-V600 PolarHBondContact O-N 3.24Å; V600-I644 HydrophobicContact CB-CD1 3.96Å; V600-I644 HydrophobicContact CG1-CD1 4.35Å; V600-I644 HydrophobicContact CG2-CD1 3.66Å; V600-F657 HydrophobicContact CB-CZ 4.41Å; V600-F657 HydrophobicContact CG1-CZ 4.19Å; V600-F657 HydrophobicContact CG2-CE1 4.25Å; V600-F657 HydrophobicContact CG2-CZ 4.17Å; V600-F680 HydrophobicContact CG2-CZ 4.06Å; V600-V684 HydrophobicContact CG2-CG1 4.03Å; V600-V684 HydrophobicContact CG2-CG2 3.8Å
601L81.5Confident83.1Confident42 Ų4235.6 Ų35.622%0.2221%0.209CC..THydrogen-bonded Turntrans-90.3-4.1179.9-58.1176.7000113.7A560 L563 Y597 V599 F603 W611A560-L601 HydrophobicContact CB-CB 4.07Å; A560-L601 HydrophobicContact CB-CD1 3.98Å; A560-L601 HydrophobicContact CB-CD2 4.14Å; A560-L601 HydrophobicContact CB-CG 4.27Å; L563-L601 HydrophobicContact CD1-CD1 3.42Å; L563-L601 VanDerWaalsContact CD1-CD1 3.42Å; Y597-L601 HydrophobicContact CD1-CD1 4.47Å; Y597-L601 VanDerWaalsContact O-CB 3.31Å; Y597-L601 WeakPolarHBondContact O-CB 3.46Å; Y597-L601 VanDerWaalsContact O-CG 3.32Å; Y597-L601 WeakPolarHBondContact O-CG 3.44Å; Y597-L601 PolarHBondContact O-N 2.92Å; V599-L601 VanDerWaalsContact C-N 3.31Å; V599-L601 PolarHBondContact O-N 3.39Å; L601-F603 HydrophobicContact CB-CD2 4.35Å; L601-F603 HydrophobicContact CB-CE2 3.94Å; L601-F603 HydrophobicContact CB-CZ 4.14Å; L601-F603 HydrophobicContact CD1-CE2 3.91Å; L601-F603 HydrophobicContact CD1-CZ 4.24Å; L601-W611 PolarHBondContact O-NE1 2.98Å
602G82.6Confident82.7Confident14 Ų1438.5 Ų38.514%0.14423%0.228CC..THydrogen-bonded Turntrans81.317.2173.900000116.4C598 V599 T604 V605C598-G602 PolarHBondContact O-N 3.26Å; V599-G602 PolarHBondContact O-N 3.19Å; G602-T604 PolarHBondContact O-N 3.45Å; G602-T604 VanDerWaalsContact O-N 3.17Å; G602-V605 PolarHBondContact O-N 2.97Å
603F86.9Confident82.4Confident3 Ų341.2 Ų41.21%0.01324%0.241CC..THydrogen-bonded Turntrans-68.1-9.4174.6-57.7-48.2000113.9F535 A560 L563 I567 C598 L601 W611 W615 V619F535-F603 HydrophobicContact CZ-CE2 4.32Å; A560-F603 HydrophobicContact CB-CE1 4.37Å; A560-F603 HydrophobicContact CB-CZ 3.9Å; A560-F603 WeakPolarHBondContact O-CZ 3.43Å; L563-F603 HydrophobicContact CB-CE2 4.29Å; L563-F603 HydrophobicContact CB-CZ 4.33Å; I567-F603 HydrophobicContact CD1-CB 4.12Å; I567-F603 HydrophobicContact CD1-CD1 4.23Å; I567-F603 HydrophobicContact CD1-CD2 3.67Å; I567-F603 HydrophobicContact CD1-CE2 4.17Å; I567-F603 HydrophobicContact CD1-CG 3.76Å; C598-F603 HydrophobicContact CB-CB 4.28Å; C598-F603 HydrophobicContact CB-CD2 4.28Å; C598-F603 PolarHBondContact O-N 3.23Å; L601-F603 HydrophobicContact CB-CD2 4.35Å; L601-F603 HydrophobicContact CB-CE2 3.94Å; L601-F603 HydrophobicContact CB-CZ 4.14Å; L601-F603 HydrophobicContact CD1-CE2 3.91Å; L601-F603 HydrophobicContact CD1-CZ 4.24Å; F603-W611 HydrophobicContact CD1-CB 4.46Å; F603-W611 AromaticContact CD1-CD1 3.57Å; F603-W611 AromaticContact CD1-CD2 3.99Å; F603-W611 HydrophobicContact CD1-CD2 3.99Å; F603-W611 AromaticContact CD1-CG 3.74Å; F603-W611 HydrophobicContact CD1-CG 3.74Å; F603-W611 AromaticContact CD1-NE1 3.7Å; F603-W611 AromaticContact CE1-CD1 3.99Å; F603-W611 AromaticContact CE1-CD2 3.64Å; F603-W611 HydrophobicContact CE1-CD2 3.64Å; F603-W611 AromaticContact CE1-CE2 3.65Å; F603-W611 HydrophobicContact CE1-CE3 4.14Å; F603-W611 AromaticContact CE1-CG 3.91Å; F603-W611 HydrophobicContact CE1-CG 3.91Å; F603-W611 HydrophobicContact CE1-CZ2 4.2Å; F603-W611 AromaticContact CE1-NE1 3.79Å; F603-W615 HydrophobicContact CD1-CE3 4.29Å; F603-W615 AromaticContact CE1-CE3 3.97Å; F603-W615 HydrophobicContact CE1-CE3 3.97Å; F603-W615 HydrophobicContact CE1-CZ3 4.16Å; F603-V619 HydrophobicContact CB-CG2 3.98Å
604T86.5Confident82.2Confident5 Ų544.7 Ų44.73%0.03126%0.26CS..THydrogen-bonded Turntrans-96.77.4-178.156.70000113.6W595 C598 V599 G602 V619 R691 L695W595-T604 HydrophobicContact CE3-CG2 4.31Å; W595-T604 HydrophobicContact CZ3-CG2 3.94Å; C598-T604 HydrophobicContact CB-CG2 4.03Å; V599-T604 HydrophobicContact CG2-CG2 4.09Å; G602-T604 PolarHBondContact O-N 3.45Å; G602-T604 VanDerWaalsContact O-N 3.17Å; T604-V619 HydrophobicContact CG2-CG1 4.05Å; T604-R691 HydrophobicContact CG2-CB 4.23Å; T604-L695 HydrophobicContact CG2-CD1 4.21Å
605V82.4Confident82.1Confident52 Ų5246.1 Ų46.132%0.31527%0.265SS..  trans-113.8112-176.2-174.10000109.7G602 S608G602-V605 PolarHBondContact O-N 2.97Å; V605-S608 PolarHBondContact O-OG 2.92Å
606E77.9Confident82Confident120 Ų12047 Ų4756%0.56127%0.269SS*.THydrogen-bonded Turntrans-61.2142.6173.3-164.5169.2-160.800110.7S608 F616E606-S608 PolarHBondContact O-N 2.94Å; E606-F616 HydrophobicContact CB-CD1 4.35Å; E606-F616 HydrophobicContact CB-CE1 3.73Å; E606-F616 HydrophobicContact CB-CE2 3.98Å; E606-F616 HydrophobicContact CB-CZ 3.54Å; E606-F616 HydrophobicContact CG-CD1 4.2Å; E606-F616 HydrophobicContact CG-CE1 3.67Å; E606-F616 HydrophobicContact CG-CZ 4.01Å
607D73.2Confident82.1Confident132 Ų13250.9 Ų50.971%0.70629%0.29SS*.THydrogen-bonded Turntrans52.124.6177.4-63-30.8000115.3G609D607-G609 PolarHBondContact O-N 3.01Å
608S71.7Confident82.3Confident42 Ų4250.4 Ų50.429%0.29429%0.29SS..  trans-59.5-18.4175.259.90000112.9V605 E606 L610V605-S608 PolarHBondContact O-OG 2.92Å; E606-S608 PolarHBondContact O-N 2.94Å; S608-L610 PolarHBondContact O-N 3.38Å; S608-L610 PolarHBondContact OG-N 2.87Å
609G69.8Low82.5Confident78 Ų7850.4 Ų50.480%0.80429%0.29SS*.SBendtrans68.1-3.9-17300000113.7D607D607-G609 PolarHBondContact O-N 3.01Å
610L70.5Confident82.8Confident121 Ų12150.2 Ų50.263%0.63429%0.289SS*.SBendtrans-84.2-34.8-176.7-67170.1000112.2S608S608-L610 PolarHBondContact O-N 3.38Å; S608-L610 PolarHBondContact OG-N 2.87Å
611W83.4Confident83.2Confident41 Ų4150.4 Ų50.416%0.15529%0.29CS..SBendtrans-128150.3-170.6-54.5120000112.3S557 A560 L601 F603 Q613 W615S557-W611 WeakPolarHBondContact O-CH2 3.43Å; A560-W611 HydrophobicContact CB-CH2 3.19Å; A560-W611 HydrophobicContact CB-CZ2 3.28Å; A560-W611 HydrophobicContact CB-CZ3 4.1Å; L601-W611 PolarHBondContact O-NE1 2.98Å; F603-W611 HydrophobicContact CD1-CB 4.46Å; F603-W611 AromaticContact CD1-CD1 3.57Å; F603-W611 AromaticContact CD1-CD2 3.99Å; F603-W611 HydrophobicContact CD1-CD2 3.99Å; F603-W611 AromaticContact CD1-CG 3.74Å; F603-W611 HydrophobicContact CD1-CG 3.74Å; F603-W611 AromaticContact CD1-NE1 3.7Å; F603-W611 AromaticContact CE1-CD1 3.99Å; F603-W611 AromaticContact CE1-CD2 3.64Å; F603-W611 HydrophobicContact CE1-CD2 3.64Å; F603-W611 AromaticContact CE1-CE2 3.65Å; F603-W611 HydrophobicContact CE1-CE3 4.14Å; F603-W611 AromaticContact CE1-CG 3.91Å; F603-W611 HydrophobicContact CE1-CG 3.91Å; F603-W611 HydrophobicContact CE1-CZ2 4.2Å; F603-W611 AromaticContact CE1-NE1 3.79Å; W611-Q613 PolarHBondContact O-N 3.21Å; W611-W615 HydrophobicContact CB-CE3 4.04Å; W611-W615 HydrophobicContact CD2-CE3 4.4Å; W611-W615 HydrophobicContact CD2-CZ3 4.2Å; W611-W615 HydrophobicContact CE3-CE3 4.11Å; W611-W615 HydrophobicContact CE3-CH2 4.45Å; W611-W615 AromaticContact CE3-CZ3 3.5Å; W611-W615 HydrophobicContact CE3-CZ3 3.5Å; W611-W615 VanDerWaalsContact CE3-CZ3 3.5Å; W611-W615 HydrophobicContact CG-CE3 4.39Å; W611-W615 HydrophobicContact CZ3-CZ3 4.16Å
612P82Confident83.7Confident61 Ų6148.4 Ų48.440%0.39628%0.279SS..  trans-53.3133.6169.7-27.736.7000112.5N614 W615P612-N614 WeakPolarHBondContact CB-OD1 3.33Å; P612-N614 PolarHBondContact O-N 3.45Å; P612-W615 HydrophobicContact CB-CD2 4.22Å; P612-W615 HydrophobicContact CB-CG 4.24Å; P612-W615 HydrophobicContact CG-CD2 4.06Å; P612-W615 HydrophobicContact CG-CE3 4.37Å; P612-W615 HydrophobicContact CG-CH2 4.23Å; P612-W615 HydrophobicContact CG-CZ2 3.93Å; P612-W615 HydrophobicContact CG-CZ3 4.46Å; P612-W615 WeakPolarHBondContact O-CB 3.46Å; P612-W615 PolarHBondContact O-N 2.9Å
613Q82.3Confident84.2Confident74 Ų7447.7 Ų47.735%0.34627%0.272SS..Hα-helixtrans-58.2-35.8-176-171.264.313.400113.1W611 W615 F616 D617W611-Q613 PolarHBondContact O-N 3.21Å; Q613-W615 PolarHBondContact O-N 3.23Å; Q613-W615 VanDerWaalsContact O-N 3.13Å; Q613-F616 WeakPolarHBondContact O-CA 3.49Å; Q613-F616 WeakPolarHBondContact O-CB 3.15Å; Q613-F616 PolarHBondContact O-N 3.46Å; Q613-D617 PolarHBondContact O-N 3Å
614N84.1Confident84.4Confident87 Ų8749.4 Ų49.447%0.46528%0.283SS..Hα-helixtrans-61.5-22.4177.366-35.8000113.5P612 G618P612-N614 WeakPolarHBondContact CB-OD1 3.33Å; P612-N614 PolarHBondContact O-N 3.45Å; N614-G618 PolarHBondContact O-N 3.5Å
615W89.4Confident84.4Confident30 Ų3049.9 Ų49.911%0.11429%0.286CS..Hα-helixtrans-74.3-43.2172.9-62.10.1000110.6G561 V565 I567 F603 W611 P612 Q613 G618 V619G561-W615 WeakPolarHBondContact O-CH2 3.47Å; V565-W615 HydrophobicContact CG2-CH2 4.44Å; V565-W615 HydrophobicContact CG2-CZ2 3.99Å; I567-W615 WeakPolarHBondContact CG2-O 3.44Å; F603-W615 HydrophobicContact CD1-CE3 4.29Å; F603-W615 AromaticContact CE1-CE3 3.97Å; F603-W615 HydrophobicContact CE1-CE3 3.97Å; F603-W615 HydrophobicContact CE1-CZ3 4.16Å; W611-W615 HydrophobicContact CB-CE3 4.04Å; W611-W615 HydrophobicContact CD2-CE3 4.4Å; W611-W615 HydrophobicContact CD2-CZ3 4.2Å; W611-W615 HydrophobicContact CE3-CE3 4.11Å; W611-W615 HydrophobicContact CE3-CH2 4.45Å; W611-W615 AromaticContact CE3-CZ3 3.5Å; W611-W615 HydrophobicContact CE3-CZ3 3.5Å; W611-W615 VanDerWaalsContact CE3-CZ3 3.5Å; W611-W615 HydrophobicContact CG-CE3 4.39Å; W611-W615 HydrophobicContact CZ3-CZ3 4.16Å; P612-W615 HydrophobicContact CB-CD2 4.22Å; P612-W615 HydrophobicContact CB-CG 4.24Å; P612-W615 HydrophobicContact CG-CD2 4.06Å; P612-W615 HydrophobicContact CG-CE3 4.37Å; P612-W615 HydrophobicContact CG-CH2 4.23Å; P612-W615 HydrophobicContact CG-CZ2 3.93Å; P612-W615 HydrophobicContact CG-CZ3 4.46Å; P612-W615 WeakPolarHBondContact O-CB 3.46Å; P612-W615 PolarHBondContact O-N 2.9Å; Q613-W615 PolarHBondContact O-N 3.23Å; Q613-W615 VanDerWaalsContact O-N 3.13Å; W615-G618 CarbonylContact O-C 3.26Å; W615-G618 WeakPolarHBondContact O-CA 3.27Å; W615-G618 PolarHBondContact O-N 3.45Å; W615-G618 VanDerWaalsContact O-N 3.15Å; W615-V619 WeakPolarHBondContact O-CG2 3.44Å; W615-V619 PolarHBondContact O-N 2.88Å
616F89.3Confident84.9Confident18 Ų1847.4 Ų47.48%0.07927%0.271CS..Hα-helixtrans-60-47.5173176.2-100.7000111.1E606 Q613 G618 V619 C620 L695E606-F616 HydrophobicContact CB-CD1 4.35Å; E606-F616 HydrophobicContact CB-CE1 3.73Å; E606-F616 HydrophobicContact CB-CE2 3.98Å; E606-F616 HydrophobicContact CB-CZ 3.54Å; E606-F616 HydrophobicContact CG-CD1 4.2Å; E606-F616 HydrophobicContact CG-CE1 3.67Å; E606-F616 HydrophobicContact CG-CZ 4.01Å; Q613-F616 WeakPolarHBondContact O-CA 3.49Å; Q613-F616 WeakPolarHBondContact O-CB 3.15Å; Q613-F616 PolarHBondContact O-N 3.46Å; F616-G618 PolarHBondContact O-N 2.85Å; F616-V619 CarbonylContact O-C 3.56Å; F616-V619 WeakPolarHBondContact O-CA 3.37Å; F616-V619 WeakPolarHBondContact O-CB 3.37Å; F616-V619 PolarHBondContact O-N 3.5Å; F616-C620 VanDerWaalsContact CE1-SG 3.56Å; F616-C620 PolarHBondContact O-N 3.5Å; F616-C620 PolarHBondContact O-SG 2.94Å; F616-C620 VanDerWaalsContact O-SG 3.38Å; F616-L695 HydrophobicContact CE2-CD2 3.9Å; F616-L695 HydrophobicContact CZ-CD2 3.82Å
617D88.3Confident85.4Confident82 Ų8241.7 Ų41.744%0.43924%0.244SC..Hα-helixtrans-57.2-36.7174.6-60.1-25.5000111.9Q613 C620 T621Q613-D617 PolarHBondContact O-N 3Å; D617-C620 WeakPolarHBondContact O-CB 3.4Å; D617-C620 PolarHBondContact O-N 3.26Å; D617-T621 PolarHBondContact O-N 2.69Å; D617-T621 PolarHBondContact O-OG1 3.22Å
618G90.7Very high86.1Confident5 Ų536.7 Ų36.75%0.05222%0.218CC..Hα-helixtrans-63.2-47.2172.900000112.3A571 N614 W615 F616 C620 T621 I622A571-G618 WeakPolarHBondContact CB-O 3.35Å; N614-G618 PolarHBondContact O-N 3.5Å; W615-G618 CarbonylContact O-C 3.26Å; W615-G618 WeakPolarHBondContact O-CA 3.27Å; W615-G618 PolarHBondContact O-N 3.45Å; W615-G618 VanDerWaalsContact O-N 3.15Å; F616-G618 PolarHBondContact O-N 2.85Å; G618-C620 VanDerWaalsContact C-N 3.33Å; G618-C620 PolarHBondContact O-N 3.38Å; G618-T621 WeakPolarHBondContact O-CB 2.97Å; G618-T621 PolarHBondContact O-N 3.46Å; G618-I622 VanDerWaalsContact O-CG1 3.25Å; G618-I622 WeakPolarHBondContact O-CG1 3.47Å; G618-I622 PolarHBondContact O-N 3.31Å
619V92.9Very high86.9Confident0 Ų034.7 Ų34.70%020%0.204CC..Hα-helixtrans-60.8-41.2174.81780000111.4I567 W595 F603 T604 W615 F616 T621 I622 A623 L695I567-V619 HydrophobicContact CD1-CG2 3.96Å; I567-V619 HydrophobicContact CG2-CG2 3.83Å; W595-V619 HydrophobicContact CH2-CG1 3.53Å; W595-V619 HydrophobicContact CZ3-CG1 3.56Å; F603-V619 HydrophobicContact CB-CG2 3.98Å; T604-V619 HydrophobicContact CG2-CG1 4.05Å; W615-V619 WeakPolarHBondContact O-CG2 3.44Å; W615-V619 PolarHBondContact O-N 2.88Å; F616-V619 CarbonylContact O-C 3.56Å; F616-V619 WeakPolarHBondContact O-CA 3.37Å; F616-V619 WeakPolarHBondContact O-CB 3.37Å; F616-V619 PolarHBondContact O-N 3.5Å; V619-T621 VanDerWaalsContact C-N 3.34Å; V619-T621 PolarHBondContact O-N 3.43Å; V619-I622 PolarHBondContact O-N 3.01Å; V619-A623 PolarHBondContact O-N 3.49Å; V619-L695 HydrophobicContact CG1-CD1 3.89Å
620C91.5Very high87.4Confident6 Ų631.7 Ų31.74%0.04117%0.17CC..Hα-helixtrans-57.8-46.3173.7-69.10000111.6F616 D617 G618 I622 A623 V624 N699F616-C620 VanDerWaalsContact CE1-SG 3.56Å; F616-C620 PolarHBondContact O-N 3.5Å; F616-C620 PolarHBondContact O-SG 2.94Å; F616-C620 VanDerWaalsContact O-SG 3.38Å; D617-C620 WeakPolarHBondContact O-CB 3.4Å; D617-C620 PolarHBondContact O-N 3.26Å; G618-C620 VanDerWaalsContact C-N 3.33Å; G618-C620 PolarHBondContact O-N 3.38Å; C620-I622 VanDerWaalsContact C-N 3.32Å; C620-I622 PolarHBondContact O-N 2.68Å; C620-A623 WeakPolarHBondContact O-CB 3.48Å; C620-A623 PolarHBondContact O-N 2.74Å; C620-V624 PolarHBondContact O-N 3.34Å; C620-N699 HydrophobicContact CB-CB 4.45Å
621T90Very high87.6Confident45 Ų4527.1 Ų27.128%0.27615%0.145SC..Hα-helixtrans-62.9-39.5177.6-56.80000111.9A571 K575 D617 G618 V619 V624A571-T621 HydrophobicContact CB-CG2 4.31Å; K575-T621 HydrophobicContact CB-CG2 3.86Å; K575-T621 HydrophobicContact CD-CG2 4.39Å; K575-T621 HydrophobicContact CG-CG2 4.3Å; D617-T621 PolarHBondContact O-N 2.69Å; D617-T621 PolarHBondContact O-OG1 3.22Å; G618-T621 WeakPolarHBondContact O-CB 2.97Å; G618-T621 PolarHBondContact O-N 3.46Å; V619-T621 VanDerWaalsContact C-N 3.34Å; V619-T621 PolarHBondContact O-N 3.43Å; T621-V624 PolarHBondContact O-N 3.36Å
622I93.2Very high86.9Confident0 Ų028.6 Ų28.60%016%0.16CC..Hα-helixtrans-67.6-36.2176.8-67.4165.4000111.3I567 I570 A571 M574 F594 W595 G618 V619 C620 V624 T625 S626I567-I622 HydrophobicContact CG2-CD1 4.01Å; I570-I622 HydrophobicContact CB-CD1 3.88Å; I570-I622 HydrophobicContact CG2-CD1 3.61Å; I570-I622 HydrophobicContact CG2-CG1 3.97Å; A571-I622 HydrophobicContact CB-CD1 4.2Å; A571-I622 HydrophobicContact CB-CG1 4.02Å; M574-I622 HydrophobicContact CE-CB 4.49Å; M574-I622 HydrophobicContact CE-CG2 3.9Å; M574-I622 WeakPolarHBondContact CE-O 3.3Å; M574-I622 HydrophobicContact SD-CB 4.18Å; M574-I622 HydrophobicContact SD-CG1 3.98Å; M574-I622 HydrophobicContact SD-CG2 3.64Å; F594-I622 HydrophobicContact CE1-CD1 4.45Å; F594-I622 HydrophobicContact CE1-CG2 3.74Å; F594-I622 HydrophobicContact CZ-CD1 3.79Å; F594-I622 HydrophobicContact CZ-CG2 4.18Å; W595-I622 HydrophobicContact CZ2-CG2 3.92Å; G618-I622 VanDerWaalsContact O-CG1 3.25Å; G618-I622 WeakPolarHBondContact O-CG1 3.47Å; G618-I622 PolarHBondContact O-N 3.31Å; V619-I622 PolarHBondContact O-N 3.01Å; C620-I622 VanDerWaalsContact C-N 3.32Å; C620-I622 PolarHBondContact O-N 2.68Å; I622-V624 VanDerWaalsContact C-N 3.29Å; I622-V624 PolarHBondContact O-N 3.16Å; I622-T625 PolarHBondContact O-N 3.11Å; I622-S626 WeakPolarHBondContact O-CB 3.2Å; I622-S626 PolarHBondContact O-N 3.02Å; I622-S626 PolarHBondContact O-OG 2.72Å
623A93.1Very high86.4Confident0 Ų032.9 Ų32.90%018%0.18CC..Hα-helixtrans-58.5-40.7178.200000112.4W595 V619 C620 T625 L692 L695 R696W595-A623 HydrophobicContact CH2-CB 3.76Å; W595-A623 HydrophobicContact CZ2-CB 4Å; V619-A623 PolarHBondContact O-N 3.49Å; C620-A623 WeakPolarHBondContact O-CB 3.48Å; C620-A623 PolarHBondContact O-N 2.74Å; A623-T625 VanDerWaalsContact C-N 3.28Å; A623-T625 PolarHBondContact O-N 3.31Å; A623-L692 HydrophobicContact CB-CD1 4Å; A623-L695 HydrophobicContact CB-CB 3.77Å; A623-R696 HydrophobicContact CB-CB 4.29Å; A623-R696 PolarHBondContact O-NE 2.97Å
624V90.2Very high86.1Confident39 Ų3931 Ų3124%0.23618%0.175CC..Hα-helixtrans-60.9-34.8-177.4177.10000112.7L579 C620 T621 I622 N699L579-V624 WeakPolarHBondContact CD1-O 3.34Å; C620-V624 PolarHBondContact O-N 3.34Å; T621-V624 PolarHBondContact O-N 3.36Å; I622-V624 VanDerWaalsContact C-N 3.29Å; I622-V624 PolarHBondContact O-N 3.16Å; V624-N699 HydrophobicContact CG2-CB 4.03Å
625T87Confident85.9Confident14 Ų1427.4 Ų27.49%0.08616%0.155CC..Hα-helixtrans-109.9-7-174.247.30000113.7M574 I580 I622 A623M574-T625 WeakPolarHBondContact CE-OG1 3.18Å; I580-T625 PolarHBondContact N-O 3.29Å; I622-T625 PolarHBondContact O-N 3.11Å; A623-T625 VanDerWaalsContact C-N 3.28Å; A623-T625 PolarHBondContact O-N 3.31Å
626S91.5Very high85.2Confident1 Ų134.7 Ų34.71%0.00718%0.183CC..PPolyproline II helixtrans-60.5147.6176.2-74.10000111.6W595 I622 R696W595-S626 PolarHBondContact NE1-OG 3.17Å; W595-S626 VanDerWaalsContact NE1-OG 3.11Å; I622-S626 WeakPolarHBondContact O-CB 3.2Å; I622-S626 PolarHBondContact O-N 3.02Å; I622-S626 PolarHBondContact O-OG 2.72Å; S626-R696 PolarHBondContact O-NH2 3.26Å
627P90Very high84.3Confident0 Ų039.9 Ų39.90%021%0.211CC..PPolyproline II helixtrans-7416117430.9-35.7000112.7I580 P583 F591 L629 R696I580-P627 HydrophobicContact CB-CB 4.36Å; I580-P627 HydrophobicContact CG2-CB 4.23Å; I580-P627 WeakPolarHBondContact O-CA 3.28Å; I580-P627 WeakPolarHBondContact O-CB 3.45Å; P583-P627 HydrophobicContact CB-CB 4.43Å; P583-P627 HydrophobicContact CB-CG 4.39Å; P583-P627 HydrophobicContact CG-CB 3.61Å; P583-P627 HydrophobicContact CG-CG 3.88Å; F591-P627 HydrophobicContact CB-CG 4.27Å; F591-P627 HydrophobicContact CD2-CG 3.56Å; F591-P627 HydrophobicContact CE2-CG 4.01Å; F591-P627 HydrophobicContact CG-CG 3.95Å; P627-L629 PolarHBondContact O-N 2.84Å; P627-R696 PolarHBondContact O-NH2 2.95Å
628V88.2Confident83.4Confident26 Ų2636.4 Ų36.416%0.15819%0.193CC..PPolyproline II helixtrans-65.7128.6167-169.80000109V630 F708 D711 Y712V628-V630 HydrophobicContact CG1-CB 4.39Å; V628-V630 HydrophobicContact CG1-CG2 3.64Å; V628-V630 PolarHBondContact O-N 2.92Å; V628-F708 HydrophobicContact CG2-CB 3.99Å; V628-F708 HydrophobicContact CG2-CD1 3.92Å; V628-F708 HydrophobicContact CG2-CG 3.99Å; V628-D711 HydrophobicContact CG1-CB 4.22Å; V628-Y712 HydrophobicContact CG1-CD1 4.33Å; V628-Y712 HydrophobicContact CG1-CD2 3.89Å; V628-Y712 HydrophobicContact CG1-CE1 3.9Å; V628-Y712 HydrophobicContact CG1-CE2 3.4Å; V628-Y712 VanDerWaalsContact CG1-CE2 3.4Å; V628-Y712 HydrophobicContact CG1-CG 4.34Å; V628-Y712 VanDerWaalsContact CG1-CZ 3.41Å
629L86.6Confident82.8Confident0 Ų036.7 Ų36.70%019%0.193CC..  trans-83.347.5-173.9-59.5179.2000112.9F591 W595 P627 F631 Y685 T688 L692 Y712F591-L629 HydrophobicContact CB-CD2 4.01Å; W595-L629 HydrophobicContact CB-CD1 4.43Å; P627-L629 PolarHBondContact O-N 2.84Å; L629-F631 WeakPolarHBondContact O-CD2 3.38Å; L629-F631 WeakPolarHBondContact O-CE2 3.32Å; L629-Y685 PolarHBondContact O-OH 3.31Å; L629-T688 HydrophobicContact CD1-CG2 3.71Å; L629-L692 HydrophobicContact CD1-CD2 3.78Å; L629-L692 HydrophobicContact CG-CD2 3.92Å; L629-Y712 HydrophobicContact CB-CE1 4.19Å; L629-Y712 PolarHBondContact N-OH 3.17Å
630V81.5Confident81.8Confident16 Ų1644 Ų4410%0.09723%0.225CC..  trans-97.2138.2-179.6170.80000110.7R588 V628 Y712 E715R588-V630 VanDerWaalsContact CD-O 3.28Å; R588-V630 WeakPolarHBondContact CD-O 3.46Å; R588-V630 PolarHBondContact NH1-O 2.69Å; V628-V630 HydrophobicContact CG1-CB 4.39Å; V628-V630 HydrophobicContact CG1-CG2 3.64Å; V628-V630 PolarHBondContact O-N 2.92Å; V630-Y712 HydrophobicContact CG2-CD1 3.5Å; V630-Y712 VanDerWaalsContact CG2-CD1 3.5Å; V630-Y712 HydrophobicContact CG2-CE1 3.84Å; V630-Y712 HydrophobicContact CG2-CG 4.04Å; V630-E715 HydrophobicContact CG1-CB 3.83Å; V630-E715 VanDerWaalsContact CG1-CD 3.49Å; V630-E715 HydrophobicContact CG1-CG 3.48Å; V630-E715 VanDerWaalsContact CG1-CG 3.48Å; V630-E715 WeakPolarHBondContact CG1-OE2 3.34Å
631F75.2Confident80.8Confident25 Ų2545.5 Ų45.511%0.1124%0.241CC..  trans-128.7114.2-175.8-66.4-93.3000111.3R588 R592 L629 D633 V638R588-F631 HydrophobicContact CB-CE1 4.19Å; R588-F631 HydrophobicContact CG-CD1 4.24Å; R588-F631 HydrophobicContact CG-CE1 3.61Å; R588-F631 HydrophobicContact CG-CZ 3.82Å; R592-F631 HydrophobicContact CB-CE2 4.36Å; R592-F631 HydrophobicContact CB-CZ 3.89Å; R592-F631 HydrophobicContact CG-CE2 4.41Å; R592-F631 HydrophobicContact CG-CZ 4.27Å; L629-F631 WeakPolarHBondContact O-CD2 3.38Å; L629-F631 WeakPolarHBondContact O-CE2 3.32Å; F631-D633 PolarHBondContact O-N 3.42Å; F631-V638 HydrophobicContact CB-CG2 3.29Å; F631-V638 HydrophobicContact CD1-CG2 3.74Å; F631-V638 HydrophobicContact CD2-CB 4.13Å; F631-V638 HydrophobicContact CD2-CG1 3.41Å; F631-V638 VanDerWaalsContact CD2-CG1 3.41Å; F631-V638 HydrophobicContact CD2-CG2 3.6Å; F631-V638 HydrophobicContact CE1-CG2 4.42Å; F631-V638 HydrophobicContact CE2-CG1 3.5Å; F631-V638 VanDerWaalsContact CE2-CG1 3.5Å; F631-V638 HydrophobicContact CE2-CG2 4.31Å; F631-V638 HydrophobicContact CG-CB 4.28Å; F631-V638 HydrophobicContact CG-CG1 4.01Å; F631-V638 HydrophobicContact CG-CG2 3.26Å; F631-V638 HydrophobicContact CZ-CG1 4.16Å
632P68.7Low80Confident71 Ų7144.1 Ų44.146%0.46123%0.232SC..SBendtrans-71.2-25.9-169.824.3-32.8000114.3C717P632-C717 PolarHBondContact O-SG 3.46Å
633D71.7Confident78.9Confident151 Ų15145 Ų4581%0.80724%0.239SC*.SBendtrans-86.7-39.2-167-57.9-37.4000114.6F631F631-D633 PolarHBondContact O-N 3.42Å
634S76.2Confident77.7Confident35 Ų3545.9 Ų45.925%0.24524%0.244CC..  trans-173.3118.1179.1-179.40000113R636 L637 V638S634-R636 VanDerWaalsContact C-N 3.3Å; S634-R636 PolarHBondContact O-N 2.81Å; S634-R636 PolarHBondContact OG-N 3.35Å; S634-L637 PolarHBondContact O-N 2.9Å; S634-L637 PolarHBondContact OG-N 3.17Å; S634-V638 WeakPolarHBondContact O-CG2 3.34Å; S634-V638 PolarHBondContact O-N 3.09Å
635L78.5Confident76.6Confident11 Ų1146.3 Ų46.36%0.05825%0.248CC..Hα-helixtrans-60.9-37.9173-174.967.5000112.4L637 V638 I639 Y685 C717 I718 D721 M725L635-L637 PolarHBondContact O-N 3.39Å; L635-V638 WeakPolarHBondContact O-CB 3.44Å; L635-V638 PolarHBondContact O-N 2.7Å; L635-V638 VanDerWaalsContact O-N 3.14Å; L635-I639 HydrophobicContact CD1-CD1 4.18Å; L635-I639 HydrophobicContact CD1-CG1 4.46Å; L635-I639 HydrophobicContact CD2-CD1 4.31Å; L635-I639 HydrophobicContact CG-CD1 3.79Å; L635-I639 HydrophobicContact CG-CG1 4.44Å; L635-I639 WeakPolarHBondContact O-CG1 3.41Å; L635-I639 PolarHBondContact O-N 3.11Å; L635-Y685 HydrophobicContact CD1-CE1 4.11Å; L635-C717 HydrophobicContact CB-CB 4.38Å; L635-I718 HydrophobicContact CD1-CG1 4.06Å; L635-I718 HydrophobicContact CD2-CG1 4.4Å; L635-D721 HydrophobicContact CD2-CB 3.8Å; L635-M725 HydrophobicContact CD1-CE 4.43Å; L635-M725 HydrophobicContact CD2-CE 4.32Å; L635-M725 HydrophobicContact CD2-SD 3.61Å; L635-M725 HydrophobicContact CG-SD 4.29Å
636R76Confident75.5Confident183 Ų18348.3 Ų48.369%0.69126%0.263SS*.Hα-helixtrans-65.3-40.3-179-169.3177.6-171.9-175.71.7112.1S634 V638 K640S634-R636 VanDerWaalsContact C-N 3.3Å; S634-R636 PolarHBondContact O-N 2.81Å; S634-R636 PolarHBondContact OG-N 3.35Å; R636-V638 VanDerWaalsContact C-N 3.27Å; R636-K640 VanDerWaalsContact O-CB 3.31Å; R636-K640 WeakPolarHBondContact O-CB 3.34Å; R636-K640 WeakPolarHBondContact O-CG 3.48Å; R636-K640 PolarHBondContact O-N 3.32Å
637L70.5Confident74.2Confident127 Ų12755.4 Ų55.467%0.66530%0.301SS*.Hα-helixtrans-67.6-30.8175-69.2175.1000111.8S634 L635 G641S634-L637 PolarHBondContact O-N 2.9Å; S634-L637 PolarHBondContact OG-N 3.17Å; L635-L637 PolarHBondContact O-N 3.39Å; L637-G641 WeakPolarHBondContact O-CA 3.43Å; L637-G641 PolarHBondContact O-N 2.95Å
638V69Low72.8Confident9 Ų958.4 Ų58.46%0.05532%0.322CS..Hα-helixtrans-69.8-45.8179171.70000111.3R592 F631 S634 L635 R636 G641 L642 Y685R592-V638 PolarHBondContact NH1-O 2.7Å; F631-V638 HydrophobicContact CB-CG2 3.29Å; F631-V638 HydrophobicContact CD1-CG2 3.74Å; F631-V638 HydrophobicContact CD2-CB 4.13Å; F631-V638 HydrophobicContact CD2-CG1 3.41Å; F631-V638 VanDerWaalsContact CD2-CG1 3.41Å; F631-V638 HydrophobicContact CD2-CG2 3.6Å; F631-V638 HydrophobicContact CE1-CG2 4.42Å; F631-V638 HydrophobicContact CE2-CG1 3.5Å; F631-V638 VanDerWaalsContact CE2-CG1 3.5Å; F631-V638 HydrophobicContact CE2-CG2 4.31Å; F631-V638 HydrophobicContact CG-CB 4.28Å; F631-V638 HydrophobicContact CG-CG1 4.01Å; F631-V638 HydrophobicContact CG-CG2 3.26Å; F631-V638 HydrophobicContact CZ-CG1 4.16Å; S634-V638 WeakPolarHBondContact O-CG2 3.34Å; S634-V638 PolarHBondContact O-N 3.09Å; L635-V638 WeakPolarHBondContact O-CB 3.44Å; L635-V638 PolarHBondContact O-N 2.7Å; L635-V638 VanDerWaalsContact O-N 3.14Å; R636-V638 VanDerWaalsContact C-N 3.27Å; V638-G641 PolarHBondContact O-N 2.73Å; V638-L642 PolarHBondContact O-N 3.11Å; V638-Y685 HydrophobicContact CG1-CD2 4.49Å; V638-Y685 HydrophobicContact CG1-CE2 4.06Å
639I76.8Confident71.9Confident12 Ų1259.3 Ų59.36%0.06233%0.325CS..Hα-helixtrans-69.9-48.3179.4-64.2167.1000110.2L635 G641 L642 A681 Q682 M725L635-I639 HydrophobicContact CD1-CD1 4.18Å; L635-I639 HydrophobicContact CD1-CG1 4.46Å; L635-I639 HydrophobicContact CD2-CD1 4.31Å; L635-I639 HydrophobicContact CG-CD1 3.79Å; L635-I639 HydrophobicContact CG-CG1 4.44Å; L635-I639 WeakPolarHBondContact O-CG1 3.41Å; L635-I639 PolarHBondContact O-N 3.11Å; I639-G641 PolarHBondContact O-N 2.93Å; I639-L642 WeakPolarHBondContact O-CB 3.31Å; I639-L642 WeakPolarHBondContact O-CD1 3.35Å; I639-L642 PolarHBondContact O-N 2.93Å; I639-A681 HydrophobicContact CG2-CB 3.39Å; I639-Q682 HydrophobicContact CD1-CG 4.15Å; I639-Q682 HydrophobicContact CG2-CG 4.13Å; I639-M725 HydrophobicContact CD1-CE 3.65Å; I639-M725 HydrophobicContact CD1-SD 3.33Å; I639-M725 WeakPolarHBondContact CD1-SD 3.48Å; I639-M725 HydrophobicContact CG1-CE 4.45Å
640K72.3Confident71.3Confident154 Ų15463.5 Ų63.567%0.6735%0.348SS*.Hα-helixtrans-65.4-26.1176.1-76.4-166.3166.4-160.20113.4R636 L642R636-K640 VanDerWaalsContact O-CB 3.31Å; R636-K640 WeakPolarHBondContact O-CB 3.34Å; R636-K640 WeakPolarHBondContact O-CG 3.48Å; R636-K640 PolarHBondContact O-N 3.32Å; K640-L642 VanDerWaalsContact C-N 3.33Å
641G71.3Confident71.1Confident37 Ų3768 Ų6838%0.38138%0.377SS..THydrogen-bonded Turntrans-87.34.2179.700000114.3R592 L637 V638 I639 A643R592-G641 PolarHBondContact NH1-O 3.08Å; R592-G641 PolarHBondContact NH2-O 3.38Å; L637-G641 WeakPolarHBondContact O-CA 3.43Å; L637-G641 PolarHBondContact O-N 2.95Å; V638-G641 PolarHBondContact O-N 2.73Å; I639-G641 PolarHBondContact O-N 2.93Å; G641-A643 PolarHBondContact O-N 3.22Å
642L73.7Confident71.4Confident15 Ų1570.3 Ų70.38%0.07940%0.397CS..  trans-56.9134.8171.2-82.9159.3000109.3R592 A596 V638 I639 K640 I644 A681R592-L642 HydrophobicContact CG-CD2 4.02Å; A596-L642 HydrophobicContact CB-CD2 3.6Å; V638-L642 PolarHBondContact O-N 3.11Å; I639-L642 WeakPolarHBondContact O-CB 3.31Å; I639-L642 WeakPolarHBondContact O-CD1 3.35Å; I639-L642 PolarHBondContact O-N 2.93Å; K640-L642 VanDerWaalsContact C-N 3.33Å; L642-I644 PolarHBondContact O-N 3.47Å; L642-I644 VanDerWaalsContact O-N 3.07Å; L642-A681 HydrophobicContact CD1-CB 4Å; L642-A681 WeakPolarHBondContact CD1-O 3.37Å
643A68.3Low71.8Confident19 Ų1969.8 Ų69.816%0.15739%0.39CS..SBendtrans-58-23178.100000113.3V536 L540 D593 Y597 G641 S645V536-A643 HydrophobicContact CG1-CB 4.4Å; L540-A643 HydrophobicContact CD2-CB 3.99Å; L540-A643 HydrophobicContact CG-CB 4.44Å; D593-A643 HydrophobicContact CB-CB 4.04Å; D593-A643 PolarHBondContact OD1-N 3.39Å; Y597-A643 HydrophobicContact CE2-CB 3.87Å; G641-A643 PolarHBondContact O-N 3.22Å; A643-S645 PolarHBondContact O-N 3.23Å
644I69.7Low72.4Confident18 Ų1864 Ų649%0.09236%0.359CS..SBendtrans-92.897.7179.3-48.7176.6000108.8A596 Y597 V600 L642 F680A596-I644 HydrophobicContact CB-CD1 4.17Å; Y597-I644 HydrophobicContact CD1-CD1 3.82Å; Y597-I644 HydrophobicContact CD1-CG1 4.05Å; Y597-I644 HydrophobicContact CE1-CD1 4.04Å; Y597-I644 HydrophobicContact CE1-CG1 3.75Å; Y597-I644 HydrophobicContact CG-CD1 4.28Å; V600-I644 HydrophobicContact CB-CD1 3.96Å; V600-I644 HydrophobicContact CG1-CD1 4.35Å; V600-I644 HydrophobicContact CG2-CD1 3.66Å; L642-I644 PolarHBondContact O-N 3.47Å; L642-I644 VanDerWaalsContact O-N 3.07Å; I644-F680 HydrophobicContact CB-CE1 4.39Å; I644-F680 HydrophobicContact CG2-CE1 3.65Å; I644-F680 HydrophobicContact CG2-CZ 4.12Å
645S65.2Low73Confident48 Ų4865.5 Ų65.534%0.33636%0.362SS..  trans-70.1144.8-179.571.20000113.3K543 A643 D647K543-S645 PolarHBondContact NZ-O 2.63Å; K543-S645 PolarHBondContact NZ-OG 2.7Å; A643-S645 PolarHBondContact O-N 3.23Å; S645-D647 VanDerWaalsContact C-N 3.31Å; S645-D647 PolarHBondContact O-N 2.94Å
646S64.5Low73.3Confident57 Ų5771.4 Ų71.440%0.39939%0.389SS..G310 helixtrans-69-22.7179.346.70000114.8S648S646-S648 PolarHBondContact O-N 3.02Å; S646-S648 VanDerWaalsContact O-N 3.15Å
647D63.5Low73.6Confident150 Ų15064.5 Ų64.580%0.80236%0.364SS*.G310 helixtrans-73.4-12.3-161-56.4-22.5000114S645S645-D647 VanDerWaalsContact C-N 3.31Å; S645-D647 PolarHBondContact O-N 2.94Å
648S61.7Low74.5Confident63 Ų6360.2 Ų60.244%0.44134%0.339SS..G310 helixtrans-113.811.9-17164.20000114.3K543 S646K543-S648 WeakPolarHBondContact CE-OG 3.32Å; K543-S648 PolarHBondContact NZ-OG 3.14Å; S646-S648 PolarHBondContact O-N 3.02Å; S646-S648 VanDerWaalsContact O-N 3.15Å
649I68.1Low75.5Confident44 Ų4463.7 Ų63.723%0.22636%0.358CS..  trans-105.1128.2-166.3-62.2170.9000110.4D653 L654 F680I649-D653 HydrophobicContact CG2-CB 4.16Å; I649-L654 HydrophobicContact CG2-CB 4.49Å; I649-F680 HydrophobicContact CD1-CB 3.99Å; I649-F680 HydrophobicContact CD1-CD1 3.04Å; I649-F680 HydrophobicContact CD1-CD2 3.47Å; I649-F680 VanDerWaalsContact CD1-CD2 3.47Å; I649-F680 HydrophobicContact CD1-CE1 3.14Å; I649-F680 HydrophobicContact CD1-CE2 3.55Å; I649-F680 HydrophobicContact CD1-CG 3.18Å; I649-F680 HydrophobicContact CD1-CZ 3.38Å; I649-F680 HydrophobicContact CG1-CG 4.5Å; I649-F680 HydrophobicContact CG2-CD2 4.04Å; I649-F680 HydrophobicContact CG2-CE2 4.36Å
650N75.4Confident76Confident89 Ų8965.8 Ų65.848%0.47637%0.369SS..  trans-64.5142.6179.1-72.5-29.9000110.7S652 D653 L654N650-S652 WeakPolarHBondContact CB-OG 3.32Å; N650-S652 PolarHBondContact O-N 3.33Å; N650-S652 VanDerWaalsContact O-N 3.13Å; N650-D653 PolarHBondContact O-N 2.82Å; N650-L654 PolarHBondContact O-N 3.05Å; N650-L654 VanDerWaalsContact O-N 3.14Å
651P77.6Confident76.8Confident109 Ų10958.5 Ų58.571%0.70834%0.337SS*.Hα-helixtrans-56-30176-24.933.1000113.8Q655P651-Q655 PolarHBondContact O-N 3.01Å; P651-Q655 VanDerWaalsContact O-N 3.08Å
652S80.5Confident77.8Confident75 Ų7557 Ų5752%0.52432%0.32SS..Hα-helixtrans-61.5-48174.250.70000112.3N650 Q655 E656N650-S652 WeakPolarHBondContact CB-OG 3.32Å; N650-S652 PolarHBondContact O-N 3.33Å; N650-S652 VanDerWaalsContact O-N 3.13Å; S652-Q655 WeakPolarHBondContact O-CB 2.96Å; S652-Q655 PolarHBondContact O-N 3Å; S652-Q655 VanDerWaalsContact O-N 3.12Å; S652-E656 PolarHBondContact O-N 2.67Å
653D78.2Confident78.5Confident59 Ų5959 Ų5932%0.31634%0.336SS..Hα-helixtrans-70.7-40.8-174.3-50.4-9.4000108.8I649 N650 Q655 E656 F657I649-D653 HydrophobicContact CG2-CB 4.16Å; N650-D653 PolarHBondContact O-N 2.82Å; D653-Q655 VanDerWaalsContact C-N 3.26Å; D653-Q655 PolarHBondContact O-N 2.99Å; D653-E656 WeakPolarHBondContact O-CA 3.31Å; D653-E656 WeakPolarHBondContact O-CB 3.48Å; D653-E656 PolarHBondContact O-N 2.97Å; D653-E656 VanDerWaalsContact O-N 3.09Å; D653-F657 WeakPolarHBondContact O-CD2 3.38Å; D653-F657 PolarHBondContact O-N 3.32Å
654L83.9Confident79.5Confident31 Ų3160.8 Ų60.816%0.16234%0.341CS..Hα-helixtrans-57.1-41.9171.2177.357.3000111.7I649 N650 E656 F657 R658 F680I649-L654 HydrophobicContact CG2-CB 4.49Å; N650-L654 PolarHBondContact O-N 3.05Å; N650-L654 VanDerWaalsContact O-N 3.14Å; L654-E656 VanDerWaalsContact C-N 3.32Å; L654-F657 PolarHBondContact O-N 3.39Å; L654-R658 HydrophobicContact CD1-CG 4.49Å; L654-R658 WeakPolarHBondContact O-CG 3.5Å; L654-R658 PolarHBondContact O-N 3.45Å; L654-F680 VanDerWaalsContact CD1-CA 3.5Å; L654-F680 HydrophobicContact CD1-CB 3.86Å; L654-F680 HydrophobicContact CD1-CD2 4.28Å
655Q88.3Confident80.4Confident66 Ų6660.1 Ų60.131%0.30834%0.338SS..Hα-helixtrans-67.3-34.7176.8-167.758.437.100112P651 S652 D653 R658 N659P651-Q655 PolarHBondContact O-N 3.01Å; P651-Q655 VanDerWaalsContact O-N 3.08Å; S652-Q655 WeakPolarHBondContact O-CB 2.96Å; S652-Q655 PolarHBondContact O-N 3Å; S652-Q655 VanDerWaalsContact O-N 3.12Å; D653-Q655 VanDerWaalsContact C-N 3.26Å; D653-Q655 PolarHBondContact O-N 2.99Å; Q655-R658 PolarHBondContact O-N 2.98Å; Q655-N659 PolarHBondContact NE2-OD1 3.23Å; Q655-N659 WeakPolarHBondContact O-CB 3.34Å; Q655-N659 PolarHBondContact O-N 3.32Å; Q655-N659 PolarHBondContact O-ND2 3Å; Q655-N659 PolarHBondContact O-OD1 3.41Å
656E83.9Confident81.5Confident135 Ų13563.3 Ų63.363%0.63135%0.351SS*.Hα-helixtrans-63.9-45172.8-168.7179.7175.300111.9S652 D653 L654 R658 N659 N660S652-E656 PolarHBondContact O-N 2.67Å; D653-E656 WeakPolarHBondContact O-CA 3.31Å; D653-E656 WeakPolarHBondContact O-CB 3.48Å; D653-E656 PolarHBondContact O-N 2.97Å; D653-E656 VanDerWaalsContact O-N 3.09Å; L654-E656 VanDerWaalsContact C-N 3.32Å; E656-R658 VanDerWaalsContact C-N 3.34Å; E656-R658 PolarHBondContact O-N 3.04Å; E656-N659 PolarHBondContact O-N 2.97Å; E656-N660 WeakPolarHBondContact O-CB 3.34Å; E656-N660 PolarHBondContact O-N 3.08Å
657F82.8Confident82.7Confident37 Ų3766 Ų6616%0.16236%0.357CS..Hα-helixtrans-60.6-41.7174.1-83.1-77.1000112.3V600 D653 L654 N660 L661 F680 L687V600-F657 HydrophobicContact CB-CZ 4.41Å; V600-F657 HydrophobicContact CG1-CZ 4.19Å; V600-F657 HydrophobicContact CG2-CE1 4.25Å; V600-F657 HydrophobicContact CG2-CZ 4.17Å; D653-F657 WeakPolarHBondContact O-CD2 3.38Å; D653-F657 PolarHBondContact O-N 3.32Å; L654-F657 PolarHBondContact O-N 3.39Å; F657-N660 PolarHBondContact O-N 2.96Å; F657-L661 WeakPolarHBondContact O-CB 3.22Å; F657-L661 PolarHBondContact O-N 2.91Å; F657-F680 HydrophobicContact CD2-CD2 4.18Å; F657-F680 AromaticContact CD2-CE2 3.62Å; F657-F680 HydrophobicContact CD2-CE2 3.62Å; F657-F680 AromaticContact CE2-CE2 3.64Å; F657-F680 HydrophobicContact CE2-CE2 3.64Å; F657-F680 HydrophobicContact CE2-CZ 4.42Å; F657-F680 HydrophobicContact CG-CE2 4.17Å; F657-F680 HydrophobicContact CZ-CE2 4.17Å; F657-L687 HydrophobicContact CD1-CD2 4.12Å; F657-L687 HydrophobicContact CE1-CD2 4.46Å
658R90.8Very high83.9Confident38 Ų3860.3 Ų60.314%0.14333%0.328CS..Hα-helixtrans-63.2-45.7174.6-73.4170.2175.5167.2-1.6111.5L654 Q655 E656 L661 L662 V675 N676 M678L654-R658 HydrophobicContact CD1-CG 4.49Å; L654-R658 WeakPolarHBondContact O-CG 3.5Å; L654-R658 PolarHBondContact O-N 3.45Å; Q655-R658 PolarHBondContact O-N 2.98Å; E656-R658 VanDerWaalsContact C-N 3.34Å; E656-R658 PolarHBondContact O-N 3.04Å; R658-L661 PolarHBondContact O-N 3.35Å; R658-L662 WeakPolarHBondContact O-CB 3.32Å; R658-L662 VanDerWaalsContact O-CG 3.27Å; R658-L662 WeakPolarHBondContact O-CG 3.49Å; R658-L662 PolarHBondContact O-N 3.17Å; R658-V675 HydrophobicContact CB-CG1 3.98Å; R658-V675 HydrophobicContact CG-CG1 3.98Å; R658-V675 PolarHBondContact NE-O 3.42Å; R658-N676 PolarHBondContact NH1-O 3.25Å; R658-N676 PolarHBondContact NH2-O 3.4Å; R658-M678 PolarHBondContact NE-O 3.27Å; R658-M678 PolarHBondContact NH2-O 3.37Å
659N89.2Confident85.1Confident82 Ų8262.3 Ų62.344%0.43934%0.34SS..Hα-helixtrans-64.5-41.3178.4-70.1-11.8000111.4Q655 E656 L662 S663Q655-N659 PolarHBondContact NE2-OD1 3.23Å; Q655-N659 WeakPolarHBondContact O-CB 3.34Å; Q655-N659 PolarHBondContact O-N 3.32Å; Q655-N659 PolarHBondContact O-ND2 3Å; Q655-N659 PolarHBondContact O-OD1 3.41Å; E656-N659 PolarHBondContact O-N 2.97Å; N659-L662 PolarHBondContact O-N 2.93Å; N659-S663 VanDerWaalsContact O-CB 3.3Å; N659-S663 WeakPolarHBondContact O-CB 3.49Å; N659-S663 PolarHBondContact O-N 3.33Å; N659-S663 PolarHBondContact O-OG 3.02Å
660N86.5Confident86Confident55 Ų5566 Ų6629%0.29436%0.36SS..Hα-helixtrans-60.1-52.9175.1-173.6-7.7000110.2E656 F657 L662 S663 Q664E656-N660 WeakPolarHBondContact O-CB 3.34Å; E656-N660 PolarHBondContact O-N 3.08Å; F657-N660 PolarHBondContact O-N 2.96Å; N660-L662 VanDerWaalsContact C-N 3.34Å; N660-L662 PolarHBondContact O-N 2.72Å; N660-S663 PolarHBondContact O-N 2.94Å; N660-S663 VanDerWaalsContact O-N 3.14Å; N660-S663 PolarHBondContact O-OG 3.45Å; N660-Q664 WeakPolarHBondContact O-CG 3.4Å; N660-Q664 PolarHBondContact O-N 2.93Å
661L89.2Confident86.8Confident1 Ų162 Ų621%0.00534%0.338CS..Hα-helixtrans-56-47176.3-178.363.1000111.8F657 R658 S663 Q664 L665 V675 L686 L687 L690F657-L661 WeakPolarHBondContact O-CB 3.22Å; F657-L661 PolarHBondContact O-N 2.91Å; R658-L661 PolarHBondContact O-N 3.35Å; L661-S663 VanDerWaalsContact C-N 3.34Å; L661-S663 PolarHBondContact O-N 3.43Å; L661-Q664 PolarHBondContact O-N 3.3Å; L661-L665 HydrophobicContact CD1-CD1 4Å; L661-L665 HydrophobicContact CD1-CG 4.3Å; L661-L665 HydrophobicContact CG-CD1 4.02Å; L661-L665 WeakPolarHBondContact O-CB 3.25Å; L661-L665 VanDerWaalsContact O-CG 3.23Å; L661-L665 WeakPolarHBondContact O-CG 3.35Å; L661-L665 PolarHBondContact O-N 3.5Å; L661-V675 HydrophobicContact CD2-CG1 4.02Å; L661-V675 HydrophobicContact CD2-CG2 4Å; L661-L686 HydrophobicContact CD1-CB 4.41Å; L661-L686 HydrophobicContact CD2-CB 4.14Å; L661-L686 HydrophobicContact CD2-CD1 4.15Å; L661-L687 HydrophobicContact CD1-CD1 4.32Å; L661-L690 HydrophobicContact CD1-CD2 4.21Å
662L92.4Very high87.5Confident5 Ų558.7 Ų58.73%0.02632%0.316CS..Hα-helixtrans-64.9-37.2178.7-71.5176.7000113R658 N659 N660 L665 N666 H667 V671 V672 V675R658-L662 WeakPolarHBondContact O-CB 3.32Å; R658-L662 VanDerWaalsContact O-CG 3.27Å; R658-L662 WeakPolarHBondContact O-CG 3.49Å; R658-L662 PolarHBondContact O-N 3.17Å; N659-L662 PolarHBondContact O-N 2.93Å; N660-L662 VanDerWaalsContact C-N 3.34Å; N660-L662 PolarHBondContact O-N 2.72Å; L662-L665 PolarHBondContact O-N 3.07Å; L662-N666 PolarHBondContact O-N 2.71Å; L662-N666 VanDerWaalsContact O-N 3.13Å; L662-H667 PolarHBondContact O-N 2.99Å; L662-V671 HydrophobicContact CD2-CG1 4.42Å; L662-V672 HydrophobicContact CD1-CG1 4.43Å; L662-V672 HydrophobicContact CD1-CG2 4.36Å; L662-V672 HydrophobicContact CD2-CB 4.41Å; L662-V672 HydrophobicContact CD2-CG2 3.83Å; L662-V675 HydrophobicContact CD1-CG1 4.29Å; L662-V675 HydrophobicContact CD2-CB 3.89Å; L662-V675 HydrophobicContact CD2-CG1 4.1Å; L662-V675 HydrophobicContact CD2-CG2 3.94Å; L662-V675 HydrophobicContact CG-CB 4.22Å; L662-V675 HydrophobicContact CG-CG1 3.9Å
663S89.9Confident88.1Confident59 Ų5958.4 Ų58.441%0.41331%0.313SS..Hα-helixtrans-64.4-43.1176.774.50000111.4N659 N660 L661 L665 N666N659-S663 VanDerWaalsContact O-CB 3.3Å; N659-S663 WeakPolarHBondContact O-CB 3.49Å; N659-S663 PolarHBondContact O-N 3.33Å; N659-S663 PolarHBondContact O-OG 3.02Å; N660-S663 PolarHBondContact O-N 2.94Å; N660-S663 VanDerWaalsContact O-N 3.14Å; N660-S663 PolarHBondContact O-OG 3.45Å; L661-S663 VanDerWaalsContact C-N 3.34Å; L661-S663 PolarHBondContact O-N 3.43Å; S663-L665 VanDerWaalsContact C-N 3.27Å; S663-L665 PolarHBondContact O-N 3.18Å; S663-N666 PolarHBondContact O-N 2.94Å
664Q87.8Confident88.7Confident56 Ų5657.8 Ų57.826%0.26231%0.309SS..Hα-helixtrans-69.2-27.8177.6-52.9-134.8-65.500112.6N660 L661 N666 L690 R691N660-Q664 WeakPolarHBondContact O-CG 3.4Å; N660-Q664 PolarHBondContact O-N 2.93Å; L661-Q664 PolarHBondContact O-N 3.3Å; Q664-N666 VanDerWaalsContact C-N 3.34Å; Q664-L690 HydrophobicContact CB-CD2 3.71Å; Q664-L690 HydrophobicContact CG-CD2 4.35Å; Q664-R691 VanDerWaalsContact CD-CZ 3.48Å; Q664-R691 VanDerWaalsContact CD-NH2 3.27Å; Q664-R691 VanDerWaalsContact OE1-CZ 3.22Å
665L89Confident89.1Confident4 Ų456.3 Ų56.32%0.02130%0.302CS..THydrogen-bonded Turntrans-85.9-2.9177.4-66.2-179.4000113.6L661 L662 S663 H667 P668 V671 L690 A731 I732 Q735L661-L665 HydrophobicContact CD1-CD1 4Å; L661-L665 HydrophobicContact CD1-CG 4.3Å; L661-L665 HydrophobicContact CG-CD1 4.02Å; L661-L665 WeakPolarHBondContact O-CB 3.25Å; L661-L665 VanDerWaalsContact O-CG 3.23Å; L661-L665 WeakPolarHBondContact O-CG 3.35Å; L661-L665 PolarHBondContact O-N 3.5Å; L662-L665 PolarHBondContact O-N 3.07Å; S663-L665 VanDerWaalsContact C-N 3.27Å; S663-L665 PolarHBondContact O-N 3.18Å; L665-H667 VanDerWaalsContact C-N 3.34Å; L665-P668 HydrophobicContact CB-CG 4.09Å; L665-P668 WeakPolarHBondContact O-CD 3.48Å; L665-P668 WeakPolarHBondContact O-CG 3.42Å; L665-V671 HydrophobicContact CD1-CG1 4.05Å; L665-L690 HydrophobicContact CD2-CD2 4.39Å; L665-A731 HydrophobicContact CD2-CB 4.4Å; L665-I732 HydrophobicContact CD2-CB 4.46Å; L665-I732 HydrophobicContact CD2-CG1 3.73Å; L665-Q735 VanDerWaalsContact C-NE2 3.32Å; L665-Q735 HydrophobicContact CD2-CG 3.87Å; L665-Q735 PolarHBondContact O-NE2 2.76Å; L665-Q735 VanDerWaalsContact O-NE2 3.09Å
666N88.2Confident89.2Confident115 Ų11556.2 Ų56.262%0.61530%0.303SS*.THydrogen-bonded Turntrans5938.1-173.4-58.1-32.1000113.9L662 S663 Q664 Q735L662-N666 PolarHBondContact O-N 2.71Å; L662-N666 VanDerWaalsContact O-N 3.13Å; S663-N666 PolarHBondContact O-N 2.94Å; Q664-N666 VanDerWaalsContact C-N 3.34Å; N666-Q735 PolarHBondContact ND2-NE2 2.97Å
667H89.6Confident89.5Confident113 Ų11358.3 Ų58.352%0.52331%0.31SS..  trans49.358.6174.2-56.9-91.5000116L662 L665 V672L662-H667 PolarHBondContact O-N 2.99Å; L665-H667 VanDerWaalsContact C-N 3.34Å; H667-V672 HydrophobicContact CB-CG2 4.24Å
668P88.6Confident89.8Confident30 Ų3056.6 Ų56.620%0.19530%0.303CS..  trans-65.3131.5179.3-7.921.6000110.9L665 D670 V671 V672 A731L665-P668 HydrophobicContact CB-CG 4.09Å; L665-P668 WeakPolarHBondContact O-CD 3.48Å; L665-P668 WeakPolarHBondContact O-CG 3.42Å; P668-D670 VanDerWaalsContact C-N 3.26Å; P668-D670 PolarHBondContact O-N 3.5Å; P668-V671 HydrophobicContact CB-CB 3.95Å; P668-V671 HydrophobicContact CB-CG2 3.92Å; P668-V671 HydrophobicContact CG-CB 3.96Å; P668-V671 HydrophobicContact CG-CG2 4.04Å; P668-V671 PolarHBondContact O-N 3.24Å; P668-V672 WeakPolarHBondContact O-CG2 3.23Å; P668-V672 PolarHBondContact O-N 3.36Å; P668-A731 HydrophobicContact CG-CB 4.16Å
669P87.7Confident89.6Confident106 Ų10658.2 Ų58.269%0.68831%0.314SS*.THydrogen-bonded Turntrans-60.4-33.3-17222.9-33.5000113.4V671 P673P669-V671 VanDerWaalsContact C-N 3.33Å; P669-P673 WeakPolarHBondContact O-CD 3.32Å
670D87.2Confident89.4Confident121 Ų12154.8 Ų54.865%0.64730%0.295SS*.THydrogen-bonded Turntrans-78.4-18.6179.4-53.8-29.4000112.9P668 L674P668-D670 VanDerWaalsContact C-N 3.26Å; P668-D670 PolarHBondContact O-N 3.5Å; D670-L674 WeakPolarHBondContact O-CD1 3.42Å
671V91.9Very high89.3Confident4 Ų452.5 Ų52.52%0.02428%0.284CS..THydrogen-bonded Turntrans-98.3-34.3-175174.70000111.5L662 L665 P668 P669 L674 V675 T727 A731L662-V671 HydrophobicContact CD2-CG1 4.42Å; L665-V671 HydrophobicContact CD1-CG1 4.05Å; P668-V671 HydrophobicContact CB-CB 3.95Å; P668-V671 HydrophobicContact CB-CG2 3.92Å; P668-V671 HydrophobicContact CG-CB 3.96Å; P668-V671 HydrophobicContact CG-CG2 4.04Å; P668-V671 PolarHBondContact O-N 3.24Å; P669-V671 VanDerWaalsContact C-N 3.33Å; V671-L674 WeakPolarHBondContact O-CB 3.35Å; V671-L674 PolarHBondContact O-N 3.3Å; V671-V675 HydrophobicContact CG1-CG2 3.55Å; V671-V675 PolarHBondContact O-N 3.46Å; V671-T727 HydrophobicContact CG2-CG2 4.34Å; V671-A731 HydrophobicContact CG2-CB 3.94Å
672V93Very high89.3Confident40 Ų4053.7 Ų53.724%0.24229%0.29CS..Hα-helixtrans-52.4-48.4-179.9170.90000112.8L662 H667 P668 L674 N676L662-V672 HydrophobicContact CD1-CG1 4.43Å; L662-V672 HydrophobicContact CD1-CG2 4.36Å; L662-V672 HydrophobicContact CD2-CB 4.41Å; L662-V672 HydrophobicContact CD2-CG2 3.83Å; H667-V672 HydrophobicContact CB-CG2 4.24Å; P668-V672 WeakPolarHBondContact O-CG2 3.23Å; P668-V672 PolarHBondContact O-N 3.36Å; V672-L674 VanDerWaalsContact C-N 3.28Å; V672-L674 PolarHBondContact O-N 2.88Å; V672-N676 WeakPolarHBondContact O-CB 3.15Å; V672-N676 PolarHBondContact O-N 3.42Å; V672-N676 VanDerWaalsContact O-N 3.15Å; V672-N676 PolarHBondContact O-ND2 3.28Å
673P91.7Very high89.1Confident70 Ų7053.5 Ų53.546%0.45529%0.289SS..Hα-helixtrans-66.8-28.5178.2-19.632.5000113.6P669 K677P669-P673 WeakPolarHBondContact O-CD 3.32Å; P673-K677 WeakPolarHBondContact O-CG 3.39Å
674L91.9Very high89.1Confident46 Ų4650.8 Ų50.824%0.24127%0.269CS..Hα-helixtrans-74.6-51.8179.2-62.6174.7000110.3D670 V671 V672 N676 K677 M678 T727D670-L674 WeakPolarHBondContact O-CD1 3.42Å; V671-L674 WeakPolarHBondContact O-CB 3.35Å; V671-L674 PolarHBondContact O-N 3.3Å; V672-L674 VanDerWaalsContact C-N 3.28Å; V672-L674 PolarHBondContact O-N 2.88Å; L674-N676 VanDerWaalsContact C-N 3.29Å; L674-N676 PolarHBondContact O-N 3.48Å; L674-K677 CarbonylContact O-C 3.55Å; L674-K677 WeakPolarHBondContact O-CA 3.47Å; L674-K677 PolarHBondContact O-N 3.29Å; L674-M678 HydrophobicContact CB-CE 4.41Å; L674-M678 WeakPolarHBondContact O-CG 3.42Å; L674-M678 PolarHBondContact O-N 3.06Å; L674-M678 VanDerWaalsContact O-N 3.07Å; L674-T727 HydrophobicContact CD1-CG2 4Å
675V91.2Very high89.1Confident0 Ų048.2 Ų48.20%026%0.258CS..Hα-helixtrans-60.6-38.6-179.7173.70000111.6R658 L661 L662 V671 K677 M678R658-V675 HydrophobicContact CB-CG1 3.98Å; R658-V675 HydrophobicContact CG-CG1 3.98Å; R658-V675 PolarHBondContact NE-O 3.42Å; L661-V675 HydrophobicContact CD2-CG1 4.02Å; L661-V675 HydrophobicContact CD2-CG2 4Å; L662-V675 HydrophobicContact CD1-CG1 4.29Å; L662-V675 HydrophobicContact CD2-CB 3.89Å; L662-V675 HydrophobicContact CD2-CG1 4.1Å; L662-V675 HydrophobicContact CD2-CG2 3.94Å; L662-V675 HydrophobicContact CG-CB 4.22Å; L662-V675 HydrophobicContact CG-CG1 3.9Å; V671-V675 HydrophobicContact CG1-CG2 3.55Å; V671-V675 PolarHBondContact O-N 3.46Å; V675-K677 PolarHBondContact O-N 3.15Å; V675-M678 HydrophobicContact CG2-SD 4.38Å; V675-M678 PolarHBondContact O-N 2.67Å; V675-M678 VanDerWaalsContact O-N 3.12Å
676N91Very high89.2Confident64 Ų6448 Ų4834%0.34226%0.257SS..THydrogen-bonded Turntrans-65.1-19.4175.9-74.3-27000113.8R658 V672 L674R658-N676 PolarHBondContact NH1-O 3.25Å; R658-N676 PolarHBondContact NH2-O 3.4Å; V672-N676 WeakPolarHBondContact O-CB 3.15Å; V672-N676 PolarHBondContact O-N 3.42Å; V672-N676 VanDerWaalsContact O-N 3.15Å; V672-N676 PolarHBondContact O-ND2 3.28Å; L674-N676 VanDerWaalsContact C-N 3.29Å; L674-N676 PolarHBondContact O-N 3.48Å
677K90.1Very high89.3Confident178 Ų17842.7 Ų42.777%0.77423%0.228SC*.THydrogen-bonded Turntrans-97.6-12.6174.6-68.5177.1-176.9178.70113.5P673 L674 V675P673-K677 WeakPolarHBondContact O-CG 3.39Å; L674-K677 CarbonylContact O-C 3.55Å; L674-K677 WeakPolarHBondContact O-CA 3.47Å; L674-K677 PolarHBondContact O-N 3.29Å; V675-K677 PolarHBondContact O-N 3.15Å
678M88.8Confident89.4Confident2 Ų237.4 Ų37.41%0.0120%0.204CC..  trans-71.9140.9-177.8-77.7177.1176.400111.8R658 L674 V675 Q682 L686 M725 C728R658-M678 PolarHBondContact NE-O 3.27Å; R658-M678 PolarHBondContact NH2-O 3.37Å; L674-M678 HydrophobicContact CB-CE 4.41Å; L674-M678 WeakPolarHBondContact O-CG 3.42Å; L674-M678 PolarHBondContact O-N 3.06Å; L674-M678 VanDerWaalsContact O-N 3.07Å; V675-M678 HydrophobicContact CG2-SD 4.38Å; V675-M678 PolarHBondContact O-N 2.67Å; V675-M678 VanDerWaalsContact O-N 3.12Å; M678-Q682 VanDerWaalsContact CA-OE1 3.27Å; M678-Q682 HydrophobicContact CB-CB 3.98Å; M678-Q682 HydrophobicContact CG-CB 4.17Å; M678-Q682 HydrophobicContact SD-CB 4.43Å; M678-L686 HydrophobicContact CE-CD1 3.96Å; M678-L686 HydrophobicContact SD-CD1 3.47Å; M678-L686 WeakPolarHBondContact SD-CD1 3.41Å; M678-M725 HydrophobicContact CE-CG 3.99Å; M678-C728 HydrophobicContact CE-CB 4.46Å; M678-C728 WeakPolarHBondContact CE-SG 3.33Å
679D87.5Confident89.6Confident71 Ų7136 Ų3638%0.3819%0.194SC..  trans-71.7172.7171.769.233.9000111.6A681 Q682 C683D679-A681 VanDerWaalsContact C-N 3.33Å; D679-A681 PolarHBondContact O-N 3.18Å; D679-A681 PolarHBondContact OD1-N 2.76Å; D679-Q682 PolarHBondContact O-N 3.06Å; D679-Q682 WeakPolarHBondContact OD1-CB 3.41Å; D679-Q682 VanDerWaalsContact OD1-CG 3.25Å; D679-Q682 WeakPolarHBondContact OD1-CG 3.09Å; D679-Q682 PolarHBondContact OD1-N 3.13Å; D679-C683 PolarHBondContact O-N 3.45Å; D679-C683 VanDerWaalsContact O-N 3.11Å; D679-C683 PolarHBondContact O-SG 2.85Å
680F84.6Confident89.8Confident10 Ų1031.1 Ų31.14%0.04416%0.163CC..Hα-helixtrans-58.6-44.5179.8175.7-99.6000112.8V600 I644 I649 L654 F657 Q682 C683 V684V600-F680 HydrophobicContact CG2-CZ 4.06Å; I644-F680 HydrophobicContact CB-CE1 4.39Å; I644-F680 HydrophobicContact CG2-CE1 3.65Å; I644-F680 HydrophobicContact CG2-CZ 4.12Å; I649-F680 HydrophobicContact CD1-CB 3.99Å; I649-F680 HydrophobicContact CD1-CD1 3.04Å; I649-F680 HydrophobicContact CD1-CD2 3.47Å; I649-F680 VanDerWaalsContact CD1-CD2 3.47Å; I649-F680 HydrophobicContact CD1-CE1 3.14Å; I649-F680 HydrophobicContact CD1-CE2 3.55Å; I649-F680 HydrophobicContact CD1-CG 3.18Å; I649-F680 HydrophobicContact CD1-CZ 3.38Å; I649-F680 HydrophobicContact CG1-CG 4.5Å; I649-F680 HydrophobicContact CG2-CD2 4.04Å; I649-F680 HydrophobicContact CG2-CE2 4.36Å; L654-F680 VanDerWaalsContact CD1-CA 3.5Å; L654-F680 HydrophobicContact CD1-CB 3.86Å; L654-F680 HydrophobicContact CD1-CD2 4.28Å; F657-F680 HydrophobicContact CD2-CD2 4.18Å; F657-F680 AromaticContact CD2-CE2 3.62Å; F657-F680 HydrophobicContact CD2-CE2 3.62Å; F657-F680 AromaticContact CE2-CE2 3.64Å; F657-F680 HydrophobicContact CE2-CE2 3.64Å; F657-F680 HydrophobicContact CE2-CZ 4.42Å; F657-F680 HydrophobicContact CG-CE2 4.17Å; F657-F680 HydrophobicContact CZ-CE2 4.17Å; F680-Q682 VanDerWaalsContact C-N 3.33Å; F680-Q682 PolarHBondContact O-N 3.39Å; F680-C683 PolarHBondContact O-N 2.9Å; F680-C683 VanDerWaalsContact O-N 3.17Å; F680-V684 HydrophobicContact CD1-CG2 4.02Å; F680-V684 HydrophobicContact CD2-CG2 4.16Å; F680-V684 HydrophobicContact CE1-CG2 3.49Å; F680-V684 VanDerWaalsContact CE1-CG2 3.49Å; F680-V684 HydrophobicContact CE2-CG2 3.64Å; F680-V684 HydrophobicContact CG-CG2 4.34Å; F680-V684 HydrophobicContact CZ-CG2 3.3Å; F680-V684 WeakPolarHBondContact O-CG2 3.29Å; F680-V684 PolarHBondContact O-N 3.41Å
681A85Confident90.1Very high7 Ų727.1 Ų27.16%0.05814%0.139CC..Hα-helixtrans-66.7-37.7-174.300000111.3I639 L642 D679 Y685I639-A681 HydrophobicContact CG2-CB 3.39Å; L642-A681 HydrophobicContact CD1-CB 4Å; L642-A681 WeakPolarHBondContact CD1-O 3.37Å; D679-A681 VanDerWaalsContact C-N 3.33Å; D679-A681 PolarHBondContact O-N 3.18Å; D679-A681 PolarHBondContact OD1-N 2.76Å; A681-Y685 WeakPolarHBondContact O-CB 3.28Å; A681-Y685 PolarHBondContact O-N 3.35Å
682Q88.9Confident90.1Very high27 Ų2727 Ų2713%0.12614%0.137CC..Hα-helixtrans-62.2-46.3171.3-72.2170.3-34.700111.7I639 M678 D679 F680 Y685 L686 S723 M725I639-Q682 HydrophobicContact CD1-CG 4.15Å; I639-Q682 HydrophobicContact CG2-CG 4.13Å; M678-Q682 VanDerWaalsContact CA-OE1 3.27Å; M678-Q682 HydrophobicContact CB-CB 3.98Å; M678-Q682 HydrophobicContact CG-CB 4.17Å; M678-Q682 HydrophobicContact SD-CB 4.43Å; D679-Q682 PolarHBondContact O-N 3.06Å; D679-Q682 WeakPolarHBondContact OD1-CB 3.41Å; D679-Q682 VanDerWaalsContact OD1-CG 3.25Å; D679-Q682 WeakPolarHBondContact OD1-CG 3.09Å; D679-Q682 PolarHBondContact OD1-N 3.13Å; F680-Q682 VanDerWaalsContact C-N 3.33Å; F680-Q682 PolarHBondContact O-N 3.39Å; Q682-Y685 PolarHBondContact O-N 2.96Å; Q682-L686 WeakPolarHBondContact O-CG 3.05Å; Q682-L686 PolarHBondContact O-N 2.97Å; Q682-L686 VanDerWaalsContact O-N 3.07Å; Q682-S723 PolarHBondContact NE2-OG 3.42Å; Q682-M725 HydrophobicContact CG-SD 4.25Å
683C88.6Confident90.2Very high1 Ų125 Ų251%0.00713%0.126CC..Hα-helixtrans-62.1-45.7178.5-65.20000111.8D679 F680 Y685 L686 L687D679-C683 PolarHBondContact O-N 3.45Å; D679-C683 VanDerWaalsContact O-N 3.11Å; D679-C683 PolarHBondContact O-SG 2.85Å; F680-C683 PolarHBondContact O-N 2.9Å; F680-C683 VanDerWaalsContact O-N 3.17Å; C683-Y685 PolarHBondContact O-N 3.48Å; C683-L686 PolarHBondContact O-N 3.49Å; C683-L687 WeakPolarHBondContact O-CB 3.18Å; C683-L687 PolarHBondContact O-N 2.93Å
684V88.1Confident90.3Very high1 Ų123.5 Ų23.51%0.00612%0.115CC..Hα-helixtrans-62.8-42.6178171.40000111.5A596 V600 F680 L687 T688A596-V684 HydrophobicContact CB-CG1 3.91Å; V600-V684 HydrophobicContact CG2-CG1 4.03Å; V600-V684 HydrophobicContact CG2-CG2 3.8Å; F680-V684 HydrophobicContact CD1-CG2 4.02Å; F680-V684 HydrophobicContact CD2-CG2 4.16Å; F680-V684 HydrophobicContact CE1-CG2 3.49Å; F680-V684 VanDerWaalsContact CE1-CG2 3.49Å; F680-V684 HydrophobicContact CE2-CG2 3.64Å; F680-V684 HydrophobicContact CG-CG2 4.34Å; F680-V684 HydrophobicContact CZ-CG2 3.3Å; F680-V684 WeakPolarHBondContact O-CG2 3.29Å; F680-V684 PolarHBondContact O-N 3.41Å; V684-L687 PolarHBondContact O-N 3.49Å; V684-T688 VanDerWaalsContact O-CB 3.23Å; V684-T688 WeakPolarHBondContact O-CB 3.49Å; V684-T688 PolarHBondContact O-N 3.23Å; V684-T688 PolarHBondContact O-OG1 3.27Å
685Y89.1Confident90.3Very high3 Ų322 Ų221%0.01211%0.107CC..Hα-helixtrans-62.6-44.5178.3179.6-96.6000112.2L629 L635 V638 A681 Q682 C683 T688 I689 M725L629-Y685 PolarHBondContact O-OH 3.31Å; L635-Y685 HydrophobicContact CD1-CE1 4.11Å; V638-Y685 HydrophobicContact CG1-CD2 4.49Å; V638-Y685 HydrophobicContact CG1-CE2 4.06Å; A681-Y685 WeakPolarHBondContact O-CB 3.28Å; A681-Y685 PolarHBondContact O-N 3.35Å; Q682-Y685 PolarHBondContact O-N 2.96Å; C683-Y685 PolarHBondContact O-N 3.48Å; Y685-T688 WeakPolarHBondContact O-CB 3.37Å; Y685-T688 PolarHBondContact O-N 3.14Å; Y685-I689 HydrophobicContact CD1-CD1 3.93Å; Y685-I689 HydrophobicContact CE1-CD1 3.33Å; Y685-I689 HydrophobicContact CE1-CG1 4.43Å; Y685-I689 HydrophobicContact CE2-CD1 4.3Å; Y685-I689 PolarHBondContact O-N 3.44Å; Y685-I689 VanDerWaalsContact O-N 3.09Å; Y685-M725 HydrophobicContact CD1-CE 3.23Å; Y685-M725 HydrophobicContact CE1-CE 3.68Å; Y685-M725 HydrophobicContact CG-CE 4.19Å
686L91.3Very high90.4Very high0 Ų022 Ų220%011%0.107CC..Hα-helixtrans-64.4-44.2177-71.5174.3000111.9L661 M678 Q682 C683 T688 I689 L690 M725 C728 L729 I732L661-L686 HydrophobicContact CD1-CB 4.41Å; L661-L686 HydrophobicContact CD2-CB 4.14Å; L661-L686 HydrophobicContact CD2-CD1 4.15Å; M678-L686 HydrophobicContact CE-CD1 3.96Å; M678-L686 HydrophobicContact SD-CD1 3.47Å; M678-L686 WeakPolarHBondContact SD-CD1 3.41Å; Q682-L686 WeakPolarHBondContact O-CG 3.05Å; Q682-L686 PolarHBondContact O-N 2.97Å; Q682-L686 VanDerWaalsContact O-N 3.07Å; C683-L686 PolarHBondContact O-N 3.49Å; L686-T688 VanDerWaalsContact C-N 3.28Å; L686-T688 PolarHBondContact O-N 3.27Å; L686-I689 PolarHBondContact O-N 2.75Å; L686-L690 WeakPolarHBondContact O-CB 3.42Å; L686-L690 PolarHBondContact O-N 3.38Å; L686-M725 HydrophobicContact CD2-CE 4.22Å; L686-M725 HydrophobicContact CG-CE 4.29Å; L686-C728 HydrophobicContact CD1-CB 3.68Å; L686-C728 HydrophobicContact CD2-CB 3.99Å; L686-C728 HydrophobicContact CG-CB 4.49Å; L686-L729 HydrophobicContact CD2-CD2 4.12Å; L686-L729 HydrophobicContact CD2-CG 3.98Å; L686-I732 HydrophobicContact CB-CD1 4.04Å; L686-I732 HydrophobicContact CD2-CD1 3.87Å
687L89.7Confident90.4Very high3 Ų319.5 Ų19.52%0.0169%0.094CC..Hα-helixtrans-65.6-34.1177.2-168.860.8000111.6V599 F657 L661 C683 V684 L690 R691V599-L687 HydrophobicContact CG1-CB 3.94Å; V599-L687 HydrophobicContact CG1-CD2 3.38Å; V599-L687 HydrophobicContact CG1-CG 3.49Å; V599-L687 VanDerWaalsContact CG1-CG 3.49Å; F657-L687 HydrophobicContact CD1-CD2 4.12Å; F657-L687 HydrophobicContact CE1-CD2 4.46Å; L661-L687 HydrophobicContact CD1-CD1 4.32Å; C683-L687 WeakPolarHBondContact O-CB 3.18Å; C683-L687 PolarHBondContact O-N 2.93Å; V684-L687 PolarHBondContact O-N 3.49Å; L687-L690 HydrophobicContact CD1-CD2 4.23Å; L687-L690 PolarHBondContact O-N 2.95Å; L687-R691 HydrophobicContact CD1-CG 4.28Å; L687-R691 HydrophobicContact CG-CG 4.31Å; L687-R691 WeakPolarHBondContact O-CB 3.47Å; L687-R691 WeakPolarHBondContact O-CG 3.43Å; L687-R691 PolarHBondContact O-N 3.42Å
688T91.5Very high90.3Very high2 Ų213.1 Ų13.11%0.0127%0.07CC..Hα-helixtrans-59.7-50.3172.9-65.10000111.8W595 L629 V684 Y685 L686 R691 L692W595-T688 HydrophobicContact CB-CG2 3.49Å; W595-T688 VanDerWaalsContact CB-CG2 3.49Å; W595-T688 HydrophobicContact CG-CG2 4.42Å; L629-T688 HydrophobicContact CD1-CG2 3.71Å; V684-T688 VanDerWaalsContact O-CB 3.23Å; V684-T688 WeakPolarHBondContact O-CB 3.49Å; V684-T688 PolarHBondContact O-N 3.23Å; V684-T688 PolarHBondContact O-OG1 3.27Å; Y685-T688 WeakPolarHBondContact O-CB 3.37Å; Y685-T688 PolarHBondContact O-N 3.14Å; L686-T688 VanDerWaalsContact C-N 3.28Å; L686-T688 PolarHBondContact O-N 3.27Å; T688-R691 PolarHBondContact O-N 3.49Å; T688-L692 VanDerWaalsContact O-CB 3.23Å; T688-L692 WeakPolarHBondContact O-CB 3.32Å; T688-L692 PolarHBondContact O-N 3.33Å
689I92.8Very high90.3Very high0 Ų016.7 Ų16.70%09%0.089CC..Hα-helixtrans-62.7-47.4177.3-66.4171.3000110.3Y685 L686 R691 L692 E693 M709 Y712 L729 I732Y685-I689 HydrophobicContact CD1-CD1 3.93Å; Y685-I689 HydrophobicContact CE1-CD1 3.33Å; Y685-I689 HydrophobicContact CE1-CG1 4.43Å; Y685-I689 HydrophobicContact CE2-CD1 4.3Å; Y685-I689 PolarHBondContact O-N 3.44Å; Y685-I689 VanDerWaalsContact O-N 3.09Å; L686-I689 PolarHBondContact O-N 2.75Å; I689-R691 PolarHBondContact O-N 3.16Å; I689-L692 PolarHBondContact O-N 3.06Å; I689-E693 HydrophobicContact CG2-CG 4.18Å; I689-E693 WeakPolarHBondContact O-CB 3.31Å; I689-E693 WeakPolarHBondContact O-CG 3.43Å; I689-E693 PolarHBondContact O-N 3.34Å; I689-M709 HydrophobicContact CG2-CE 4.32Å; I689-M709 HydrophobicContact CG2-SD 4.21Å; I689-Y712 HydrophobicContact CD1-CD1 3.77Å; I689-Y712 HydrophobicContact CD1-CE1 3.59Å; I689-Y712 HydrophobicContact CG1-CD1 4.43Å; I689-Y712 HydrophobicContact CG1-CE1 3.82Å; I689-Y712 HydrophobicContact CG2-CD2 4.35Å; I689-Y712 HydrophobicContact CG2-CE1 4.27Å; I689-Y712 HydrophobicContact CG2-CE2 4.07Å; I689-L729 HydrophobicContact CB-CD2 4.42Å; I689-L729 HydrophobicContact CD1-CD2 3.75Å; I689-L729 HydrophobicContact CG2-CD2 3.98Å; I689-I732 HydrophobicContact CG2-CG2 4.42Å
690L93.1Very high90.1Very high4 Ų414.1 Ų14.12%0.0218%0.077CC..Hα-helixtrans-56.2-49.1179.3175.861.6000111.7L661 Q664 L665 L686 L687 T694 I732 Q735 V736L661-L690 HydrophobicContact CD1-CD2 4.21Å; Q664-L690 HydrophobicContact CB-CD2 3.71Å; Q664-L690 HydrophobicContact CG-CD2 4.35Å; L665-L690 HydrophobicContact CD2-CD2 4.39Å; L686-L690 WeakPolarHBondContact O-CB 3.42Å; L686-L690 PolarHBondContact O-N 3.38Å; L687-L690 HydrophobicContact CD1-CD2 4.23Å; L687-L690 PolarHBondContact O-N 2.95Å; L690-T694 WeakPolarHBondContact O-CB 3.13Å; L690-T694 PolarHBondContact O-N 2.67Å; L690-T694 PolarHBondContact O-OG1 3.45Å; L690-I732 HydrophobicContact CB-CD1 4.41Å; L690-I732 HydrophobicContact CB-CG1 4.29Å; L690-I732 HydrophobicContact CB-CG2 3.98Å; L690-I732 HydrophobicContact CD1-CG1 4.49Å; L690-I732 HydrophobicContact CD1-CG2 3.88Å; L690-Q735 HydrophobicContact CD1-CB 4.19Å; L690-V736 HydrophobicContact CD1-CG2 4.24Å
691R91.5Very high89.9Confident37 Ų3723 Ų2314%0.1412%0.119CC..Hα-helixtrans-68.9-48-178.5-67.8-65.9-176.8161.67.2112.3V599 T604 Q664 L687 T688 I689 E693 T694 L695V599-R691 HydrophobicContact CG2-CB 3.96Å; V599-R691 HydrophobicContact CG2-CG 3.99Å; T604-R691 HydrophobicContact CG2-CB 4.23Å; Q664-R691 VanDerWaalsContact CD-CZ 3.48Å; Q664-R691 VanDerWaalsContact CD-NH2 3.27Å; Q664-R691 VanDerWaalsContact OE1-CZ 3.22Å; L687-R691 HydrophobicContact CD1-CG 4.28Å; L687-R691 HydrophobicContact CG-CG 4.31Å; L687-R691 WeakPolarHBondContact O-CB 3.47Å; L687-R691 WeakPolarHBondContact O-CG 3.43Å; L687-R691 PolarHBondContact O-N 3.42Å; T688-R691 PolarHBondContact O-N 3.49Å; I689-R691 PolarHBondContact O-N 3.16Å; R691-E693 PolarHBondContact O-N 3.09Å; R691-T694 PolarHBondContact O-N 3.5Å; R691-L695 WeakPolarHBondContact O-CB 3.36Å; R691-L695 VanDerWaalsContact O-CG 3.22Å; R691-L695 WeakPolarHBondContact O-CG 3.41Å; R691-L695 PolarHBondContact O-N 3.27Å
692L93.7Very high89.7Confident0 Ų025.2 Ų25.20%013%0.129CC..Hα-helixtrans-56.8-52.5178.816560000111W595 A623 L629 T688 I689 L695 R696W595-L692 HydrophobicContact CD2-CB 4.22Å; W595-L692 HydrophobicContact CD2-CD1 4.23Å; W595-L692 HydrophobicContact CE3-CB 4.17Å; W595-L692 HydrophobicContact CH2-CD1 3.87Å; W595-L692 HydrophobicContact CZ2-CD1 3.36Å; W595-L692 HydrophobicContact CZ2-CG 4.47Å; W595-L692 HydrophobicContact CZ3-CB 4.32Å; W595-L692 HydrophobicContact CZ3-CD1 4.46Å; A623-L692 HydrophobicContact CB-CD1 4Å; L629-L692 HydrophobicContact CD1-CD2 3.78Å; L629-L692 HydrophobicContact CG-CD2 3.92Å; T688-L692 VanDerWaalsContact O-CB 3.23Å; T688-L692 WeakPolarHBondContact O-CB 3.32Å; T688-L692 PolarHBondContact O-N 3.33Å; I689-L692 PolarHBondContact O-N 3.06Å; L692-L695 PolarHBondContact O-N 3.37Å; L692-R696 WeakPolarHBondContact O-CB 3.42Å; L692-R696 PolarHBondContact O-N 2.91Å
693E93.9Very high89Confident0 Ų024.7 Ų24.70%013%0.129CC..Hα-helixtrans-73.7-33-173.4-61.2-60.3156.600111.7I689 R691 R696 V697 M709 Y712 V736I689-E693 HydrophobicContact CG2-CG 4.18Å; I689-E693 WeakPolarHBondContact O-CB 3.31Å; I689-E693 WeakPolarHBondContact O-CG 3.43Å; I689-E693 PolarHBondContact O-N 3.34Å; R691-E693 PolarHBondContact O-N 3.09Å; E693-R696 PolarHBondContact O-N 3.01Å; E693-R696 IonicContact OE1-CZ 3.38Å; E693-R696 IonicContact OE1-NH1 3.71Å; E693-R696 PolarHBondContact OE1-NH1 2.74Å; E693-R696 IonicContact OE1-NH2 2.72Å; E693-R696 IonicContact OE2-CZ 3.51Å; E693-R696 IonicContact OE2-NE 3.68Å; E693-R696 IonicContact OE2-NH1 2.73Å; E693-R696 PolarHBondContact OE2-NH1 2.68Å; E693-V697 VanDerWaalsContact O-CB 3.23Å; E693-V697 WeakPolarHBondContact O-CB 3.39Å; E693-V697 VanDerWaalsContact O-CG2 3.25Å; E693-V697 WeakPolarHBondContact O-CG2 3.49Å; E693-V697 PolarHBondContact O-N 3.5Å; E693-M709 HydrophobicContact CB-CG 4.46Å; E693-M709 HydrophobicContact CB-SD 3.75Å; E693-M709 HydrophobicContact CG-SD 3.65Å; E693-Y712 HydrophobicContact CG-CE2 4.03Å; E693-Y712 PolarHBondContact OE1-OH 3.1Å; E693-V736 HydrophobicContact CB-CG1 4.07Å; E693-V736 HydrophobicContact CB-CG2 4.02Å
694T93.1Very high88.7Confident37 Ų3731.6 Ų31.623%0.22716%0.155CC..Hα-helixtrans-62.8-46.1171.2-58.90000111.5L690 R691 T698 A739L690-T694 WeakPolarHBondContact O-CB 3.13Å; L690-T694 PolarHBondContact O-N 2.67Å; L690-T694 PolarHBondContact O-OG1 3.45Å; R691-T694 PolarHBondContact O-N 3.5Å; T694-T698 WeakPolarHBondContact O-CB 3.15Å; T694-T698 VanDerWaalsContact O-CG2 3.31Å; T694-T698 WeakPolarHBondContact O-CG2 3.15Å; T694-T698 PolarHBondContact O-N 2.75Å; T694-T698 VanDerWaalsContact O-N 3.13Å; T694-T698 PolarHBondContact O-OG1 3.14Å; T694-A739 HydrophobicContact CG2-CB 3.86Å
695L92.9Very high88.6Confident14 Ų1431.7 Ų31.77%0.07316%0.156CC..Hα-helixtrans-67.3-38.6178-68.2175.5000111.8W595 T604 F616 V619 A623 R691 L692 T698 N699W595-L695 HydrophobicContact CH2-CD1 4.47Å; W595-L695 HydrophobicContact CZ3-CD1 4.28Å; T604-L695 HydrophobicContact CG2-CD1 4.21Å; F616-L695 HydrophobicContact CE2-CD2 3.9Å; F616-L695 HydrophobicContact CZ-CD2 3.82Å; V619-L695 HydrophobicContact CG1-CD1 3.89Å; A623-L695 HydrophobicContact CB-CB 3.77Å; R691-L695 WeakPolarHBondContact O-CB 3.36Å; R691-L695 VanDerWaalsContact O-CG 3.22Å; R691-L695 WeakPolarHBondContact O-CG 3.41Å; R691-L695 PolarHBondContact O-N 3.27Å; L692-L695 PolarHBondContact O-N 3.37Å; L695-T698 WeakPolarHBondContact CA-OG1 3.44Å; L695-T698 PolarHBondContact O-OG1 3.12Å; L695-T698 VanDerWaalsContact O-OG1 3.06Å; L695-N699 WeakPolarHBondContact O-CB 3.42Å; L695-N699 PolarHBondContact O-N 3.13Å; L695-N699 PolarHBondContact O-ND2 3.2Å
696R92.9Very high88.5Confident2 Ų232.1 Ų32.11%0.00816%0.158CC..Hα-helixtrans-61.4-50175.8-177.2-175.1-70154.42110.9A623 S626 P627 L692 E693 T698 N699 S700 A705 F708A623-R696 HydrophobicContact CB-CB 4.29Å; A623-R696 PolarHBondContact O-NE 2.97Å; S626-R696 PolarHBondContact O-NH2 3.26Å; P627-R696 PolarHBondContact O-NH2 2.95Å; L692-R696 WeakPolarHBondContact O-CB 3.42Å; L692-R696 PolarHBondContact O-N 2.91Å; E693-R696 PolarHBondContact O-N 3.01Å; E693-R696 IonicContact OE1-CZ 3.38Å; E693-R696 IonicContact OE1-NH1 3.71Å; E693-R696 PolarHBondContact OE1-NH1 2.74Å; E693-R696 IonicContact OE1-NH2 2.72Å; E693-R696 IonicContact OE2-CZ 3.51Å; E693-R696 IonicContact OE2-NE 3.68Å; E693-R696 IonicContact OE2-NH1 2.73Å; E693-R696 PolarHBondContact OE2-NH1 2.68Å; R696-T698 VanDerWaalsContact C-N 3.32Å; R696-T698 PolarHBondContact O-N 2.96Å; R696-N699 PolarHBondContact O-N 3.43Å; R696-S700 WeakPolarHBondContact O-CA 3.41Å; R696-S700 WeakPolarHBondContact O-CB 3.21Å; R696-S700 PolarHBondContact O-N 3.48Å; R696-A705 HydrophobicContact CG-CB 4.05Å; R696-F708 VanDerWaalsContact NH1-CD2 3.31Å
697V90.8Very high88.5Confident10 Ų1033.4 Ų33.46%0.06116%0.164CC..Hα-helixtrans-66.6-32.7-176160.30000113.1E693 A705 V706 V736 Y740E693-V697 VanDerWaalsContact O-CB 3.23Å; E693-V697 WeakPolarHBondContact O-CB 3.39Å; E693-V697 VanDerWaalsContact O-CG2 3.25Å; E693-V697 WeakPolarHBondContact O-CG2 3.49Å; E693-V697 PolarHBondContact O-N 3.5Å; V697-A705 HydrophobicContact CG2-CB 4.33Å; V697-V706 HydrophobicContact CG1-CG2 3.96Å; V697-V706 HydrophobicContact CG2-CB 4.41Å; V697-V706 HydrophobicContact CG2-CG2 3.86Å; V697-V736 HydrophobicContact CB-CG1 4.31Å; V697-V736 HydrophobicContact CG2-CG1 3.76Å; V697-Y740 VanDerWaalsContact CG1-CA 3.42Å; V697-Y740 HydrophobicContact CG1-CD2 3.76Å; V697-Y740 HydrophobicContact CG1-CG 3.96Å
698T88.8Confident88.4Confident44 Ų4434.7 Ų34.727%0.2717%0.17SC..Hα-helixtrans-78.9-30.2179.346.80000113.1T694 L695 R696 A739 A743T694-T698 WeakPolarHBondContact O-CB 3.15Å; T694-T698 VanDerWaalsContact O-CG2 3.31Å; T694-T698 WeakPolarHBondContact O-CG2 3.15Å; T694-T698 PolarHBondContact O-N 2.75Å; T694-T698 VanDerWaalsContact O-N 3.13Å; T694-T698 PolarHBondContact O-OG1 3.14Å; L695-T698 WeakPolarHBondContact CA-OG1 3.44Å; L695-T698 PolarHBondContact O-OG1 3.12Å; L695-T698 VanDerWaalsContact O-OG1 3.06Å; R696-T698 VanDerWaalsContact C-N 3.32Å; R696-T698 PolarHBondContact O-N 2.96Å; T698-A739 HydrophobicContact CG2-CB 4.47Å; T698-A743 HydrophobicContact CG2-CB 4.34Å
699N88.7Confident88.4Confident78 Ų7834.6 Ų34.642%0.41717%0.169SC..Hα-helixtrans-108.9-18.1-172.5-66.6-81000114.9C620 V624 L695 R696C620-N699 HydrophobicContact CB-CB 4.45Å; V624-N699 HydrophobicContact CG2-CB 4.03Å; L695-N699 WeakPolarHBondContact O-CB 3.42Å; L695-N699 PolarHBondContact O-N 3.13Å; L695-N699 PolarHBondContact O-ND2 3.2Å; R696-N699 PolarHBondContact O-N 3.43Å
700S84.1Confident88.3Confident17 Ų1734.7 Ų34.712%0.11917%0.17CC..  trans-70144.6-179.8-178.80000112R696 D702R696-S700 WeakPolarHBondContact O-CA 3.41Å; R696-S700 WeakPolarHBondContact O-CB 3.21Å; R696-S700 PolarHBondContact O-N 3.48Å; S700-D702 PolarHBondContact OG-N 2.87Å; S700-D702 PolarHBondContact OG-O 3.27Å
701Q79.7Confident88.1Confident197 Ų19737.7 Ų37.792%0.92119%0.186SC*.  trans-92.6-11.9164.5-63.6-174.4-2.600112.3S703Q701-S703 PolarHBondContact O-N 3.1Å
702D79.6Confident88Confident52 Ų5235.9 Ų35.928%0.27818%0.179SC..  trans-78.5114.2174-170.4-12.8000110S700 R704 A705S700-D702 PolarHBondContact OG-N 2.87Å; S700-D702 PolarHBondContact OG-O 3.27Å; D702-R704 PolarHBondContact O-N 3.12Å; D702-R704 VanDerWaalsContact O-N 3.12Å; D702-R704 WeakPolarHBondContact OD1-CB 3.36Å; D702-R704 IonicContact OD1-CZ 3.44Å; D702-R704 PolarHBondContact OD1-N 3.37Å; D702-R704 IonicContact OD1-NE 3.77Å; D702-R704 PolarHBondContact OD1-NE 2.92Å; D702-R704 IonicContact OD1-NH2 2.72Å; D702-R704 IonicContact OD2-CZ 3.62Å; D702-R704 IonicContact OD2-NE 3.48Å; D702-R704 PolarHBondContact OD2-NE 3.42Å; D702-R704 IonicContact OD2-NH2 2.75Å; D702-R704 PolarHBondContact OD2-NH2 3.38Å; D702-A705 VanDerWaalsContact O-CB 3.32Å; D702-A705 WeakPolarHBondContact O-CB 3.23Å; D702-A705 PolarHBondContact O-N 3.18Å; D702-A705 VanDerWaalsContact O-N 3.1Å
703S75.7Confident87.9Confident17 Ų1735.9 Ų35.912%0.11918%0.179CC..G310 helixtrans-48.5-31.2172.5-167.80000113.5Q701 A705 D756 H760Q701-S703 PolarHBondContact O-N 3.1Å; S703-A705 VanDerWaalsContact C-N 3.25Å; S703-A705 PolarHBondContact O-N 3.11Å; S703-D756 WeakPolarHBondContact CB-OD1 3.42Å; S703-D756 WeakPolarHBondContact OG-CB 3.29Å; S703-D756 PolarHBondContact OG-OD1 3.39Å; S703-H760 PolarHBondContact O-CE1 3.49Å; S703-H760 PolarHBondContact O-NE2 3.44Å
704R82Confident87.6Confident145 Ų14539.3 Ų39.355%0.54720%0.195SC..G310 helixtrans-77.8-5.2-177.3-61.9170.9-62.9171.67.4114.2D702 V706 H707D702-R704 PolarHBondContact O-N 3.12Å; D702-R704 VanDerWaalsContact O-N 3.12Å; D702-R704 WeakPolarHBondContact OD1-CB 3.36Å; D702-R704 IonicContact OD1-CZ 3.44Å; D702-R704 PolarHBondContact OD1-N 3.37Å; D702-R704 IonicContact OD1-NE 3.77Å; D702-R704 PolarHBondContact OD1-NE 2.92Å; D702-R704 IonicContact OD1-NH2 2.72Å; D702-R704 IonicContact OD2-CZ 3.62Å; D702-R704 IonicContact OD2-NE 3.48Å; D702-R704 PolarHBondContact OD2-NE 3.42Å; D702-R704 IonicContact OD2-NH2 2.75Å; D702-R704 PolarHBondContact OD2-NH2 3.38Å; R704-V706 PolarHBondContact O-N 3.45Å; R704-H707 VanDerWaalsContact O-CB 3.28Å; R704-H707 WeakPolarHBondContact O-CB 3.38Å; R704-H707 PolarHBondContact O-N 2.71Å
705A85.9Confident87.3Confident4 Ų439.6 Ų39.63%0.03319%0.194CC..G310 helixtrans-54-39.3-177.200000113.6R696 V697 D702 S703 H707 F708R696-A705 HydrophobicContact CG-CB 4.05Å; V697-A705 HydrophobicContact CG2-CB 4.33Å; D702-A705 VanDerWaalsContact O-CB 3.32Å; D702-A705 WeakPolarHBondContact O-CB 3.23Å; D702-A705 PolarHBondContact O-N 3.18Å; D702-A705 VanDerWaalsContact O-N 3.1Å; S703-A705 VanDerWaalsContact C-N 3.25Å; S703-A705 PolarHBondContact O-N 3.11Å; A705-H707 PolarHBondContact O-N 3.08Å; A705-F708 WeakPolarHBondContact O-CD2 3.35Å
706V87.5Confident87Confident11 Ų1145.7 Ų45.77%0.06722%0.22CC..G310 helixtrans-66.8-28178.8-1780000112V697 R704 F708 V737 Y740V697-V706 HydrophobicContact CG1-CG2 3.96Å; V697-V706 HydrophobicContact CG2-CB 4.41Å; V697-V706 HydrophobicContact CG2-CG2 3.86Å; R704-V706 PolarHBondContact O-N 3.45Å; V706-F708 VanDerWaalsContact C-N 3.31Å; V706-F708 PolarHBondContact O-N 3.19Å; V706-V737 HydrophobicContact CG1-CG2 3.83Å; V706-Y740 HydrophobicContact CG2-CD1 4.09Å; V706-Y740 HydrophobicContact CG2-CD2 3.42Å; V706-Y740 VanDerWaalsContact CG2-CD2 3.42Å; V706-Y740 HydrophobicContact CG2-CE2 3.94Å; V706-Y740 HydrophobicContact CG2-CG 3.48Å; V706-Y740 VanDerWaalsContact CG2-CG 3.48Å
707H90.3Very high86.6Confident27 Ų2747.3 Ų47.313%0.12523%0.231CC..G310 helixtrans-71.6-26.2-174.7-56.6171.4000112.1R704 A705 M709 F710 H760 F763R704-H707 VanDerWaalsContact O-CB 3.28Å; R704-H707 WeakPolarHBondContact O-CB 3.38Å; R704-H707 PolarHBondContact O-N 2.71Å; A705-H707 PolarHBondContact O-N 3.08Å; H707-M709 PolarHBondContact O-N 3.17Å; H707-M709 VanDerWaalsContact O-N 3.11Å; H707-F710 WeakPolarHBondContact O-CB 3.45Å; H707-F710 PolarHBondContact O-N 3.44Å; H707-H760 AromaticContact CD2-ND1 3.61Å; H707-H760 AromaticContact NE2-CE1 3.83Å; H707-H760 AromaticContact NE2-ND1 3.12Å; H707-H760 PolarHBondContact NE2-ND1 2.96Å; H707-H760 VanDerWaalsContact NE2-ND1 3.12Å; H707-F763 HydrophobicContact CB-CD1 4.38Å; H707-F763 HydrophobicContact CB-CD2 4.31Å; H707-F763 HydrophobicContact CB-CE1 3.91Å; H707-F763 HydrophobicContact CB-CE2 3.83Å; H707-F763 HydrophobicContact CB-CZ 3.59Å; H707-F763 AromaticContact CD2-CD1 3.55Å; H707-F763 AromaticContact CD2-CE1 3.88Å; H707-F763 AromaticContact CD2-CG 3.75Å; H707-F763 AromaticContact CE1-CG 3.8Å; H707-F763 AromaticContact CG-CD1 3.86Å; H707-F763 AromaticContact CG-CD2 3.86Å; H707-F763 AromaticContact CG-CE1 3.91Å; H707-F763 AromaticContact CG-CE2 3.91Å; H707-F763 AromaticContact CG-CG 3.82Å; H707-F763 AromaticContact CG-CZ 3.92Å; H707-F763 AromaticContact ND1-CD2 3.72Å; H707-F763 AromaticContact ND1-CG 3.86Å; H707-F763 AromaticContact NE2-CD1 3.92Å; H707-F763 AromaticContact NE2-CG 3.75Å
708F88.4Confident86.4Confident30 Ų3047 Ų4713%0.13223%0.229CC..Hα-helixtrans-59.8-23.4-179.2-63.4-43000114L579 V628 R696 A705 V706 F710 D711 Y712L579-F708 HydrophobicContact CD2-CE1 4.49Å; L579-F708 HydrophobicContact CD2-CE2 3.97Å; L579-F708 HydrophobicContact CD2-CZ 3.5Å; L579-F708 VanDerWaalsContact CD2-CZ 3.5Å; V628-F708 HydrophobicContact CG2-CB 3.99Å; V628-F708 HydrophobicContact CG2-CD1 3.92Å; V628-F708 HydrophobicContact CG2-CG 3.99Å; R696-F708 VanDerWaalsContact NH1-CD2 3.31Å; A705-F708 WeakPolarHBondContact O-CD2 3.35Å; V706-F708 VanDerWaalsContact C-N 3.31Å; V706-F708 PolarHBondContact O-N 3.19Å; F708-F710 PolarHBondContact O-N 3.28Å; F708-D711 WeakPolarHBondContact O-CB 3.4Å; F708-D711 PolarHBondContact O-N 3.39Å; F708-D711 VanDerWaalsContact O-N 3.14Å; F708-Y712 WeakPolarHBondContact O-CD2 3.46Å
709M91.6Very high86.2Confident0 Ų047.8 Ų47.80%023%0.227CC..Hα-helixtrans-59.1-33173-80.5-54.8-52.800112.7I689 E693 H707 D711 Y712 L713 I732 T733 V736I689-M709 HydrophobicContact CG2-CE 4.32Å; I689-M709 HydrophobicContact CG2-SD 4.21Å; E693-M709 HydrophobicContact CB-CG 4.46Å; E693-M709 HydrophobicContact CB-SD 3.75Å; E693-M709 HydrophobicContact CG-SD 3.65Å; H707-M709 PolarHBondContact O-N 3.17Å; H707-M709 VanDerWaalsContact O-N 3.11Å; M709-D711 VanDerWaalsContact C-N 3.31Å; M709-D711 PolarHBondContact O-N 3.45Å; M709-Y712 PolarHBondContact O-N 3.14Å; M709-Y712 HydrophobicContact SD-CD2 4.29Å; M709-L713 PolarHBondContact O-N 3.15Å; M709-I732 HydrophobicContact CE-CB 4.41Å; M709-I732 HydrophobicContact CE-CG2 3.79Å; M709-I732 HydrophobicContact SD-CG2 4.42Å; M709-T733 HydrophobicContact CB-CG2 3.91Å; M709-T733 WeakPolarHBondContact CE-OG1 3.37Å; M709-T733 HydrophobicContact CG-CG2 4.49Å; M709-V736 HydrophobicContact CG-CB 4.15Å; M709-V736 HydrophobicContact CG-CG1 3.94Å; M709-V736 HydrophobicContact CG-CG2 4.41Å; M709-V736 HydrophobicContact SD-CG2 4.14Å
710F91Very high85.9Confident2 Ų252.5 Ų52.51%0.00924%0.244CC..Hα-helixtrans-73.1-24.7179.7-73.8-98000112.6H707 F708 Y712 L713 E714 T733 F763 L764 K767 I775 A779H707-F710 WeakPolarHBondContact O-CB 3.45Å; H707-F710 PolarHBondContact O-N 3.44Å; F708-F710 PolarHBondContact O-N 3.28Å; F710-Y712 VanDerWaalsContact C-N 3.27Å; F710-Y712 PolarHBondContact O-N 3.41Å; F710-L713 HydrophobicContact CD1-CD1 4.21Å; F710-L713 HydrophobicContact CE1-CD1 4.45Å; F710-L713 PolarHBondContact O-N 3.24Å; F710-L713 VanDerWaalsContact O-N 3.1Å; F710-E714 WeakPolarHBondContact O-CG 3.4Å; F710-E714 PolarHBondContact O-N 3.29Å; F710-T733 HydrophobicContact CE2-CG2 4.39Å; F710-F763 HydrophobicContact CB-CE1 4.44Å; F710-F763 HydrophobicContact CB-CZ 4.04Å; F710-F763 AromaticContact CD2-CE1 3.51Å; F710-F763 HydrophobicContact CD2-CE1 3.51Å; F710-F763 AromaticContact CD2-CZ 3.96Å; F710-F763 HydrophobicContact CD2-CZ 3.96Å; F710-F763 AromaticContact CE2-CE1 3.83Å; F710-F763 HydrophobicContact CE2-CE1 3.83Å; F710-F763 AromaticContact CG-CE1 3.93Å; F710-F763 HydrophobicContact CG-CE1 3.93Å; F710-F763 HydrophobicContact CG-CZ 4.03Å; F710-L764 HydrophobicContact CE2-CD2 3.96Å; F710-L764 HydrophobicContact CZ-CD2 3.67Å; F710-K767 HydrophobicContact CB-CD 4.46Å; F710-K767 HydrophobicContact CD1-CB 4.06Å; F710-K767 HydrophobicContact CD1-CD 3.89Å; F710-K767 HydrophobicContact CD1-CG 3.66Å; F710-K767 HydrophobicContact CE1-CB 3.8Å; F710-K767 HydrophobicContact CE1-CG 3.86Å; F710-K767 HydrophobicContact CG-CD 4.34Å; F710-K767 HydrophobicContact CG-CG 4.16Å; F710-K767 HydrophobicContact CZ-CG 4.5Å; F710-I775 HydrophobicContact CD1-CG2 4.04Å; F710-I775 HydrophobicContact CE1-CG2 4.13Å; F710-A779 HydrophobicContact CE1-CB 4.18Å; F710-A779 HydrophobicContact CZ-CB 4.31Å
711D88.2Confident85.9Confident67 Ų6754.1 Ų54.136%0.35825%0.251SS..Hα-helixtrans-64-35.9174.5-60.6-25.9000110.9V628 F708 M709 E715V628-D711 HydrophobicContact CG1-CB 4.22Å; F708-D711 WeakPolarHBondContact O-CB 3.4Å; F708-D711 PolarHBondContact O-N 3.39Å; F708-D711 VanDerWaalsContact O-N 3.14Å; M709-D711 VanDerWaalsContact C-N 3.31Å; M709-D711 PolarHBondContact O-N 3.45Å; D711-E715 PolarHBondContact O-N 3.29Å
712Y90.2Very high86.1Confident0 Ų054.8 Ų54.80%025%0.251CS..Hα-helixtrans-66.8-37.7172.1-66.8-82000112.7V628 L629 V630 I689 E693 F708 M709 F710 I718V628-Y712 HydrophobicContact CG1-CD1 4.33Å; V628-Y712 HydrophobicContact CG1-CD2 3.89Å; V628-Y712 HydrophobicContact CG1-CE1 3.9Å; V628-Y712 HydrophobicContact CG1-CE2 3.4Å; V628-Y712 VanDerWaalsContact CG1-CE2 3.4Å; V628-Y712 HydrophobicContact CG1-CG 4.34Å; V628-Y712 VanDerWaalsContact CG1-CZ 3.41Å; L629-Y712 HydrophobicContact CB-CE1 4.19Å; L629-Y712 PolarHBondContact N-OH 3.17Å; V630-Y712 HydrophobicContact CG2-CD1 3.5Å; V630-Y712 VanDerWaalsContact CG2-CD1 3.5Å; V630-Y712 HydrophobicContact CG2-CE1 3.84Å; V630-Y712 HydrophobicContact CG2-CG 4.04Å; I689-Y712 HydrophobicContact CD1-CD1 3.77Å; I689-Y712 HydrophobicContact CD1-CE1 3.59Å; I689-Y712 HydrophobicContact CG1-CD1 4.43Å; I689-Y712 HydrophobicContact CG1-CE1 3.82Å; I689-Y712 HydrophobicContact CG2-CD2 4.35Å; I689-Y712 HydrophobicContact CG2-CE1 4.27Å; I689-Y712 HydrophobicContact CG2-CE2 4.07Å; E693-Y712 HydrophobicContact CG-CE2 4.03Å; E693-Y712 PolarHBondContact OE1-OH 3.1Å; F708-Y712 WeakPolarHBondContact O-CD2 3.46Å; M709-Y712 PolarHBondContact O-N 3.14Å; M709-Y712 HydrophobicContact SD-CD2 4.29Å; F710-Y712 VanDerWaalsContact C-N 3.27Å; F710-Y712 PolarHBondContact O-N 3.41Å; Y712-I718 HydrophobicContact CD1-CD1 4.35Å; Y712-I718 WeakPolarHBondContact O-CD1 3.16Å
713L90.1Very high86.3Confident0 Ų053.8 Ų53.80%025%0.248CC..Hα-helixtrans-72.7-31.1-178.6-63.4-179.7000112.4M709 F710 R719 W726 L729 L730 T733 I775M709-L713 PolarHBondContact O-N 3.15Å; F710-L713 HydrophobicContact CD1-CD1 4.21Å; F710-L713 HydrophobicContact CE1-CD1 4.45Å; F710-L713 PolarHBondContact O-N 3.24Å; F710-L713 VanDerWaalsContact O-N 3.1Å; L713-R719 VanDerWaalsContact O-CD 3.27Å; L713-R719 WeakPolarHBondContact O-CD 3.31Å; L713-R719 WeakPolarHBondContact O-CG 3.25Å; L713-W726 PolarHBondContact O-NE1 3.44Å; L713-L729 HydrophobicContact CD2-CB 4.02Å; L713-L730 HydrophobicContact CD1-CD2 3.91Å; L713-L730 HydrophobicContact CD2-CD2 3.74Å; L713-L730 HydrophobicContact CD2-CG 3.99Å; L713-L730 HydrophobicContact CG-CD2 4.45Å; L713-T733 HydrophobicContact CD1-CG2 4.39Å; L713-I775 HydrophobicContact CB-CD1 4.41Å; L713-I775 HydrophobicContact CB-CG1 4.39Å
714E88Confident86.9Confident72 Ų7253.6 Ų53.634%0.33625%0.249SC..Hα-helixtrans-82.4-20.7-178-72.4178.2171.600113F710 K716 R719 K767 I775F710-E714 WeakPolarHBondContact O-CG 3.4Å; F710-E714 PolarHBondContact O-N 3.29Å; E714-K716 PolarHBondContact O-N 3.24Å; E714-R719 PolarHBondContact O-NE 2.9Å; E714-R719 VanDerWaalsContact O-NE 3.1Å; E714-R719 PolarHBondContact O-NH2 3.13Å; E714-K767 WeakPolarHBondContact OE1-CE 3.45Å; E714-K767 IonicContact OE1-NZ 2.93Å; E714-K767 PolarHBondContact OE1-NZ 3.46Å; E714-K767 IonicContact OE2-NZ 4Å; E714-K767 PolarHBondContact OE2-NZ 2.92Å; E714-I775 HydrophobicContact CG-CD1 3.94Å
715E87.6Confident87.2Confident42 Ų4246.7 Ų46.720%0.19622%0.223CC..  trans-58.7130.1-179.6-176.256.4-128.600113.2V630 D711 C717 I718 R719V630-E715 HydrophobicContact CG1-CB 3.83Å; V630-E715 VanDerWaalsContact CG1-CD 3.49Å; V630-E715 HydrophobicContact CG1-CG 3.48Å; V630-E715 VanDerWaalsContact CG1-CG 3.48Å; V630-E715 WeakPolarHBondContact CG1-OE2 3.34Å; D711-E715 PolarHBondContact O-N 3.29Å; E715-C717 HydrophobicContact CG-CB 4.42Å; E715-C717 PolarHBondContact O-N 2.74Å; E715-I718 HydrophobicContact CB-CB 4.43Å; E715-I718 HydrophobicContact CB-CD1 4.13Å; E715-I718 HydrophobicContact CB-CG1 4.32Å; E715-I718 HydrophobicContact CG-CD1 4.39Å; E715-I718 HydrophobicContact CG-CG1 4.29Å; E715-I718 PolarHBondContact O-N 2.72Å; E715-R719 PolarHBondContact O-N 2.82Å; E715-R719 PolarHBondContact O-NE 3.34Å
716K85.2Confident87.4Confident143 Ų14348.3 Ų48.362%0.62223%0.228SC*.Hα-helixtrans-67.3-38.6-174.2-70.1177.4-178174.90112.5E714 I718 K720E714-K716 PolarHBondContact O-N 3.24Å; K716-I718 VanDerWaalsContact C-N 3.34Å; K716-K720 WeakPolarHBondContact O-CG 3.31Å; K716-K720 PolarHBondContact O-N 2.92Å
717C84.9Confident87.6Confident35 Ų3550.3 Ų50.324%0.23624%0.241CC..Hα-helixtrans-69.3-30.8-178-78.40000113.3P632 L635 E715P632-C717 PolarHBondContact O-SG 3.46Å; L635-C717 HydrophobicContact CB-CB 4.38Å; E715-C717 HydrophobicContact CG-CB 4.42Å; E715-C717 PolarHBondContact O-N 2.74Å
718I86Confident87.7Confident3 Ų349 Ų492%0.01524%0.235CC..Hα-helixtrans-75.3-43.1176.7-66.5176.1000110.5L635 Y712 E715 K716 K720 D721 W726 L729L635-I718 HydrophobicContact CD1-CG1 4.06Å; L635-I718 HydrophobicContact CD2-CG1 4.4Å; Y712-I718 HydrophobicContact CD1-CD1 4.35Å; Y712-I718 WeakPolarHBondContact O-CD1 3.16Å; E715-I718 HydrophobicContact CB-CB 4.43Å; E715-I718 HydrophobicContact CB-CD1 4.13Å; E715-I718 HydrophobicContact CB-CG1 4.32Å; E715-I718 HydrophobicContact CG-CD1 4.39Å; E715-I718 HydrophobicContact CG-CG1 4.29Å; E715-I718 PolarHBondContact O-N 2.72Å; K716-I718 VanDerWaalsContact C-N 3.34Å; I718-K720 PolarHBondContact O-N 3.21Å; I718-D721 VanDerWaalsContact O-CB 3.28Å; I718-D721 WeakPolarHBondContact O-CB 3.23Å; I718-D721 PolarHBondContact O-N 3.49Å; I718-W726 HydrophobicContact CG2-CB 4.29Å; I718-L729 HydrophobicContact CD1-CD1 4.08Å; I718-L729 HydrophobicContact CG2-CD1 3.34Å
719R85Confident87.9Confident61 Ų6147.6 Ų47.623%0.2323%0.228CC..Hα-helixtrans-66.1-35.3-179.6-75-173.6-70.1124-11.7114.4L713 E714 E715 D721 W726L713-R719 VanDerWaalsContact O-CD 3.27Å; L713-R719 WeakPolarHBondContact O-CD 3.31Å; L713-R719 WeakPolarHBondContact O-CG 3.25Å; E714-R719 PolarHBondContact O-NE 2.9Å; E714-R719 VanDerWaalsContact O-NE 3.1Å; E714-R719 PolarHBondContact O-NH2 3.13Å; E715-R719 PolarHBondContact O-N 2.82Å; E715-R719 PolarHBondContact O-NE 3.34Å; R719-D721 PolarHBondContact O-N 3Å; R719-W726 HydrophobicContact CG-CD2 4.12Å; R719-W726 HydrophobicContact CG-CG 4.15Å; R719-W726 HydrophobicContact CG-CZ2 4.09Å
720K83.1Confident87.9Confident178 Ų17849 Ų4977%0.77424%0.235SC*.THydrogen-bonded Turntrans-79.8-2179.4-70.1-175.5178.5-175.30113.6K716 I718K716-K720 WeakPolarHBondContact O-CG 3.31Å; K716-K720 PolarHBondContact O-N 2.92Å; I718-K720 PolarHBondContact O-N 3.21Å
721D83.3Confident88Confident51 Ų5149.6 Ų49.627%0.27324%0.241SC..  trans-69.4136.9-178.4178.161.7000112.3L635 I718 R719 S723 G724L635-D721 HydrophobicContact CD2-CB 3.8Å; I718-D721 VanDerWaalsContact O-CB 3.28Å; I718-D721 WeakPolarHBondContact O-CB 3.23Å; I718-D721 PolarHBondContact O-N 3.49Å; R719-D721 PolarHBondContact O-N 3Å; D721-S723 PolarHBondContact OD1-OG 3.45Å; D721-S723 WeakPolarHBondContact OD2-CA 3.4Å; D721-S723 WeakPolarHBondContact OD2-CB 3.35Å; D721-S723 PolarHBondContact OD2-N 3.4Å; D721-S723 PolarHBondContact OD2-OG 3.05Å; D721-G724 PolarHBondContact OD2-N 3.32Å
722K83.6Confident88.3Confident210 Ų21046.4 Ų46.491%0.91322%0.224SC*.SBendtrans-92.7-5.3-178.6-66-173.2179.1-176.40113.7G724K722-G724 VanDerWaalsContact C-N 3.34Å
723S84.2Confident88.5Confident31 Ų3146.4 Ų46.422%0.21722%0.224CC..SBendtrans-86.8-4.8-177.572.80000113.9Q682 D721 M725Q682-S723 PolarHBondContact NE2-OG 3.42Å; D721-S723 PolarHBondContact OD1-OG 3.45Å; D721-S723 WeakPolarHBondContact OD2-CA 3.4Å; D721-S723 WeakPolarHBondContact OD2-CB 3.35Å; D721-S723 PolarHBondContact OD2-N 3.4Å; D721-S723 PolarHBondContact OD2-OG 3.05Å; S723-M725 WeakPolarHBondContact OG-CG 3.38Å
724G88.1Confident88.7Confident14 Ų1448 Ų4814%0.14423%0.233CC..SBendtrans85.616.4178.900000114D721 K722 W726 T727 C728D721-G724 PolarHBondContact OD2-N 3.32Å; K722-G724 VanDerWaalsContact C-N 3.34Å; G724-W726 VanDerWaalsContact C-N 3.27Å; G724-W726 PolarHBondContact O-N 3.04Å; G724-T727 PolarHBondContact O-N 2.73Å; G724-C728 PolarHBondContact O-N 3.08Å; G724-C728 PolarHBondContact O-SG 2.82Å; G724-C728 VanDerWaalsContact O-SG 3.37Å
725M89.2Confident88.9Confident0 Ų046.6 Ų46.60%023%0.226CC..Hα-helixtrans-61-35.9177.7-73.5-177.478.500113L635 I639 M678 Q682 Y685 L686 S723 T727 C728 L729L635-M725 HydrophobicContact CD1-CE 4.43Å; L635-M725 HydrophobicContact CD2-CE 4.32Å; L635-M725 HydrophobicContact CD2-SD 3.61Å; L635-M725 HydrophobicContact CG-SD 4.29Å; I639-M725 HydrophobicContact CD1-CE 3.65Å; I639-M725 HydrophobicContact CD1-SD 3.33Å; I639-M725 WeakPolarHBondContact CD1-SD 3.48Å; I639-M725 HydrophobicContact CG1-CE 4.45Å; M678-M725 HydrophobicContact CE-CG 3.99Å; Q682-M725 HydrophobicContact CG-SD 4.25Å; Y685-M725 HydrophobicContact CD1-CE 3.23Å; Y685-M725 HydrophobicContact CE1-CE 3.68Å; Y685-M725 HydrophobicContact CG-CE 4.19Å; L686-M725 HydrophobicContact CD2-CE 4.22Å; L686-M725 HydrophobicContact CG-CE 4.29Å; S723-M725 WeakPolarHBondContact OG-CG 3.38Å; M725-T727 PolarHBondContact O-N 3.28Å; M725-C728 WeakPolarHBondContact O-CB 3.37Å; M725-C728 PolarHBondContact O-N 2.98Å; M725-L729 WeakPolarHBondContact O-CG 3.3Å; M725-L729 PolarHBondContact O-N 3.49Å
726W90.4Very high89.2Confident37 Ų3744.6 Ų44.614%0.1422%0.216CC..Hα-helixtrans-62.9-41.7177.9-170.757.6000112.2L713 I718 R719 G724 C728 L729 L730 E774 I775L713-W726 PolarHBondContact O-NE1 3.44Å; I718-W726 HydrophobicContact CG2-CB 4.29Å; R719-W726 HydrophobicContact CG-CD2 4.12Å; R719-W726 HydrophobicContact CG-CG 4.15Å; R719-W726 HydrophobicContact CG-CZ2 4.09Å; G724-W726 VanDerWaalsContact C-N 3.27Å; G724-W726 PolarHBondContact O-N 3.04Å; W726-C728 VanDerWaalsContact C-N 3.31Å; W726-C728 PolarHBondContact O-N 2.92Å; W726-L729 PolarHBondContact O-N 3.49Å; W726-L730 HydrophobicContact CD2-CD1 4.35Å; W726-L730 HydrophobicContact CE3-CD1 4.42Å; W726-L730 WeakPolarHBondContact O-CG 3.46Å; W726-L730 PolarHBondContact O-N 3.48Å; W726-E774 HydrophobicContact CH2-CB 3.37Å; W726-E774 HydrophobicContact CH2-CG 3.54Å; W726-E774 WeakPolarHBondContact CH2-OE2 3.33Å; W726-E774 HydrophobicContact CZ2-CB 3.94Å; W726-E774 HydrophobicContact CZ3-CB 3.9Å; W726-E774 HydrophobicContact CZ3-CG 3.63Å; W726-I775 HydrophobicContact CZ2-CG1 4.29Å
727T91.4Very high89.6Confident54 Ų5438 Ų3833%0.33119%0.188SC..Hα-helixtrans-61.1-39.6173.5-47.30000111.9V671 L674 G724 M725 L730 A731V671-T727 HydrophobicContact CG2-CG2 4.34Å; L674-T727 HydrophobicContact CD1-CG2 4Å; G724-T727 PolarHBondContact O-N 2.73Å; M725-T727 PolarHBondContact O-N 3.28Å; T727-L730 PolarHBondContact O-N 2.85Å; T727-A731 PolarHBondContact O-N 3.42Å
728C92.1Very high90Very high0 Ų039.7 Ų39.70%019%0.193CC..Hα-helixtrans-67.4-39.3176.5-60.40000111.8M678 L686 G724 M725 W726 L730 A731 I732M678-C728 HydrophobicContact CE-CB 4.46Å; M678-C728 WeakPolarHBondContact CE-SG 3.33Å; L686-C728 HydrophobicContact CD1-CB 3.68Å; L686-C728 HydrophobicContact CD2-CB 3.99Å; L686-C728 HydrophobicContact CG-CB 4.49Å; G724-C728 PolarHBondContact O-N 3.08Å; G724-C728 PolarHBondContact O-SG 2.82Å; G724-C728 VanDerWaalsContact O-SG 3.37Å; M725-C728 WeakPolarHBondContact O-CB 3.37Å; M725-C728 PolarHBondContact O-N 2.98Å; W726-C728 VanDerWaalsContact C-N 3.31Å; W726-C728 PolarHBondContact O-N 2.92Å; C728-L730 VanDerWaalsContact C-N 3.33Å; C728-L730 PolarHBondContact O-N 3.36Å; C728-A731 WeakPolarHBondContact O-CB 3.32Å; C728-A731 PolarHBondContact O-N 3.41Å; C728-A731 VanDerWaalsContact O-N 3.15Å; C728-I732 WeakPolarHBondContact O-CG1 3.38Å; C728-I732 PolarHBondContact O-N 2.91Å
729L92.6Very high90.2Very high0 Ų040.7 Ų40.70%020%0.201CC..Hα-helixtrans-66.1-33.8176.7-75.4166.4000113L686 I689 L713 I718 M725 W726 A731 I732 T733L686-L729 HydrophobicContact CD2-CD2 4.12Å; L686-L729 HydrophobicContact CD2-CG 3.98Å; I689-L729 HydrophobicContact CB-CD2 4.42Å; I689-L729 HydrophobicContact CD1-CD2 3.75Å; I689-L729 HydrophobicContact CG2-CD2 3.98Å; L713-L729 HydrophobicContact CD2-CB 4.02Å; I718-L729 HydrophobicContact CD1-CD1 4.08Å; I718-L729 HydrophobicContact CG2-CD1 3.34Å; M725-L729 WeakPolarHBondContact O-CG 3.3Å; M725-L729 PolarHBondContact O-N 3.49Å; W726-L729 PolarHBondContact O-N 3.49Å; L729-A731 VanDerWaalsContact C-N 3.3Å; L729-A731 PolarHBondContact O-N 3.46Å; L729-I732 HydrophobicContact CD2-CD1 4.07Å; L729-I732 PolarHBondContact O-N 3.2Å; L729-T733 WeakPolarHBondContact O-CB 3.47Å; L729-T733 PolarHBondContact O-N 3.41Å; L729-T733 PolarHBondContact O-OG1 3.36Å
730L92.6Very high90.6Very high28 Ų2838.9 Ų38.915%0.14719%0.194CC..Hα-helixtrans-61.2-40.7171.1-70.6165.6000111.2L713 W726 T727 C728 L734 E774 C778L713-L730 HydrophobicContact CD1-CD2 3.91Å; L713-L730 HydrophobicContact CD2-CD2 3.74Å; L713-L730 HydrophobicContact CD2-CG 3.99Å; L713-L730 HydrophobicContact CG-CD2 4.45Å; W726-L730 HydrophobicContact CD2-CD1 4.35Å; W726-L730 HydrophobicContact CE3-CD1 4.42Å; W726-L730 WeakPolarHBondContact O-CG 3.46Å; W726-L730 PolarHBondContact O-N 3.48Å; T727-L730 PolarHBondContact O-N 2.85Å; C728-L730 VanDerWaalsContact C-N 3.33Å; C728-L730 PolarHBondContact O-N 3.36Å; L730-L734 PolarHBondContact O-N 3.39Å; L730-E774 HydrophobicContact CD1-CB 4.05Å; L730-C778 HydrophobicContact CD2-CB 3.69Å
731A92.5Very high90.9Very high15 Ų1530.5 Ų30.512%0.12416%0.158CC..Hα-helixtrans-69.4-40.517500000112.6L665 P668 V671 T727 C728 L729 T733 L734 Q735L665-A731 HydrophobicContact CD2-CB 4.4Å; P668-A731 HydrophobicContact CG-CB 4.16Å; V671-A731 HydrophobicContact CG2-CB 3.94Å; T727-A731 PolarHBondContact O-N 3.42Å; C728-A731 WeakPolarHBondContact O-CB 3.32Å; C728-A731 PolarHBondContact O-N 3.41Å; C728-A731 VanDerWaalsContact O-N 3.15Å; L729-A731 VanDerWaalsContact C-N 3.3Å; L729-A731 PolarHBondContact O-N 3.46Å; A731-T733 VanDerWaalsContact C-N 3.3Å; A731-T733 PolarHBondContact O-N 3.41Å; A731-L734 PolarHBondContact O-N 3.28Å; A731-Q735 PolarHBondContact O-N 3.37Å
732I94.7Very high91.2Very high0 Ų031.5 Ų31.50%017%0.166CC..Hα-helixtrans-59.1-42.9174.4-70.3165.7000110.7L665 L686 I689 L690 M709 C728 L729 L734 Q735 V736L665-I732 HydrophobicContact CD2-CB 4.46Å; L665-I732 HydrophobicContact CD2-CG1 3.73Å; L686-I732 HydrophobicContact CB-CD1 4.04Å; L686-I732 HydrophobicContact CD2-CD1 3.87Å; I689-I732 HydrophobicContact CG2-CG2 4.42Å; L690-I732 HydrophobicContact CB-CD1 4.41Å; L690-I732 HydrophobicContact CB-CG1 4.29Å; L690-I732 HydrophobicContact CB-CG2 3.98Å; L690-I732 HydrophobicContact CD1-CG1 4.49Å; L690-I732 HydrophobicContact CD1-CG2 3.88Å; M709-I732 HydrophobicContact CE-CB 4.41Å; M709-I732 HydrophobicContact CE-CG2 3.79Å; M709-I732 HydrophobicContact SD-CG2 4.42Å; C728-I732 WeakPolarHBondContact O-CG1 3.38Å; C728-I732 PolarHBondContact O-N 2.91Å; L729-I732 HydrophobicContact CD2-CD1 4.07Å; L729-I732 PolarHBondContact O-N 3.2Å; I732-L734 VanDerWaalsContact C-N 3.28Å; I732-L734 PolarHBondContact O-N 2.86Å; I732-Q735 PolarHBondContact O-N 3.25Å; I732-V736 HydrophobicContact CG2-CG2 4.05Å; I732-V736 WeakPolarHBondContact O-CG2 3.49Å; I732-V736 PolarHBondContact O-N 3.3Å
733T94.2Very high91.3Very high0 Ų022.4 Ų22.40%013%0.13CC..Hα-helixtrans-56.1-44.2179.4-57.40000111.3M709 F710 L713 L729 A731 Q735 V736 V737M709-T733 HydrophobicContact CB-CG2 3.91Å; M709-T733 WeakPolarHBondContact CE-OG1 3.37Å; M709-T733 HydrophobicContact CG-CG2 4.49Å; F710-T733 HydrophobicContact CE2-CG2 4.39Å; L713-T733 HydrophobicContact CD1-CG2 4.39Å; L729-T733 WeakPolarHBondContact O-CB 3.47Å; L729-T733 PolarHBondContact O-N 3.41Å; L729-T733 PolarHBondContact O-OG1 3.36Å; A731-T733 VanDerWaalsContact C-N 3.3Å; A731-T733 PolarHBondContact O-N 3.41Å; T733-Q735 VanDerWaalsContact C-N 3.34Å; T733-Q735 PolarHBondContact O-N 3.03Å; T733-V736 PolarHBondContact O-N 3.46Å; T733-V737 VanDerWaalsContact O-CG2 3.3Å; T733-V737 WeakPolarHBondContact O-CG2 3.5Å; T733-V737 PolarHBondContact O-N 3.15Å
734L93.7Very high91.3Very high35 Ų3521.1 Ų21.118%0.18312%0.121CC..Hα-helixtrans-64-39177.6-62.7174.8000112.3L730 A731 I732 Q738 R781 L785L730-L734 PolarHBondContact O-N 3.39Å; A731-L734 PolarHBondContact O-N 3.28Å; I732-L734 VanDerWaalsContact C-N 3.28Å; I732-L734 PolarHBondContact O-N 2.86Å; L734-Q738 WeakPolarHBondContact O-CB 3.39Å; L734-Q738 PolarHBondContact O-N 3.18Å; L734-R781 HydrophobicContact CD2-CB 3.52Å; L734-L785 HydrophobicContact CB-CD1 4.45Å; L734-L785 HydrophobicContact CD2-CD1 4.23Å
735Q93.2Very high91Very high42 Ų4222.8 Ų22.820%0.19613%0.127CC..Hα-helixtrans-69.7-40.3178-66.4-65-8.600112.5L665 N666 L690 A731 I732 T733 Q738 A739L665-Q735 VanDerWaalsContact C-NE2 3.32Å; L665-Q735 HydrophobicContact CD2-CG 3.87Å; L665-Q735 PolarHBondContact O-NE2 2.76Å; L665-Q735 VanDerWaalsContact O-NE2 3.09Å; N666-Q735 PolarHBondContact ND2-NE2 2.97Å; L690-Q735 HydrophobicContact CD1-CB 4.19Å; A731-Q735 PolarHBondContact O-N 3.37Å; I732-Q735 PolarHBondContact O-N 3.25Å; T733-Q735 VanDerWaalsContact C-N 3.34Å; T733-Q735 PolarHBondContact O-N 3.03Å; Q735-Q738 WeakPolarHBondContact O-CB 3.3Å; Q735-Q738 PolarHBondContact O-N 3.02Å; Q735-A739 PolarHBondContact O-N 3.12Å
736V94Very high90.4Very high0 Ų030.6 Ų30.60%016%0.163CC..Hα-helixtrans-64.3-43.2176.11730000110.7L690 E693 V697 M709 I732 T733 Q738 A739 Y740L690-V736 HydrophobicContact CD1-CG2 4.24Å; E693-V736 HydrophobicContact CB-CG1 4.07Å; E693-V736 HydrophobicContact CB-CG2 4.02Å; V697-V736 HydrophobicContact CB-CG1 4.31Å; V697-V736 HydrophobicContact CG2-CG1 3.76Å; M709-V736 HydrophobicContact CG-CB 4.15Å; M709-V736 HydrophobicContact CG-CG1 3.94Å; M709-V736 HydrophobicContact CG-CG2 4.41Å; M709-V736 HydrophobicContact SD-CG2 4.14Å; I732-V736 HydrophobicContact CG2-CG2 4.05Å; I732-V736 WeakPolarHBondContact O-CG2 3.49Å; I732-V736 PolarHBondContact O-N 3.3Å; T733-V736 PolarHBondContact O-N 3.46Å; V736-Q738 VanDerWaalsContact C-N 3.34Å; V736-A739 WeakPolarHBondContact O-CB 3.32Å; V736-A739 PolarHBondContact O-N 3.48Å; V736-Y740 PolarHBondContact O-N 3.48Å
737V92.4Very high89.5Confident5 Ų533.1 Ų33.13%0.0318%0.175CC..Hα-helixtrans-64.7-38.6174.3172.80000111.1V706 T733 A739 Y740 V741 C782 L785V706-V737 HydrophobicContact CG1-CG2 3.83Å; T733-V737 VanDerWaalsContact O-CG2 3.3Å; T733-V737 WeakPolarHBondContact O-CG2 3.5Å; T733-V737 PolarHBondContact O-N 3.15Å; V737-A739 VanDerWaalsContact C-N 3.32Å; V737-A739 PolarHBondContact O-N 3.13Å; V737-Y740 VanDerWaalsContact O-CB 3.32Å; V737-Y740 WeakPolarHBondContact O-CB 3.48Å; V737-Y740 PolarHBondContact O-N 2.88Å; V737-V741 HydrophobicContact CG1-CG2 4.39Å; V737-V741 WeakPolarHBondContact O-CG2 3.43Å; V737-V741 PolarHBondContact O-N 3.33Å; V737-C782 HydrophobicContact CG1-CB 4.18Å; V737-C782 HydrophobicContact CG2-CB 4.32Å; V737-L785 HydrophobicContact CG1-CD1 4.43Å
738Q93Very high88.4Confident70 Ų7035 Ų3533%0.32718%0.176SC..Hα-helixtrans-62.3-39.7174.4-175.660.33600112.1L734 Q735 V736 V741 T742L734-Q738 WeakPolarHBondContact O-CB 3.39Å; L734-Q738 PolarHBondContact O-N 3.18Å; Q735-Q738 WeakPolarHBondContact O-CB 3.3Å; Q735-Q738 PolarHBondContact O-N 3.02Å; V736-Q738 VanDerWaalsContact C-N 3.34Å; Q738-V741 PolarHBondContact O-N 3.22Å; Q738-T742 WeakPolarHBondContact O-CB 3.31Å; Q738-T742 PolarHBondContact O-N 3.21Å; Q738-T742 PolarHBondContact O-OG1 3.43Å
739A91.3Very high86.8Confident23 Ų2339 Ų3919%0.1921%0.205CC..Hα-helixtrans-64.2-41.7174.300000111.6T694 T698 Q735 V736 V737 T742 A743T694-A739 HydrophobicContact CG2-CB 3.86Å; T698-A739 HydrophobicContact CG2-CB 4.47Å; Q735-A739 PolarHBondContact O-N 3.12Å; V736-A739 WeakPolarHBondContact O-CB 3.32Å; V736-A739 PolarHBondContact O-N 3.48Å; V737-A739 VanDerWaalsContact C-N 3.32Å; V737-A739 PolarHBondContact O-N 3.13Å; A739-T742 PolarHBondContact O-N 3.4Å; A739-A743 PolarHBondContact O-N 2.94Å
740Y92.3Very high85.6Confident24 Ų2444 Ų449%0.09423%0.228CC..Hα-helixtrans-55.4-53.9171.1177.9-108.8000111.5V697 V706 V736 V737 T742 A743 A744 L757 H760V697-Y740 VanDerWaalsContact CG1-CA 3.42Å; V697-Y740 HydrophobicContact CG1-CD2 3.76Å; V697-Y740 HydrophobicContact CG1-CG 3.96Å; V706-Y740 HydrophobicContact CG2-CD1 4.09Å; V706-Y740 HydrophobicContact CG2-CD2 3.42Å; V706-Y740 VanDerWaalsContact CG2-CD2 3.42Å; V706-Y740 HydrophobicContact CG2-CE2 3.94Å; V706-Y740 HydrophobicContact CG2-CG 3.48Å; V706-Y740 VanDerWaalsContact CG2-CG 3.48Å; V736-Y740 PolarHBondContact O-N 3.48Å; V737-Y740 VanDerWaalsContact O-CB 3.32Å; V737-Y740 WeakPolarHBondContact O-CB 3.48Å; V737-Y740 PolarHBondContact O-N 2.88Å; Y740-T742 PolarHBondContact O-N 3.43Å; Y740-A743 PolarHBondContact O-N 3.42Å; Y740-A743 VanDerWaalsContact O-N 3.09Å; Y740-A744 HydrophobicContact CE1-CB 4.22Å; Y740-A744 VanDerWaalsContact O-CB 3.3Å; Y740-A744 WeakPolarHBondContact O-CB 3.49Å; Y740-A744 PolarHBondContact O-N 3.39Å; Y740-L757 HydrophobicContact CE1-CD2 4.22Å; Y740-H760 AromaticContact CE1-CD2 3.73Å; Y740-H760 AromaticContact CE1-NE2 3.7Å; Y740-H760 AromaticContact CE2-NE2 3.74Å; Y740-H760 AromaticContact CZ-CD2 3.57Å; Y740-H760 AromaticContact CZ-NE2 3.16Å; Y740-H760 PolarHBondContact OH-CD2 3.46Å; Y740-H760 PolarHBondContact OH-NE2 3.04Å
741V90.6Very high84.3Confident2 Ų248.9 Ų48.91%0.01226%0.259CS..Hα-helixtrans-59-37.6-176.41690000110.8V737 Q738 D745 K789 F790V737-V741 HydrophobicContact CG1-CG2 4.39Å; V737-V741 WeakPolarHBondContact O-CG2 3.43Å; V737-V741 PolarHBondContact O-N 3.33Å; Q738-V741 PolarHBondContact O-N 3.22Å; V741-D745 PolarHBondContact O-N 3.07Å; V741-K789 HydrophobicContact CG1-CB 3.46Å; V741-K789 VanDerWaalsContact CG1-CB 3.46Å; V741-K789 HydrophobicContact CG1-CG 3.69Å; V741-F790 HydrophobicContact CG1-CE2 4.06Å
742T89Confident83.4Confident72 Ų7252.2 Ų52.244%0.44228%0.278SS..Hα-helixtrans-67.6-44.1176.8-53.20000111.8Q738 A739 Y740 D745Q738-T742 WeakPolarHBondContact O-CB 3.31Å; Q738-T742 PolarHBondContact O-N 3.21Å; Q738-T742 PolarHBondContact O-OG1 3.43Å; A739-T742 PolarHBondContact O-N 3.4Å; Y740-T742 PolarHBondContact O-N 3.43Å; T742-D745 PolarHBondContact O-N 2.81Å
743A85.4Confident82.8Confident18 Ų1853 Ų5315%0.14928%0.282CS..Hα-helixtrans-67.8-38.7176.200000112.5T698 A739 Y740 D745 Q746T698-A743 HydrophobicContact CG2-CB 4.34Å; A739-A743 PolarHBondContact O-N 2.94Å; Y740-A743 PolarHBondContact O-N 3.42Å; Y740-A743 VanDerWaalsContact O-N 3.09Å; A743-D745 VanDerWaalsContact C-N 3.32Å; A743-D745 PolarHBondContact O-N 3.49Å; A743-Q746 PolarHBondContact O-N 3.03Å
744A84.7Confident82Confident4 Ų457.5 Ų57.53%0.03330%0.301CS..Hα-helixtrans-62.2-37.6175.600000112.1Y740 Q746 K747 R748 L753 F790Y740-A744 HydrophobicContact CE1-CB 4.22Å; Y740-A744 VanDerWaalsContact O-CB 3.3Å; Y740-A744 WeakPolarHBondContact O-CB 3.49Å; Y740-A744 PolarHBondContact O-N 3.39Å; A744-Q746 VanDerWaalsContact C-N 3.25Å; A744-Q746 PolarHBondContact O-N 2.98Å; A744-K747 PolarHBondContact O-N 3.32Å; A744-R748 PolarHBondContact O-N 3.44Å; A744-L753 HydrophobicContact CB-CD1 3.8Å; A744-L753 WeakPolarHBondContact O-CD2 3.04Å; A744-F790 HydrophobicContact CB-CE2 3.96Å; A744-F790 HydrophobicContact CB-CZ 3.79Å
745D81Confident81.4Confident50 Ų5058.1 Ų58.127%0.26731%0.308SS..Hα-helixtrans-63.5-32.5179.3-17049.6000112.3V741 T742 A743 K747 R748 K789 F790V741-D745 PolarHBondContact O-N 3.07Å; T742-D745 PolarHBondContact O-N 2.81Å; A743-D745 VanDerWaalsContact C-N 3.32Å; A743-D745 PolarHBondContact O-N 3.49Å; D745-K747 VanDerWaalsContact C-N 3.25Å; D745-K747 PolarHBondContact O-N 3.32Å; D745-R748 IonicContact OD1-NH1 2.7Å; D745-K789 HydrophobicContact CB-CG 4.46Å; D745-K789 WeakPolarHBondContact OD1-CE 3.23Å; D745-K789 IonicContact OD1-NZ 2.81Å; D745-K789 WeakPolarHBondContact OD2-CE 3.44Å; D745-K789 IonicContact OD2-NZ 2.92Å; D745-K789 PolarHBondContact OD2-NZ 3.39Å; D745-F790 HydrophobicContact CB-CZ 4.25Å
746Q76.5Confident81Confident164 Ų16457.3 Ų57.377%0.76631%0.305SS*.Hα-helixtrans-69.5-22.7175.3-62.6-179.6-5.200112.8A743 A744A743-Q746 PolarHBondContact O-N 3.03Å; A744-Q746 VanDerWaalsContact C-N 3.25Å; A744-Q746 PolarHBondContact O-N 2.98Å
747K72.7Confident80.7Confident89 Ų8957.4 Ų57.439%0.38731%0.306SS..THydrogen-bonded Turntrans-103.417.1-176.9-60.9-179.5-174.1172.80113.8A744 D745 S749 E750A744-K747 PolarHBondContact O-N 3.32Å; D745-K747 VanDerWaalsContact C-N 3.25Å; D745-K747 PolarHBondContact O-N 3.32Å; K747-S749 PolarHBondContact O-N 3.09Å; K747-E750 PolarHBondContact O-N 3.01Å
748R68.6Low80.5Confident93 Ų9359.6 Ų59.635%0.35132%0.316SS..THydrogen-bonded Turntrans-55.5-19.9-170.7-162.7172.1-175145.85.7116.1A744 D745 F1096A744-R748 PolarHBondContact O-N 3.44Å; D745-R748 IonicContact OD1-NH1 2.7Å; R748-F1096 PolarHBondContact NH2-O 3.2Å; R748-F1096 VanDerWaalsContact NH2-O 3.13Å
749S58.4Low80.2Confident86 Ų8660.7 Ų60.760%0.60132%0.319SS*.THydrogen-bonded Turntrans-81.8-9.1178.652.10000115K747K747-S749 PolarHBondContact O-N 3.09Å
750E66.5Low80.2Confident105 Ų10559.8 Ų59.849%0.49131%0.311SS..  trans-85.5127-176.9-65.7178.5-174.400110.9K747 V752 L753K747-E750 PolarHBondContact O-N 3.01Å; E750-V752 PolarHBondContact O-N 3.36Å; E750-L753 WeakPolarHBondContact O-CB 3.45Å; E750-L753 PolarHBondContact O-N 2.95Å; E750-L753 VanDerWaalsContact O-N 3.13Å
751T66.1Low80.1Confident129 Ų12958.7 Ų58.779%0.79131%0.307SS*.Hα-helixtrans-60.5-27.5177.648.10000112.8L753 K754T751-L753 VanDerWaalsContact C-N 3.29Å; T751-L753 PolarHBondContact O-N 2.97Å; T751-K754 PolarHBondContact O-N 2.63Å
752V73.5Confident80.1Confident86 Ų8659.2 Ų59.252%0.52131%0.31SS..Hα-helixtrans-62.4-37177.8-174.60000111.4E750 K754 S755 D756E750-V752 PolarHBondContact O-N 3.36Å; V752-K754 VanDerWaalsContact C-N 3.3Å; V752-K754 PolarHBondContact O-N 3.03Å; V752-S755 PolarHBondContact O-N 3.32Å; V752-S755 VanDerWaalsContact O-N 3.15Å; V752-D756 PolarHBondContact O-N 3.46Å; V752-D756 VanDerWaalsContact O-N 3.08Å
753L80.9Confident80.1Confident15 Ų1556.6 Ų56.68%0.07929%0.292CS..Hα-helixtrans-60.5-38.3-177.7-179.265.5000112.2A744 E750 T751 S755 D756 L757 F790A744-L753 HydrophobicContact CB-CD1 3.8Å; A744-L753 WeakPolarHBondContact O-CD2 3.04Å; E750-L753 WeakPolarHBondContact O-CB 3.45Å; E750-L753 PolarHBondContact O-N 2.95Å; E750-L753 VanDerWaalsContact O-N 3.13Å; T751-L753 VanDerWaalsContact C-N 3.29Å; T751-L753 PolarHBondContact O-N 2.97Å; L753-S755 VanDerWaalsContact C-N 3.34Å; L753-S755 PolarHBondContact O-N 3.09Å; L753-D756 PolarHBondContact O-N 3.34Å; L753-L757 HydrophobicContact CD1-CD1 4.4Å; L753-L757 HydrophobicContact CD1-CD2 4.47Å; L753-L757 HydrophobicContact CD1-CG 4.11Å; L753-L757 HydrophobicContact CD2-CD1 4.44Å; L753-L757 HydrophobicContact CG-CD1 4Å; L753-L757 HydrophobicContact CG-CG 4.16Å; L753-L757 VanDerWaalsContact O-CG 3.3Å; L753-L757 WeakPolarHBondContact O-CG 3.31Å; L753-L757 PolarHBondContact O-N 3.03Å; L753-F790 HydrophobicContact CD2-CE1 4.49Å
754K78.1Confident80.4Confident96 Ų9656.3 Ų56.342%0.41729%0.288SS..Hα-helixtrans-59.9-46178.4-172-175.9175.7-170.60111T751 V752 D756 L757 E758 D796T751-K754 PolarHBondContact O-N 2.63Å; V752-K754 VanDerWaalsContact C-N 3.3Å; V752-K754 PolarHBondContact O-N 3.03Å; K754-D756 VanDerWaalsContact C-N 3.31Å; K754-D756 PolarHBondContact O-N 3.38Å; K754-L757 PolarHBondContact O-N 3.46Å; K754-E758 PolarHBondContact O-N 2.78Å; K754-E758 VanDerWaalsContact O-N 3.08Å; K754-D796 VanDerWaalsContact CE-OD1 3.29Å; K754-D796 WeakPolarHBondContact CE-OD1 3.41Å; K754-D796 IonicContact NZ-OD1 3.99Å
755S80.7Confident80.6Confident47 Ų4756.3 Ų56.333%0.32929%0.287SS..Hα-helixtrans-65.1-35177.4-175.80000112.2V752 L753 K759V752-S755 PolarHBondContact O-N 3.32Å; V752-S755 VanDerWaalsContact O-N 3.15Å; L753-S755 VanDerWaalsContact C-N 3.34Å; L753-S755 PolarHBondContact O-N 3.09Å; S755-K759 VanDerWaalsContact O-CG 3.29Å; S755-K759 WeakPolarHBondContact O-CG 3.5Å; S755-K759 PolarHBondContact O-N 3.02Å; S755-K759 VanDerWaalsContact O-N 3.17Å; S755-K759 WeakPolarHBondContact OG-CE 3.13Å; S755-K759 PolarHBondContact OG-NZ 3.39Å
756D84.6Confident80.9Confident25 Ų2554.7 Ų54.713%0.13428%0.278CS..Hα-helixtrans-69.7-46.3177.2-70.1-22.3000111.8S703 V752 L753 K754 E758 K759 H760S703-D756 WeakPolarHBondContact CB-OD1 3.42Å; S703-D756 WeakPolarHBondContact OG-CB 3.29Å; S703-D756 PolarHBondContact OG-OD1 3.39Å; V752-D756 PolarHBondContact O-N 3.46Å; V752-D756 VanDerWaalsContact O-N 3.08Å; L753-D756 PolarHBondContact O-N 3.34Å; K754-D756 VanDerWaalsContact C-N 3.31Å; K754-D756 PolarHBondContact O-N 3.38Å; D756-E758 VanDerWaalsContact C-N 3.3Å; D756-E758 PolarHBondContact O-N 3.25Å; D756-K759 PolarHBondContact O-N 3.46Å; D756-K759 VanDerWaalsContact O-N 3.14Å; D756-K759 IonicContact OD1-NZ 3.74Å; D756-H760 VanDerWaalsContact C-CD2 3.42Å; D756-H760 PolarHBondContact O-CD2 3.31Å; D756-H760 PolarHBondContact O-N 2.95Å
757L88Confident81.4Confident2 Ų248.1 Ų48.11%0.0125%0.247CC..Hα-helixtrans-58.9-40.9176.3-69.1174.9000112.2Y740 L753 K754 H760 A761 L786 F790 V793Y740-L757 HydrophobicContact CE1-CD2 4.22Å; L753-L757 HydrophobicContact CD1-CD1 4.4Å; L753-L757 HydrophobicContact CD1-CD2 4.47Å; L753-L757 HydrophobicContact CD1-CG 4.11Å; L753-L757 HydrophobicContact CD2-CD1 4.44Å; L753-L757 HydrophobicContact CG-CD1 4Å; L753-L757 HydrophobicContact CG-CG 4.16Å; L753-L757 VanDerWaalsContact O-CG 3.3Å; L753-L757 WeakPolarHBondContact O-CG 3.31Å; L753-L757 PolarHBondContact O-N 3.03Å; K754-L757 PolarHBondContact O-N 3.46Å; L757-H760 PolarHBondContact O-N 3.39Å; L757-A761 PolarHBondContact O-N 3.05Å; L757-L786 HydrophobicContact CD2-CD1 3.92Å; L757-L786 HydrophobicContact CD2-CD2 4.32Å; L757-L786 HydrophobicContact CD2-CG 4.09Å; L757-F790 HydrophobicContact CD1-CB 4Å; L757-F790 HydrophobicContact CD1-CD1 3.91Å; L757-F790 HydrophobicContact CD1-CD2 4.04Å; L757-F790 HydrophobicContact CD1-CE1 4.4Å; L757-F790 HydrophobicContact CD1-CG 3.71Å; L757-F790 HydrophobicContact CD2-CD2 3.78Å; L757-F790 HydrophobicContact CD2-CE2 4.07Å; L757-F790 HydrophobicContact CD2-CG 4.29Å; L757-V793 HydrophobicContact CB-CG2 3.8Å; L757-V793 HydrophobicContact CD1-CG2 4.2Å; L757-V793 HydrophobicContact CG-CG2 4.5Å
758E88Confident82.1Confident51 Ų5145.1 Ų45.124%0.23823%0.234CC..Hα-helixtrans-57.4-51.2172.8-172.3-162.6146.200111K754 D756 H760 A761 Q762 G798 V799K754-E758 PolarHBondContact O-N 2.78Å; K754-E758 VanDerWaalsContact O-N 3.08Å; D756-E758 VanDerWaalsContact C-N 3.3Å; D756-E758 PolarHBondContact O-N 3.25Å; E758-H760 VanDerWaalsContact C-N 3.33Å; E758-H760 PolarHBondContact O-N 3.27Å; E758-A761 PolarHBondContact O-N 3.42Å; E758-Q762 WeakPolarHBondContact O-CB 3.32Å; E758-Q762 VanDerWaalsContact O-CG 3.31Å; E758-Q762 WeakPolarHBondContact O-CG 3.35Å; E758-Q762 PolarHBondContact O-N 3.23Å; E758-Q762 PolarHBondContact OE1-NE2 2.96Å; E758-G798 WeakPolarHBondContact OE1-CA 3.48Å; E758-V799 HydrophobicContact CG-CG2 3.96Å
759K87.7Confident83Confident93 Ų9340.9 Ų40.940%0.40422%0.218SC..Hα-helixtrans-61.7-38.8178.2-69.7167-166.3156.20112.5S755 D756 F763S755-K759 VanDerWaalsContact O-CG 3.29Å; S755-K759 WeakPolarHBondContact O-CG 3.5Å; S755-K759 PolarHBondContact O-N 3.02Å; S755-K759 VanDerWaalsContact O-N 3.17Å; S755-K759 WeakPolarHBondContact OG-CE 3.13Å; S755-K759 PolarHBondContact OG-NZ 3.39Å; D756-K759 PolarHBondContact O-N 3.46Å; D756-K759 VanDerWaalsContact O-N 3.14Å; D756-K759 IonicContact OD1-NZ 3.74Å; K759-F763 VanDerWaalsContact O-CB 3.31Å; K759-F763 WeakPolarHBondContact O-CB 3.15Å; K759-F763 PolarHBondContact O-N 3.47Å
760H90.6Very high84.2Confident5 Ų537.3 Ų37.32%0.02319%0.194CC..Hα-helixtrans-63.5-46.3175.5-69.5-62.4000111.5S703 H707 Y740 D756 L757 E758 F763 L764 L786S703-H760 PolarHBondContact O-CE1 3.49Å; S703-H760 PolarHBondContact O-NE2 3.44Å; H707-H760 AromaticContact CD2-ND1 3.61Å; H707-H760 AromaticContact NE2-CE1 3.83Å; H707-H760 AromaticContact NE2-ND1 3.12Å; H707-H760 PolarHBondContact NE2-ND1 2.96Å; H707-H760 VanDerWaalsContact NE2-ND1 3.12Å; Y740-H760 AromaticContact CE1-CD2 3.73Å; Y740-H760 AromaticContact CE1-NE2 3.7Å; Y740-H760 AromaticContact CE2-NE2 3.74Å; Y740-H760 AromaticContact CZ-CD2 3.57Å; Y740-H760 AromaticContact CZ-NE2 3.16Å; Y740-H760 PolarHBondContact OH-CD2 3.46Å; Y740-H760 PolarHBondContact OH-NE2 3.04Å; D756-H760 VanDerWaalsContact C-CD2 3.42Å; D756-H760 PolarHBondContact O-CD2 3.31Å; D756-H760 PolarHBondContact O-N 2.95Å; L757-H760 PolarHBondContact O-N 3.39Å; E758-H760 VanDerWaalsContact C-N 3.33Å; E758-H760 PolarHBondContact O-N 3.27Å; H760-F763 PolarHBondContact O-N 2.97Å; H760-L764 WeakPolarHBondContact O-CB 3.45Å; H760-L764 VanDerWaalsContact O-CG 3.24Å; H760-L764 WeakPolarHBondContact O-CG 3.22Å; H760-L764 PolarHBondContact O-N 3.12Å; H760-L786 HydrophobicContact CB-CD1 3.91Å
761A90.8Very high85Confident0 Ų035.7 Ų35.70%019%0.188CC..Hα-helixtrans-64.7-43.9177.300000112L757 E758 F763 L764 L765 L783 V793 V799L757-A761 PolarHBondContact O-N 3.05Å; E758-A761 PolarHBondContact O-N 3.42Å; A761-F763 PolarHBondContact O-N 3.12Å; A761-L764 PolarHBondContact O-N 3.11Å; A761-L765 WeakPolarHBondContact O-CG 3.29Å; A761-L765 PolarHBondContact O-N 3.42Å; A761-L783 HydrophobicContact CB-CD1 4.11Å; A761-V793 HydrophobicContact CB-CG1 3.33Å; A761-V799 HydrophobicContact CB-CG1 4.12Å; A761-V799 HydrophobicContact CB-CG2 3.75Å
762Q89.7Confident85.8Confident14 Ų1433 Ų337%0.06517%0.165CC..Hα-helixtrans-55.1-51.7172.9-73.1169.1-15.900110.7E758 L764 L765 F766 G798 T802E758-Q762 WeakPolarHBondContact O-CB 3.32Å; E758-Q762 VanDerWaalsContact O-CG 3.31Å; E758-Q762 WeakPolarHBondContact O-CG 3.35Å; E758-Q762 PolarHBondContact O-N 3.23Å; E758-Q762 PolarHBondContact OE1-NE2 2.96Å; Q762-L764 VanDerWaalsContact C-N 3.33Å; Q762-L764 PolarHBondContact O-N 2.89Å; Q762-L765 WeakPolarHBondContact O-CB 3.19Å; Q762-L765 PolarHBondContact O-N 3.11Å; Q762-L765 VanDerWaalsContact O-N 3.13Å; Q762-F766 WeakPolarHBondContact O-CD2 3.46Å; Q762-F766 PolarHBondContact O-N 3.47Å; Q762-G798 PolarHBondContact NE2-O 2.92Å; Q762-T802 HydrophobicContact CB-CG2 4.35Å; Q762-T802 HydrophobicContact CG-CG2 4.15Å; Q762-T802 PolarHBondContact NE2-OG1 2.91Å
763F89.7Confident86.4Confident16 Ų1631.5 Ų31.57%0.0716%0.157CC..Hα-helixtrans-57-42.9177.1174.4-93.9000112.9H707 F710 K759 H760 A761 F766 K767 L832H707-F763 HydrophobicContact CB-CD1 4.38Å; H707-F763 HydrophobicContact CB-CD2 4.31Å; H707-F763 HydrophobicContact CB-CE1 3.91Å; H707-F763 HydrophobicContact CB-CE2 3.83Å; H707-F763 HydrophobicContact CB-CZ 3.59Å; H707-F763 AromaticContact CD2-CD1 3.55Å; H707-F763 AromaticContact CD2-CE1 3.88Å; H707-F763 AromaticContact CD2-CG 3.75Å; H707-F763 AromaticContact CE1-CG 3.8Å; H707-F763 AromaticContact CG-CD1 3.86Å; H707-F763 AromaticContact CG-CD2 3.86Å; H707-F763 AromaticContact CG-CE1 3.91Å; H707-F763 AromaticContact CG-CE2 3.91Å; H707-F763 AromaticContact CG-CG 3.82Å; H707-F763 AromaticContact CG-CZ 3.92Å; H707-F763 AromaticContact ND1-CD2 3.72Å; H707-F763 AromaticContact ND1-CG 3.86Å; H707-F763 AromaticContact NE2-CD1 3.92Å; H707-F763 AromaticContact NE2-CG 3.75Å; F710-F763 HydrophobicContact CB-CE1 4.44Å; F710-F763 HydrophobicContact CB-CZ 4.04Å; F710-F763 AromaticContact CD2-CE1 3.51Å; F710-F763 HydrophobicContact CD2-CE1 3.51Å; F710-F763 AromaticContact CD2-CZ 3.96Å; F710-F763 HydrophobicContact CD2-CZ 3.96Å; F710-F763 AromaticContact CE2-CE1 3.83Å; F710-F763 HydrophobicContact CE2-CE1 3.83Å; F710-F763 AromaticContact CG-CE1 3.93Å; F710-F763 HydrophobicContact CG-CE1 3.93Å; F710-F763 HydrophobicContact CG-CZ 4.03Å; K759-F763 VanDerWaalsContact O-CB 3.31Å; K759-F763 WeakPolarHBondContact O-CB 3.15Å; K759-F763 PolarHBondContact O-N 3.47Å; H760-F763 PolarHBondContact O-N 2.97Å; A761-F763 PolarHBondContact O-N 3.12Å; F763-F766 WeakPolarHBondContact O-CB 3.16Å; F763-F766 PolarHBondContact O-N 3.14Å; F763-K767 HydrophobicContact CD1-CG 4.24Å; F763-K767 HydrophobicContact CE1-CG 3.76Å; F763-K767 VanDerWaalsContact CE2-CE 3.49Å; F763-K767 HydrophobicContact CE2-CG 4.35Å; F763-K767 HydrophobicContact CZ-CD 4.17Å; F763-K767 HydrophobicContact CZ-CG 3.83Å; F763-K767 PolarHBondContact O-N 2.85Å; F763-L832 HydrophobicContact CD2-CD1 4.24Å
764L91.3Very high86.7Confident13 Ų1334.4 Ų34.47%0.06817%0.17CC..Hα-helixtrans-66.8-35.4177.8-69.3170.3000112.2F710 H760 A761 Q762 F766 K767 F768 A779 C782 L783F710-L764 HydrophobicContact CE2-CD2 3.96Å; F710-L764 HydrophobicContact CZ-CD2 3.67Å; H760-L764 WeakPolarHBondContact O-CB 3.45Å; H760-L764 VanDerWaalsContact O-CG 3.24Å; H760-L764 WeakPolarHBondContact O-CG 3.22Å; H760-L764 PolarHBondContact O-N 3.12Å; A761-L764 PolarHBondContact O-N 3.11Å; Q762-L764 VanDerWaalsContact C-N 3.33Å; Q762-L764 PolarHBondContact O-N 2.89Å; L764-F766 VanDerWaalsContact C-N 3.31Å; L764-F766 PolarHBondContact O-N 3.1Å; L764-K767 PolarHBondContact O-N 2.98Å; L764-F768 PolarHBondContact O-N 3.27Å; L764-A779 HydrophobicContact CD2-CB 4.24Å; L764-C782 HydrophobicContact CD1-CB 4.08Å; L764-C782 HydrophobicContact CD2-CB 3.76Å; L764-L783 HydrophobicContact CD1-CB 4.1Å; L764-L783 HydrophobicContact CD1-CD1 4.36Å
765L88.8Confident87.3Confident4 Ų429.9 Ų29.92%0.02115%0.151CC..Hα-helixtrans-62.9-37.2172-69.6172.1000111.8A761 Q762 F768 N769 V799 M803 I806 F850 I857A761-L765 WeakPolarHBondContact O-CG 3.29Å; A761-L765 PolarHBondContact O-N 3.42Å; Q762-L765 WeakPolarHBondContact O-CB 3.19Å; Q762-L765 PolarHBondContact O-N 3.11Å; Q762-L765 VanDerWaalsContact O-N 3.13Å; L765-F768 PolarHBondContact O-N 3.4Å; L765-N769 PolarHBondContact O-ND2 3.34Å; L765-V799 HydrophobicContact CD1-CG1 3.83Å; L765-M803 HydrophobicContact CD1-CB 3.94Å; L765-I806 HydrophobicContact CB-CD1 4.19Å; L765-F850 HydrophobicContact CD2-CE2 4.1Å; L765-F850 HydrophobicContact CD2-CZ 4.41Å; L765-I857 HydrophobicContact CD2-CD1 4.15Å
766F87.9Confident87.7Confident15 Ų1529 Ų297%0.06614%0.14CC..Hα-helixtrans-63.2-47.2170.6-79.4-84.5000111.7Q762 F763 L764 F768 N769 T802 I806 V827 F830 L832 I834Q762-F766 WeakPolarHBondContact O-CD2 3.46Å; Q762-F766 PolarHBondContact O-N 3.47Å; F763-F766 WeakPolarHBondContact O-CB 3.16Å; F763-F766 PolarHBondContact O-N 3.14Å; L764-F766 VanDerWaalsContact C-N 3.31Å; L764-F766 PolarHBondContact O-N 3.1Å; F766-F768 VanDerWaalsContact C-N 3.27Å; F766-F768 PolarHBondContact O-N 2.96Å; F766-N769 PolarHBondContact O-N 3.44Å; F766-T802 HydrophobicContact CE2-CG2 3.97Å; F766-I806 HydrophobicContact CD1-CD1 4.36Å; F766-I806 HydrophobicContact CD2-CD1 4.37Å; F766-I806 HydrophobicContact CE1-CD1 4.4Å; F766-I806 HydrophobicContact CE2-CD1 4.34Å; F766-I806 HydrophobicContact CG-CD1 4.34Å; F766-I806 HydrophobicContact CZ-CD1 4.35Å; F766-V827 HydrophobicContact CD1-CG2 4.45Å; F766-V827 HydrophobicContact CE1-CB 3.84Å; F766-V827 HydrophobicContact CE1-CG1 4.44Å; F766-V827 HydrophobicContact CE1-CG2 3.37Å; F766-V827 HydrophobicContact CZ-CB 3.86Å; F766-V827 HydrophobicContact CZ-CG1 4.07Å; F766-V827 HydrophobicContact CZ-CG2 3.86Å; F766-F830 HydrophobicContact CE2-CB 4.34Å; F766-F830 HydrophobicContact CE2-CD1 4.37Å; F766-F830 HydrophobicContact CE2-CG 4.24Å; F766-F830 HydrophobicContact CZ-CB 3.86Å; F766-F830 HydrophobicContact CZ-CD2 4.45Å; F766-F830 HydrophobicContact CZ-CG 4.08Å; F766-L832 HydrophobicContact CD1-CB 3.84Å; F766-L832 HydrophobicContact CD2-CB 4.28Å; F766-L832 HydrophobicContact CD2-CD1 3.7Å; F766-L832 HydrophobicContact CE1-CB 3.74Å; F766-L832 HydrophobicContact CE2-CB 4.28Å; F766-L832 HydrophobicContact CE2-CD1 4.02Å; F766-L832 HydrophobicContact CG-CB 4.12Å; F766-L832 HydrophobicContact CG-CD1 4.08Å; F766-L832 HydrophobicContact CZ-CB 4.02Å; F766-I834 HydrophobicContact CD1-CD1 4.34Å; F766-I834 HydrophobicContact CD1-CG1 3.91Å; F766-I834 HydrophobicContact CE1-CG1 4.28Å
767K87.7Confident88Confident26 Ų2634.3 Ų34.311%0.11316%0.162CC..Hα-helixtrans-68.7-21.9179.7-64.2-59.7-173.7-175.40113.6F710 E714 F763 L764 N769 A770 A779F710-K767 HydrophobicContact CB-CD 4.46Å; F710-K767 HydrophobicContact CD1-CB 4.06Å; F710-K767 HydrophobicContact CD1-CD 3.89Å; F710-K767 HydrophobicContact CD1-CG 3.66Å; F710-K767 HydrophobicContact CE1-CB 3.8Å; F710-K767 HydrophobicContact CE1-CG 3.86Å; F710-K767 HydrophobicContact CG-CD 4.34Å; F710-K767 HydrophobicContact CG-CG 4.16Å; F710-K767 HydrophobicContact CZ-CG 4.5Å; E714-K767 WeakPolarHBondContact OE1-CE 3.45Å; E714-K767 IonicContact OE1-NZ 2.93Å; E714-K767 PolarHBondContact OE1-NZ 3.46Å; E714-K767 IonicContact OE2-NZ 4Å; E714-K767 PolarHBondContact OE2-NZ 2.92Å; F763-K767 HydrophobicContact CD1-CG 4.24Å; F763-K767 HydrophobicContact CE1-CG 3.76Å; F763-K767 VanDerWaalsContact CE2-CE 3.49Å; F763-K767 HydrophobicContact CE2-CG 4.35Å; F763-K767 HydrophobicContact CZ-CD 4.17Å; F763-K767 HydrophobicContact CZ-CG 3.83Å; F763-K767 PolarHBondContact O-N 2.85Å; L764-K767 PolarHBondContact O-N 2.98Å; K767-N769 PolarHBondContact O-N 3.26Å; K767-A770 VanDerWaalsContact O-CB 3.25Å; K767-A770 WeakPolarHBondContact O-CB 3.25Å; K767-A770 PolarHBondContact O-N 3.35Å; K767-A770 VanDerWaalsContact O-N 3.13Å; K767-A779 HydrophobicContact CB-CB 3.87Å
768F87Confident88.1Confident26 Ų2634.5 Ų34.511%0.11416%0.163CC..THydrogen-bonded Turntrans-63.7-17.4169.5-161.1-83.5000112.7L764 L765 F766 R776 D780 F850 K853L764-F768 PolarHBondContact O-N 3.27Å; L765-F768 PolarHBondContact O-N 3.4Å; F766-F768 VanDerWaalsContact C-N 3.27Å; F766-F768 PolarHBondContact O-N 2.96Å; F768-R776 WeakPolarHBondContact O-CD 3.28Å; F768-R776 WeakPolarHBondContact O-CG 3.21Å; F768-D780 HydrophobicContact CD2-CB 4.08Å; F768-D780 HydrophobicContact CE2-CB 3.77Å; F768-F850 HydrophobicContact CB-CD2 4.48Å; F768-F850 HydrophobicContact CD1-CB 4.42Å; F768-F850 AromaticContact CD1-CD2 3.53Å; F768-F850 HydrophobicContact CD1-CD2 3.53Å; F768-F850 HydrophobicContact CD1-CE2 4.31Å; F768-F850 HydrophobicContact CD1-CG 4.46Å; F768-F850 HydrophobicContact CE1-CB 4.44Å; F768-F850 HydrophobicContact CE1-CD2 4.1Å; F768-F850 HydrophobicContact CG-CD2 4.29Å; F768-K853 HydrophobicContact CE1-CB 3.91Å; F768-K853 HydrophobicContact CE1-CG 4.26Å; F768-K853 HydrophobicContact CE2-CB 4.32Å; F768-K853 HydrophobicContact CE2-CD 4.06Å; F768-K853 HydrophobicContact CE2-CG 3.86Å; F768-K853 HydrophobicContact CZ-CB 3.65Å; F768-K853 HydrophobicContact CZ-CD 4.11Å; F768-K853 HydrophobicContact CZ-CG 3.71Å
769N86.2Confident88.3Confident5 Ų532.1 Ų32.13%0.02715%0.152CC..THydrogen-bonded Turntrans-102.917.2176.6-66.9-73.5000113L765 F766 K767 L810 I834 F850L765-N769 PolarHBondContact O-ND2 3.34Å; F766-N769 PolarHBondContact O-N 3.44Å; K767-N769 PolarHBondContact O-N 3.26Å; N769-L810 VanDerWaalsContact OD1-CD1 3.22Å; N769-L810 WeakPolarHBondContact OD1-CD1 3.29Å; N769-I834 HydrophobicContact CB-CG2 3.94Å; N769-F850 WeakPolarHBondContact ND2-CD2 3.38Å; N769-F850 WeakPolarHBondContact ND2-CE2 3.25Å
770A85.1Confident88.5Confident10 Ų1029.8 Ų29.88%0.08314%0.144CC..  trans-66.2150.8174.600000112.4K767 F772 I775 R776K767-A770 VanDerWaalsContact O-CB 3.25Å; K767-A770 WeakPolarHBondContact O-CB 3.25Å; K767-A770 PolarHBondContact O-N 3.35Å; K767-A770 VanDerWaalsContact O-N 3.13Å; A770-F772 VanDerWaalsContact C-N 3.26Å; A770-F772 PolarHBondContact O-N 3.29Å; A770-I775 HydrophobicContact CB-CB 4.09Å; A770-I775 HydrophobicContact CB-CG2 3.8Å; A770-R776 HydrophobicContact CB-CG 4.4Å; A770-R776 VanDerWaalsContact O-CD 3.29Å; A770-R776 WeakPolarHBondContact O-CD 3.39Å; A770-R776 WeakPolarHBondContact O-CG 3.42Å; A770-R776 PolarHBondContact O-NE 2.96Å
771I81.8Confident88.5Confident71 Ų7136.7 Ų36.736%0.36417%0.17SC..SBendtrans-57.4-38.5179.2-62.8170.4000111.7S835 T837I771-S835 WeakPolarHBondContact CG1-OG 3.09Å; I771-T837 HydrophobicContact CG2-CG2 4.43Å
772F84.4Confident88.6Confident73 Ų7336.7 Ų36.732%0.3217%0.17SC..SBendtrans-88.9122.1-174.8-63-78000111.9A770 E774 I775 R776A770-F772 VanDerWaalsContact C-N 3.26Å; A770-F772 PolarHBondContact O-N 3.29Å; F772-E774 VanDerWaalsContact C-N 3.26Å; F772-E774 PolarHBondContact O-N 3.11Å; F772-I775 HydrophobicContact CB-CD1 4.06Å; F772-I775 HydrophobicContact CB-CG1 4.11Å; F772-I775 HydrophobicContact CD2-CD1 4.24Å; F772-I775 PolarHBondContact O-N 3.37Å; F772-I775 VanDerWaalsContact O-N 3.15Å; F772-R776 PolarHBondContact O-N 2.89Å
773P86.4Confident88.7Confident54 Ų5436.6 Ų36.635%0.35117%0.17SC..Hα-helixtrans-56.1-33.4-178.9-2533.3000115R776 K777P773-R776 WeakPolarHBondContact O-CB 3.25Å; P773-R776 PolarHBondContact O-N 3.36Å; P773-K777 WeakPolarHBondContact O-CG 3.41Å; P773-K777 PolarHBondContact O-N 2.86Å
774E87.3Confident88.8Confident76 Ų7638 Ų3836%0.35518%0.182SC..Hα-helixtrans-69.6-34.5-179-62.275.2-171.100111.9W726 L730 F772 K777 C778W726-E774 HydrophobicContact CH2-CB 3.37Å; W726-E774 HydrophobicContact CH2-CG 3.54Å; W726-E774 WeakPolarHBondContact CH2-OE2 3.33Å; W726-E774 HydrophobicContact CZ2-CB 3.94Å; W726-E774 HydrophobicContact CZ3-CB 3.9Å; W726-E774 HydrophobicContact CZ3-CG 3.63Å; L730-E774 HydrophobicContact CD1-CB 4.05Å; F772-E774 VanDerWaalsContact C-N 3.26Å; F772-E774 PolarHBondContact O-N 3.11Å; E774-K777 PolarHBondContact O-N 3.08Å; E774-C778 WeakPolarHBondContact O-CB 3.47Å; E774-C778 PolarHBondContact O-N 3.39Å
775I90.1Very high88.8Confident2 Ų239.5 Ų39.51%0.0119%0.19CC..Hα-helixtrans-66.9-42.1173.2-60.7179.7000109.4F710 L713 E714 W726 A770 F772 K777 C778 A779F710-I775 HydrophobicContact CD1-CG2 4.04Å; F710-I775 HydrophobicContact CE1-CG2 4.13Å; L713-I775 HydrophobicContact CB-CD1 4.41Å; L713-I775 HydrophobicContact CB-CG1 4.39Å; E714-I775 HydrophobicContact CG-CD1 3.94Å; W726-I775 HydrophobicContact CZ2-CG1 4.29Å; A770-I775 HydrophobicContact CB-CB 4.09Å; A770-I775 HydrophobicContact CB-CG2 3.8Å; F772-I775 HydrophobicContact CB-CD1 4.06Å; F772-I775 HydrophobicContact CB-CG1 4.11Å; F772-I775 HydrophobicContact CD2-CD1 4.24Å; F772-I775 PolarHBondContact O-N 3.37Å; F772-I775 VanDerWaalsContact O-N 3.15Å; I775-K777 PolarHBondContact O-N 3.45Å; I775-C778 WeakPolarHBondContact O-CB 3.39Å; I775-C778 PolarHBondContact O-N 2.92Å; I775-A779 WeakPolarHBondContact O-CB 3.35Å; I775-A779 PolarHBondContact O-N 3.04Å
776R89.6Confident88.9Confident29 Ų2939.4 Ų39.411%0.10919%0.189CC..Hα-helixtrans-59-47.6175.5-58.3-167.8-86.5147.1-3.9111.5F768 A770 F772 P773 C778 A779 D780 D849F768-R776 WeakPolarHBondContact O-CD 3.28Å; F768-R776 WeakPolarHBondContact O-CG 3.21Å; A770-R776 HydrophobicContact CB-CG 4.4Å; A770-R776 VanDerWaalsContact O-CD 3.29Å; A770-R776 WeakPolarHBondContact O-CD 3.39Å; A770-R776 WeakPolarHBondContact O-CG 3.42Å; A770-R776 PolarHBondContact O-NE 2.96Å; F772-R776 PolarHBondContact O-N 2.89Å; P773-R776 WeakPolarHBondContact O-CB 3.25Å; P773-R776 PolarHBondContact O-N 3.36Å; R776-C778 VanDerWaalsContact C-N 3.32Å; R776-C778 PolarHBondContact O-N 2.96Å; R776-A779 PolarHBondContact O-N 2.65Å; R776-D780 WeakPolarHBondContact O-CB 3.45Å; R776-D780 PolarHBondContact O-N 3.1Å; R776-D849 IonicContact CZ-OD2 2.73Å; R776-D849 IonicContact NH1-OD2 3.28Å; R776-D849 PolarHBondContact NH1-OD2 3.08Å; R776-D849 IonicContact NH2-OD2 3.63Å
777K89.7Confident88.9Confident136 Ų13639.7 Ų39.759%0.59119%0.192SC*.Hα-helixtrans-62-36.9175.3-71.2175.3-1771780112.8P773 E774 I775 R781P773-K777 WeakPolarHBondContact O-CG 3.41Å; P773-K777 PolarHBondContact O-N 2.86Å; E774-K777 PolarHBondContact O-N 3.08Å; I775-K777 PolarHBondContact O-N 3.45Å; K777-R781 WeakPolarHBondContact O-CG 3.39Å; K777-R781 PolarHBondContact O-N 2.86Å; K777-R781 VanDerWaalsContact O-N 3.13Å
778C91.3Very high88.8Confident5 Ų544.6 Ų44.63%0.03422%0.22CC..Hα-helixtrans-67.5-46.7176.4-170.80000111.2L730 E774 I775 R776 D780 R781 C782L730-C778 HydrophobicContact CD2-CB 3.69Å; E774-C778 WeakPolarHBondContact O-CB 3.47Å; E774-C778 PolarHBondContact O-N 3.39Å; I775-C778 WeakPolarHBondContact O-CB 3.39Å; I775-C778 PolarHBondContact O-N 2.92Å; R776-C778 VanDerWaalsContact C-N 3.32Å; R776-C778 PolarHBondContact O-N 2.96Å; C778-D780 VanDerWaalsContact C-N 3.3Å; C778-D780 PolarHBondContact O-N 3.14Å; C778-R781 PolarHBondContact O-N 3.41Å; C778-C782 PolarHBondContact O-N 3.2Å; C778-C782 PolarHBondContact O-SG 3.23Å
779A92.4Very high88.7Confident1 Ų147.5 Ų47.51%0.00823%0.232CC..Hα-helixtrans-58.7-42175.900000111.8F710 L764 K767 I775 R776 C782 L783F710-A779 HydrophobicContact CE1-CB 4.18Å; F710-A779 HydrophobicContact CZ-CB 4.31Å; L764-A779 HydrophobicContact CD2-CB 4.24Å; K767-A779 HydrophobicContact CB-CB 3.87Å; I775-A779 WeakPolarHBondContact O-CB 3.35Å; I775-A779 PolarHBondContact O-N 3.04Å; R776-A779 PolarHBondContact O-N 2.65Å; A779-C782 PolarHBondContact O-N 3.13Å; A779-L783 WeakPolarHBondContact O-CB 3.12Å; A779-L783 PolarHBondContact O-N 3.44Å
780D90.1Very high88.7Confident44 Ų4447.3 Ų47.324%0.23523%0.231CC..Hα-helixtrans-59.5-46.5175.6-172.144.4000112.9F768 R776 C778 L783 S784 K853F768-D780 HydrophobicContact CD2-CB 4.08Å; F768-D780 HydrophobicContact CE2-CB 3.77Å; R776-D780 WeakPolarHBondContact O-CB 3.45Å; R776-D780 PolarHBondContact O-N 3.1Å; C778-D780 VanDerWaalsContact C-N 3.3Å; C778-D780 PolarHBondContact O-N 3.14Å; D780-L783 PolarHBondContact O-N 3.25Å; D780-S784 PolarHBondContact O-N 3.46Å; D780-S784 PolarHBondContact O-OG 3.47Å; D780-K853 WeakPolarHBondContact OD1-CE 3.22Å; D780-K853 IonicContact OD1-NZ 3.46Å; D780-K853 PolarHBondContact OD1-NZ 3.41Å; D780-K853 IonicContact OD2-NZ 3.97Å
781R91.4Very high88.7Confident151 Ų15147.5 Ų47.557%0.5723%0.232SC*.Hα-helixtrans-65.5-41176.1-72.7177.4179.7-175.2-0.4111.7L734 K777 C778 L783 S784 L785L734-R781 HydrophobicContact CD2-CB 3.52Å; K777-R781 WeakPolarHBondContact O-CG 3.39Å; K777-R781 PolarHBondContact O-N 2.86Å; K777-R781 VanDerWaalsContact O-N 3.13Å; C778-R781 PolarHBondContact O-N 3.41Å; R781-L783 VanDerWaalsContact C-N 3.34Å; R781-L783 PolarHBondContact O-N 3.32Å; R781-S784 WeakPolarHBondContact O-CB 3.27Å; R781-S784 PolarHBondContact O-N 3.05Å; R781-L785 WeakPolarHBondContact O-CG 3.34Å; R781-L785 PolarHBondContact O-N 2.93Å
782C93.5Very high88.8Confident0 Ų044.8 Ų44.80%022%0.217CC..Hα-helixtrans-61.9-42.9175.9-65.50000111.5V737 L764 C778 A779 S784 L785 L786V737-C782 HydrophobicContact CG1-CB 4.18Å; V737-C782 HydrophobicContact CG2-CB 4.32Å; L764-C782 HydrophobicContact CD1-CB 4.08Å; L764-C782 HydrophobicContact CD2-CB 3.76Å; C778-C782 PolarHBondContact O-N 3.2Å; C778-C782 PolarHBondContact O-SG 3.23Å; A779-C782 PolarHBondContact O-N 3.13Å; C782-S784 VanDerWaalsContact C-N 3.31Å; C782-S784 PolarHBondContact O-N 2.96Å; C782-L785 PolarHBondContact O-N 3.26Å; C782-L786 PolarHBondContact O-N 3.48Å; C782-L786 VanDerWaalsContact O-N 3.11Å
783L91.4Very high88.9Confident11 Ų1141.4 Ų41.46%0.05820%0.203CC..Hα-helixtrans-63.5-40.6176-177.462000110.7A761 L764 A779 D780 R781 L786 V787 I857A761-L783 HydrophobicContact CB-CD1 4.11Å; L764-L783 HydrophobicContact CD1-CB 4.1Å; L764-L783 HydrophobicContact CD1-CD1 4.36Å; A779-L783 WeakPolarHBondContact O-CB 3.12Å; A779-L783 PolarHBondContact O-N 3.44Å; D780-L783 PolarHBondContact O-N 3.25Å; R781-L783 VanDerWaalsContact C-N 3.34Å; R781-L783 PolarHBondContact O-N 3.32Å; L783-L786 PolarHBondContact O-N 2.92Å; L783-V787 HydrophobicContact CD1-CG2 4.1Å; L783-V787 HydrophobicContact CG-CG2 4.2Å; L783-V787 WeakPolarHBondContact O-CB 3.35Å; L783-V787 WeakPolarHBondContact O-CG2 3.46Å; L783-V787 PolarHBondContact O-N 2.88Å; L783-I857 HydrophobicContact CD2-CD1 4.01Å
784S91.9Very high89Confident47 Ų4739.3 Ų39.333%0.32919%0.189SC..Hα-helixtrans-61.4-45.7176.4-54.60000111.8D780 R781 C782 L786 V787 D788D780-S784 PolarHBondContact O-N 3.46Å; D780-S784 PolarHBondContact O-OG 3.47Å; R781-S784 WeakPolarHBondContact O-CB 3.27Å; R781-S784 PolarHBondContact O-N 3.05Å; C782-S784 VanDerWaalsContact C-N 3.31Å; C782-S784 PolarHBondContact O-N 2.96Å; S784-L786 VanDerWaalsContact C-N 3.27Å; S784-L786 PolarHBondContact O-N 2.92Å; S784-V787 PolarHBondContact O-N 3.45Å; S784-D788 WeakPolarHBondContact O-CB 3.41Å; S784-D788 PolarHBondContact O-N 3.01Å
785L91.6Very high89Confident43 Ų4336.3 Ų36.323%0.22517%0.174CC..Hα-helixtrans-59.6-38.2175.9-64.8171.9000112.4L734 V737 R781 C782L734-L785 HydrophobicContact CB-CD1 4.45Å; L734-L785 HydrophobicContact CD2-CD1 4.23Å; V737-L785 HydrophobicContact CG1-CD1 4.43Å; R781-L785 WeakPolarHBondContact O-CG 3.34Å; R781-L785 PolarHBondContact O-N 2.93Å; C782-L785 PolarHBondContact O-N 3.26Å
786L90.1Very high88.8Confident3 Ų337 Ų372%0.01618%0.178CC..Hα-helixtrans-69.5-43.6177.8-170.6142.2000111.3L757 H760 C782 L783 S784 K789 F790 V793L757-L786 HydrophobicContact CD2-CD1 3.92Å; L757-L786 HydrophobicContact CD2-CD2 4.32Å; L757-L786 HydrophobicContact CD2-CG 4.09Å; H760-L786 HydrophobicContact CB-CD1 3.91Å; C782-L786 PolarHBondContact O-N 3.48Å; C782-L786 VanDerWaalsContact O-N 3.11Å; L783-L786 PolarHBondContact O-N 2.92Å; S784-L786 VanDerWaalsContact C-N 3.27Å; S784-L786 PolarHBondContact O-N 2.92Å; L786-K789 PolarHBondContact O-N 2.83Å; L786-F790 HydrophobicContact CG-CD2 4.5Å; L786-F790 WeakPolarHBondContact O-CA 3.45Å; L786-F790 WeakPolarHBondContact O-CB 3.38Å; L786-F790 WeakPolarHBondContact O-CD2 2.88Å; L786-F790 PolarHBondContact O-N 3Å; L786-V793 HydrophobicContact CD2-CB 3.88Å; L786-V793 HydrophobicContact CD2-CG1 3.68Å; L786-V793 HydrophobicContact CD2-CG2 3.73Å
787V88.2Confident88.6Confident20 Ų2037.3 Ų37.312%0.12118%0.18CC..Hα-helixtrans-69.2-39.2-179.9167.70000112.1L783 S784 K789 F790 P791 L794L783-V787 HydrophobicContact CD1-CG2 4.1Å; L783-V787 HydrophobicContact CG-CG2 4.2Å; L783-V787 WeakPolarHBondContact O-CB 3.35Å; L783-V787 WeakPolarHBondContact O-CG2 3.46Å; L783-V787 PolarHBondContact O-N 2.88Å; S784-V787 PolarHBondContact O-N 3.45Å; V787-K789 PolarHBondContact O-N 2.87Å; V787-K789 VanDerWaalsContact O-N 3.15Å; V787-F790 CarbonylContact O-C 3.57Å; V787-F790 VanDerWaalsContact O-C 3.27Å; V787-F790 PolarHBondContact O-N 2.97Å; V787-P791 VanDerWaalsContact O-CA 3.24Å; V787-P791 WeakPolarHBondContact O-CA 3.32Å; V787-P791 VanDerWaalsContact O-CD 3.26Å; V787-P791 WeakPolarHBondContact O-CD 3.21Å; V787-P791 WeakPolarHBondContact O-CG 3.37Å; V787-L794 HydrophobicContact CB-CD2 4.38Å; V787-L794 HydrophobicContact CB-CG 4.44Å; V787-L794 HydrophobicContact CG1-CD1 3.53Å; V787-L794 HydrophobicContact CG1-CD2 3.97Å; V787-L794 HydrophobicContact CG1-CG 3.72Å; V787-L794 HydrophobicContact CG2-CD2 3.45Å; V787-L794 VanDerWaalsContact CG2-CD2 3.45Å; V787-L794 HydrophobicContact CG2-CG 3.83Å
788D84.6Confident88.4Confident129 Ų12931.5 Ų31.569%0.6916%0.158SC*.Hα-helixtrans-56.7-33.4177.9-75.1-15.5000111.7S784S784-D788 WeakPolarHBondContact O-CB 3.41Å; S784-D788 PolarHBondContact O-N 3.01Å
789K85Confident88.3Confident87 Ų8731.6 Ų31.638%0.37816%0.159SC..Hα-helixtrans-95.7-35.4178.6-160.371.3179.8-175.10113.5V741 D745 L786 V787 P791V741-K789 HydrophobicContact CG1-CB 3.46Å; V741-K789 VanDerWaalsContact CG1-CB 3.46Å; V741-K789 HydrophobicContact CG1-CG 3.69Å; D745-K789 HydrophobicContact CB-CG 4.46Å; D745-K789 WeakPolarHBondContact OD1-CE 3.23Å; D745-K789 IonicContact OD1-NZ 2.81Å; D745-K789 WeakPolarHBondContact OD2-CE 3.44Å; D745-K789 IonicContact OD2-NZ 2.92Å; D745-K789 PolarHBondContact OD2-NZ 3.39Å; L786-K789 PolarHBondContact O-N 2.83Å; V787-K789 PolarHBondContact O-N 2.87Å; V787-K789 VanDerWaalsContact O-N 3.15Å; K789-P791 WeakPolarHBondContact O-CD 3.5Å
790F86.7Confident88Confident1 Ų131.8 Ų31.80%0.00416%0.16CC..  trans-126.171.2-178.3-52.3-70.7000111.4V741 A744 D745 L753 L757 L786 V787 H792 V793V741-F790 HydrophobicContact CG1-CE2 4.06Å; A744-F790 HydrophobicContact CB-CE2 3.96Å; A744-F790 HydrophobicContact CB-CZ 3.79Å; D745-F790 HydrophobicContact CB-CZ 4.25Å; L753-F790 HydrophobicContact CD2-CE1 4.49Å; L757-F790 HydrophobicContact CD1-CB 4Å; L757-F790 HydrophobicContact CD1-CD1 3.91Å; L757-F790 HydrophobicContact CD1-CD2 4.04Å; L757-F790 HydrophobicContact CD1-CE1 4.4Å; L757-F790 HydrophobicContact CD1-CG 3.71Å; L757-F790 HydrophobicContact CD2-CD2 3.78Å; L757-F790 HydrophobicContact CD2-CE2 4.07Å; L757-F790 HydrophobicContact CD2-CG 4.29Å; L786-F790 HydrophobicContact CG-CD2 4.5Å; L786-F790 WeakPolarHBondContact O-CA 3.45Å; L786-F790 WeakPolarHBondContact O-CB 3.38Å; L786-F790 WeakPolarHBondContact O-CD2 2.88Å; L786-F790 PolarHBondContact O-N 3Å; V787-F790 CarbonylContact O-C 3.57Å; V787-F790 VanDerWaalsContact O-C 3.27Å; V787-F790 PolarHBondContact O-N 2.97Å; F790-H792 PolarHBondContact O-N 3.29Å; F790-V793 HydrophobicContact CB-CG2 3.95Å; F790-V793 WeakPolarHBondContact O-CG2 3.33Å; F790-V793 PolarHBondContact O-N 2.98Å
791P84.3Confident87.7Confident15 Ų1531.8 Ų31.810%0.09716%0.158CC..G310 helixtrans-58.3-29-175.6-25.433.1000113.4V787 K789 V793 L794 W795 F1096V787-P791 VanDerWaalsContact O-CA 3.24Å; V787-P791 WeakPolarHBondContact O-CA 3.32Å; V787-P791 VanDerWaalsContact O-CD 3.26Å; V787-P791 WeakPolarHBondContact O-CD 3.21Å; V787-P791 WeakPolarHBondContact O-CG 3.37Å; K789-P791 WeakPolarHBondContact O-CD 3.5Å; P791-V793 PolarHBondContact O-N 3.14Å; P791-L794 WeakPolarHBondContact O-CB 3.48Å; P791-L794 WeakPolarHBondContact O-CG 3.47Å; P791-L794 PolarHBondContact O-N 3.37Å; P791-W795 HydrophobicContact CB-CH2 3.95Å; P791-W795 HydrophobicContact CB-CZ3 3.88Å; P791-W795 WeakPolarHBondContact O-CZ3 3.43Å; P791-F1096 HydrophobicContact CG-CD1 4.35Å; P791-F1096 HydrophobicContact CG-CE1 4.31Å
792H84.5Confident87.4Confident13 Ų1324.8 Ų24.86%0.0613%0.131CC..G310 helixtrans-61-17.3-177.368.8-81.7000115.6F790 L794 W795 D796 F1096 C1097F790-H792 PolarHBondContact O-N 3.29Å; H792-L794 PolarHBondContact O-N 3.39Å; H792-W795 VanDerWaalsContact CA-CH2 3.45Å; H792-W795 HydrophobicContact CB-CD2 4.4Å; H792-W795 HydrophobicContact CB-CH2 3.98Å; H792-W795 HydrophobicContact CB-CZ2 3.41Å; H792-W795 VanDerWaalsContact CB-CZ2 3.41Å; H792-W795 PolarHBondContact O-N 2.81Å; H792-D796 PolarHBondContact O-N 3.4Å; H792-F1096 HydrophobicContact CB-CB 3.98Å; H792-F1096 PolarHBondContact ND1-O 2.91Å; H792-C1097 HydrophobicContact CB-CB 4.31Å
793V87.8Confident87.1Confident3 Ų324.8 Ų24.82%0.01813%0.131CC..G310 helixtrans-65.7-25.7175.6179.10000111.6L757 A761 L786 F790 P791 W795 V799L757-V793 HydrophobicContact CB-CG2 3.8Å; L757-V793 HydrophobicContact CD1-CG2 4.2Å; L757-V793 HydrophobicContact CG-CG2 4.5Å; A761-V793 HydrophobicContact CB-CG1 3.33Å; L786-V793 HydrophobicContact CD2-CB 3.88Å; L786-V793 HydrophobicContact CD2-CG1 3.68Å; L786-V793 HydrophobicContact CD2-CG2 3.73Å; F790-V793 HydrophobicContact CB-CG2 3.95Å; F790-V793 WeakPolarHBondContact O-CG2 3.33Å; F790-V793 PolarHBondContact O-N 2.98Å; P791-V793 PolarHBondContact O-N 3.14Å; V793-W795 VanDerWaalsContact C-N 3.34Å; V793-W795 PolarHBondContact O-N 3.43Å; V793-V799 HydrophobicContact CG1-CG2 4.19Å
794L87Confident86.7Confident10 Ų1024.3 Ų24.35%0.05213%0.129CC..G310 helixtrans-69-28.9177.9-64.2179.2000113.9V787 P791 H792 L800 I857 E860 A861V787-L794 HydrophobicContact CB-CD2 4.38Å; V787-L794 HydrophobicContact CB-CG 4.44Å; V787-L794 HydrophobicContact CG1-CD1 3.53Å; V787-L794 HydrophobicContact CG1-CD2 3.97Å; V787-L794 HydrophobicContact CG1-CG 3.72Å; V787-L794 HydrophobicContact CG2-CD2 3.45Å; V787-L794 VanDerWaalsContact CG2-CD2 3.45Å; V787-L794 HydrophobicContact CG2-CG 3.83Å; P791-L794 WeakPolarHBondContact O-CB 3.48Å; P791-L794 WeakPolarHBondContact O-CG 3.47Å; P791-L794 PolarHBondContact O-N 3.37Å; H792-L794 PolarHBondContact O-N 3.39Å; L794-L800 WeakPolarHBondContact O-CD2 3.45Å; L794-I857 HydrophobicContact CD2-CG1 4.33Å; L794-I857 HydrophobicContact CD2-CG2 4Å; L794-E860 HydrophobicContact CD1-CB 3.88Å; L794-E860 HydrophobicContact CD1-CG 3.49Å; L794-E860 VanDerWaalsContact CD1-CG 3.49Å; L794-A861 HydrophobicContact CB-CB 4.05Å
795W87Confident86.1Confident12 Ų1223.9 Ų23.95%0.04513%0.126CC..G310 helixtrans-111.114.6-179.262.682.8000113P791 H792 V793 A861 W864 A865 V869 H872 T1093 F1096P791-W795 HydrophobicContact CB-CH2 3.95Å; P791-W795 HydrophobicContact CB-CZ3 3.88Å; P791-W795 WeakPolarHBondContact O-CZ3 3.43Å; H792-W795 VanDerWaalsContact CA-CH2 3.45Å; H792-W795 HydrophobicContact CB-CD2 4.4Å; H792-W795 HydrophobicContact CB-CH2 3.98Å; H792-W795 HydrophobicContact CB-CZ2 3.41Å; H792-W795 VanDerWaalsContact CB-CZ2 3.41Å; H792-W795 PolarHBondContact O-N 2.81Å; V793-W795 VanDerWaalsContact C-N 3.34Å; V793-W795 PolarHBondContact O-N 3.43Å; W795-A861 HydrophobicContact CB-CB 4.16Å; W795-W864 HydrophobicContact CE3-CB 3.85Å; W795-W864 HydrophobicContact CE3-CG 4.48Å; W795-W864 HydrophobicContact CH2-CB 3.72Å; W795-W864 HydrophobicContact CH2-CG 4.14Å; W795-W864 HydrophobicContact CZ3-CB 3.29Å; W795-W864 HydrophobicContact CZ3-CD2 4.43Å; W795-W864 AromaticContact CZ3-CG 3.63Å; W795-W864 HydrophobicContact CZ3-CG 3.63Å; W795-A865 HydrophobicContact CB-CB 4.29Å; W795-A865 HydrophobicContact CD2-CB 3.82Å; W795-A865 HydrophobicContact CE3-CB 4.39Å; W795-A865 HydrophobicContact CG-CB 3.8Å; W795-V869 HydrophobicContact CB-CG2 3.51Å; W795-H872 PolarHBondContact O-CD2 2.89Å; W795-T1093 HydrophobicContact CZ2-CG2 4.38Å; W795-F1096 HydrophobicContact CH2-CD2 4.1Å; W795-F1096 HydrophobicContact CZ2-CB 4.45Å; W795-F1096 HydrophobicContact CZ2-CD2 4.29Å
796D86.5Confident85.7Confident17 Ų1721.9 Ų21.99%0.09112%0.115CC..  trans-69.8134.7173.7-169.892.7000110.5K754 H792 G798 V799 L800K754-D796 VanDerWaalsContact CE-OD1 3.29Å; K754-D796 WeakPolarHBondContact CE-OD1 3.41Å; K754-D796 IonicContact NZ-OD1 3.99Å; H792-D796 PolarHBondContact O-N 3.4Å; D796-G798 VanDerWaalsContact C-N 3.28Å; D796-G798 PolarHBondContact O-N 3.42Å; D796-G798 PolarHBondContact OD2-N 3.43Å; D796-V799 HydrophobicContact CB-CB 4.37Å; D796-V799 HydrophobicContact CB-CG2 4.06Å; D796-V799 PolarHBondContact O-N 3.1Å; D796-L800 WeakPolarHBondContact O-CG 3.05Å; D796-L800 PolarHBondContact O-N 3.43Å
797K84.9Confident85.3Confident36 Ų3622 Ų2216%0.15712%0.116CC..Hα-helixtrans-52.6-45.4-178.4-177.4177.5177.6171.70111.9K801 E875 E1027K797-K801 HydrophobicContact CG-CD 4.35Å; K797-K801 WeakPolarHBondContact O-CB 3.25Å; K797-K801 VanDerWaalsContact O-CG 3.3Å; K797-K801 WeakPolarHBondContact O-CG 3.39Å; K797-K801 PolarHBondContact O-N 2.92Å; K797-E875 WeakPolarHBondContact CE-OE2 3.35Å; K797-E875 IonicContact NZ-OE1 3.46Å; K797-E875 PolarHBondContact NZ-OE1 3.17Å; K797-E875 IonicContact NZ-OE2 2.8Å; K797-E875 PolarHBondContact NZ-OE2 3.41Å; K797-E1027 IonicContact NZ-OE1 2.82Å
798G85.7Confident84.9Confident13 Ų1321.8 Ų21.813%0.13411%0.114CC..Hα-helixtrans-67.4-41.4-177.700000112.3E758 Q762 D796 T802E758-G798 WeakPolarHBondContact OE1-CA 3.48Å; Q762-G798 PolarHBondContact NE2-O 2.92Å; D796-G798 VanDerWaalsContact C-N 3.28Å; D796-G798 PolarHBondContact O-N 3.42Å; D796-G798 PolarHBondContact OD2-N 3.43Å; G798-T802 WeakPolarHBondContact O-CB 3.44Å; G798-T802 PolarHBondContact O-N 3.27Å; G798-T802 PolarHBondContact O-OG1 3.41Å
799V88.8Confident84.6Confident8 Ų817 Ų175%0.0489%0.088CC..Hα-helixtrans-65.6-45.6177.8-179.30000111.1E758 A761 L765 V793 D796 T802 M803E758-V799 HydrophobicContact CG-CG2 3.96Å; A761-V799 HydrophobicContact CB-CG1 4.12Å; A761-V799 HydrophobicContact CB-CG2 3.75Å; L765-V799 HydrophobicContact CD1-CG1 3.83Å; V793-V799 HydrophobicContact CG1-CG2 4.19Å; D796-V799 HydrophobicContact CB-CB 4.37Å; D796-V799 HydrophobicContact CB-CG2 4.06Å; D796-V799 PolarHBondContact O-N 3.1Å; V799-T802 PolarHBondContact O-N 2.82Å; V799-M803 VanDerWaalsContact O-CB 3.28Å; V799-M803 WeakPolarHBondContact O-CB 3.44Å; V799-M803 PolarHBondContact O-N 3.46Å
800L86.3Confident84.4Confident4 Ų413 Ų132%0.0217%0.071CC..Hα-helixtrans-62.6-45.4177.8-70.7177.1000111.9L794 D796 M803 L804 L858 V869 H872L794-L800 WeakPolarHBondContact O-CD2 3.45Å; D796-L800 WeakPolarHBondContact O-CG 3.05Å; D796-L800 PolarHBondContact O-N 3.43Å; L800-M803 HydrophobicContact CD2-CE 3.87Å; L800-M803 PolarHBondContact O-N 3.44Å; L800-L804 VanDerWaalsContact O-CG 3.31Å; L800-L804 WeakPolarHBondContact O-CG 3.46Å; L800-L804 PolarHBondContact O-N 3.04Å; L800-L858 HydrophobicContact CD2-CD2 3.8Å; L800-V869 HydrophobicContact CD1-CG1 4.24Å; L800-V869 HydrophobicContact CD1-CG2 4.47Å; L800-H872 HydrophobicContact CD1-CB 4.12Å
801K84.5Confident83.9Confident45 Ų4515.5 Ų15.520%0.1968%0.082CC..Hα-helixtrans-59.8-51.1176-74.9-172179.2-1660111.2K797 M803 L804 S805 Y876 E879K797-K801 HydrophobicContact CG-CD 4.35Å; K797-K801 WeakPolarHBondContact O-CB 3.25Å; K797-K801 VanDerWaalsContact O-CG 3.3Å; K797-K801 WeakPolarHBondContact O-CG 3.39Å; K797-K801 PolarHBondContact O-N 2.92Å; K801-M803 VanDerWaalsContact C-N 3.32Å; K801-M803 PolarHBondContact O-N 2.92Å; K801-L804 PolarHBondContact O-N 2.63Å; K801-S805 WeakPolarHBondContact O-CB 3.37Å; K801-S805 PolarHBondContact O-N 3.15Å; K801-S805 PolarHBondContact O-OG 3.36Å; K801-Y876 HydrophobicContact CB-CD2 4.45Å; K801-Y876 HydrophobicContact CD-CD2 4.43Å; K801-Y876 HydrophobicContact CG-CD2 3.88Å; K801-E879 IonicContact NZ-OE1 2.63Å; K801-E879 PolarHBondContact NZ-OE1 2.65Å; K801-E879 IonicContact NZ-OE2 3.03Å; K801-E879 PolarHBondContact NZ-OE2 2.7Å
802T85.2Confident83.6Confident3 Ų318.2 Ų18.22%0.0189%0.093CC..Hα-helixtrans-58.3-43.6178.4-59.80000111.9Q762 F766 G798 V799 L804 S805 I806 F830Q762-T802 HydrophobicContact CB-CG2 4.35Å; Q762-T802 HydrophobicContact CG-CG2 4.15Å; Q762-T802 PolarHBondContact NE2-OG1 2.91Å; F766-T802 HydrophobicContact CE2-CG2 3.97Å; G798-T802 WeakPolarHBondContact O-CB 3.44Å; G798-T802 PolarHBondContact O-N 3.27Å; G798-T802 PolarHBondContact O-OG1 3.41Å; V799-T802 PolarHBondContact O-N 2.82Å; T802-L804 PolarHBondContact O-N 3.45Å; T802-S805 PolarHBondContact O-N 3.35Å; T802-I806 HydrophobicContact CG2-CD1 3.72Å; T802-I806 HydrophobicContact CG2-CG1 4.3Å; T802-I806 WeakPolarHBondContact O-CB 2.84Å; T802-I806 VanDerWaalsContact O-CG1 3.23Å; T802-I806 WeakPolarHBondContact O-CG1 3.49Å; T802-I806 PolarHBondContact O-N 2.63Å; T802-F830 HydrophobicContact CG2-CE2 4.48Å; T802-F830 WeakPolarHBondContact OG1-CZ 3.44Å
803M86.6Confident83.3Confident0 Ų017.9 Ų17.90%09%0.093CC..Hα-helixtrans-59-47.1177.2-179.1-174.271.400112L765 V799 L800 K801 L807 F850 C854 I857 L858L765-M803 HydrophobicContact CD1-CB 3.94Å; V799-M803 VanDerWaalsContact O-CB 3.28Å; V799-M803 WeakPolarHBondContact O-CB 3.44Å; V799-M803 PolarHBondContact O-N 3.46Å; L800-M803 HydrophobicContact CD2-CE 3.87Å; L800-M803 PolarHBondContact O-N 3.44Å; K801-M803 VanDerWaalsContact C-N 3.32Å; K801-M803 PolarHBondContact O-N 2.92Å; M803-L807 WeakPolarHBondContact O-CB 3.48Å; M803-L807 PolarHBondContact O-N 3.4Å; M803-L807 VanDerWaalsContact O-N 3.08Å; M803-F850 HydrophobicContact CG-CZ 4.37Å; M803-C854 HydrophobicContact CE-CB 4.39Å; M803-C854 HydrophobicContact CG-CB 4.07Å; M803-C854 WeakPolarHBondContact CG-SG 3.46Å; M803-C854 HydrophobicContact SD-CB 3.82Å; M803-I857 HydrophobicContact SD-CB 4.22Å; M803-I857 HydrophobicContact SD-CD1 4.41Å; M803-I857 HydrophobicContact SD-CG2 3.87Å; M803-L858 HydrophobicContact CE-CD1 3.97Å; M803-L858 HydrophobicContact CE-CD2 3.77Å; M803-L858 HydrophobicContact CE-CG 3.63Å
804L82.6Confident82.7Confident2 Ų218 Ų181%0.019%0.093CC..Hα-helixtrans-68.8-39.4179.7-66.4177000112.5L800 K801 T802 L807 Q808 I873 Y876 T897L800-L804 VanDerWaalsContact O-CG 3.31Å; L800-L804 WeakPolarHBondContact O-CG 3.46Å; L800-L804 PolarHBondContact O-N 3.04Å; K801-L804 PolarHBondContact O-N 2.63Å; T802-L804 PolarHBondContact O-N 3.45Å; L804-L807 PolarHBondContact O-N 3.33Å; L804-Q808 PolarHBondContact O-N 2.88Å; L804-I873 HydrophobicContact CD1-CG1 4.3Å; L804-Y876 HydrophobicContact CB-CE1 3.87Å; L804-Y876 HydrophobicContact CD1-CD1 3.69Å; L804-Y876 HydrophobicContact CD1-CE1 3.86Å; L804-Y876 HydrophobicContact CD1-CG 4.29Å; L804-T897 HydrophobicContact CD2-CG2 4.04Å; L804-T897 WeakPolarHBondContact CD2-OG1 3.36Å
805S80.7Confident81.9Confident38 Ų3822.3 Ų22.327%0.26612%0.117SC..Hα-helixtrans-65.8-42.5176-57.20000112.1K801 T802 L807 Q808 L809K801-S805 WeakPolarHBondContact O-CB 3.37Å; K801-S805 PolarHBondContact O-N 3.15Å; K801-S805 PolarHBondContact O-OG 3.36Å; T802-S805 PolarHBondContact O-N 3.35Å; S805-L807 VanDerWaalsContact C-N 3.34Å; S805-L807 PolarHBondContact O-N 3.45Å; S805-Q808 PolarHBondContact O-N 2.94Å; S805-L809 WeakPolarHBondContact O-CG 3.17Å; S805-L809 PolarHBondContact O-N 3.24Å
806I82.7Confident80.8Confident0 Ų025.9 Ų25.90%014%0.136CC..Hα-helixtrans-61.2-44.7174.8-69.3170.3000110.3L765 F766 T802 Q808 L809 L810 I834 F850L765-I806 HydrophobicContact CB-CD1 4.19Å; F766-I806 HydrophobicContact CD1-CD1 4.36Å; F766-I806 HydrophobicContact CD2-CD1 4.37Å; F766-I806 HydrophobicContact CE1-CD1 4.4Å; F766-I806 HydrophobicContact CE2-CD1 4.34Å; F766-I806 HydrophobicContact CG-CD1 4.34Å; F766-I806 HydrophobicContact CZ-CD1 4.35Å; T802-I806 HydrophobicContact CG2-CD1 3.72Å; T802-I806 HydrophobicContact CG2-CG1 4.3Å; T802-I806 WeakPolarHBondContact O-CB 2.84Å; T802-I806 VanDerWaalsContact O-CG1 3.23Å; T802-I806 WeakPolarHBondContact O-CG1 3.49Å; T802-I806 PolarHBondContact O-N 2.63Å; I806-Q808 VanDerWaalsContact C-N 3.29Å; I806-Q808 PolarHBondContact O-N 3.39Å; I806-L809 PolarHBondContact O-N 3.03Å; I806-L810 HydrophobicContact CG2-CD1 3.88Å; I806-L810 HydrophobicContact CG2-CG 4.29Å; I806-L810 VanDerWaalsContact O-CG 3.3Å; I806-L810 WeakPolarHBondContact O-CG 3.33Å; I806-L810 PolarHBondContact O-N 3.42Å; I806-I834 HydrophobicContact CG1-CD1 4.24Å; I806-I834 HydrophobicContact CG2-CD1 3.79Å; I806-F850 HydrophobicContact CB-CE1 3.81Å; I806-F850 HydrophobicContact CB-CZ 4Å; I806-F850 HydrophobicContact CG2-CD1 4.07Å; I806-F850 HydrophobicContact CG2-CE1 3.4Å; I806-F850 HydrophobicContact CG2-CZ 3.65Å
807L81.5Confident79.4Confident6 Ų629 Ų293%0.03117%0.165CC..Hα-helixtrans-61.1-39.7179.7-177.259.9000111.8M803 L804 S805 F811 F850 A851M803-L807 WeakPolarHBondContact O-CB 3.48Å; M803-L807 PolarHBondContact O-N 3.4Å; M803-L807 VanDerWaalsContact O-N 3.08Å; L804-L807 PolarHBondContact O-N 3.33Å; S805-L807 VanDerWaalsContact C-N 3.34Å; S805-L807 PolarHBondContact O-N 3.45Å; L807-F811 PolarHBondContact O-N 2.91Å; L807-F811 VanDerWaalsContact O-N 3.16Å; L807-F850 HydrophobicContact CB-CD1 4.27Å; L807-F850 HydrophobicContact CB-CE1 4.08Å; L807-F850 HydrophobicContact CD1-CD1 4.11Å; L807-A851 HydrophobicContact CD1-CB 3.77Å
808Q79.3Confident77.9Confident15 Ų1531.6 Ų31.67%0.0718%0.184CC..Hα-helixtrans-65.2-48.3175.6-176.955.919.800112.2L804 S805 I806 L810 F811 E812 H891L804-Q808 PolarHBondContact O-N 2.88Å; S805-Q808 PolarHBondContact O-N 2.94Å; I806-Q808 VanDerWaalsContact C-N 3.29Å; I806-Q808 PolarHBondContact O-N 3.39Å; Q808-L810 VanDerWaalsContact C-N 3.31Å; Q808-L810 PolarHBondContact O-N 2.87Å; Q808-F811 WeakPolarHBondContact O-CB 3.14Å; Q808-F811 PolarHBondContact O-N 2.91Å; Q808-E812 WeakPolarHBondContact CG-OE1 3.33Å; Q808-E812 PolarHBondContact NE2-OE1 3.24Å; Q808-E812 PolarHBondContact O-N 3.3Å; Q808-H891 PolarHBondContact OE1-CE1 3.13Å; Q808-H891 VanDerWaalsContact OE1-CG 3.3Å; Q808-H891 PolarHBondContact OE1-ND1 3.48Å
809L78.8Confident76.4Confident28 Ų2832 Ų3215%0.14718%0.184CC..Hα-helixtrans-60.6-39.4178.6-71.2170.6000112.3S805 I806 F811 E812 S813 I825 V827S805-L809 WeakPolarHBondContact O-CG 3.17Å; S805-L809 PolarHBondContact O-N 3.24Å; I806-L809 PolarHBondContact O-N 3.03Å; L809-F811 VanDerWaalsContact C-N 3.31Å; L809-F811 PolarHBondContact O-N 2.96Å; L809-E812 PolarHBondContact O-N 3.47Å; L809-S813 WeakPolarHBondContact O-CB 3.3Å; L809-S813 PolarHBondContact O-N 2.75Å; L809-I825 HydrophobicContact CB-CG2 4.43Å; L809-I825 HydrophobicContact CD1-CG2 4.46Å; L809-I825 HydrophobicContact CD2-CG2 4.32Å; L809-V827 HydrophobicContact CD1-CB 4.09Å; L809-V827 HydrophobicContact CD1-CG1 3.96Å; L809-V827 HydrophobicContact CD1-CG2 3.68Å
810L80.4Confident74.6Confident5 Ų542.1 Ų42.13%0.02622%0.222CC..Hα-helixtrans-64-37.3174.8-70.8170.4000111.8N769 I806 Q808 S813 C814 R847 F850N769-L810 VanDerWaalsContact OD1-CD1 3.22Å; N769-L810 WeakPolarHBondContact OD1-CD1 3.29Å; I806-L810 HydrophobicContact CG2-CD1 3.88Å; I806-L810 HydrophobicContact CG2-CG 4.29Å; I806-L810 VanDerWaalsContact O-CG 3.3Å; I806-L810 WeakPolarHBondContact O-CG 3.33Å; I806-L810 PolarHBondContact O-N 3.42Å; Q808-L810 VanDerWaalsContact C-N 3.31Å; Q808-L810 PolarHBondContact O-N 2.87Å; L810-S813 PolarHBondContact O-OG 2.72Å; L810-C814 PolarHBondContact O-N 3.32Å; L810-C814 PolarHBondContact O-SG 3.5Å; L810-R847 HydrophobicContact CB-CB 4.29Å; L810-R847 HydrophobicContact CB-CG 4.19Å; L810-F850 HydrophobicContact CD1-CB 4.16Å; L810-F850 HydrophobicContact CD1-CD1 3.64Å; L810-F850 HydrophobicContact CD1-CE1 4.35Å; L810-F850 HydrophobicContact CD1-CG 4.1Å
811F77.7Confident73Confident53 Ų5349.4 Ų49.423%0.23226%0.259CS..Hα-helixtrans-69-45.2176.6-172.8-100.4000112.6L807 Q808 L809 S813 C814 N815 S892L807-F811 PolarHBondContact O-N 2.91Å; L807-F811 VanDerWaalsContact O-N 3.16Å; Q808-F811 WeakPolarHBondContact O-CB 3.14Å; Q808-F811 PolarHBondContact O-N 2.91Å; L809-F811 VanDerWaalsContact C-N 3.31Å; L809-F811 PolarHBondContact O-N 2.96Å; F811-S813 VanDerWaalsContact C-N 3.29Å; F811-S813 PolarHBondContact O-N 3.47Å; F811-C814 WeakPolarHBondContact O-CA 3.47Å; F811-C814 WeakPolarHBondContact O-CB 3.28Å; F811-C814 PolarHBondContact O-N 3.41Å; F811-N815 WeakPolarHBondContact CD1-ND2 3.36Å; F811-N815 WeakPolarHBondContact CE1-ND2 3.24Å; F811-N815 WeakPolarHBondContact CZ-ND2 3.02Å; F811-N815 PolarHBondContact O-N 3.37Å; F811-S892 WeakPolarHBondContact CB-OG 3.49Å; F811-S892 WeakPolarHBondContact CD1-OG 3.41Å; F811-S892 VanDerWaalsContact CD2-CB 3.49Å; F811-S892 WeakPolarHBondContact CD2-OG 3.48Å; F811-S892 VanDerWaalsContact CE2-CB 3.41Å; F811-S892 WeakPolarHBondContact CE2-OG 3.36Å; F811-S892 WeakPolarHBondContact CG-OG 3.15Å; F811-S892 VanDerWaalsContact CZ-CB 3.45Å
812E77.3Confident71.6Confident71 Ų7150.5 Ų50.533%0.33227%0.272SS..Hα-helixtrans-58.7-42.7175.1-73.4170.5-171.300111.2Q808 L809 C814 N815 D816Q808-E812 WeakPolarHBondContact CG-OE1 3.33Å; Q808-E812 PolarHBondContact NE2-OE1 3.24Å; Q808-E812 PolarHBondContact O-N 3.3Å; L809-E812 PolarHBondContact O-N 3.47Å; E812-C814 PolarHBondContact O-N 2.89Å; E812-C814 VanDerWaalsContact O-N 3.1Å; E812-N815 PolarHBondContact O-N 3.35Å; E812-D816 WeakPolarHBondContact O-CB 3.46Å; E812-D816 PolarHBondContact O-N 2.83Å
813S77.6Confident70.6Confident7 Ų754.2 Ų54.25%0.04930%0.298CS..Hα-helixtrans-60.8-22.5175.584.10000114.1L809 L810 F811 S819 I825L809-S813 WeakPolarHBondContact O-CB 3.3Å; L809-S813 PolarHBondContact O-N 2.75Å; L810-S813 PolarHBondContact O-OG 2.72Å; F811-S813 VanDerWaalsContact C-N 3.29Å; F811-S813 PolarHBondContact O-N 3.47Å; S813-S819 PolarHBondContact O-OG 2.92Å; S813-S819 VanDerWaalsContact O-OG 3.09Å; S813-I825 VanDerWaalsContact CB-CD1 3.49Å
814C75.8Confident70Confident4 Ų456.7 Ų56.73%0.02731%0.314CS..THydrogen-bonded Turntrans-88.5-10.2176.3-69.30000113.4L810 F811 E812 M840L810-C814 PolarHBondContact O-N 3.32Å; L810-C814 PolarHBondContact O-SG 3.5Å; F811-C814 WeakPolarHBondContact O-CA 3.47Å; F811-C814 WeakPolarHBondContact O-CB 3.28Å; F811-C814 PolarHBondContact O-N 3.41Å; E812-C814 PolarHBondContact O-N 2.89Å; E812-C814 VanDerWaalsContact O-N 3.1Å; C814-M840 VanDerWaalsContact CA-CE 3.44Å; C814-M840 HydrophobicContact CB-CE 4.1Å; C814-M840 WeakPolarHBondContact O-CE 3.23Å
815N69.8Low69.5Low102 Ų10258.1 Ų58.155%0.54532%0.321SS..THydrogen-bonded Turntrans-113-27.7-178.1-67.7-21.1000112.4F811 E812 A817F811-N815 WeakPolarHBondContact CD1-ND2 3.36Å; F811-N815 WeakPolarHBondContact CE1-ND2 3.24Å; F811-N815 WeakPolarHBondContact CZ-ND2 3.02Å; F811-N815 PolarHBondContact O-N 3.37Å; E812-N815 PolarHBondContact O-N 3.35Å; N815-A817 PolarHBondContact O-N 2.97Å
816D64.6Low69.1Low86 Ų8660.8 Ų60.846%0.4634%0.339SS..  trans-79.9114.7-174.6-157-18000111.5E812 T818 S819E812-D816 WeakPolarHBondContact O-CB 3.46Å; E812-D816 PolarHBondContact O-N 2.83Å; D816-T818 PolarHBondContact O-N 2.95Å; D816-T818 PolarHBondContact OD1-N 3.49Å; D816-T818 PolarHBondContact OD1-OG1 2.94Å; D816-T818 PolarHBondContact OD2-OG1 2.76Å; D816-S819 WeakPolarHBondContact O-CB 3.45Å; D816-S819 PolarHBondContact O-N 3.43Å; D816-S819 PolarHBondContact O-OG 3.43Å
817A56.3Low68.5Low83 Ų8361 Ų6169%0.68634%0.341SS*.G310 helixtrans-63-23.4177.500000112.3N815N815-A817 PolarHBondContact O-N 2.97Å
818T54.4Low67.6Low91 Ų9165.6 Ų65.656%0.55837%0.371SS*.G310 helixtrans-77.8-19.1178.461.40000113.6D816 R820 I821D816-T818 PolarHBondContact O-N 2.95Å; D816-T818 PolarHBondContact OD1-N 3.49Å; D816-T818 PolarHBondContact OD1-OG1 2.94Å; D816-T818 PolarHBondContact OD2-OG1 2.76Å; T818-R820 PolarHBondContact O-N 2.69Å; T818-I821 PolarHBondContact O-N 2.81Å; T818-I821 VanDerWaalsContact O-N 3.13Å
819S52.8Low67Low20 Ų2069 Ų6914%0.1441%0.41CS..G310 helixtrans-65.9-1.8176.7730000114.6S813 D816 I821 R843S813-S819 PolarHBondContact O-OG 2.92Å; S813-S819 VanDerWaalsContact O-OG 3.09Å; D816-S819 WeakPolarHBondContact O-CB 3.45Å; D816-S819 PolarHBondContact O-N 3.43Å; D816-S819 PolarHBondContact O-OG 3.43Å; S819-I821 PolarHBondContact O-N 3.35Å; S819-R843 PolarHBondContact O-NH1 2.88Å; S819-R843 VanDerWaalsContact O-NH1 3.16Å
820R52.4Low66.4Low222 Ų22270.7 Ų70.784%0.83842%0.416SS*.G310 helixtrans-67.6-18.8168.9-69.6-174.2-176.3-176.32.8112.7T818T818-R820 PolarHBondContact O-N 2.69Å
821I51.9Low65.6Low157 Ų15776.8 Ų76.881%0.80546%0.456SS*.SBendtrans-92-34.8-173.1-54.5173.3000112.6T818 S819T818-I821 PolarHBondContact O-N 2.81Å; T818-I821 VanDerWaalsContact O-N 3.13Å; S819-I821 PolarHBondContact O-N 3.35Å
822S54.6Low65.2Low68 Ų6877 Ų7748%0.47646%0.459SS..  trans-101.5120.9179.6-166.10000111.6T824S822-T824 PolarHBondContact O-N 3.45Å; S822-T824 PolarHBondContact OG-N 2.9Å; S822-T824 PolarHBondContact OG-O 2.89Å
823S65.8Low65Low81 Ų8176.8 Ų76.857%0.56647%0.466SS*.SBendtrans-72.3-10.2172.9560000113.1L836S823-L836 PolarHBondContact O-N 3.09Å
824T73.4Confident65.1Low52 Ų5276.9 Ų76.932%0.31947%0.465SS..EExtended strand (participates in β ladder)trans-138.5134.5-171-32.30000111.2S822 S833 I834S822-T824 PolarHBondContact O-N 3.45Å; S822-T824 PolarHBondContact OG-N 2.9Å; S822-T824 PolarHBondContact OG-O 2.89Å; T824-S833 VanDerWaalsContact CG2-CB 3.5Å; T824-S833 VanDerWaalsContact CG2-OG 3.29Å; T824-S833 WeakPolarHBondContact CG2-OG 3.45Å; T824-I834 CarbonylContact C-O 3.58Å; T824-I834 WeakPolarHBondContact CA-O 3.27Å; T824-I834 WeakPolarHBondContact CG2-O 3.29Å
825I72.8Confident65Low32 Ų3279 Ų7916%0.16448%0.48CS..EExtended strand (participates in β ladder)trans-105.7125.9175.7-55178000108.5L809 S813 S833 I834 L836L809-I825 HydrophobicContact CB-CG2 4.43Å; L809-I825 HydrophobicContact CD1-CG2 4.46Å; L809-I825 HydrophobicContact CD2-CG2 4.32Å; S813-I825 VanDerWaalsContact CB-CD1 3.49Å; I825-S833 CarbonylContact O-C 3.58Å; I825-S833 WeakPolarHBondContact O-CA 3.48Å; I825-S833 WeakPolarHBondContact O-CB 3.38Å; I825-I834 PolarHBondContact N-O 3.35Å; I825-I834 PolarHBondContact O-N 3.14Å; I825-L836 HydrophobicContact CD1-CD1 3.8Å; I825-L836 HydrophobicContact CD1-CD2 3.7Å; I825-L836 HydrophobicContact CD1-CG 3.98Å; I825-L836 HydrophobicContact CG1-CD1 3.81Å; I825-L836 HydrophobicContact CG1-CD2 4.25Å; I825-L836 HydrophobicContact CG1-CG 4.01Å
826S72Confident65.2Low93 Ų9375 Ų7565%0.6546%0.458SS*.EExtended strand (participates in β ladder)trans-86.5132.3170.8-62.40000109.6
827V68.7Low65.7Low5 Ų571.6 Ų71.63%0.0344%0.441CS..PPolyproline II helixtrans-87.5125.1177.2-179.70000108.9F766 L809 G829 F830 I834F766-V827 HydrophobicContact CD1-CG2 4.45Å; F766-V827 HydrophobicContact CE1-CB 3.84Å; F766-V827 HydrophobicContact CE1-CG1 4.44Å; F766-V827 HydrophobicContact CE1-CG2 3.37Å; F766-V827 HydrophobicContact CZ-CB 3.86Å; F766-V827 HydrophobicContact CZ-CG1 4.07Å; F766-V827 HydrophobicContact CZ-CG2 3.86Å; L809-V827 HydrophobicContact CD1-CB 4.09Å; L809-V827 HydrophobicContact CD1-CG1 3.96Å; L809-V827 HydrophobicContact CD1-CG2 3.68Å; V827-G829 PolarHBondContact O-N 3.36Å; V827-F830 HydrophobicContact CG1-CD2 4.04Å; V827-F830 PolarHBondContact O-N 3.05Å; V827-I834 HydrophobicContact CG2-CD1 4.03Å; V827-I834 HydrophobicContact CG2-CG1 4.36Å
828P64.2Low66.5Low102 Ų10276.3 Ų76.366%0.66245%0.449SS*.THydrogen-bonded Turntrans-54.6131.2179.3-23.632.6000111.8F830P828-F830 VanDerWaalsContact C-N 3.31Å; P828-F830 PolarHBondContact O-N 3.39Å
829G65.2Low67.6Low86 Ų8675.1 Ų75.189%0.88744%0.441SS*.THydrogen-bonded Turntrans83.8-9.8179.100000116V827V827-G829 PolarHBondContact O-N 3.36Å
830F66.2Low68.9Low65 Ų6577.9 Ų77.929%0.28545%0.453SS..  trans-119.4140.5-179.9-67.8-85.8000111.6F766 T802 V827 P828 L832F766-F830 HydrophobicContact CE2-CB 4.34Å; F766-F830 HydrophobicContact CE2-CD1 4.37Å; F766-F830 HydrophobicContact CE2-CG 4.24Å; F766-F830 HydrophobicContact CZ-CB 3.86Å; F766-F830 HydrophobicContact CZ-CD2 4.45Å; F766-F830 HydrophobicContact CZ-CG 4.08Å; T802-F830 HydrophobicContact CG2-CE2 4.48Å; T802-F830 WeakPolarHBondContact OG1-CZ 3.44Å; V827-F830 HydrophobicContact CG1-CD2 4.04Å; V827-F830 PolarHBondContact O-N 3.05Å; P828-F830 VanDerWaalsContact C-N 3.31Å; P828-F830 PolarHBondContact O-N 3.39Å; F830-L832 PolarHBondContact O-N 2.9Å; F830-L832 VanDerWaalsContact O-N 3.14Å
831P64.1Low70.1Confident132 Ų13275.2 Ų75.286%0.85745%0.45SS*.SBendtrans-73.80.617830.9-35.2000113.6
832L69.6Low71.5Confident59 Ų5972.6 Ų72.631%0.30943%0.434SS..  trans-98.1139.3-174.5-68.3162.8000110.6F763 F766 F830F763-L832 HydrophobicContact CD2-CD1 4.24Å; F766-L832 HydrophobicContact CD1-CB 3.84Å; F766-L832 HydrophobicContact CD2-CB 4.28Å; F766-L832 HydrophobicContact CD2-CD1 3.7Å; F766-L832 HydrophobicContact CE1-CB 3.74Å; F766-L832 HydrophobicContact CE2-CB 4.28Å; F766-L832 HydrophobicContact CE2-CD1 4.02Å; F766-L832 HydrophobicContact CG-CB 4.12Å; F766-L832 HydrophobicContact CG-CD1 4.08Å; F766-L832 HydrophobicContact CZ-CB 4.02Å; F830-L832 PolarHBondContact O-N 2.9Å; F830-L832 VanDerWaalsContact O-N 3.14Å
833S73.8Confident72.8Confident66 Ų6670.6 Ų70.646%0.46242%0.417SS..EExtended strand (participates in β ladder)trans-121.9137.8-178.8660000111.3T824 I825T824-S833 VanDerWaalsContact CG2-CB 3.5Å; T824-S833 VanDerWaalsContact CG2-OG 3.29Å; T824-S833 WeakPolarHBondContact CG2-OG 3.45Å; I825-S833 CarbonylContact O-C 3.58Å; I825-S833 WeakPolarHBondContact O-CA 3.48Å; I825-S833 WeakPolarHBondContact O-CB 3.38Å
834I78.8Confident73.6Confident8 Ų872.8 Ų72.84%0.04141%0.412CS..EExtended strand (participates in β ladder)trans-91.2120.4-179.2-59.2171.4000109F766 N769 I806 T824 I825 V827F766-I834 HydrophobicContact CD1-CD1 4.34Å; F766-I834 HydrophobicContact CD1-CG1 3.91Å; F766-I834 HydrophobicContact CE1-CG1 4.28Å; N769-I834 HydrophobicContact CB-CG2 3.94Å; I806-I834 HydrophobicContact CG1-CD1 4.24Å; I806-I834 HydrophobicContact CG2-CD1 3.79Å; T824-I834 CarbonylContact C-O 3.58Å; T824-I834 WeakPolarHBondContact CA-O 3.27Å; T824-I834 WeakPolarHBondContact CG2-O 3.29Å; I825-I834 PolarHBondContact N-O 3.35Å; I825-I834 PolarHBondContact O-N 3.14Å; V827-I834 HydrophobicContact CG2-CD1 4.03Å; V827-I834 HydrophobicContact CG2-CG1 4.36Å
835S74.4Confident74.1Confident48 Ų4876.5 Ų76.534%0.33642%0.424SS..EExtended strand (participates in β ladder)trans-81.1119.4174.558.10000110.6I771I771-S835 WeakPolarHBondContact CG1-OG 3.09Å
836L73.9Confident74.7Confident18 Ų1875.6 Ų75.69%0.09442%0.42CS..PPolyproline II helixtrans-80.2146.6-179.7-63.6175.1000111.6S823 I825S823-L836 PolarHBondContact O-N 3.09Å; I825-L836 HydrophobicContact CD1-CD1 3.8Å; I825-L836 HydrophobicContact CD1-CD2 3.7Å; I825-L836 HydrophobicContact CD1-CG 3.98Å; I825-L836 HydrophobicContact CG1-CD1 3.81Å; I825-L836 HydrophobicContact CG1-CD2 4.25Å; I825-L836 HydrophobicContact CG1-CG 4.01Å
837T75.1Confident75.2Confident15 Ų1573.3 Ų73.39%0.09240%0.397CS..PPolyproline II helixtrans-67.8157169.8560000110.7I771 T839 E842 R843 V846I771-T837 HydrophobicContact CG2-CG2 4.43Å; T837-T839 PolarHBondContact OG1-O 3.08Å; T837-E842 HydrophobicContact CG2-CB 4.12Å; T837-E842 WeakPolarHBondContact OG1-CB 3.47Å; T837-R843 PolarHBondContact O-NE 3.43Å; T837-R843 PolarHBondContact O-NH2 3.26Å; T837-R843 VanDerWaalsContact O-NH2 3.12Å; T837-R843 WeakPolarHBondContact OG1-CA 3.21Å; T837-R843 WeakPolarHBondContact OG1-CG 3.34Å; T837-R843 PolarHBondContact OG1-N 2.93Å; T837-V846 HydrophobicContact CG2-CG2 4.39Å
838E72.4Confident75.9Confident183 Ų18376.9 Ų76.986%0.85542%0.416SS*.SBendtrans-73.4-37.5-175.5-66.5-178.6-177.500112
839T77.9Confident76.8Confident65 Ų6575 Ų7540%0.39940%0.4SS..SBendtrans-91.5141.3-17771.10000111.9T837 E841 E842 R843T837-T839 PolarHBondContact OG1-O 3.08Å; T839-E841 VanDerWaalsContact C-N 3.25Å; T839-E841 PolarHBondContact O-N 3.32Å; T839-E842 PolarHBondContact O-N 3.25Å; T839-E842 VanDerWaalsContact OG1-CB 3.25Å; T839-E842 WeakPolarHBondContact OG1-CB 3.34Å; T839-E842 WeakPolarHBondContact OG1-CG 3.5Å; T839-E842 PolarHBondContact OG1-N 2.96Å; T839-E842 PolarHBondContact OG1-OE2 2.91Å; T839-R843 WeakPolarHBondContact O-CG 3.29Å; T839-R843 PolarHBondContact O-N 3.43Å; T839-R843 VanDerWaalsContact O-N 3.07Å
840M79Confident77.9Confident78 Ų7870.9 Ų70.938%0.38436%0.358SS..Hα-helixtrans-62.9-33.8179.2-165.764.6175.300112.7C814 R843 R844C814-M840 VanDerWaalsContact CA-CE 3.44Å; C814-M840 HydrophobicContact CB-CE 4.1Å; C814-M840 WeakPolarHBondContact O-CE 3.23Å; M840-R843 PolarHBondContact O-N 3.04Å; M840-R844 WeakPolarHBondContact O-CG 3.43Å; M840-R844 PolarHBondContact O-N 2.78Å
841E79.4Confident78.6Confident167 Ų16768.6 Ų68.678%0.7835%0.351SS*.Hα-helixtrans-67.1-43.9178.8-168.9174.417900111.3T839 R844 K845T839-E841 VanDerWaalsContact C-N 3.25Å; T839-E841 PolarHBondContact O-N 3.32Å; E841-R844 PolarHBondContact O-N 3.4Å; E841-K845 WeakPolarHBondContact O-CB 3.24Å; E841-K845 PolarHBondContact O-N 3.49Å
842E79.2Confident79.5Confident101 Ų10164.9 Ų64.947%0.47233%0.332SS..Hα-helixtrans-65.6-37.8173.9-70.9169.2157.600112.1T837 T839 R844 K845 V846T837-E842 HydrophobicContact CG2-CB 4.12Å; T837-E842 WeakPolarHBondContact OG1-CB 3.47Å; T839-E842 PolarHBondContact O-N 3.25Å; T839-E842 VanDerWaalsContact OG1-CB 3.25Å; T839-E842 WeakPolarHBondContact OG1-CB 3.34Å; T839-E842 WeakPolarHBondContact OG1-CG 3.5Å; T839-E842 PolarHBondContact OG1-N 2.96Å; T839-E842 PolarHBondContact OG1-OE2 2.91Å; E842-R844 PolarHBondContact O-N 3.48Å; E842-K845 WeakPolarHBondContact O-CB 3.12Å; E842-K845 PolarHBondContact O-N 3.17Å; E842-V846 WeakPolarHBondContact O-CG2 3.49Å; E842-V846 PolarHBondContact O-N 3.11Å
843R83.5Confident80.2Confident27 Ų2763.1 Ų63.110%0.10232%0.322CS..Hα-helixtrans-60.6-46.8175.8-71.6-176.1-165.2-171.8-2.2110.9S819 T837 T839 M840 K845 V846 R847S819-R843 PolarHBondContact O-NH1 2.88Å; S819-R843 VanDerWaalsContact O-NH1 3.16Å; T837-R843 PolarHBondContact O-NE 3.43Å; T837-R843 PolarHBondContact O-NH2 3.26Å; T837-R843 VanDerWaalsContact O-NH2 3.12Å; T837-R843 WeakPolarHBondContact OG1-CA 3.21Å; T837-R843 WeakPolarHBondContact OG1-CG 3.34Å; T837-R843 PolarHBondContact OG1-N 2.93Å; T839-R843 WeakPolarHBondContact O-CG 3.29Å; T839-R843 PolarHBondContact O-N 3.43Å; T839-R843 VanDerWaalsContact O-N 3.07Å; M840-R843 PolarHBondContact O-N 3.04Å; R843-K845 VanDerWaalsContact C-N 3.32Å; R843-K845 PolarHBondContact O-N 3.49Å; R843-V846 PolarHBondContact O-N 2.79Å; R843-R847 WeakPolarHBondContact O-CB 3.44Å; R843-R847 PolarHBondContact O-N 3.47Å
844R82.7Confident80.7Confident126 Ų12660.1 Ų60.148%0.47530%0.301SS..Hα-helixtrans-61-41.5175.9-74.9179.8-179.7-1690111.6M840 E841 E842 R847 D848M840-R844 WeakPolarHBondContact O-CG 3.43Å; M840-R844 PolarHBondContact O-N 2.78Å; E841-R844 PolarHBondContact O-N 3.4Å; E842-R844 PolarHBondContact O-N 3.48Å; R844-R847 WeakPolarHBondContact O-CB 3.49Å; R844-R847 PolarHBondContact O-N 3.48Å; R844-D848 WeakPolarHBondContact O-CB 3.37Å; R844-D848 PolarHBondContact O-N 3.32Å
845K84Confident80.8Confident130 Ų13063.8 Ų63.857%0.56532%0.317SS*.Hα-helixtrans-61.9-46176.2-173.1177.5-179.1176.20112.3E841 E842 R843 R847 D848 D849E841-K845 WeakPolarHBondContact O-CB 3.24Å; E841-K845 PolarHBondContact O-N 3.49Å; E842-K845 WeakPolarHBondContact O-CB 3.12Å; E842-K845 PolarHBondContact O-N 3.17Å; R843-K845 VanDerWaalsContact C-N 3.32Å; R843-K845 PolarHBondContact O-N 3.49Å; K845-R847 VanDerWaalsContact C-N 3.34Å; K845-R847 PolarHBondContact O-N 3.3Å; K845-D848 PolarHBondContact O-N 3.2Å; K845-D849 WeakPolarHBondContact O-CB 3.34Å; K845-D849 PolarHBondContact O-N 3.23Å
846V84.4Confident81.2Confident14 Ų1467.2 Ų67.29%0.08533%0.328CS..Hα-helixtrans-61.6-43.2176.61730000111T837 E842 R843 F850T837-V846 HydrophobicContact CG2-CG2 4.39Å; E842-V846 WeakPolarHBondContact O-CG2 3.49Å; E842-V846 PolarHBondContact O-N 3.11Å; R843-V846 PolarHBondContact O-N 2.79Å; V846-F850 WeakPolarHBondContact O-CB 3.41Å; V846-F850 PolarHBondContact O-N 3.27Å
847R83.7Confident81.7Confident44 Ų4466.8 Ų66.817%0.16633%0.326CS..Hα-helixtrans-57.9-48.3173.7176.7-152.666.3-170.1-2.9111.7L810 R843 R844 K845 F850 A851L810-R847 HydrophobicContact CB-CB 4.29Å; L810-R847 HydrophobicContact CB-CG 4.19Å; R843-R847 WeakPolarHBondContact O-CB 3.44Å; R843-R847 PolarHBondContact O-N 3.47Å; R844-R847 WeakPolarHBondContact O-CB 3.49Å; R844-R847 PolarHBondContact O-N 3.48Å; K845-R847 VanDerWaalsContact C-N 3.34Å; K845-R847 PolarHBondContact O-N 3.3Å; R847-F850 PolarHBondContact O-N 3.02Å; R847-A851 WeakPolarHBondContact O-CB 3.47Å; R847-A851 PolarHBondContact O-N 2.77Å
848D83.1Confident82Confident80 Ų8066.1 Ų66.143%0.42832%0.322SS..Hα-helixtrans-68.2-40.7-177.2-66.6-18.6000111.8R844 K845 F850 A851 A852R844-D848 WeakPolarHBondContact O-CB 3.37Å; R844-D848 PolarHBondContact O-N 3.32Å; K845-D848 PolarHBondContact O-N 3.2Å; D848-F850 VanDerWaalsContact C-N 3.35Å; D848-F850 PolarHBondContact O-N 3.13Å; D848-A851 PolarHBondContact O-N 2.71Å; D848-A852 WeakPolarHBondContact O-CB 3.45Å; D848-A852 PolarHBondContact O-N 2.78Å
849D83.4Confident82.4Confident62 Ų6259.1 Ų59.133%0.33230%0.295SS..Hα-helixtrans-59.4-45.1172.8-70.1-17.6000110.8R776 K845 K853R776-D849 IonicContact CZ-OD2 2.73Å; R776-D849 IonicContact NH1-OD2 3.28Å; R776-D849 PolarHBondContact NH1-OD2 3.08Å; R776-D849 IonicContact NH2-OD2 3.63Å; K845-D849 WeakPolarHBondContact O-CB 3.34Å; K845-D849 PolarHBondContact O-N 3.23Å; D849-K853 PolarHBondContact O-N 3.44Å; D849-K853 VanDerWaalsContact O-N 3.09Å
850F86.7Confident82.6Confident1 Ų160.2 Ų60.20%0.00430%0.296CS..Hα-helixtrans-67.5-42.6178.2-172.7-114.1000111.8L765 F768 N769 M803 I806 L807 L810 V846 R847 D848 A852 K853 C854L765-F850 HydrophobicContact CD2-CE2 4.1Å; L765-F850 HydrophobicContact CD2-CZ 4.41Å; F768-F850 HydrophobicContact CB-CD2 4.48Å; F768-F850 HydrophobicContact CD1-CB 4.42Å; F768-F850 AromaticContact CD1-CD2 3.53Å; F768-F850 HydrophobicContact CD1-CD2 3.53Å; F768-F850 HydrophobicContact CD1-CE2 4.31Å; F768-F850 HydrophobicContact CD1-CG 4.46Å; F768-F850 HydrophobicContact CE1-CB 4.44Å; F768-F850 HydrophobicContact CE1-CD2 4.1Å; F768-F850 HydrophobicContact CG-CD2 4.29Å; N769-F850 WeakPolarHBondContact ND2-CD2 3.38Å; N769-F850 WeakPolarHBondContact ND2-CE2 3.25Å; M803-F850 HydrophobicContact CG-CZ 4.37Å; I806-F850 HydrophobicContact CB-CE1 3.81Å; I806-F850 HydrophobicContact CB-CZ 4Å; I806-F850 HydrophobicContact CG2-CD1 4.07Å; I806-F850 HydrophobicContact CG2-CE1 3.4Å; I806-F850 HydrophobicContact CG2-CZ 3.65Å; L807-F850 HydrophobicContact CB-CD1 4.27Å; L807-F850 HydrophobicContact CB-CE1 4.08Å; L807-F850 HydrophobicContact CD1-CD1 4.11Å; L810-F850 HydrophobicContact CD1-CB 4.16Å; L810-F850 HydrophobicContact CD1-CD1 3.64Å; L810-F850 HydrophobicContact CD1-CE1 4.35Å; L810-F850 HydrophobicContact CD1-CG 4.1Å; V846-F850 WeakPolarHBondContact O-CB 3.41Å; V846-F850 PolarHBondContact O-N 3.27Å; R847-F850 PolarHBondContact O-N 3.02Å; D848-F850 VanDerWaalsContact C-N 3.35Å; D848-F850 PolarHBondContact O-N 3.13Å; F850-A852 VanDerWaalsContact C-N 3.34Å; F850-A852 PolarHBondContact O-N 3.3Å; F850-K853 WeakPolarHBondContact O-CB 3.33Å; F850-K853 PolarHBondContact O-N 3.26Å; F850-K853 VanDerWaalsContact O-N 3.09Å; F850-C854 VanDerWaalsContact CE1-SG 3.53Å; F850-C854 PolarHBondContact O-N 2.9Å; F850-C854 PolarHBondContact O-SG 2.98Å
851A82.4Confident82.8Confident16 Ų1656.5 Ų56.513%0.13228%0.277CS..Hα-helixtrans-58.2-44.9175.800000112L807 R847 D848 K853 C854 Q855L807-A851 HydrophobicContact CD1-CB 3.77Å; R847-A851 WeakPolarHBondContact O-CB 3.47Å; R847-A851 PolarHBondContact O-N 2.77Å; D848-A851 PolarHBondContact O-N 2.71Å; A851-K853 VanDerWaalsContact C-N 3.3Å; A851-K853 PolarHBondContact O-N 2.9Å; A851-C854 PolarHBondContact O-N 3.25Å; A851-Q855 WeakPolarHBondContact O-CG 3.47Å; A851-Q855 PolarHBondContact O-N 3.13Å
852A82.8Confident82.8Confident55 Ų5550 Ų5046%0.45525%0.25SC..Hα-helixtrans-61.8-38.3175.300000111.8D848 F850 Q855 Q856D848-A852 WeakPolarHBondContact O-CB 3.45Å; D848-A852 PolarHBondContact O-N 2.78Å; F850-A852 VanDerWaalsContact C-N 3.34Å; F850-A852 PolarHBondContact O-N 3.3Å; A852-Q855 PolarHBondContact O-N 2.92Å; A852-Q856 PolarHBondContact O-N 2.89Å; A852-Q856 VanDerWaalsContact O-N 3.14Å
853K83Confident82.6Confident22 Ų2249.9 Ų49.910%0.09626%0.256CS..Hα-helixtrans-67.7-42.4175.4-172.768.5-165.4-176.30112.5F768 D780 D849 F850 A851 Q855 Q856 I857F768-K853 HydrophobicContact CE1-CB 3.91Å; F768-K853 HydrophobicContact CE1-CG 4.26Å; F768-K853 HydrophobicContact CE2-CB 4.32Å; F768-K853 HydrophobicContact CE2-CD 4.06Å; F768-K853 HydrophobicContact CE2-CG 3.86Å; F768-K853 HydrophobicContact CZ-CB 3.65Å; F768-K853 HydrophobicContact CZ-CD 4.11Å; F768-K853 HydrophobicContact CZ-CG 3.71Å; D780-K853 WeakPolarHBondContact OD1-CE 3.22Å; D780-K853 IonicContact OD1-NZ 3.46Å; D780-K853 PolarHBondContact OD1-NZ 3.41Å; D780-K853 IonicContact OD2-NZ 3.97Å; D849-K853 PolarHBondContact O-N 3.44Å; D849-K853 VanDerWaalsContact O-N 3.09Å; F850-K853 WeakPolarHBondContact O-CB 3.33Å; F850-K853 PolarHBondContact O-N 3.26Å; F850-K853 VanDerWaalsContact O-N 3.09Å; A851-K853 VanDerWaalsContact C-N 3.3Å; A851-K853 PolarHBondContact O-N 2.9Å; K853-Q855 VanDerWaalsContact C-N 3.27Å; K853-Q855 PolarHBondContact O-N 3.38Å; K853-Q856 WeakPolarHBondContact O-CB 3.27Å; K853-Q856 PolarHBondContact O-N 3.01Å; K853-Q856 VanDerWaalsContact O-N 3.1Å; K853-I857 HydrophobicContact CG-CD1 4.08Å; K853-I857 PolarHBondContact O-N 3.46Å
854C84.6Confident82.1Confident3 Ų353.3 Ų53.32%0.0227%0.268CS..Hα-helixtrans-57.5-41.7174.5-63.40000111.2M803 F850 A851 Q856 I857 L858M803-C854 HydrophobicContact CE-CB 4.39Å; M803-C854 HydrophobicContact CG-CB 4.07Å; M803-C854 WeakPolarHBondContact CG-SG 3.46Å; M803-C854 HydrophobicContact SD-CB 3.82Å; F850-C854 VanDerWaalsContact CE1-SG 3.53Å; F850-C854 PolarHBondContact O-N 2.9Å; F850-C854 PolarHBondContact O-SG 2.98Å; A851-C854 PolarHBondContact O-N 3.25Å; C854-Q856 PolarHBondContact O-N 2.96Å; C854-I857 PolarHBondContact O-N 3.27Å; C854-L858 WeakPolarHBondContact O-CB 3.43Å; C854-L858 VanDerWaalsContact O-CG 3.28Å; C854-L858 WeakPolarHBondContact O-CG 3.32Å; C854-L858 PolarHBondContact O-N 3.06Å
855Q81.8Confident81.9Confident84 Ų8447.3 Ų47.339%0.39325%0.246SC..Hα-helixtrans-61.4-41.5174.7-71.7176.2-10.100112.4A851 A852 K853 A859 V896A851-Q855 WeakPolarHBondContact O-CG 3.47Å; A851-Q855 PolarHBondContact O-N 3.13Å; A852-Q855 PolarHBondContact O-N 2.92Å; K853-Q855 VanDerWaalsContact C-N 3.27Å; K853-Q855 PolarHBondContact O-N 3.38Å; Q855-A859 VanDerWaalsContact O-CB 3.28Å; Q855-A859 WeakPolarHBondContact O-CB 3.3Å; Q855-A859 PolarHBondContact O-N 2.77Å; Q855-V896 HydrophobicContact CG-CG1 4.12Å
856Q82.6Confident81.6Confident120 Ų12043.2 Ų43.256%0.56123%0.233SC*.Hα-helixtrans-64.2-46.7176.4-171.5-171.612.300111.7A852 K853 C854 A859 E860A852-Q856 PolarHBondContact O-N 2.89Å; A852-Q856 VanDerWaalsContact O-N 3.14Å; K853-Q856 WeakPolarHBondContact O-CB 3.27Å; K853-Q856 PolarHBondContact O-N 3.01Å; K853-Q856 VanDerWaalsContact O-N 3.1Å; C854-Q856 PolarHBondContact O-N 2.96Å; Q856-A859 PolarHBondContact O-N 2.99Å; Q856-E860 PolarHBondContact O-N 3.43Å
857I84.8Confident81.1Confident10 Ų1043.3 Ų43.35%0.05123%0.234CC..Hα-helixtrans-60.1-47.5178.5-74.4169.4000110.5L765 L783 L794 M803 K853 C854 E860 A861L765-I857 HydrophobicContact CD2-CD1 4.15Å; L783-I857 HydrophobicContact CD2-CD1 4.01Å; L794-I857 HydrophobicContact CD2-CG1 4.33Å; L794-I857 HydrophobicContact CD2-CG2 4Å; M803-I857 HydrophobicContact SD-CB 4.22Å; M803-I857 HydrophobicContact SD-CD1 4.41Å; M803-I857 HydrophobicContact SD-CG2 3.87Å; K853-I857 HydrophobicContact CG-CD1 4.08Å; K853-I857 PolarHBondContact O-N 3.46Å; C854-I857 PolarHBondContact O-N 3.27Å; I857-E860 PolarHBondContact O-N 2.88Å; I857-A861 VanDerWaalsContact O-CB 3.29Å; I857-A861 WeakPolarHBondContact O-CB 3.43Å; I857-A861 PolarHBondContact O-N 3.19Å
858L81.2Confident80.9Confident1 Ų143.4 Ų43.41%0.00524%0.237CC..Hα-helixtrans-65-40.9178.6-75.3167.7000112.2L800 M803 C854 E860 A861 V862 V869 I873 T897 W904L800-L858 HydrophobicContact CD2-CD2 3.8Å; M803-L858 HydrophobicContact CE-CD1 3.97Å; M803-L858 HydrophobicContact CE-CD2 3.77Å; M803-L858 HydrophobicContact CE-CG 3.63Å; C854-L858 WeakPolarHBondContact O-CB 3.43Å; C854-L858 VanDerWaalsContact O-CG 3.28Å; C854-L858 WeakPolarHBondContact O-CG 3.32Å; C854-L858 PolarHBondContact O-N 3.06Å; L858-E860 VanDerWaalsContact C-N 3.33Å; L858-E860 PolarHBondContact O-N 3.31Å; L858-A861 PolarHBondContact O-N 3.48Å; L858-V862 WeakPolarHBondContact O-CB 3.23Å; L858-V862 WeakPolarHBondContact O-CG2 3.31Å; L858-V862 PolarHBondContact O-N 2.91Å; L858-V869 HydrophobicContact CD2-CG1 4.15Å; L858-I873 HydrophobicContact CD2-CD1 3.84Å; L858-T897 HydrophobicContact CD1-CG2 3.77Å; L858-W904 HydrophobicContact CB-CH2 3.35Å; L858-W904 HydrophobicContact CB-CZ2 4.39Å; L858-W904 HydrophobicContact CB-CZ3 3.8Å; L858-W904 HydrophobicContact CD1-CH2 4.3Å; L858-W904 HydrophobicContact CG-CH2 4.45Å
859A79.9Confident80.8Confident36 Ų3639.6 Ų39.630%0.29822%0.217SC..Hα-helixtrans-59.1-47.3176.500000110.7Q855 Q856 V862 T863 W904Q855-A859 VanDerWaalsContact O-CB 3.28Å; Q855-A859 WeakPolarHBondContact O-CB 3.3Å; Q855-A859 PolarHBondContact O-N 2.77Å; Q856-A859 PolarHBondContact O-N 2.99Å; A859-V862 PolarHBondContact O-N 3.29Å; A859-T863 WeakPolarHBondContact O-CG2 3.28Å; A859-T863 PolarHBondContact O-N 2.87Å; A859-T863 VanDerWaalsContact O-N 3.13Å; A859-W904 HydrophobicContact CB-CZ2 3.95Å
860E81.9Confident80.5Confident87 Ų8740.8 Ų40.841%0.40722%0.217SC..Hα-helixtrans-63.3-50.1176.4-168.764.9-156.700110.8L794 Q856 I857 L858 V862 T863 W864L794-E860 HydrophobicContact CD1-CB 3.88Å; L794-E860 HydrophobicContact CD1-CG 3.49Å; L794-E860 VanDerWaalsContact CD1-CG 3.49Å; Q856-E860 PolarHBondContact O-N 3.43Å; I857-E860 PolarHBondContact O-N 2.88Å; L858-E860 VanDerWaalsContact C-N 3.33Å; L858-E860 PolarHBondContact O-N 3.31Å; E860-V862 VanDerWaalsContact C-N 3.28Å; E860-V862 PolarHBondContact O-N 3.41Å; E860-T863 WeakPolarHBondContact O-CB 3.42Å; E860-T863 PolarHBondContact O-N 3.39Å; E860-T863 PolarHBondContact O-OG1 3.48Å; E860-W864 PolarHBondContact O-N 3.42Å; E860-W864 PolarHBondContact OE1-NE1 3.39Å
861A84.1Confident80.1Confident0 Ų041.1 Ų41.10%022%0.219CC..Hα-helixtrans-55.2-41.6178.700000112.9L794 W795 I857 L858 T863 W864 A865 V869L794-A861 HydrophobicContact CB-CB 4.05Å; W795-A861 HydrophobicContact CB-CB 4.16Å; I857-A861 VanDerWaalsContact O-CB 3.29Å; I857-A861 WeakPolarHBondContact O-CB 3.43Å; I857-A861 PolarHBondContact O-N 3.19Å; L858-A861 PolarHBondContact O-N 3.48Å; A861-T863 VanDerWaalsContact C-N 3.34Å; A861-W864 PolarHBondContact O-N 3.18Å; A861-A865 PolarHBondContact O-N 3.25Å; A861-V869 HydrophobicContact CB-CG2 3.72Å
862V78.1Confident80Confident32 Ų3241.7 Ų41.719%0.19422%0.218CC..Hα-helixtrans-68.5-31.5177.31700000111.8L858 A859 E860 W864 P866 V869 W904L858-V862 WeakPolarHBondContact O-CB 3.23Å; L858-V862 WeakPolarHBondContact O-CG2 3.31Å; L858-V862 PolarHBondContact O-N 2.91Å; A859-V862 PolarHBondContact O-N 3.29Å; E860-V862 VanDerWaalsContact C-N 3.28Å; E860-V862 PolarHBondContact O-N 3.41Å; V862-W864 VanDerWaalsContact C-N 3.25Å; V862-W864 PolarHBondContact O-N 3.47Å; V862-P866 HydrophobicContact CG1-CB 4.09Å; V862-P866 WeakPolarHBondContact O-CB 3.45Å; V862-P866 VanDerWaalsContact O-CD 3.26Å; V862-P866 WeakPolarHBondContact O-CD 3.37Å; V862-V869 HydrophobicContact CG2-CB 4.18Å; V862-V869 HydrophobicContact CG2-CG1 3.84Å; V862-W904 HydrophobicContact CB-CE3 4.44Å; V862-W904 HydrophobicContact CG2-CE3 3.98Å; V862-W904 HydrophobicContact CG2-CZ3 4.04Å
863T75.1Confident79.8Confident98 Ų9839.1 Ų39.160%0.60120%0.197SC*.Hα-helixtrans-64.1-32.8174.8710000112.6A859 E860 A861A859-T863 WeakPolarHBondContact O-CG2 3.28Å; A859-T863 PolarHBondContact O-N 2.87Å; A859-T863 VanDerWaalsContact O-N 3.13Å; E860-T863 WeakPolarHBondContact O-CB 3.42Å; E860-T863 PolarHBondContact O-N 3.39Å; E860-T863 PolarHBondContact O-OG1 3.48Å; A861-T863 VanDerWaalsContact C-N 3.34Å
864W73.2Confident79.4Confident98 Ų9838.3 Ų38.337%0.37119%0.194SC..Hα-helixtrans-90.1-43-178.6-67.3100.4000113.1W795 E860 A861 V862 F1096W795-W864 HydrophobicContact CE3-CB 3.85Å; W795-W864 HydrophobicContact CE3-CG 4.48Å; W795-W864 HydrophobicContact CH2-CB 3.72Å; W795-W864 HydrophobicContact CH2-CG 4.14Å; W795-W864 HydrophobicContact CZ3-CB 3.29Å; W795-W864 HydrophobicContact CZ3-CD2 4.43Å; W795-W864 AromaticContact CZ3-CG 3.63Å; W795-W864 HydrophobicContact CZ3-CG 3.63Å; E860-W864 PolarHBondContact O-N 3.42Å; E860-W864 PolarHBondContact OE1-NE1 3.39Å; A861-W864 PolarHBondContact O-N 3.18Å; V862-W864 VanDerWaalsContact C-N 3.25Å; V862-W864 PolarHBondContact O-N 3.47Å; W864-F1096 AromaticContact CE3-CE2 3.89Å; W864-F1096 HydrophobicContact CE3-CE2 3.89Å; W864-F1096 HydrophobicContact CE3-CZ 4.23Å; W864-F1096 HydrophobicContact CH2-CZ 4.43Å; W864-F1096 AromaticContact CZ3-CE2 3.82Å; W864-F1096 HydrophobicContact CZ3-CE2 3.82Å; W864-F1096 AromaticContact CZ3-CZ 3.73Å; W864-F1096 HydrophobicContact CZ3-CZ 3.73Å
865A80Confident79Confident1 Ų139.7 Ų39.71%0.00820%0.2CC..  trans-142.762.4-16900000112.3W795 A861 S867 I868 V869W795-A865 HydrophobicContact CB-CB 4.29Å; W795-A865 HydrophobicContact CD2-CB 3.82Å; W795-A865 HydrophobicContact CE3-CB 4.39Å; W795-A865 HydrophobicContact CG-CB 3.8Å; A861-A865 PolarHBondContact O-N 3.25Å; A865-S867 PolarHBondContact O-N 3.5Å; A865-I868 HydrophobicContact CB-CB 4.18Å; A865-I868 HydrophobicContact CB-CD1 4.27Å; A865-I868 PolarHBondContact O-N 2.94Å; A865-V869 VanDerWaalsContact O-CG2 3.29Å; A865-V869 WeakPolarHBondContact O-CG2 3.36Å; A865-V869 PolarHBondContact O-N 2.97Å
866P76.4Confident78.8Confident44 Ų4436.6 Ų36.629%0.28619%0.185SC..Hα-helixtrans-60.5-45.9-171.123.9-32.5000112.6V862 R870 E1089V862-P866 HydrophobicContact CG1-CB 4.09Å; V862-P866 WeakPolarHBondContact O-CB 3.45Å; V862-P866 VanDerWaalsContact O-CD 3.26Å; V862-P866 WeakPolarHBondContact O-CD 3.37Å; P866-R870 VanDerWaalsContact O-CB 3.27Å; P866-R870 WeakPolarHBondContact O-CB 3.41Å; P866-R870 PolarHBondContact O-N 3.43Å; P866-E1089 HydrophobicContact CG-CG 4.49Å
867S75Confident78.3Confident16 Ų1631.3 Ų31.311%0.11216%0.16CC..Hα-helixtrans-63-42.7179.8-64.70000112.2A865 R870 N871 E1089A865-S867 PolarHBondContact O-N 3.5Å; S867-R870 PolarHBondContact O-N 2.82Å; S867-N871 PolarHBondContact O-N 3.02Å; S867-N871 PolarHBondContact O-ND2 3.26Å; S867-N871 PolarHBondContact O-OD1 3.44Å; S867-N871 VanDerWaalsContact O-OD1 3.05Å; S867-E1089 VanDerWaalsContact CB-OE2 3.31Å; S867-E1089 WeakPolarHBondContact CB-OE2 3.46Å; S867-E1089 PolarHBondContact OG-OE2 3.02Å
868I79.7Confident77.7Confident45 Ų4531.5 Ų31.523%0.23116%0.162CC..Hα-helixtrans-68.3-47.6-178.1-65.8170.5000110.8A865 R870 N871 H872 T1093A865-I868 HydrophobicContact CB-CB 4.18Å; A865-I868 HydrophobicContact CB-CD1 4.27Å; A865-I868 PolarHBondContact O-N 2.94Å; I868-R870 VanDerWaalsContact C-N 3.3Å; I868-R870 PolarHBondContact O-N 3.39Å; I868-N871 PolarHBondContact O-N 3.41Å; I868-H872 VanDerWaalsContact CG2-NE2 3.32Å; I868-H872 WeakPolarHBondContact CG2-NE2 3.48Å; I868-H872 PolarHBondContact O-CD2 3.21Å; I868-H872 PolarHBondContact O-N 3.42Å; I868-T1093 HydrophobicContact CD1-CG2 3.37Å; I868-T1093 WeakPolarHBondContact CD1-OG1 3.35Å
869V81.2Confident77.3Confident0 Ų035.3 Ų35.30%018%0.18CC..Hα-helixtrans-60.2-42.8177.4177.50000110.6W795 L800 L858 A861 V862 A865 I873 M901W795-V869 HydrophobicContact CB-CG2 3.51Å; L800-V869 HydrophobicContact CD1-CG1 4.24Å; L800-V869 HydrophobicContact CD1-CG2 4.47Å; L858-V869 HydrophobicContact CD2-CG1 4.15Å; A861-V869 HydrophobicContact CB-CG2 3.72Å; V862-V869 HydrophobicContact CG2-CB 4.18Å; V862-V869 HydrophobicContact CG2-CG1 3.84Å; A865-V869 VanDerWaalsContact O-CG2 3.29Å; A865-V869 WeakPolarHBondContact O-CG2 3.36Å; A865-V869 PolarHBondContact O-N 2.97Å; V869-I873 HydrophobicContact CG1-CD1 4.03Å; V869-I873 WeakPolarHBondContact O-CG1 3.32Å; V869-I873 PolarHBondContact O-N 2.82Å; V869-M901 HydrophobicContact CG1-CE 3.81Å
870R76.5Confident76.7Confident88 Ų8834.9 Ų34.933%0.33217%0.173SC..Hα-helixtrans-57.6-51.5174.7-171.8-175.566.9-164.5-2.9111.2P866 S867 I868 H872 I873 Q874 M901 F923P866-R870 VanDerWaalsContact O-CB 3.27Å; P866-R870 WeakPolarHBondContact O-CB 3.41Å; P866-R870 PolarHBondContact O-N 3.43Å; S867-R870 PolarHBondContact O-N 2.82Å; I868-R870 VanDerWaalsContact C-N 3.3Å; I868-R870 PolarHBondContact O-N 3.39Å; R870-H872 PolarHBondContact O-N 3.49Å; R870-I873 PolarHBondContact O-N 2.82Å; R870-Q874 HydrophobicContact CG-CG 4.45Å; R870-Q874 VanDerWaalsContact O-CG 3.3Å; R870-Q874 WeakPolarHBondContact O-CG 3.4Å; R870-Q874 PolarHBondContact O-N 3.13Å; R870-M901 HydrophobicContact CB-CE 4.43Å; R870-F923 HydrophobicContact CG-CD2 3.67Å; R870-F923 HydrophobicContact CG-CE2 3.65Å
871N78.5Confident75.8Confident7 Ų732.7 Ų32.74%0.03717%0.167CC..Hα-helixtrans-66.5-39.9-177.1-54.7-17.3000112S867 I868 I873 Q874 E875 N1020S867-N871 PolarHBondContact O-N 3.02Å; S867-N871 PolarHBondContact O-ND2 3.26Å; S867-N871 PolarHBondContact O-OD1 3.44Å; S867-N871 VanDerWaalsContact O-OD1 3.05Å; I868-N871 PolarHBondContact O-N 3.41Å; N871-I873 VanDerWaalsContact C-N 3.26Å; N871-I873 PolarHBondContact O-N 3.07Å; N871-Q874 PolarHBondContact O-N 3.25Å; N871-Q874 PolarHBondContact OD1-OE1 3.19Å; N871-E875 WeakPolarHBondContact O-CB 3.35Å; N871-E875 PolarHBondContact O-N 3.48Å; N871-N1020 VanDerWaalsContact ND2-C 3.3Å; N871-N1020 WeakPolarHBondContact ND2-CB 3.44Å; N871-N1020 PolarHBondContact ND2-O 3.22Å
872H80.5Confident74.6Confident28 Ų2838.8 Ų38.813%0.1320%0.198CC..Hα-helixtrans-61.7-36.5175.3-71.9-29.5000112W795 L800 I868 R870 E875 Y876W795-H872 PolarHBondContact O-CD2 2.89Å; L800-H872 HydrophobicContact CD1-CB 4.12Å; I868-H872 VanDerWaalsContact CG2-NE2 3.32Å; I868-H872 WeakPolarHBondContact CG2-NE2 3.48Å; I868-H872 PolarHBondContact O-CD2 3.21Å; I868-H872 PolarHBondContact O-N 3.42Å; R870-H872 PolarHBondContact O-N 3.49Å; H872-E875 IonicContact ND1-OE2 2.71Å; H872-Y876 WeakPolarHBondContact O-CB 3.49Å; H872-Y876 PolarHBondContact O-N 2.99Å
873I77.4Confident73.6Confident1 Ų144.8 Ų44.81%0.00522%0.224CC..Hα-helixtrans-71.4-41.4174.2-70.7174.8000111.1L804 L858 V869 R870 N871 E875 Y876 I877 T897 M901 F923L804-I873 HydrophobicContact CD1-CG1 4.3Å; L858-I873 HydrophobicContact CD2-CD1 3.84Å; V869-I873 HydrophobicContact CG1-CD1 4.03Å; V869-I873 WeakPolarHBondContact O-CG1 3.32Å; V869-I873 PolarHBondContact O-N 2.82Å; R870-I873 PolarHBondContact O-N 2.82Å; N871-I873 VanDerWaalsContact C-N 3.26Å; N871-I873 PolarHBondContact O-N 3.07Å; I873-E875 VanDerWaalsContact C-N 3.31Å; I873-E875 PolarHBondContact O-N 3.35Å; I873-Y876 PolarHBondContact O-N 3.19Å; I873-I877 HydrophobicContact CG2-CD1 3.86Å; I873-I877 HydrophobicContact CG2-CG1 4.42Å; I873-I877 WeakPolarHBondContact O-CG1 3.32Å; I873-I877 PolarHBondContact O-N 2.93Å; I873-T897 HydrophobicContact CD1-CG2 3.59Å; I873-T897 HydrophobicContact CG2-CG2 4.46Å; I873-M901 HydrophobicContact CB-CE 4.17Å; I873-M901 HydrophobicContact CB-SD 4.22Å; I873-M901 HydrophobicContact CD1-CE 3.23Å; I873-M901 HydrophobicContact CD1-SD 3.61Å; I873-M901 HydrophobicContact CG1-CE 4.13Å; I873-M901 HydrophobicContact CG1-SD 4.47Å; I873-M901 HydrophobicContact CG2-SD 3.98Å; I873-F923 HydrophobicContact CG2-CZ 4.12Å
874Q74.9Confident72.6Confident6 Ų642 Ų423%0.02821%0.209CC..Hα-helixtrans-60.9-40.4174.5-69.8176.3-55.100111.9R870 N871 I877 S878 F923 I927R870-Q874 HydrophobicContact CG-CG 4.45Å; R870-Q874 VanDerWaalsContact O-CG 3.3Å; R870-Q874 WeakPolarHBondContact O-CG 3.4Å; R870-Q874 PolarHBondContact O-N 3.13Å; N871-Q874 PolarHBondContact O-N 3.25Å; N871-Q874 PolarHBondContact OD1-OE1 3.19Å; Q874-I877 PolarHBondContact O-N 3.16Å; Q874-S878 WeakPolarHBondContact O-CB 3.4Å; Q874-S878 PolarHBondContact O-N 3.23Å; Q874-S878 PolarHBondContact O-OG 3.07Å; Q874-F923 HydrophobicContact CG-CD2 4.13Å; Q874-F923 HydrophobicContact CG-CE2 3.43Å; Q874-F923 VanDerWaalsContact CG-CE2 3.43Å; Q874-F923 HydrophobicContact CG-CZ 3.88Å; Q874-I927 HydrophobicContact CB-CG1 3.99Å; Q874-I927 HydrophobicContact CG-CD1 4.05Å; Q874-I927 HydrophobicContact CG-CG1 3.63Å
875E76.1Confident71.6Confident31 Ų3142.1 Ų42.115%0.14522%0.224CC..Hα-helixtrans-65.5-46.6176.1-169.7-178.3-171.500111.1K797 N871 H872 I873 I877 S878 E879K797-E875 WeakPolarHBondContact CE-OE2 3.35Å; K797-E875 IonicContact NZ-OE1 3.46Å; K797-E875 PolarHBondContact NZ-OE1 3.17Å; K797-E875 IonicContact NZ-OE2 2.8Å; K797-E875 PolarHBondContact NZ-OE2 3.41Å; N871-E875 WeakPolarHBondContact O-CB 3.35Å; N871-E875 PolarHBondContact O-N 3.48Å; H872-E875 IonicContact ND1-OE2 2.71Å; I873-E875 VanDerWaalsContact C-N 3.31Å; I873-E875 PolarHBondContact O-N 3.35Å; E875-I877 VanDerWaalsContact C-N 3.32Å; E875-I877 PolarHBondContact O-N 3.44Å; E875-S878 PolarHBondContact O-N 2.87Å; E875-S878 VanDerWaalsContact O-N 3.16Å; E875-E879 WeakPolarHBondContact O-CG 3.4Å; E875-E879 PolarHBondContact O-N 3.42Å
876Y77.1Confident70.3Confident19 Ų1949.6 Ų49.68%0.07526%0.259CS..Hα-helixtrans-57.6-42.8174.1176.6-104.9000112.4K801 L804 H872 I873 L880 H891 L894K801-Y876 HydrophobicContact CB-CD2 4.45Å; K801-Y876 HydrophobicContact CD-CD2 4.43Å; K801-Y876 HydrophobicContact CG-CD2 3.88Å; L804-Y876 HydrophobicContact CB-CE1 3.87Å; L804-Y876 HydrophobicContact CD1-CD1 3.69Å; L804-Y876 HydrophobicContact CD1-CE1 3.86Å; L804-Y876 HydrophobicContact CD1-CG 4.29Å; H872-Y876 WeakPolarHBondContact O-CB 3.49Å; H872-Y876 PolarHBondContact O-N 2.99Å; I873-Y876 PolarHBondContact O-N 3.19Å; Y876-L880 HydrophobicContact CD1-CD1 3.95Å; Y876-L880 HydrophobicContact CE1-CD1 3.43Å; Y876-L880 VanDerWaalsContact CE1-CD1 3.43Å; Y876-L880 HydrophobicContact CE2-CD1 4.16Å; Y876-L880 WeakPolarHBondContact O-CG 3.47Å; Y876-L880 PolarHBondContact O-N 3.05Å; Y876-L880 VanDerWaalsContact O-N 3.16Å; Y876-H891 AromaticContact CE1-NE2 3.82Å; Y876-H891 AromaticContact CZ-NE2 3.99Å; Y876-H891 PolarHBondContact OH-NE2 3.24Å; Y876-L894 HydrophobicContact CD1-CD1 4Å; Y876-L894 HydrophobicContact CE1-CD1 4Å
877I73.5Confident69.2Low9 Ų952 Ų525%0.04627%0.265CS..Hα-helixtrans-64.5-43.1175.9-67.8168.8000111.1I873 Q874 E875 L880 S881 L888 L894 I898 F923 I927I873-I877 HydrophobicContact CG2-CD1 3.86Å; I873-I877 HydrophobicContact CG2-CG1 4.42Å; I873-I877 WeakPolarHBondContact O-CG1 3.32Å; I873-I877 PolarHBondContact O-N 2.93Å; Q874-I877 PolarHBondContact O-N 3.16Å; E875-I877 VanDerWaalsContact C-N 3.32Å; E875-I877 PolarHBondContact O-N 3.44Å; I877-L880 PolarHBondContact O-N 2.77Å; I877-S881 WeakPolarHBondContact O-CB 3.4Å; I877-S881 PolarHBondContact O-N 3.38Å; I877-L888 HydrophobicContact CG2-CD2 4.07Å; I877-L894 HydrophobicContact CD1-CD1 3.96Å; I877-L894 HydrophobicContact CD1-CD2 4.09Å; I877-L894 HydrophobicContact CD1-CG 4.26Å; I877-L894 HydrophobicContact CG1-CD1 3.47Å; I877-L894 VanDerWaalsContact CG1-CD1 3.47Å; I877-L894 HydrophobicContact CG1-CD2 3.83Å; I877-L894 HydrophobicContact CG1-CG 4.1Å; I877-I898 HydrophobicContact CD1-CD1 4.17Å; I877-I898 HydrophobicContact CD1-CG1 4.44Å; I877-F923 HydrophobicContact CD1-CE1 4.09Å; I877-F923 HydrophobicContact CD1-CZ 3.96Å; I877-I927 HydrophobicContact CD1-CD1 3.89Å; I877-I927 HydrophobicContact CG2-CD1 4.29Å; I877-I927 HydrophobicContact CG2-CG2 4.36Å
878S71.2Confident68.1Low14 Ų1455.2 Ų55.210%0.09828%0.281CS..Hα-helixtrans-67.1-41-177.9-59.70000111.2Q874 E875 L880 S881 I882 N931Q874-S878 WeakPolarHBondContact O-CB 3.4Å; Q874-S878 PolarHBondContact O-N 3.23Å; Q874-S878 PolarHBondContact O-OG 3.07Å; E875-S878 PolarHBondContact O-N 2.87Å; E875-S878 VanDerWaalsContact O-N 3.16Å; S878-L880 PolarHBondContact O-N 3.35Å; S878-S881 PolarHBondContact O-N 3.21Å; S878-S881 PolarHBondContact O-OG 3.37Å; S878-I882 WeakPolarHBondContact O-CG1 3.39Å; S878-I882 PolarHBondContact O-N 2.76Å; S878-N931 PolarHBondContact OG-ND2 3.46Å; S878-N931 VanDerWaalsContact OG-ND2 3.12Å
879E73Confident66.9Low81 Ų8157.7 Ų57.738%0.37930%0.302SS..Hα-helixtrans-57.4-47.6172-74.2173.9-169.300111.7K801 E875 S881 I882K801-E879 IonicContact NZ-OE1 2.63Å; K801-E879 PolarHBondContact NZ-OE1 2.65Å; K801-E879 IonicContact NZ-OE2 3.03Å; K801-E879 PolarHBondContact NZ-OE2 2.7Å; E875-E879 WeakPolarHBondContact O-CG 3.4Å; E875-E879 PolarHBondContact O-N 3.42Å; E879-S881 PolarHBondContact O-N 2.94Å; E879-I882 PolarHBondContact O-N 3.34Å
880L67.4Low65.5Low28 Ų2861.8 Ų61.815%0.14733%0.33CS..Hα-helixtrans-65.6-37178.2-73.1171.7000113.3Y876 I877 S878 I882 E883 S884Y876-L880 HydrophobicContact CD1-CD1 3.95Å; Y876-L880 HydrophobicContact CE1-CD1 3.43Å; Y876-L880 VanDerWaalsContact CE1-CD1 3.43Å; Y876-L880 HydrophobicContact CE2-CD1 4.16Å; Y876-L880 WeakPolarHBondContact O-CG 3.47Å; Y876-L880 PolarHBondContact O-N 3.05Å; Y876-L880 VanDerWaalsContact O-N 3.16Å; I877-L880 PolarHBondContact O-N 2.77Å; S878-L880 PolarHBondContact O-N 3.35Å; L880-I882 PolarHBondContact O-N 3.46Å; L880-E883 PolarHBondContact O-N 3.12Å; L880-E883 VanDerWaalsContact O-N 3.11Å; L880-S884 PolarHBondContact O-N 3.41Å
881S63.3Low64.6Low40 Ų4058 Ų5828%0.2832%0.316SS..Hα-helixtrans-63.5-25.7-179.274.30000113.2I877 S878 E879I877-S881 WeakPolarHBondContact O-CB 3.4Å; I877-S881 PolarHBondContact O-N 3.38Å; S878-S881 PolarHBondContact O-N 3.21Å; S878-S881 PolarHBondContact O-OG 3.37Å; E879-S881 PolarHBondContact O-N 2.94Å
882I59.6Low63.7Low129 Ų12958.8 Ų58.866%0.66232%0.322SS*.Hα-helixtrans-75-33.5176.7-64.7164.5000110.8S878 E879 L880S878-I882 WeakPolarHBondContact O-CG1 3.39Å; S878-I882 PolarHBondContact O-N 2.76Å; E879-I882 PolarHBondContact O-N 3.34Å; L880-I882 PolarHBondContact O-N 3.46Å
883E56.7Low62.5Low158 Ų15857.5 Ų57.574%0.73832%0.316SS*.Hα-helixtrans-78.1-40.8-175.2-68-172.3162.100112.8L880L880-E883 PolarHBondContact O-N 3.12Å; L880-E883 VanDerWaalsContact O-N 3.11Å
884S52.5Low61.6Low39 Ų3957.8 Ų57.827%0.27332%0.317SS..  trans-172.2132.7173.240.80000113.8L880 E886 F887L880-S884 PolarHBondContact O-N 3.41Å; S884-E886 VanDerWaalsContact C-N 3.29Å; S884-E886 PolarHBondContact O-N 2.89Å; S884-F887 PolarHBondContact O-N 3.16Å; S884-F887 WeakPolarHBondContact OG-CD2 3.43Å; S884-F887 WeakPolarHBondContact OG-CE2 3.42Å
885S52.4Low61Low100 Ų10060.3 Ų60.370%0.69934%0.339SS*.Hα-helixtrans-67-25.7179.656.10000114.1F887 L888S885-F887 VanDerWaalsContact C-N 3.27Å; S885-F887 PolarHBondContact O-N 3.33Å; S885-L888 PolarHBondContact O-N 3.34Å
886E53.4Low60.2Low158 Ų15861.1 Ų61.174%0.73835%0.347SS*.Hα-helixtrans-61.7-33.8177.6-77.7-177160.600112.2S884 L888 S889S884-E886 VanDerWaalsContact C-N 3.29Å; S884-E886 PolarHBondContact O-N 2.89Å; E886-L888 VanDerWaalsContact C-N 3.34Å; E886-L888 PolarHBondContact O-N 3.47Å; E886-S889 PolarHBondContact O-N 2.91Å; E886-S889 VanDerWaalsContact O-N 3.14Å; E886-S889 PolarHBondContact O-OG 3.48Å
887F52.5Low59.2Low96 Ų9660.3 Ų60.342%0.42134%0.344SS..Hα-helixtrans-62.9-36.2-177.9-89.7-102.4000113.2S884 S885 S889 C890 H891S884-F887 PolarHBondContact O-N 3.16Å; S884-F887 WeakPolarHBondContact OG-CD2 3.43Å; S884-F887 WeakPolarHBondContact OG-CE2 3.42Å; S885-F887 VanDerWaalsContact C-N 3.27Å; S885-F887 PolarHBondContact O-N 3.33Å; F887-S889 PolarHBondContact O-N 3.4Å; F887-C890 PolarHBondContact O-N 3.33Å; F887-H891 WeakPolarHBondContact O-CB 3.33Å; F887-H891 PolarHBondContact O-N 3.07Å
888L52.6Low58.4Low82 Ų8261.3 Ų61.343%0.42935%0.349SS..Hα-helixtrans-63-27.7178.9-71.5170.1000112.6I877 S885 E886 L894I877-L888 HydrophobicContact CG2-CD2 4.07Å; S885-L888 PolarHBondContact O-N 3.34Å; E886-L888 VanDerWaalsContact C-N 3.34Å; E886-L888 PolarHBondContact O-N 3.47Å; L888-L894 HydrophobicContact CD2-CD2 4.17Å
889S54.7Low57.8Low97 Ų9763.4 Ų63.468%0.67836%0.364SS*.Hα-helixtrans-79.5-21179.573.30000113.8E886 F887E886-S889 PolarHBondContact O-N 2.91Å; E886-S889 VanDerWaalsContact O-N 3.14Å; E886-S889 PolarHBondContact O-OG 3.48Å; F887-S889 PolarHBondContact O-N 3.4Å
890C52.5Low57Low87 Ų8760.1 Ų60.159%0.58835%0.349SS*.Hα-helixtrans-121.11.2-172.2-64.30000114.8F887 S892F887-C890 PolarHBondContact O-N 3.33Å; C890-S892 PolarHBondContact O-N 3.21Å; C890-S892 VanDerWaalsContact O-N 3.1Å
891H57.6Low56.3Low9 Ų960 Ų604%0.04235%0.349CS..  trans-81.490.8-178.1-164.4-31.8000111.7Q808 Y876 F887 G893 L894 A895Q808-H891 PolarHBondContact OE1-CE1 3.13Å; Q808-H891 VanDerWaalsContact OE1-CG 3.3Å; Q808-H891 PolarHBondContact OE1-ND1 3.48Å; Y876-H891 AromaticContact CE1-NE2 3.82Å; Y876-H891 AromaticContact CZ-NE2 3.99Å; Y876-H891 PolarHBondContact OH-NE2 3.24Å; F887-H891 WeakPolarHBondContact O-CB 3.33Å; F887-H891 PolarHBondContact O-N 3.07Å; H891-G893 PolarHBondContact ND1-N 2.97Å; H891-G893 PolarHBondContact O-N 2.87Å; H891-L894 HydrophobicContact CB-CB 3.89Å; H891-L894 PolarHBondContact CE1-N 3.02Å; H891-L894 PolarHBondContact ND1-N 3Å; H891-L894 WeakPolarHBondContact O-CB 3.43Å; H891-L894 PolarHBondContact O-N 3.21Å; H891-A895 PolarHBondContact O-N 3.31Å
892S58.4Low55.7Low23 Ų2360.5 Ų60.516%0.16135%0.348CS..Hα-helixtrans-64.3-37.5-179.862.20000113.4F811 C890 L894 A895 V896F811-S892 WeakPolarHBondContact CB-OG 3.49Å; F811-S892 WeakPolarHBondContact CD1-OG 3.41Å; F811-S892 VanDerWaalsContact CD2-CB 3.49Å; F811-S892 WeakPolarHBondContact CD2-OG 3.48Å; F811-S892 VanDerWaalsContact CE2-CB 3.41Å; F811-S892 WeakPolarHBondContact CE2-OG 3.36Å; F811-S892 WeakPolarHBondContact CG-OG 3.15Å; F811-S892 VanDerWaalsContact CZ-CB 3.45Å; C890-S892 PolarHBondContact O-N 3.21Å; C890-S892 VanDerWaalsContact O-N 3.1Å; S892-L894 VanDerWaalsContact C-N 3.27Å; S892-L894 PolarHBondContact O-N 3.35Å; S892-A895 PolarHBondContact O-N 3.07Å; S892-V896 WeakPolarHBondContact O-CG2 3.5Å; S892-V896 PolarHBondContact O-N 3.37Å
893G56.2Low55.4Low1 Ų159.1 Ų59.11%0.0134%0.341CS..Hα-helixtrans-60.2-39.617600000111.9H891 T897H891-G893 PolarHBondContact ND1-N 2.97Å; H891-G893 PolarHBondContact O-N 2.87Å; G893-T897 VanDerWaalsContact O-CB 3.23Å; G893-T897 WeakPolarHBondContact O-CB 3.33Å; G893-T897 PolarHBondContact O-N 2.99Å; G893-T897 PolarHBondContact O-OG1 2.92Å
894L58.4Low55.2Low6 Ų654 Ų543%0.03132%0.315CS..Hα-helixtrans-70.1-42.5174.1-156.784.9000111Y876 I877 L888 H891 S892 V896 T897 I898Y876-L894 HydrophobicContact CD1-CD1 4Å; Y876-L894 HydrophobicContact CE1-CD1 4Å; I877-L894 HydrophobicContact CD1-CD1 3.96Å; I877-L894 HydrophobicContact CD1-CD2 4.09Å; I877-L894 HydrophobicContact CD1-CG 4.26Å; I877-L894 HydrophobicContact CG1-CD1 3.47Å; I877-L894 VanDerWaalsContact CG1-CD1 3.47Å; I877-L894 HydrophobicContact CG1-CD2 3.83Å; I877-L894 HydrophobicContact CG1-CG 4.1Å; L888-L894 HydrophobicContact CD2-CD2 4.17Å; H891-L894 HydrophobicContact CB-CB 3.89Å; H891-L894 PolarHBondContact CE1-N 3.02Å; H891-L894 PolarHBondContact ND1-N 3Å; H891-L894 WeakPolarHBondContact O-CB 3.43Å; H891-L894 PolarHBondContact O-N 3.21Å; S892-L894 VanDerWaalsContact C-N 3.27Å; S892-L894 PolarHBondContact O-N 3.35Å; L894-V896 VanDerWaalsContact C-N 3.34Å; L894-V896 PolarHBondContact O-N 3.01Å; L894-T897 PolarHBondContact O-N 2.97Å; L894-I898 HydrophobicContact CD2-CD1 3.59Å; L894-I898 HydrophobicContact CG-CD1 3.65Å; L894-I898 HydrophobicContact CG-CG1 4.14Å; L894-I898 WeakPolarHBondContact O-CB 3.42Å; L894-I898 WeakPolarHBondContact O-CG1 3.3Å; L894-I898 PolarHBondContact O-N 3.35Å
895A61.2Low54.8Low59 Ų5954.3 Ų54.349%0.48833%0.325SS..Hα-helixtrans-60.9-41.8176.900000112.3H891 S892 S899H891-A895 PolarHBondContact O-N 3.31Å; S892-A895 PolarHBondContact O-N 3.07Å; A895-S899 WeakPolarHBondContact O-CB 3.49Å; A895-S899 PolarHBondContact O-N 3.49Å
896V59.1Low53.9Low49 Ų4952.6 Ų52.630%0.29731%0.308SS..Hα-helixtrans-66.8-44.1174.6173.90000110.8Q855 S892 L894 S899 S900Q855-V896 HydrophobicContact CG-CG1 4.12Å; S892-V896 WeakPolarHBondContact O-CG2 3.5Å; S892-V896 PolarHBondContact O-N 3.37Å; L894-V896 VanDerWaalsContact C-N 3.34Å; L894-V896 PolarHBondContact O-N 3.01Å; V896-S899 PolarHBondContact O-N 3.46Å; V896-S900 VanDerWaalsContact O-CB 3.26Å; V896-S900 WeakPolarHBondContact O-CB 3.35Å; V896-S900 PolarHBondContact O-N 3.43Å; V896-S900 PolarHBondContact O-OG 2.89Å
897T56.9Low53Low2 Ų250.5 Ų50.51%0.01231%0.306CS..Hα-helixtrans-64.5-48.2179.1-60.80000111.5L804 L858 I873 G893 L894 S900 M901L804-T897 HydrophobicContact CD2-CG2 4.04Å; L804-T897 WeakPolarHBondContact CD2-OG1 3.36Å; L858-T897 HydrophobicContact CD1-CG2 3.77Å; I873-T897 HydrophobicContact CD1-CG2 3.59Å; I873-T897 HydrophobicContact CG2-CG2 4.46Å; G893-T897 VanDerWaalsContact O-CB 3.23Å; G893-T897 WeakPolarHBondContact O-CB 3.33Å; G893-T897 PolarHBondContact O-N 2.99Å; G893-T897 PolarHBondContact O-OG1 2.92Å; L894-T897 PolarHBondContact O-N 2.97Å; T897-S900 PolarHBondContact O-N 3.21Å; T897-M901 WeakPolarHBondContact O-CB 3.43Å; T897-M901 WeakPolarHBondContact O-CG 3.44Å; T897-M901 PolarHBondContact O-N 3.39Å
898I56.4Low52.2Low29 Ų2949.3 Ų49.315%0.14932%0.321CS..Hα-helixtrans-60-54.7174.2-70171.1000108.6I877 L894 S900 M901 L902 F923I877-I898 HydrophobicContact CD1-CD1 4.17Å; I877-I898 HydrophobicContact CD1-CG1 4.44Å; L894-I898 HydrophobicContact CD2-CD1 3.59Å; L894-I898 HydrophobicContact CG-CD1 3.65Å; L894-I898 HydrophobicContact CG-CG1 4.14Å; L894-I898 WeakPolarHBondContact O-CB 3.42Å; L894-I898 WeakPolarHBondContact O-CG1 3.3Å; L894-I898 PolarHBondContact O-N 3.35Å; I898-S900 PolarHBondContact O-N 2.92Å; I898-S900 VanDerWaalsContact O-N 3.15Å; I898-M901 CarbonylContact O-C 3.47Å; I898-M901 WeakPolarHBondContact O-CA 3.16Å; I898-M901 WeakPolarHBondContact O-CB 3.45Å; I898-M901 PolarHBondContact O-N 2.59Å; I898-L902 HydrophobicContact CG2-CD1 3.66Å; I898-L902 HydrophobicContact CG2-CD2 4.41Å; I898-L902 HydrophobicContact CG2-CG 3.8Å; I898-L902 WeakPolarHBondContact O-CB 3.47Å; I898-L902 WeakPolarHBondContact O-CG 3.49Å; I898-L902 PolarHBondContact O-N 3.42Å; I898-F923 HydrophobicContact CG1-CE1 4.24Å
899S58.7Low51.1Low59 Ų5951.1 Ų51.141%0.41333%0.331SS..Hα-helixtrans-54.7-39.2178.9-178.60000112.4A895 V896 N903A895-S899 WeakPolarHBondContact O-CB 3.49Å; A895-S899 PolarHBondContact O-N 3.49Å; V896-S899 PolarHBondContact O-N 3.46Å; S899-N903 WeakPolarHBondContact O-CB 3.48Å; S899-N903 VanDerWaalsContact O-CG 3.26Å; S899-N903 PolarHBondContact O-N 2.92Å; S899-N903 PolarHBondContact O-ND2 3.49Å
900S56.6Low49.8Very low12 Ų1254.1 Ų54.18%0.08433%0.334CS..Hα-helixtrans-66.5-48.4175.7-54.10000111.3V896 T897 I898 L902 N903 W904V896-S900 VanDerWaalsContact O-CB 3.26Å; V896-S900 WeakPolarHBondContact O-CB 3.35Å; V896-S900 PolarHBondContact O-N 3.43Å; V896-S900 PolarHBondContact O-OG 2.89Å; T897-S900 PolarHBondContact O-N 3.21Å; I898-S900 PolarHBondContact O-N 2.92Å; I898-S900 VanDerWaalsContact O-N 3.15Å; S900-L902 VanDerWaalsContact C-N 3.34Å; S900-L902 PolarHBondContact O-N 3.45Å; S900-N903 PolarHBondContact O-N 3.03Å; S900-W904 VanDerWaalsContact CB-CH2 3.41Å; S900-W904 PolarHBondContact O-N 2.85Å; S900-W904 VanDerWaalsContact O-N 3.1Å
901M53Low48.4Very low26 Ų2659.8 Ų59.813%0.12835%0.349CS..Hα-helixtrans-57.7-42.1174-75.3-171.413400113.4V869 R870 I873 T897 I898 W904 F923V869-M901 HydrophobicContact CG1-CE 3.81Å; R870-M901 HydrophobicContact CB-CE 4.43Å; I873-M901 HydrophobicContact CB-CE 4.17Å; I873-M901 HydrophobicContact CB-SD 4.22Å; I873-M901 HydrophobicContact CD1-CE 3.23Å; I873-M901 HydrophobicContact CD1-SD 3.61Å; I873-M901 HydrophobicContact CG1-CE 4.13Å; I873-M901 HydrophobicContact CG1-SD 4.47Å; I873-M901 HydrophobicContact CG2-SD 3.98Å; T897-M901 WeakPolarHBondContact O-CB 3.43Å; T897-M901 WeakPolarHBondContact O-CG 3.44Å; T897-M901 PolarHBondContact O-N 3.39Å; I898-M901 CarbonylContact O-C 3.47Å; I898-M901 WeakPolarHBondContact O-CA 3.16Å; I898-M901 WeakPolarHBondContact O-CB 3.45Å; I898-M901 PolarHBondContact O-N 2.59Å; M901-W904 HydrophobicContact CB-CE3 4.41Å; M901-W904 HydrophobicContact CG-CE3 4.09Å; M901-W904 HydrophobicContact CG-CZ3 3.88Å; M901-W904 PolarHBondContact O-N 3.08Å; M901-F923 HydrophobicContact SD-CE2 4.29Å; M901-F923 HydrophobicContact SD-CZ 4.37Å
902L50.5Low46.9Very low50 Ų5066.2 Ų66.226%0.26238%0.382SS..Hα-helixtrans-66-39179.2-66.3-171.8000111.7I898 S900 W904 A920I898-L902 HydrophobicContact CG2-CD1 3.66Å; I898-L902 HydrophobicContact CG2-CD2 4.41Å; I898-L902 HydrophobicContact CG2-CG 3.8Å; I898-L902 WeakPolarHBondContact O-CB 3.47Å; I898-L902 WeakPolarHBondContact O-CG 3.49Å; I898-L902 PolarHBondContact O-N 3.42Å; S900-L902 VanDerWaalsContact C-N 3.34Å; S900-L902 PolarHBondContact O-N 3.45Å; L902-W904 VanDerWaalsContact C-N 3.32Å; L902-A920 HydrophobicContact CB-CB 4.48Å; L902-A920 HydrophobicContact CD1-CB 3.56Å; L902-A920 HydrophobicContact CD2-CB 3.32Å; L902-A920 HydrophobicContact CG-CB 3.91Å
903N52.8Low45.6Very low99 Ų9970.6 Ų70.653%0.52941%0.411SS..Hα-helixtrans-73-22.8177-74.8-26.5000112.9S899 S900 N906S899-N903 WeakPolarHBondContact O-CB 3.48Å; S899-N903 VanDerWaalsContact O-CG 3.26Å; S899-N903 PolarHBondContact O-N 2.92Å; S899-N903 PolarHBondContact O-ND2 3.49Å; S900-N903 PolarHBondContact O-N 3.03Å; N903-N906 PolarHBondContact O-N 2.8Å
904W51.8Low44.2Very low50 Ų5080.4 Ų80.419%0.18945%0.449CS..Hα-helixtrans-80-22.5-172.9-68.8-28.4000115.7L858 A859 V862 S900 M901 L902 N906 T907L858-W904 HydrophobicContact CB-CH2 3.35Å; L858-W904 HydrophobicContact CB-CZ2 4.39Å; L858-W904 HydrophobicContact CB-CZ3 3.8Å; L858-W904 HydrophobicContact CD1-CH2 4.3Å; L858-W904 HydrophobicContact CG-CH2 4.45Å; A859-W904 HydrophobicContact CB-CZ2 3.95Å; V862-W904 HydrophobicContact CB-CE3 4.44Å; V862-W904 HydrophobicContact CG2-CE3 3.98Å; V862-W904 HydrophobicContact CG2-CZ3 4.04Å; S900-W904 VanDerWaalsContact CB-CH2 3.41Å; S900-W904 PolarHBondContact O-N 2.85Å; S900-W904 VanDerWaalsContact O-N 3.1Å; M901-W904 HydrophobicContact CB-CE3 4.41Å; M901-W904 HydrophobicContact CG-CE3 4.09Å; M901-W904 HydrophobicContact CG-CZ3 3.88Å; M901-W904 PolarHBondContact O-N 3.08Å; L902-W904 VanDerWaalsContact C-N 3.32Å; W904-N906 PolarHBondContact O-N 3.45Å; W904-T907 PolarHBondContact O-N 3.47Å; W904-T907 PolarHBondContact O-OG1 2.88Å
905G44.2Very low42.9Very low47 Ų4783.5 Ų83.549%0.48548%0.482SS..THydrogen-bonded Turntrans-51.3-26169.700000112.8
906N33.6Very low41.6Very low64 Ų6485.4 Ų85.434%0.34248%0.484SS..THydrogen-bonded Turntrans-83.5-6.7-180-64.1-21.5000114.9N903 W904 L909N903-N906 PolarHBondContact O-N 2.8Å; W904-N906 PolarHBondContact O-N 3.45Å; N906-L909 CarbonylContact O-C 3.59Å
907T35.1Very low40.4Very low113 Ų11390 Ų9069%0.69351%0.506SS*.THydrogen-bonded Turntrans-83.9-23.2-17656.70000113.6W904 L909W904-T907 PolarHBondContact O-N 3.47Å; W904-T907 PolarHBondContact O-OG1 2.88Å; T907-L909 VanDerWaalsContact C-N 3.34Å
908G35.9Very low39.6Very low71 Ų7193.4 Ų93.473%0.73253%0.528SS*.SBendtrans-76.5-19.6170.600000114.1
909L28.7Very low38.9Very low120 Ų12094 Ų9463%0.62854%0.537SS*.SBendtrans-129.693.3-177.7-74.7161.7000108.6N906 T907 K911N906-L909 CarbonylContact O-C 3.59Å; T907-L909 VanDerWaalsContact C-N 3.34Å; L909-K911 PolarHBondContact O-N 3.28Å; L909-K911 VanDerWaalsContact O-N 3.12Å
910Q27.6Very low38.2Very low161 Ų16192.3 Ų92.375%0.75253%0.528SS*.  trans-34.8115.8178.5-75.7175.2-23.200113.5L912Q910-L912 PolarHBondContact O-N 3.43Å
911K24.3Very low37.9Very low206 Ų20695.6 Ų95.690%0.89655%0.55SS**  trans18.682.4155.4-66-177.7177.7-179.80115.7L909L909-K911 PolarHBondContact O-N 3.28Å; L909-K911 VanDerWaalsContact O-N 3.12Å
912L25.2Very low38.1Very low143 Ų143100 Ų10075%0.74957%0.574SS**  trans-87.5142.8155.1-83.5152.8000109.5Q910 Y914Q910-L912 PolarHBondContact O-N 3.43Å; L912-Y914 VanDerWaalsContact C-N 3.29Å; L912-Y914 PolarHBondContact O-N 2.9Å; L912-Y914 VanDerWaalsContact O-N 3.11Å
913P31.5Very low38.5Very low116 Ų11698.3 Ų98.375%0.75357%0.565SS**SBendtrans-7911.6-163.5-12.729.5000116.9
914Y26.7Very low39Very low206 Ų20698.4 Ų98.481%0.80856%0.563SS**SBendtrans-129.1122.1177.3-77.4-86.2000109.2L912 D916L912-Y914 VanDerWaalsContact C-N 3.29Å; L912-Y914 PolarHBondContact O-N 2.9Å; L912-Y914 VanDerWaalsContact O-N 3.11Å; Y914-D916 PolarHBondContact O-N 3.25Å; Y914-D916 VanDerWaalsContact O-N 3.12Å
915G30.6Very low39.7Very low72 Ų7298.3 Ų98.374%0.74257%0.57SS**  trans-56.2113.4-175.100000111.9L917G915-L917 VanDerWaalsContact C-N 3.33Å; G915-L917 PolarHBondContact O-N 2.73Å
916D34.7Very low40.9Very low99 Ų9996.9 Ų96.953%0.52956%0.555SS.*  trans-72.587.1176.1-86.6-33.7000110.6Y914 P918Y914-D916 PolarHBondContact O-N 3.25Å; Y914-D916 VanDerWaalsContact O-N 3.12Å; D916-P918 VanDerWaalsContact CA-CD 3.47Å; D916-P918 WeakPolarHBondContact O-CD 3.48Å
917L34Very low42.6Very low145 Ų14594.4 Ų94.476%0.75954%0.542SS*.THydrogen-bonded Turntrans-46.7-25.7161.8-137.380.2000116G915 A919 A920 S921G915-L917 VanDerWaalsContact C-N 3.33Å; G915-L917 PolarHBondContact O-N 2.73Å; L917-A919 PolarHBondContact O-N 3.08Å; L917-A920 PolarHBondContact O-N 2.92Å; L917-S921 PolarHBondContact O-N 3.25Å
918P38.9Very low44.3Very low73 Ų7391 Ų9147%0.47453%0.529SS..Hα-helixtrans-63.3-37.8-175.5-26.535.7000115.6D916 A920 S921 L922D916-P918 VanDerWaalsContact CA-CD 3.47Å; D916-P918 WeakPolarHBondContact O-CD 3.48Å; P918-A920 VanDerWaalsContact C-N 3.3Å; P918-A920 PolarHBondContact O-N 3.03Å; P918-S921 WeakPolarHBondContact O-CB 3.34Å; P918-S921 PolarHBondContact O-N 3.06Å; P918-L922 WeakPolarHBondContact O-CG 3.32Å; P918-L922 PolarHBondContact O-N 3.38Å
919A42.4Very low46.2Very low41 Ų4191.2 Ų91.234%0.33951%0.513SS..Hα-helixtrans-65.5-36.8-177.100000111.8L917 L922 F923L917-A919 PolarHBondContact O-N 3.08Å; A919-L922 PolarHBondContact O-N 3.44Å; A919-F923 PolarHBondContact O-N 2.98Å
920A43.3Very low48.6Very low25 Ų2586.6 Ų86.621%0.20749%0.488CS..Hα-helixtrans-67.5-43.1173.600000113L902 L917 P918 L922 F923 M924L902-A920 HydrophobicContact CB-CB 4.48Å; L902-A920 HydrophobicContact CD1-CB 3.56Å; L902-A920 HydrophobicContact CD2-CB 3.32Å; L902-A920 HydrophobicContact CG-CB 3.91Å; L917-A920 PolarHBondContact O-N 2.92Å; P918-A920 VanDerWaalsContact C-N 3.3Å; P918-A920 PolarHBondContact O-N 3.03Å; A920-L922 VanDerWaalsContact C-N 3.3Å; A920-L922 PolarHBondContact O-N 2.99Å; A920-F923 PolarHBondContact O-N 3.5Å; A920-M924 WeakPolarHBondContact O-CB 3.34Å; A920-M924 WeakPolarHBondContact O-CG 3.45Å; A920-M924 PolarHBondContact O-N 3.38Å
921S50.5Low51.1Low80 Ų8081.2 Ų81.256%0.55946%0.464SS*.Hα-helixtrans-58.8-43.3173-176.30000111L917 P918 S925L917-S921 PolarHBondContact O-N 3.25Å; P918-S921 WeakPolarHBondContact O-CB 3.34Å; P918-S921 PolarHBondContact O-N 3.06Å; S921-S925 WeakPolarHBondContact O-CA 3.4Å; S921-S925 WeakPolarHBondContact O-CB 3.08Å; S921-S925 PolarHBondContact O-N 3.21Å; S921-S925 PolarHBondContact O-OG 3.03Å; S921-S925 VanDerWaalsContact O-OG 3.06Å
922L57.1Low53.9Low118 Ų11877.2 Ų77.262%0.61845%0.447SS*.Hα-helixtrans-63.7-48.2178.4-75.9166.2000112.4P918 A919 A920 S925 G926P918-L922 WeakPolarHBondContact O-CG 3.32Å; P918-L922 PolarHBondContact O-N 3.38Å; A919-L922 PolarHBondContact O-N 3.44Å; A920-L922 VanDerWaalsContact C-N 3.3Å; A920-L922 PolarHBondContact O-N 2.99Å; L922-S925 WeakPolarHBondContact CA-OG 3.37Å; L922-S925 PolarHBondContact O-N 2.81Å; L922-S925 PolarHBondContact O-OG 2.9Å; L922-G926 PolarHBondContact O-N 3.21Å
923F60.6Low56.9Low16 Ų1671.4 Ų71.47%0.0742%0.416CS..Hα-helixtrans-59.8-49.5178177.8-100.5000112.4R870 I873 Q874 I877 I898 M901 A919 A920 G926 I927R870-F923 HydrophobicContact CG-CD2 3.67Å; R870-F923 HydrophobicContact CG-CE2 3.65Å; I873-F923 HydrophobicContact CG2-CZ 4.12Å; Q874-F923 HydrophobicContact CG-CD2 4.13Å; Q874-F923 HydrophobicContact CG-CE2 3.43Å; Q874-F923 VanDerWaalsContact CG-CE2 3.43Å; Q874-F923 HydrophobicContact CG-CZ 3.88Å; I877-F923 HydrophobicContact CD1-CE1 4.09Å; I877-F923 HydrophobicContact CD1-CZ 3.96Å; I898-F923 HydrophobicContact CG1-CE1 4.24Å; M901-F923 HydrophobicContact SD-CE2 4.29Å; M901-F923 HydrophobicContact SD-CZ 4.37Å; A919-F923 PolarHBondContact O-N 2.98Å; A920-F923 PolarHBondContact O-N 3.5Å; F923-G926 PolarHBondContact O-N 3.32Å; F923-I927 HydrophobicContact CD1-CD1 4Å; F923-I927 HydrophobicContact CE1-CD1 3.48Å; F923-I927 VanDerWaalsContact CE1-CD1 3.48Å; F923-I927 HydrophobicContact CE2-CD1 4.44Å; F923-I927 HydrophobicContact CZ-CD1 3.74Å; F923-I927 PolarHBondContact O-N 2.99Å
924M62.4Low59.6Low101 Ų10167.9 Ų67.950%0.49839%0.39SS..Hα-helixtrans-67.8-37.6178.7-67.5-56.9-62.200112A920 G926 I927 G928A920-M924 WeakPolarHBondContact O-CB 3.34Å; A920-M924 WeakPolarHBondContact O-CG 3.45Å; A920-M924 PolarHBondContact O-N 3.38Å; M924-G926 VanDerWaalsContact C-N 3.3Å; M924-G926 PolarHBondContact O-N 3.47Å; M924-I927 PolarHBondContact O-N 3.12Å; M924-I927 HydrophobicContact SD-CD1 4.38Å; M924-G928 PolarHBondContact O-N 3.36Å
925S66Low62.4Low48 Ų4860.1 Ų60.134%0.33637%0.373SS..Hα-helixtrans-64.8-35.6174.874.20000111.8S921 L922 G928 L929S921-S925 WeakPolarHBondContact O-CA 3.4Å; S921-S925 WeakPolarHBondContact O-CB 3.08Å; S921-S925 PolarHBondContact O-N 3.21Å; S921-S925 PolarHBondContact O-OG 3.03Å; S921-S925 VanDerWaalsContact O-OG 3.06Å; L922-S925 WeakPolarHBondContact CA-OG 3.37Å; L922-S925 PolarHBondContact O-N 2.81Å; L922-S925 PolarHBondContact O-OG 2.9Å; S925-G928 PolarHBondContact O-N 3.33Å; S925-L929 WeakPolarHBondContact O-CB 3.17Å; S925-L929 WeakPolarHBondContact O-CD1 3.41Å; S925-L929 WeakPolarHBondContact O-CG 3.27Å; S925-L929 PolarHBondContact O-N 3.39Å
926G69.6Low65.2Low16 Ų1659.5 Ų59.517%0.16535%0.351CS..Hα-helixtrans-60.3-51.817500000111.6L922 F923 M924 G928 L929 E930L922-G926 PolarHBondContact O-N 3.21Å; F923-G926 PolarHBondContact O-N 3.32Å; M924-G926 VanDerWaalsContact C-N 3.3Å; M924-G926 PolarHBondContact O-N 3.47Å; G926-G928 VanDerWaalsContact C-N 3.31Å; G926-G928 PolarHBondContact O-N 3.16Å; G926-L929 PolarHBondContact O-N 3.44Å; G926-E930 WeakPolarHBondContact O-CB 3.43Å; G926-E930 WeakPolarHBondContact O-CG 3.23Å; G926-E930 PolarHBondContact O-N 2.92Å
927I69.1Low67.8Low13 Ų1355 Ų557%0.06733%0.327CS..Hα-helixtrans-59-44176.3-64.4163000111Q874 I877 F923 M924 N931Q874-I927 HydrophobicContact CB-CG1 3.99Å; Q874-I927 HydrophobicContact CG-CD1 4.05Å; Q874-I927 HydrophobicContact CG-CG1 3.63Å; I877-I927 HydrophobicContact CD1-CD1 3.89Å; I877-I927 HydrophobicContact CG2-CD1 4.29Å; I877-I927 HydrophobicContact CG2-CG2 4.36Å; F923-I927 HydrophobicContact CD1-CD1 4Å; F923-I927 HydrophobicContact CE1-CD1 3.48Å; F923-I927 VanDerWaalsContact CE1-CD1 3.48Å; F923-I927 HydrophobicContact CE2-CD1 4.44Å; F923-I927 HydrophobicContact CZ-CD1 3.74Å; F923-I927 PolarHBondContact O-N 2.99Å; M924-I927 PolarHBondContact O-N 3.12Å; M924-I927 HydrophobicContact SD-CD1 4.38Å; I927-N931 WeakPolarHBondContact CG2-ND2 3.47Å; I927-N931 WeakPolarHBondContact O-CB 3.3Å; I927-N931 PolarHBondContact O-N 2.97Å; I927-N931 PolarHBondContact O-ND2 3.47Å
928G70.5Confident70.3Confident42 Ų4254.3 Ų54.343%0.43332%0.318SS..Hα-helixtrans-62.8-42.7178.700000112.7M924 S925 G926 F932M924-G928 PolarHBondContact O-N 3.36Å; S925-G928 PolarHBondContact O-N 3.33Å; G926-G928 VanDerWaalsContact C-N 3.31Å; G926-G928 PolarHBondContact O-N 3.16Å; G928-F932 WeakPolarHBondContact O-CB 3.39Å; G928-F932 PolarHBondContact O-N 3.41Å
929L75.7Confident72.6Confident75 Ų7552.2 Ų52.239%0.39331%0.309SS..Hα-helixtrans-67.6-49.3178.1-74.1164.4000111.4S925 G926 N931 F932 Y933 L979S925-L929 WeakPolarHBondContact O-CB 3.17Å; S925-L929 WeakPolarHBondContact O-CD1 3.41Å; S925-L929 WeakPolarHBondContact O-CG 3.27Å; S925-L929 PolarHBondContact O-N 3.39Å; G926-L929 PolarHBondContact O-N 3.44Å; L929-N931 PolarHBondContact O-N 2.78Å; L929-F932 PolarHBondContact O-N 2.89Å; L929-Y933 HydrophobicContact CD2-CE2 3.84Å; L929-Y933 WeakPolarHBondContact O-CD2 3.4Å; L929-Y933 PolarHBondContact O-N 3.42Å; L929-L979 HydrophobicContact CD2-CD1 4.49Å
930E80.5Confident74.9Confident23 Ų2352.7 Ų52.711%0.10731%0.308CS..Hα-helixtrans-57.1-50.6179.5-72.9173.5-167.800111.2G926 F932 Y933 L934 W1021G926-E930 WeakPolarHBondContact O-CB 3.43Å; G926-E930 WeakPolarHBondContact O-CG 3.23Å; G926-E930 PolarHBondContact O-N 2.92Å; E930-F932 PolarHBondContact O-N 3.16Å; E930-Y933 PolarHBondContact O-N 3.26Å; E930-L934 WeakPolarHBondContact O-CB 3.44Å; E930-L934 PolarHBondContact O-N 3.13Å; E930-W1021 HydrophobicContact CB-CD2 4.48Å; E930-W1021 HydrophobicContact CB-CH2 4.02Å; E930-W1021 HydrophobicContact CB-CZ2 3.77Å; E930-W1021 HydrophobicContact CB-CZ3 4.47Å; E930-W1021 HydrophobicContact CG-CD2 3.82Å; E930-W1021 HydrophobicContact CG-CE3 3.95Å; E930-W1021 HydrophobicContact CG-CG 4.35Å; E930-W1021 HydrophobicContact CG-CH2 4.15Å; E930-W1021 HydrophobicContact CG-CZ2 4.02Å; E930-W1021 HydrophobicContact CG-CZ3 4.12Å
931N79.3Confident76.9Confident47 Ų4753.2 Ų53.225%0.25131%0.307SS..Hα-helixtrans-65.4-37.8178.8-75.2-49.2000112.9S878 I927 L929 G935S878-N931 PolarHBondContact OG-ND2 3.46Å; S878-N931 VanDerWaalsContact OG-ND2 3.12Å; I927-N931 WeakPolarHBondContact CG2-ND2 3.47Å; I927-N931 WeakPolarHBondContact O-CB 3.3Å; I927-N931 PolarHBondContact O-N 2.97Å; I927-N931 PolarHBondContact O-ND2 3.47Å; L929-N931 PolarHBondContact O-N 2.78Å; N931-G935 PolarHBondContact O-N 2.98Å
932F83.9Confident78.6Confident122 Ų12252.9 Ų52.954%0.53531%0.305SS..Hα-helixtrans-61.3-51.7176.5177.2-92.6000111.7G928 L929 E930 G935 E936G928-F932 WeakPolarHBondContact O-CB 3.39Å; G928-F932 PolarHBondContact O-N 3.41Å; L929-F932 PolarHBondContact O-N 2.89Å; E930-F932 PolarHBondContact O-N 3.16Å; F932-G935 PolarHBondContact O-N 3.09Å; F932-E936 WeakPolarHBondContact O-CB 3.46Å; F932-E936 PolarHBondContact O-N 2.68Å
933Y88.1Confident79.9Confident21 Ų2154.4 Ų54.48%0.08231%0.313CS..Hα-helixtrans-74.4-33.7-178-71.5-72.4000112.8L929 E930 G935 E936 V937 K976 L979 R980 S983L929-Y933 HydrophobicContact CD2-CE2 3.84Å; L929-Y933 WeakPolarHBondContact O-CD2 3.4Å; L929-Y933 PolarHBondContact O-N 3.42Å; E930-Y933 PolarHBondContact O-N 3.26Å; Y933-G935 VanDerWaalsContact C-N 3.34Å; Y933-E936 WeakPolarHBondContact CD1-OE2 3.28Å; Y933-E936 PolarHBondContact O-N 3.16Å; Y933-V937 WeakPolarHBondContact O-CB 3.48Å; Y933-V937 WeakPolarHBondContact O-CG2 3.2Å; Y933-V937 PolarHBondContact O-N 3.48Å; Y933-K976 WeakPolarHBondContact OH-CG 3.47Å; Y933-L979 HydrophobicContact CD1-CB 4.18Å; Y933-L979 HydrophobicContact CD2-CB 3.56Å; Y933-L979 HydrophobicContact CD2-CD1 3.66Å; Y933-L979 HydrophobicContact CD2-CG 4.11Å; Y933-L979 HydrophobicContact CE1-CB 4.4Å; Y933-L979 HydrophobicContact CE2-CB 3.87Å; Y933-L979 HydrophobicContact CE2-CD1 3.3Å; Y933-L979 HydrophobicContact CE2-CG 4.17Å; Y933-L979 HydrophobicContact CG-CB 3.76Å; Y933-R980 HydrophobicContact CD1-CG 3.7Å; Y933-R980 HydrophobicContact CE1-CG 4.11Å; Y933-S983 VanDerWaalsContact CB-OG 3.27Å; Y933-S983 WeakPolarHBondContact CB-OG 3.15Å
934L86.8Confident81Confident42 Ų4256.7 Ų56.722%0.2233%0.326CS..Hα-helixtrans-61.3-45.7172-168.673.4000110.5E930 K938 S983 I986 L987 W1021E930-L934 WeakPolarHBondContact O-CB 3.44Å; E930-L934 PolarHBondContact O-N 3.13Å; L934-K938 WeakPolarHBondContact O-CB 3.34Å; L934-K938 PolarHBondContact O-N 3.44Å; L934-S983 PolarHBondContact N-OG 3.31Å; L934-I986 HydrophobicContact CD1-CG2 4.26Å; L934-L987 HydrophobicContact CD1-CD1 4Å; L934-L987 HydrophobicContact CD1-CD2 3.81Å; L934-L987 HydrophobicContact CD1-CG 3.67Å; L934-L987 HydrophobicContact CG-CD2 4.37Å; L934-W1021 HydrophobicContact CB-CH2 4.44Å; L934-W1021 HydrophobicContact CB-CZ2 4.3Å; L934-W1021 HydrophobicContact CD1-CZ2 4.27Å
935G85.6Confident81.3Confident43 Ų4356.2 Ų56.244%0.44333%0.332SS..Hα-helixtrans-63.3-45.717500000113.1N931 F932 Y933 V937 K938 G939N931-G935 PolarHBondContact O-N 2.98Å; F932-G935 PolarHBondContact O-N 3.09Å; Y933-G935 VanDerWaalsContact C-N 3.34Å; G935-V937 PolarHBondContact O-N 2.94Å; G935-K938 PolarHBondContact O-N 3.43Å; G935-G939 PolarHBondContact O-N 2.92Å
936E90Very high81.4Confident59 Ų5959 Ų5928%0.27636%0.358SS..Hα-helixtrans-57.9-49.4177.4-175.8-173.8-147.500111.5F932 Y933 G939 T940 R980F932-E936 WeakPolarHBondContact O-CB 3.46Å; F932-E936 PolarHBondContact O-N 2.68Å; Y933-E936 WeakPolarHBondContact CD1-OE2 3.28Å; Y933-E936 PolarHBondContact O-N 3.16Å; E936-G939 PolarHBondContact O-N 3.43Å; E936-T940 WeakPolarHBondContact O-CB 3.35Å; E936-T940 PolarHBondContact O-N 2.92Å; E936-T940 PolarHBondContact O-OG1 3.24Å; E936-R980 IonicContact OE1-CZ 3.58Å; E936-R980 IonicContact OE1-NE 3.51Å; E936-R980 PolarHBondContact OE1-NE 3.2Å; E936-R980 IonicContact OE1-NH2 3.32Å; E936-R980 PolarHBondContact OE1-NH2 3.13Å; E936-R980 IonicContact OE2-CZ 2.7Å; E936-R980 IonicContact OE2-NE 3.41Å; E936-R980 PolarHBondContact OE2-NE 3.26Å; E936-R980 IonicContact OE2-NH2 3.99Å
937V90Very high81Confident5 Ų560.4 Ų60.43%0.0337%0.365CS..Hα-helixtrans-71-40.3-179176.20000111.3Y933 G935 G939 T940 L941 L954 R980 L984 L987Y933-V937 WeakPolarHBondContact O-CB 3.48Å; Y933-V937 WeakPolarHBondContact O-CG2 3.2Å; Y933-V937 PolarHBondContact O-N 3.48Å; G935-V937 PolarHBondContact O-N 2.94Å; V937-G939 VanDerWaalsContact C-N 3.34Å; V937-G939 PolarHBondContact O-N 3.48Å; V937-T940 PolarHBondContact O-N 3.02Å; V937-L941 HydrophobicContact CG1-CD1 4.14Å; V937-L941 HydrophobicContact CG1-CG 4.35Å; V937-L941 WeakPolarHBondContact O-CB 3.43Å; V937-L941 WeakPolarHBondContact O-CG 3.46Å; V937-L941 PolarHBondContact O-N 3.14Å; V937-L954 HydrophobicContact CG1-CD2 4.13Å; V937-R980 HydrophobicContact CG2-CB 4.26Å; V937-R980 HydrophobicContact CG2-CG 4.38Å; V937-L984 HydrophobicContact CG1-CB 3.92Å; V937-L984 HydrophobicContact CG1-CD1 3.98Å; V937-L987 HydrophobicContact CB-CD1 4.04Å; V937-L987 HydrophobicContact CG1-CD1 3.83Å
938K87Confident81Confident131 Ų13169.9 Ų69.957%0.5741%0.409SS*.Hα-helixtrans-60.3-43.8174.9-172.3175.9-178.4179.10111.4L934 G935 L941 S942 L987L934-K938 WeakPolarHBondContact O-CB 3.34Å; L934-K938 PolarHBondContact O-N 3.44Å; G935-K938 PolarHBondContact O-N 3.43Å; K938-L941 PolarHBondContact O-N 3.44Å; K938-S942 WeakPolarHBondContact O-CB 3.47Å; K938-S942 PolarHBondContact O-N 3.27Å; K938-L987 HydrophobicContact CB-CD1 3.84Å; K938-L987 HydrophobicContact CB-CD2 4.41Å; K938-L987 HydrophobicContact CD-CD2 4.49Å
939G87.2Confident81.4Confident29 Ų2969.9 Ų69.930%0.29940%0.402SS..Hα-helixtrans-60.9-44.7173.400000112.1G935 E936 V937 L941 S942 L943G935-G939 PolarHBondContact O-N 2.92Å; E936-G939 PolarHBondContact O-N 3.43Å; V937-G939 VanDerWaalsContact C-N 3.34Å; V937-G939 PolarHBondContact O-N 3.48Å; G939-L941 PolarHBondContact O-N 3.45Å; G939-S942 PolarHBondContact O-N 3.47Å; G939-S942 PolarHBondContact O-OG 3.07Å; G939-L943 PolarHBondContact O-N 3.12Å
940T88.7Confident81.7Confident50 Ų5066.8 Ų66.831%0.30739%0.388SS..Hα-helixtrans-62.4-43.7176.9-54.10000112.2E936 V937 S942 L943 L944 L954E936-T940 WeakPolarHBondContact O-CB 3.35Å; E936-T940 PolarHBondContact O-N 2.92Å; E936-T940 PolarHBondContact O-OG1 3.24Å; V937-T940 PolarHBondContact O-N 3.02Å; T940-S942 VanDerWaalsContact C-N 3.34Å; T940-L943 PolarHBondContact O-N 3.06Å; T940-L944 HydrophobicContact CG2-CD1 4.02Å; T940-L944 WeakPolarHBondContact O-CB 3.4Å; T940-L944 WeakPolarHBondContact O-CG 3.5Å; T940-L944 PolarHBondContact O-N 3.01Å; T940-L954 HydrophobicContact CG2-CD1 3.91Å; T940-L954 HydrophobicContact CG2-CD2 4.22Å
941L86.8Confident81.9Confident36 Ų3667.2 Ų67.219%0.18840%0.395CS..Hα-helixtrans-62.8-40.4174.7-75.3171.9000111.6V937 K938 G939 L943 L944 S945 A951 L954 L984 L987V937-L941 HydrophobicContact CG1-CD1 4.14Å; V937-L941 HydrophobicContact CG1-CG 4.35Å; V937-L941 WeakPolarHBondContact O-CB 3.43Å; V937-L941 WeakPolarHBondContact O-CG 3.46Å; V937-L941 PolarHBondContact O-N 3.14Å; K938-L941 PolarHBondContact O-N 3.44Å; G939-L941 PolarHBondContact O-N 3.45Å; L941-L943 VanDerWaalsContact C-N 3.34Å; L941-L943 PolarHBondContact O-N 3.45Å; L941-L944 CarbonylContact O-C 3.36Å; L941-L944 PolarHBondContact O-N 2.9Å; L941-S945 PolarHBondContact O-N 3Å; L941-A951 HydrophobicContact CD2-CB 4.45Å; L941-L954 HydrophobicContact CD2-CD2 4.02Å; L941-L954 HydrophobicContact CG-CD2 4.22Å; L941-L984 HydrophobicContact CD1-CD1 3.95Å; L941-L984 HydrophobicContact CD2-CD1 4.03Å; L941-L984 HydrophobicContact CG-CD1 4.29Å; L941-L987 HydrophobicContact CD1-CB 4.07Å; L941-L987 HydrophobicContact CD1-CD1 4.16Å
942S85.4Confident82.2Confident74 Ų7471.5 Ų71.552%0.51741%0.414SS..Hα-helixtrans-63.8-38.4176.875.50000112.4K938 G939 T940 S945K938-S942 WeakPolarHBondContact O-CB 3.47Å; K938-S942 PolarHBondContact O-N 3.27Å; G939-S942 PolarHBondContact O-N 3.47Å; G939-S942 PolarHBondContact O-OG 3.07Å; T940-S942 VanDerWaalsContact C-N 3.34Å; S942-S945 WeakPolarHBondContact O-CB 3.34Å; S942-S945 PolarHBondContact O-N 3.11Å; S942-S945 PolarHBondContact O-OG 3.35Å
943L85.6Confident82.3Confident150 Ų15070.3 Ų70.379%0.78541%0.412SS*.Hα-helixtrans-68.2-33.7174.7-76.2161.3000112.5G939 T940 L941G939-L943 PolarHBondContact O-N 3.12Å; T940-L943 PolarHBondContact O-N 3.06Å; L941-L943 VanDerWaalsContact C-N 3.34Å; L941-L943 PolarHBondContact O-N 3.45Å
944L83.3Confident82.4Confident64 Ų6470 Ų7034%0.33541%0.412SS..Hα-helixtrans-86.6-7.3179.1-69.1172.5000113.8T940 L941 A946 S947 A950 L954T940-L944 HydrophobicContact CG2-CD1 4.02Å; T940-L944 WeakPolarHBondContact O-CB 3.4Å; T940-L944 WeakPolarHBondContact O-CG 3.5Å; T940-L944 PolarHBondContact O-N 3.01Å; L941-L944 CarbonylContact O-C 3.36Å; L941-L944 PolarHBondContact O-N 2.9Å; L944-A946 PolarHBondContact O-N 2.91Å; L944-S947 PolarHBondContact O-N 3.34Å; L944-A950 HydrophobicContact CB-CB 3.68Å; L944-L954 HydrophobicContact CD1-CD1 4.33Å
945S69.2Low82.6Confident91 Ų9168.4 Ų68.464%0.63640%0.404SS*.THydrogen-bonded Turntrans-56.3-14.5-172.162.20000115.2L941 S942 S947L941-S945 PolarHBondContact O-N 3Å; S942-S945 WeakPolarHBondContact O-CB 3.34Å; S942-S945 PolarHBondContact O-N 3.11Å; S942-S945 PolarHBondContact O-OG 3.35Å; S945-S947 PolarHBondContact O-N 2.8Å
946A66.9Low82.8Confident106 Ų10670.2 Ų70.288%0.87640%0.403SS*.THydrogen-bonded Turntrans-65.1-15.8169.400000114.2L944L944-A946 PolarHBondContact O-N 2.91Å
947S61.5Low82.8Confident45 Ų4575.1 Ų75.132%0.31542%0.42SS..SBendtrans-107.7120.4177.9-167.90000110.2L944 S945 S949 A950L944-S947 PolarHBondContact O-N 3.34Å; S945-S947 PolarHBondContact O-N 2.8Å; S947-S949 PolarHBondContact O-N 3.17Å; S947-S949 PolarHBondContact OG-OG 3.23Å; S947-A950 VanDerWaalsContact O-CB 3.31Å; S947-A950 WeakPolarHBondContact O-CB 3.38Å; S947-A950 PolarHBondContact O-N 2.96Å
948E69.2Low83Confident213 Ų21375.4 Ų75.4100%0.99542%0.421SS*.THydrogen-bonded Turntrans-55-24.5175-70.2-175.4160.100112.5
949S78.4Confident83.2Confident41 Ų4170.2 Ų70.229%0.28740%0.4SS..THydrogen-bonded Turntrans-9715.5178.461.30000115.2S947 A951 E952 L953S947-S949 PolarHBondContact O-N 3.17Å; S947-S949 PolarHBondContact OG-OG 3.23Å; S949-A951 VanDerWaalsContact C-N 3.29Å; S949-A951 PolarHBondContact O-N 2.69Å; S949-E952 PolarHBondContact O-N 3.21Å; S949-L953 PolarHBondContact O-N 3.18Å
950A82.8Confident83.5Confident11 Ų1176 Ų769%0.09141%0.413CS..Hα-helixtrans-52-43.5-174.300000113.9L944 S947 L954L944-A950 HydrophobicContact CB-CB 3.68Å; S947-A950 VanDerWaalsContact O-CB 3.31Å; S947-A950 WeakPolarHBondContact O-CB 3.38Å; S947-A950 PolarHBondContact O-N 2.96Å; A950-L954 WeakPolarHBondContact O-CB 3.32Å; A950-L954 PolarHBondContact O-N 3.35Å; A950-L954 VanDerWaalsContact O-N 3.08Å
951A84.4Confident83.7Confident31 Ų3176.5 Ų76.526%0.25641%0.413SS..Hα-helixtrans-67.8-35.8179.900000112.7L941 S949 T955 T988L941-A951 HydrophobicContact CD2-CB 4.45Å; S949-A951 VanDerWaalsContact C-N 3.29Å; S949-A951 PolarHBondContact O-N 2.69Å; A951-T955 WeakPolarHBondContact O-CB 3.49Å; A951-T955 PolarHBondContact O-N 2.97Å; A951-T955 PolarHBondContact O-OG1 3.49Å; A951-T988 HydrophobicContact CB-CG2 4.31Å
952E85.9Confident84Confident138 Ų13874.8 Ų74.865%0.64540%0.404SS*.Hα-helixtrans-70.3-47.8178.3-64.2-179.2165.800111S949 L954 T955 D956S949-E952 PolarHBondContact O-N 3.21Å; E952-L954 VanDerWaalsContact C-N 3.27Å; E952-L954 PolarHBondContact O-N 2.81Å; E952-T955 WeakPolarHBondContact O-CB 3.39Å; E952-T955 PolarHBondContact O-N 2.94Å; E952-T955 VanDerWaalsContact O-N 3.11Å; E952-D956 PolarHBondContact O-N 3.42Å
953L86.3Confident84.4Confident97 Ų9774 Ų7451%0.50840%0.395SS..Hα-helixtrans-58.5-41.3176.2-70.9173.2000111.9S949 R957S949-L953 PolarHBondContact O-N 3.18Å; L953-R957 WeakPolarHBondContact O-CB 3.46Å; L953-R957 PolarHBondContact O-N 3.02Å; L953-R957 VanDerWaalsContact O-N 3.11Å
954L89.4Confident84.8Confident14 Ų1471 Ų717%0.07338%0.38CS..Hα-helixtrans-70-38177.6-164.965.8000111.5V937 T940 L941 L944 A950 E952 R957 L958 L984V937-L954 HydrophobicContact CG1-CD2 4.13Å; T940-L954 HydrophobicContact CG2-CD1 3.91Å; T940-L954 HydrophobicContact CG2-CD2 4.22Å; L941-L954 HydrophobicContact CD2-CD2 4.02Å; L941-L954 HydrophobicContact CG-CD2 4.22Å; L944-L954 HydrophobicContact CD1-CD1 4.33Å; A950-L954 WeakPolarHBondContact O-CB 3.32Å; A950-L954 PolarHBondContact O-N 3.35Å; A950-L954 VanDerWaalsContact O-N 3.08Å; E952-L954 VanDerWaalsContact C-N 3.27Å; E952-L954 PolarHBondContact O-N 2.81Å; L954-R957 PolarHBondContact O-N 3.38Å; L954-L958 HydrophobicContact CG-CD1 4.15Å; L954-L958 HydrophobicContact CG-CG 4.34Å; L954-L958 WeakPolarHBondContact O-CB 3.37Å; L954-L958 VanDerWaalsContact O-CG 3.32Å; L954-L958 WeakPolarHBondContact O-CG 3.44Å; L954-L958 PolarHBondContact O-N 3.34Å; L954-L984 HydrophobicContact CB-CD2 4.08Å; L954-L984 HydrophobicContact CD2-CD1 3.89Å; L954-L984 HydrophobicContact CD2-CD2 4.09Å; L954-L984 HydrophobicContact CG-CD2 3.98Å
955T90.3Very high85.2Confident9 Ų968.2 Ų68.26%0.05537%0.365CS..Hα-helixtrans-57.7-49.2173.9-65.90000111.1A951 E952 R957 L958 T959 I994 L995A951-T955 WeakPolarHBondContact O-CB 3.49Å; A951-T955 PolarHBondContact O-N 2.97Å; A951-T955 PolarHBondContact O-OG1 3.49Å; E952-T955 WeakPolarHBondContact O-CB 3.39Å; E952-T955 PolarHBondContact O-N 2.94Å; E952-T955 VanDerWaalsContact O-N 3.11Å; T955-R957 VanDerWaalsContact C-N 3.34Å; T955-R957 PolarHBondContact O-N 2.66Å; T955-L958 PolarHBondContact O-N 3.33Å; T955-T959 VanDerWaalsContact O-CB 3.31Å; T955-T959 WeakPolarHBondContact O-CB 3.47Å; T955-T959 PolarHBondContact O-N 3.12Å; T955-T959 PolarHBondContact O-OG1 3.26Å; T955-I994 HydrophobicContact CG2-CG2 4.38Å; T955-L995 HydrophobicContact CG2-CD1 4.3Å; T955-L995 HydrophobicContact CG2-CD2 3.79Å; T955-L995 HydrophobicContact CG2-CG 3.72Å
956D89.8Confident86.2Confident80 Ų8064.9 Ų64.943%0.42834%0.342SS..Hα-helixtrans-64-39.5179.8-77.1-12.8000112.5E952 R960E952-D956 PolarHBondContact O-N 3.42Å; D956-R960 WeakPolarHBondContact O-CB 3.28Å; D956-R960 WeakPolarHBondContact O-CG 3.37Å; D956-R960 PolarHBondContact O-N 2.93Å; D956-R960 VanDerWaalsContact O-N 3.08Å; D956-R960 PolarHBondContact O-NE 3.13Å
957R91.5Very high87.3Confident163 Ų16364.1 Ų64.162%0.61534%0.335SS*.Hα-helixtrans-68.5-47.2179.2-173177.7-176.91790.3111.8L953 L954 T955 T959 R960 N961L953-R957 WeakPolarHBondContact O-CB 3.46Å; L953-R957 PolarHBondContact O-N 3.02Å; L953-R957 VanDerWaalsContact O-N 3.11Å; L954-R957 PolarHBondContact O-N 3.38Å; T955-R957 VanDerWaalsContact C-N 3.34Å; T955-R957 PolarHBondContact O-N 2.66Å; R957-T959 VanDerWaalsContact C-N 3.35Å; R957-R960 PolarHBondContact O-N 3.07Å; R957-N961 VanDerWaalsContact O-CG 3.25Å; R957-N961 PolarHBondContact O-N 3.39Å; R957-N961 PolarHBondContact O-OD1 3.16Å
958L92.5Very high88.7Confident11 Ų1168.7 Ų68.76%0.05835%0.352CS..Hα-helixtrans-66.3-38.7179.8-69.2-179.9000111.7L954 T955 N961 F962 R980 M981 L984L954-L958 HydrophobicContact CG-CD1 4.15Å; L954-L958 HydrophobicContact CG-CG 4.34Å; L954-L958 WeakPolarHBondContact O-CB 3.37Å; L954-L958 VanDerWaalsContact O-CG 3.32Å; L954-L958 WeakPolarHBondContact O-CG 3.44Å; L954-L958 PolarHBondContact O-N 3.34Å; T955-L958 PolarHBondContact O-N 3.33Å; L958-N961 PolarHBondContact O-N 3Å; L958-F962 WeakPolarHBondContact O-CB 3.45Å; L958-F962 PolarHBondContact O-N 2.89Å; L958-R980 HydrophobicContact CD1-CB 4Å; L958-R980 HydrophobicContact CD2-CB 3.89Å; L958-M981 HydrophobicContact CB-CG 3.75Å; L958-M981 HydrophobicContact CD1-CG 4.41Å; L958-L984 HydrophobicContact CD1-CB 4.25Å; L958-L984 HydrophobicContact CD1-CD2 3.83Å
959T92.8Very high89.5Confident21 Ų2163.6 Ų63.613%0.12933%0.332CS..Hα-helixtrans-64.2-41.4176-550000111.4T955 R957 F962 N963 T998T955-T959 VanDerWaalsContact O-CB 3.31Å; T955-T959 WeakPolarHBondContact O-CB 3.47Å; T955-T959 PolarHBondContact O-N 3.12Å; T955-T959 PolarHBondContact O-OG1 3.26Å; R957-T959 VanDerWaalsContact C-N 3.35Å; T959-F962 PolarHBondContact O-N 3.39Å; T959-N963 PolarHBondContact O-N 3.38Å; T959-N963 PolarHBondContact O-ND2 3.39Å; T959-N963 VanDerWaalsContact O-ND2 3.15Å; T959-T998 HydrophobicContact CG2-CG2 4.33Å
960R93.1Very high90.1Very high152 Ų15263.8 Ų63.857%0.57433%0.329SS*.Hα-helixtrans-61.3-51.9173-85.7-179.1-92.1170.1-12.4112.2D956 R957 F962 N963 D964D956-R960 WeakPolarHBondContact O-CB 3.28Å; D956-R960 WeakPolarHBondContact O-CG 3.37Å; D956-R960 PolarHBondContact O-N 2.93Å; D956-R960 VanDerWaalsContact O-N 3.08Å; D956-R960 PolarHBondContact O-NE 3.13Å; R957-R960 PolarHBondContact O-N 3.07Å; R960-F962 PolarHBondContact O-N 2.79Å; R960-N963 WeakPolarHBondContact O-CB 3.48Å; R960-N963 PolarHBondContact O-N 3.43Å; R960-D964 VanDerWaalsContact O-CG 3.31Å; R960-D964 PolarHBondContact O-N 3.49Å
961N92.8Very high90.4Very high59 Ų5965.6 Ų65.632%0.31634%0.337SS..Hα-helixtrans-56.3-40.3177.9-68.8-4.7000112.3R957 L958 D964 A965R957-N961 VanDerWaalsContact O-CG 3.25Å; R957-N961 PolarHBondContact O-N 3.39Å; R957-N961 PolarHBondContact O-OD1 3.16Å; L958-N961 PolarHBondContact O-N 3Å; N961-D964 PolarHBondContact O-N 2.86Å; N961-A965 WeakPolarHBondContact O-CB 3.5Å; N961-A965 PolarHBondContact O-N 3.08Å
962F93.4Very high90.6Very high0 Ų068 Ų680%035%0.35CS..Hα-helixtrans-64.2-43.3176.1177.5-102.7000112L958 T959 R960 A965 C966 L974 L978 M981 T998 A1002 K1005L958-F962 WeakPolarHBondContact O-CB 3.45Å; L958-F962 PolarHBondContact O-N 2.89Å; T959-F962 PolarHBondContact O-N 3.39Å; R960-F962 PolarHBondContact O-N 2.79Å; F962-A965 PolarHBondContact O-N 3.24Å; F962-C966 PolarHBondContact O-N 2.99Å; F962-C966 PolarHBondContact O-SG 3.44Å; F962-L974 HydrophobicContact CD2-CD2 4.45Å; F962-L974 HydrophobicContact CD2-CG 4.09Å; F962-L974 HydrophobicContact CE2-CD1 4.33Å; F962-L974 HydrophobicContact CE2-CD2 3.65Å; F962-L974 HydrophobicContact CE2-CG 3.61Å; F962-L974 HydrophobicContact CZ-CD2 4.45Å; F962-L974 HydrophobicContact CZ-CG 4.42Å; F962-L978 HydrophobicContact CE2-CB 4.45Å; F962-L978 HydrophobicContact CE2-CD1 4.3Å; F962-M981 HydrophobicContact CB-CE 3.71Å; F962-M981 HydrophobicContact CB-SD 4.05Å; F962-M981 HydrophobicContact CD1-CE 3.97Å; F962-M981 HydrophobicContact CD2-CE 3.5Å; F962-M981 VanDerWaalsContact CD2-CE 3.5Å; F962-M981 HydrophobicContact CE1-CE 4.49Å; F962-M981 HydrophobicContact CE2-CE 4.07Å; F962-M981 HydrophobicContact CG-CE 3.44Å; F962-M981 VanDerWaalsContact CG-CE 3.44Å; F962-M981 HydrophobicContact CG-SD 4.3Å; F962-T998 HydrophobicContact CD1-CG2 3.72Å; F962-T998 HydrophobicContact CE1-CG2 3.94Å; F962-A1002 HydrophobicContact CE1-CB 4.35Å; F962-A1002 HydrophobicContact CE2-CB 4.25Å; F962-A1002 HydrophobicContact CZ-CB 3.53Å; F962-K1005 HydrophobicContact CE1-CD 4Å
963N93.5Very high90.8Very high59 Ų5964.8 Ų64.832%0.31634%0.337SS..Hα-helixtrans-64.7-41.8176.7-68.1-28.8000112.2T959 R960 C966 A967 K1005T959-N963 PolarHBondContact O-N 3.38Å; T959-N963 PolarHBondContact O-ND2 3.39Å; T959-N963 VanDerWaalsContact O-ND2 3.15Å; R960-N963 WeakPolarHBondContact O-CB 3.48Å; R960-N963 PolarHBondContact O-N 3.43Å; N963-C966 WeakPolarHBondContact O-CB 3.26Å; N963-C966 PolarHBondContact O-N 2.93Å; N963-A967 PolarHBondContact O-N 3.13Å; N963-K1005 PolarHBondContact OD1-NZ 3.3Å
964D93.4Very high90.9Very high87 Ų8760.2 Ų60.247%0.46531%0.313SS..Hα-helixtrans-64.5-42.1177.5-63.8-23.4000110.8R960 N961 C966 A967 Q968R960-D964 VanDerWaalsContact O-CG 3.31Å; R960-D964 PolarHBondContact O-N 3.49Å; N961-D964 PolarHBondContact O-N 2.86Å; D964-C966 PolarHBondContact O-N 2.94Å; D964-A967 PolarHBondContact O-N 2.68Å; D964-Q968 WeakPolarHBondContact O-CB 3.48Å; D964-Q968 VanDerWaalsContact O-CG 3.3Å; D964-Q968 WeakPolarHBondContact O-CG 3.26Å; D964-Q968 PolarHBondContact O-N 3.41Å
965A91.8Very high90.9Very high4 Ų462.7 Ų62.73%0.03332%0.323CS..Hα-helixtrans-64.3-37.5174.400000112.5N961 F962 Q968 N969 D970 N973 L974N961-A965 WeakPolarHBondContact O-CB 3.5Å; N961-A965 PolarHBondContact O-N 3.08Å; F962-A965 PolarHBondContact O-N 3.24Å; A965-Q968 PolarHBondContact O-N 3.4Å; A965-N969 PolarHBondContact O-N 3.14Å; A965-D970 PolarHBondContact O-N 3.46Å; A965-N973 HydrophobicContact CB-CB 4.21Å; A965-L974 HydrophobicContact CB-CB 4.2Å
966C89.9Confident90.9Very high21 Ų2166.7 Ų66.714%0.14234%0.34CS..Hα-helixtrans-62.9-45.2172.3-67.90000111.3F962 N963 D964 Q968 N969 L974 K1005 V1006F962-C966 PolarHBondContact O-N 2.99Å; F962-C966 PolarHBondContact O-SG 3.44Å; N963-C966 WeakPolarHBondContact O-CB 3.26Å; N963-C966 PolarHBondContact O-N 2.93Å; D964-C966 PolarHBondContact O-N 2.94Å; C966-Q968 VanDerWaalsContact C-N 3.28Å; C966-Q968 PolarHBondContact O-N 3.08Å; C966-N969 PolarHBondContact O-N 3.08Å; C966-N969 VanDerWaalsContact O-N 3.13Å; C966-L974 VanDerWaalsContact SG-CD1 3.59Å; C966-K1005 HydrophobicContact CB-CB 4.43Å; C966-V1006 HydrophobicContact CB-CG2 4.18Å
967A90Very high91Very high90 Ų9063.2 Ų63.274%0.74432%0.322SS*.Hα-helixtrans-64.3-32.8179.400000112.6N963 D964 N969N963-A967 PolarHBondContact O-N 3.13Å; D964-A967 PolarHBondContact O-N 2.68Å; A967-N969 VanDerWaalsContact C-N 3.34Å
968Q90.7Very high91Very high141 Ų14155.4 Ų55.466%0.65929%0.293SS*.THydrogen-bonded Turntrans-85.1-5.9176.5-66170.723.800113.4D964 A965 C966 D970D964-Q968 WeakPolarHBondContact O-CB 3.48Å; D964-Q968 VanDerWaalsContact O-CG 3.3Å; D964-Q968 WeakPolarHBondContact O-CG 3.26Å; D964-Q968 PolarHBondContact O-N 3.41Å; A965-Q968 PolarHBondContact O-N 3.4Å; C966-Q968 VanDerWaalsContact C-N 3.28Å; C966-Q968 PolarHBondContact O-N 3.08Å; Q968-D970 HydrophobicContact CB-CB 4.31Å; Q968-D970 PolarHBondContact O-N 2.99Å
969N87.1Confident90.9Very high107 Ų10755.5 Ų55.557%0.57229%0.293SS*.THydrogen-bonded Turntrans5134.1-170.6-157.227.8000113.2A965 C966 A967 I971A965-N969 PolarHBondContact O-N 3.14Å; C966-N969 PolarHBondContact O-N 3.08Å; C966-N969 VanDerWaalsContact O-N 3.13Å; A967-N969 VanDerWaalsContact C-N 3.34Å; N969-I971 PolarHBondContact O-N 2.82Å
970D90.8Very high91Very high44 Ų4457.9 Ų57.924%0.23530%0.3CS..  trans-84.888.9-179.3-176.4-20000109.9A965 Q968 P972 N973 L974A965-D970 PolarHBondContact O-N 3.46Å; Q968-D970 HydrophobicContact CB-CB 4.31Å; Q968-D970 PolarHBondContact O-N 2.99Å; D970-P972 WeakPolarHBondContact OD1-CD 3.35Å; D970-N973 HydrophobicContact CB-CB 4.34Å; D970-N973 PolarHBondContact O-N 3.35Å; D970-N973 PolarHBondContact OD1-N 3.38Å; D970-N973 VanDerWaalsContact OD1-N 3.07Å; D970-N973 PolarHBondContact OD2-ND2 3.29Å; D970-L974 VanDerWaalsContact O-CB 3.29Å; D970-L974 WeakPolarHBondContact O-CB 3.24Å; D970-L974 PolarHBondContact O-N 3.22Å
971I88.5Confident91Very high50 Ų5050.6 Ų50.626%0.25627%0.272SS..Hα-helixtrans-55-49-177.3-63.7169.2000111.8N969 N973 L974 K975 I1011N969-I971 PolarHBondContact O-N 2.82Å; I971-N973 PolarHBondContact O-N 3.43Å; I971-L974 PolarHBondContact O-N 2.9Å; I971-K975 HydrophobicContact CG2-CD 4.31Å; I971-K975 HydrophobicContact CG2-CG 4.45Å; I971-K975 WeakPolarHBondContact O-CG 3.4Å; I971-K975 PolarHBondContact O-N 3.31Å; I971-I1011 HydrophobicContact CG2-CD1 4.06Å
972P88.8Confident91Very high81 Ų8147.8 Ų47.853%0.52626%0.257SS..Hα-helixtrans-55.4-48.4176.4-27.533.3000114.6D970 K975 K976D970-P972 WeakPolarHBondContact OD1-CD 3.35Å; P972-K975 PolarHBondContact O-N 3.32Å; P972-K976 WeakPolarHBondContact O-CG 3.48Å; P972-K976 PolarHBondContact O-N 3.31Å; P972-K976 VanDerWaalsContact O-N 3.16Å
973N89.3Confident90.9Very high71 Ų7147.8 Ų47.838%0.3826%0.257SS..Hα-helixtrans-73.2-29.2-178.7-80.1-34.3000112.8A965 D970 I971 S977A965-N973 HydrophobicContact CB-CB 4.21Å; D970-N973 HydrophobicContact CB-CB 4.34Å; D970-N973 PolarHBondContact O-N 3.35Å; D970-N973 PolarHBondContact OD1-N 3.38Å; D970-N973 VanDerWaalsContact OD1-N 3.07Å; D970-N973 PolarHBondContact OD2-ND2 3.29Å; I971-N973 PolarHBondContact O-N 3.43Å; N973-S977 WeakPolarHBondContact O-CB 3.37Å; N973-S977 PolarHBondContact O-N 2.85Å; N973-S977 PolarHBondContact O-OG 3.22Å
974L88.5Confident90.9Very high1 Ų145 Ų451%0.00524%0.242CC..Hα-helixtrans-63.8-47.3171.8-169.6160.8000110.6F962 A965 C966 D970 I971 K976 S977 L978 V1006 I1011F962-L974 HydrophobicContact CD2-CD2 4.45Å; F962-L974 HydrophobicContact CD2-CG 4.09Å; F962-L974 HydrophobicContact CE2-CD1 4.33Å; F962-L974 HydrophobicContact CE2-CD2 3.65Å; F962-L974 HydrophobicContact CE2-CG 3.61Å; F962-L974 HydrophobicContact CZ-CD2 4.45Å; F962-L974 HydrophobicContact CZ-CG 4.42Å; A965-L974 HydrophobicContact CB-CB 4.2Å; C966-L974 VanDerWaalsContact SG-CD1 3.59Å; D970-L974 VanDerWaalsContact O-CB 3.29Å; D970-L974 WeakPolarHBondContact O-CB 3.24Å; D970-L974 PolarHBondContact O-N 3.22Å; I971-L974 PolarHBondContact O-N 2.9Å; L974-K976 PolarHBondContact O-N 2.71Å; L974-S977 PolarHBondContact O-N 3.29Å; L974-L978 WeakPolarHBondContact O-CB 3.41Å; L974-L978 PolarHBondContact O-N 3.39Å; L974-V1006 HydrophobicContact CD1-CB 3.99Å; L974-V1006 HydrophobicContact CD1-CG1 4.44Å; L974-V1006 HydrophobicContact CD1-CG2 3.54Å; L974-I1011 HydrophobicContact CD2-CD1 3.61Å; L974-I1011 HydrophobicContact CD2-CG1 4.1Å; L974-I1011 HydrophobicContact CD2-CG2 3.91Å
975K89.7Confident90.8Very high65 Ų6540.9 Ų40.928%0.28322%0.22SC..Hα-helixtrans-57.2-47.9176.3-69.8-176.2-179.6178.80111.6I971 P972 S977 L978 L979 D1010 I1011 L1014I971-K975 HydrophobicContact CG2-CD 4.31Å; I971-K975 HydrophobicContact CG2-CG 4.45Å; I971-K975 WeakPolarHBondContact O-CG 3.4Å; I971-K975 PolarHBondContact O-N 3.31Å; P972-K975 PolarHBondContact O-N 3.32Å; K975-S977 PolarHBondContact O-N 2.91Å; K975-L978 PolarHBondContact O-N 3.13Å; K975-L979 WeakPolarHBondContact O-CG 3.47Å; K975-L979 PolarHBondContact O-N 3.32Å; K975-L979 VanDerWaalsContact O-N 3.14Å; K975-D1010 IonicContact NZ-OD2 3.34Å; K975-D1010 PolarHBondContact NZ-OD2 3.18Å; K975-I1011 HydrophobicContact CG-CD1 3.74Å; K975-L1014 HydrophobicContact CB-CD2 3.62Å; K975-L1014 HydrophobicContact CD-CD2 4.45Å; K975-L1014 HydrophobicContact CG-CD2 3.62Å
976K90.7Very high90.7Very high93 Ų9342.1 Ų42.140%0.40423%0.226SC..Hα-helixtrans-60-46.1176.6-67.8-179.8178.3175.40112.3Y933 P972 L974 L979 R980Y933-K976 WeakPolarHBondContact OH-CG 3.47Å; P972-K976 WeakPolarHBondContact O-CG 3.48Å; P972-K976 PolarHBondContact O-N 3.31Å; P972-K976 VanDerWaalsContact O-N 3.16Å; L974-K976 PolarHBondContact O-N 2.71Å; K976-L979 PolarHBondContact O-N 3.05Å; K976-R980 WeakPolarHBondContact O-CG 3.24Å; K976-R980 PolarHBondContact O-N 3.37Å
977S91.7Very high90.6Very high7 Ų743.7 Ų43.75%0.04923%0.232CC..Hα-helixtrans-66.1-38.9-178.3-59.40000111.8N973 L974 K975 R980 M981N973-S977 WeakPolarHBondContact O-CB 3.37Å; N973-S977 PolarHBondContact O-N 2.85Å; N973-S977 PolarHBondContact O-OG 3.22Å; L974-S977 PolarHBondContact O-N 3.29Å; K975-S977 PolarHBondContact O-N 2.91Å; S977-R980 PolarHBondContact O-N 3.07Å; S977-M981 WeakPolarHBondContact O-CG 3.19Å; S977-M981 PolarHBondContact O-N 3.12Å
978L91.7Very high90.4Very high0 Ų040.5 Ų40.50%020%0.204CC..Hα-helixtrans-63.3-45.6176.3-170.866.7000112F962 L974 K975 R980 M981 C982 I999 A1002 L1014 C1015F962-L978 HydrophobicContact CE2-CB 4.45Å; F962-L978 HydrophobicContact CE2-CD1 4.3Å; L974-L978 WeakPolarHBondContact O-CB 3.41Å; L974-L978 PolarHBondContact O-N 3.39Å; K975-L978 PolarHBondContact O-N 3.13Å; L978-R980 PolarHBondContact O-N 2.92Å; L978-M981 HydrophobicContact CD1-CE 3.95Å; L978-M981 PolarHBondContact O-N 3.07Å; L978-C982 WeakPolarHBondContact O-CB 3.26Å; L978-C982 PolarHBondContact O-N 3.31Å; L978-I999 HydrophobicContact CD1-CB 4.42Å; L978-I999 HydrophobicContact CD1-CG1 4.17Å; L978-I999 HydrophobicContact CD1-CG2 4.3Å; L978-A1002 HydrophobicContact CD1-CB 4.01Å; L978-L1014 HydrophobicContact CB-CD2 4.44Å; L978-L1014 HydrophobicContact CD2-CD2 3.91Å; L978-L1014 HydrophobicContact CD2-CG 3.95Å; L978-C1015 VanDerWaalsContact CD2-SG 3.58Å
979L91.7Very high90Very high13 Ų1339.7 Ų39.77%0.06821%0.211CC..Hα-helixtrans-63.9-39.2177.3-73.5167.9000112.4L929 Y933 K975 K976 C982 S983 L1014L929-L979 HydrophobicContact CD2-CD1 4.49Å; Y933-L979 HydrophobicContact CD1-CB 4.18Å; Y933-L979 HydrophobicContact CD2-CB 3.56Å; Y933-L979 HydrophobicContact CD2-CD1 3.66Å; Y933-L979 HydrophobicContact CD2-CG 4.11Å; Y933-L979 HydrophobicContact CE1-CB 4.4Å; Y933-L979 HydrophobicContact CE2-CB 3.87Å; Y933-L979 HydrophobicContact CE2-CD1 3.3Å; Y933-L979 HydrophobicContact CE2-CG 4.17Å; Y933-L979 HydrophobicContact CG-CB 3.76Å; K975-L979 WeakPolarHBondContact O-CG 3.47Å; K975-L979 PolarHBondContact O-N 3.32Å; K975-L979 VanDerWaalsContact O-N 3.14Å; K976-L979 PolarHBondContact O-N 3.05Å; L979-C982 PolarHBondContact O-N 3Å; L979-S983 WeakPolarHBondContact O-CB 3.05Å; L979-S983 PolarHBondContact O-N 3.45Å; L979-S983 PolarHBondContact O-OG 2.77Å; L979-L1014 HydrophobicContact CD1-CD1 4.25Å; L979-L1014 HydrophobicContact CD2-CD1 3.93Å; L979-L1014 HydrophobicContact CG-CD1 4.11Å
980R93.8Very high89.8Confident70 Ų7037 Ų3726%0.26421%0.209SC..Hα-helixtrans-64.4-43.5173.5-72.3170.9172.9168.9-4.9112.4Y933 E936 V937 L958 K976 S977 L978 S983 L984Y933-R980 HydrophobicContact CD1-CG 3.7Å; Y933-R980 HydrophobicContact CE1-CG 4.11Å; E936-R980 IonicContact OE1-CZ 3.58Å; E936-R980 IonicContact OE1-NE 3.51Å; E936-R980 PolarHBondContact OE1-NE 3.2Å; E936-R980 IonicContact OE1-NH2 3.32Å; E936-R980 PolarHBondContact OE1-NH2 3.13Å; E936-R980 IonicContact OE2-CZ 2.7Å; E936-R980 IonicContact OE2-NE 3.41Å; E936-R980 PolarHBondContact OE2-NE 3.26Å; E936-R980 IonicContact OE2-NH2 3.99Å; V937-R980 HydrophobicContact CG2-CB 4.26Å; V937-R980 HydrophobicContact CG2-CG 4.38Å; L958-R980 HydrophobicContact CD1-CB 4Å; L958-R980 HydrophobicContact CD2-CB 3.89Å; K976-R980 WeakPolarHBondContact O-CG 3.24Å; K976-R980 PolarHBondContact O-N 3.37Å; S977-R980 PolarHBondContact O-N 3.07Å; L978-R980 PolarHBondContact O-N 2.92Å; R980-S983 PolarHBondContact O-N 2.91Å; R980-L984 WeakPolarHBondContact O-CB 3.46Å; R980-L984 PolarHBondContact O-N 2.85Å
981M93.4Very high89.5Confident0 Ų037.9 Ų37.90%022%0.215CC..Hα-helixtrans-63-42.4175.7-73.9-173.3-59.300111.7L958 F962 S977 L978 L984 F985 L995 T998 I999L958-M981 HydrophobicContact CB-CG 3.75Å; L958-M981 HydrophobicContact CD1-CG 4.41Å; F962-M981 HydrophobicContact CB-CE 3.71Å; F962-M981 HydrophobicContact CB-SD 4.05Å; F962-M981 HydrophobicContact CD1-CE 3.97Å; F962-M981 HydrophobicContact CD2-CE 3.5Å; F962-M981 VanDerWaalsContact CD2-CE 3.5Å; F962-M981 HydrophobicContact CE1-CE 4.49Å; F962-M981 HydrophobicContact CE2-CE 4.07Å; F962-M981 HydrophobicContact CG-CE 3.44Å; F962-M981 VanDerWaalsContact CG-CE 3.44Å; F962-M981 HydrophobicContact CG-SD 4.3Å; S977-M981 WeakPolarHBondContact O-CG 3.19Å; S977-M981 PolarHBondContact O-N 3.12Å; L978-M981 HydrophobicContact CD1-CE 3.95Å; L978-M981 PolarHBondContact O-N 3.07Å; M981-L984 PolarHBondContact O-N 3.15Å; M981-F985 WeakPolarHBondContact O-CB 3.14Å; M981-F985 PolarHBondContact O-N 3.09Å; M981-L995 HydrophobicContact CB-CD2 4.12Å; M981-L995 HydrophobicContact CG-CD2 4.02Å; M981-L995 HydrophobicContact SD-CD2 4.42Å; M981-T998 HydrophobicContact CE-CG2 4.03Å; M981-T998 HydrophobicContact SD-CG2 3.84Å; M981-I999 HydrophobicContact CB-CD1 4.31Å; M981-I999 HydrophobicContact CB-CG1 4.28Å
982C93Very high89.5Confident0 Ų037 Ų370%021%0.213CC..Hα-helixtrans-61.3-46.6175.7-168.30000111.4L978 L979 L984 F985 I986 I999 C1018 W1021L978-C982 WeakPolarHBondContact O-CB 3.26Å; L978-C982 PolarHBondContact O-N 3.31Å; L979-C982 PolarHBondContact O-N 3Å; C982-L984 PolarHBondContact O-N 2.91Å; C982-F985 WeakPolarHBondContact O-CB 3.35Å; C982-F985 PolarHBondContact O-N 3.34Å; C982-I986 WeakPolarHBondContact O-CG1 3.31Å; C982-I986 PolarHBondContact O-N 3.15Å; C982-I999 HydrophobicContact CB-CD1 4.37Å; C982-C1018 HydrophobicContact CB-CB 4.25Å; C982-W1021 HydrophobicContact CB-CE3 4.18Å; C982-W1021 HydrophobicContact CB-CZ3 4.18Å
983S91.2Very high89.5Confident0 Ų040.3 Ų40.30%022%0.215CC..Hα-helixtrans-61.2-43.6176.6-56.60000112.2Y933 L934 L979 R980 F985 I986 L987 W1021Y933-S983 VanDerWaalsContact CB-OG 3.27Å; Y933-S983 WeakPolarHBondContact CB-OG 3.15Å; L934-S983 PolarHBondContact N-OG 3.31Å; L979-S983 WeakPolarHBondContact O-CB 3.05Å; L979-S983 PolarHBondContact O-N 3.45Å; L979-S983 PolarHBondContact O-OG 2.77Å; R980-S983 PolarHBondContact O-N 2.91Å; S983-F985 VanDerWaalsContact C-N 3.34Å; S983-F985 PolarHBondContact O-N 2.9Å; S983-I986 PolarHBondContact O-N 3.47Å; S983-L987 WeakPolarHBondContact O-CG 3.45Å; S983-L987 PolarHBondContact O-N 3.37Å; S983-W1021 VanDerWaalsContact OG-CH2 3.22Å; S983-W1021 WeakPolarHBondContact OG-CH2 3.39Å
984L92.7Very high89.6Confident0 Ų041.8 Ų41.80%022%0.222CC..Hα-helixtrans-62.2-41.7175.3-179.157.1000111.8V937 L941 L954 L958 R980 M981 C982 I986 L987 T988 L995V937-L984 HydrophobicContact CG1-CB 3.92Å; V937-L984 HydrophobicContact CG1-CD1 3.98Å; L941-L984 HydrophobicContact CD1-CD1 3.95Å; L941-L984 HydrophobicContact CD2-CD1 4.03Å; L941-L984 HydrophobicContact CG-CD1 4.29Å; L954-L984 HydrophobicContact CB-CD2 4.08Å; L954-L984 HydrophobicContact CD2-CD1 3.89Å; L954-L984 HydrophobicContact CD2-CD2 4.09Å; L954-L984 HydrophobicContact CG-CD2 3.98Å; L958-L984 HydrophobicContact CD1-CB 4.25Å; L958-L984 HydrophobicContact CD1-CD2 3.83Å; R980-L984 WeakPolarHBondContact O-CB 3.46Å; R980-L984 PolarHBondContact O-N 2.85Å; M981-L984 PolarHBondContact O-N 3.15Å; C982-L984 PolarHBondContact O-N 2.91Å; L984-I986 VanDerWaalsContact C-N 3.32Å; L984-I986 PolarHBondContact O-N 2.97Å; L984-L987 PolarHBondContact O-N 3.24Å; L984-T988 WeakPolarHBondContact O-CB 3.48Å; L984-T988 PolarHBondContact O-N 2.67Å; L984-T988 PolarHBondContact O-OG1 3.23Å; L984-L995 HydrophobicContact CB-CD1 4.29Å; L984-L995 HydrophobicContact CD2-CD1 3.94Å; L984-L995 HydrophobicContact CG-CD1 3.87Å
985F92.2Very high89.7Confident1 Ų141.8 Ų41.80%0.00422%0.222CC..Hα-helixtrans-61.8-39.7177.4-180-92.4000112.3M981 C982 S983 V991 C992 L995 L996 I999 I1022 K1026 I1029M981-F985 WeakPolarHBondContact O-CB 3.14Å; M981-F985 PolarHBondContact O-N 3.09Å; C982-F985 WeakPolarHBondContact O-CB 3.35Å; C982-F985 PolarHBondContact O-N 3.34Å; S983-F985 VanDerWaalsContact C-N 3.34Å; S983-F985 PolarHBondContact O-N 2.9Å; F985-V991 HydrophobicContact CE2-CG1 4.49Å; F985-C992 HydrophobicContact CD2-CB 4.44Å; F985-L995 HydrophobicContact CB-CB 4.41Å; F985-L995 HydrophobicContact CB-CD1 4.27Å; F985-L995 HydrophobicContact CD2-CB 4.08Å; F985-L996 HydrophobicContact CD2-CB 4.44Å; F985-L996 HydrophobicContact CE2-CB 3.86Å; F985-L996 HydrophobicContact CE2-CD1 4.34Å; F985-L996 HydrophobicContact CZ-CB 4.39Å; F985-L996 HydrophobicContact CZ-CD1 4.07Å; F985-I999 HydrophobicContact CB-CD1 4.41Å; F985-I1022 HydrophobicContact CD1-CD1 4.19Å; F985-I1022 HydrophobicContact CD1-CG1 3.98Å; F985-I1022 HydrophobicContact CD1-CG2 4.14Å; F985-I1022 HydrophobicContact CE1-CG1 4.35Å; F985-I1022 HydrophobicContact CE1-CG2 3.65Å; F985-K1026 HydrophobicContact CE1-CD 3.94Å; F985-K1026 HydrophobicContact CZ-CD 4.48Å; F985-K1026 WeakPolarHBondContact O-CE 3.25Å; F985-K1026 PolarHBondContact O-NZ 2.86Å; F985-I1029 HydrophobicContact CE1-CG1 4.29Å; F985-I1029 HydrophobicContact CZ-CD1 4Å; F985-I1029 HydrophobicContact CZ-CG1 4.02Å
986I88.9Confident89.9Confident29 Ų2938.7 Ų38.715%0.14921%0.209CC..Hα-helixtrans-68.1-44.3178.1-68.5168.5000111L934 C982 S983 L984 W1021L934-I986 HydrophobicContact CD1-CG2 4.26Å; C982-I986 WeakPolarHBondContact O-CG1 3.31Å; C982-I986 PolarHBondContact O-N 3.15Å; S983-I986 PolarHBondContact O-N 3.47Å; L984-I986 VanDerWaalsContact C-N 3.32Å; L984-I986 PolarHBondContact O-N 2.97Å; I986-W1021 HydrophobicContact CD1-CD2 3.37Å; I986-W1021 HydrophobicContact CD1-CE3 3.97Å; I986-W1021 HydrophobicContact CD1-CG 3.7Å; I986-W1021 HydrophobicContact CD1-CH2 4.28Å; I986-W1021 HydrophobicContact CD1-CZ2 3.72Å; I986-W1021 HydrophobicContact CD1-CZ3 4.38Å
987L87.7Confident90Very high54 Ų5441.1 Ų41.128%0.28322%0.215SC..Hα-helixtrans-73.1-26.8-178-69.8168.1000114.3L934 V937 K938 L941 S983 L984L934-L987 HydrophobicContact CD1-CD1 4Å; L934-L987 HydrophobicContact CD1-CD2 3.81Å; L934-L987 HydrophobicContact CD1-CG 3.67Å; L934-L987 HydrophobicContact CG-CD2 4.37Å; V937-L987 HydrophobicContact CB-CD1 4.04Å; V937-L987 HydrophobicContact CG1-CD1 3.83Å; K938-L987 HydrophobicContact CB-CD1 3.84Å; K938-L987 HydrophobicContact CB-CD2 4.41Å; K938-L987 HydrophobicContact CD-CD2 4.49Å; L941-L987 HydrophobicContact CD1-CB 4.07Å; L941-L987 HydrophobicContact CD1-CD1 4.16Å; S983-L987 WeakPolarHBondContact O-CG 3.45Å; S983-L987 PolarHBondContact O-N 3.37Å; L984-L987 PolarHBondContact O-N 3.24Å
988T86.5Confident90Very high24 Ų2441.6 Ų41.615%0.14722%0.218CC..SBendtrans-79.2126.1-177-54.50000110.5A951 L984 K1026A951-T988 HydrophobicContact CB-CG2 4.31Å; L984-T988 WeakPolarHBondContact O-CB 3.48Å; L984-T988 PolarHBondContact O-N 2.67Å; L984-T988 PolarHBondContact O-OG1 3.23Å; T988-K1026 PolarHBondContact O-NZ 3.48Å
989P81.2Confident90.1Very high124 Ų12441.6 Ų41.681%0.80522%0.218SC*.SBendtrans-65.5142.6175.226.3-32.7000111.6
990G83.2Confident90.2Very high51 Ų5141 Ų4153%0.52621%0.214SC..SBendtrans82.7-163.2-176.800000114.5K1026G990-K1026 PolarHBondContact O-NZ 3.27Å
991V84.8Confident90.2Very high62 Ų6239.2 Ų39.238%0.37621%0.209SC..  trans-115.398.9-175.8-174.50000110.8F985 R993 L996 I1029F985-V991 HydrophobicContact CE2-CG1 4.49Å; V991-R993 HydrophobicContact CG1-CG 4.31Å; V991-R993 PolarHBondContact O-N 3.36Å; V991-R993 VanDerWaalsContact O-N 3.09Å; V991-L996 HydrophobicContact CG1-CD2 4.31Å; V991-I1029 HydrophobicContact CB-CD1 4.2Å; V991-I1029 HydrophobicContact CG1-CD1 3.78Å; V991-I1029 HydrophobicContact CG2-CD1 3.42Å; V991-I1029 VanDerWaalsContact CG2-CD1 3.42Å
992C89.1Confident90.1Very high31 Ų3139.2 Ų39.221%0.20921%0.209CC..  trans-76.893.2170.3-177.10000110F985 I994 L995 L996F985-C992 HydrophobicContact CD2-CB 4.44Å; C992-I994 PolarHBondContact O-N 2.87Å; C992-L995 HydrophobicContact CB-CB 4.38Å; C992-L995 HydrophobicContact CB-CD1 4.15Å; C992-L995 HydrophobicContact CB-CG 4.43Å; C992-L995 PolarHBondContact O-N 3.43Å; C992-L996 PolarHBondContact O-N 2.52Å; C992-L996 VanDerWaalsContact O-N 3.13Å
993R89.1Confident90.1Very high151 Ų15139.2 Ų39.257%0.5721%0.209SC*.Hα-helixtrans-59.8-30.4-177.6-70.2-165.8178.9-149.50113.6V991 R997V991-R993 HydrophobicContact CG1-CG 4.31Å; V991-R993 PolarHBondContact O-N 3.36Å; V991-R993 VanDerWaalsContact O-N 3.09Å; R993-R997 WeakPolarHBondContact O-CB 3.48Å; R993-R997 PolarHBondContact O-N 3.45Å
994I90.5Very high90.1Very high102 Ų10240.1 Ų40.152%0.52321%0.214SC..Hα-helixtrans-64.5-47.9179.2-61.3173000110.8T955 C992 T998T955-I994 HydrophobicContact CG2-CG2 4.38Å; C992-I994 PolarHBondContact O-N 2.87Å; I994-T998 WeakPolarHBondContact O-CB 3.46Å; I994-T998 PolarHBondContact O-N 3.46Å; I994-T998 PolarHBondContact O-OG1 3.14Å
995L92Very high89.9Confident0 Ų044.7 Ų44.70%023%0.234CC..Hα-helixtrans-64.7-48.4176.7-72.4175.5000111T955 M981 L984 F985 C992 R997 T998 I999T955-L995 HydrophobicContact CG2-CD1 4.3Å; T955-L995 HydrophobicContact CG2-CD2 3.79Å; T955-L995 HydrophobicContact CG2-CG 3.72Å; M981-L995 HydrophobicContact CB-CD2 4.12Å; M981-L995 HydrophobicContact CG-CD2 4.02Å; M981-L995 HydrophobicContact SD-CD2 4.42Å; L984-L995 HydrophobicContact CB-CD1 4.29Å; L984-L995 HydrophobicContact CD2-CD1 3.94Å; L984-L995 HydrophobicContact CG-CD1 3.87Å; F985-L995 HydrophobicContact CB-CB 4.41Å; F985-L995 HydrophobicContact CB-CD1 4.27Å; F985-L995 HydrophobicContact CD2-CB 4.08Å; C992-L995 HydrophobicContact CB-CB 4.38Å; C992-L995 HydrophobicContact CB-CD1 4.15Å; C992-L995 HydrophobicContact CB-CG 4.43Å; C992-L995 PolarHBondContact O-N 3.43Å; L995-R997 PolarHBondContact O-N 3.39Å; L995-T998 PolarHBondContact O-N 3.31Å; L995-T998 VanDerWaalsContact O-N 3.14Å; L995-I999 VanDerWaalsContact O-CG1 3.25Å; L995-I999 WeakPolarHBondContact O-CG1 3.4Å; L995-I999 PolarHBondContact O-N 3.03Å
996L92.7Very high89.8Confident1 Ų145.3 Ų45.31%0.00524%0.238CC..Hα-helixtrans-56.1-50.4179.6-174.362.2000111.4F985 V991 C992 T998 I999 C1000 E1032 F1033 E1036F985-L996 HydrophobicContact CD2-CB 4.44Å; F985-L996 HydrophobicContact CE2-CB 3.86Å; F985-L996 HydrophobicContact CE2-CD1 4.34Å; F985-L996 HydrophobicContact CZ-CB 4.39Å; F985-L996 HydrophobicContact CZ-CD1 4.07Å; V991-L996 HydrophobicContact CG1-CD2 4.31Å; C992-L996 PolarHBondContact O-N 2.52Å; C992-L996 VanDerWaalsContact O-N 3.13Å; L996-T998 VanDerWaalsContact C-N 3.35Å; L996-T998 PolarHBondContact O-N 3.44Å; L996-I999 PolarHBondContact O-N 3.16Å; L996-C1000 PolarHBondContact O-N 2.98Å; L996-C1000 PolarHBondContact O-SG 3.22Å; L996-C1000 VanDerWaalsContact O-SG 3.37Å; L996-E1032 HydrophobicContact CD2-CB 4.43Å; L996-F1033 HydrophobicContact CD1-CD2 3.95Å; L996-E1036 HydrophobicContact CD2-CB 4.45Å; L996-E1036 HydrophobicContact CD2-CG 3.94Å; L996-E1036 HydrophobicContact CG-CB 4.34Å; L996-E1036 HydrophobicContact CG-CG 4.17Å
997R93.2Very high89.9Confident144 Ų14445.9 Ų45.954%0.54324%0.239SC..Hα-helixtrans-60-43.9176.6-175.6174.9176.5178-0.1111.6R993 L995 I999 C1000 F1001R993-R997 WeakPolarHBondContact O-CB 3.48Å; R993-R997 PolarHBondContact O-N 3.45Å; L995-R997 PolarHBondContact O-N 3.39Å; R997-I999 VanDerWaalsContact C-N 3.32Å; R997-I999 PolarHBondContact O-N 2.95Å; R997-C1000 PolarHBondContact O-N 3.32Å; R997-F1001 HydrophobicContact CG-CD2 3.69Å; R997-F1001 HydrophobicContact CG-CE2 3.83Å; R997-F1001 VanDerWaalsContact O-CB 3.28Å; R997-F1001 WeakPolarHBondContact O-CB 3.33Å; R997-F1001 WeakPolarHBondContact O-CD2 3.11Å; R997-F1001 PolarHBondContact O-N 3.29Å
998T92.1Very high90.1Very high16 Ų1645.5 Ų45.510%0.09824%0.238CC..Hα-helixtrans-63-40.1179.6-570000111.7T959 F962 M981 I994 L995 L996 A1002T959-T998 HydrophobicContact CG2-CG2 4.33Å; F962-T998 HydrophobicContact CD1-CG2 3.72Å; F962-T998 HydrophobicContact CE1-CG2 3.94Å; M981-T998 HydrophobicContact CE-CG2 4.03Å; M981-T998 HydrophobicContact SD-CG2 3.84Å; I994-T998 WeakPolarHBondContact O-CB 3.46Å; I994-T998 PolarHBondContact O-N 3.46Å; I994-T998 PolarHBondContact O-OG1 3.14Å; L995-T998 PolarHBondContact O-N 3.31Å; L995-T998 VanDerWaalsContact O-N 3.14Å; L996-T998 VanDerWaalsContact C-N 3.35Å; L996-T998 PolarHBondContact O-N 3.44Å; T998-A1002 PolarHBondContact O-N 3.32Å; T998-A1002 VanDerWaalsContact O-N 3.08Å
999I93.8Very high90.3Very high0 Ų045.7 Ų45.70%024%0.239CC..Hα-helixtrans-68-45.4177.3-65.6163.9000111L978 M981 C982 F985 L995 L996 R997 F1001 A1002 C1018 I1022L978-I999 HydrophobicContact CD1-CB 4.42Å; L978-I999 HydrophobicContact CD1-CG1 4.17Å; L978-I999 HydrophobicContact CD1-CG2 4.3Å; M981-I999 HydrophobicContact CB-CD1 4.31Å; M981-I999 HydrophobicContact CB-CG1 4.28Å; C982-I999 HydrophobicContact CB-CD1 4.37Å; F985-I999 HydrophobicContact CB-CD1 4.41Å; L995-I999 VanDerWaalsContact O-CG1 3.25Å; L995-I999 WeakPolarHBondContact O-CG1 3.4Å; L995-I999 PolarHBondContact O-N 3.03Å; L996-I999 PolarHBondContact O-N 3.16Å; R997-I999 VanDerWaalsContact C-N 3.32Å; R997-I999 PolarHBondContact O-N 2.95Å; I999-F1001 PolarHBondContact O-N 3.41Å; I999-A1002 WeakPolarHBondContact O-CB 3.3Å; I999-A1002 PolarHBondContact O-N 2.94Å; I999-C1018 HydrophobicContact CG2-CB 4.43Å; I999-I1022 HydrophobicContact CD1-CD1 4.07Å; I999-I1022 HydrophobicContact CG2-CD1 4.15Å
1000C93.5Very high90.5Very high0 Ų043.2 Ų43.20%022%0.219CC..Hα-helixtrans-65.6-36.5177.4-68.10000112.4L996 R997 P1003 E1036 A1040L996-C1000 PolarHBondContact O-N 2.98Å; L996-C1000 PolarHBondContact O-SG 3.22Å; L996-C1000 VanDerWaalsContact O-SG 3.37Å; R997-C1000 PolarHBondContact O-N 3.32Å; C1000-P1003 WeakPolarHBondContact O-CD 3.44Å; C1000-E1036 HydrophobicContact CB-CB 4.48Å; C1000-A1040 HydrophobicContact CB-CB 4.13Å; C1000-A1040 WeakPolarHBondContact O-CB 3.49Å
1001F93.6Very high90.9Very high33 Ų3340.8 Ų40.815%0.14519%0.194CC..Hα-helixtrans-85.5-4.4-179.8-81.3-108.4000114R997 I999 P1003 T1004 F1039 A1040 A1043R997-F1001 HydrophobicContact CG-CD2 3.69Å; R997-F1001 HydrophobicContact CG-CE2 3.83Å; R997-F1001 VanDerWaalsContact O-CB 3.28Å; R997-F1001 WeakPolarHBondContact O-CB 3.33Å; R997-F1001 WeakPolarHBondContact O-CD2 3.11Å; R997-F1001 PolarHBondContact O-N 3.29Å; I999-F1001 PolarHBondContact O-N 3.41Å; F1001-P1003 VanDerWaalsContact C-CD 3.42Å; F1001-P1003 VanDerWaalsContact C-N 3.31Å; F1001-T1004 HydrophobicContact CD1-CG2 4.15Å; F1001-T1004 WeakPolarHBondContact O-CB 2.91Å; F1001-T1004 PolarHBondContact O-N 3.23Å; F1001-T1004 PolarHBondContact O-OG1 3.01Å; F1001-F1039 HydrophobicContact CE2-CB 4.1Å; F1001-F1039 HydrophobicContact CZ-CB 3.91Å; F1001-A1040 HydrophobicContact CD2-CB 3.73Å; F1001-A1040 HydrophobicContact CE2-CB 3.82Å; F1001-A1040 HydrophobicContact CG-CB 4.14Å; F1001-A1040 HydrophobicContact CZ-CB 4.28Å; F1001-A1043 HydrophobicContact CD1-CB 4.31Å; F1001-A1043 HydrophobicContact CE1-CB 3.68Å; F1001-A1043 HydrophobicContact CZ-CB 4.46Å
1002A92.1Very high91.2Very high0 Ų037.9 Ų37.90%018%0.176CC..Hα-helixtrans-50.3-42.7179.200000113.8F962 L978 T998 I999 T1004 K1005 V1006F962-A1002 HydrophobicContact CE1-CB 4.35Å; F962-A1002 HydrophobicContact CE2-CB 4.25Å; F962-A1002 HydrophobicContact CZ-CB 3.53Å; L978-A1002 HydrophobicContact CD1-CB 4.01Å; T998-A1002 PolarHBondContact O-N 3.32Å; T998-A1002 VanDerWaalsContact O-N 3.08Å; I999-A1002 WeakPolarHBondContact O-CB 3.3Å; I999-A1002 PolarHBondContact O-N 2.94Å; A1002-T1004 PolarHBondContact O-N 2.65Å; A1002-K1005 PolarHBondContact O-N 3.36Å; A1002-K1005 VanDerWaalsContact O-N 3.15Å; A1002-V1006 PolarHBondContact O-N 2.8Å
1003P91.4Very high91.2Very high1 Ų141.3 Ų41.31%0.00619%0.189CC..Hα-helixtrans-67.4-19.5177.4-19.833000115C1000 F1001 K1005 V1006 M1012 C1015 W1019C1000-P1003 WeakPolarHBondContact O-CD 3.44Å; F1001-P1003 VanDerWaalsContact C-CD 3.42Å; F1001-P1003 VanDerWaalsContact C-N 3.31Å; P1003-K1005 VanDerWaalsContact C-N 3.34Å; P1003-V1006 CarbonylContact O-C 3.37Å; P1003-M1012 HydrophobicContact CB-CE 3.44Å; P1003-M1012 VanDerWaalsContact CB-CE 3.44Å; P1003-M1012 HydrophobicContact CB-SD 4.01Å; P1003-M1012 HydrophobicContact CG-CE 3.89Å; P1003-M1012 HydrophobicContact CG-SD 3.77Å; P1003-C1015 HydrophobicContact CG-CB 4.13Å; P1003-W1019 HydrophobicContact CG-CH2 4.23Å; P1003-W1019 HydrophobicContact CG-CZ2 4.09Å
1004T90.8Very high91.2Very high18 Ų1835.4 Ų35.411%0.1117%0.169CC..Hα-helixtrans-74.6-26.817566.50000112.3F1001 A1002 A1043 Q1044F1001-T1004 HydrophobicContact CD1-CG2 4.15Å; F1001-T1004 WeakPolarHBondContact O-CB 2.91Å; F1001-T1004 PolarHBondContact O-N 3.23Å; F1001-T1004 PolarHBondContact O-OG1 3.01Å; A1002-T1004 PolarHBondContact O-N 2.65Å; T1004-A1043 HydrophobicContact CG2-CB 4.01Å; T1004-Q1044 HydrophobicContact CG2-CG 3.49Å; T1004-Q1044 VanDerWaalsContact CG2-CG 3.49Å
1005K89.3Confident91.3Very high97 Ų9730.5 Ų30.542%0.42214%0.144SC..Hα-helixtrans-84.5-41.7179.4-66.4-173.9-179.5169.80112F962 N963 C966 A1002 P1003F962-K1005 HydrophobicContact CE1-CD 4Å; N963-K1005 PolarHBondContact OD1-NZ 3.3Å; C966-K1005 HydrophobicContact CB-CB 4.43Å; A1002-K1005 PolarHBondContact O-N 3.36Å; A1002-K1005 VanDerWaalsContact O-N 3.15Å; P1003-K1005 VanDerWaalsContact C-N 3.34Å
1006V89.4Confident91.2Very high13 Ų1331.5 Ų31.58%0.07915%0.15CC..SBendtrans-133.598.4178.3-177.80000108.9C966 L974 A1002 P1003 N1008 I1011C966-V1006 HydrophobicContact CB-CG2 4.18Å; L974-V1006 HydrophobicContact CD1-CB 3.99Å; L974-V1006 HydrophobicContact CD1-CG1 4.44Å; L974-V1006 HydrophobicContact CD1-CG2 3.54Å; A1002-V1006 PolarHBondContact O-N 2.8Å; P1003-V1006 CarbonylContact O-C 3.37Å; V1006-N1008 HydrophobicContact CG1-CB 4.11Å; V1006-N1008 PolarHBondContact O-N 3.15Å; V1006-I1011 HydrophobicContact CG1-CG1 4.34Å
1007F91.4Very high90.8Very high41 Ų4133.9 Ų33.918%0.1817%0.166CC..  trans-82.380.8-177.4-166.1-104.2000111.4M1012 L1049 F1076 P1079 H1080F1007-M1012 HydrophobicContact CE2-CE 4.43Å; F1007-L1049 HydrophobicContact CB-CD1 4.24Å; F1007-L1049 HydrophobicContact CB-CD2 4.46Å; F1007-L1049 HydrophobicContact CD1-CB 4.43Å; F1007-L1049 HydrophobicContact CD2-CB 3.95Å; F1007-L1049 HydrophobicContact CD2-CD1 3.91Å; F1007-L1049 HydrophobicContact CD2-CG 4.46Å; F1007-L1049 HydrophobicContact CE1-CB 4.43Å; F1007-L1049 HydrophobicContact CE2-CB 3.95Å; F1007-L1049 HydrophobicContact CG-CB 4.19Å; F1007-L1049 HydrophobicContact CG-CD1 4.21Å; F1007-L1049 HydrophobicContact CZ-CB 4.2Å; F1007-F1076 HydrophobicContact CD1-CD1 4.2Å; F1007-F1076 HydrophobicContact CE1-CD1 4.2Å; F1007-F1076 WeakPolarHBondContact CE1-O 3.44Å; F1007-P1079 HydrophobicContact CD1-CG 4.12Å; F1007-P1079 HydrophobicContact CE1-CB 4.1Å; F1007-P1079 HydrophobicContact CE1-CG 3.76Å; F1007-P1079 HydrophobicContact CE2-CB 3.98Å; F1007-P1079 HydrophobicContact CE2-CG 4.48Å; F1007-P1079 HydrophobicContact CZ-CB 3.76Å; F1007-P1079 HydrophobicContact CZ-CG 3.96Å; F1007-H1080 AromaticContact CE2-CD2 3.46Å; F1007-H1080 VanDerWaalsContact CE2-CD2 3.46Å; F1007-H1080 WeakPolarHBondContact CE2-CD2 3.45Å; F1007-H1080 AromaticContact CE2-NE2 3.32Å; F1007-H1080 VanDerWaalsContact CE2-NE2 3.32Å; F1007-H1080 WeakPolarHBondContact CE2-NE2 3.39Å; F1007-H1080 AromaticContact CZ-CD2 3.45Å; F1007-H1080 VanDerWaalsContact CZ-CD2 3.45Å; F1007-H1080 WeakPolarHBondContact CZ-CD2 3.41Å; F1007-H1080 AromaticContact CZ-NE2 3.47Å; F1007-H1080 WeakPolarHBondContact CZ-NE2 3.36Å
1008N91.5Very high90.6Very high46 Ų4627.1 Ų27.125%0.24614%0.141CC..  trans-132.5151.7-174.6-178.6-78.4000111.1V1006 D1010 I1011 M1012V1006-N1008 HydrophobicContact CG1-CB 4.11Å; V1006-N1008 PolarHBondContact O-N 3.15Å; N1008-D1010 WeakPolarHBondContact OD1-CB 3.29Å; N1008-D1010 PolarHBondContact OD1-N 2.83Å; N1008-I1011 HydrophobicContact CB-CB 4.27Å; N1008-I1011 HydrophobicContact CB-CG1 4.06Å; N1008-M1012 WeakPolarHBondContact O-CB 3.41Å; N1008-M1012 PolarHBondContact O-N 3.43Å
1009V90.5Very high90.6Very high28 Ų2826.4 Ų26.417%0.1714%0.137CC..Hα-helixtrans-64.7-53.6-176.7176.10000111.2I1011 M1012 E1013 F1076 K1078 P1079V1009-I1011 PolarHBondContact O-N 3.21Å; V1009-M1012 PolarHBondContact O-N 3.11Å; V1009-M1012 VanDerWaalsContact O-N 3.08Å; V1009-E1013 HydrophobicContact CG1-CG 4.38Å; V1009-E1013 WeakPolarHBondContact CG1-OE1 3.4Å; V1009-E1013 WeakPolarHBondContact O-CG 3.3Å; V1009-E1013 PolarHBondContact O-N 2.98Å; V1009-F1076 HydrophobicContact CG2-CE1 4.08Å; V1009-F1076 HydrophobicContact CG2-CE2 4.34Å; V1009-F1076 HydrophobicContact CG2-CZ 3.52Å; V1009-K1078 HydrophobicContact CG2-CB 3.49Å; V1009-K1078 VanDerWaalsContact CG2-CB 3.49Å; V1009-K1078 HydrophobicContact CG2-CD 4.4Å; V1009-P1079 HydrophobicContact CG2-CG 3.89Å
1010D86.3Confident90.3Very high73 Ų7326.8 Ų26.839%0.3914%0.139SC..Hα-helixtrans-58-38.1-179.7-68.415000112.4K975 N1008 L1014K975-D1010 IonicContact NZ-OD2 3.34Å; K975-D1010 PolarHBondContact NZ-OD2 3.18Å; N1008-D1010 WeakPolarHBondContact OD1-CB 3.29Å; N1008-D1010 PolarHBondContact OD1-N 2.83Å; D1010-L1014 WeakPolarHBondContact O-CB 3.47Å; D1010-L1014 PolarHBondContact O-N 2.87Å
1011I90.7Very high89.9Confident0 Ų027.5 Ų27.50%014%0.141CC..Hα-helixtrans-71-41.2179.2-60.4-44.3000110.4I971 L974 K975 V1006 N1008 V1009 L1014 C1015I971-I1011 HydrophobicContact CG2-CD1 4.06Å; L974-I1011 HydrophobicContact CD2-CD1 3.61Å; L974-I1011 HydrophobicContact CD2-CG1 4.1Å; L974-I1011 HydrophobicContact CD2-CG2 3.91Å; K975-I1011 HydrophobicContact CG-CD1 3.74Å; V1006-I1011 HydrophobicContact CG1-CG1 4.34Å; N1008-I1011 HydrophobicContact CB-CB 4.27Å; N1008-I1011 HydrophobicContact CB-CG1 4.06Å; V1009-I1011 PolarHBondContact O-N 3.21Å; I1011-L1014 PolarHBondContact O-N 3.31Å; I1011-C1015 WeakPolarHBondContact O-CB 3.29Å; I1011-C1015 PolarHBondContact O-N 3.49Å; I1011-C1015 PolarHBondContact O-SG 3.24Å
1012M92.8Very high89.6Confident1 Ų125.9 Ų25.91%0.00513%0.134CC..Hα-helixtrans-64-45175.7-175.366.178.400111.8P1003 F1007 N1008 V1009 L1014 C1015 V1016 W1019 P1079 A1082 L1083P1003-M1012 HydrophobicContact CB-CE 3.44Å; P1003-M1012 VanDerWaalsContact CB-CE 3.44Å; P1003-M1012 HydrophobicContact CB-SD 4.01Å; P1003-M1012 HydrophobicContact CG-CE 3.89Å; P1003-M1012 HydrophobicContact CG-SD 3.77Å; F1007-M1012 HydrophobicContact CE2-CE 4.43Å; N1008-M1012 WeakPolarHBondContact O-CB 3.41Å; N1008-M1012 PolarHBondContact O-N 3.43Å; V1009-M1012 PolarHBondContact O-N 3.11Å; V1009-M1012 VanDerWaalsContact O-N 3.08Å; M1012-L1014 VanDerWaalsContact C-N 3.31Å; M1012-L1014 PolarHBondContact O-N 3.24Å; M1012-C1015 WeakPolarHBondContact O-CB 3.32Å; M1012-C1015 PolarHBondContact O-N 3.37Å; M1012-C1015 VanDerWaalsContact O-N 3.16Å; M1012-V1016 WeakPolarHBondContact O-CG2 3.45Å; M1012-V1016 PolarHBondContact O-N 3.5Å; M1012-W1019 HydrophobicContact SD-CH2 3.97Å; M1012-W1019 HydrophobicContact SD-CZ3 4.43Å; M1012-P1079 HydrophobicContact CB-CB 3.95Å; M1012-P1079 HydrophobicContact CE-CB 4.11Å; M1012-P1079 HydrophobicContact CG-CB 4.21Å; M1012-P1079 WeakPolarHBondContact CG-O 3.09Å; M1012-A1082 HydrophobicContact CG-CB 4.26Å; M1012-L1083 HydrophobicContact CE-CB 4.19Å; M1012-L1083 HydrophobicContact CE-CD2 3.95Å; M1012-L1083 HydrophobicContact SD-CB 4.09Å; M1012-L1083 HydrophobicContact SD-CD1 4.1Å; M1012-L1083 HydrophobicContact SD-CD2 4.46Å; M1012-L1083 HydrophobicContact SD-CG 4.47Å
1013E89.3Confident89.4Confident102 Ų10227.6 Ų27.648%0.47714%0.143SC..Hα-helixtrans-62-39.4177-71.5177.617700111.8V1009 S1017 A1082V1009-E1013 HydrophobicContact CG1-CG 4.38Å; V1009-E1013 WeakPolarHBondContact CG1-OE1 3.4Å; V1009-E1013 WeakPolarHBondContact O-CG 3.3Å; V1009-E1013 PolarHBondContact O-N 2.98Å; E1013-S1017 WeakPolarHBondContact O-CB 3.22Å; E1013-S1017 PolarHBondContact O-N 2.87Å; E1013-S1017 PolarHBondContact O-OG 2.88Å; E1013-A1082 HydrophobicContact CG-CB 4.44Å
1014L88.4Confident88.8Confident27 Ų2728 Ų2814%0.14115%0.146CC..Hα-helixtrans-66.1-42.1172.6-17664.2000111.7K975 L978 L979 D1010 I1011 M1012 S1017 C1018K975-L1014 HydrophobicContact CB-CD2 3.62Å; K975-L1014 HydrophobicContact CD-CD2 4.45Å; K975-L1014 HydrophobicContact CG-CD2 3.62Å; L978-L1014 HydrophobicContact CB-CD2 4.44Å; L978-L1014 HydrophobicContact CD2-CD2 3.91Å; L978-L1014 HydrophobicContact CD2-CG 3.95Å; L979-L1014 HydrophobicContact CD1-CD1 4.25Å; L979-L1014 HydrophobicContact CD2-CD1 3.93Å; L979-L1014 HydrophobicContact CG-CD1 4.11Å; D1010-L1014 WeakPolarHBondContact O-CB 3.47Å; D1010-L1014 PolarHBondContact O-N 2.87Å; I1011-L1014 PolarHBondContact O-N 3.31Å; M1012-L1014 VanDerWaalsContact C-N 3.31Å; M1012-L1014 PolarHBondContact O-N 3.24Å; L1014-S1017 WeakPolarHBondContact O-CB 3.31Å; L1014-S1017 PolarHBondContact O-N 3.13Å; L1014-S1017 VanDerWaalsContact O-N 3.17Å; L1014-C1018 PolarHBondContact O-N 3.13Å; L1014-C1018 PolarHBondContact O-SG 3.42Å; L1014-C1018 VanDerWaalsContact O-SG 3.36Å
1015C91.8Very high88.4Confident0 Ų028.7 Ų28.70%015%0.152CC..Hα-helixtrans-60.7-47.4176-70.30000111.2L978 P1003 I1011 M1012 S1017 C1018 W1019L978-C1015 VanDerWaalsContact CD2-SG 3.58Å; P1003-C1015 HydrophobicContact CG-CB 4.13Å; I1011-C1015 WeakPolarHBondContact O-CB 3.29Å; I1011-C1015 PolarHBondContact O-N 3.49Å; I1011-C1015 PolarHBondContact O-SG 3.24Å; M1012-C1015 WeakPolarHBondContact O-CB 3.32Å; M1012-C1015 PolarHBondContact O-N 3.37Å; M1012-C1015 VanDerWaalsContact O-N 3.16Å; C1015-S1017 PolarHBondContact O-N 3.29Å; C1015-C1018 CarbonylContact O-C 3.11Å; C1015-C1018 PolarHBondContact O-N 2.94Å; C1015-C1018 VanDerWaalsContact O-N 3.13Å; C1015-W1019 HydrophobicContact CB-CD2 4.47Å; C1015-W1019 HydrophobicContact CB-CH2 4.14Å; C1015-W1019 HydrophobicContact CB-CZ2 3.7Å; C1015-W1019 WeakPolarHBondContact O-CB 3.14Å; C1015-W1019 VanDerWaalsContact O-CD1 3.25Å; C1015-W1019 VanDerWaalsContact O-CD2 3.29Å; C1015-W1019 PolarHBondContact O-N 3.18Å
1016V89.9Confident88.2Confident21 Ų2125.6 Ų25.613%0.12714%0.138CC..Hα-helixtrans-56.8-41174.2169.30000110.7M1012 W1019 N1020 F1086M1012-V1016 WeakPolarHBondContact O-CG2 3.45Å; M1012-V1016 PolarHBondContact O-N 3.5Å; V1016-W1019 HydrophobicContact CB-CE3 4.38Å; V1016-W1019 HydrophobicContact CG2-CE3 3.92Å; V1016-W1019 HydrophobicContact CG2-CZ3 3.7Å; V1016-W1019 PolarHBondContact O-N 2.92Å; V1016-N1020 VanDerWaalsContact O-CB 3.22Å; V1016-N1020 WeakPolarHBondContact O-CB 3.39Å; V1016-N1020 PolarHBondContact O-N 2.9Å; V1016-N1020 PolarHBondContact O-ND2 3.38Å; V1016-N1020 VanDerWaalsContact O-ND2 3.13Å; V1016-F1086 HydrophobicContact CG1-CB 4.06Å; V1016-F1086 HydrophobicContact CG1-CD2 4.02Å; V1016-F1086 HydrophobicContact CG1-CG 4.29Å; V1016-F1086 HydrophobicContact CG2-CB 4.06Å; V1016-F1086 HydrophobicContact CG2-CG 4.41Å
1017S84.3Confident87.5Confident51 Ų5132.9 Ų32.936%0.35717%0.171SC..Hα-helixtrans-64.3-45.8175.1-55.70000112.1E1013 L1014 C1015 W1019 N1020 W1021E1013-S1017 WeakPolarHBondContact O-CB 3.22Å; E1013-S1017 PolarHBondContact O-N 2.87Å; E1013-S1017 PolarHBondContact O-OG 2.88Å; L1014-S1017 WeakPolarHBondContact O-CB 3.31Å; L1014-S1017 PolarHBondContact O-N 3.13Å; L1014-S1017 VanDerWaalsContact O-N 3.17Å; C1015-S1017 PolarHBondContact O-N 3.29Å; S1017-W1019 PolarHBondContact O-N 3.46Å; S1017-N1020 WeakPolarHBondContact O-CB 3.46Å; S1017-N1020 PolarHBondContact O-N 3.4Å; S1017-W1021 WeakPolarHBondContact O-CB 3.41Å; S1017-W1021 PolarHBondContact O-N 2.89Å
1018C89.2Confident87Confident2 Ų233.9 Ų33.91%0.01419%0.193CC..Hα-helixtrans-62.4-40.8175.3-690000112.6C982 I999 L1014 C1015 W1021 I1022C982-C1018 HydrophobicContact CB-CB 4.25Å; I999-C1018 HydrophobicContact CG2-CB 4.43Å; L1014-C1018 PolarHBondContact O-N 3.13Å; L1014-C1018 PolarHBondContact O-SG 3.42Å; L1014-C1018 VanDerWaalsContact O-SG 3.36Å; C1015-C1018 CarbonylContact O-C 3.11Å; C1015-C1018 PolarHBondContact O-N 2.94Å; C1015-C1018 VanDerWaalsContact O-N 3.13Å; C1018-W1021 PolarHBondContact O-N 3.23Å; C1018-I1022 VanDerWaalsContact O-CG1 3.29Å; C1018-I1022 WeakPolarHBondContact O-CG1 3.42Å; C1018-I1022 PolarHBondContact O-N 3.4Å
1019W92.3Very high86.8Confident1 Ų131.9 Ų31.90%0.00418%0.183CC..Hα-helixtrans-64-45.4177.7-61-18.8000111.3P1003 M1012 C1015 V1016 S1017 W1021 I1022 L1023 F1033 F1037 L1083 F1086P1003-W1019 HydrophobicContact CG-CH2 4.23Å; P1003-W1019 HydrophobicContact CG-CZ2 4.09Å; M1012-W1019 HydrophobicContact SD-CH2 3.97Å; M1012-W1019 HydrophobicContact SD-CZ3 4.43Å; C1015-W1019 HydrophobicContact CB-CD2 4.47Å; C1015-W1019 HydrophobicContact CB-CH2 4.14Å; C1015-W1019 HydrophobicContact CB-CZ2 3.7Å; C1015-W1019 WeakPolarHBondContact O-CB 3.14Å; C1015-W1019 VanDerWaalsContact O-CD1 3.25Å; C1015-W1019 VanDerWaalsContact O-CD2 3.29Å; C1015-W1019 PolarHBondContact O-N 3.18Å; V1016-W1019 HydrophobicContact CB-CE3 4.38Å; V1016-W1019 HydrophobicContact CG2-CE3 3.92Å; V1016-W1019 HydrophobicContact CG2-CZ3 3.7Å; V1016-W1019 PolarHBondContact O-N 2.92Å; S1017-W1019 PolarHBondContact O-N 3.46Å; W1019-W1021 VanDerWaalsContact C-N 3.31Å; W1019-W1021 PolarHBondContact O-N 3.5Å; W1019-I1022 PolarHBondContact O-N 2.89Å; W1019-L1023 WeakPolarHBondContact O-CB 3.37Å; W1019-L1023 VanDerWaalsContact O-CG 3.27Å; W1019-L1023 WeakPolarHBondContact O-CG 3.22Å; W1019-L1023 PolarHBondContact O-N 3.04Å; W1019-F1033 HydrophobicContact CB-CE2 3.74Å; W1019-F1033 HydrophobicContact CB-CZ 3.53Å; W1019-F1033 AromaticContact CD1-CE2 3.54Å; W1019-F1033 AromaticContact CD1-CZ 3.94Å; W1019-F1033 HydrophobicContact CD2-CE2 4.3Å; W1019-F1033 AromaticContact CD2-CZ 3.92Å; W1019-F1033 HydrophobicContact CD2-CZ 3.92Å; W1019-F1033 HydrophobicContact CE3-CZ 4.46Å; W1019-F1033 AromaticContact CG-CE2 3.56Å; W1019-F1033 HydrophobicContact CG-CE2 3.56Å; W1019-F1033 AromaticContact CG-CZ 3.48Å; W1019-F1033 HydrophobicContact CG-CZ 3.48Å; W1019-F1033 VanDerWaalsContact CG-CZ 3.48Å; W1019-F1037 HydrophobicContact CE3-CD2 4.46Å; W1019-F1037 HydrophobicContact CE3-CE2 4.13Å; W1019-F1037 HydrophobicContact CH2-CD2 4.37Å; W1019-F1037 AromaticContact CH2-CE2 3.93Å; W1019-F1037 HydrophobicContact CH2-CE2 3.93Å; W1019-F1037 HydrophobicContact CZ3-CD2 4.31Å; W1019-F1037 AromaticContact CZ3-CE2 3.68Å; W1019-F1037 HydrophobicContact CZ3-CE2 3.68Å; W1019-L1083 HydrophobicContact CH2-CD1 3.64Å; W1019-L1083 HydrophobicContact CZ3-CD1 3.43Å; W1019-L1083 VanDerWaalsContact CZ3-CD1 3.43Å; W1019-F1086 HydrophobicContact CB-CE2 4.25Å; W1019-F1086 HydrophobicContact CB-CZ 4.05Å; W1019-F1086 AromaticContact CE3-CD1 3.81Å; W1019-F1086 HydrophobicContact CE3-CD1 3.81Å; W1019-F1086 AromaticContact CE3-CE1 3.71Å; W1019-F1086 HydrophobicContact CE3-CE1 3.71Å; W1019-F1086 HydrophobicContact CE3-CE2 4.48Å; W1019-F1086 HydrophobicContact CE3-CG 4.25Å; W1019-F1086 HydrophobicContact CE3-CZ 4.07Å; W1019-F1086 HydrophobicContact CZ3-CD1 4.06Å; W1019-F1086 HydrophobicContact CZ3-CE1 4.29Å
1020N86.9Confident86.6Confident7 Ų733.4 Ų33.44%0.03719%0.188CC..Hα-helixtrans-56.6-44.3172.8-89.3-35.1000112N871 V1016 S1017 L1023 S1024N871-N1020 VanDerWaalsContact ND2-C 3.3Å; N871-N1020 WeakPolarHBondContact ND2-CB 3.44Å; N871-N1020 PolarHBondContact ND2-O 3.22Å; V1016-N1020 VanDerWaalsContact O-CB 3.22Å; V1016-N1020 WeakPolarHBondContact O-CB 3.39Å; V1016-N1020 PolarHBondContact O-N 2.9Å; V1016-N1020 PolarHBondContact O-ND2 3.38Å; V1016-N1020 VanDerWaalsContact O-ND2 3.13Å; S1017-N1020 WeakPolarHBondContact O-CB 3.46Å; S1017-N1020 PolarHBondContact O-N 3.4Å; N1020-L1023 PolarHBondContact O-N 3.02Å; N1020-S1024 PolarHBondContact O-N 2.73Å; N1020-S1024 PolarHBondContact O-OG 2.85Å
1021W85.3Confident86.5Confident15 Ų1531.5 Ų31.56%0.05718%0.182CC..Hα-helixtrans-64.7-40.8176.3-17526.4000112.9E930 L934 C982 S983 I986 S1017 C1018 W1019 S1024 S1025E930-W1021 HydrophobicContact CB-CD2 4.48Å; E930-W1021 HydrophobicContact CB-CH2 4.02Å; E930-W1021 HydrophobicContact CB-CZ2 3.77Å; E930-W1021 HydrophobicContact CB-CZ3 4.47Å; E930-W1021 HydrophobicContact CG-CD2 3.82Å; E930-W1021 HydrophobicContact CG-CE3 3.95Å; E930-W1021 HydrophobicContact CG-CG 4.35Å; E930-W1021 HydrophobicContact CG-CH2 4.15Å; E930-W1021 HydrophobicContact CG-CZ2 4.02Å; E930-W1021 HydrophobicContact CG-CZ3 4.12Å; L934-W1021 HydrophobicContact CB-CH2 4.44Å; L934-W1021 HydrophobicContact CB-CZ2 4.3Å; L934-W1021 HydrophobicContact CD1-CZ2 4.27Å; C982-W1021 HydrophobicContact CB-CE3 4.18Å; C982-W1021 HydrophobicContact CB-CZ3 4.18Å; S983-W1021 VanDerWaalsContact OG-CH2 3.22Å; S983-W1021 WeakPolarHBondContact OG-CH2 3.39Å; I986-W1021 HydrophobicContact CD1-CD2 3.37Å; I986-W1021 HydrophobicContact CD1-CE3 3.97Å; I986-W1021 HydrophobicContact CD1-CG 3.7Å; I986-W1021 HydrophobicContact CD1-CH2 4.28Å; I986-W1021 HydrophobicContact CD1-CZ2 3.72Å; I986-W1021 HydrophobicContact CD1-CZ3 4.38Å; S1017-W1021 WeakPolarHBondContact O-CB 3.41Å; S1017-W1021 PolarHBondContact O-N 2.89Å; C1018-W1021 PolarHBondContact O-N 3.23Å; W1019-W1021 VanDerWaalsContact C-N 3.31Å; W1019-W1021 PolarHBondContact O-N 3.5Å; W1021-S1024 PolarHBondContact O-OG 3.35Å; W1021-S1024 VanDerWaalsContact O-OG 3.08Å; W1021-S1025 PolarHBondContact NE1-OG 3.33Å; W1021-S1025 VanDerWaalsContact O-CB 3.25Å; W1021-S1025 WeakPolarHBondContact O-CB 3.43Å; W1021-S1025 PolarHBondContact O-N 2.96Å; W1021-S1025 PolarHBondContact O-OG 2.97Å
1022I88.7Confident86.4Confident0 Ų034.7 Ų34.70%020%0.197CC..Hα-helixtrans-62.7-48.2175.1-72.9166.5000110.8F985 I999 C1018 W1019 S1024 S1025 K1026 I1029F985-I1022 HydrophobicContact CD1-CD1 4.19Å; F985-I1022 HydrophobicContact CD1-CG1 3.98Å; F985-I1022 HydrophobicContact CD1-CG2 4.14Å; F985-I1022 HydrophobicContact CE1-CG1 4.35Å; F985-I1022 HydrophobicContact CE1-CG2 3.65Å; I999-I1022 HydrophobicContact CD1-CD1 4.07Å; I999-I1022 HydrophobicContact CG2-CD1 4.15Å; C1018-I1022 VanDerWaalsContact O-CG1 3.29Å; C1018-I1022 WeakPolarHBondContact O-CG1 3.42Å; C1018-I1022 PolarHBondContact O-N 3.4Å; W1019-I1022 PolarHBondContact O-N 2.89Å; I1022-S1024 VanDerWaalsContact C-N 3.3Å; I1022-S1024 PolarHBondContact O-N 3.38Å; I1022-S1025 PolarHBondContact O-N 3.43Å; I1022-K1026 PolarHBondContact O-N 2.82Å; I1022-K1026 VanDerWaalsContact O-N 3.1Å; I1022-I1029 HydrophobicContact CG2-CG2 4.08Å
1023L87Confident86.5Confident35 Ų3534.6 Ų34.618%0.18320%0.197CC..Hα-helixtrans-65.9-31-177.4-71.6171.3000112.5W1019 N1020 I1029 E1030 F1033 F1034 F1086W1019-L1023 WeakPolarHBondContact O-CB 3.37Å; W1019-L1023 VanDerWaalsContact O-CG 3.27Å; W1019-L1023 WeakPolarHBondContact O-CG 3.22Å; W1019-L1023 PolarHBondContact O-N 3.04Å; N1020-L1023 PolarHBondContact O-N 3.02Å; L1023-I1029 HydrophobicContact CD2-CG2 4.4Å; L1023-E1030 HydrophobicContact CD2-CB 4.33Å; L1023-E1030 HydrophobicContact CD2-CG 4.16Å; L1023-F1033 HydrophobicContact CD1-CD1 4.13Å; L1023-F1033 HydrophobicContact CD1-CE1 4.01Å; L1023-F1033 HydrophobicContact CD2-CB 4.16Å; L1023-F1033 HydrophobicContact CD2-CD1 3.79Å; L1023-F1033 HydrophobicContact CD2-CE1 4.49Å; L1023-F1033 HydrophobicContact CD2-CG 3.99Å; L1023-F1033 HydrophobicContact CG-CD1 4.22Å; L1023-F1033 HydrophobicContact CG-CE1 4.48Å; L1023-F1033 HydrophobicContact CG-CG 4.47Å; L1023-F1034 HydrophobicContact CD1-CE2 4.38Å; L1023-F1034 HydrophobicContact CD1-CZ 4.13Å; L1023-F1034 HydrophobicContact CD2-CE2 4.31Å; L1023-F1086 HydrophobicContact CD1-CE2 4.22Å; L1023-F1086 HydrophobicContact CD1-CZ 3.98Å
1024S79.9Confident86.6Confident10 Ų1030.2 Ų30.27%0.0718%0.176CC..Hα-helixtrans-81.4-36.9176.663.70000113.4N1020 W1021 I1022N1020-S1024 PolarHBondContact O-N 2.73Å; N1020-S1024 PolarHBondContact O-OG 2.85Å; W1021-S1024 PolarHBondContact O-OG 3.35Å; W1021-S1024 VanDerWaalsContact O-OG 3.08Å; I1022-S1024 VanDerWaalsContact C-N 3.3Å; I1022-S1024 PolarHBondContact O-N 3.38Å
1025S81.5Confident86.6Confident32 Ų3233.1 Ų33.122%0.22419%0.189CC..Hα-helixtrans-89.3-20.6-170.1-47.90000113.9W1021 I1022W1021-S1025 PolarHBondContact NE1-OG 3.33Å; W1021-S1025 VanDerWaalsContact O-CB 3.25Å; W1021-S1025 WeakPolarHBondContact O-CB 3.43Å; W1021-S1025 PolarHBondContact O-N 2.96Å; W1021-S1025 PolarHBondContact O-OG 2.97Å; I1022-S1025 PolarHBondContact O-N 3.43Å
1026K84Confident86.6Confident32 Ų3234.3 Ų34.314%0.13919%0.194CC..SBendtrans-119.1104.1176.8-95.6-164.6171.7168.50112F985 T988 G990 I1022 I1029F985-K1026 HydrophobicContact CE1-CD 3.94Å; F985-K1026 HydrophobicContact CZ-CD 4.48Å; F985-K1026 WeakPolarHBondContact O-CE 3.25Å; F985-K1026 PolarHBondContact O-NZ 2.86Å; T988-K1026 PolarHBondContact O-NZ 3.48Å; G990-K1026 PolarHBondContact O-NZ 3.27Å; I1022-K1026 PolarHBondContact O-N 2.82Å; I1022-K1026 VanDerWaalsContact O-N 3.1Å; K1026-I1029 HydrophobicContact CB-CB 4.16Å; K1026-I1029 HydrophobicContact CB-CG2 3.99Å; K1026-I1029 WeakPolarHBondContact O-CG2 3.45Å
1027E76.4Confident86.8Confident166 Ų16633.5 Ų33.578%0.77619%0.189SC*.THydrogen-bonded Turntrans-64.4136.7175.2-64.8179.7-171.200111.5K797 I1029K797-E1027 IonicContact NZ-OE1 2.82Å; E1027-I1029 VanDerWaalsContact C-N 3.35Å; E1027-I1029 PolarHBondContact O-N 3.3Å
1028G79.4Confident87.1Confident62 Ų6231.7 Ų31.764%0.63918%0.176SC*.THydrogen-bonded Turntrans83.3-4.7177.200000116.2E1030G1028-E1030 VanDerWaalsContact C-N 3.27Å; G1028-E1030 PolarHBondContact O-N 3.32Å
1029I87.3Confident87.2Confident5 Ų536.6 Ų36.63%0.02620%0.197CC..  trans-77.7-9-178.9-16060.1000114.4F985 V991 I1022 L1023 K1026 E1027 A1031 E1032 F1033F985-I1029 HydrophobicContact CE1-CG1 4.29Å; F985-I1029 HydrophobicContact CZ-CD1 4Å; F985-I1029 HydrophobicContact CZ-CG1 4.02Å; V991-I1029 HydrophobicContact CB-CD1 4.2Å; V991-I1029 HydrophobicContact CG1-CD1 3.78Å; V991-I1029 HydrophobicContact CG2-CD1 3.42Å; V991-I1029 VanDerWaalsContact CG2-CD1 3.42Å; I1022-I1029 HydrophobicContact CG2-CG2 4.08Å; L1023-I1029 HydrophobicContact CD2-CG2 4.4Å; K1026-I1029 HydrophobicContact CB-CB 4.16Å; K1026-I1029 HydrophobicContact CB-CG2 3.99Å; K1026-I1029 WeakPolarHBondContact O-CG2 3.45Å; E1027-I1029 VanDerWaalsContact C-N 3.35Å; E1027-I1029 PolarHBondContact O-N 3.3Å; I1029-A1031 VanDerWaalsContact C-N 3.31Å; I1029-A1031 PolarHBondContact O-N 3.47Å; I1029-E1032 HydrophobicContact CD1-CB 4.15Å; I1029-E1032 PolarHBondContact O-N 3.19Å; I1029-F1033 WeakPolarHBondContact O-CB 3.39Å; I1029-F1033 PolarHBondContact O-N 3.3Å
1030E86.8Confident87.2Confident60 Ų6036.6 Ų36.628%0.2820%0.197SC..Hα-helixtrans-56.3-44-168.5-54.4171.6153.200111.8L1023 G1028 F1033 F1034 N1098 L1101L1023-E1030 HydrophobicContact CD2-CB 4.33Å; L1023-E1030 HydrophobicContact CD2-CG 4.16Å; G1028-E1030 VanDerWaalsContact C-N 3.27Å; G1028-E1030 PolarHBondContact O-N 3.32Å; E1030-F1033 PolarHBondContact O-N 3.15Å; E1030-F1034 WeakPolarHBondContact O-CB 3.46Å; E1030-F1034 WeakPolarHBondContact O-CD2 3.3Å; E1030-F1034 PolarHBondContact O-N 3.06Å; E1030-N1098 PolarHBondContact OE2-ND2 2.92Å; E1030-L1101 HydrophobicContact CB-CD1 4.09Å; E1030-L1101 HydrophobicContact CB-CD2 4Å; E1030-L1101 HydrophobicContact CB-CG 4.48Å
1031A85.5Confident87.5Confident33 Ų3336.4 Ų36.427%0.27320%0.196SC..Hα-helixtrans-66.8-46.8-177.600000111.9I1029 F1034 Q1035 I1104I1029-A1031 VanDerWaalsContact C-N 3.31Å; I1029-A1031 PolarHBondContact O-N 3.47Å; A1031-F1034 PolarHBondContact O-N 3.47Å; A1031-Q1035 VanDerWaalsContact O-CG 3.23Å; A1031-Q1035 WeakPolarHBondContact O-CG 3.41Å; A1031-Q1035 PolarHBondContact O-N 3.42Å; A1031-I1104 HydrophobicContact CB-CD1 4.13Å
1032E88.1Confident87.8Confident66 Ų6636.8 Ų36.831%0.30820%0.198SC..Hα-helixtrans-64.5-40.9176.9-66.484.3169.100111.5L996 I1029 Q1035 E1036L996-E1032 HydrophobicContact CD2-CB 4.43Å; I1029-E1032 HydrophobicContact CD1-CB 4.15Å; I1029-E1032 PolarHBondContact O-N 3.19Å; E1032-Q1035 PolarHBondContact O-N 3.12Å; E1032-E1036 PolarHBondContact O-N 3.27Å; E1032-E1036 VanDerWaalsContact O-N 3.13Å
1033F93.7Very high87.8Confident0 Ų037.9 Ų37.90%021%0.208CC..Hα-helixtrans-60.5-52.2175.4170.5-93000111.2L996 W1019 L1023 I1029 E1030 Q1035 E1036 F1037 F1086L996-F1033 HydrophobicContact CD1-CD2 3.95Å; W1019-F1033 HydrophobicContact CB-CE2 3.74Å; W1019-F1033 HydrophobicContact CB-CZ 3.53Å; W1019-F1033 AromaticContact CD1-CE2 3.54Å; W1019-F1033 AromaticContact CD1-CZ 3.94Å; W1019-F1033 HydrophobicContact CD2-CE2 4.3Å; W1019-F1033 AromaticContact CD2-CZ 3.92Å; W1019-F1033 HydrophobicContact CD2-CZ 3.92Å; W1019-F1033 HydrophobicContact CE3-CZ 4.46Å; W1019-F1033 AromaticContact CG-CE2 3.56Å; W1019-F1033 HydrophobicContact CG-CE2 3.56Å; W1019-F1033 AromaticContact CG-CZ 3.48Å; W1019-F1033 HydrophobicContact CG-CZ 3.48Å; W1019-F1033 VanDerWaalsContact CG-CZ 3.48Å; L1023-F1033 HydrophobicContact CD1-CD1 4.13Å; L1023-F1033 HydrophobicContact CD1-CE1 4.01Å; L1023-F1033 HydrophobicContact CD2-CB 4.16Å; L1023-F1033 HydrophobicContact CD2-CD1 3.79Å; L1023-F1033 HydrophobicContact CD2-CE1 4.49Å; L1023-F1033 HydrophobicContact CD2-CG 3.99Å; L1023-F1033 HydrophobicContact CG-CD1 4.22Å; L1023-F1033 HydrophobicContact CG-CE1 4.48Å; L1023-F1033 HydrophobicContact CG-CG 4.47Å; I1029-F1033 WeakPolarHBondContact O-CB 3.39Å; I1029-F1033 PolarHBondContact O-N 3.3Å; E1030-F1033 PolarHBondContact O-N 3.15Å; F1033-Q1035 VanDerWaalsContact C-N 3.25Å; F1033-Q1035 PolarHBondContact O-N 3.36Å; F1033-E1036 PolarHBondContact O-N 2.96Å; F1033-F1037 HydrophobicContact CE1-CB 4.26Å; F1033-F1037 HydrophobicContact CE1-CD2 4.38Å; F1033-F1037 HydrophobicContact CE1-CG 4.49Å; F1033-F1037 HydrophobicContact CZ-CB 4.4Å; F1033-F1037 HydrophobicContact CZ-CD2 4.13Å; F1033-F1037 VanDerWaalsContact O-CB 3.32Å; F1033-F1037 WeakPolarHBondContact O-CB 3.14Å; F1033-F1037 PolarHBondContact O-N 2.98Å; F1033-F1086 HydrophobicContact CE1-CE1 4.08Å; F1033-F1086 AromaticContact CE1-CZ 3.8Å; F1033-F1086 HydrophobicContact CE1-CZ 3.8Å; F1033-F1086 HydrophobicContact CZ-CE1 4.19Å; F1033-F1086 AromaticContact CZ-CZ 3.95Å; F1033-F1086 HydrophobicContact CZ-CZ 3.95Å
1034F92.4Very high88.1Confident9 Ų936.4 Ų36.44%0.03920%0.2CC..Hα-helixtrans-69.3-23.7-177-77.3-65.1000113L1023 E1030 A1031 F1037 D1038 F1086 L1101 I1104 F1105L1023-F1034 HydrophobicContact CD1-CE2 4.38Å; L1023-F1034 HydrophobicContact CD1-CZ 4.13Å; L1023-F1034 HydrophobicContact CD2-CE2 4.31Å; E1030-F1034 WeakPolarHBondContact O-CB 3.46Å; E1030-F1034 WeakPolarHBondContact O-CD2 3.3Å; E1030-F1034 PolarHBondContact O-N 3.06Å; A1031-F1034 PolarHBondContact O-N 3.47Å; F1034-F1037 HydrophobicContact CD1-CD1 4.38Å; F1034-F1037 HydrophobicContact CD1-CG 4.5Å; F1034-D1038 WeakPolarHBondContact O-CB 3.3Å; F1034-D1038 PolarHBondContact O-N 3.02Å; F1034-F1086 HydrophobicContact CE1-CE1 4.15Å; F1034-F1086 HydrophobicContact CE1-CZ 4.27Å; F1034-F1086 HydrophobicContact CZ-CZ 4.4Å; F1034-L1101 HydrophobicContact CD2-CD2 3.52Å; F1034-L1101 HydrophobicContact CE2-CD1 4.35Å; F1034-L1101 HydrophobicContact CE2-CD2 4.16Å; F1034-L1101 HydrophobicContact CG-CD2 4.38Å; F1034-I1104 HydrophobicContact CB-CG2 3.92Å; F1034-F1105 AromaticContact CD1-CE1 3.95Å; F1034-F1105 HydrophobicContact CD1-CE1 3.95Å; F1034-F1105 AromaticContact CD1-CZ 3.69Å; F1034-F1105 HydrophobicContact CD1-CZ 3.69Å; F1034-F1105 HydrophobicContact CD2-CZ 4.42Å; F1034-F1105 AromaticContact CE1-CE1 3.93Å; F1034-F1105 HydrophobicContact CE1-CE1 3.93Å; F1034-F1105 HydrophobicContact CE1-CE2 4.43Å; F1034-F1105 AromaticContact CE1-CZ 3.41Å; F1034-F1105 HydrophobicContact CE1-CZ 3.41Å; F1034-F1105 VanDerWaalsContact CE1-CZ 3.41Å; F1034-F1105 HydrophobicContact CE2-CZ 4.19Å; F1034-F1105 HydrophobicContact CG-CZ 4.21Å; F1034-F1105 HydrophobicContact CZ-CE2 4.39Å; F1034-F1105 AromaticContact CZ-CZ 3.7Å; F1034-F1105 HydrophobicContact CZ-CZ 3.7Å
1035Q88.9Confident88.5Confident88 Ų8836 Ų3641%0.41120%0.197SC..Hα-helixtrans-66.7-50.7168.3-74.6171.611.400111.9A1031 E1032 F1033 F1037 D1038 F1039A1031-Q1035 VanDerWaalsContact O-CG 3.23Å; A1031-Q1035 WeakPolarHBondContact O-CG 3.41Å; A1031-Q1035 PolarHBondContact O-N 3.42Å; E1032-Q1035 PolarHBondContact O-N 3.12Å; F1033-Q1035 VanDerWaalsContact C-N 3.25Å; F1033-Q1035 PolarHBondContact O-N 3.36Å; Q1035-F1037 VanDerWaalsContact C-N 3.3Å; Q1035-F1037 PolarHBondContact O-N 2.75Å; Q1035-D1038 WeakPolarHBondContact O-CB 3.47Å; Q1035-D1038 PolarHBondContact O-N 3.34Å; Q1035-F1039 WeakPolarHBondContact O-CD2 3.2Å; Q1035-F1039 PolarHBondContact O-N 3.42Å
1036E90.8Very high88.9Confident25 Ų2539 Ų3912%0.11721%0.214CC..Hα-helixtrans-65-35.1176.9-68.9-63.7157.900112L996 C1000 E1032 F1033 F1039 A1040L996-E1036 HydrophobicContact CD2-CB 4.45Å; L996-E1036 HydrophobicContact CD2-CG 3.94Å; L996-E1036 HydrophobicContact CG-CB 4.34Å; L996-E1036 HydrophobicContact CG-CG 4.17Å; C1000-E1036 HydrophobicContact CB-CB 4.48Å; E1032-E1036 PolarHBondContact O-N 3.27Å; E1032-E1036 VanDerWaalsContact O-N 3.13Å; F1033-E1036 PolarHBondContact O-N 2.96Å; E1036-F1039 PolarHBondContact O-N 3.27Å; E1036-A1040 PolarHBondContact O-N 3.5Å
1037F93.8Very high89.1Confident5 Ų542.7 Ų42.72%0.02223%0.233CC..Hα-helixtrans-61.6-44172.1-179.9-89.3000112.2W1019 F1033 F1034 Q1035 F1039 A1040 W1041 L1083 F1086 I1087 F1108W1019-F1037 HydrophobicContact CE3-CD2 4.46Å; W1019-F1037 HydrophobicContact CE3-CE2 4.13Å; W1019-F1037 HydrophobicContact CH2-CD2 4.37Å; W1019-F1037 AromaticContact CH2-CE2 3.93Å; W1019-F1037 HydrophobicContact CH2-CE2 3.93Å; W1019-F1037 HydrophobicContact CZ3-CD2 4.31Å; W1019-F1037 AromaticContact CZ3-CE2 3.68Å; W1019-F1037 HydrophobicContact CZ3-CE2 3.68Å; F1033-F1037 HydrophobicContact CE1-CB 4.26Å; F1033-F1037 HydrophobicContact CE1-CD2 4.38Å; F1033-F1037 HydrophobicContact CE1-CG 4.49Å; F1033-F1037 HydrophobicContact CZ-CB 4.4Å; F1033-F1037 HydrophobicContact CZ-CD2 4.13Å; F1033-F1037 VanDerWaalsContact O-CB 3.32Å; F1033-F1037 WeakPolarHBondContact O-CB 3.14Å; F1033-F1037 PolarHBondContact O-N 2.98Å; F1034-F1037 HydrophobicContact CD1-CD1 4.38Å; F1034-F1037 HydrophobicContact CD1-CG 4.5Å; Q1035-F1037 VanDerWaalsContact C-N 3.3Å; Q1035-F1037 PolarHBondContact O-N 2.75Å; F1037-F1039 VanDerWaalsContact C-N 3.29Å; F1037-F1039 PolarHBondContact O-N 3.44Å; F1037-A1040 PolarHBondContact O-N 2.84Å; F1037-A1040 VanDerWaalsContact O-N 3.16Å; F1037-W1041 WeakPolarHBondContact O-CB 3.32Å; F1037-W1041 PolarHBondContact O-N 3.21Å; F1037-L1083 HydrophobicContact CE2-CD1 3.56Å; F1037-L1083 HydrophobicContact CZ-CD1 3.6Å; F1037-L1083 HydrophobicContact CZ-CG 4.39Å; F1037-F1086 HydrophobicContact CD2-CE1 4.23Å; F1037-F1086 AromaticContact CE2-CD1 3.98Å; F1037-F1086 HydrophobicContact CE2-CD1 3.98Å; F1037-F1086 AromaticContact CE2-CE1 3.81Å; F1037-F1086 HydrophobicContact CE2-CE1 3.81Å; F1037-F1086 HydrophobicContact CZ-CD1 4.2Å; F1037-F1086 HydrophobicContact CZ-CE1 4.25Å; F1037-I1087 HydrophobicContact CE1-CD1 4.09Å; F1037-I1087 HydrophobicContact CE1-CG1 3.88Å; F1037-I1087 HydrophobicContact CZ-CD1 3.9Å; F1037-I1087 HydrophobicContact CZ-CG1 3.65Å; F1037-F1108 HydrophobicContact CD1-CE2 4.39Å; F1037-F1108 AromaticContact CE1-CE2 3.99Å; F1037-F1108 HydrophobicContact CE1-CE2 3.99Å; F1037-F1108 HydrophobicContact CE1-CZ 4.37Å
1038D91.1Very high89.8Confident13 Ų1337.2 Ų37.27%0.0721%0.205CC..Hα-helixtrans-56.5-44.4175.4-178.460.7000111F1034 Q1035 W1041 H1042 F1108 R1111F1034-D1038 WeakPolarHBondContact O-CB 3.3Å; F1034-D1038 PolarHBondContact O-N 3.02Å; Q1035-D1038 WeakPolarHBondContact O-CB 3.47Å; Q1035-D1038 PolarHBondContact O-N 3.34Å; D1038-W1041 PolarHBondContact O-N 3.13Å; D1038-H1042 PolarHBondContact O-N 3.19Å; D1038-H1042 VanDerWaalsContact O-N 3.12Å; D1038-H1042 PolarHBondContact O-ND1 2.9Å; D1038-H1042 IonicContact OD1-CE1 2.8Å; D1038-H1042 PolarHBondContact OD1-CE1 3.27Å; D1038-H1042 IonicContact OD1-ND1 3.81Å; D1038-H1042 PolarHBondContact OD1-ND1 3.48Å; D1038-H1042 IonicContact OD2-CE1 3.73Å; D1038-H1042 IonicContact OD2-ND1 3.13Å; D1038-F1108 HydrophobicContact CB-CD2 4.39Å; D1038-F1108 VanDerWaalsContact OD1-CD2 3.23Å; D1038-F1108 WeakPolarHBondContact OD1-CD2 3.49Å; D1038-R1111 IonicContact OD2-CZ 3.81Å; D1038-R1111 IonicContact OD2-NH1 2.84Å; D1038-R1111 PolarHBondContact OD2-NH1 3.41Å
1039F91.9Very high90.3Very high104 Ų10436.1 Ų36.146%0.45619%0.185SC..Hα-helixtrans-64.4-42.4176-69.6-69.7000112.6F1001 Q1035 E1036 F1037 H1042 A1043F1001-F1039 HydrophobicContact CE2-CB 4.1Å; F1001-F1039 HydrophobicContact CZ-CB 3.91Å; Q1035-F1039 WeakPolarHBondContact O-CD2 3.2Å; Q1035-F1039 PolarHBondContact O-N 3.42Å; E1036-F1039 PolarHBondContact O-N 3.27Å; F1037-F1039 VanDerWaalsContact C-N 3.29Å; F1037-F1039 PolarHBondContact O-N 3.44Å; F1039-H1042 PolarHBondContact O-N 3.14Å; F1039-A1043 PolarHBondContact O-N 3.37Å
1040A92.4Very high90.5Very high2 Ų236.1 Ų36.12%0.01719%0.186CC..Hα-helixtrans-63.6-41.2178.200000112.2C1000 F1001 E1036 F1037 A1043 Q1044C1000-A1040 HydrophobicContact CB-CB 4.13Å; C1000-A1040 WeakPolarHBondContact O-CB 3.49Å; F1001-A1040 HydrophobicContact CD2-CB 3.73Å; F1001-A1040 HydrophobicContact CE2-CB 3.82Å; F1001-A1040 HydrophobicContact CG-CB 4.14Å; F1001-A1040 HydrophobicContact CZ-CB 4.28Å; E1036-A1040 PolarHBondContact O-N 3.5Å; F1037-A1040 PolarHBondContact O-N 2.84Å; F1037-A1040 VanDerWaalsContact O-N 3.16Å; A1040-A1043 WeakPolarHBondContact O-CB 3.39Å; A1040-A1043 PolarHBondContact O-N 3.02Å; A1040-Q1044 WeakPolarHBondContact O-CG 3.42Å; A1040-Q1044 PolarHBondContact O-N 2.91Å; A1040-Q1044 VanDerWaalsContact O-N 3.07Å
1041W93.1Very high90.7Very high3 Ų333.3 Ų33.31%0.01117%0.173CC..Hα-helixtrans-59.9-48.6175.1170.4-96.7000112.2F1037 D1038 A1043 Q1044 A1045 F1051 F1052 L1083 I1087 F1108 S1112 L1149F1037-W1041 WeakPolarHBondContact O-CB 3.32Å; F1037-W1041 PolarHBondContact O-N 3.21Å; D1038-W1041 PolarHBondContact O-N 3.13Å; W1041-A1043 VanDerWaalsContact C-N 3.26Å; W1041-A1043 PolarHBondContact O-N 3.28Å; W1041-Q1044 WeakPolarHBondContact O-CB 3.39Å; W1041-Q1044 PolarHBondContact O-N 3.13Å; W1041-Q1044 VanDerWaalsContact O-N 3.12Å; W1041-A1045 PolarHBondContact O-N 3.15Å; W1041-F1051 HydrophobicContact CH2-CE2 4.31Å; W1041-F1051 AromaticContact CH2-CZ 3.61Å; W1041-F1051 HydrophobicContact CH2-CZ 3.61Å; W1041-F1051 HydrophobicContact CZ2-CZ 4.24Å; W1041-F1051 HydrophobicContact CZ3-CZ 4.31Å; W1041-F1052 AromaticContact CE2-CZ 3.85Å; W1041-F1052 HydrophobicContact CH2-CZ 4.28Å; W1041-F1052 HydrophobicContact CZ2-CE2 4.32Å; W1041-F1052 AromaticContact CZ2-CZ 3.68Å; W1041-F1052 HydrophobicContact CZ2-CZ 3.68Å; W1041-L1083 HydrophobicContact CE3-CD2 3.66Å; W1041-L1083 HydrophobicContact CE3-CG 4.31Å; W1041-L1083 HydrophobicContact CZ3-CD2 3.69Å; W1041-L1083 HydrophobicContact CZ3-CG 4.09Å; W1041-I1087 HydrophobicContact CE3-CD1 4.04Å; W1041-I1087 HydrophobicContact CH2-CD1 4.05Å; W1041-I1087 HydrophobicContact CZ3-CD1 3.62Å; W1041-F1108 HydrophobicContact CB-CE2 3.83Å; W1041-F1108 AromaticContact CD1-CE2 3.48Å; W1041-F1108 VanDerWaalsContact CD1-CE2 3.48Å; W1041-F1108 AromaticContact CD1-CZ 3.86Å; W1041-F1108 AromaticContact CD2-CE2 3.85Å; W1041-F1108 HydrophobicContact CD2-CE2 3.85Å; W1041-F1108 AromaticContact CD2-CZ 3.69Å; W1041-F1108 HydrophobicContact CD2-CZ 3.69Å; W1041-F1108 AromaticContact CE2-CZ 3.61Å; W1041-F1108 HydrophobicContact CE3-CZ 4.23Å; W1041-F1108 AromaticContact CG-CE2 3.46Å; W1041-F1108 HydrophobicContact CG-CE2 3.46Å; W1041-F1108 VanDerWaalsContact CG-CE2 3.46Å; W1041-F1108 AromaticContact CG-CZ 3.84Å; W1041-F1108 HydrophobicContact CG-CZ 3.84Å; W1041-F1108 HydrophobicContact CH2-CZ 4.47Å; W1041-F1108 HydrophobicContact CZ2-CZ 4.04Å; W1041-F1108 AromaticContact NE1-CE2 3.84Å; W1041-F1108 AromaticContact NE1-CZ 3.73Å; W1041-S1112 PolarHBondContact NE1-OG 2.97Å; W1041-L1149 HydrophobicContact CH2-CD1 4.18Å; W1041-L1149 HydrophobicContact CH2-CD2 3.8Å; W1041-L1149 HydrophobicContact CZ2-CD2 3.74Å
1042H90.4Very high91Very high22 Ų2231.9 Ų31.910%0.10216%0.161CC..Hα-helixtrans-65.6-31.2178.7-74.189.7000112.4D1038 F1039 A1045 T1046 R1111D1038-H1042 PolarHBondContact O-N 3.19Å; D1038-H1042 VanDerWaalsContact O-N 3.12Å; D1038-H1042 PolarHBondContact O-ND1 2.9Å; D1038-H1042 IonicContact OD1-CE1 2.8Å; D1038-H1042 PolarHBondContact OD1-CE1 3.27Å; D1038-H1042 IonicContact OD1-ND1 3.81Å; D1038-H1042 PolarHBondContact OD1-ND1 3.48Å; D1038-H1042 IonicContact OD2-CE1 3.73Å; D1038-H1042 IonicContact OD2-ND1 3.13Å; F1039-H1042 PolarHBondContact O-N 3.14Å; H1042-A1045 PolarHBondContact O-N 3.21Å; H1042-T1046 WeakPolarHBondContact O-CB 3.07Å; H1042-T1046 PolarHBondContact O-N 3.4Å; H1042-T1046 PolarHBondContact O-OG1 2.84Å; H1042-R1111 VanDerWaalsContact CE1-CD 3.43Å; H1042-R1111 WeakPolarHBondContact CE1-CD 3.27Å; H1042-R1111 VanDerWaalsContact NE2-CD 3.34Å; H1042-R1111 WeakPolarHBondContact NE2-CD 3.21Å; H1042-R1111 WeakPolarHBondContact NE2-CG 3.39Å; H1042-R1111 PolarHBondContact NE2-NE 2.92Å
1043A90.4Very high91Very high24 Ų2432.4 Ų32.420%0.19816%0.16CC..Hα-helixtrans-64.4-43.4171.300000111.8F1001 T1004 F1039 A1040 W1041 A1045 T1046 M1047F1001-A1043 HydrophobicContact CD1-CB 4.31Å; F1001-A1043 HydrophobicContact CE1-CB 3.68Å; F1001-A1043 HydrophobicContact CZ-CB 4.46Å; T1004-A1043 HydrophobicContact CG2-CB 4.01Å; F1039-A1043 PolarHBondContact O-N 3.37Å; A1040-A1043 WeakPolarHBondContact O-CB 3.39Å; A1040-A1043 PolarHBondContact O-N 3.02Å; W1041-A1043 VanDerWaalsContact C-N 3.26Å; W1041-A1043 PolarHBondContact O-N 3.28Å; A1043-A1045 VanDerWaalsContact C-N 3.31Å; A1043-A1045 PolarHBondContact O-N 3.24Å; A1043-T1046 PolarHBondContact O-N 3.17Å; A1043-M1047 WeakPolarHBondContact O-CB 3.5Å; A1043-M1047 VanDerWaalsContact O-CG 3.3Å; A1043-M1047 WeakPolarHBondContact O-CG 3.2Å; A1043-M1047 PolarHBondContact O-N 3.13Å
1044Q92.4Very high90.5Very high3 Ų338.3 Ų38.31%0.01419%0.188CC..Hα-helixtrans-61.3-39.3174.9-65.3177.945.500112.1T1004 A1040 W1041 M1047 R1048 L1049 H1080T1004-Q1044 HydrophobicContact CG2-CG 3.49Å; T1004-Q1044 VanDerWaalsContact CG2-CG 3.49Å; A1040-Q1044 WeakPolarHBondContact O-CG 3.42Å; A1040-Q1044 PolarHBondContact O-N 2.91Å; A1040-Q1044 VanDerWaalsContact O-N 3.07Å; W1041-Q1044 WeakPolarHBondContact O-CB 3.39Å; W1041-Q1044 PolarHBondContact O-N 3.13Å; W1041-Q1044 VanDerWaalsContact O-N 3.12Å; Q1044-M1047 PolarHBondContact O-N 3.05Å; Q1044-R1048 PolarHBondContact O-N 3.17Å; Q1044-L1049 HydrophobicContact CB-CD1 4.45Å; Q1044-L1049 HydrophobicContact CG-CD1 4.38Å; Q1044-L1049 PolarHBondContact O-N 3.05Å; Q1044-L1049 VanDerWaalsContact O-N 3.13Å; Q1044-H1080 PolarHBondContact OE1-NE2 3.48Å; Q1044-H1080 VanDerWaalsContact OE1-NE2 3.14Å
1045A89.3Confident89.8Confident2 Ų241 Ų412%0.01720%0.2CC..Hα-helixtrans-65.8-43.8176.700000112.3W1041 H1042 A1043 M1047 R1048 F1052W1041-A1045 PolarHBondContact O-N 3.15Å; H1042-A1045 PolarHBondContact O-N 3.21Å; A1043-A1045 VanDerWaalsContact C-N 3.31Å; A1043-A1045 PolarHBondContact O-N 3.24Å; A1045-M1047 VanDerWaalsContact C-N 3.33Å; A1045-M1047 PolarHBondContact O-N 3.34Å; A1045-R1048 PolarHBondContact O-N 2.97Å; A1045-F1052 VanDerWaalsContact CA-CD2 3.44Å; A1045-F1052 HydrophobicContact CB-CD1 4.09Å; A1045-F1052 HydrophobicContact CB-CD2 3.83Å; A1045-F1052 HydrophobicContact CB-CE1 3.92Å; A1045-F1052 HydrophobicContact CB-CE2 3.68Å; A1045-F1052 HydrophobicContact CB-CG 4.03Å; A1045-F1052 HydrophobicContact CB-CZ 3.7Å
1046T88.5Confident89.1Confident95 Ų9539.7 Ų39.758%0.58320%0.199SC*.Hα-helixtrans-63.8-39.1176-52.90000111.5H1042 A1043 R1048H1042-T1046 WeakPolarHBondContact O-CB 3.07Å; H1042-T1046 PolarHBondContact O-N 3.4Å; H1042-T1046 PolarHBondContact O-OG1 2.84Å; A1043-T1046 PolarHBondContact O-N 3.17Å; T1046-R1048 PolarHBondContact O-N 3.13Å
1047M89.4Confident88.2Confident110 Ų11043.4 Ų43.454%0.54223%0.226SC..THydrogen-bonded Turntrans-73.8-2174.5-70.7176.6162.900114A1043 Q1044 A1045 L1049A1043-M1047 WeakPolarHBondContact O-CB 3.5Å; A1043-M1047 VanDerWaalsContact O-CG 3.3Å; A1043-M1047 WeakPolarHBondContact O-CG 3.2Å; A1043-M1047 PolarHBondContact O-N 3.13Å; Q1044-M1047 PolarHBondContact O-N 3.05Å; A1045-M1047 VanDerWaalsContact C-N 3.33Å; A1045-M1047 PolarHBondContact O-N 3.34Å; M1047-L1049 VanDerWaalsContact C-N 3.31Å; M1047-L1049 HydrophobicContact CB-CD1 4.06Å; M1047-L1049 HydrophobicContact CB-CD2 4.45Å; M1047-L1049 HydrophobicContact CB-CG 3.81Å; M1047-L1049 PolarHBondContact O-N 3.49Å; M1047-L1049 HydrophobicContact SD-CD1 4.31Å
1048R90.5Very high87Confident50 Ų5049.2 Ų49.219%0.18926%0.264CS..THydrogen-bonded Turntrans56.140.4179.7-55.1-66.5179.5163-1.7113.3Q1044 A1045 T1046 F1052 R1053 Q1135Q1044-R1048 PolarHBondContact O-N 3.17Å; A1045-R1048 PolarHBondContact O-N 2.97Å; T1046-R1048 PolarHBondContact O-N 3.13Å; R1048-F1052 VanDerWaalsContact CD-O 3.25Å; R1048-F1052 WeakPolarHBondContact CD-O 3.2Å; R1048-R1053 WeakPolarHBondContact O-CA 3.29Å; R1048-R1053 PolarHBondContact O-N 2.86Å; R1048-Q1135 VanDerWaalsContact NH1-CA 3.35Å
1049L90.4Very high86.4Confident39 Ų3952.6 Ų52.620%0.20429%0.285CS..  trans-84151-179.6-59.7176.4000112.4F1007 Q1044 M1047 F1051 F1052 H1080F1007-L1049 HydrophobicContact CB-CD1 4.24Å; F1007-L1049 HydrophobicContact CB-CD2 4.46Å; F1007-L1049 HydrophobicContact CD1-CB 4.43Å; F1007-L1049 HydrophobicContact CD2-CB 3.95Å; F1007-L1049 HydrophobicContact CD2-CD1 3.91Å; F1007-L1049 HydrophobicContact CD2-CG 4.46Å; F1007-L1049 HydrophobicContact CE1-CB 4.43Å; F1007-L1049 HydrophobicContact CE2-CB 3.95Å; F1007-L1049 HydrophobicContact CG-CB 4.19Å; F1007-L1049 HydrophobicContact CG-CD1 4.21Å; F1007-L1049 HydrophobicContact CZ-CB 4.2Å; Q1044-L1049 HydrophobicContact CB-CD1 4.45Å; Q1044-L1049 HydrophobicContact CG-CD1 4.38Å; Q1044-L1049 PolarHBondContact O-N 3.05Å; Q1044-L1049 VanDerWaalsContact O-N 3.13Å; M1047-L1049 VanDerWaalsContact C-N 3.31Å; M1047-L1049 HydrophobicContact CB-CD1 4.06Å; M1047-L1049 HydrophobicContact CB-CD2 4.45Å; M1047-L1049 HydrophobicContact CB-CG 3.81Å; M1047-L1049 PolarHBondContact O-N 3.49Å; M1047-L1049 HydrophobicContact SD-CD1 4.31Å; L1049-F1051 PolarHBondContact O-N 3.19Å; L1049-F1052 WeakPolarHBondContact O-CB 3.35Å; L1049-F1052 PolarHBondContact O-N 3.45Å; L1049-H1080 PolarHBondContact O-CE1 2.98Å
1050G90.8Very high85.9Confident6 Ų649.5 Ų49.56%0.06227%0.273CS..G310 helixtrans54.9-122.7175.500000113.5F1052 R1053 P1075 F1076G1050-F1052 PolarHBondContact O-N 3.21Å; G1050-R1053 WeakPolarHBondContact O-CB 3.45Å; G1050-R1053 PolarHBondContact O-N 3.03Å; G1050-P1075 WeakPolarHBondContact O-CB 3.45Å; G1050-F1076 WeakPolarHBondContact CA-O 3.35Å
1051F90.5Very high85.7Confident1 Ų149.9 Ų49.90%0.00428%0.275CS..G310 helixtrans-74.5-2.1178.762.3-127.1000114.4W1041 L1049 R1053 V1077 H1080 V1084 F1136 S1137 A1142 A1145 L1149W1041-F1051 HydrophobicContact CH2-CE2 4.31Å; W1041-F1051 AromaticContact CH2-CZ 3.61Å; W1041-F1051 HydrophobicContact CH2-CZ 3.61Å; W1041-F1051 HydrophobicContact CZ2-CZ 4.24Å; W1041-F1051 HydrophobicContact CZ3-CZ 4.31Å; L1049-F1051 PolarHBondContact O-N 3.19Å; F1051-R1053 VanDerWaalsContact C-N 3.33Å; F1051-V1077 HydrophobicContact CB-CG1 3.83Å; F1051-H1080 HydrophobicContact CD1-CB 3.5Å; F1051-H1080 VanDerWaalsContact CD1-CB 3.5Å; F1051-H1080 AromaticContact CD1-CG 3.78Å; F1051-H1080 AromaticContact CD1-ND1 3.27Å; F1051-H1080 VanDerWaalsContact CD1-ND1 3.27Å; F1051-H1080 WeakPolarHBondContact CD1-ND1 3.34Å; F1051-H1080 AromaticContact CD2-ND1 3.69Å; F1051-H1080 HydrophobicContact CE1-CB 3.45Å; F1051-H1080 VanDerWaalsContact CE1-CB 3.45Å; F1051-H1080 AromaticContact CE1-CG 3.71Å; F1051-H1080 AromaticContact CE1-ND1 3.38Å; F1051-H1080 WeakPolarHBondContact CE1-ND1 3.39Å; F1051-H1080 AromaticContact CE2-ND1 3.75Å; F1051-H1080 HydrophobicContact CG-CB 4.46Å; F1051-H1080 AromaticContact CG-ND1 3.43Å; F1051-H1080 WeakPolarHBondContact CG-ND1 3.21Å; F1051-H1080 HydrophobicContact CZ-CB 4.35Å; F1051-H1080 AromaticContact CZ-ND1 3.59Å; F1051-H1080 PolarHBondContact N-ND1 3.34Å; F1051-V1084 HydrophobicContact CE1-CG2 3.84Å; F1051-V1084 HydrophobicContact CZ-CG2 4.34Å; F1051-F1136 AromaticContact CD2-CD1 3.77Å; F1051-F1136 HydrophobicContact CD2-CD1 3.77Å; F1051-F1136 HydrophobicContact CD2-CE1 4.02Å; F1051-F1136 AromaticContact CE2-CD1 3.73Å; F1051-F1136 HydrophobicContact CE2-CD1 3.73Å; F1051-F1136 AromaticContact CE2-CE1 3.47Å; F1051-F1136 HydrophobicContact CE2-CE1 3.47Å; F1051-F1136 VanDerWaalsContact CE2-CE1 3.47Å; F1051-F1136 HydrophobicContact CZ-CE1 4.19Å; F1051-S1137 WeakPolarHBondContact O-CB 3.4Å; F1051-S1137 PolarHBondContact O-N 2.77Å; F1051-A1142 HydrophobicContact CB-CB 3.7Å; F1051-A1145 HydrophobicContact CD1-CB 3.61Å; F1051-A1145 HydrophobicContact CE1-CB 3.98Å; F1051-L1149 HydrophobicContact CZ-CD2 4.33Å
1052F91.8Very high85.4Confident2 Ų249.9 Ų49.91%0.00928%0.276CS..G310 helixtrans-89.9-1.4169.6-58.1-67.4000112.6W1041 A1045 R1048 L1049 G1050 Q1054 H1080 Q1135 F1136W1041-F1052 AromaticContact CE2-CZ 3.85Å; W1041-F1052 HydrophobicContact CH2-CZ 4.28Å; W1041-F1052 HydrophobicContact CZ2-CE2 4.32Å; W1041-F1052 AromaticContact CZ2-CZ 3.68Å; W1041-F1052 HydrophobicContact CZ2-CZ 3.68Å; A1045-F1052 VanDerWaalsContact CA-CD2 3.44Å; A1045-F1052 HydrophobicContact CB-CD1 4.09Å; A1045-F1052 HydrophobicContact CB-CD2 3.83Å; A1045-F1052 HydrophobicContact CB-CE1 3.92Å; A1045-F1052 HydrophobicContact CB-CE2 3.68Å; A1045-F1052 HydrophobicContact CB-CG 4.03Å; A1045-F1052 HydrophobicContact CB-CZ 3.7Å; R1048-F1052 VanDerWaalsContact CD-O 3.25Å; R1048-F1052 WeakPolarHBondContact CD-O 3.2Å; L1049-F1052 WeakPolarHBondContact O-CB 3.35Å; L1049-F1052 PolarHBondContact O-N 3.45Å; G1050-F1052 PolarHBondContact O-N 3.21Å; F1052-Q1054 PolarHBondContact O-N 3.05Å; F1052-H1080 AromaticContact CD2-CE1 3.5Å; F1052-H1080 VanDerWaalsContact CD2-CE1 3.5Å; F1052-H1080 WeakPolarHBondContact CD2-CE1 3.41Å; F1052-H1080 AromaticContact CE2-CE1 3.7Å; F1052-Q1135 WeakPolarHBondContact CA-O 3.38Å; F1052-Q1135 HydrophobicContact CD1-CB 4.15Å; F1052-F1136 HydrophobicContact CD1-CD1 4.31Å; F1052-F1136 HydrophobicContact CD1-CE1 4.43Å; F1052-F1136 HydrophobicContact CE1-CD1 4.01Å; F1052-F1136 AromaticContact CE1-CE1 3.68Å; F1052-F1136 HydrophobicContact CE1-CE1 3.68Å; F1052-F1136 HydrophobicContact CE1-CE2 4.23Å; F1052-F1136 HydrophobicContact CE1-CG 4.43Å; F1052-F1136 AromaticContact CE1-CZ 3.79Å; F1052-F1136 HydrophobicContact CE1-CZ 3.79Å; F1052-F1136 HydrophobicContact CZ-CE1 4.31Å; F1052-F1136 HydrophobicContact CZ-CZ 4.45Å
1053R88.9Confident85.1Confident78 Ų7849.5 Ų49.529%0.29428%0.276SS..PPolyproline II helixtrans-57.5129.7179.6-173.8-174178.1-163.90.5110.5R1048 G1050 F1051 E1055 N1073 P1074 P1075 S1137R1048-R1053 WeakPolarHBondContact O-CA 3.29Å; R1048-R1053 PolarHBondContact O-N 2.86Å; G1050-R1053 WeakPolarHBondContact O-CB 3.45Å; G1050-R1053 PolarHBondContact O-N 3.03Å; F1051-R1053 VanDerWaalsContact C-N 3.33Å; R1053-E1055 PolarHBondContact O-N 3.38Å; R1053-N1073 PolarHBondContact NH1-O 3.36Å; R1053-N1073 PolarHBondContact NH1-OD1 3.38Å; R1053-N1073 PolarHBondContact NH2-ND2 3.42Å; R1053-N1073 PolarHBondContact NH2-OD1 2.78Å; R1053-P1074 PolarHBondContact NH1-O 3.08Å; R1053-P1075 HydrophobicContact CB-CB 4.18Å; R1053-S1137 WeakPolarHBondContact O-CB 3.28Å
1054Q82.2Confident84.7Confident124 Ų12448.7 Ų48.758%0.57927%0.269SS*.PPolyproline II helixtrans-65.9127.3171.5-171.6170.42.600109.4F1052F1052-Q1054 PolarHBondContact O-N 3.05Å
1055E77.7Confident83.6Confident64 Ų6455.1 Ų55.130%0.29929%0.293SS..PPolyproline II helixtrans-70.9128.1-179.3-165166-170.400109.2R1053 H1139 Q1188R1053-E1055 PolarHBondContact O-N 3.38Å; E1055-H1139 IonicContact OE1-CD2 2.88Å; E1055-Q1188 PolarHBondContact OE1-NE2 3.44Å
1056P75.7Confident82.6Confident61 Ų6157.3 Ų57.340%0.39631%0.308SS..PPolyproline II helixtrans-64155.1171.828.9-33.6000109.7
1057P70.2Confident81.6Confident103 Ų10356 Ų5667%0.66930%0.303SS*.PPolyproline II helixtrans-55.9134.6175.522.3-31.6000110V1059P1057-V1059 PolarHBondContact O-N 3.3Å
1058P70.1Confident80.6Confident127 Ų12759 Ų5983%0.82531%0.313SS*.PPolyproline II helixtrans-63.4127-17625.1-33.1000110.3D1060P1058-D1060 PolarHBondContact O-N 3.16Å
1059V76.8Confident79.7Confident84 Ų8460.4 Ų60.451%0.50932%0.322SS..PPolyproline II helixtrans-77.8121.1173-178.80000107.8P1057 P1061 V1064P1057-V1059 PolarHBondContact O-N 3.3Å; V1059-P1061 WeakPolarHBondContact O-CD 3.49Å; V1059-V1064 HydrophobicContact CG1-CG2 4.08Å
1060D83.3Confident79.1Confident40 Ų4059 Ų5921%0.21431%0.314CS..PPolyproline II helixtrans-69.3116.8172178.9-1.7000108.7P1058 L1062 A1063 V1064 S1464P1058-D1060 PolarHBondContact O-N 3.16Å; D1060-L1062 PolarHBondContact O-N 2.96Å; D1060-L1062 WeakPolarHBondContact OD1-CB 3.44Å; D1060-L1062 PolarHBondContact OD1-N 3.29Å; D1060-A1063 HydrophobicContact CB-CB 4.03Å; D1060-A1063 PolarHBondContact O-N 3.36Å; D1060-V1064 VanDerWaalsContact O-CG2 3.27Å; D1060-V1064 WeakPolarHBondContact O-CG2 3.14Å; D1060-S1464 WeakPolarHBondContact OD2-CB 3.46Å
1061P86.4Confident78.5Confident9 Ų963.4 Ų63.46%0.05834%0.34CS..THydrogen-bonded Turntrans-61.6-16.2-179.526.1-35000112.9V1059 L1070 N1715 V1716V1059-P1061 WeakPolarHBondContact O-CD 3.49Å; P1061-L1070 HydrophobicContact CB-CD2 4Å; P1061-N1715 HydrophobicContact CB-CB 4.43Å; P1061-N1715 WeakPolarHBondContact O-CB 3.29Å; P1061-N1715 PolarHBondContact O-ND2 2.74Å; P1061-V1716 HydrophobicContact CB-CG2 4.02Å; P1061-V1716 HydrophobicContact CG-CG2 3.88Å
1062L87.7Confident77.9Confident4 Ų465.2 Ų65.22%0.02135%0.352CS..THydrogen-bonded Turntrans-88.2-7.1176-48.5-176.2000112.6D1060 Y1501 L1712 V1716 H1815 S1818 F1819D1060-L1062 PolarHBondContact O-N 2.96Å; D1060-L1062 WeakPolarHBondContact OD1-CB 3.44Å; D1060-L1062 PolarHBondContact OD1-N 3.29Å; L1062-Y1501 WeakPolarHBondContact CB-OH 3.4Å; L1062-Y1501 WeakPolarHBondContact O-CE2 3.27Å; L1062-Y1501 PolarHBondContact O-OH 3.08Å; L1062-L1712 HydrophobicContact CB-CD2 4.26Å; L1062-L1712 HydrophobicContact CD2-CB 3.92Å; L1062-L1712 HydrophobicContact CD2-CD2 4.01Å; L1062-L1712 HydrophobicContact CD2-CG 4.39Å; L1062-V1716 HydrophobicContact CD2-CG2 4.11Å; L1062-H1815 HydrophobicContact CD1-CB 4.28Å; L1062-S1818 VanDerWaalsContact CD1-CB 3.44Å; L1062-F1819 HydrophobicContact CD2-CZ 4.44Å
1063A85Confident77.5Confident13 Ų1369.5 Ų69.511%0.10738%0.375CS..SBendtrans-128.545.6-173.400000113.2D1060 P1465 Y1493 V1497D1060-A1063 HydrophobicContact CB-CB 4.03Å; D1060-A1063 PolarHBondContact O-N 3.36Å; A1063-P1465 HydrophobicContact CB-CG 3.94Å; A1063-Y1493 HydrophobicContact CB-CD1 4.08Å; A1063-Y1493 HydrophobicContact CB-CE1 3.53Å; A1063-V1497 HydrophobicContact CB-CG1 4Å; A1063-V1497 WeakPolarHBondContact O-CG2 3.47Å
1064V80.1Confident77.5Confident8 Ų868.1 Ų68.15%0.04838%0.376CS..  trans-103.9140.7-170.6-168.40000111.9V1059 D1060 S1066 E1069 L1070V1059-V1064 HydrophobicContact CG1-CG2 4.08Å; D1060-V1064 VanDerWaalsContact O-CG2 3.27Å; D1060-V1064 WeakPolarHBondContact O-CG2 3.14Å; V1064-S1066 WeakPolarHBondContact CG1-O 3.36Å; V1064-E1069 HydrophobicContact CG1-CB 3.68Å; V1064-E1069 HydrophobicContact CG1-CG 4.43Å; V1064-E1069 VanDerWaalsContact CG1-OE2 3.22Å; V1064-E1069 WeakPolarHBondContact CG1-OE2 3.47Å; V1064-L1070 HydrophobicContact CB-CG 4.43Å; V1064-L1070 HydrophobicContact CG1-CD1 4.27Å; V1064-L1070 HydrophobicContact CG1-CG 3.93Å; V1064-L1070 HydrophobicContact CG2-CD1 4.32Å; V1064-L1070 HydrophobicContact CG2-CD2 3.66Å; V1064-L1070 HydrophobicContact CG2-CG 3.96Å
1065R69.4Low77.9Confident137 Ų13762.7 Ų62.752%0.51735%0.351SS..SBendtrans-79.7-42.6177.1-56.7174.3-173.6-158.2-7.8112.1E1069 P1494 V1497R1065-E1069 PolarHBondContact N-OE2 2.83Å; R1065-P1494 HydrophobicContact CG-CG 3.97Å; R1065-V1497 HydrophobicContact CG-CG2 3.82Å
1066S68.7Low78.5Confident48 Ų4864.4 Ų64.434%0.33636%0.358SS..SBendtrans-142.4151.1-175.880.90000111.7V1064 K1068 E1069V1064-S1066 WeakPolarHBondContact CG1-O 3.36Å; S1066-K1068 PolarHBondContact O-N 3.41Å; S1066-K1068 PolarHBondContact OG-N 2.81Å; S1066-E1069 PolarHBondContact O-N 2.83Å; S1066-E1069 VanDerWaalsContact O-N 3.13Å
1067S66.9Low79.3Confident68 Ų6862 Ų6248%0.47634%0.343SS..G310 helixtrans-61.3-16177.558.50000114.2E1069 L1070S1067-E1069 VanDerWaalsContact C-N 3.31Å; S1067-L1070 PolarHBondContact O-N 3.39Å
1068K68.9Low80.3Confident174 Ų17462.6 Ų62.676%0.75733%0.334SS*.G310 helixtrans-70-27.4177.7-64.4-177.7178.8178.30112.6S1066 L1070 T1071S1066-K1068 PolarHBondContact O-N 3.41Å; S1066-K1068 PolarHBondContact OG-N 2.81Å; K1068-L1070 VanDerWaalsContact C-N 3.26Å; K1068-L1070 PolarHBondContact O-N 3Å; K1068-T1071 PolarHBondContact O-OG1 3.4Å
1069E71.7Confident81.4Confident79 Ų7956.5 Ų56.537%0.36930%0.295SS..G310 helixtrans-74.2-16.4179.5-67.2172178.700113.1V1064 R1065 S1066 S1067 T1071V1064-E1069 HydrophobicContact CG1-CB 3.68Å; V1064-E1069 HydrophobicContact CG1-CG 4.43Å; V1064-E1069 VanDerWaalsContact CG1-OE2 3.22Å; V1064-E1069 WeakPolarHBondContact CG1-OE2 3.47Å; R1065-E1069 PolarHBondContact N-OE2 2.83Å; S1066-E1069 PolarHBondContact O-N 2.83Å; S1066-E1069 VanDerWaalsContact O-N 3.13Å; S1067-E1069 VanDerWaalsContact C-N 3.31Å; E1069-T1071 VanDerWaalsContact C-N 3.34Å
1070L79.1Confident82.2Confident8 Ų852.5 Ų52.54%0.04227%0.271CS..G310 helixtrans-85.70.1-175.3-76.2165.3000114P1061 V1064 S1067 K1068 N1715 R1718 S1719P1061-L1070 HydrophobicContact CB-CD2 4Å; V1064-L1070 HydrophobicContact CB-CG 4.43Å; V1064-L1070 HydrophobicContact CG1-CD1 4.27Å; V1064-L1070 HydrophobicContact CG1-CG 3.93Å; V1064-L1070 HydrophobicContact CG2-CD1 4.32Å; V1064-L1070 HydrophobicContact CG2-CD2 3.66Å; V1064-L1070 HydrophobicContact CG2-CG 3.96Å; S1067-L1070 PolarHBondContact O-N 3.39Å; K1068-L1070 VanDerWaalsContact C-N 3.26Å; K1068-L1070 PolarHBondContact O-N 3Å; L1070-N1715 HydrophobicContact CD1-CB 3.71Å; L1070-N1715 HydrophobicContact CD2-CB 4.38Å; L1070-N1715 WeakPolarHBondContact CD2-O 3.39Å; L1070-R1718 HydrophobicContact CB-CB 3.88Å; L1070-R1718 HydrophobicContact CD1-CB 4.08Å; L1070-R1718 CarbonylContact O-C 3.57Å; L1070-S1719 WeakPolarHBondContact O-CA 3.34Å
1071T76.9Confident82.6Confident100 Ų10052.3 Ų52.361%0.61327%0.268SS*.SBendtrans-71.3131.8-179.750.40000110.6K1068 E1069 N1073K1068-T1071 PolarHBondContact O-OG1 3.4Å; E1069-T1071 VanDerWaalsContact C-N 3.34Å; T1071-N1073 PolarHBondContact O-N 3.27Å
1072P78.9Confident82.7Confident39 Ų3952.9 Ų52.925%0.25327%0.274SS..  trans-57.9134.9176-23.732.6000111.2P1074 T1191 D1721P1072-P1074 VanDerWaalsContact O-CD 3.26Å; P1072-P1074 WeakPolarHBondContact O-CD 3.39Å; P1072-T1191 HydrophobicContact CB-CG2 4.26Å; P1072-D1721 HydrophobicContact CG-CB 3.6Å
1073N83.3Confident82.9Confident92 Ų9252.7 Ų52.749%0.49227%0.273SS..  trans-120.160.2179.7-169.3-2000111.5R1053 T1071R1053-N1073 PolarHBondContact NH1-O 3.36Å; R1053-N1073 PolarHBondContact NH1-OD1 3.38Å; R1053-N1073 PolarHBondContact NH2-ND2 3.42Å; R1053-N1073 PolarHBondContact NH2-OD1 2.78Å; T1071-N1073 PolarHBondContact O-N 3.27Å
1074P87.7Confident83.4Confident49 Ų4952.1 Ų52.132%0.31827%0.267SS..  trans-66.3153.4-176.429.1-35.6000112R1053 P1072 A1141R1053-P1074 PolarHBondContact NH1-O 3.08Å; P1072-P1074 VanDerWaalsContact O-CD 3.26Å; P1072-P1074 WeakPolarHBondContact O-CD 3.39Å; P1074-A1141 HydrophobicContact CB-CB 3.82Å
1075P90.9Very high83.8Confident9 Ų956.6 Ų56.66%0.05829%0.288CS..  trans-61.2138.2168.925.8-33.5000111.1G1050 R1053 V1077 H1139 A1141 A1142G1050-P1075 WeakPolarHBondContact O-CB 3.45Å; R1053-P1075 HydrophobicContact CB-CB 4.18Å; P1075-V1077 HydrophobicContact CB-CG1 4.05Å; P1075-V1077 HydrophobicContact CG-CG1 4.04Å; P1075-V1077 PolarHBondContact O-N 2.94Å; P1075-H1139 WeakPolarHBondContact CD-ND1 3.49Å; P1075-H1139 HydrophobicContact CG-CB 4.03Å; P1075-A1141 HydrophobicContact CG-CB 4.29Å; P1075-A1142 HydrophobicContact CG-CB 4.25Å
1076F90.9Very high84.9Confident100 Ų10050.3 Ų50.344%0.43926%0.264SS..  trans-78.984.5178.5-174.5-126.5000111.1F1007 V1009 G1050 K1078 P1079F1007-F1076 HydrophobicContact CD1-CD1 4.2Å; F1007-F1076 HydrophobicContact CE1-CD1 4.2Å; F1007-F1076 WeakPolarHBondContact CE1-O 3.44Å; V1009-F1076 HydrophobicContact CG2-CE1 4.08Å; V1009-F1076 HydrophobicContact CG2-CE2 4.34Å; V1009-F1076 HydrophobicContact CG2-CZ 3.52Å; G1050-F1076 WeakPolarHBondContact CA-O 3.35Å; F1076-K1078 HydrophobicContact CE2-CB 4.16Å; F1076-K1078 HydrophobicContact CE2-CD 4.17Å; F1076-K1078 HydrophobicContact CE2-CG 4.26Å; F1076-K1078 HydrophobicContact CZ-CB 4.39Å; F1076-P1079 HydrophobicContact CD1-CG 3.99Å; F1076-P1079 HydrophobicContact CE1-CG 3.63Å; F1076-P1079 HydrophobicContact CZ-CG 4.37Å
1077V92.2Very high86Confident12 Ų1248 Ų487%0.07325%0.248CC..  trans-88.9-9.3-170.5-60.40000115.2F1051 P1075 H1080 K1081 A1141 A1142F1051-V1077 HydrophobicContact CB-CG1 3.83Å; P1075-V1077 HydrophobicContact CB-CG1 4.05Å; P1075-V1077 HydrophobicContact CG-CG1 4.04Å; P1075-V1077 PolarHBondContact O-N 2.94Å; V1077-H1080 CarbonylContact O-C 3.6Å; V1077-H1080 WeakPolarHBondContact O-CA 3.49Å; V1077-H1080 WeakPolarHBondContact O-CB 3.38Å; V1077-H1080 PolarHBondContact O-N 3.01Å; V1077-K1081 PolarHBondContact O-N 3.05Å; V1077-A1141 VanDerWaalsContact CG2-O 3.31Å; V1077-A1141 WeakPolarHBondContact CG2-O 3.42Å; V1077-A1142 HydrophobicContact CG1-CB 4.07Å
1078K91.1Very high87.1Confident114 Ų11445.4 Ų45.450%0.49623%0.229SC..Hα-helixtrans-55.1-45.8-173-67.4-171.9178.7-173.90113.6V1009 F1076 H1080 K1081 A1082V1009-K1078 HydrophobicContact CG2-CB 3.49Å; V1009-K1078 VanDerWaalsContact CG2-CB 3.49Å; V1009-K1078 HydrophobicContact CG2-CD 4.4Å; F1076-K1078 HydrophobicContact CE2-CB 4.16Å; F1076-K1078 HydrophobicContact CE2-CD 4.17Å; F1076-K1078 HydrophobicContact CE2-CG 4.26Å; F1076-K1078 HydrophobicContact CZ-CB 4.39Å; K1078-H1080 VanDerWaalsContact C-N 3.31Å; K1078-H1080 PolarHBondContact O-N 3.27Å; K1078-K1081 WeakPolarHBondContact O-CB 3.23Å; K1078-K1081 PolarHBondContact O-N 2.72Å; K1078-K1081 VanDerWaalsContact O-N 3.09Å; K1078-A1082 PolarHBondContact O-N 3.13Å
1079P92.7Very high87.9Confident0 Ų038.5 Ų38.50%020%0.2CC..Hα-helixtrans-59.5-42.2175.3-22.934.2000112F1007 V1009 M1012 F1076 K1081 A1082 L1083F1007-P1079 HydrophobicContact CD1-CG 4.12Å; F1007-P1079 HydrophobicContact CE1-CB 4.1Å; F1007-P1079 HydrophobicContact CE1-CG 3.76Å; F1007-P1079 HydrophobicContact CE2-CB 3.98Å; F1007-P1079 HydrophobicContact CE2-CG 4.48Å; F1007-P1079 HydrophobicContact CZ-CB 3.76Å; F1007-P1079 HydrophobicContact CZ-CG 3.96Å; V1009-P1079 HydrophobicContact CG2-CG 3.89Å; M1012-P1079 HydrophobicContact CB-CB 3.95Å; M1012-P1079 HydrophobicContact CE-CB 4.11Å; M1012-P1079 HydrophobicContact CG-CB 4.21Å; M1012-P1079 WeakPolarHBondContact CG-O 3.09Å; F1076-P1079 HydrophobicContact CD1-CG 3.99Å; F1076-P1079 HydrophobicContact CE1-CG 3.63Å; F1076-P1079 HydrophobicContact CZ-CG 4.37Å; P1079-K1081 VanDerWaalsContact C-N 3.32Å; P1079-K1081 PolarHBondContact O-N 3.41Å; P1079-A1082 PolarHBondContact O-N 3.35Å; P1079-L1083 PolarHBondContact O-N 3.39Å
1080H93.9Very high88.7Confident0 Ų035.5 Ų35.50%019%0.188CC..Hα-helixtrans-67.3-28.9176.4-78.5-175.4000113.6F1007 Q1044 L1049 F1051 F1052 V1077 K1078 A1082 L1083 V1084F1007-H1080 AromaticContact CE2-CD2 3.46Å; F1007-H1080 VanDerWaalsContact CE2-CD2 3.46Å; F1007-H1080 WeakPolarHBondContact CE2-CD2 3.45Å; F1007-H1080 AromaticContact CE2-NE2 3.32Å; F1007-H1080 VanDerWaalsContact CE2-NE2 3.32Å; F1007-H1080 WeakPolarHBondContact CE2-NE2 3.39Å; F1007-H1080 AromaticContact CZ-CD2 3.45Å; F1007-H1080 VanDerWaalsContact CZ-CD2 3.45Å; F1007-H1080 WeakPolarHBondContact CZ-CD2 3.41Å; F1007-H1080 AromaticContact CZ-NE2 3.47Å; F1007-H1080 WeakPolarHBondContact CZ-NE2 3.36Å; Q1044-H1080 PolarHBondContact OE1-NE2 3.48Å; Q1044-H1080 VanDerWaalsContact OE1-NE2 3.14Å; L1049-H1080 PolarHBondContact O-CE1 2.98Å; F1051-H1080 HydrophobicContact CD1-CB 3.5Å; F1051-H1080 VanDerWaalsContact CD1-CB 3.5Å; F1051-H1080 AromaticContact CD1-CG 3.78Å; F1051-H1080 AromaticContact CD1-ND1 3.27Å; F1051-H1080 VanDerWaalsContact CD1-ND1 3.27Å; F1051-H1080 WeakPolarHBondContact CD1-ND1 3.34Å; F1051-H1080 AromaticContact CD2-ND1 3.69Å; F1051-H1080 HydrophobicContact CE1-CB 3.45Å; F1051-H1080 VanDerWaalsContact CE1-CB 3.45Å; F1051-H1080 AromaticContact CE1-CG 3.71Å; F1051-H1080 AromaticContact CE1-ND1 3.38Å; F1051-H1080 WeakPolarHBondContact CE1-ND1 3.39Å; F1051-H1080 AromaticContact CE2-ND1 3.75Å; F1051-H1080 HydrophobicContact CG-CB 4.46Å; F1051-H1080 AromaticContact CG-ND1 3.43Å; F1051-H1080 WeakPolarHBondContact CG-ND1 3.21Å; F1051-H1080 HydrophobicContact CZ-CB 4.35Å; F1051-H1080 AromaticContact CZ-ND1 3.59Å; F1051-H1080 PolarHBondContact N-ND1 3.34Å; F1052-H1080 AromaticContact CD2-CE1 3.5Å; F1052-H1080 VanDerWaalsContact CD2-CE1 3.5Å; F1052-H1080 WeakPolarHBondContact CD2-CE1 3.41Å; F1052-H1080 AromaticContact CE2-CE1 3.7Å; V1077-H1080 CarbonylContact O-C 3.6Å; V1077-H1080 WeakPolarHBondContact O-CA 3.49Å; V1077-H1080 WeakPolarHBondContact O-CB 3.38Å; V1077-H1080 PolarHBondContact O-N 3.01Å; K1078-H1080 VanDerWaalsContact C-N 3.31Å; K1078-H1080 PolarHBondContact O-N 3.27Å; H1080-A1082 VanDerWaalsContact C-N 3.34Å; H1080-L1083 PolarHBondContact O-N 3.5Å; H1080-V1084 WeakPolarHBondContact O-CB 3.44Å; H1080-V1084 WeakPolarHBondContact O-CG2 3.45Å; H1080-V1084 PolarHBondContact O-N 3.42Å
1081K92.2Very high89.1Confident36 Ų3635.1 Ų35.116%0.15719%0.186CC..Hα-helixtrans-60.2-45.6173.1-75.1-171.4167.2-1650110.9V1077 K1078 P1079 V1084 Q1085 A1145 E1199 D1200V1077-K1081 PolarHBondContact O-N 3.05Å; K1078-K1081 WeakPolarHBondContact O-CB 3.23Å; K1078-K1081 PolarHBondContact O-N 2.72Å; K1078-K1081 VanDerWaalsContact O-N 3.09Å; P1079-K1081 VanDerWaalsContact C-N 3.32Å; P1079-K1081 PolarHBondContact O-N 3.41Å; K1081-V1084 PolarHBondContact O-N 3.44Å; K1081-Q1085 PolarHBondContact O-N 3.26Å; K1081-A1145 HydrophobicContact CG-CB 4.16Å; K1081-E1199 IonicContact NZ-OE2 4Å; K1081-E1199 PolarHBondContact NZ-OE2 3.1Å; K1081-D1200 VanDerWaalsContact CE-OD1 3.25Å; K1081-D1200 WeakPolarHBondContact CE-OD1 3.31Å; K1081-D1200 IonicContact NZ-OD1 3.29Å; K1081-D1200 PolarHBondContact NZ-OD1 2.95Å
1082A88.6Confident89.4Confident21 Ų2133 Ų3317%0.17417%0.171CC..Hα-helixtrans-63.2-42.7174.900000112M1012 E1013 K1078 P1079 H1080 Q1085 F1086M1012-A1082 HydrophobicContact CG-CB 4.26Å; E1013-A1082 HydrophobicContact CG-CB 4.44Å; K1078-A1082 PolarHBondContact O-N 3.13Å; P1079-A1082 PolarHBondContact O-N 3.35Å; H1080-A1082 VanDerWaalsContact C-N 3.34Å; A1082-Q1085 PolarHBondContact O-N 3.47Å; A1082-F1086 PolarHBondContact O-N 2.85Å
1083L92.5Very high89.5Confident0 Ų031.7 Ų31.70%016%0.162CC..Hα-helixtrans-62.8-44.5176.9-174.158000112.7M1012 W1019 F1037 W1041 P1079 H1080 Q1085 F1086 I1087M1012-L1083 HydrophobicContact CE-CB 4.19Å; M1012-L1083 HydrophobicContact CE-CD2 3.95Å; M1012-L1083 HydrophobicContact SD-CB 4.09Å; M1012-L1083 HydrophobicContact SD-CD1 4.1Å; M1012-L1083 HydrophobicContact SD-CD2 4.46Å; M1012-L1083 HydrophobicContact SD-CG 4.47Å; W1019-L1083 HydrophobicContact CH2-CD1 3.64Å; W1019-L1083 HydrophobicContact CZ3-CD1 3.43Å; W1019-L1083 VanDerWaalsContact CZ3-CD1 3.43Å; F1037-L1083 HydrophobicContact CE2-CD1 3.56Å; F1037-L1083 HydrophobicContact CZ-CD1 3.6Å; F1037-L1083 HydrophobicContact CZ-CG 4.39Å; W1041-L1083 HydrophobicContact CE3-CD2 3.66Å; W1041-L1083 HydrophobicContact CE3-CG 4.31Å; W1041-L1083 HydrophobicContact CZ3-CD2 3.69Å; W1041-L1083 HydrophobicContact CZ3-CG 4.09Å; P1079-L1083 PolarHBondContact O-N 3.39Å; H1080-L1083 PolarHBondContact O-N 3.5Å; L1083-Q1085 VanDerWaalsContact C-N 3.32Å; L1083-Q1085 PolarHBondContact O-N 3.36Å; L1083-F1086 WeakPolarHBondContact O-CB 3.27Å; L1083-F1086 PolarHBondContact O-N 2.99Å; L1083-I1087 HydrophobicContact CG-CD1 4.26Å; L1083-I1087 WeakPolarHBondContact O-CG1 3.38Å; L1083-I1087 PolarHBondContact O-N 3Å
1084V93.8Very high89.4Confident0 Ų027.4 Ų27.40%014%0.139CC..Hα-helixtrans-65.1-38.4177.7174.50000110.2F1051 H1080 K1081 I1087 T1088 H1148 L1149F1051-V1084 HydrophobicContact CE1-CG2 3.84Å; F1051-V1084 HydrophobicContact CZ-CG2 4.34Å; H1080-V1084 WeakPolarHBondContact O-CB 3.44Å; H1080-V1084 WeakPolarHBondContact O-CG2 3.45Å; H1080-V1084 PolarHBondContact O-N 3.42Å; K1081-V1084 PolarHBondContact O-N 3.44Å; V1084-I1087 PolarHBondContact O-N 3.44Å; V1084-T1088 WeakPolarHBondContact O-CB 3.47Å; V1084-T1088 PolarHBondContact O-N 3.19Å; V1084-T1088 PolarHBondContact O-OG1 3.1Å; V1084-H1148 HydrophobicContact CG1-CB 3.9Å; V1084-H1148 VanDerWaalsContact CG1-CG 3.48Å; V1084-L1149 HydrophobicContact CG1-CB 4Å; V1084-L1149 HydrophobicContact CG1-CD1 4.35Å; V1084-L1149 HydrophobicContact CG2-CB 4.29Å; V1084-L1149 HydrophobicContact CG2-CD1 4.35Å
1085Q90.1Very high88.9Confident103 Ų10326.2 Ų26.248%0.48113%0.129SC..Hα-helixtrans-59.8-47.2173.6-178.4177.1-9.300111.7K1081 A1082 L1083 I1087 T1088 E1089K1081-Q1085 PolarHBondContact O-N 3.26Å; A1082-Q1085 PolarHBondContact O-N 3.47Å; L1083-Q1085 VanDerWaalsContact C-N 3.32Å; L1083-Q1085 PolarHBondContact O-N 3.36Å; Q1085-I1087 VanDerWaalsContact C-N 3.34Å; Q1085-I1087 PolarHBondContact O-N 3.23Å; Q1085-T1088 PolarHBondContact O-N 3.23Å; Q1085-E1089 WeakPolarHBondContact CG-OE1 3.4Å; Q1085-E1089 PolarHBondContact NE2-OE1 3.23Å; Q1085-E1089 WeakPolarHBondContact O-CG 3.08Å; Q1085-E1089 PolarHBondContact O-N 3.23Å
1086F91.1Very high88Confident4 Ų428 Ų282%0.01814%0.136CC..Hα-helixtrans-57.7-44.3174.4171.4-102.4000112.3V1016 W1019 L1023 F1033 F1034 F1037 A1082 L1083 T1088 S1090V1016-F1086 HydrophobicContact CG1-CB 4.06Å; V1016-F1086 HydrophobicContact CG1-CD2 4.02Å; V1016-F1086 HydrophobicContact CG1-CG 4.29Å; V1016-F1086 HydrophobicContact CG2-CB 4.06Å; V1016-F1086 HydrophobicContact CG2-CG 4.41Å; W1019-F1086 HydrophobicContact CB-CE2 4.25Å; W1019-F1086 HydrophobicContact CB-CZ 4.05Å; W1019-F1086 AromaticContact CE3-CD1 3.81Å; W1019-F1086 HydrophobicContact CE3-CD1 3.81Å; W1019-F1086 AromaticContact CE3-CE1 3.71Å; W1019-F1086 HydrophobicContact CE3-CE1 3.71Å; W1019-F1086 HydrophobicContact CE3-CE2 4.48Å; W1019-F1086 HydrophobicContact CE3-CG 4.25Å; W1019-F1086 HydrophobicContact CE3-CZ 4.07Å; W1019-F1086 HydrophobicContact CZ3-CD1 4.06Å; W1019-F1086 HydrophobicContact CZ3-CE1 4.29Å; L1023-F1086 HydrophobicContact CD1-CE2 4.22Å; L1023-F1086 HydrophobicContact CD1-CZ 3.98Å; F1033-F1086 HydrophobicContact CE1-CE1 4.08Å; F1033-F1086 AromaticContact CE1-CZ 3.8Å; F1033-F1086 HydrophobicContact CE1-CZ 3.8Å; F1033-F1086 HydrophobicContact CZ-CE1 4.19Å; F1033-F1086 AromaticContact CZ-CZ 3.95Å; F1033-F1086 HydrophobicContact CZ-CZ 3.95Å; F1034-F1086 HydrophobicContact CE1-CE1 4.15Å; F1034-F1086 HydrophobicContact CE1-CZ 4.27Å; F1034-F1086 HydrophobicContact CZ-CZ 4.4Å; F1037-F1086 HydrophobicContact CD2-CE1 4.23Å; F1037-F1086 AromaticContact CE2-CD1 3.98Å; F1037-F1086 HydrophobicContact CE2-CD1 3.98Å; F1037-F1086 AromaticContact CE2-CE1 3.81Å; F1037-F1086 HydrophobicContact CE2-CE1 3.81Å; F1037-F1086 HydrophobicContact CZ-CD1 4.2Å; F1037-F1086 HydrophobicContact CZ-CE1 4.25Å; A1082-F1086 PolarHBondContact O-N 2.85Å; L1083-F1086 WeakPolarHBondContact O-CB 3.27Å; L1083-F1086 PolarHBondContact O-N 2.99Å; F1086-T1088 PolarHBondContact O-N 3.38Å; F1086-S1090 VanDerWaalsContact O-CB 3.3Å; F1086-S1090 WeakPolarHBondContact O-CB 3.35Å; F1086-S1090 PolarHBondContact O-N 3.36Å; F1086-S1090 PolarHBondContact O-OG 3.07Å
1087I92.4Very high86.9Confident0 Ų025.3 Ų25.30%013%0.129CC..Hα-helixtrans-60.7-46.2175.7-67.3163.8000110.5F1037 W1041 L1083 V1084 Q1085 S1090 V1091 F1108 F1109 L1149F1037-I1087 HydrophobicContact CE1-CD1 4.09Å; F1037-I1087 HydrophobicContact CE1-CG1 3.88Å; F1037-I1087 HydrophobicContact CZ-CD1 3.9Å; F1037-I1087 HydrophobicContact CZ-CG1 3.65Å; W1041-I1087 HydrophobicContact CE3-CD1 4.04Å; W1041-I1087 HydrophobicContact CH2-CD1 4.05Å; W1041-I1087 HydrophobicContact CZ3-CD1 3.62Å; L1083-I1087 HydrophobicContact CG-CD1 4.26Å; L1083-I1087 WeakPolarHBondContact O-CG1 3.38Å; L1083-I1087 PolarHBondContact O-N 3Å; V1084-I1087 PolarHBondContact O-N 3.44Å; Q1085-I1087 VanDerWaalsContact C-N 3.34Å; Q1085-I1087 PolarHBondContact O-N 3.23Å; I1087-S1090 PolarHBondContact O-N 3.05Å; I1087-V1091 HydrophobicContact CG2-CG2 4.06Å; I1087-V1091 VanDerWaalsContact O-CB 3.26Å; I1087-V1091 WeakPolarHBondContact O-CB 2.98Å; I1087-V1091 WeakPolarHBondContact O-CG2 3.39Å; I1087-V1091 PolarHBondContact O-N 3.45Å; I1087-F1108 HydrophobicContact CD1-CE1 4.36Å; I1087-F1108 HydrophobicContact CD1-CZ 3.88Å; I1087-F1108 HydrophobicContact CG2-CE1 4.33Å; I1087-F1109 HydrophobicContact CG2-CE1 4.4Å; I1087-F1109 HydrophobicContact CG2-CZ 4.12Å; I1087-L1149 HydrophobicContact CD1-CD1 4.34Å; I1087-L1149 HydrophobicContact CG2-CD1 4.36Å
1088T90.4Very high86Confident13 Ų1326.6 Ų26.68%0.0814%0.136CC..Hα-helixtrans-61.9-47-178.9-60.60000112.2V1084 Q1085 F1086 S1090 V1091 N1092 H1148 S1152V1084-T1088 WeakPolarHBondContact O-CB 3.47Å; V1084-T1088 PolarHBondContact O-N 3.19Å; V1084-T1088 PolarHBondContact O-OG1 3.1Å; Q1085-T1088 PolarHBondContact O-N 3.23Å; F1086-T1088 PolarHBondContact O-N 3.38Å; T1088-S1090 VanDerWaalsContact C-N 3.34Å; T1088-V1091 PolarHBondContact O-N 2.92Å; T1088-N1092 WeakPolarHBondContact O-CB 3.46Å; T1088-N1092 VanDerWaalsContact O-CG 3.23Å; T1088-N1092 PolarHBondContact O-N 3.07Å; T1088-N1092 PolarHBondContact O-ND2 3.16Å; T1088-H1148 WeakPolarHBondContact CB-NE2 3.28Å; T1088-H1148 PolarHBondContact OG1-CD2 2.91Å; T1088-H1148 PolarHBondContact OG1-NE2 3.37Å; T1088-S1152 WeakPolarHBondContact CB-OG 3.21Å; T1088-S1152 VanDerWaalsContact CG2-OG 3.28Å; T1088-S1152 WeakPolarHBondContact CG2-OG 3.36Å; T1088-S1152 PolarHBondContact OG1-OG 3.36Å
1089E86.4Confident85.2Confident30 Ų3026.6 Ų26.614%0.1413%0.133CC..Hα-helixtrans-62.1-43.6176.8-71.2177.9-158.600111P866 S867 Q1085 N1092 T1093P866-E1089 HydrophobicContact CG-CG 4.49Å; S867-E1089 VanDerWaalsContact CB-OE2 3.31Å; S867-E1089 WeakPolarHBondContact CB-OE2 3.46Å; S867-E1089 PolarHBondContact OG-OE2 3.02Å; Q1085-E1089 WeakPolarHBondContact CG-OE1 3.4Å; Q1085-E1089 PolarHBondContact NE2-OE1 3.23Å; Q1085-E1089 WeakPolarHBondContact O-CG 3.08Å; Q1085-E1089 PolarHBondContact O-N 3.23Å; E1089-N1092 PolarHBondContact O-N 3.31Å; E1089-T1093 PolarHBondContact O-N 2.72Å; E1089-T1093 PolarHBondContact O-OG1 2.94Å
1090S88.6Confident84.4Confident16 Ų1631.9 Ų31.911%0.11216%0.161CC..Hα-helixtrans-64.3-44.2178-580000112.2F1086 I1087 T1088 T1093 A1094F1086-S1090 VanDerWaalsContact O-CB 3.3Å; F1086-S1090 WeakPolarHBondContact O-CB 3.35Å; F1086-S1090 PolarHBondContact O-N 3.36Å; F1086-S1090 PolarHBondContact O-OG 3.07Å; I1087-S1090 PolarHBondContact O-N 3.05Å; T1088-S1090 VanDerWaalsContact C-N 3.34Å; S1090-T1093 PolarHBondContact O-N 3.14Å; S1090-A1094 VanDerWaalsContact O-CB 3.29Å; S1090-A1094 WeakPolarHBondContact O-CB 3.25Å; S1090-A1094 PolarHBondContact O-N 3.46Å
1091V87.2Confident83.9Confident0 Ų032.2 Ų32.20%016%0.162CC..Hα-helixtrans-64.5-42.5177163.30000111I1087 T1088 T1093 A1094 K1095 F1105 F1109 L1156I1087-V1091 HydrophobicContact CG2-CG2 4.06Å; I1087-V1091 VanDerWaalsContact O-CB 3.26Å; I1087-V1091 WeakPolarHBondContact O-CB 2.98Å; I1087-V1091 WeakPolarHBondContact O-CG2 3.39Å; I1087-V1091 PolarHBondContact O-N 3.45Å; T1088-V1091 PolarHBondContact O-N 2.92Å; V1091-T1093 VanDerWaalsContact C-N 3.33Å; V1091-T1093 PolarHBondContact O-N 3.34Å; V1091-A1094 PolarHBondContact O-N 2.68Å; V1091-K1095 WeakPolarHBondContact O-CE 3.4Å; V1091-K1095 VanDerWaalsContact O-CG 3.26Å; V1091-K1095 WeakPolarHBondContact O-CG 3.5Å; V1091-K1095 PolarHBondContact O-N 3.43Å; V1091-K1095 VanDerWaalsContact O-N 3.16Å; V1091-F1105 HydrophobicContact CG2-CB 4.1Å; V1091-F1105 HydrophobicContact CG2-CD1 3.47Å; V1091-F1105 VanDerWaalsContact CG2-CD1 3.47Å; V1091-F1105 HydrophobicContact CG2-CD2 3.87Å; V1091-F1105 HydrophobicContact CG2-CE1 3.75Å; V1091-F1105 HydrophobicContact CG2-CE2 4.12Å; V1091-F1105 HydrophobicContact CG2-CG 3.54Å; V1091-F1105 HydrophobicContact CG2-CZ 4.07Å; V1091-F1109 HydrophobicContact CG2-CE2 3.95Å; V1091-F1109 HydrophobicContact CG2-CZ 3.97Å; V1091-L1156 HydrophobicContact CG1-CB 4.08Å; V1091-L1156 HydrophobicContact CG1-CD1 4.25Å
1092N82.9Confident83.4Confident55 Ų5530.5 Ų30.529%0.29416%0.155SC..Hα-helixtrans-64.9-38.3177.3-74.5-21.9000111.8T1088 E1089 K1095 F1096T1088-N1092 WeakPolarHBondContact O-CB 3.46Å; T1088-N1092 VanDerWaalsContact O-CG 3.23Å; T1088-N1092 PolarHBondContact O-N 3.07Å; T1088-N1092 PolarHBondContact O-ND2 3.16Å; E1089-N1092 PolarHBondContact O-N 3.31Å; N1092-K1095 PolarHBondContact OD1-NZ 3.46Å; N1092-F1096 WeakPolarHBondContact O-CD2 3.15Å; N1092-F1096 VanDerWaalsContact O-CE2 3.31Å; N1092-F1096 WeakPolarHBondContact O-CE2 3.36Å
1093T80.7Confident83.1Confident12 Ų1232.2 Ų32.27%0.07416%0.162CC..Hα-helixtrans-67.7-48.5175-50.70000111.1W795 I868 E1089 S1090 V1091 K1095 F1096 C1097W795-T1093 HydrophobicContact CZ2-CG2 4.38Å; I868-T1093 HydrophobicContact CD1-CG2 3.37Å; I868-T1093 WeakPolarHBondContact CD1-OG1 3.35Å; E1089-T1093 PolarHBondContact O-N 2.72Å; E1089-T1093 PolarHBondContact O-OG1 2.94Å; S1090-T1093 PolarHBondContact O-N 3.14Å; V1091-T1093 VanDerWaalsContact C-N 3.33Å; V1091-T1093 PolarHBondContact O-N 3.34Å; T1093-K1095 VanDerWaalsContact C-N 3.28Å; T1093-K1095 PolarHBondContact O-N 3.35Å; T1093-F1096 PolarHBondContact O-N 2.85Å; T1093-C1097 PolarHBondContact O-N 3.37Å; T1093-C1097 PolarHBondContact O-SG 2.89Å
1094A80.4Confident82.8Confident2 Ų233.8 Ų33.82%0.01717%0.17CC..Hα-helixtrans-57.3-37.7-177.300000113.3S1090 V1091 F1096 C1097 N1098 L1101 V1102 F1105S1090-A1094 VanDerWaalsContact O-CB 3.29Å; S1090-A1094 WeakPolarHBondContact O-CB 3.25Å; S1090-A1094 PolarHBondContact O-N 3.46Å; V1091-A1094 PolarHBondContact O-N 2.68Å; A1094-F1096 PolarHBondContact O-N 3.01Å; A1094-F1096 VanDerWaalsContact O-N 3.07Å; A1094-C1097 PolarHBondContact O-N 3.13Å; A1094-N1098 PolarHBondContact O-N 2.94Å; A1094-N1098 VanDerWaalsContact O-N 3.07Å; A1094-L1101 HydrophobicContact CB-CB 3.71Å; A1094-L1101 HydrophobicContact CB-CD1 4.33Å; A1094-V1102 HydrophobicContact CB-CG2 4.34Å; A1094-F1105 HydrophobicContact CB-CD2 3.96Å; A1094-F1105 HydrophobicContact CB-CE2 3.88Å
1095K76.9Confident82.7Confident23 Ų2333.9 Ų33.910%0.117%0.17CC..Hα-helixtrans-53.1-29.3176-74.7168.5-153.2177.20113.4V1091 N1092 T1093 G1155 L1156 C1159 I1161V1091-K1095 WeakPolarHBondContact O-CE 3.4Å; V1091-K1095 VanDerWaalsContact O-CG 3.26Å; V1091-K1095 WeakPolarHBondContact O-CG 3.5Å; V1091-K1095 PolarHBondContact O-N 3.43Å; V1091-K1095 VanDerWaalsContact O-N 3.16Å; N1092-K1095 PolarHBondContact OD1-NZ 3.46Å; T1093-K1095 VanDerWaalsContact C-N 3.28Å; T1093-K1095 PolarHBondContact O-N 3.35Å; K1095-G1155 WeakPolarHBondContact CE-O 3.38Å; K1095-G1155 PolarHBondContact NZ-O 3.38Å; K1095-L1156 HydrophobicContact CD-CD1 4.4Å; K1095-L1156 HydrophobicContact CG-CD1 3.67Å; K1095-C1159 HydrophobicContact CD-CB 4.49Å; K1095-C1159 HydrophobicContact CG-CB 4.4Å; K1095-I1161 VanDerWaalsContact O-CD1 3.29Å; K1095-I1161 WeakPolarHBondContact O-CD1 3.05Å
1096F72.6Confident82.6Confident47 Ų4729.8 Ų29.821%0.20615%0.151CC..Hα-helixtrans-98.4-31.2-175-62.4-69.6000113.5R748 P791 H792 W795 W864 N1092 T1093 A1094R748-F1096 PolarHBondContact NH2-O 3.2Å; R748-F1096 VanDerWaalsContact NH2-O 3.13Å; P791-F1096 HydrophobicContact CG-CD1 4.35Å; P791-F1096 HydrophobicContact CG-CE1 4.31Å; H792-F1096 HydrophobicContact CB-CB 3.98Å; H792-F1096 PolarHBondContact ND1-O 2.91Å; W795-F1096 HydrophobicContact CH2-CD2 4.1Å; W795-F1096 HydrophobicContact CZ2-CB 4.45Å; W795-F1096 HydrophobicContact CZ2-CD2 4.29Å; W864-F1096 AromaticContact CE3-CE2 3.89Å; W864-F1096 HydrophobicContact CE3-CE2 3.89Å; W864-F1096 HydrophobicContact CE3-CZ 4.23Å; W864-F1096 HydrophobicContact CH2-CZ 4.43Å; W864-F1096 AromaticContact CZ3-CE2 3.82Å; W864-F1096 HydrophobicContact CZ3-CE2 3.82Å; W864-F1096 AromaticContact CZ3-CZ 3.73Å; W864-F1096 HydrophobicContact CZ3-CZ 3.73Å; N1092-F1096 WeakPolarHBondContact O-CD2 3.15Å; N1092-F1096 VanDerWaalsContact O-CE2 3.31Å; N1092-F1096 WeakPolarHBondContact O-CE2 3.36Å; T1093-F1096 PolarHBondContact O-N 2.85Å; A1094-F1096 PolarHBondContact O-N 3.01Å; A1094-F1096 VanDerWaalsContact O-N 3.07Å
1097C67.2Low82.5Confident44 Ų4433 Ų3330%0.29717%0.166SC..Hα-helixtrans-115.2-26-166.264.50000115.7H792 T1093 A1094H792-C1097 HydrophobicContact CB-CB 4.31Å; T1093-C1097 PolarHBondContact O-N 3.37Å; T1093-C1097 PolarHBondContact O-SG 2.89Å; A1094-C1097 PolarHBondContact O-N 3.13Å
1098N73.2Confident82.4Confident39 Ų3933.2 Ų33.221%0.20917%0.167CC..  trans-146.6103.9-166.7-167.3-25.1000113.3E1030 A1094 N1100 L1101 V1102E1030-N1098 PolarHBondContact OE2-ND2 2.92Å; A1094-N1098 PolarHBondContact O-N 2.94Å; A1094-N1098 VanDerWaalsContact O-N 3.07Å; N1098-N1100 VanDerWaalsContact C-N 3.34Å; N1098-N1100 PolarHBondContact O-N 3.01Å; N1098-N1100 WeakPolarHBondContact OD1-CB 3.5Å; N1098-N1100 PolarHBondContact OD1-N 3.41Å; N1098-L1101 HydrophobicContact CB-CB 4.06Å; N1098-L1101 HydrophobicContact CB-CD1 3.91Å; N1098-L1101 HydrophobicContact CB-CG 3.96Å; N1098-L1101 WeakPolarHBondContact ND2-CG 3.48Å; N1098-L1101 PolarHBondContact O-N 2.91Å; N1098-L1101 PolarHBondContact OD1-N 3.19Å; N1098-V1102 PolarHBondContact O-N 3.48Å; N1098-V1102 VanDerWaalsContact O-N 3.11Å
1099R74.4Confident82.6Confident114 Ų11432.6 Ų32.643%0.4316%0.163SC..Hα-helixtrans-61.4-38177.6-178.1178.5175.1166.83.2112.9L1101 V1102 D1103R1099-L1101 VanDerWaalsContact C-N 3.3Å; R1099-L1101 PolarHBondContact O-N 3.19Å; R1099-V1102 WeakPolarHBondContact O-CB 3.45Å; R1099-V1102 PolarHBondContact O-N 2.62Å; R1099-V1102 VanDerWaalsContact O-N 3.12Å; R1099-D1103 PolarHBondContact O-N 3.32Å
1100N77.3Confident82.7Confident110 Ų11031.8 Ų31.859%0.58816%0.159SC*.Hα-helixtrans-64.4-39.3-179.9-64.3-22.1000110.9N1098 V1102 D1103 I1104N1098-N1100 VanDerWaalsContact C-N 3.34Å; N1098-N1100 PolarHBondContact O-N 3.01Å; N1098-N1100 WeakPolarHBondContact OD1-CB 3.5Å; N1098-N1100 PolarHBondContact OD1-N 3.41Å; N1100-V1102 VanDerWaalsContact C-N 3.34Å; N1100-D1103 PolarHBondContact O-N 3.15Å; N1100-I1104 VanDerWaalsContact O-CG1 3.32Å; N1100-I1104 WeakPolarHBondContact O-CG1 3.26Å; N1100-I1104 PolarHBondContact O-N 3.02Å
1101L82Confident82.6Confident7 Ų736.5 Ų36.54%0.03717%0.174CC..Hα-helixtrans-66-37.9173.3-68.8-176.4000111.9E1030 F1034 A1094 N1098 R1099 D1103 I1104 F1105E1030-L1101 HydrophobicContact CB-CD1 4.09Å; E1030-L1101 HydrophobicContact CB-CD2 4Å; E1030-L1101 HydrophobicContact CB-CG 4.48Å; F1034-L1101 HydrophobicContact CD2-CD2 3.52Å; F1034-L1101 HydrophobicContact CE2-CD1 4.35Å; F1034-L1101 HydrophobicContact CE2-CD2 4.16Å; F1034-L1101 HydrophobicContact CG-CD2 4.38Å; A1094-L1101 HydrophobicContact CB-CB 3.71Å; A1094-L1101 HydrophobicContact CB-CD1 4.33Å; N1098-L1101 HydrophobicContact CB-CB 4.06Å; N1098-L1101 HydrophobicContact CB-CD1 3.91Å; N1098-L1101 HydrophobicContact CB-CG 3.96Å; N1098-L1101 WeakPolarHBondContact ND2-CG 3.48Å; N1098-L1101 PolarHBondContact O-N 2.91Å; N1098-L1101 PolarHBondContact OD1-N 3.19Å; R1099-L1101 VanDerWaalsContact C-N 3.3Å; R1099-L1101 PolarHBondContact O-N 3.19Å; L1101-D1103 VanDerWaalsContact C-N 3.31Å; L1101-D1103 PolarHBondContact O-N 2.91Å; L1101-I1104 HydrophobicContact CD2-CD1 4.19Å; L1101-I1104 PolarHBondContact O-N 3.39Å; L1101-F1105 HydrophobicContact CB-CD2 4.41Å; L1101-F1105 HydrophobicContact CB-CE2 4.39Å; L1101-F1105 WeakPolarHBondContact O-CB 3.37Å; L1101-F1105 WeakPolarHBondContact O-CD2 3.48Å; L1101-F1105 PolarHBondContact O-N 3.32Å
1102V82.8Confident82.8Confident0 Ų037 Ų370%018%0.178CC..Hα-helixtrans-58.9-44.2173.3167.50000111.1A1094 N1098 R1099 N1100 F1105 F1106 L1156 I1161 I1163A1094-V1102 HydrophobicContact CB-CG2 4.34Å; N1098-V1102 PolarHBondContact O-N 3.48Å; N1098-V1102 VanDerWaalsContact O-N 3.11Å; R1099-V1102 WeakPolarHBondContact O-CB 3.45Å; R1099-V1102 PolarHBondContact O-N 2.62Å; R1099-V1102 VanDerWaalsContact O-N 3.12Å; N1100-V1102 VanDerWaalsContact C-N 3.34Å; V1102-F1105 PolarHBondContact O-N 3Å; V1102-F1106 VanDerWaalsContact O-CB 3.24Å; V1102-F1106 WeakPolarHBondContact O-CB 3.17Å; V1102-F1106 PolarHBondContact O-N 3.05Å; V1102-L1156 HydrophobicContact CB-CD1 4.46Å; V1102-L1156 HydrophobicContact CG1-CD1 3.95Å; V1102-L1156 HydrophobicContact CG2-CD1 4.14Å; V1102-I1161 HydrophobicContact CB-CD1 4.43Å; V1102-I1161 HydrophobicContact CG1-CD1 4.17Å; V1102-I1161 HydrophobicContact CG2-CD1 3.73Å; V1102-I1163 HydrophobicContact CG1-CD1 3.78Å
1103D82.7Confident83.2Confident58 Ų5834.5 Ų34.531%0.3117%0.165SC..Hα-helixtrans-65.4-39.6177-68.3-29.6000111.9R1099 N1100 L1101 F1106 H1107R1099-D1103 PolarHBondContact O-N 3.32Å; N1100-D1103 PolarHBondContact O-N 3.15Å; L1101-D1103 VanDerWaalsContact C-N 3.31Å; L1101-D1103 PolarHBondContact O-N 2.91Å; D1103-F1106 PolarHBondContact O-N 2.95Å; D1103-H1107 WeakPolarHBondContact O-CB 3.47Å; D1103-H1107 PolarHBondContact O-N 3.36Å
1104I85.9Confident83.3Confident33 Ų3334.8 Ų34.817%0.16917%0.167CC..Hα-helixtrans-62.5-48.9174.1-69165.4000110.8A1031 F1034 N1100 L1101 F1106 H1107 F1108A1031-I1104 HydrophobicContact CB-CD1 4.13Å; F1034-I1104 HydrophobicContact CB-CG2 3.92Å; N1100-I1104 VanDerWaalsContact O-CG1 3.32Å; N1100-I1104 WeakPolarHBondContact O-CG1 3.26Å; N1100-I1104 PolarHBondContact O-N 3.02Å; L1101-I1104 HydrophobicContact CD2-CD1 4.19Å; L1101-I1104 PolarHBondContact O-N 3.39Å; I1104-F1106 VanDerWaalsContact C-N 3.31Å; I1104-F1106 PolarHBondContact O-N 3.1Å; I1104-H1107 PolarHBondContact O-N 3.46Å; I1104-F1108 WeakPolarHBondContact O-CB 3.45Å; I1104-F1108 PolarHBondContact O-N 3.45Å
1105F90.8Very high83Confident2 Ų237.5 Ų37.51%0.00919%0.185CC..Hα-helixtrans-65.1-35.6177.5-77.4-60.2000112.3F1034 V1091 A1094 L1101 V1102 H1107 F1108 F1109 L1156F1034-F1105 AromaticContact CD1-CE1 3.95Å; F1034-F1105 HydrophobicContact CD1-CE1 3.95Å; F1034-F1105 AromaticContact CD1-CZ 3.69Å; F1034-F1105 HydrophobicContact CD1-CZ 3.69Å; F1034-F1105 HydrophobicContact CD2-CZ 4.42Å; F1034-F1105 AromaticContact CE1-CE1 3.93Å; F1034-F1105 HydrophobicContact CE1-CE1 3.93Å; F1034-F1105 HydrophobicContact CE1-CE2 4.43Å; F1034-F1105 AromaticContact CE1-CZ 3.41Å; F1034-F1105 HydrophobicContact CE1-CZ 3.41Å; F1034-F1105 VanDerWaalsContact CE1-CZ 3.41Å; F1034-F1105 HydrophobicContact CE2-CZ 4.19Å; F1034-F1105 HydrophobicContact CG-CZ 4.21Å; F1034-F1105 HydrophobicContact CZ-CE2 4.39Å; F1034-F1105 AromaticContact CZ-CZ 3.7Å; F1034-F1105 HydrophobicContact CZ-CZ 3.7Å; V1091-F1105 HydrophobicContact CG2-CB 4.1Å; V1091-F1105 HydrophobicContact CG2-CD1 3.47Å; V1091-F1105 VanDerWaalsContact CG2-CD1 3.47Å; V1091-F1105 HydrophobicContact CG2-CD2 3.87Å; V1091-F1105 HydrophobicContact CG2-CE1 3.75Å; V1091-F1105 HydrophobicContact CG2-CE2 4.12Å; V1091-F1105 HydrophobicContact CG2-CG 3.54Å; V1091-F1105 HydrophobicContact CG2-CZ 4.07Å; A1094-F1105 HydrophobicContact CB-CD2 3.96Å; A1094-F1105 HydrophobicContact CB-CE2 3.88Å; L1101-F1105 HydrophobicContact CB-CD2 4.41Å; L1101-F1105 HydrophobicContact CB-CE2 4.39Å; L1101-F1105 WeakPolarHBondContact O-CB 3.37Å; L1101-F1105 WeakPolarHBondContact O-CD2 3.48Å; L1101-F1105 PolarHBondContact O-N 3.32Å; V1102-F1105 PolarHBondContact O-N 3Å; F1105-H1107 VanDerWaalsContact C-N 3.35Å; F1105-F1108 WeakPolarHBondContact O-CB 3.29Å; F1105-F1108 PolarHBondContact O-N 2.92Å; F1105-F1109 HydrophobicContact CB-CE2 4.33Å; F1105-F1109 WeakPolarHBondContact O-CD2 3.44Å; F1105-F1109 WeakPolarHBondContact O-CG 3.45Å; F1105-F1109 PolarHBondContact O-N 3.14Å; F1105-L1156 HydrophobicContact CB-CD2 3.81Å
1106F89.4Confident82.9Confident17 Ų1739.5 Ų39.58%0.07520%0.201CC..Hα-helixtrans-61.4-46.2174.5-165.1-83.7000110.8V1102 D1103 I1104 F1109 L1110 L1156 I1163 A1167 L1171V1102-F1106 VanDerWaalsContact O-CB 3.24Å; V1102-F1106 WeakPolarHBondContact O-CB 3.17Å; V1102-F1106 PolarHBondContact O-N 3.05Å; D1103-F1106 PolarHBondContact O-N 2.95Å; I1104-F1106 VanDerWaalsContact C-N 3.31Å; I1104-F1106 PolarHBondContact O-N 3.1Å; F1106-F1109 PolarHBondContact O-N 2.96Å; F1106-L1110 WeakPolarHBondContact O-CB 3.34Å; F1106-L1110 PolarHBondContact O-N 3.17Å; F1106-L1156 HydrophobicContact CB-CD2 4.48Å; F1106-I1163 HydrophobicContact CD2-CD1 3.86Å; F1106-I1163 HydrophobicContact CD2-CG2 4.43Å; F1106-I1163 HydrophobicContact CE2-CD1 4.29Å; F1106-I1163 HydrophobicContact CE2-CG2 4.18Å; F1106-I1163 HydrophobicContact CZ-CG2 4.36Å; F1106-A1167 HydrophobicContact CE1-CB 3.77Å; F1106-A1167 VanDerWaalsContact CZ-C 3.47Å; F1106-A1167 HydrophobicContact CZ-CB 3.86Å; F1106-A1167 WeakPolarHBondContact CZ-O 3.48Å; F1106-L1171 HydrophobicContact CD2-CD2 3.77Å; F1106-L1171 HydrophobicContact CE1-CB 4.32Å; F1106-L1171 HydrophobicContact CE1-CD2 4.49Å; F1106-L1171 HydrophobicContact CE2-CB 4.13Å; F1106-L1171 HydrophobicContact CE2-CD2 3.5Å; F1106-L1171 VanDerWaalsContact CE2-CD2 3.5Å; F1106-L1171 HydrophobicContact CE2-CG 4.45Å; F1106-L1171 HydrophobicContact CG-CD2 4.38Å; F1106-L1171 HydrophobicContact CZ-CB 3.7Å; F1106-L1171 HydrophobicContact CZ-CD2 3.87Å; F1106-L1171 HydrophobicContact CZ-CG 4.43Å
1107H87.3Confident83.1Confident72 Ų7238.2 Ų38.233%0.33320%0.197SC..Hα-helixtrans-63.8-45.5174.8-172.878.2000112.3D1103 I1104 F1105 F1109 L1110 R1111D1103-H1107 WeakPolarHBondContact O-CB 3.47Å; D1103-H1107 PolarHBondContact O-N 3.36Å; I1104-H1107 PolarHBondContact O-N 3.46Å; F1105-H1107 VanDerWaalsContact C-N 3.35Å; H1107-F1109 VanDerWaalsContact C-N 3.34Å; H1107-F1109 PolarHBondContact O-N 3.36Å; H1107-L1110 PolarHBondContact O-N 3.39Å; H1107-R1111 WeakPolarHBondContact O-CB 3.32Å; H1107-R1111 PolarHBondContact O-N 3.31Å
1108F91.8Very high82.8Confident4 Ų436.7 Ų36.72%0.01819%0.186CC..Hα-helixtrans-51.9-50.4175.3166.5-90.4000111.4F1037 D1038 W1041 I1087 I1104 F1105 R1111 S1112F1037-F1108 HydrophobicContact CD1-CE2 4.39Å; F1037-F1108 AromaticContact CE1-CE2 3.99Å; F1037-F1108 HydrophobicContact CE1-CE2 3.99Å; F1037-F1108 HydrophobicContact CE1-CZ 4.37Å; D1038-F1108 HydrophobicContact CB-CD2 4.39Å; D1038-F1108 VanDerWaalsContact OD1-CD2 3.23Å; D1038-F1108 WeakPolarHBondContact OD1-CD2 3.49Å; W1041-F1108 HydrophobicContact CB-CE2 3.83Å; W1041-F1108 AromaticContact CD1-CE2 3.48Å; W1041-F1108 VanDerWaalsContact CD1-CE2 3.48Å; W1041-F1108 AromaticContact CD1-CZ 3.86Å; W1041-F1108 AromaticContact CD2-CE2 3.85Å; W1041-F1108 HydrophobicContact CD2-CE2 3.85Å; W1041-F1108 AromaticContact CD2-CZ 3.69Å; W1041-F1108 HydrophobicContact CD2-CZ 3.69Å; W1041-F1108 AromaticContact CE2-CZ 3.61Å; W1041-F1108 HydrophobicContact CE3-CZ 4.23Å; W1041-F1108 AromaticContact CG-CE2 3.46Å; W1041-F1108 HydrophobicContact CG-CE2 3.46Å; W1041-F1108 VanDerWaalsContact CG-CE2 3.46Å; W1041-F1108 AromaticContact CG-CZ 3.84Å; W1041-F1108 HydrophobicContact CG-CZ 3.84Å; W1041-F1108 HydrophobicContact CH2-CZ 4.47Å; W1041-F1108 HydrophobicContact CZ2-CZ 4.04Å; W1041-F1108 AromaticContact NE1-CE2 3.84Å; W1041-F1108 AromaticContact NE1-CZ 3.73Å; I1087-F1108 HydrophobicContact CD1-CE1 4.36Å; I1087-F1108 HydrophobicContact CD1-CZ 3.88Å; I1087-F1108 HydrophobicContact CG2-CE1 4.33Å; I1104-F1108 WeakPolarHBondContact O-CB 3.45Å; I1104-F1108 PolarHBondContact O-N 3.45Å; F1105-F1108 WeakPolarHBondContact O-CB 3.29Å; F1105-F1108 PolarHBondContact O-N 2.92Å; F1108-R1111 PolarHBondContact O-N 2.9Å; F1108-S1112 VanDerWaalsContact O-CB 3.24Å; F1108-S1112 WeakPolarHBondContact O-CB 3.35Å; F1108-S1112 PolarHBondContact O-N 3.14Å; F1108-S1112 PolarHBondContact O-OG 2.93Å
1109F93.2Very high81.7Confident0 Ų038.6 Ų38.60%020%0.199CC..Hα-helixtrans-69.4-39.5178.7-69.5-54.4000112.5I1087 V1091 F1105 F1106 H1107 R1111 S1112 F1113 L1149 A1153 L1156 L1171I1087-F1109 HydrophobicContact CG2-CE1 4.4Å; I1087-F1109 HydrophobicContact CG2-CZ 4.12Å; V1091-F1109 HydrophobicContact CG2-CE2 3.95Å; V1091-F1109 HydrophobicContact CG2-CZ 3.97Å; F1105-F1109 HydrophobicContact CB-CE2 4.33Å; F1105-F1109 WeakPolarHBondContact O-CD2 3.44Å; F1105-F1109 WeakPolarHBondContact O-CG 3.45Å; F1105-F1109 PolarHBondContact O-N 3.14Å; F1106-F1109 PolarHBondContact O-N 2.96Å; H1107-F1109 VanDerWaalsContact C-N 3.34Å; H1107-F1109 PolarHBondContact O-N 3.36Å; F1109-R1111 VanDerWaalsContact C-N 3.27Å; F1109-R1111 PolarHBondContact O-N 3.25Å; F1109-S1112 PolarHBondContact O-N 2.97Å; F1109-F1113 HydrophobicContact CB-CD2 4.15Å; F1109-F1113 HydrophobicContact CB-CE2 3.84Å; F1109-F1113 AromaticContact CD1-CE2 3.72Å; F1109-F1113 HydrophobicContact CD1-CE2 3.72Å; F1109-F1113 AromaticContact CD1-CZ 3.64Å; F1109-F1113 HydrophobicContact CD1-CZ 3.64Å; F1109-F1113 HydrophobicContact CE1-CZ 4.29Å; F1109-F1113 HydrophobicContact CG-CE2 4.08Å; F1109-F1113 HydrophobicContact CG-CZ 4.46Å; F1109-F1113 WeakPolarHBondContact O-CB 3.46Å; F1109-F1113 VanDerWaalsContact O-CD2 3.28Å; F1109-F1113 WeakPolarHBondContact O-CD2 3.47Å; F1109-F1113 WeakPolarHBondContact O-CG 3.47Å; F1109-F1113 PolarHBondContact O-N 3.42Å; F1109-L1149 HydrophobicContact CE1-CD1 3.84Å; F1109-L1149 HydrophobicContact CE1-CG 4.39Å; F1109-A1153 HydrophobicContact CB-CB 4.37Å; F1109-A1153 HydrophobicContact CD1-CB 3.7Å; F1109-A1153 HydrophobicContact CD2-CB 3.86Å; F1109-A1153 HydrophobicContact CE1-CB 3.83Å; F1109-A1153 HydrophobicContact CE2-CB 4Å; F1109-A1153 HydrophobicContact CG-CB 3.72Å; F1109-A1153 HydrophobicContact CZ-CB 3.99Å; F1109-L1156 HydrophobicContact CD2-CD2 3.91Å; F1109-L1156 HydrophobicContact CE2-CD2 3.91Å; F1109-L1171 HydrophobicContact CB-CD1 3.73Å; F1109-L1171 HydrophobicContact CB-CD2 4.31Å
1110L89Confident80.4Confident13 Ų1341.6 Ų41.67%0.06821%0.211CC..Hα-helixtrans-59.2-42.9176.8-164.177.8000110.3F1106 H1107 L1170 L1171 R1174 I1281F1106-L1110 WeakPolarHBondContact O-CB 3.34Å; F1106-L1110 PolarHBondContact O-N 3.17Å; H1107-L1110 PolarHBondContact O-N 3.39Å; L1110-L1170 HydrophobicContact CD1-CB 4.27Å; L1110-L1171 HydrophobicContact CD1-CB 4.23Å; L1110-R1174 PolarHBondContact O-NH1 3.48Å; L1110-I1281 HydrophobicContact CD2-CD1 4.07Å
1111R87.7Confident78.7Confident114 Ų11440.7 Ų40.743%0.4321%0.209SC..Hα-helixtrans-73.5-37.9179.2-163.4-176.8161.3-177.41.2112.8D1038 H1042 H1107 F1108 F1109D1038-R1111 IonicContact OD2-CZ 3.81Å; D1038-R1111 IonicContact OD2-NH1 2.84Å; D1038-R1111 PolarHBondContact OD2-NH1 3.41Å; H1042-R1111 VanDerWaalsContact CE1-CD 3.43Å; H1042-R1111 WeakPolarHBondContact CE1-CD 3.27Å; H1042-R1111 VanDerWaalsContact NE2-CD 3.34Å; H1042-R1111 WeakPolarHBondContact NE2-CD 3.21Å; H1042-R1111 WeakPolarHBondContact NE2-CG 3.39Å; H1042-R1111 PolarHBondContact NE2-NE 2.92Å; H1107-R1111 WeakPolarHBondContact O-CB 3.32Å; H1107-R1111 PolarHBondContact O-N 3.31Å; F1108-R1111 PolarHBondContact O-N 2.9Å; F1109-R1111 VanDerWaalsContact C-N 3.27Å; F1109-R1111 PolarHBondContact O-N 3.25Å
1112S89.5Confident76.6Confident12 Ų1247.1 Ų47.18%0.08424%0.239CC..Hα-helixtrans-69.8-32-179.7-63.50000113.8W1041 F1108 F1109 F1136W1041-S1112 PolarHBondContact NE1-OG 2.97Å; F1108-S1112 VanDerWaalsContact O-CB 3.24Å; F1108-S1112 WeakPolarHBondContact O-CB 3.35Å; F1108-S1112 PolarHBondContact O-N 3.14Å; F1108-S1112 PolarHBondContact O-OG 2.93Å; F1109-S1112 PolarHBondContact O-N 2.97Å; S1112-F1136 WeakPolarHBondContact O-CE2 3.28Å
1113F91.8Very high74.2Confident1 Ų152.9 Ų52.90%0.00427%0.266CS..SBendtrans-99.5129.9-175.4-58.3-31.2000112.1F1109 F1136 L1149 L1150 A1153 L1171 R1174 I1175 V1178F1109-F1113 HydrophobicContact CB-CD2 4.15Å; F1109-F1113 HydrophobicContact CB-CE2 3.84Å; F1109-F1113 AromaticContact CD1-CE2 3.72Å; F1109-F1113 HydrophobicContact CD1-CE2 3.72Å; F1109-F1113 AromaticContact CD1-CZ 3.64Å; F1109-F1113 HydrophobicContact CD1-CZ 3.64Å; F1109-F1113 HydrophobicContact CE1-CZ 4.29Å; F1109-F1113 HydrophobicContact CG-CE2 4.08Å; F1109-F1113 HydrophobicContact CG-CZ 4.46Å; F1109-F1113 WeakPolarHBondContact O-CB 3.46Å; F1109-F1113 VanDerWaalsContact O-CD2 3.28Å; F1109-F1113 WeakPolarHBondContact O-CD2 3.47Å; F1109-F1113 WeakPolarHBondContact O-CG 3.47Å; F1109-F1113 PolarHBondContact O-N 3.42Å; F1113-F1136 AromaticContact CD1-CE2 3.89Å; F1113-F1136 HydrophobicContact CD1-CE2 3.89Å; F1113-F1136 AromaticContact CD1-CZ 3.81Å; F1113-F1136 HydrophobicContact CD1-CZ 3.81Å; F1113-F1136 HydrophobicContact CE1-CE2 4.37Å; F1113-F1136 AromaticContact CE1-CZ 3.85Å; F1113-F1136 HydrophobicContact CE1-CZ 3.85Å; F1113-L1149 HydrophobicContact CE1-CD2 3.76Å; F1113-L1149 HydrophobicContact CE1-CG 4.16Å; F1113-L1149 HydrophobicContact CZ-CD2 4.19Å; F1113-L1149 HydrophobicContact CZ-CG 4.07Å; F1113-L1150 HydrophobicContact CD1-CD2 4.47Å; F1113-L1150 HydrophobicContact CE1-CD2 4.04Å; F1113-L1150 HydrophobicContact CE2-CD2 4.17Å; F1113-L1150 HydrophobicContact CZ-CD2 3.87Å; F1113-A1153 HydrophobicContact CE2-CB 3.51Å; F1113-A1153 HydrophobicContact CZ-CB 3.95Å; F1113-L1171 HydrophobicContact CD2-CD1 3.97Å; F1113-L1171 HydrophobicContact CE2-CD1 4.42Å; F1113-R1174 HydrophobicContact CB-CB 3.71Å; F1113-R1174 VanDerWaalsContact O-CD 3.32Å; F1113-R1174 WeakPolarHBondContact O-CD 3.33Å; F1113-R1174 PolarHBondContact O-NH1 3.23Å; F1113-I1175 HydrophobicContact CD2-CG1 3.99Å; F1113-I1175 HydrophobicContact CE2-CG1 3.94Å; F1113-V1178 HydrophobicContact CB-CG2 3.84Å; F1113-V1178 HydrophobicContact CD1-CG2 4.15Å; F1113-V1178 HydrophobicContact CG-CG2 4.21Å
1114S82.7Confident71.7Confident18 Ų1857.3 Ų57.313%0.12629%0.286CS..  trans-72.3140.7175.6-168.70000111.3S1116 A1133S1114-S1116 PolarHBondContact O-N 3.28Å; S1114-S1116 PolarHBondContact OG-N 3.27Å; S1114-S1116 PolarHBondContact OG-O 2.69Å; S1114-A1133 WeakPolarHBondContact CB-O 3.43Å; S1114-A1133 PolarHBondContact OG-O 3.21Å
1115P75.4Confident69.4Low60 Ų6062.6 Ų62.639%0.3932%0.32SS..SBendtrans-73.6-14.7170.931.4-35.1000113.2R1174P1115-R1174 HydrophobicContact CB-CG 4.16Å
1116S73.3Confident66.8Low64 Ų6465.8 Ų65.845%0.44835%0.353SS..SBendtrans-115.6141.9-173.2-57.80000111.2S1114S1114-S1116 PolarHBondContact O-N 3.28Å; S1114-S1116 PolarHBondContact OG-N 3.27Å; S1114-S1116 PolarHBondContact OG-O 2.69Å
1117I77.3Confident64Low21 Ų2167.6 Ų67.611%0.10837%0.368CS..  trans-74.1130.1164.4-61.9165000106.1V1119 A1177 L1180 D1181 I1398 C1399 I1402I1117-V1119 PolarHBondContact O-N 3.3Å; I1117-A1177 HydrophobicContact CG1-CB 4.22Å; I1117-L1180 HydrophobicContact CD1-CB 3.73Å; I1117-L1180 HydrophobicContact CD1-CD1 4.23Å; I1117-L1180 HydrophobicContact CG1-CB 4.33Å; I1117-D1181 HydrophobicContact CG1-CB 4.47Å; I1117-D1181 HydrophobicContact CG2-CB 3.98Å; I1117-I1398 HydrophobicContact CD1-CG2 3.3Å; I1117-C1399 HydrophobicContact CB-CB 4.47Å; I1117-C1399 HydrophobicContact CD1-CB 4.09Å; I1117-C1399 HydrophobicContact CG2-CB 4.05Å; I1117-I1402 HydrophobicContact CD1-CD1 4.14Å
1118S60.7Low61.6Low11 Ų1174 Ų748%0.07740%0.397CS..  trans-68129.7-170-166.20000111.5P1132 A1133 R1138 D1181S1118-P1132 WeakPolarHBondContact OG-CB 3.34Å; S1118-A1133 PolarHBondContact OG-N 3.06Å; S1118-R1138 PolarHBondContact O-NH2 3.3Å; S1118-D1181 PolarHBondContact N-OD1 3.42Å; S1118-D1181 VanDerWaalsContact N-OD1 3.16Å
1119V50.7Low58.9Low80 Ų8078.4 Ų78.449%0.48543%0.428SS..  trans-126.2138.2-177.8170.10000109.6I1117I1117-V1119 PolarHBondContact O-N 3.3Å
1120R47.8Very low56.3Low177 Ų17781.9 Ų81.967%0.66845%0.452SS*.  trans64.568.6163.9-71.1169.8-176.8-170.8-0.1119
1121T40.1Very low54.2Low90 Ų9087.9 Ų87.955%0.55248%0.48SS*.SBendtrans-81.1-13.5172.214.50000116.5P1132T1121-P1132 HydrophobicContact CG2-CB 4.1Å; T1121-P1132 HydrophobicContact CG2-CG 4.41Å
1122E38.1Very low52.4Low142 Ų14283.9 Ų83.966%0.66447%0.469SS*.SBendtrans-115.1-20.7-164.4-67.6-175.4179.900117.5
1123Q33.5Very low51.1Low122 Ų12285.7 Ų85.757%0.5748%0.484SS*.SBendtrans-105.61.3-170.2-78.2-170.1-7.700117.4V1125Q1123-V1125 PolarHBondContact O-N 2.89Å
1124M29.3Very low50.2Low150 Ų15086 Ų8674%0.73949%0.486SS*.  trans-94.474162.5-77.6-154.1164.900110.2G1126 C1127M1124-G1126 PolarHBondContact O-N 3.48Å; M1124-C1127 PolarHBondContact O-N 3.22Å
1125V38.3Very low50.1Low145 Ų14587.8 Ų87.888%0.87949%0.493SS*.THydrogen-bonded Turntrans-68.736.3174.6-169.60000111.8Q1123Q1123-V1125 PolarHBondContact O-N 2.89Å
1126G36.4Very low50.8Low68 Ų6885.4 Ų85.470%0.70148%0.476SS*.THydrogen-bonded Turntrans-154.9-1.8179.200000115.5M1124M1124-G1126 PolarHBondContact O-N 3.48Å
1127C30.9Very low51.5Low56 Ų5682.8 Ų82.838%0.37846%0.458SS..  trans-121.689.7178.9-161.70000110.2M1124 S1129 C1130M1124-C1127 PolarHBondContact O-N 3.22Å; C1127-S1129 PolarHBondContact O-N 3.04Å; C1127-S1129 PolarHBondContact SG-OG 3.37Å; C1127-C1130 PolarHBondContact O-N 3.49Å; C1127-C1130 VanDerWaalsContact SG-SG 3.63Å
1128H35.9Very low52.1Low206 Ų20684 Ų8495%0.95446%0.461SS*.THydrogen-bonded Turntrans-61.62.7178.5-70.7-67.2000115
1129S35.8Very low53.6Low96 Ų9684.6 Ų84.667%0.67146%0.463SS*.THydrogen-bonded Turntrans-111.87.8-175.862.10000115.3C1127 E1131C1127-S1129 PolarHBondContact O-N 3.04Å; C1127-S1129 PolarHBondContact SG-OG 3.37Å; S1129-E1131 PolarHBondContact O-N 2.84Å
1130C37.9Very low55.5Low74 Ų7480.8 Ų80.850%0.544%0.44SS..  trans-89.578.5-179.9-52.40000110.8C1127C1127-C1130 PolarHBondContact O-N 3.49Å; C1127-C1130 VanDerWaalsContact SG-SG 3.63Å
1131E44.3Very low57.6Low138 Ų13872.6 Ų72.665%0.64541%0.41SS*.  trans-62.9140.6171.1-71.7-169.8164.400111.1S1129 A1133S1129-E1131 PolarHBondContact O-N 2.84Å; E1131-A1133 PolarHBondContact O-N 3.39Å
1132P51.5Low60.1Low31 Ų3168.4 Ų68.420%0.20138%0.384CS..  trans-59.8129.8174.721.2-29.7000110.4S1118 T1121 C1134S1118-P1132 WeakPolarHBondContact OG-CB 3.34Å; T1121-P1132 HydrophobicContact CG2-CB 4.1Å; T1121-P1132 HydrophobicContact CG2-CG 4.41Å; P1132-C1134 VanDerWaalsContact C-N 3.29Å; P1132-C1134 PolarHBondContact O-N 2.88Å
1133A62.3Low62.8Low50 Ų5061.7 Ų61.741%0.41335%0.353SS..SBendtrans-62.3-33.2-171.600000113.4S1114 S1118 E1131S1114-A1133 WeakPolarHBondContact CB-O 3.43Å; S1114-A1133 PolarHBondContact OG-O 3.21Å; S1118-A1133 PolarHBondContact OG-N 3.06Å; E1131-A1133 PolarHBondContact O-N 3.39Å
1134C71.7Confident65.6Low7 Ų755.9 Ų55.95%0.04733%0.326CS..  trans-101.7124173.4-172.90000109.2P1132 D1181P1132-C1134 VanDerWaalsContact C-N 3.29Å; P1132-C1134 PolarHBondContact O-N 2.88Å; C1134-D1181 PolarHBondContact SG-OD2 2.81Å
1135Q81.1Confident68.7Low55 Ų5548.8 Ų48.826%0.25729%0.291SS..  trans-87.7-10.8-177.3-62.6-176.4-15.100114R1048 F1052R1048-Q1135 VanDerWaalsContact NH1-CA 3.35Å; F1052-Q1135 WeakPolarHBondContact CA-O 3.38Å; F1052-Q1135 HydrophobicContact CD1-CB 4.15Å
1136F89.3Confident71.4Confident11 Ų1142 Ų425%0.04825%0.25CC..SBendtrans-78.1134.6-177.9-66.2-92.7000111.5F1051 F1052 S1112 F1113 R1146 L1149 V1178F1051-F1136 AromaticContact CD2-CD1 3.77Å; F1051-F1136 HydrophobicContact CD2-CD1 3.77Å; F1051-F1136 HydrophobicContact CD2-CE1 4.02Å; F1051-F1136 AromaticContact CE2-CD1 3.73Å; F1051-F1136 HydrophobicContact CE2-CD1 3.73Å; F1051-F1136 AromaticContact CE2-CE1 3.47Å; F1051-F1136 HydrophobicContact CE2-CE1 3.47Å; F1051-F1136 VanDerWaalsContact CE2-CE1 3.47Å; F1051-F1136 HydrophobicContact CZ-CE1 4.19Å; F1052-F1136 HydrophobicContact CD1-CD1 4.31Å; F1052-F1136 HydrophobicContact CD1-CE1 4.43Å; F1052-F1136 HydrophobicContact CE1-CD1 4.01Å; F1052-F1136 AromaticContact CE1-CE1 3.68Å; F1052-F1136 HydrophobicContact CE1-CE1 3.68Å; F1052-F1136 HydrophobicContact CE1-CE2 4.23Å; F1052-F1136 HydrophobicContact CE1-CG 4.43Å; F1052-F1136 AromaticContact CE1-CZ 3.79Å; F1052-F1136 HydrophobicContact CE1-CZ 3.79Å; F1052-F1136 HydrophobicContact CZ-CE1 4.31Å; F1052-F1136 HydrophobicContact CZ-CZ 4.45Å; S1112-F1136 WeakPolarHBondContact O-CE2 3.28Å; F1113-F1136 AromaticContact CD1-CE2 3.89Å; F1113-F1136 HydrophobicContact CD1-CE2 3.89Å; F1113-F1136 AromaticContact CD1-CZ 3.81Å; F1113-F1136 HydrophobicContact CD1-CZ 3.81Å; F1113-F1136 HydrophobicContact CE1-CE2 4.37Å; F1113-F1136 AromaticContact CE1-CZ 3.85Å; F1113-F1136 HydrophobicContact CE1-CZ 3.85Å; F1136-R1146 HydrophobicContact CD1-CG 4.42Å; F1136-L1149 HydrophobicContact CE1-CD2 3.9Å; F1136-L1149 HydrophobicContact CZ-CD2 4.09Å; F1136-V1178 HydrophobicContact CD2-CG1 3.77Å; F1136-V1178 HydrophobicContact CD2-CG2 4.41Å; F1136-V1178 HydrophobicContact CE2-CG1 4.04Å; F1136-V1178 HydrophobicContact CE2-CG2 4.36Å; F1136-V1178 HydrophobicContact CG-CG1 4.15Å
1137S89.3Confident74.2Confident9 Ų938.8 Ų38.86%0.06322%0.216CC..  trans-60.8141.8172.1-172.70000111F1051 R1053 H1139 R1146F1051-S1137 WeakPolarHBondContact O-CB 3.4Å; F1051-S1137 PolarHBondContact O-N 2.77Å; R1053-S1137 WeakPolarHBondContact O-CB 3.28Å; S1137-H1139 WeakPolarHBondContact OG-CB 3.38Å; S1137-H1139 PolarHBondContact OG-N 3.1Å; S1137-R1146 PolarHBondContact O-NH1 2.85Å
1138R89.5Confident77.4Confident46 Ų4636.6 Ų36.617%0.17420%0.201CC..  trans-91.4-4.2175.3-60-179.6-179.6167.5-7.1112.5S1118 D1181 Y1182 V1185S1118-R1138 PolarHBondContact O-NH2 3.3Å; R1138-D1181 WeakPolarHBondContact CD-O 3.31Å; R1138-D1181 IonicContact CZ-OD1 3.11Å; R1138-D1181 PolarHBondContact NE-O 3.3Å; R1138-D1181 IonicContact NE-OD1 3.32Å; R1138-D1181 PolarHBondContact NE-OD1 3.07Å; R1138-D1181 IonicContact NE-OD2 2.65Å; R1138-D1181 IonicContact NH2-OD1 2.81Å; R1138-D1181 PolarHBondContact NH2-OD1 3.35Å; R1138-Y1182 WeakPolarHBondContact O-CE2 3.3Å; R1138-V1185 HydrophobicContact CB-CG1 4.17Å; R1138-V1185 HydrophobicContact CB-CG2 3.8Å; R1138-V1185 HydrophobicContact CG-CG1 4.5Å
1139H91.4Very high80.2Confident23 Ų2326.8 Ų26.811%0.10616%0.155CC..SBendtrans-64.1139.7-179.7-167.5-79.1000112.2E1055 P1075 S1137 A1141 A1142 Q1188E1055-H1139 IonicContact OE1-CD2 2.88Å; P1075-H1139 WeakPolarHBondContact CD-ND1 3.49Å; P1075-H1139 HydrophobicContact CG-CB 4.03Å; S1137-H1139 WeakPolarHBondContact OG-CB 3.38Å; S1137-H1139 PolarHBondContact OG-N 3.1Å; H1139-A1141 VanDerWaalsContact C-N 3.27Å; H1139-A1141 VanDerWaalsContact ND1-CB 3.33Å; H1139-A1141 WeakPolarHBondContact ND1-CB 3.09Å; H1139-A1141 PolarHBondContact ND1-N 2.77Å; H1139-A1141 VanDerWaalsContact ND1-N 3.13Å; H1139-A1141 PolarHBondContact O-N 2.61Å; H1139-A1142 WeakPolarHBondContact O-CB 3.47Å; H1139-A1142 PolarHBondContact O-N 3.05Å; H1139-Q1188 PolarHBondContact CD2-OE1 3.32Å
1140V91.6Very high83.1Confident0 Ų022.3 Ų22.30%012%0.124CC..G310 helixtrans-58.4-35.1-175.864.80000113.5A1142 A1143 Q1188 C1189 Q1192 L1350V1140-A1142 PolarHBondContact O-N 2.66Å; V1140-A1142 VanDerWaalsContact O-N 3.12Å; V1140-A1143 WeakPolarHBondContact O-CB 3.33Å; V1140-A1143 PolarHBondContact O-N 3.34Å; V1140-Q1188 HydrophobicContact CB-CB 4.2Å; V1140-Q1188 HydrophobicContact CG1-CB 4.11Å; V1140-Q1188 VanDerWaalsContact N-OE1 3.14Å; V1140-C1189 WeakPolarHBondContact CG1-O 3.25Å; V1140-Q1192 PolarHBondContact O-NE2 3.42Å; V1140-L1350 HydrophobicContact CG2-CD2 4.06Å
1141A91.5Very high85.8Confident6 Ų619.9 Ų19.95%0.0511%0.107CC..G310 helixtrans-58.1-22.4174.300000114.5P1074 P1075 V1077 H1139 Q1192P1074-A1141 HydrophobicContact CB-CB 3.82Å; P1075-A1141 HydrophobicContact CG-CB 4.29Å; V1077-A1141 VanDerWaalsContact CG2-O 3.31Å; V1077-A1141 WeakPolarHBondContact CG2-O 3.42Å; H1139-A1141 VanDerWaalsContact C-N 3.27Å; H1139-A1141 VanDerWaalsContact ND1-CB 3.33Å; H1139-A1141 WeakPolarHBondContact ND1-CB 3.09Å; H1139-A1141 PolarHBondContact ND1-N 2.77Å; H1139-A1141 VanDerWaalsContact ND1-N 3.13Å; H1139-A1141 PolarHBondContact O-N 2.61Å; A1141-Q1192 HydrophobicContact CB-CG 4.43Å
1142A93.6Very high88.1Confident1 Ų113.5 Ų13.51%0.0088%0.078CC..G310 helixtrans-91.7-9.8176.100000113.8F1051 P1075 V1077 H1139 V1140 G1144 A1145 R1146F1051-A1142 HydrophobicContact CB-CB 3.7Å; P1075-A1142 HydrophobicContact CG-CB 4.25Å; V1077-A1142 HydrophobicContact CG1-CB 4.07Å; H1139-A1142 WeakPolarHBondContact O-CB 3.47Å; H1139-A1142 PolarHBondContact O-N 3.05Å; V1140-A1142 PolarHBondContact O-N 2.66Å; V1140-A1142 VanDerWaalsContact O-N 3.12Å; A1142-G1144 PolarHBondContact O-N 2.84Å; A1142-A1145 PolarHBondContact O-N 2.96Å; A1142-R1146 WeakPolarHBondContact O-CB 3.45Å; A1142-R1146 PolarHBondContact O-N 3.33Å
1143A93.4Very high90.1Very high1 Ų112 Ų121%0.0087%0.068CC..Hα-helixtrans-58.4-49.6-17300000111.8V1140 A1145 R1146 F1147 Y1182 I1204V1140-A1143 WeakPolarHBondContact O-CB 3.33Å; V1140-A1143 PolarHBondContact O-N 3.34Å; A1143-A1145 PolarHBondContact O-N 2.91Å; A1143-R1146 PolarHBondContact O-N 3.18Å; A1143-F1147 HydrophobicContact CB-CD2 4.23Å; A1143-F1147 HydrophobicContact CB-CE2 4.33Å; A1143-F1147 WeakPolarHBondContact O-CD2 3.44Å; A1143-F1147 PolarHBondContact O-N 2.95Å; A1143-Y1182 HydrophobicContact CB-CE2 3.9Å; A1143-I1204 HydrophobicContact CB-CD1 4.15Å
1144G92.9Very high91.5Very high0 Ų09.7 Ų9.70%05%0.048CC..Hα-helixtrans-58.5-47.5-178.600000113.4A1142 F1147 H1148 D1200A1142-G1144 PolarHBondContact O-N 2.84Å; G1144-F1147 PolarHBondContact O-N 3.33Å; G1144-H1148 WeakPolarHBondContact O-CB 3.23Å; G1144-H1148 PolarHBondContact O-N 3.01Å; G1144-D1200 WeakPolarHBondContact CA-OD1 3.18Å
1145A93.8Very high92.4Very high1 Ų110.4 Ų10.41%0.0086%0.057CC..Hα-helixtrans-65.3-40.717800000112.4F1051 K1081 A1142 A1143 L1149F1051-A1145 HydrophobicContact CD1-CB 3.61Å; F1051-A1145 HydrophobicContact CE1-CB 3.98Å; K1081-A1145 HydrophobicContact CG-CB 4.16Å; A1142-A1145 PolarHBondContact O-N 2.96Å; A1143-A1145 PolarHBondContact O-N 2.91Å; A1145-L1149 WeakPolarHBondContact O-CB 3.36Å; A1145-L1149 PolarHBondContact O-N 3.49Å
1146R94.7Very high92.7Very high2 Ų27.8 Ų7.81%0.0085%0.045CC..Hα-helixtrans-60.7-52.3175.8-175.2-176.7-167.8147.43.6111F1136 S1137 A1142 A1143 L1149 L1150 V1178 D1181F1136-R1146 HydrophobicContact CD1-CG 4.42Å; S1137-R1146 PolarHBondContact O-NH1 2.85Å; A1142-R1146 WeakPolarHBondContact O-CB 3.45Å; A1142-R1146 PolarHBondContact O-N 3.33Å; A1143-R1146 PolarHBondContact O-N 3.18Å; R1146-L1149 PolarHBondContact O-N 2.87Å; R1146-L1150 HydrophobicContact CG-CD1 4.11Å; R1146-L1150 VanDerWaalsContact O-CG 3.26Å; R1146-L1150 WeakPolarHBondContact O-CG 3.49Å; R1146-L1150 PolarHBondContact O-N 3.29Å; R1146-V1178 HydrophobicContact CG-CG1 4.44Å; R1146-V1178 PolarHBondContact NE-O 3.35Å; R1146-V1178 PolarHBondContact NH2-O 2.98Å; R1146-D1181 IonicContact CZ-OD2 2.76Å; R1146-D1181 IonicContact NH1-OD2 2.93Å; R1146-D1181 IonicContact NH2-OD2 3.6Å; R1146-D1181 PolarHBondContact NH2-OD2 3.35Å
1147F96.8Very high92.5Very high1 Ų17.3 Ų7.30%0.0044%0.043CC..Hα-helixtrans-72.2-28.5-177.9-73.2-69.6000112.9A1143 G1144 L1150 T1151 A1179 Y1182 F1183 I1204 F1207 V1343A1143-F1147 HydrophobicContact CB-CD2 4.23Å; A1143-F1147 HydrophobicContact CB-CE2 4.33Å; A1143-F1147 WeakPolarHBondContact O-CD2 3.44Å; A1143-F1147 PolarHBondContact O-N 2.95Å; G1144-F1147 PolarHBondContact O-N 3.33Å; F1147-L1150 HydrophobicContact CD1-CD1 4.07Å; F1147-L1150 HydrophobicContact CE1-CD1 4.32Å; F1147-T1151 WeakPolarHBondContact O-CB 3.45Å; F1147-T1151 PolarHBondContact O-N 3.24Å; F1147-T1151 PolarHBondContact O-OG1 2.88Å; F1147-A1179 HydrophobicContact CE1-CB 4.23Å; F1147-Y1182 HydrophobicContact CE2-CD1 4.05Å; F1147-Y1182 HydrophobicContact CE2-CE1 4.41Å; F1147-Y1182 HydrophobicContact CE2-CG 4.21Å; F1147-Y1182 HydrophobicContact CZ-CD1 4.11Å; F1147-Y1182 HydrophobicContact CZ-CG 4.34Å; F1147-F1183 HydrophobicContact CZ-CE2 4.27Å; F1147-F1183 HydrophobicContact CZ-CZ 4.41Å; F1147-I1204 HydrophobicContact CB-CG1 4.21Å; F1147-I1204 HydrophobicContact CD2-CD1 4.38Å; F1147-I1204 HydrophobicContact CD2-CG1 3.6Å; F1147-I1204 HydrophobicContact CE2-CG1 4.28Å; F1147-I1204 HydrophobicContact CG-CG1 4.1Å; F1147-F1207 HydrophobicContact CB-CB 4.2Å; F1147-F1207 HydrophobicContact CD1-CB 4.11Å; F1147-F1207 AromaticContact CD1-CD1 3.38Å; F1147-F1207 HydrophobicContact CD1-CD1 3.38Å; F1147-F1207 HydrophobicContact CD1-CD2 4.38Å; F1147-F1207 AromaticContact CD1-CE1 3.82Å; F1147-F1207 HydrophobicContact CD1-CE1 3.82Å; F1147-F1207 AromaticContact CD1-CG 3.69Å; F1147-F1207 HydrophobicContact CD1-CG 3.69Å; F1147-F1207 HydrophobicContact CD1-CZ 4.49Å; F1147-F1207 AromaticContact CE1-CD1 3.7Å; F1147-F1207 HydrophobicContact CE1-CD1 3.7Å; F1147-F1207 AromaticContact CE1-CE1 3.79Å; F1147-F1207 HydrophobicContact CE1-CE1 3.79Å; F1147-F1207 HydrophobicContact CE1-CG 4.45Å; F1147-V1343 HydrophobicContact CE1-CG2 4.31Å
1148H96.1Very high92.4Very high11 Ų117.8 Ų7.85%0.0514%0.044CC..Hα-helixtrans-60.8-52.4168-176-177.8000110.4V1084 T1088 G1144 L1150 T1151 S1152 W1203V1084-H1148 HydrophobicContact CG1-CB 3.9Å; V1084-H1148 VanDerWaalsContact CG1-CG 3.48Å; T1088-H1148 WeakPolarHBondContact CB-NE2 3.28Å; T1088-H1148 PolarHBondContact OG1-CD2 2.91Å; T1088-H1148 PolarHBondContact OG1-NE2 3.37Å; G1144-H1148 WeakPolarHBondContact O-CB 3.23Å; G1144-H1148 PolarHBondContact O-N 3.01Å; H1148-L1150 VanDerWaalsContact C-N 3.34Å; H1148-L1150 PolarHBondContact O-N 3.35Å; H1148-T1151 WeakPolarHBondContact O-CB 3.42Å; H1148-T1151 PolarHBondContact O-N 3.47Å; H1148-T1151 VanDerWaalsContact O-N 3.14Å; H1148-S1152 PolarHBondContact O-N 2.85Å; H1148-S1152 PolarHBondContact O-OG 3.38Å; H1148-S1152 VanDerWaalsContact O-OG 3.1Å; H1148-W1203 HydrophobicContact CB-CB 4.23Å; H1148-W1203 HydrophobicContact CB-CD2 3.62Å; H1148-W1203 HydrophobicContact CB-CE3 3.89Å; H1148-W1203 HydrophobicContact CB-CG 3.76Å; H1148-W1203 AromaticContact CD2-CD2 3.83Å; H1148-W1203 AromaticContact CD2-CE2 3.8Å; H1148-W1203 AromaticContact CD2-CE3 3.57Å; H1148-W1203 AromaticContact CD2-CH2 3.31Å; H1148-W1203 WeakPolarHBondContact CD2-CH2 3.2Å; H1148-W1203 AromaticContact CD2-CZ2 3.58Å; H1148-W1203 AromaticContact CD2-CZ3 3.31Å; H1148-W1203 WeakPolarHBondContact CD2-CZ3 3.46Å; H1148-W1203 AromaticContact CE1-CE2 3.72Å; H1148-W1203 AromaticContact CE1-CH2 3.7Å; H1148-W1203 AromaticContact CE1-CZ2 3.31Å; H1148-W1203 WeakPolarHBondContact CE1-CZ2 3.33Å; H1148-W1203 AromaticContact CG-CD2 3.52Å; H1148-W1203 AromaticContact CG-CE2 3.51Å; H1148-W1203 AromaticContact CG-CE3 3.72Å; H1148-W1203 AromaticContact CG-CH2 3.93Å; H1148-W1203 AromaticContact CG-CZ2 3.75Å; H1148-W1203 AromaticContact CG-CZ3 3.92Å; H1148-W1203 AromaticContact ND1-CD2 3.96Å; H1148-W1203 AromaticContact ND1-CE2 3.45Å; H1148-W1203 AromaticContact ND1-CZ2 3.57Å; H1148-W1203 AromaticContact ND1-NE1 3.7Å; H1148-W1203 AromaticContact NE2-CE2 3.95Å; H1148-W1203 AromaticContact NE2-CH2 3.18Å; H1148-W1203 WeakPolarHBondContact NE2-CH2 3.36Å; H1148-W1203 AromaticContact NE2-CZ2 3.33Å; H1148-W1203 VanDerWaalsContact NE2-CZ2 3.33Å; H1148-W1203 WeakPolarHBondContact NE2-CZ2 3.39Å; H1148-W1203 AromaticContact NE2-CZ3 3.72Å
1149L95.7Very high91.8Very high0 Ų06.7 Ų6.70%04%0.043CC..Hα-helixtrans-59.3-43.3178.6-174.969.3000112.3W1041 F1051 V1084 I1087 F1109 F1113 F1136 A1145 R1146 T1151 S1152 A1153W1041-L1149 HydrophobicContact CH2-CD1 4.18Å; W1041-L1149 HydrophobicContact CH2-CD2 3.8Å; W1041-L1149 HydrophobicContact CZ2-CD2 3.74Å; F1051-L1149 HydrophobicContact CZ-CD2 4.33Å; V1084-L1149 HydrophobicContact CG1-CB 4Å; V1084-L1149 HydrophobicContact CG1-CD1 4.35Å; V1084-L1149 HydrophobicContact CG2-CB 4.29Å; V1084-L1149 HydrophobicContact CG2-CD1 4.35Å; I1087-L1149 HydrophobicContact CD1-CD1 4.34Å; I1087-L1149 HydrophobicContact CG2-CD1 4.36Å; F1109-L1149 HydrophobicContact CE1-CD1 3.84Å; F1109-L1149 HydrophobicContact CE1-CG 4.39Å; F1113-L1149 HydrophobicContact CE1-CD2 3.76Å; F1113-L1149 HydrophobicContact CE1-CG 4.16Å; F1113-L1149 HydrophobicContact CZ-CD2 4.19Å; F1113-L1149 HydrophobicContact CZ-CG 4.07Å; F1136-L1149 HydrophobicContact CE1-CD2 3.9Å; F1136-L1149 HydrophobicContact CZ-CD2 4.09Å; A1145-L1149 WeakPolarHBondContact O-CB 3.36Å; A1145-L1149 PolarHBondContact O-N 3.49Å; R1146-L1149 PolarHBondContact O-N 2.87Å; L1149-T1151 VanDerWaalsContact C-N 3.35Å; L1149-S1152 PolarHBondContact O-N 3.39Å; L1149-A1153 PolarHBondContact O-N 3.05Å
1150L96.1Very high90.6Very high1 Ų111.8 Ų11.81%0.0057%0.071CC..Hα-helixtrans-65.7-36.2177.2-67.4171.8000112.4F1113 R1146 F1147 H1148 S1152 A1153 L1154 I1175 V1178 A1179 F1207F1113-L1150 HydrophobicContact CD1-CD2 4.47Å; F1113-L1150 HydrophobicContact CE1-CD2 4.04Å; F1113-L1150 HydrophobicContact CE2-CD2 4.17Å; F1113-L1150 HydrophobicContact CZ-CD2 3.87Å; R1146-L1150 HydrophobicContact CG-CD1 4.11Å; R1146-L1150 VanDerWaalsContact O-CG 3.26Å; R1146-L1150 WeakPolarHBondContact O-CG 3.49Å; R1146-L1150 PolarHBondContact O-N 3.29Å; F1147-L1150 HydrophobicContact CD1-CD1 4.07Å; F1147-L1150 HydrophobicContact CE1-CD1 4.32Å; H1148-L1150 VanDerWaalsContact C-N 3.34Å; H1148-L1150 PolarHBondContact O-N 3.35Å; L1150-S1152 VanDerWaalsContact C-N 3.33Å; L1150-A1153 PolarHBondContact O-N 2.97Å; L1150-L1154 VanDerWaalsContact O-CB 3.27Å; L1150-L1154 WeakPolarHBondContact O-CB 3.44Å; L1150-L1154 PolarHBondContact O-N 3.13Å; L1150-I1175 HydrophobicContact CB-CG2 4.47Å; L1150-I1175 HydrophobicContact CD2-CB 4.44Å; L1150-I1175 HydrophobicContact CD2-CG2 4.07Å; L1150-V1178 HydrophobicContact CD1-CG1 4.24Å; L1150-V1178 HydrophobicContact CD2-CB 4Å; L1150-V1178 HydrophobicContact CD2-CG1 3.93Å; L1150-V1178 HydrophobicContact CG-CG1 4.49Å; L1150-A1179 HydrophobicContact CD1-CB 4.01Å; L1150-F1207 HydrophobicContact CB-CD2 3.9Å; L1150-F1207 HydrophobicContact CB-CE2 3.59Å; L1150-F1207 HydrophobicContact CB-CZ 4.33Å; L1150-F1207 HydrophobicContact CD1-CE2 4.48Å; L1150-F1207 HydrophobicContact CD1-CZ 4.44Å
1151T95.8Very high89.4Confident23 Ų2313.3 Ų13.314%0.1418%0.079CC..Hα-helixtrans-63.4-42174.8-590000110.7F1147 H1148 L1149 L1154 G1155 K1206 F1207F1147-T1151 WeakPolarHBondContact O-CB 3.45Å; F1147-T1151 PolarHBondContact O-N 3.24Å; F1147-T1151 PolarHBondContact O-OG1 2.88Å; H1148-T1151 WeakPolarHBondContact O-CB 3.42Å; H1148-T1151 PolarHBondContact O-N 3.47Å; H1148-T1151 VanDerWaalsContact O-N 3.14Å; L1149-T1151 VanDerWaalsContact C-N 3.35Å; T1151-L1154 PolarHBondContact O-N 3.47Å; T1151-G1155 PolarHBondContact O-N 2.93Å; T1151-K1206 HydrophobicContact CG2-CB 4.44Å; T1151-F1207 VanDerWaalsContact OG1-CA 3.31Å; T1151-F1207 WeakPolarHBondContact OG1-CA 3.46Å; T1151-F1207 VanDerWaalsContact OG1-CB 3.3Å; T1151-F1207 WeakPolarHBondContact OG1-CB 3.19Å; T1151-F1207 PolarHBondContact OG1-N 2.63Å
1152S92.4Very high87.8Confident5 Ų516.7 Ų16.74%0.03511%0.107CC..Hα-helixtrans-65.4-43.2178.9-54.80000112.1T1088 H1148 L1149 L1150 G1155 L1156T1088-S1152 WeakPolarHBondContact CB-OG 3.21Å; T1088-S1152 VanDerWaalsContact CG2-OG 3.28Å; T1088-S1152 WeakPolarHBondContact CG2-OG 3.36Å; T1088-S1152 PolarHBondContact OG1-OG 3.36Å; H1148-S1152 PolarHBondContact O-N 2.85Å; H1148-S1152 PolarHBondContact O-OG 3.38Å; H1148-S1152 VanDerWaalsContact O-OG 3.1Å; L1149-S1152 PolarHBondContact O-N 3.39Å; L1150-S1152 VanDerWaalsContact C-N 3.33Å; S1152-G1155 PolarHBondContact O-N 3.38Å; S1152-L1156 PolarHBondContact O-N 2.83Å
1153A93.4Very high86.4Confident0 Ų017.7 Ų17.70%011%0.112CC..Hα-helixtrans-65-42.5174.700000112.6F1109 F1113 L1149 L1150 G1155 L1156 L1157 I1175F1109-A1153 HydrophobicContact CB-CB 4.37Å; F1109-A1153 HydrophobicContact CD1-CB 3.7Å; F1109-A1153 HydrophobicContact CD2-CB 3.86Å; F1109-A1153 HydrophobicContact CE1-CB 3.83Å; F1109-A1153 HydrophobicContact CE2-CB 4Å; F1109-A1153 HydrophobicContact CG-CB 3.72Å; F1109-A1153 HydrophobicContact CZ-CB 3.99Å; F1113-A1153 HydrophobicContact CE2-CB 3.51Å; F1113-A1153 HydrophobicContact CZ-CB 3.95Å; L1149-A1153 PolarHBondContact O-N 3.05Å; L1150-A1153 PolarHBondContact O-N 2.97Å; A1153-G1155 VanDerWaalsContact C-N 3.32Å; A1153-G1155 PolarHBondContact O-N 3.1Å; A1153-L1156 WeakPolarHBondContact O-CB 2.99Å; A1153-L1156 PolarHBondContact O-N 3.35Å; A1153-L1157 WeakPolarHBondContact O-CB 2.78Å; A1153-L1157 PolarHBondContact O-N 2.8Å; A1153-I1175 HydrophobicContact CB-CD1 3.91Å; A1153-I1175 HydrophobicContact CB-CG1 4.26Å
1154L92.1Very high85.3Confident0 Ų020.2 Ų20.20%013%0.129CC..Hα-helixtrans-65-38.5176.2-173.558.7000111.2L1150 T1151 L1156 L1157 Q1158 I1175 F1207 A1210 I1211L1150-L1154 VanDerWaalsContact O-CB 3.27Å; L1150-L1154 WeakPolarHBondContact O-CB 3.44Å; L1150-L1154 PolarHBondContact O-N 3.13Å; T1151-L1154 PolarHBondContact O-N 3.47Å; L1154-L1156 VanDerWaalsContact C-N 3.3Å; L1154-L1156 PolarHBondContact O-N 3.36Å; L1154-L1157 HydrophobicContact CD1-CD2 3.93Å; L1154-L1157 WeakPolarHBondContact O-CB 2.78Å; L1154-L1157 PolarHBondContact O-N 3.44Å; L1154-L1157 VanDerWaalsContact O-N 3.16Å; L1154-Q1158 HydrophobicContact CD1-CG 4.37Å; L1154-Q1158 HydrophobicContact CG-CG 4.46Å; L1154-Q1158 WeakPolarHBondContact O-CB 3.47Å; L1154-Q1158 VanDerWaalsContact O-CG 3.23Å; L1154-Q1158 WeakPolarHBondContact O-CG 3.35Å; L1154-Q1158 PolarHBondContact O-N 3.29Å; L1154-I1175 HydrophobicContact CB-CD1 4.37Å; L1154-F1207 HydrophobicContact CD2-CE2 4.26Å; L1154-A1210 HydrophobicContact CD2-CB 3.68Å; L1154-A1210 HydrophobicContact CG-CB 4.41Å; L1154-I1211 HydrophobicContact CD2-CD1 3.59Å; L1154-I1211 HydrophobicContact CD2-CG1 4Å
1155G89.6Confident84.3Confident22 Ų2220.4 Ų20.423%0.22713%0.131CC..Hα-helixtrans-67-27.4174.500000113.9K1095 T1151 S1152 A1153K1095-G1155 WeakPolarHBondContact CE-O 3.38Å; K1095-G1155 PolarHBondContact NZ-O 3.38Å; T1151-G1155 PolarHBondContact O-N 2.93Å; S1152-G1155 PolarHBondContact O-N 3.38Å; A1153-G1155 VanDerWaalsContact C-N 3.32Å; A1153-G1155 PolarHBondContact O-N 3.1Å
1156L87.2Confident83.3Confident0 Ų023.7 Ų23.70%015%0.151CC..Hα-helixtrans-72.2-41169.1-174.667.1000110.8V1091 K1095 V1102 F1105 F1106 F1109 S1152 A1153 L1154 Q1158 C1159V1091-L1156 HydrophobicContact CG1-CB 4.08Å; V1091-L1156 HydrophobicContact CG1-CD1 4.25Å; K1095-L1156 HydrophobicContact CD-CD1 4.4Å; K1095-L1156 HydrophobicContact CG-CD1 3.67Å; V1102-L1156 HydrophobicContact CB-CD1 4.46Å; V1102-L1156 HydrophobicContact CG1-CD1 3.95Å; V1102-L1156 HydrophobicContact CG2-CD1 4.14Å; F1105-L1156 HydrophobicContact CB-CD2 3.81Å; F1106-L1156 HydrophobicContact CB-CD2 4.48Å; F1109-L1156 HydrophobicContact CD2-CD2 3.91Å; F1109-L1156 HydrophobicContact CE2-CD2 3.91Å; S1152-L1156 PolarHBondContact O-N 2.83Å; A1153-L1156 WeakPolarHBondContact O-CB 2.99Å; A1153-L1156 PolarHBondContact O-N 3.35Å; L1154-L1156 VanDerWaalsContact C-N 3.3Å; L1154-L1156 PolarHBondContact O-N 3.36Å; L1156-Q1158 VanDerWaalsContact C-N 3.29Å; L1156-Q1158 PolarHBondContact O-N 3.26Å; L1156-C1159 PolarHBondContact O-N 3.12Å; L1156-C1159 PolarHBondContact O-SG 3.39Å
1157L86.5Confident82.5Confident1 Ų124.9 Ų24.91%0.00516%0.161CC..Hα-helixtrans-65.9-32.4179.2-170.4118.4000113.2A1153 L1154 C1159 K1168 L1171 R1172A1153-L1157 WeakPolarHBondContact O-CB 2.78Å; A1153-L1157 PolarHBondContact O-N 2.8Å; L1154-L1157 HydrophobicContact CD1-CD2 3.93Å; L1154-L1157 WeakPolarHBondContact O-CB 2.78Å; L1154-L1157 PolarHBondContact O-N 3.44Å; L1154-L1157 VanDerWaalsContact O-N 3.16Å; L1157-C1159 VanDerWaalsContact C-N 3.34Å; L1157-K1168 HydrophobicContact CD1-CB 4.3Å; L1157-K1168 VanDerWaalsContact CD1-O 3.28Å; L1157-K1168 WeakPolarHBondContact CD1-O 2.99Å; L1157-L1171 HydrophobicContact CD1-CB 3.7Å; L1157-L1171 HydrophobicContact CD1-CD2 3.85Å; L1157-L1171 HydrophobicContact CD1-CG 3.77Å; L1157-R1172 HydrophobicContact CD1-CB 4.17Å; L1157-R1172 HydrophobicContact CD2-CB 4.02Å; L1157-R1172 HydrophobicContact CD2-CG 4.34Å
1158Q86Confident82Confident20 Ų2025.1 Ų25.19%0.09316%0.162CC..THydrogen-bonded Turntrans-81.8-6.1179.9-69.7175.5-10.200113.9L1154 L1156 A1210 D1214 Y1217L1154-Q1158 HydrophobicContact CD1-CG 4.37Å; L1154-Q1158 HydrophobicContact CG-CG 4.46Å; L1154-Q1158 WeakPolarHBondContact O-CB 3.47Å; L1154-Q1158 VanDerWaalsContact O-CG 3.23Å; L1154-Q1158 WeakPolarHBondContact O-CG 3.35Å; L1154-Q1158 PolarHBondContact O-N 3.29Å; L1156-Q1158 VanDerWaalsContact C-N 3.29Å; L1156-Q1158 PolarHBondContact O-N 3.26Å; Q1158-A1210 PolarHBondContact NE2-O 3.15Å; Q1158-D1214 PolarHBondContact NE2-OD1 2.91Å; Q1158-Y1217 HydrophobicContact CB-CD1 4.15Å; Q1158-Y1217 HydrophobicContact CB-CD2 3.98Å; Q1158-Y1217 HydrophobicContact CB-CE1 4.05Å; Q1158-Y1217 HydrophobicContact CB-CE2 3.85Å; Q1158-Y1217 HydrophobicContact CB-CG 4.1Å; Q1158-Y1217 HydrophobicContact CG-CD1 4.4Å; Q1158-Y1217 HydrophobicContact CG-CD2 3.53Å; Q1158-Y1217 HydrophobicContact CG-CE2 3.77Å; Q1158-Y1217 HydrophobicContact CG-CG 3.84Å; Q1158-Y1217 WeakPolarHBondContact O-CD1 3.43Å; Q1158-Y1217 WeakPolarHBondContact O-CE1 3.39Å
1159C77Confident81.4Confident22 Ų2225.4 Ų25.415%0.14917%0.166CC..SBendtrans-72.3154.4178.6770000112.2K1095 L1156 L1157 I1161K1095-C1159 HydrophobicContact CD-CB 4.49Å; K1095-C1159 HydrophobicContact CG-CB 4.4Å; L1156-C1159 PolarHBondContact O-N 3.12Å; L1156-C1159 PolarHBondContact O-SG 3.39Å; L1157-C1159 VanDerWaalsContact C-N 3.34Å; C1159-I1161 HydrophobicContact CB-CG1 4.47Å; C1159-I1161 PolarHBondContact O-N 3.32Å; C1159-I1161 VanDerWaalsContact O-N 3.13Å; C1159-I1161 VanDerWaalsContact SG-CD1 3.54Å
1160N65.5Low80.8Confident130 Ų13028.6 Ų28.670%0.69518%0.182SC*.  trans-80.316.7-176.6-70.5-0.7000114.1R1220N1160-R1220 PolarHBondContact OD1-NH1 2.86Å; N1160-R1220 PolarHBondContact OD1-NH2 3.39Å
1161I66.6Low80.5Confident32 Ų3228.6 Ų28.616%0.16418%0.182CC..SBendtrans-77.5134.6-177.5-56.2170.9000108.1K1095 V1102 C1159 I1163K1095-I1161 VanDerWaalsContact O-CD1 3.29Å; K1095-I1161 WeakPolarHBondContact O-CD1 3.05Å; V1102-I1161 HydrophobicContact CB-CD1 4.43Å; V1102-I1161 HydrophobicContact CG1-CD1 4.17Å; V1102-I1161 HydrophobicContact CG2-CD1 3.73Å; C1159-I1161 HydrophobicContact CB-CG1 4.47Å; C1159-I1161 PolarHBondContact O-N 3.32Å; C1159-I1161 VanDerWaalsContact O-N 3.13Å; C1159-I1161 VanDerWaalsContact SG-CD1 3.54Å; I1161-I1163 PolarHBondContact O-N 3.02Å
1162A58.2Low80.4Confident77 Ų7727.5 Ų27.564%0.63618%0.175SC*.  trans-68.175.3-175.700000112.4
1163I65Low80.2Confident22 Ų2233.3 Ų33.311%0.11320%0.197CC..  trans-99.9136.4169-55.3172000107.2V1102 F1106 I1161 G1165 A1167 K1168V1102-I1163 HydrophobicContact CG1-CD1 3.78Å; F1106-I1163 HydrophobicContact CD2-CD1 3.86Å; F1106-I1163 HydrophobicContact CD2-CG2 4.43Å; F1106-I1163 HydrophobicContact CE2-CD1 4.29Å; F1106-I1163 HydrophobicContact CE2-CG2 4.18Å; F1106-I1163 HydrophobicContact CZ-CG2 4.36Å; I1161-I1163 PolarHBondContact O-N 3.02Å; I1163-G1165 PolarHBondContact O-N 3.27Å; I1163-A1167 HydrophobicContact CG2-CB 4.25Å; I1163-K1168 HydrophobicContact CB-CG 4.41Å; I1163-K1168 HydrophobicContact CG2-CG 4.34Å; I1163-K1168 WeakPolarHBondContact O-CE 3.47Å
1164C69.8Low80.2Confident54 Ų5435.2 Ų35.237%0.36520%0.204SC..  trans-46.7127.8176.5175.90000111.5T1166 A1167 K1168C1164-T1166 PolarHBondContact O-N 3.39Å; C1164-T1166 VanDerWaalsContact O-N 3.13Å; C1164-A1167 HydrophobicContact CB-CB 4.48Å; C1164-A1167 WeakPolarHBondContact O-CB 3.46Å; C1164-A1167 PolarHBondContact O-N 2.98Å; C1164-A1167 VanDerWaalsContact O-N 3.08Å; C1164-K1168 PolarHBondContact O-N 2.92Å
1165G72.2Confident80.3Confident5 Ų535.2 Ų35.25%0.05220%0.204CC..Hα-helixtrans-58.9-28.6-176.800000113.3I1163 K1168 C1169 N1225I1163-G1165 PolarHBondContact O-N 3.27Å; G1165-K1168 WeakPolarHBondContact O-CB 3.4Å; G1165-K1168 PolarHBondContact O-N 2.91Å; G1165-C1169 PolarHBondContact O-N 3.3Å; G1165-C1169 PolarHBondContact O-SG 3.09Å; G1165-N1225 VanDerWaalsContact C-ND2 3.27Å; G1165-N1225 WeakPolarHBondContact CA-OD1 3.49Å; G1165-N1225 PolarHBondContact N-OD1 3.1Å; G1165-N1225 PolarHBondContact O-ND2 2.98Å
1166T73.6Confident80.5Confident69 Ų6934.2 Ų34.242%0.42319%0.193SC..Hα-helixtrans-66.9-43.3178.3-58.10000110.6C1164 K1168 C1169 L1170 N1225C1164-T1166 PolarHBondContact O-N 3.39Å; C1164-T1166 VanDerWaalsContact O-N 3.13Å; T1166-K1168 VanDerWaalsContact C-N 3.33Å; T1166-K1168 PolarHBondContact O-N 3.41Å; T1166-C1169 PolarHBondContact O-N 3.05Å; T1166-L1170 WeakPolarHBondContact O-CG 3.29Å; T1166-L1170 PolarHBondContact O-N 2.59Å; T1166-N1225 PolarHBondContact N-ND2 3.28Å; T1166-N1225 PolarHBondContact N-OD1 3.24Å; T1166-N1225 PolarHBondContact OG1-OD1 3.39Å
1167A77.8Confident80.7Confident28 Ų2834.6 Ų34.623%0.23120%0.197CC..Hα-helixtrans-61.3-44.9175.300000110.3F1106 I1163 C1164 C1169 L1170 L1171F1106-A1167 HydrophobicContact CE1-CB 3.77Å; F1106-A1167 VanDerWaalsContact CZ-C 3.47Å; F1106-A1167 HydrophobicContact CZ-CB 3.86Å; F1106-A1167 WeakPolarHBondContact CZ-O 3.48Å; I1163-A1167 HydrophobicContact CG2-CB 4.25Å; C1164-A1167 HydrophobicContact CB-CB 4.48Å; C1164-A1167 WeakPolarHBondContact O-CB 3.46Å; C1164-A1167 PolarHBondContact O-N 2.98Å; C1164-A1167 VanDerWaalsContact O-N 3.08Å; A1167-C1169 PolarHBondContact O-N 2.85Å; A1167-L1170 WeakPolarHBondContact O-CB 3.48Å; A1167-L1170 PolarHBondContact O-N 3.09Å; A1167-L1170 VanDerWaalsContact O-N 3.15Å; A1167-L1171 PolarHBondContact O-N 2.99Å
1168K84.8Confident81Confident6 Ų634.6 Ų34.63%0.02620%0.197CC..Hα-helixtrans-57.8-47174.7-65-177.9178.6173.10111.6L1157 I1163 C1164 G1165 T1166 L1170 L1171 R1172 D1221L1157-K1168 HydrophobicContact CD1-CB 4.3Å; L1157-K1168 VanDerWaalsContact CD1-O 3.28Å; L1157-K1168 WeakPolarHBondContact CD1-O 2.99Å; I1163-K1168 HydrophobicContact CB-CG 4.41Å; I1163-K1168 HydrophobicContact CG2-CG 4.34Å; I1163-K1168 WeakPolarHBondContact O-CE 3.47Å; C1164-K1168 PolarHBondContact O-N 2.92Å; G1165-K1168 WeakPolarHBondContact O-CB 3.4Å; G1165-K1168 PolarHBondContact O-N 2.91Å; T1166-K1168 VanDerWaalsContact C-N 3.33Å; T1166-K1168 PolarHBondContact O-N 3.41Å; K1168-L1170 VanDerWaalsContact C-N 3.29Å; K1168-L1170 PolarHBondContact O-N 3.38Å; K1168-L1171 PolarHBondContact O-N 3.04Å; K1168-R1172 WeakPolarHBondContact O-CB 3.41Å; K1168-R1172 PolarHBondContact O-N 3.48Å; K1168-D1221 HydrophobicContact CD-CB 4.23Å; K1168-D1221 VanDerWaalsContact CD-CG 3.49Å; K1168-D1221 WeakPolarHBondContact CD-OD1 3.42Å; K1168-D1221 IonicContact NZ-OD1 3.21Å; K1168-D1221 PolarHBondContact NZ-OD1 3.17Å
1169C83.7Confident81.4Confident17 Ų1733.7 Ų33.712%0.11519%0.192CC..Hα-helixtrans-57.4-40.9175.8-70.20000112.5G1165 T1166 A1167 R1173 F1332G1165-C1169 PolarHBondContact O-N 3.3Å; G1165-C1169 PolarHBondContact O-SG 3.09Å; T1166-C1169 PolarHBondContact O-N 3.05Å; A1167-C1169 PolarHBondContact O-N 2.85Å; C1169-R1173 WeakPolarHBondContact O-CB 3.27Å; C1169-R1173 PolarHBondContact O-N 3.43Å; C1169-F1332 HydrophobicContact CB-CE2 4.37Å; C1169-F1332 HydrophobicContact CB-CZ 4.22Å
1170L84.4Confident82.3Confident67 Ų6732.7 Ų32.735%0.35119%0.186SC..Hα-helixtrans-64.5-48.1177.1-71.6172.2000112.7L1110 T1166 A1167 K1168 R1172 R1173 R1174L1110-L1170 HydrophobicContact CD1-CB 4.27Å; T1166-L1170 WeakPolarHBondContact O-CG 3.29Å; T1166-L1170 PolarHBondContact O-N 2.59Å; A1167-L1170 WeakPolarHBondContact O-CB 3.48Å; A1167-L1170 PolarHBondContact O-N 3.09Å; A1167-L1170 VanDerWaalsContact O-N 3.15Å; K1168-L1170 VanDerWaalsContact C-N 3.29Å; K1168-L1170 PolarHBondContact O-N 3.38Å; L1170-R1172 VanDerWaalsContact C-N 3.35Å; L1170-R1173 PolarHBondContact O-N 2.95Å; L1170-R1174 WeakPolarHBondContact O-CG 3.36Å; L1170-R1174 PolarHBondContact O-N 2.84Å; L1170-R1174 VanDerWaalsContact O-N 3.14Å
1171L89.9Confident83.6Confident0 Ų026.6 Ų26.60%015%0.153CC..Hα-helixtrans-64.2-41.8178.3177.958.5000111F1106 F1109 L1110 F1113 L1157 A1167 K1168 R1173 R1174 I1175F1106-L1171 HydrophobicContact CD2-CD2 3.77Å; F1106-L1171 HydrophobicContact CE1-CB 4.32Å; F1106-L1171 HydrophobicContact CE1-CD2 4.49Å; F1106-L1171 HydrophobicContact CE2-CB 4.13Å; F1106-L1171 HydrophobicContact CE2-CD2 3.5Å; F1106-L1171 VanDerWaalsContact CE2-CD2 3.5Å; F1106-L1171 HydrophobicContact CE2-CG 4.45Å; F1106-L1171 HydrophobicContact CG-CD2 4.38Å; F1106-L1171 HydrophobicContact CZ-CB 3.7Å; F1106-L1171 HydrophobicContact CZ-CD2 3.87Å; F1106-L1171 HydrophobicContact CZ-CG 4.43Å; F1109-L1171 HydrophobicContact CB-CD1 3.73Å; F1109-L1171 HydrophobicContact CB-CD2 4.31Å; L1110-L1171 HydrophobicContact CD1-CB 4.23Å; F1113-L1171 HydrophobicContact CD2-CD1 3.97Å; F1113-L1171 HydrophobicContact CE2-CD1 4.42Å; L1157-L1171 HydrophobicContact CD1-CB 3.7Å; L1157-L1171 HydrophobicContact CD1-CD2 3.85Å; L1157-L1171 HydrophobicContact CD1-CG 3.77Å; A1167-L1171 PolarHBondContact O-N 2.99Å; K1168-L1171 PolarHBondContact O-N 3.04Å; L1171-R1173 VanDerWaalsContact C-N 3.33Å; L1171-R1173 PolarHBondContact O-N 3.49Å; L1171-R1174 PolarHBondContact O-N 2.88Å; L1171-R1174 VanDerWaalsContact O-N 3.14Å; L1171-I1175 HydrophobicContact CD1-CD1 4.34Å; L1171-I1175 HydrophobicContact CD1-CG1 4.29Å; L1171-I1175 HydrophobicContact CG-CD1 4Å; L1171-I1175 HydrophobicContact CG-CG1 4.43Å; L1171-I1175 WeakPolarHBondContact O-CG1 3.43Å; L1171-I1175 PolarHBondContact O-N 3.49Å
1172R91.7Very high84.8Confident0 Ų025.3 Ų25.30%015%0.146CC..Hα-helixtrans-57.7-44.6175-174.3178.1-81.4108-7.1111.9L1157 K1168 L1170 R1174 I1175 Y1176 D1214 L1218 D1221 F1332L1157-R1172 HydrophobicContact CD1-CB 4.17Å; L1157-R1172 HydrophobicContact CD2-CB 4.02Å; L1157-R1172 HydrophobicContact CD2-CG 4.34Å; K1168-R1172 WeakPolarHBondContact O-CB 3.41Å; K1168-R1172 PolarHBondContact O-N 3.48Å; L1170-R1172 VanDerWaalsContact C-N 3.35Å; R1172-R1174 VanDerWaalsContact C-N 3.32Å; R1172-R1174 PolarHBondContact O-N 2.89Å; R1172-I1175 PolarHBondContact O-N 2.83Å; R1172-Y1176 HydrophobicContact CG-CD1 4.26Å; R1172-Y1176 HydrophobicContact CG-CE1 3.76Å; R1172-Y1176 HydrophobicContact CG-CE2 4.2Å; R1172-Y1176 WeakPolarHBondContact O-CD1 3.24Å; R1172-Y1176 PolarHBondContact O-N 3.44Å; R1172-D1214 IonicContact CZ-OD1 3.51Å; R1172-D1214 IonicContact CZ-OD2 3.84Å; R1172-D1214 IonicContact NE-OD1 3.97Å; R1172-D1214 IonicContact NE-OD2 3.35Å; R1172-D1214 PolarHBondContact NE-OD2 3.41Å; R1172-D1214 IonicContact NH2-OD1 3.35Å; R1172-D1214 PolarHBondContact NH2-OD1 3.24Å; R1172-D1214 VanDerWaalsContact NH2-OD1 3.14Å; R1172-D1214 IonicContact NH2-OD2 3.17Å; R1172-L1218 VanDerWaalsContact CD-CD2 3.46Å; R1172-D1221 IonicContact CZ-OD2 3.75Å; R1172-D1221 VanDerWaalsContact CZ-OD2 3.28Å; R1172-D1221 IonicContact NH1-OD2 3.26Å; R1172-D1221 PolarHBondContact NH1-OD2 2.78Å; R1172-D1221 IonicContact NH2-OD2 3Å; R1172-D1221 PolarHBondContact NH2-OD2 3.26Å; R1172-F1332 HydrophobicContact CB-CE1 4.27Å; R1172-F1332 HydrophobicContact CG-CD1 4.26Å; R1172-F1332 HydrophobicContact CG-CE1 4.04Å
1173R89.4Confident86.5Confident128 Ų12821.7 Ų21.748%0.48312%0.116SC..Hα-helixtrans-58.9-42.3176.3-179.2174.9172.3161.2-1.2111.8C1169 L1170 L1171 Y1176 A1177 F1332C1169-R1173 WeakPolarHBondContact O-CB 3.27Å; C1169-R1173 PolarHBondContact O-N 3.43Å; L1170-R1173 PolarHBondContact O-N 2.95Å; L1171-R1173 VanDerWaalsContact C-N 3.33Å; L1171-R1173 PolarHBondContact O-N 3.49Å; R1173-Y1176 PolarHBondContact O-N 2.83Å; R1173-A1177 WeakPolarHBondContact O-CB 3.4Å; R1173-A1177 PolarHBondContact O-N 3.35Å; R1173-F1332 HydrophobicContact CB-CE1 4.21Å; R1173-F1332 HydrophobicContact CB-CZ 4.36Å
1174R92.1Very high87.7Confident39 Ų3920.8 Ų20.815%0.14711%0.112CC..Hα-helixtrans-67.9-42.6177.1-68174.4-177.4-120.85.8112.4L1110 F1113 P1115 L1170 L1171 R1172 Y1176 A1177 V1178L1110-R1174 PolarHBondContact O-NH1 3.48Å; F1113-R1174 HydrophobicContact CB-CB 3.71Å; F1113-R1174 VanDerWaalsContact O-CD 3.32Å; F1113-R1174 WeakPolarHBondContact O-CD 3.33Å; F1113-R1174 PolarHBondContact O-NH1 3.23Å; P1115-R1174 HydrophobicContact CB-CG 4.16Å; L1170-R1174 WeakPolarHBondContact O-CG 3.36Å; L1170-R1174 PolarHBondContact O-N 2.84Å; L1170-R1174 VanDerWaalsContact O-N 3.14Å; L1171-R1174 PolarHBondContact O-N 2.88Å; L1171-R1174 VanDerWaalsContact O-N 3.14Å; R1172-R1174 VanDerWaalsContact C-N 3.32Å; R1172-R1174 PolarHBondContact O-N 2.89Å; R1174-Y1176 VanDerWaalsContact C-N 3.3Å; R1174-Y1176 PolarHBondContact O-N 3.3Å; R1174-A1177 PolarHBondContact O-N 3.33Å; R1174-V1178 WeakPolarHBondContact O-CG2 3.1Å; R1174-V1178 PolarHBondContact O-N 3.26Å
1175I94.3Very high88.6Confident0 Ų019.5 Ų19.50%010%0.102CC..Hα-helixtrans-56.5-47173.8-68.4167.5000110F1113 L1150 A1153 L1154 L1171 R1172 V1178 A1179 F1207F1113-I1175 HydrophobicContact CD2-CG1 3.99Å; F1113-I1175 HydrophobicContact CE2-CG1 3.94Å; L1150-I1175 HydrophobicContact CB-CG2 4.47Å; L1150-I1175 HydrophobicContact CD2-CB 4.44Å; L1150-I1175 HydrophobicContact CD2-CG2 4.07Å; A1153-I1175 HydrophobicContact CB-CD1 3.91Å; A1153-I1175 HydrophobicContact CB-CG1 4.26Å; L1154-I1175 HydrophobicContact CB-CD1 4.37Å; L1171-I1175 HydrophobicContact CD1-CD1 4.34Å; L1171-I1175 HydrophobicContact CD1-CG1 4.29Å; L1171-I1175 HydrophobicContact CG-CD1 4Å; L1171-I1175 HydrophobicContact CG-CG1 4.43Å; L1171-I1175 WeakPolarHBondContact O-CG1 3.43Å; L1171-I1175 PolarHBondContact O-N 3.49Å; R1172-I1175 PolarHBondContact O-N 2.83Å; I1175-V1178 PolarHBondContact O-N 2.89Å; I1175-A1179 WeakPolarHBondContact O-CB 3.33Å; I1175-A1179 PolarHBondContact O-N 3.16Å; I1175-F1207 HydrophobicContact CG2-CE2 4.15Å; I1175-F1207 HydrophobicContact CG2-CZ 4.32Å
1176Y94.3Very high89.4Confident1 Ų122.3 Ų22.30%0.00411%0.114CC..Hα-helixtrans-66.4-40-180-71.810.6000112R1172 R1173 R1174 A1179 L1180 I1211 D1214 F1332 K1335 R1336 L1339R1172-Y1176 HydrophobicContact CG-CD1 4.26Å; R1172-Y1176 HydrophobicContact CG-CE1 3.76Å; R1172-Y1176 HydrophobicContact CG-CE2 4.2Å; R1172-Y1176 WeakPolarHBondContact O-CD1 3.24Å; R1172-Y1176 PolarHBondContact O-N 3.44Å; R1173-Y1176 PolarHBondContact O-N 2.83Å; R1174-Y1176 VanDerWaalsContact C-N 3.3Å; R1174-Y1176 PolarHBondContact O-N 3.3Å; Y1176-A1179 PolarHBondContact O-N 2.66Å; Y1176-L1180 WeakPolarHBondContact O-CB 3.46Å; Y1176-L1180 VanDerWaalsContact O-CG 3.26Å; Y1176-L1180 WeakPolarHBondContact O-CG 3.26Å; Y1176-L1180 PolarHBondContact O-N 3.46Å; Y1176-I1211 HydrophobicContact CD1-CD1 4.14Å; Y1176-I1211 HydrophobicContact CE1-CD1 3.56Å; Y1176-D1214 PolarHBondContact OH-OD2 2.95Å; Y1176-F1332 HydrophobicContact CD2-CD1 4.28Å; Y1176-F1332 AromaticContact CE2-CD1 3.99Å; Y1176-F1332 HydrophobicContact CE2-CD1 3.99Å; Y1176-K1335 HydrophobicContact CD2-CB 3.83Å; Y1176-K1335 HydrophobicContact CE2-CB 4.3Å; Y1176-R1336 HydrophobicContact CE2-CB 4.22Å; Y1176-L1339 HydrophobicContact CD1-CD1 3.75Å; Y1176-L1339 HydrophobicContact CD2-CD1 4.16Å; Y1176-L1339 HydrophobicContact CE1-CD1 4.36Å; Y1176-L1339 HydrophobicContact CG-CD1 3.65Å
1177A91.8Very high90.2Very high9 Ų919.7 Ų19.77%0.07410%0.098CC..Hα-helixtrans-62-47.517600000111.5I1117 R1173 R1174 A1179 L1180 D1181I1117-A1177 HydrophobicContact CG1-CB 4.22Å; R1173-A1177 WeakPolarHBondContact O-CB 3.4Å; R1173-A1177 PolarHBondContact O-N 3.35Å; R1174-A1177 PolarHBondContact O-N 3.33Å; A1177-A1179 VanDerWaalsContact C-N 3.33Å; A1177-A1179 PolarHBondContact O-N 3.23Å; A1177-L1180 PolarHBondContact O-N 2.95Å; A1177-D1181 WeakPolarHBondContact O-CB 3.36Å; A1177-D1181 PolarHBondContact O-N 2.88Å
1178V93.3Very high90.7Very high1 Ų120.2 Ų20.21%0.00610%0.096CC..Hα-helixtrans-65.6-35.2176.9178.10000111.2F1113 F1136 R1146 L1150 R1174 I1175F1113-V1178 HydrophobicContact CB-CG2 3.84Å; F1113-V1178 HydrophobicContact CD1-CG2 4.15Å; F1113-V1178 HydrophobicContact CG-CG2 4.21Å; F1136-V1178 HydrophobicContact CD2-CG1 3.77Å; F1136-V1178 HydrophobicContact CD2-CG2 4.41Å; F1136-V1178 HydrophobicContact CE2-CG1 4.04Å; F1136-V1178 HydrophobicContact CE2-CG2 4.36Å; F1136-V1178 HydrophobicContact CG-CG1 4.15Å; R1146-V1178 HydrophobicContact CG-CG1 4.44Å; R1146-V1178 PolarHBondContact NE-O 3.35Å; R1146-V1178 PolarHBondContact NH2-O 2.98Å; L1150-V1178 HydrophobicContact CD1-CG1 4.24Å; L1150-V1178 HydrophobicContact CD2-CB 4Å; L1150-V1178 HydrophobicContact CD2-CG1 3.93Å; L1150-V1178 HydrophobicContact CG-CG1 4.49Å; R1174-V1178 WeakPolarHBondContact O-CG2 3.1Å; R1174-V1178 PolarHBondContact O-N 3.26Å; I1175-V1178 PolarHBondContact O-N 2.89Å
1179A95Very high90.9Very high0 Ų021.4 Ų21.40%010%0.104CC..Hα-helixtrans-67.6-43.5174.300000112.4F1147 L1150 I1175 Y1176 A1177 Y1182 F1183 F1207 L1339F1147-A1179 HydrophobicContact CE1-CB 4.23Å; L1150-A1179 HydrophobicContact CD1-CB 4.01Å; I1175-A1179 WeakPolarHBondContact O-CB 3.33Å; I1175-A1179 PolarHBondContact O-N 3.16Å; Y1176-A1179 PolarHBondContact O-N 2.66Å; A1177-A1179 VanDerWaalsContact C-N 3.33Å; A1177-A1179 PolarHBondContact O-N 3.23Å; A1179-Y1182 PolarHBondContact O-N 3.36Å; A1179-F1183 VanDerWaalsContact O-CD2 3.32Å; A1179-F1183 WeakPolarHBondContact O-CD2 3.43Å; A1179-F1183 WeakPolarHBondContact O-CE2 3.33Å; A1179-F1207 HydrophobicContact CB-CE1 3.89Å; A1179-F1207 HydrophobicContact CB-CZ 3.81Å; A1179-L1339 HydrophobicContact CB-CD1 4.33Å; A1179-L1339 HydrophobicContact CB-CD2 3.56Å
1180L94.3Very high91.2Very high2 Ų221.2 Ų21.21%0.0110%0.103CC..Hα-helixtrans-68.2-34.1-179.6-75.4170.4000112.8I1117 Y1176 A1177 Y1182 F1183 L1338 L1339 L1342 I1398 I1402I1117-L1180 HydrophobicContact CD1-CB 3.73Å; I1117-L1180 HydrophobicContact CD1-CD1 4.23Å; I1117-L1180 HydrophobicContact CG1-CB 4.33Å; Y1176-L1180 WeakPolarHBondContact O-CB 3.46Å; Y1176-L1180 VanDerWaalsContact O-CG 3.26Å; Y1176-L1180 WeakPolarHBondContact O-CG 3.26Å; Y1176-L1180 PolarHBondContact O-N 3.46Å; A1177-L1180 PolarHBondContact O-N 2.95Å; L1180-Y1182 PolarHBondContact O-N 3.38Å; L1180-F1183 WeakPolarHBondContact O-CB 3.26Å; L1180-F1183 PolarHBondContact O-N 3.03Å; L1180-L1338 HydrophobicContact CD2-CD2 4.01Å; L1180-L1338 HydrophobicContact CD2-CG 4.19Å; L1180-L1339 HydrophobicContact CD2-CD2 3.63Å; L1180-L1339 HydrophobicContact CD2-CG 3.86Å; L1180-L1339 HydrophobicContact CG-CD1 4.48Å; L1180-L1339 HydrophobicContact CG-CD2 3.7Å; L1180-L1339 HydrophobicContact CG-CG 3.96Å; L1180-L1342 HydrophobicContact CD2-CD1 3.91Å; L1180-I1398 HydrophobicContact CD1-CD1 4.27Å; L1180-I1398 HydrophobicContact CD1-CG2 4.1Å; L1180-I1402 HydrophobicContact CB-CD1 3.88Å; L1180-I1402 HydrophobicContact CD2-CD1 4.36Å; L1180-I1402 WeakPolarHBondContact O-CD1 3.36Å
1181D92.4Very high91.4Very high1 Ų120 Ų201%0.00510%0.098CC..Hα-helixtrans-60.7-26.8179.5174.186000113.5I1117 S1118 C1134 R1138 R1146 A1177 F1183 A1184I1117-D1181 HydrophobicContact CG1-CB 4.47Å; I1117-D1181 HydrophobicContact CG2-CB 3.98Å; S1118-D1181 PolarHBondContact N-OD1 3.42Å; S1118-D1181 VanDerWaalsContact N-OD1 3.16Å; C1134-D1181 PolarHBondContact SG-OD2 2.81Å; R1138-D1181 WeakPolarHBondContact CD-O 3.31Å; R1138-D1181 IonicContact CZ-OD1 3.11Å; R1138-D1181 PolarHBondContact NE-O 3.3Å; R1138-D1181 IonicContact NE-OD1 3.32Å; R1138-D1181 PolarHBondContact NE-OD1 3.07Å; R1138-D1181 IonicContact NE-OD2 2.65Å; R1138-D1181 IonicContact NH2-OD1 2.81Å; R1138-D1181 PolarHBondContact NH2-OD1 3.35Å; R1146-D1181 IonicContact CZ-OD2 2.76Å; R1146-D1181 IonicContact NH1-OD2 2.93Å; R1146-D1181 IonicContact NH2-OD2 3.6Å; R1146-D1181 PolarHBondContact NH2-OD2 3.35Å; A1177-D1181 WeakPolarHBondContact O-CB 3.36Å; A1177-D1181 PolarHBondContact O-N 2.88Å; D1181-F1183 PolarHBondContact O-N 3.01Å; D1181-A1184 WeakPolarHBondContact O-CB 3.34Å; D1181-A1184 PolarHBondContact O-N 2.99Å
1182Y93.3Very high91.2Very high6 Ų621.5 Ų21.52%0.02411%0.105CC..G310 helixtrans-60.9-33.2171174.2-104.1000112.6R1138 A1143 F1147 A1179 L1180 A1184 E1346R1138-Y1182 WeakPolarHBondContact O-CE2 3.3Å; A1143-Y1182 HydrophobicContact CB-CE2 3.9Å; F1147-Y1182 HydrophobicContact CE2-CD1 4.05Å; F1147-Y1182 HydrophobicContact CE2-CE1 4.41Å; F1147-Y1182 HydrophobicContact CE2-CG 4.21Å; F1147-Y1182 HydrophobicContact CZ-CD1 4.11Å; F1147-Y1182 HydrophobicContact CZ-CG 4.34Å; A1179-Y1182 PolarHBondContact O-N 3.36Å; L1180-Y1182 PolarHBondContact O-N 3.38Å; Y1182-A1184 VanDerWaalsContact C-N 3.31Å; Y1182-A1184 PolarHBondContact O-N 3.04Å; Y1182-E1346 HydrophobicContact CE1-CG 3.95Å; Y1182-E1346 WeakPolarHBondContact CE1-OE1 3.48Å; Y1182-E1346 PolarHBondContact OH-OE1 3.22Å
1183F94.3Very high90.9Very high0 Ų025.7 Ų25.70%013%0.127CC..G310 helixtrans-86.3-0.3-176.4-61-77.8000113.7F1147 A1179 L1180 D1181 V1185 L1342 V1343 E1346 I1402F1147-F1183 HydrophobicContact CZ-CE2 4.27Å; F1147-F1183 HydrophobicContact CZ-CZ 4.41Å; A1179-F1183 VanDerWaalsContact O-CD2 3.32Å; A1179-F1183 WeakPolarHBondContact O-CD2 3.43Å; A1179-F1183 WeakPolarHBondContact O-CE2 3.33Å; L1180-F1183 WeakPolarHBondContact O-CB 3.26Å; L1180-F1183 PolarHBondContact O-N 3.03Å; D1181-F1183 PolarHBondContact O-N 3.01Å; F1183-V1185 PolarHBondContact O-N 3.08Å; F1183-L1342 HydrophobicContact CB-CD1 4.04Å; F1183-L1342 HydrophobicContact CD1-CB 3.85Å; F1183-L1342 HydrophobicContact CD1-CD1 4.5Å; F1183-L1342 HydrophobicContact CD1-CD2 4.21Å; F1183-L1342 HydrophobicContact CD1-CG 4.42Å; F1183-L1342 HydrophobicContact CD2-CB 4.02Å; F1183-L1342 HydrophobicContact CD2-CD1 4.04Å; F1183-L1342 HydrophobicContact CE1-CB 3.77Å; F1183-L1342 WeakPolarHBondContact CE1-O 3.31Å; F1183-L1342 HydrophobicContact CE2-CB 3.93Å; F1183-L1342 HydrophobicContact CG-CB 3.99Å; F1183-L1342 HydrophobicContact CG-CD1 3.94Å; F1183-L1342 HydrophobicContact CG-CD2 4.38Å; F1183-L1342 HydrophobicContact CG-CG 4.34Å; F1183-L1342 HydrophobicContact CZ-CB 3.82Å; F1183-V1343 HydrophobicContact CE2-CG2 3.84Å; F1183-V1343 HydrophobicContact CZ-CB 4.39Å; F1183-V1343 HydrophobicContact CZ-CG2 3.72Å; F1183-E1346 HydrophobicContact CE1-CB 4.01Å; F1183-E1346 HydrophobicContact CE1-CG 4.4Å; F1183-E1346 HydrophobicContact CZ-CB 4.41Å; F1183-I1402 HydrophobicContact CB-CG2 4.22Å
1184A90.3Very high90.6Very high3 Ų323.1 Ų23.13%0.02512%0.123CC..G310 helixtrans-77.95.6178.700000113.7D1181 Y1182 D1401 I1402 Y1405D1181-A1184 WeakPolarHBondContact O-CB 3.34Å; D1181-A1184 PolarHBondContact O-N 2.99Å; Y1182-A1184 VanDerWaalsContact C-N 3.31Å; Y1182-A1184 PolarHBondContact O-N 3.04Å; A1184-D1401 HydrophobicContact CB-CB 4.09Å; A1184-I1402 HydrophobicContact CB-CG1 4Å; A1184-Y1405 WeakPolarHBondContact O-CE2 3.31Å
1185V88.5Confident90.2Very high27 Ų2723.1 Ų23.116%0.16414%0.135CC..SBendtrans-125.7161.3174.4-67.30000110.9R1138 F1183 Y1405 R1409R1138-V1185 HydrophobicContact CB-CG1 4.17Å; R1138-V1185 HydrophobicContact CB-CG2 3.8Å; R1138-V1185 HydrophobicContact CG-CG1 4.5Å; F1183-V1185 PolarHBondContact O-N 3.08Å; V1185-Y1405 VanDerWaalsContact C-CD2 3.44Å; V1185-R1409 PolarHBondContact O-NH2 3.23Å
1186H88Confident90Very high65 Ų6524.1 Ų24.130%0.30114%0.142SC..PPolyproline II helixtrans-55.2140.7173.3-169.4-83.1000110.6Q1188 Y1405H1186-Q1188 WeakPolarHBondContact O-CG 3.43Å; H1186-Q1188 PolarHBondContact O-N 3.01Å; H1186-Y1405 HydrophobicContact CB-CD1 3.85Å; H1186-Y1405 HydrophobicContact CB-CE1 3.59Å; H1186-Y1405 AromaticContact CD2-CD1 3.97Å; H1186-Y1405 AromaticContact CD2-CE1 4Å
1187P90.7Very high89.8Confident14 Ų1424.3 Ų24.39%0.09114%0.143CC..PPolyproline II helixtrans-52.9126.4172-22.630.7000111.4V1408 R1409P1187-V1408 HydrophobicContact CG-CG1 4.36Å; P1187-R1409 HydrophobicContact CG-CG 3.74Å
1188Q88.7Confident89.9Confident39 Ų3927.6 Ų27.618%0.18215%0.154CC..PPolyproline II helixtrans-100.2145.4-177.2-56.1179.85.200110.8E1055 H1139 V1140 H1186 R1349E1055-Q1188 PolarHBondContact OE1-NE2 3.44Å; H1139-Q1188 PolarHBondContact CD2-OE1 3.32Å; V1140-Q1188 HydrophobicContact CB-CB 4.2Å; V1140-Q1188 HydrophobicContact CG1-CB 4.11Å; V1140-Q1188 VanDerWaalsContact N-OE1 3.14Å; H1186-Q1188 WeakPolarHBondContact O-CG 3.43Å; H1186-Q1188 PolarHBondContact O-N 3.01Å; Q1188-R1349 PolarHBondContact O-NH1 3.27Å; Q1188-R1349 PolarHBondContact O-NH2 3.02Å
1189C88.9Confident89.8Confident30 Ų3032 Ų3220%0.20317%0.174CC..PPolyproline II helixtrans-64.5136.8172.2-61.80000110.1V1140 T1191 W1353 I1720V1140-C1189 WeakPolarHBondContact CG1-O 3.25Å; C1189-T1191 PolarHBondContact O-N 2.71Å; C1189-W1353 HydrophobicContact CB-CH2 3.92Å; C1189-W1353 HydrophobicContact CB-CZ2 4.15Å; C1189-W1353 HydrophobicContact CB-CZ3 4.46Å; C1189-I1720 HydrophobicContact CB-CB 4.39Å; C1189-I1720 HydrophobicContact CB-CG2 3.5Å; C1189-I1720 VanDerWaalsContact CB-CG2 3.5Å
1190P90.6Very high89.8Confident14 Ų1432 Ų329%0.09117%0.174CC..PPolyproline II helixtrans-59.5130.7176.2-22.334.3000111.5L1197 L1350 W1353P1190-L1197 HydrophobicContact CB-CD1 4Å; P1190-L1197 HydrophobicContact CB-CD2 3.98Å; P1190-L1197 HydrophobicContact CG-CD1 4.36Å; P1190-L1197 HydrophobicContact CG-CD2 4.31Å; P1190-L1350 HydrophobicContact CG-CD2 3.73Å; P1190-W1353 VanDerWaalsContact CD-CD2 3.46Å; P1190-W1353 HydrophobicContact CG-CB 3.82Å; P1190-W1353 HydrophobicContact CG-CD2 3.99Å; P1190-W1353 HydrophobicContact CG-CE3 4.39Å; P1190-W1353 HydrophobicContact CG-CG 3.71Å
1191T86.7Confident89.8Confident41 Ų4132 Ų3225%0.25217%0.174SC..  trans-107.9-0.8175.6660000112P1072 C1189P1072-T1191 HydrophobicContact CB-CG2 4.26Å; C1189-T1191 PolarHBondContact O-N 2.71Å
1192Q86.8Confident89.9Confident32 Ų3233.3 Ų33.315%0.1519%0.185CC..SBendtrans-78.2150.1-179.8-59.596.9-50.500110.9V1140 A1141 L1197 D1200V1140-Q1192 PolarHBondContact O-NE2 3.42Å; A1141-Q1192 HydrophobicContact CB-CG 4.43Å; Q1192-L1197 HydrophobicContact CB-CB 4.11Å; Q1192-D1200 PolarHBondContact NE2-OD2 2.87Å
1193D85Confident89.9Confident87 Ų8735.8 Ų35.847%0.46519%0.194SC..  trans-61.7162.8164.770.183.6000111G1195 S1196 L1197D1193-G1195 VanDerWaalsContact C-N 3.25Å; D1193-G1195 PolarHBondContact O-N 3.18Å; D1193-G1195 WeakPolarHBondContact OD1-CA 3.15Å; D1193-G1195 PolarHBondContact OD1-N 2.96Å; D1193-S1196 PolarHBondContact O-N 3.46Å; D1193-S1196 PolarHBondContact OD1-N 2.82Å; D1193-S1196 WeakPolarHBondContact OD2-CB 3.27Å; D1193-S1196 PolarHBondContact OD2-OG 2.81Å; D1193-L1197 WeakPolarHBondContact O-CB 3.43Å; D1193-L1197 PolarHBondContact O-N 3.06Å
1194I83.7Confident90Very high74 Ų7435.8 Ų35.838%0.37919%0.194SC..Hα-helixtrans-58-37.1-174.1-65.4172.2000112R1198 Y1354I1194-R1198 WeakPolarHBondContact O-CB 3.21Å; I1194-R1198 PolarHBondContact O-N 2.86Å; I1194-R1198 VanDerWaalsContact O-N 3.15Å; I1194-Y1354 HydrophobicContact CG2-CD2 4.04Å; I1194-Y1354 HydrophobicContact CG2-CE2 3.63Å
1195G84.4Confident90.2Very high39 Ų3935.8 Ų35.840%0.40219%0.194SC..Hα-helixtrans-70.5-50.517900000111.8D1193 L1197 R1198 E1199D1193-G1195 VanDerWaalsContact C-N 3.25Å; D1193-G1195 PolarHBondContact O-N 3.18Å; D1193-G1195 WeakPolarHBondContact OD1-CA 3.15Å; D1193-G1195 PolarHBondContact OD1-N 2.96Å; G1195-L1197 VanDerWaalsContact C-N 3.31Å; G1195-L1197 PolarHBondContact O-N 3.48Å; G1195-R1198 WeakPolarHBondContact O-CB 3.33Å; G1195-R1198 PolarHBondContact O-N 3.37Å; G1195-E1199 PolarHBondContact O-N 2.78Å; G1195-E1199 VanDerWaalsContact O-N 3.12Å
1196S88.1Confident90.5Very high22 Ų2239.2 Ų39.215%0.15421%0.207CC..Hα-helixtrans-60.2-38.8176.5-68.20000112.5D1193 E1199 D1200D1193-S1196 PolarHBondContact O-N 3.46Å; D1193-S1196 PolarHBondContact OD1-N 2.82Å; D1193-S1196 WeakPolarHBondContact OD2-CB 3.27Å; D1193-S1196 PolarHBondContact OD2-OG 2.81Å; S1196-E1199 PolarHBondContact O-N 3.03Å; S1196-D1200 PolarHBondContact O-N 3.18Å
1197L92.1Very high90.9Very high5 Ų536.1 Ų36.13%0.02619%0.192CC..Hα-helixtrans-64.9-42.5176.8-178.657000111.5P1190 Q1192 D1193 G1195 E1199 D1200 I1201 L1350P1190-L1197 HydrophobicContact CB-CD1 4Å; P1190-L1197 HydrophobicContact CB-CD2 3.98Å; P1190-L1197 HydrophobicContact CG-CD1 4.36Å; P1190-L1197 HydrophobicContact CG-CD2 4.31Å; Q1192-L1197 HydrophobicContact CB-CB 4.11Å; D1193-L1197 WeakPolarHBondContact O-CB 3.43Å; D1193-L1197 PolarHBondContact O-N 3.06Å; G1195-L1197 VanDerWaalsContact C-N 3.31Å; G1195-L1197 PolarHBondContact O-N 3.48Å; L1197-E1199 VanDerWaalsContact C-N 3.32Å; L1197-E1199 PolarHBondContact O-N 3.29Å; L1197-D1200 PolarHBondContact O-N 3.26Å; L1197-I1201 HydrophobicContact CD1-CD1 4.17Å; L1197-I1201 HydrophobicContact CD1-CG1 4.27Å; L1197-I1201 HydrophobicContact CG-CD1 3.96Å; L1197-I1201 VanDerWaalsContact O-CG1 3.25Å; L1197-I1201 WeakPolarHBondContact O-CG1 3.31Å; L1197-I1201 PolarHBondContact O-N 3.46Å; L1197-L1350 HydrophobicContact CD1-CD2 4.23Å
1198R93.7Very high91.1Very high78 Ų7835.5 Ų35.529%0.29419%0.188SC..Hα-helixtrans-58.3-45.4175.8-177.4-172.1176.5-96.91.3111.4I1194 G1195 I1201 A1202 Y1354 I1364I1194-R1198 WeakPolarHBondContact O-CB 3.21Å; I1194-R1198 PolarHBondContact O-N 2.86Å; I1194-R1198 VanDerWaalsContact O-N 3.15Å; G1195-R1198 WeakPolarHBondContact O-CB 3.33Å; G1195-R1198 PolarHBondContact O-N 3.37Å; R1198-I1201 PolarHBondContact O-N 2.93Å; R1198-A1202 PolarHBondContact O-N 3.01Å; R1198-Y1354 HydrophobicContact CB-CD2 4.37Å; R1198-Y1354 HydrophobicContact CB-CE2 3.73Å; R1198-Y1354 WeakPolarHBondContact CD-OH 3.47Å; R1198-Y1354 HydrophobicContact CG-CE1 4.39Å; R1198-Y1354 HydrophobicContact CG-CE2 4.24Å; R1198-I1364 HydrophobicContact CG-CD1 3.89Å; R1198-I1364 HydrophobicContact CG-CG1 4.19Å
1199E90.9Very high91.4Very high93 Ų9337.1 Ų37.144%0.43520%0.196SC..Hα-helixtrans-62.8-44.2177-70.1179.5174.600112.2K1081 G1195 S1196 L1197 I1201 A1202 W1203K1081-E1199 IonicContact NZ-OE2 4Å; K1081-E1199 PolarHBondContact NZ-OE2 3.1Å; G1195-E1199 PolarHBondContact O-N 2.78Å; G1195-E1199 VanDerWaalsContact O-N 3.12Å; S1196-E1199 PolarHBondContact O-N 3.03Å; L1197-E1199 VanDerWaalsContact C-N 3.32Å; L1197-E1199 PolarHBondContact O-N 3.29Å; E1199-I1201 PolarHBondContact O-N 3.33Å; E1199-A1202 WeakPolarHBondContact O-CB 3.13Å; E1199-A1202 PolarHBondContact O-N 3.41Å; E1199-W1203 VanDerWaalsContact O-CD1 3.26Å; E1199-W1203 PolarHBondContact O-N 3.3Å
1200D93.6Very high91.6Very high1 Ų136.3 Ų36.31%0.00519%0.191CC..Hα-helixtrans-62.2-44.9179.6-70.4-0.6000110.6K1081 G1144 Q1192 S1196 L1197 A1202 W1203 I1204K1081-D1200 VanDerWaalsContact CE-OD1 3.25Å; K1081-D1200 WeakPolarHBondContact CE-OD1 3.31Å; K1081-D1200 IonicContact NZ-OD1 3.29Å; K1081-D1200 PolarHBondContact NZ-OD1 2.95Å; G1144-D1200 WeakPolarHBondContact CA-OD1 3.18Å; Q1192-D1200 PolarHBondContact NE2-OD2 2.87Å; S1196-D1200 PolarHBondContact O-N 3.18Å; L1197-D1200 PolarHBondContact O-N 3.26Å; D1200-A1202 VanDerWaalsContact C-N 3.32Å; D1200-A1202 PolarHBondContact O-N 3.4Å; D1200-W1203 PolarHBondContact O-N 3.45Å; D1200-I1204 WeakPolarHBondContact O-CD1 3.49Å; D1200-I1204 WeakPolarHBondContact O-CG1 3.47Å; D1200-I1204 PolarHBondContact O-N 3.08Å
1201I95.2Very high91.8Very high0 Ų035.8 Ų35.80%019%0.187CC..Hα-helixtrans-58.9-44.7174.7-65.2164.4000110.7L1197 R1198 E1199 W1203 I1204 M1205 V1347 L1350 L1351 Y1354 I1364L1197-I1201 HydrophobicContact CD1-CD1 4.17Å; L1197-I1201 HydrophobicContact CD1-CG1 4.27Å; L1197-I1201 HydrophobicContact CG-CD1 3.96Å; L1197-I1201 VanDerWaalsContact O-CG1 3.25Å; L1197-I1201 WeakPolarHBondContact O-CG1 3.31Å; L1197-I1201 PolarHBondContact O-N 3.46Å; R1198-I1201 PolarHBondContact O-N 2.93Å; E1199-I1201 PolarHBondContact O-N 3.33Å; I1201-W1203 VanDerWaalsContact C-N 3.33Å; I1201-W1203 PolarHBondContact O-N 2.87Å; I1201-I1204 PolarHBondContact O-N 3.23Å; I1201-M1205 HydrophobicContact CG2-CG 4.31Å; I1201-M1205 HydrophobicContact CG2-SD 3.74Å; I1201-M1205 WeakPolarHBondContact O-CB 3.49Å; I1201-M1205 VanDerWaalsContact O-CG 3.31Å; I1201-M1205 WeakPolarHBondContact O-CG 3.26Å; I1201-M1205 PolarHBondContact O-N 3.49Å; I1201-V1347 HydrophobicContact CG2-CG1 4.5Å; I1201-L1350 HydrophobicContact CD1-CB 3.9Å; I1201-L1350 HydrophobicContact CG1-CB 3.69Å; I1201-L1350 HydrophobicContact CG1-CD1 4.21Å; I1201-L1351 HydrophobicContact CD1-CD2 4.41Å; I1201-L1351 HydrophobicContact CG2-CD2 4.08Å; I1201-L1351 HydrophobicContact CG2-CG 4.22Å; I1201-Y1354 HydrophobicContact CD1-CD1 4.38Å; I1201-Y1354 HydrophobicContact CD1-CG 4.12Å; I1201-I1364 HydrophobicContact CB-CD1 3.85Å; I1201-I1364 HydrophobicContact CD1-CD1 4.14Å; I1201-I1364 HydrophobicContact CG2-CD1 3.65Å
1202A94.3Very high92.1Very high29 Ų2937.2 Ų37.224%0.2419%0.191CC..Hα-helixtrans-60.7-40.5178.900000112.3R1198 E1199 D1200 M1205 K1206 I1364R1198-A1202 PolarHBondContact O-N 3.01Å; E1199-A1202 WeakPolarHBondContact O-CB 3.13Å; E1199-A1202 PolarHBondContact O-N 3.41Å; D1200-A1202 VanDerWaalsContact C-N 3.32Å; D1200-A1202 PolarHBondContact O-N 3.4Å; A1202-M1205 PolarHBondContact O-N 3.27Å; A1202-K1206 WeakPolarHBondContact O-CG 3.28Å; A1202-K1206 PolarHBondContact O-N 3.39Å; A1202-I1364 HydrophobicContact CB-CG2 4.46Å
1203W94Very high92.2Very high58 Ų5838.5 Ų38.522%0.2220%0.201CC..Hα-helixtrans-70.6-38.1176.1-77116.6000113.3H1148 E1199 D1200 I1201 M1205 K1206 F1207H1148-W1203 HydrophobicContact CB-CB 4.23Å; H1148-W1203 HydrophobicContact CB-CD2 3.62Å; H1148-W1203 HydrophobicContact CB-CE3 3.89Å; H1148-W1203 HydrophobicContact CB-CG 3.76Å; H1148-W1203 AromaticContact CD2-CD2 3.83Å; H1148-W1203 AromaticContact CD2-CE2 3.8Å; H1148-W1203 AromaticContact CD2-CE3 3.57Å; H1148-W1203 AromaticContact CD2-CH2 3.31Å; H1148-W1203 WeakPolarHBondContact CD2-CH2 3.2Å; H1148-W1203 AromaticContact CD2-CZ2 3.58Å; H1148-W1203 AromaticContact CD2-CZ3 3.31Å; H1148-W1203 WeakPolarHBondContact CD2-CZ3 3.46Å; H1148-W1203 AromaticContact CE1-CE2 3.72Å; H1148-W1203 AromaticContact CE1-CH2 3.7Å; H1148-W1203 AromaticContact CE1-CZ2 3.31Å; H1148-W1203 WeakPolarHBondContact CE1-CZ2 3.33Å; H1148-W1203 AromaticContact CG-CD2 3.52Å; H1148-W1203 AromaticContact CG-CE2 3.51Å; H1148-W1203 AromaticContact CG-CE3 3.72Å; H1148-W1203 AromaticContact CG-CH2 3.93Å; H1148-W1203 AromaticContact CG-CZ2 3.75Å; H1148-W1203 AromaticContact CG-CZ3 3.92Å; H1148-W1203 AromaticContact ND1-CD2 3.96Å; H1148-W1203 AromaticContact ND1-CE2 3.45Å; H1148-W1203 AromaticContact ND1-CZ2 3.57Å; H1148-W1203 AromaticContact ND1-NE1 3.7Å; H1148-W1203 AromaticContact NE2-CE2 3.95Å; H1148-W1203 AromaticContact NE2-CH2 3.18Å; H1148-W1203 WeakPolarHBondContact NE2-CH2 3.36Å; H1148-W1203 AromaticContact NE2-CZ2 3.33Å; H1148-W1203 VanDerWaalsContact NE2-CZ2 3.33Å; H1148-W1203 WeakPolarHBondContact NE2-CZ2 3.39Å; H1148-W1203 AromaticContact NE2-CZ3 3.72Å; E1199-W1203 VanDerWaalsContact O-CD1 3.26Å; E1199-W1203 PolarHBondContact O-N 3.3Å; D1200-W1203 PolarHBondContact O-N 3.45Å; I1201-W1203 VanDerWaalsContact C-N 3.33Å; I1201-W1203 PolarHBondContact O-N 2.87Å; W1203-M1205 VanDerWaalsContact C-N 3.31Å; W1203-M1205 PolarHBondContact O-N 3.06Å; W1203-K1206 HydrophobicContact CD2-CD 4.37Å; W1203-K1206 HydrophobicContact CE3-CB 4.33Å; W1203-K1206 HydrophobicContact CE3-CD 3.64Å; W1203-K1206 HydrophobicContact CH2-CD 4.29Å; W1203-K1206 HydrophobicContact CZ3-CD 3.6Å; W1203-K1206 PolarHBondContact O-N 3.31Å; W1203-F1207 PolarHBondContact O-N 2.88Å
1204I95.7Very high92.5Very high0 Ų034.3 Ų34.30%018%0.179CC..Hα-helixtrans-62.3-41.6173.8-64.5165.1000110.2A1143 F1147 D1200 I1201 F1207 W1208 V1343 V1347 L1350A1143-I1204 HydrophobicContact CB-CD1 4.15Å; F1147-I1204 HydrophobicContact CB-CG1 4.21Å; F1147-I1204 HydrophobicContact CD2-CD1 4.38Å; F1147-I1204 HydrophobicContact CD2-CG1 3.6Å; F1147-I1204 HydrophobicContact CE2-CG1 4.28Å; F1147-I1204 HydrophobicContact CG-CG1 4.1Å; D1200-I1204 WeakPolarHBondContact O-CD1 3.49Å; D1200-I1204 WeakPolarHBondContact O-CG1 3.47Å; D1200-I1204 PolarHBondContact O-N 3.08Å; I1201-I1204 PolarHBondContact O-N 3.23Å; I1204-F1207 PolarHBondContact O-N 2.61Å; I1204-W1208 PolarHBondContact O-N 3.01Å; I1204-V1343 HydrophobicContact CG2-CG1 3.59Å; I1204-V1347 HydrophobicContact CB-CG2 4.3Å; I1204-V1347 HydrophobicContact CG2-CG2 3.54Å; I1204-L1350 HydrophobicContact CD1-CD1 3.54Å
1205M94.7Very high92.7Very high3 Ų336.1 Ų36.12%0.01518%0.184CC..Hα-helixtrans-66-43.3175.8-74.4171.850.500112.9I1201 A1202 W1203 F1207 W1208 Q1209 V1347 I1364 P1365I1201-M1205 HydrophobicContact CG2-CG 4.31Å; I1201-M1205 HydrophobicContact CG2-SD 3.74Å; I1201-M1205 WeakPolarHBondContact O-CB 3.49Å; I1201-M1205 VanDerWaalsContact O-CG 3.31Å; I1201-M1205 WeakPolarHBondContact O-CG 3.26Å; I1201-M1205 PolarHBondContact O-N 3.49Å; A1202-M1205 PolarHBondContact O-N 3.27Å; W1203-M1205 VanDerWaalsContact C-N 3.31Å; W1203-M1205 PolarHBondContact O-N 3.06Å; M1205-F1207 VanDerWaalsContact C-N 3.3Å; M1205-F1207 PolarHBondContact O-N 2.93Å; M1205-W1208 WeakPolarHBondContact O-CB 3.17Å; M1205-W1208 PolarHBondContact O-N 3.44Å; M1205-Q1209 WeakPolarHBondContact O-CG 3.47Å; M1205-Q1209 PolarHBondContact O-N 3.35Å; M1205-V1347 HydrophobicContact CG-CB 4.35Å; M1205-V1347 HydrophobicContact CG-CG1 3.61Å; M1205-V1347 HydrophobicContact CG-CG2 3.71Å; M1205-V1347 HydrophobicContact SD-CG1 3.97Å; M1205-I1364 HydrophobicContact CE-CG2 4.21Å; M1205-I1364 HydrophobicContact SD-CG2 4.03Å; M1205-P1365 WeakPolarHBondContact CE-O 3.38Å
1206K94.2Very high92.7Very high100 Ų10042 Ų4244%0.43520%0.199SC..Hα-helixtrans-59.6-42.2174-76.9176.8-179.9-179.30111.4T1151 A1202 W1203 Q1209 A1210T1151-K1206 HydrophobicContact CG2-CB 4.44Å; A1202-K1206 WeakPolarHBondContact O-CG 3.28Å; A1202-K1206 PolarHBondContact O-N 3.39Å; W1203-K1206 HydrophobicContact CD2-CD 4.37Å; W1203-K1206 HydrophobicContact CE3-CB 4.33Å; W1203-K1206 HydrophobicContact CE3-CD 3.64Å; W1203-K1206 HydrophobicContact CH2-CD 4.29Å; W1203-K1206 HydrophobicContact CZ3-CD 3.6Å; W1203-K1206 PolarHBondContact O-N 3.31Å; K1206-Q1209 PolarHBondContact O-N 2.91Å; K1206-A1210 WeakPolarHBondContact O-CB 3.41Å; K1206-A1210 PolarHBondContact O-N 3.03Å
1207F96.4Very high92.6Very high0 Ų044 Ų440%020%0.203CC..Hα-helixtrans-61.5-44.5174.4-177.1-107.4000111.7F1147 L1150 T1151 L1154 I1175 A1179 W1203 I1204 M1205 Q1209 A1210 I1211 V1343F1147-F1207 HydrophobicContact CB-CB 4.2Å; F1147-F1207 HydrophobicContact CD1-CB 4.11Å; F1147-F1207 AromaticContact CD1-CD1 3.38Å; F1147-F1207 HydrophobicContact CD1-CD1 3.38Å; F1147-F1207 HydrophobicContact CD1-CD2 4.38Å; F1147-F1207 AromaticContact CD1-CE1 3.82Å; F1147-F1207 HydrophobicContact CD1-CE1 3.82Å; F1147-F1207 AromaticContact CD1-CG 3.69Å; F1147-F1207 HydrophobicContact CD1-CG 3.69Å; F1147-F1207 HydrophobicContact CD1-CZ 4.49Å; F1147-F1207 AromaticContact CE1-CD1 3.7Å; F1147-F1207 HydrophobicContact CE1-CD1 3.7Å; F1147-F1207 AromaticContact CE1-CE1 3.79Å; F1147-F1207 HydrophobicContact CE1-CE1 3.79Å; F1147-F1207 HydrophobicContact CE1-CG 4.45Å; L1150-F1207 HydrophobicContact CB-CD2 3.9Å; L1150-F1207 HydrophobicContact CB-CE2 3.59Å; L1150-F1207 HydrophobicContact CB-CZ 4.33Å; L1150-F1207 HydrophobicContact CD1-CE2 4.48Å; L1150-F1207 HydrophobicContact CD1-CZ 4.44Å; T1151-F1207 VanDerWaalsContact OG1-CA 3.31Å; T1151-F1207 WeakPolarHBondContact OG1-CA 3.46Å; T1151-F1207 VanDerWaalsContact OG1-CB 3.3Å; T1151-F1207 WeakPolarHBondContact OG1-CB 3.19Å; T1151-F1207 PolarHBondContact OG1-N 2.63Å; L1154-F1207 HydrophobicContact CD2-CE2 4.26Å; I1175-F1207 HydrophobicContact CG2-CE2 4.15Å; I1175-F1207 HydrophobicContact CG2-CZ 4.32Å; A1179-F1207 HydrophobicContact CB-CE1 3.89Å; A1179-F1207 HydrophobicContact CB-CZ 3.81Å; W1203-F1207 PolarHBondContact O-N 2.88Å; I1204-F1207 PolarHBondContact O-N 2.61Å; M1205-F1207 VanDerWaalsContact C-N 3.3Å; M1205-F1207 PolarHBondContact O-N 2.93Å; F1207-Q1209 VanDerWaalsContact C-N 3.34Å; F1207-Q1209 PolarHBondContact O-N 3.44Å; F1207-A1210 PolarHBondContact O-N 2.96Å; F1207-I1211 HydrophobicContact CD1-CG1 4.09Å; F1207-I1211 HydrophobicContact CD2-CG1 4.46Å; F1207-I1211 HydrophobicContact CE1-CD1 4.13Å; F1207-I1211 HydrophobicContact CE1-CG1 3.66Å; F1207-I1211 HydrophobicContact CE2-CD1 4.08Å; F1207-I1211 HydrophobicContact CE2-CG1 4.05Å; F1207-I1211 HydrophobicContact CG-CG1 4.48Å; F1207-I1211 HydrophobicContact CZ-CD1 3.65Å; F1207-I1211 HydrophobicContact CZ-CG1 3.64Å; F1207-I1211 WeakPolarHBondContact O-CG1 3.09Å; F1207-I1211 PolarHBondContact O-N 2.92Å; F1207-V1343 HydrophobicContact CD1-CG2 4.34Å; F1207-V1343 HydrophobicContact CE1-CG2 4.37Å
1208W96.5Very high92.1Very high1 Ų143.8 Ų43.80%0.00420%0.202CC..Hα-helixtrans-57.7-44.9176.3-176.194.2000112.1I1204 M1205 I1211 Q1212 L1340 V1343 V1370 W1373I1204-W1208 PolarHBondContact O-N 3.01Å; M1205-W1208 WeakPolarHBondContact O-CB 3.17Å; M1205-W1208 PolarHBondContact O-N 3.44Å; W1208-I1211 PolarHBondContact O-N 2.76Å; W1208-Q1212 WeakPolarHBondContact O-CB 3.46Å; W1208-Q1212 PolarHBondContact O-N 3.29Å; W1208-L1340 HydrophobicContact CD2-CD2 4.16Å; W1208-L1340 HydrophobicContact CG-CD2 4.19Å; W1208-L1340 HydrophobicContact CZ2-CD2 4.38Å; W1208-L1340 PolarHBondContact NE1-O 2.97Å; W1208-V1343 HydrophobicContact CB-CG1 3.8Å; W1208-V1343 HydrophobicContact CG-CG1 4.3Å; W1208-V1370 HydrophobicContact CD2-CG2 4.03Å; W1208-V1370 HydrophobicContact CE3-CG2 3.9Å; W1208-V1370 HydrophobicContact CH2-CG2 4.43Å; W1208-V1370 HydrophobicContact CZ2-CG1 4.49Å; W1208-V1370 HydrophobicContact CZ3-CG2 4.12Å; W1208-W1373 HydrophobicContact CH2-CB 3.55Å; W1208-W1373 HydrophobicContact CH2-CD2 4.3Å; W1208-W1373 AromaticContact CH2-CG 3.76Å; W1208-W1373 HydrophobicContact CH2-CG 3.76Å; W1208-W1373 HydrophobicContact CZ2-CB 3.67Å; W1208-W1373 AromaticContact CZ2-CD2 3.53Å; W1208-W1373 HydrophobicContact CZ2-CD2 3.53Å; W1208-W1373 AromaticContact CZ2-CE3 3.74Å; W1208-W1373 HydrophobicContact CZ2-CE3 3.74Å; W1208-W1373 AromaticContact CZ2-CG 3.49Å; W1208-W1373 HydrophobicContact CZ2-CG 3.49Å; W1208-W1373 VanDerWaalsContact CZ2-CG 3.49Å
1209Q94.2Very high91.2Very high73 Ų7343.2 Ų43.234%0.34121%0.205SC..Hα-helixtrans-64.1-40.3176.4-68.7173.1-1.600111.9M1205 K1206 F1207 Q1212 T1213M1205-Q1209 WeakPolarHBondContact O-CG 3.47Å; M1205-Q1209 PolarHBondContact O-N 3.35Å; K1206-Q1209 PolarHBondContact O-N 2.91Å; F1207-Q1209 VanDerWaalsContact C-N 3.34Å; F1207-Q1209 PolarHBondContact O-N 3.44Å; Q1209-Q1212 WeakPolarHBondContact O-CB 3.4Å; Q1209-Q1212 PolarHBondContact O-N 2.79Å; Q1209-T1213 PolarHBondContact O-N 2.65Å; Q1209-T1213 PolarHBondContact O-OG1 2.9Å
1210A93.4Very high90.4Very high13 Ų1342.4 Ų42.411%0.10720%0.198CC..Hα-helixtrans-63.8-39.8175.800000112L1154 Q1158 K1206 F1207 T1213 D1214L1154-A1210 HydrophobicContact CD2-CB 3.68Å; L1154-A1210 HydrophobicContact CG-CB 4.41Å; Q1158-A1210 PolarHBondContact NE2-O 3.15Å; K1206-A1210 WeakPolarHBondContact O-CB 3.41Å; K1206-A1210 PolarHBondContact O-N 3.03Å; F1207-A1210 PolarHBondContact O-N 2.96Å; A1210-T1213 PolarHBondContact O-N 3Å; A1210-T1213 PolarHBondContact O-OG1 3.37Å; A1210-D1214 PolarHBondContact O-N 3.14Å
1211I94.8Very high89.2Confident2 Ų242.3 Ų42.31%0.0120%0.197CC..Hα-helixtrans-68.1-36.2173.4-66.6-70.4000111.4L1154 Y1176 F1207 W1208 T1213 D1214 R1336 L1339 L1340L1154-I1211 HydrophobicContact CD2-CD1 3.59Å; L1154-I1211 HydrophobicContact CD2-CG1 4Å; Y1176-I1211 HydrophobicContact CD1-CD1 4.14Å; Y1176-I1211 HydrophobicContact CE1-CD1 3.56Å; F1207-I1211 HydrophobicContact CD1-CG1 4.09Å; F1207-I1211 HydrophobicContact CD2-CG1 4.46Å; F1207-I1211 HydrophobicContact CE1-CD1 4.13Å; F1207-I1211 HydrophobicContact CE1-CG1 3.66Å; F1207-I1211 HydrophobicContact CE2-CD1 4.08Å; F1207-I1211 HydrophobicContact CE2-CG1 4.05Å; F1207-I1211 HydrophobicContact CG-CG1 4.48Å; F1207-I1211 HydrophobicContact CZ-CD1 3.65Å; F1207-I1211 HydrophobicContact CZ-CG1 3.64Å; F1207-I1211 WeakPolarHBondContact O-CG1 3.09Å; F1207-I1211 PolarHBondContact O-N 2.92Å; W1208-I1211 PolarHBondContact O-N 2.76Å; I1211-T1213 PolarHBondContact O-N 3.16Å; I1211-D1214 WeakPolarHBondContact O-CB 3.49Å; I1211-D1214 PolarHBondContact O-N 3.46Å; I1211-R1336 HydrophobicContact CG2-CG 3.78Å; I1211-R1336 PolarHBondContact O-NE 2.97Å; I1211-L1339 HydrophobicContact CG2-CB 4.49Å; I1211-L1340 HydrophobicContact CB-CD2 4.13Å; I1211-L1340 HydrophobicContact CG2-CD2 3.73Å; I1211-L1340 HydrophobicContact CG2-CG 3.77Å
1212Q91.8Very high87.8Confident71 Ų7142.9 Ų42.933%0.33220%0.2SC..Hα-helixtrans-62.7-44.7177.5-164.2-171.532.900110.8W1208 Q1209 D1214 R1336 L1340W1208-Q1212 WeakPolarHBondContact O-CB 3.46Å; W1208-Q1212 PolarHBondContact O-N 3.29Å; Q1209-Q1212 WeakPolarHBondContact O-CB 3.4Å; Q1209-Q1212 PolarHBondContact O-N 2.79Å; Q1212-D1214 VanDerWaalsContact C-N 3.32Å; Q1212-D1214 PolarHBondContact O-N 2.67Å; Q1212-R1336 PolarHBondContact O-NH2 2.81Å; Q1212-L1340 HydrophobicContact CB-CD2 4.08Å
1213T90.1Very high86.3Confident59 Ų5947.1 Ų47.136%0.36221%0.214SC..Hα-helixtrans-72.7-21.8177.354.70000113.5Q1209 A1210 I1211 K1215 K1216Q1209-T1213 PolarHBondContact O-N 2.65Å; Q1209-T1213 PolarHBondContact O-OG1 2.9Å; A1210-T1213 PolarHBondContact O-N 3Å; A1210-T1213 PolarHBondContact O-OG1 3.37Å; I1211-T1213 PolarHBondContact O-N 3.16Å; T1213-K1215 PolarHBondContact O-N 2.98Å; T1213-K1216 PolarHBondContact O-N 2.96Å; T1213-K1216 VanDerWaalsContact O-N 3.08Å
1214D90.3Very high84.8Confident0 Ų047.5 Ų47.50%022%0.22CC..Hα-helixtrans-56.9-23.1-177.8-157.842.8000114.6Q1158 R1172 Y1176 A1210 I1211 Q1212 K1216 Y1217 L1218Q1158-D1214 PolarHBondContact NE2-OD1 2.91Å; R1172-D1214 IonicContact CZ-OD1 3.51Å; R1172-D1214 IonicContact CZ-OD2 3.84Å; R1172-D1214 IonicContact NE-OD1 3.97Å; R1172-D1214 IonicContact NE-OD2 3.35Å; R1172-D1214 PolarHBondContact NE-OD2 3.41Å; R1172-D1214 IonicContact NH2-OD1 3.35Å; R1172-D1214 PolarHBondContact NH2-OD1 3.24Å; R1172-D1214 VanDerWaalsContact NH2-OD1 3.14Å; R1172-D1214 IonicContact NH2-OD2 3.17Å; Y1176-D1214 PolarHBondContact OH-OD2 2.95Å; A1210-D1214 PolarHBondContact O-N 3.14Å; I1211-D1214 WeakPolarHBondContact O-CB 3.49Å; I1211-D1214 PolarHBondContact O-N 3.46Å; Q1212-D1214 VanDerWaalsContact C-N 3.32Å; Q1212-D1214 PolarHBondContact O-N 2.67Å; D1214-K1216 PolarHBondContact O-N 3.37Å; D1214-Y1217 PolarHBondContact O-N 3.3Å; D1214-Y1217 VanDerWaalsContact O-N 3.1Å; D1214-L1218 PolarHBondContact O-N 2.88Å
1215K87.8Confident82.9Confident111 Ų11148.8 Ų48.848%0.48323%0.227SC..Hα-helixtrans-55.7-37.2175.5-174.4177.3179.3-176.90112.5T1213 Y1217 L1333T1213-K1215 PolarHBondContact O-N 2.98Å; K1215-Y1217 VanDerWaalsContact C-N 3.33Å; K1215-L1333 HydrophobicContact CG-CD2 4.25Å
1216K86Confident80.5Confident164 Ų16452.9 Ų52.971%0.71324%0.244SC*.Hα-helixtrans-66.4-38.6179.9-64.3-179.4179.8-179.60111.2T1213 D1214T1213-K1216 PolarHBondContact O-N 2.96Å; T1213-K1216 VanDerWaalsContact O-N 3.08Å; D1214-K1216 PolarHBondContact O-N 3.37Å
1217Y84.9Confident78Confident64 Ų6454.4 Ų54.425%0.25125%0.253SS..Hα-helixtrans-81-34.5-176.8-58.3-76.6000112.6Q1158 D1214 K1215 N1219 R1220 D1221Q1158-Y1217 HydrophobicContact CB-CD1 4.15Å; Q1158-Y1217 HydrophobicContact CB-CD2 3.98Å; Q1158-Y1217 HydrophobicContact CB-CE1 4.05Å; Q1158-Y1217 HydrophobicContact CB-CE2 3.85Å; Q1158-Y1217 HydrophobicContact CB-CG 4.1Å; Q1158-Y1217 HydrophobicContact CG-CD1 4.4Å; Q1158-Y1217 HydrophobicContact CG-CD2 3.53Å; Q1158-Y1217 HydrophobicContact CG-CE2 3.77Å; Q1158-Y1217 HydrophobicContact CG-CG 3.84Å; Q1158-Y1217 WeakPolarHBondContact O-CD1 3.43Å; Q1158-Y1217 WeakPolarHBondContact O-CE1 3.39Å; D1214-Y1217 PolarHBondContact O-N 3.3Å; D1214-Y1217 VanDerWaalsContact O-N 3.1Å; K1215-Y1217 VanDerWaalsContact C-N 3.33Å; Y1217-N1219 VanDerWaalsContact C-N 3.34Å; Y1217-N1219 PolarHBondContact O-N 3.5Å; Y1217-R1220 PolarHBondContact O-N 3.04Å; Y1217-D1221 VanDerWaalsContact O-CG 3.29Å; Y1217-D1221 PolarHBondContact O-N 3.33Å
1218L81.9Confident75.4Confident0 Ų058.1 Ų58.10%028%0.284CS..Hα-helixtrans-55.5-46.3174.9-90.9164.4000112.6R1172 D1214 L1222 L1329 F1332 L1333R1172-L1218 VanDerWaalsContact CD-CD2 3.46Å; D1214-L1218 PolarHBondContact O-N 2.88Å; L1218-L1222 WeakPolarHBondContact O-CB 3.24Å; L1218-L1222 WeakPolarHBondContact O-CD1 3.48Å; L1218-L1222 PolarHBondContact O-N 2.94Å; L1218-L1329 HydrophobicContact CB-CD1 4.47Å; L1218-F1332 HydrophobicContact CD1-CB 4.35Å; L1218-F1332 HydrophobicContact CD2-CB 3.63Å; L1218-F1332 HydrophobicContact CD2-CD1 4.23Å; L1218-F1332 HydrophobicContact CD2-CD2 4.27Å; L1218-F1332 HydrophobicContact CD2-CG 3.81Å; L1218-L1333 HydrophobicContact CD1-CD2 4.33Å
1219N75.6Confident72.5Confident65 Ų6561 Ų6135%0.34830%0.303SS..Hα-helixtrans-59-51.6176.6-72.1-12.9000109.9Y1217 F1223Y1217-N1219 VanDerWaalsContact C-N 3.34Å; Y1217-N1219 PolarHBondContact O-N 3.5Å; N1219-F1223 WeakPolarHBondContact O-CD2 3.44Å; N1219-F1223 PolarHBondContact O-N 2.98Å; N1219-F1223 VanDerWaalsContact O-N 3.08Å
1220R72.3Confident69.6Low76 Ų7659.2 Ų59.229%0.28730%0.302SS..Hα-helixtrans-60.5-54.2-178.3-173.6-176.367.9-168.67.3113.2N1160 Y1217 L1222 F1223 D1224N1160-R1220 PolarHBondContact OD1-NH1 2.86Å; N1160-R1220 PolarHBondContact OD1-NH2 3.39Å; Y1217-R1220 PolarHBondContact O-N 3.04Å; R1220-L1222 PolarHBondContact O-N 3.02Å; R1220-F1223 PolarHBondContact O-N 3.37Å; R1220-F1223 VanDerWaalsContact O-N 3.08Å; R1220-D1224 VanDerWaalsContact O-CG 3.3Å; R1220-D1224 PolarHBondContact O-N 3.14Å
1221D68.9Low66.8Low0 Ų064.3 Ų64.30%033%0.331CS..Hα-helixtrans-61.7-30.5-174.2-66.1-25.5000112.5K1168 R1172 Y1217 N1225K1168-D1221 HydrophobicContact CD-CB 4.23Å; K1168-D1221 VanDerWaalsContact CD-CG 3.49Å; K1168-D1221 WeakPolarHBondContact CD-OD1 3.42Å; K1168-D1221 IonicContact NZ-OD1 3.21Å; K1168-D1221 PolarHBondContact NZ-OD1 3.17Å; R1172-D1221 IonicContact CZ-OD2 3.75Å; R1172-D1221 VanDerWaalsContact CZ-OD2 3.28Å; R1172-D1221 IonicContact NH1-OD2 3.26Å; R1172-D1221 PolarHBondContact NH1-OD2 2.78Å; R1172-D1221 IonicContact NH2-OD2 3Å; R1172-D1221 PolarHBondContact NH2-OD2 3.26Å; Y1217-D1221 VanDerWaalsContact O-CG 3.29Å; Y1217-D1221 PolarHBondContact O-N 3.33Å; D1221-N1225 PolarHBondContact O-ND2 3.02Å
1222L67.1Low63.9Low11 Ų1167.3 Ų67.36%0.05836%0.362CS..Hα-helixtrans-76.6-43.1175.4-79.4164.7000111L1218 R1220 D1224 N1225 F1226 F1325 L1329L1218-L1222 WeakPolarHBondContact O-CB 3.24Å; L1218-L1222 WeakPolarHBondContact O-CD1 3.48Å; L1218-L1222 PolarHBondContact O-N 2.94Å; R1220-L1222 PolarHBondContact O-N 3.02Å; L1222-D1224 VanDerWaalsContact C-N 3.31Å; L1222-D1224 PolarHBondContact O-N 3.36Å; L1222-N1225 WeakPolarHBondContact O-CB 3.42Å; L1222-N1225 PolarHBondContact O-N 2.94Å; L1222-N1225 VanDerWaalsContact O-N 3.13Å; L1222-F1226 PolarHBondContact O-N 3.15Å; L1222-F1325 VanDerWaalsContact C-CE2 3.49Å; L1222-F1325 HydrophobicContact CB-CD2 4.34Å; L1222-F1325 HydrophobicContact CB-CE2 3.47Å; L1222-F1325 VanDerWaalsContact CB-CE2 3.47Å; L1222-F1325 HydrophobicContact CB-CZ 3.81Å; L1222-F1325 HydrophobicContact CD2-CE2 4.48Å; L1222-F1325 HydrophobicContact CG-CE2 4.49Å; L1222-F1325 WeakPolarHBondContact O-CE2 3.49Å; L1222-L1329 HydrophobicContact CD1-CB 3.91Å; L1222-L1329 HydrophobicContact CD1-CD1 3.48Å; L1222-L1329 VanDerWaalsContact CD1-CD1 3.48Å; L1222-L1329 HydrophobicContact CD1-CG 4.27Å
1223F62.9Low60.9Low119 Ų11972.4 Ų72.452%0.52238%0.384SS..Hα-helixtrans-60.9-38.2174.4-85.1-69.9000112.4N1219 R1220 N1225 F1226 E1227N1219-F1223 WeakPolarHBondContact O-CD2 3.44Å; N1219-F1223 PolarHBondContact O-N 2.98Å; N1219-F1223 VanDerWaalsContact O-N 3.08Å; R1220-F1223 PolarHBondContact O-N 3.37Å; R1220-F1223 VanDerWaalsContact O-N 3.08Å; F1223-N1225 PolarHBondContact O-N 3.09Å; F1223-F1226 WeakPolarHBondContact O-CA 3.45Å; F1223-F1226 WeakPolarHBondContact O-CB 3.35Å; F1223-F1226 PolarHBondContact O-N 2.86Å; F1223-E1227 PolarHBondContact O-N 2.64Å; F1223-E1227 VanDerWaalsContact O-N 3.08Å
1224D60.4Low58Low65 Ų6574.3 Ų74.335%0.34840%0.4SS..Hα-helixtrans-58.6-34.1175.1-66.5-14.7000111.7R1220 L1222 A1228R1220-D1224 VanDerWaalsContact O-CG 3.3Å; R1220-D1224 PolarHBondContact O-N 3.14Å; L1222-D1224 VanDerWaalsContact C-N 3.31Å; L1222-D1224 PolarHBondContact O-N 3.36Å; D1224-A1228 WeakPolarHBondContact O-CB 3.48Å; D1224-A1228 PolarHBondContact O-N 3.5Å; D1224-A1228 VanDerWaalsContact O-N 3.13Å
1225N57Low55Low27 Ų2782 Ų8214%0.14444%0.44CS..Hα-helixtrans-69.5-32.9173.7-70.7-39.4000112.5G1165 T1166 D1221 L1222 F1223 C1229G1165-N1225 VanDerWaalsContact C-ND2 3.27Å; G1165-N1225 WeakPolarHBondContact CA-OD1 3.49Å; G1165-N1225 PolarHBondContact N-OD1 3.1Å; G1165-N1225 PolarHBondContact O-ND2 2.98Å; T1166-N1225 PolarHBondContact N-ND2 3.28Å; T1166-N1225 PolarHBondContact N-OD1 3.24Å; T1166-N1225 PolarHBondContact OG1-OD1 3.39Å; D1221-N1225 PolarHBondContact O-ND2 3.02Å; L1222-N1225 WeakPolarHBondContact O-CB 3.42Å; L1222-N1225 PolarHBondContact O-N 2.94Å; L1222-N1225 VanDerWaalsContact O-N 3.13Å; F1223-N1225 PolarHBondContact O-N 3.09Å; N1225-C1229 PolarHBondContact O-N 3.39Å; N1225-C1229 VanDerWaalsContact O-N 3.12Å; N1225-C1229 PolarHBondContact O-SG 2.81Å
1226F44.9Very low52.2Low89 Ų8984.2 Ų84.239%0.3946%0.457SS..Hα-helixtrans-68.5-46.3178-176.3-94.2000110.8L1222 F1223 A1228 C1229 A1230L1222-F1226 PolarHBondContact O-N 3.15Å; F1223-F1226 WeakPolarHBondContact O-CA 3.45Å; F1223-F1226 WeakPolarHBondContact O-CB 3.35Å; F1223-F1226 PolarHBondContact O-N 2.86Å; F1226-A1228 PolarHBondContact O-N 3.47Å; F1226-C1229 PolarHBondContact O-N 3.39Å; F1226-A1230 HydrophobicContact CD1-CB 4.25Å; F1226-A1230 HydrophobicContact CE1-CB 4.02Å; F1226-A1230 HydrophobicContact CZ-CB 4.41Å; F1226-A1230 WeakPolarHBondContact O-CB 3.43Å; F1226-A1230 PolarHBondContact O-N 3.45Å
1227E41.3Very low49.5Very low132 Ų13281.6 Ų81.662%0.61746%0.459SS*.Hα-helixtrans-61.9-43.4174.9-76.5-173.2169.200111.7F1223 C1229 A1230 V1231F1223-E1227 PolarHBondContact O-N 2.64Å; F1223-E1227 VanDerWaalsContact O-N 3.08Å; E1227-C1229 PolarHBondContact O-N 2.75Å; E1227-A1230 PolarHBondContact O-N 2.84Å; E1227-V1231 WeakPolarHBondContact O-CB 3.49Å; E1227-V1231 WeakPolarHBondContact O-CG2 3.21Å; E1227-V1231 PolarHBondContact O-N 3.23Å
1228A42.3Very low46.8Very low78 Ų7886.1 Ų86.165%0.64549%0.488SS*.Hα-helixtrans-59.7-31.9177.100000113D1224 F1226D1224-A1228 WeakPolarHBondContact O-CB 3.48Å; D1224-A1228 PolarHBondContact O-N 3.5Å; D1224-A1228 VanDerWaalsContact O-N 3.13Å; F1226-A1228 PolarHBondContact O-N 3.47Å
1229C35.6Very low44.2Very low61 Ų6191.2 Ų91.241%0.41252%0.523SS..Hα-helixtrans-85.9-38.9175.8-640000113N1225 F1226 E1227 G1232N1225-C1229 PolarHBondContact O-N 3.39Å; N1225-C1229 VanDerWaalsContact O-N 3.12Å; N1225-C1229 PolarHBondContact O-SG 2.81Å; F1226-C1229 PolarHBondContact O-N 3.39Å; E1227-C1229 PolarHBondContact O-N 2.75Å; C1229-G1232 PolarHBondContact O-N 3.21Å
1230A33.2Very low41.8Very low37 Ų3797.8 Ų97.831%0.30655%0.549SS..Hα-helixtrans-75-30.9-173.700000113F1226 E1227 G1232 F1233F1226-A1230 HydrophobicContact CD1-CB 4.25Å; F1226-A1230 HydrophobicContact CE1-CB 4.02Å; F1226-A1230 HydrophobicContact CZ-CB 4.41Å; F1226-A1230 WeakPolarHBondContact O-CB 3.43Å; F1226-A1230 PolarHBondContact O-N 3.45Å; E1227-A1230 PolarHBondContact O-N 2.84Å; A1230-G1232 PolarHBondContact O-N 2.9Å; A1230-G1232 VanDerWaalsContact O-N 3.08Å; A1230-F1233 PolarHBondContact O-N 2.92Å
1231V34.3Very low39.5Very low119 Ų119101 Ų10172%0.72157%0.569SS**THydrogen-bonded Turntrans-64.8-11.8174.9178.40000111.6E1227E1227-V1231 WeakPolarHBondContact O-CB 3.49Å; E1227-V1231 WeakPolarHBondContact O-CG2 3.21Å; E1227-V1231 PolarHBondContact O-N 3.23Å
1232G32.6Very low37.4Very low65 Ų65109.8 Ų109.867%0.6761%0.607SS**THydrogen-bonded Turntrans-81.6-12.1169.900000116C1229 A1230C1229-G1232 PolarHBondContact O-N 3.21Å; A1230-G1232 PolarHBondContact O-N 2.9Å; A1230-G1232 VanDerWaalsContact O-N 3.08Å
1233F29.7Very low35.4Very low179 Ų179117.8 Ų117.879%0.78564%0.644SS**SBendtrans-109.1-1.3-170.3-81.8-77.6000115.8A1230A1230-F1233 PolarHBondContact O-N 2.92Å
1234S29Very low33.7Very low99 Ų99115.8 Ų115.869%0.69266%0.657SS**SBendtrans-125.989.3174.7-175.20000109.1
1235L27.5Very low31.9Very low161 Ų161116.7 Ų116.784%0.84368%0.682SS**SBendtrans172.183.4156.1-91.4156.4000107.5
1236D29.1Very low30.4Very low158 Ų158120 Ų12085%0.84571%0.707SS**  trans174.866.8141.6-91.7-12.3000110.1
1237S29.6Very low29.3Very low108 Ų108124.7 Ų124.776%0.75573%0.73SS**SBendtrans-121.6113.614460.60000106
1238D28.3Very low28.6Very low160 Ų160129.3 Ų129.386%0.85674%0.743SS**SBendtrans74.587.7173.4-59.2-29.8000118
1239S27.6Very low27.8Very low107 Ų107130.1 Ų130.175%0.74875%0.75SS**  -166.2105123.142.40000111.9
1240K25.2Very low27.4Very low202 Ų202133.7 Ų133.788%0.87877%0.77SS**  trans-65.5149.7158.9-74.1176.3175173.30109.3
1241M23.3Very low27Very low144 Ų144139.8 Ų139.871%0.70980%0.796SS**  trans91.8135.7169-56.8-149.3168.200114.5
1242K25.4Very low26.5Very low185 Ų185139.2 Ų139.280%0.80480%0.797SS**  cis-162.4148.815-123.8163.1-176.3174.20108.2G1244K1242-G1244 PolarHBondContact O-N 3.42Å
1243E24.9Very low26.1Very low179 Ų179143.7 Ų143.784%0.83681%0.805SS**  trans-48.7128.4173.9-63.5167.6146.900112.7
1244G25.7Very low26Very low77 Ų77140.7 Ų140.779%0.79480%0.803SS**  trans-150.276.9172.100000109.2K1242K1242-G1244 PolarHBondContact O-N 3.42Å
1245G23.7Very low25.7Very low84 Ų84147.9 Ų147.987%0.86682%0.816SS**  trans-74129.5170.800000110.8
1246S24.4Very low25.7Very low96 Ų96146.7 Ų146.767%0.67182%0.815SS**  trans-157.4101.1155.6-171.50000109.6
1247E23.6Very low25.5Very low188 Ų188150.9 Ų150.988%0.87982%0.819SS**  trans33.692.6140.3-60.7-178165.500118.4
1248Y26.3Very low25.2Very low228 Ų228153.9 Ų153.989%0.89483%0.827SS**  trans-104.8105152.7-79-82000109.2T1250Y1248-T1250 PolarHBondContact O-N 3.2Å
1249A25.8Very low25Very low96 Ų96149.5 Ų149.579%0.79382%0.819SS**  trans-64.7109.5173.800000110.4I1251A1249-I1251 PolarHBondContact O-N 3.07Å
1250T25.7Very low24.8Very low135 Ų135149.6 Ų149.683%0.82882%0.82SS**  trans-58.1111.2167.117.60000110.9Y1248 S1252Y1248-T1250 PolarHBondContact O-N 3.2Å; T1250-S1252 PolarHBondContact O-N 3.43Å; T1250-S1252 VanDerWaalsContact O-N 3.13Å
1251I25.1Very low24.8Very low165 Ų165146.6 Ų146.685%0.84682%0.818SS**  trans-73.596.7165.5-62.5172.1000107.2A1249 L1253A1249-I1251 PolarHBondContact O-N 3.07Å; I1251-L1253 PolarHBondContact O-N 3.46Å
1252S24.3Very low24.9Very low107 Ų107147 Ų14775%0.74882%0.824SS**  trans-75111.9174.2470000110.7T1250T1250-S1252 PolarHBondContact O-N 3.43Å; T1250-S1252 VanDerWaalsContact O-N 3.13Å
1253L24.4Very low24.8Very low159 Ų159141.2 Ų141.283%0.83282%0.816SS**  trans-60.2140.2165.1-81.3147.9000110.3I1251 R1255I1251-L1253 PolarHBondContact O-N 3.46Å; L1253-R1255 PolarHBondContact O-N 3.04Å
1254P26.4Very low24.7Very low116 Ų116143.6 Ų143.675%0.75382%0.819SS**  trans-72.3123.3-165.727.6-32.6000112T1256P1254-T1256 PolarHBondContact O-N 3.48Å; P1254-T1256 VanDerWaalsContact O-N 3.1Å
1255R22.6Very low25.4Very low251 Ų251145 Ų14595%0.94781%0.814SS**  trans-60.2105.8168.5-78.1176.8168173.2-4.2109.8L1253 R1257L1253-R1255 PolarHBondContact O-N 3.04Å; R1255-R1257 PolarHBondContact O-N 3.01Å
1256T27.6Very low25.5Very low136 Ų136149.4 Ų149.483%0.83481%0.812SS**PPolyproline II helixtrans-66.1128.3164.533.10000109.5P1254P1254-T1256 PolarHBondContact O-N 3.48Å; P1254-T1256 VanDerWaalsContact O-N 3.1Å
1257R24.9Very low25.5Very low245 Ų245150.5 Ų150.593%0.92581%0.814SS**PPolyproline II helixtrans-70.2132.7-170.3-133173.6-179.3174.8-1.5110.5R1255 G1259R1255-R1257 PolarHBondContact O-N 3.01Å; R1257-G1259 PolarHBondContact O-N 3.29Å
1258N23.8Very low25.5Very low171 Ų171149.9 Ų149.991%0.91482%0.816SS**PPolyproline II helixtrans-47118.6168.3-71.8-18.6000111.8
1259G24.4Very low25.6Very low68 Ų68145.8 Ų145.870%0.70182%0.815SS**  trans-131.7100.8166.100000108.4R1257 V1261R1257-G1259 PolarHBondContact O-N 3.29Å; G1259-V1261 PolarHBondContact O-N 3.33Å
1260S22.5Very low25.7Very low109 Ų109146.7 Ų146.776%0.76282%0.816SS**  trans-62.6119.7172.7177.20000109.6
1261V26.9Very low25.8Very low139 Ų139147.6 Ų147.684%0.84282%0.816SS**  trans-131.2103.8162.6-178.90000107.7G1259G1259-V1261 PolarHBondContact O-N 3.33Å
1262N23.9Very low26.1Very low154 Ų154144.6 Ų144.682%0.82481%0.809SS**  trans-63.2136.9168-74.7-34.9000110.6
1263G23.2Very low26.4Very low62 Ų62143.9 Ų143.964%0.63980%0.804SS**  trans170.890.8165.700000116.2
1264Y24.5Very low26.7Very low229 Ų229140.9 Ų140.990%0.89879%0.793SS**  trans86.5113.8151.5-64.5-77.7000121.3
1265P39.1Very low26.9Very low106 Ų106142.7 Ų142.769%0.68879%0.79SS**  trans-96.8138173.936.3-27.7000111.8
1266H27Very low27.3Very low178 Ų178137.8 Ų137.882%0.82478%0.778SS**  trans-145.498.7151.1-85.7-64.3000110.1
1267T23.4Very low27.6Very low119 Ų119137.4 Ų137.473%0.7376%0.762SS**  trans30.5113.3135.152.10000118.5
1268L24.7Very low27.9Very low174 Ų174129.5 Ų129.591%0.91174%0.738SS**  -159.1105.9122.4-97.6165.3000108.2S1270L1268-S1270 PolarHBondContact O-N 2.96Å
1269T27Very low28.4Very low143 Ų143125 Ų12588%0.87772%0.72SS**  trans-72.2113.7170.245.70000109.4
1270S27.8Very low28.8Very low115 Ų115124.6 Ų124.680%0.80471%0.707SS**  trans-145.6142.3156.873.60000110L1268L1268-S1270 PolarHBondContact O-N 2.96Å
1271N27.8Very low29.4Very low154 Ų154121.7 Ų121.782%0.82468%0.682SS**  trans-58.6143-155.7-69.5-31.1000116S1273N1271-S1273 PolarHBondContact O-N 3.34Å; N1271-S1273 VanDerWaalsContact O-N 3.12Å
1272S31.3Very low29.9Very low102 Ų102119 Ų11971%0.71367%0.666SS**THydrogen-bonded Turntrans-8235.5-165.161.10000116.8
1273S31Very low30.5Very low91 Ų91114.1 Ų114.164%0.63664%0.644SS**Hα-helixtrans-81.3-17.5175.753.20000113.8N1271N1271-S1273 PolarHBondContact O-N 3.34Å; N1271-S1273 VanDerWaalsContact O-N 3.12Å
1274T31.1Very low31Very low97 Ų97115.2 Ų115.260%0.59564%0.635SS**Hα-helixtrans-83.2-30-174.6-27.40000113.5Y1277 L1278T1274-Y1277 PolarHBondContact O-N 3.32Å; T1274-L1278 PolarHBondContact O-N 3.32Å; T1274-L1278 VanDerWaalsContact O-N 3.16Å
1275H30.2Very low31.5Very low153 Ų153108.3 Ų108.371%0.70862%0.62SS**Hα-helixtrans-74.2-33.4-178.9-107.6-71.3000113.2Y1277 S1279H1275-Y1277 VanDerWaalsContact C-N 3.3Å; H1275-Y1277 PolarHBondContact O-N 3.21Å; H1275-S1279 PolarHBondContact O-N 3.09Å
1276Q31.7Very low31.1Very low149 Ų149107 Ų10770%0.69661%0.613SS**Hα-helixtrans-67-33.5171.2-77.8-177.4-17.500111.6S1279 S1280Q1276-S1279 PolarHBondContact O-N 2.8Å; Q1276-S1279 PolarHBondContact O-OG 3.3Å; Q1276-S1280 PolarHBondContact O-N 2.94Å; Q1276-S1280 PolarHBondContact O-OG 3.35Å
1277Y34.5Very low31.1Very low127 Ų127106.8 Ų106.850%0.49861%0.606SS.*Hα-helixtrans-70.2-36.4178.3-154-102.2000113.1T1274 H1275 S1279 S1280 I1281T1274-Y1277 PolarHBondContact O-N 3.32Å; H1275-Y1277 VanDerWaalsContact C-N 3.3Å; H1275-Y1277 PolarHBondContact O-N 3.21Å; Y1277-S1279 PolarHBondContact O-N 3.43Å; Y1277-S1280 PolarHBondContact O-N 3.48Å; Y1277-I1281 HydrophobicContact CD1-CD1 3.71Å; Y1277-I1281 HydrophobicContact CD1-CG1 4.36Å; Y1277-I1281 HydrophobicContact CE1-CD1 3.34Å; Y1277-I1281 HydrophobicContact CE1-CG1 4.16Å; Y1277-I1281 PolarHBondContact O-N 2.78Å; Y1277-I1281 VanDerWaalsContact O-N 3.1Å
1278L29.9Very low31.3Very low80 Ų80112.2 Ų112.242%0.41961%0.613SS.*Hα-helixtrans-59.8-42.3172.4-85.3164.2000112.1T1274 S1280 I1281 T1282T1274-L1278 PolarHBondContact O-N 3.32Å; T1274-L1278 VanDerWaalsContact O-N 3.16Å; L1278-S1280 VanDerWaalsContact C-N 3.31Å; L1278-S1280 PolarHBondContact O-N 3.28Å; L1278-I1281 PolarHBondContact O-N 2.9Å; L1278-T1282 PolarHBondContact O-N 3.5Å; L1278-T1282 VanDerWaalsContact O-N 3.09Å; L1278-T1282 PolarHBondContact O-OG1 3.01Å
1279S34.2Very low31.4Very low75 Ų75113.8 Ų113.852%0.52461%0.613SS.*Hα-helixtrans-64.5-37.1177.573.20000112.2H1275 Q1276 Y1277 S1283H1275-S1279 PolarHBondContact O-N 3.09Å; Q1276-S1279 PolarHBondContact O-N 2.8Å; Q1276-S1279 PolarHBondContact O-OG 3.3Å; Y1277-S1279 PolarHBondContact O-N 3.43Å; S1279-S1283 VanDerWaalsContact O-CB 3.32Å; S1279-S1283 WeakPolarHBondContact O-CB 3.48Å; S1279-S1283 PolarHBondContact O-N 3.01Å; S1279-S1283 PolarHBondContact O-OG 3.18Å
1280S34.3Very low31.5Very low61 Ų61111 Ų11143%0.42760%0.597SS.*Hα-helixtrans-70.2-41.2-179.6-58.10000112.1Q1276 Y1277 L1278 S1283 L1284Q1276-S1280 PolarHBondContact O-N 2.94Å; Q1276-S1280 PolarHBondContact O-OG 3.35Å; Y1277-S1280 PolarHBondContact O-N 3.48Å; L1278-S1280 VanDerWaalsContact C-N 3.31Å; L1278-S1280 PolarHBondContact O-N 3.28Å; S1280-S1283 PolarHBondContact O-N 3.41Å; S1280-S1283 PolarHBondContact O-OG 2.93Å; S1280-L1284 WeakPolarHBondContact O-CG 3.32Å; S1280-L1284 PolarHBondContact O-N 2.94Å
1281I33.4Very low31.4Very low48 Ų48114.9 Ų114.925%0.24660%0.603CS.*Hα-helixtrans-74.5-40.5179.5-67.4179.6000112.2L1110 Y1277 L1278 S1283 L1284 S1285L1110-I1281 HydrophobicContact CD2-CD1 4.07Å; Y1277-I1281 HydrophobicContact CD1-CD1 3.71Å; Y1277-I1281 HydrophobicContact CD1-CG1 4.36Å; Y1277-I1281 HydrophobicContact CE1-CD1 3.34Å; Y1277-I1281 HydrophobicContact CE1-CG1 4.16Å; Y1277-I1281 PolarHBondContact O-N 2.78Å; Y1277-I1281 VanDerWaalsContact O-N 3.1Å; L1278-I1281 PolarHBondContact O-N 2.9Å; I1281-S1283 PolarHBondContact O-N 3.49Å; I1281-L1284 PolarHBondContact O-N 3.22Å; I1281-S1285 PolarHBondContact O-N 2.89Å
1282T37.5Very low31.4Very low83 Ų83112.6 Ų112.651%0.50959%0.594SS.*Hα-helixtrans-65.9-29.4176.9-34.20000111L1278 S1285 S1286L1278-T1282 PolarHBondContact O-N 3.5Å; L1278-T1282 VanDerWaalsContact O-N 3.09Å; L1278-T1282 PolarHBondContact O-OG1 3.01Å; T1282-S1285 PolarHBondContact O-OG 3.22Å; T1282-S1286 PolarHBondContact O-N 3.3Å; T1282-S1286 PolarHBondContact O-OG 2.9Å
1283S37.2Very low31.1Very low51 Ų51114.3 Ų114.336%0.35760%0.601SS.*Hα-helixtrans-67.6-33.2171.876.60000113S1279 S1280 I1281 S1286 Y1287S1279-S1283 VanDerWaalsContact O-CB 3.32Å; S1279-S1283 WeakPolarHBondContact O-CB 3.48Å; S1279-S1283 PolarHBondContact O-N 3.01Å; S1279-S1283 PolarHBondContact O-OG 3.18Å; S1280-S1283 PolarHBondContact O-N 3.41Å; S1280-S1283 PolarHBondContact O-OG 2.93Å; I1281-S1283 PolarHBondContact O-N 3.49Å; S1283-S1286 PolarHBondContact O-N 2.95Å; S1283-Y1287 VanDerWaalsContact O-CD2 3.25Å; S1283-Y1287 WeakPolarHBondContact O-CD2 3.47Å; S1283-Y1287 PolarHBondContact O-N 3.37Å
1284L33.1Very low31Very low85 Ų85116.1 Ų116.145%0.44560%0.602SS.*Hα-helixtrans-73.1-29.5-179.1-76.2164.4000113.8S1280 I1281S1280-L1284 WeakPolarHBondContact O-CG 3.32Å; S1280-L1284 PolarHBondContact O-N 2.94Å; I1281-L1284 PolarHBondContact O-N 3.22Å
1285S34.7Very low30.7Very low84 Ų84119.6 Ų119.659%0.58762%0.617SS**Hα-helixtrans-81.6-19.1174.159.40000113.4I1281 T1282I1281-S1285 PolarHBondContact O-N 2.89Å; T1282-S1285 PolarHBondContact O-OG 3.22Å
1286S31.7Very low30.6Very low78 Ų78120 Ų12055%0.54562%0.623SS.*  trans-109.513.3-172.161.40000115.2T1282 S1283 R1288T1282-S1286 PolarHBondContact O-N 3.3Å; T1282-S1286 PolarHBondContact O-OG 2.9Å; S1283-S1286 PolarHBondContact O-N 2.95Å; S1286-R1288 VanDerWaalsContact C-N 3.28Å; S1286-R1288 PolarHBondContact O-N 3.19Å
1287Y27Very low30.2Very low173 Ų173119 Ų11968%0.67863%0.631SS**  trans-58.886.9174.1-106.2-86.2000112S1283S1283-Y1287 VanDerWaalsContact O-CD2 3.25Å; S1283-Y1287 WeakPolarHBondContact O-CD2 3.47Å; S1283-Y1287 PolarHBondContact O-N 3.37Å
1288R28.2Very low30.4Very low233 Ų233118.5 Ų118.588%0.87964%0.643SS**  trans-97.5119.9145.3-83.3-174.7175.2-179.5-0.9106.2S1286 P1290S1286-R1288 VanDerWaalsContact C-N 3.28Å; S1286-R1288 PolarHBondContact O-N 3.19Å; R1288-P1290 WeakPolarHBondContact O-CD 3.41Å
1289K25.1Very low30.2Very low207 Ų207123 Ų12390%0.967%0.667SS**  trans-27.9110.5179.4-73.2178.5172.1-178.90113.7
1290P29.2Very low30Very low84 Ų84126.8 Ų126.855%0.54568%0.682SS.*  trans-93.6122.7159.522.1-6.7000109.3R1288 V1292R1288-P1290 WeakPolarHBondContact O-CD 3.41Å; P1290-V1292 HydrophobicContact CB-CG2 4.09Å; P1290-V1292 HydrophobicContact CG-CG2 4.45Å; P1290-V1292 PolarHBondContact O-N 2.96Å; P1290-V1292 VanDerWaalsContact O-N 3.13Å
1291Q25.2Very low29.7Very low197 Ų197130.5 Ų130.592%0.92170%0.696SS**  trans-68.9101.5164.7-74.7179-30.700107.7
1292V28.7Very low30Very low106 Ų106132.3 Ų132.364%0.64272%0.719SS**  trans-101.799.2178.3-178.30000108.9P1290 I1294P1290-V1292 HydrophobicContact CB-CG2 4.09Å; P1290-V1292 HydrophobicContact CG-CG2 4.45Å; P1290-V1292 PolarHBondContact O-N 2.96Å; P1290-V1292 VanDerWaalsContact O-N 3.13Å; V1292-I1294 HydrophobicContact CG1-CG1 4.04Å
1293T26.1Very low29.9Very low139 Ų139136.9 Ų136.985%0.85373%0.734SS**  trans-69.5116.6153.218.50000108D1295T1293-D1295 PolarHBondContact O-N 3.41Å
1294I28.2Very low29.6Very low129 Ų129140.4 Ų140.466%0.66275%0.749SS**  trans-84.9107.3-177.1-61169.9000108.3V1292 L1296V1292-I1294 HydrophobicContact CG1-CG1 4.04Å; I1294-L1296 HydrophobicContact CG2-CD2 4.34Å; I1294-L1296 HydrophobicContact CG2-CG 4.18Å
1295D25.2Very low29.5Very low169 Ų169141.7 Ų141.790%0.90475%0.753SS**  trans-95118.6160.7-92.2-29.2000108.9T1293T1293-D1295 PolarHBondContact O-N 3.41Å
1296L27.9Very low29.5Very low161 Ų161143.1 Ų143.184%0.84375%0.753SS**  trans-80.7130.6-176.1-72.6154000110.7I1294I1294-L1296 HydrophobicContact CG2-CD2 4.34Å; I1294-L1296 HydrophobicContact CG2-CG 4.18Å
1297C23.6Very low29.5Very low128 Ų128147.1 Ų147.187%0.86576%0.761SS**  trans-114.7135.9162.4-118.20000108.9
1298P37.9Very low29.7Very low117 Ų117146 Ų14676%0.7676%0.76SS**  trans-93131.1-165.335.2-30.3000111.5
1299L25.8Very low30Very low176 Ų176141.1 Ų141.192%0.92175%0.745SS**  trans-133.3119.7163.8-86.3160.1000107.6D1301L1299-D1301 PolarHBondContact O-N 3.34Å
1300D30.1Very low30.6Very low154 Ų154136.9 Ų136.982%0.82473%0.729SS**  trans-63.9118.8-176.8-65.2-53.8000111.6
1301D28.9Very low30.9Very low138 Ų138135.5 Ų135.574%0.73872%0.724SS**  trans-172.886.8149.9-91.6-27.2000109.2L1299 E1303L1299-D1301 PolarHBondContact O-N 3.34Å; D1301-E1303 VanDerWaalsContact C-N 3.3Å; D1301-E1303 PolarHBondContact O-N 2.96Å
1302A38.7Very low31.2Very low86 Ų86131.8 Ų131.871%0.71171%0.71SS**Hα-helixtrans-70.4-9.4-165.700000116.2
1303E34.4Very low31.8Very low179 Ų179129.5 Ų129.584%0.83670%0.702SS**Hα-helixtrans-82.4-29.8-176.9-73.3-167.9156.300113.8D1301D1301-E1303 VanDerWaalsContact C-N 3.3Å; D1301-E1303 PolarHBondContact O-N 2.96Å
1304N32.1Very low32.4Very low126 Ų126127.7 Ų127.767%0.67469%0.687SS**Hα-helixtrans-81.4-22179.8-76.2-34.4000113.1F1308N1304-F1308 PolarHBondContact O-N 3.46Å
1305E29.8Very low32.6Very low112 Ų112124.8 Ų124.852%0.52368%0.676SS.*Hα-helixtrans-73.7-30.8-179.7-143.2-167.2151.200112.4K1309E1305-K1309 WeakPolarHBondContact O-CB 3.14Å; E1305-K1309 PolarHBondContact O-N 3.32Å; E1305-K1309 WeakPolarHBondContact OE1-CE 3.35Å; E1305-K1309 IonicContact OE1-NZ 3.47Å; E1305-K1309 PolarHBondContact OE1-NZ 3.38Å
1306L35.4Very low33.2Very low114 Ų114122.5 Ų122.560%0.59767%0.668SS**Hα-helixtrans-68.8-37.5177.6-155.688.8000111.7Q1310L1306-Q1310 WeakPolarHBondContact O-CB 3.45Å; L1306-Q1310 PolarHBondContact O-N 3.33Å
1307F31.2Very low33.9Very low161 Ų161119.3 Ų119.371%0.70665%0.652SS**Hα-helixtrans-70.6-40.2179.3-150.2-89.1000111.7A1311F1307-A1311 WeakPolarHBondContact O-CB 3.47Å; F1307-A1311 PolarHBondContact O-N 3.44Å
1308F31.9Very low34.6Very low151 Ų151115.3 Ų115.366%0.66263%0.632SS**Hα-helixtrans-70.4-39.1176.3-115.8-87.8000112.4N1304 A1311 L1312N1304-F1308 PolarHBondContact O-N 3.46Å; F1308-A1311 PolarHBondContact O-N 3.35Å; F1308-L1312 HydrophobicContact CD1-CD1 3.94Å; F1308-L1312 PolarHBondContact O-N 3.49Å
1309K35Very low35Very low129 Ų129113 Ų11356%0.56162%0.619SS**Hα-helixtrans-67.3-38.4175.3-84.7173.1168.9156.80112.7E1305 A1313E1305-K1309 WeakPolarHBondContact O-CB 3.14Å; E1305-K1309 PolarHBondContact O-N 3.32Å; E1305-K1309 WeakPolarHBondContact OE1-CE 3.35Å; E1305-K1309 IonicContact OE1-NZ 3.47Å; E1305-K1309 PolarHBondContact OE1-NZ 3.38Å; K1309-A1313 VanDerWaalsContact O-CB 3.31Å; K1309-A1313 WeakPolarHBondContact O-CB 3.17Å; K1309-A1313 PolarHBondContact O-N 2.95Å
1310Q37.8Very low36Very low119 Ų119109 Ų10956%0.55660%0.595SS**Hα-helixtrans-69-36.7174.2-81.6-178.5-18.600112.6L1306 N1314L1306-Q1310 WeakPolarHBondContact O-CB 3.45Å; L1306-Q1310 PolarHBondContact O-N 3.33Å; Q1310-N1314 PolarHBondContact O-N 3.18Å; Q1310-N1314 PolarHBondContact O-ND2 3.37Å
1311A36Very low36.9Very low55 Ų55105.8 Ų105.846%0.45557%0.574SS.*Hα-helixtrans-65.9-39.4175.900000112.4F1307 F1308 V1315F1307-A1311 WeakPolarHBondContact O-CB 3.47Å; F1307-A1311 PolarHBondContact O-N 3.44Å; F1308-A1311 PolarHBondContact O-N 3.35Å; A1311-V1315 WeakPolarHBondContact O-CG2 3.49Å
1312L30.6Very low38.5Very low119 Ų119103.4 Ų103.462%0.62356%0.561SS**Hα-helixtrans-76.6-34.9177.9-93.9135.5000113.7F1308 N1314 V1315F1308-L1312 HydrophobicContact CD1-CD1 3.94Å; F1308-L1312 PolarHBondContact O-N 3.49Å; L1312-N1314 VanDerWaalsContact C-N 3.27Å; L1312-N1314 PolarHBondContact O-N 2.95Å; L1312-V1315 PolarHBondContact O-N 2.95Å
1313A40.5Very low39.6Very low57 Ų57101.8 Ų101.847%0.47154%0.544SS..Hα-helixtrans-63.5-34.117700000112.3K1309 V1315 T1316K1309-A1313 VanDerWaalsContact O-CB 3.31Å; K1309-A1313 WeakPolarHBondContact O-CB 3.17Å; K1309-A1313 PolarHBondContact O-N 2.95Å; A1313-V1315 VanDerWaalsContact C-N 3.3Å; A1313-V1315 PolarHBondContact O-N 3.39Å; A1313-T1316 PolarHBondContact O-OG1 3.27Å
1314N39Very low41.2Very low102 Ų10297.7 Ų97.755%0.54553%0.527SS..G310 helixtrans-75.5-12.5-179.8-71.8-14.7000114.4Q1310 L1312 T1316 Q1320Q1310-N1314 PolarHBondContact O-N 3.18Å; Q1310-N1314 PolarHBondContact O-ND2 3.37Å; L1312-N1314 VanDerWaalsContact C-N 3.27Å; L1312-N1314 PolarHBondContact O-N 2.95Å; N1314-T1316 VanDerWaalsContact C-N 3.3Å; N1314-Q1320 PolarHBondContact O-OE1 3.42Å
1315V33.4Very low42.9Very low68 Ų6893.5 Ų93.541%0.41250%0.503SS..G310 helixtrans-84-4.2179.9177.60000112.6A1311 L1312 A1313 D1317 F1321A1311-V1315 WeakPolarHBondContact O-CG2 3.49Å; L1312-V1315 PolarHBondContact O-N 2.95Å; A1313-V1315 VanDerWaalsContact C-N 3.3Å; A1313-V1315 PolarHBondContact O-N 3.39Å; V1315-D1317 PolarHBondContact O-N 3.39Å; V1315-F1321 HydrophobicContact CG1-CD2 4.16Å
1316T37.4Very low45Very low120 Ų12092.5 Ų92.574%0.73650%0.498SS*.G310 helixtrans-70.6-13.1178.653.30000114.2A1313 N1314 G1318A1313-T1316 PolarHBondContact O-OG1 3.27Å; N1314-T1316 VanDerWaalsContact C-N 3.3Å; T1316-G1318 PolarHBondContact O-N 2.96Å
1317D41.9Very low46.9Very low95 Ų9591.5 Ų91.551%0.50849%0.493SS..  trans-89.4100.3174.9-154.8-24.1000109.5V1315 S1319 Q1320V1315-D1317 PolarHBondContact O-N 3.39Å; D1317-S1319 PolarHBondContact O-N 3.01Å; D1317-S1319 PolarHBondContact OD1-OG 3.2Å; D1317-Q1320 PolarHBondContact O-N 3.24Å
1318G38.9Very low49Very low44 Ų4485.8 Ų85.845%0.45447%0.473SS..Hα-helixtrans-54.2-17-178.100000114.4T1316 F1321 I1322T1316-G1318 PolarHBondContact O-N 2.96Å; G1318-F1321 PolarHBondContact O-N 2.97Å; G1318-I1322 WeakPolarHBondContact O-CG1 3.31Å; G1318-I1322 PolarHBondContact O-N 2.94Å
1319S46.4Very low51.4Low69 Ų6980 Ų8048%0.48345%0.449SS..Hα-helixtrans-60.6-37.7170.663.30000113.3D1317 S1323D1317-S1319 PolarHBondContact O-N 3.01Å; D1317-S1319 PolarHBondContact OD1-OG 3.2Å; S1319-S1323 PolarHBondContact O-N 3.35Å
1320Q45.8Very low53.8Low90 Ų9078.2 Ų78.242%0.42144%0.441SS..Hα-helixtrans-70.2-38.5179-69.4-169.312.600111.8N1314 D1317 S1323 I1324N1314-Q1320 PolarHBondContact O-OE1 3.42Å; D1317-Q1320 PolarHBondContact O-N 3.24Å; Q1320-S1323 WeakPolarHBondContact O-CB 3.37Å; Q1320-S1323 PolarHBondContact O-N 3.12Å; Q1320-S1323 VanDerWaalsContact O-N 3.16Å; Q1320-S1323 PolarHBondContact O-OG 2.83Å; Q1320-I1324 WeakPolarHBondContact O-CG1 3.43Å; Q1320-I1324 PolarHBondContact O-N 3.22Å
1321F49.6Very low56.1Low88 Ų8876.8 Ų76.839%0.38643%0.434SS..Hα-helixtrans-67.5-40.5-177.4-145.8-86.5000112.1V1315 G1318 S1323 I1324 F1325V1315-F1321 HydrophobicContact CG1-CD2 4.16Å; G1318-F1321 PolarHBondContact O-N 2.97Å; F1321-S1323 VanDerWaalsContact C-N 3.27Å; F1321-S1323 PolarHBondContact O-N 2.75Å; F1321-I1324 PolarHBondContact O-N 3.48Å; F1321-F1325 WeakPolarHBondContact O-CB 3.42Å; F1321-F1325 PolarHBondContact O-N 2.97Å
1322I61.9Low58.6Low88 Ų8875.2 Ų75.245%0.45142%0.417SS..Hα-helixtrans-59-41172.5-65169.9000110.3G1318 I1324 F1325 E1326G1318-I1322 WeakPolarHBondContact O-CG1 3.31Å; G1318-I1322 PolarHBondContact O-N 2.94Å; I1322-I1324 PolarHBondContact O-N 2.82Å; I1322-F1325 WeakPolarHBondContact O-CB 3.29Å; I1322-F1325 PolarHBondContact O-N 3.22Å; I1322-E1326 HydrophobicContact CG2-CG 4.44Å; I1322-E1326 WeakPolarHBondContact O-CB 3.25Å; I1322-E1326 WeakPolarHBondContact O-CG 3.39Å; I1322-E1326 PolarHBondContact O-N 3.4Å
1323S63.1Low61.4Low51 Ų5171.5 Ų71.536%0.35740%0.398SS..Hα-helixtrans-63.9-41.4178.285.50000112.9S1319 Q1320 F1321 E1326 N1327S1319-S1323 PolarHBondContact O-N 3.35Å; Q1320-S1323 WeakPolarHBondContact O-CB 3.37Å; Q1320-S1323 PolarHBondContact O-N 3.12Å; Q1320-S1323 VanDerWaalsContact O-N 3.16Å; Q1320-S1323 PolarHBondContact O-OG 2.83Å; F1321-S1323 VanDerWaalsContact C-N 3.27Å; F1321-S1323 PolarHBondContact O-N 2.75Å; S1323-E1326 PolarHBondContact O-N 3.19Å; S1323-N1327 VanDerWaalsContact O-CB 3.28Å; S1323-N1327 WeakPolarHBondContact O-CB 3.42Å; S1323-N1327 PolarHBondContact O-N 3.21Å; S1323-N1327 PolarHBondContact O-ND2 3.13Å; S1323-N1327 VanDerWaalsContact O-ND2 3.13Å
1324I66.6Low63.8Low94 Ų9475.3 Ų75.348%0.48240%0.4SS..Hα-helixtrans-66-42178.2-65.6166.8000110.5Q1320 F1321 I1322 N1327 S1328Q1320-I1324 WeakPolarHBondContact O-CG1 3.43Å; Q1320-I1324 PolarHBondContact O-N 3.22Å; F1321-I1324 PolarHBondContact O-N 3.48Å; I1322-I1324 PolarHBondContact O-N 2.82Å; I1324-N1327 PolarHBondContact O-N 3.45Å; I1324-S1328 WeakPolarHBondContact O-CB 3.46Å; I1324-S1328 PolarHBondContact O-N 2.93Å; I1324-S1328 PolarHBondContact O-OG 3.4Å
1325F68.6Low66.4Low38 Ų3871.9 Ų71.917%0.16738%0.38CS..Hα-helixtrans-60.1-52.6175173.9-87.4000111.7L1222 F1321 I1322 N1327 S1328 L1329L1222-F1325 VanDerWaalsContact C-CE2 3.49Å; L1222-F1325 HydrophobicContact CB-CD2 4.34Å; L1222-F1325 HydrophobicContact CB-CE2 3.47Å; L1222-F1325 VanDerWaalsContact CB-CE2 3.47Å; L1222-F1325 HydrophobicContact CB-CZ 3.81Å; L1222-F1325 HydrophobicContact CD2-CE2 4.48Å; L1222-F1325 HydrophobicContact CG-CE2 4.49Å; L1222-F1325 WeakPolarHBondContact O-CE2 3.49Å; F1321-F1325 WeakPolarHBondContact O-CB 3.42Å; F1321-F1325 PolarHBondContact O-N 2.97Å; I1322-F1325 WeakPolarHBondContact O-CB 3.29Å; I1322-F1325 PolarHBondContact O-N 3.22Å; F1325-N1327 VanDerWaalsContact C-N 3.27Å; F1325-N1327 PolarHBondContact O-N 2.92Å; F1325-S1328 PolarHBondContact O-N 3.1Å; F1325-L1329 HydrophobicContact CE1-CD2 4.49Å; F1325-L1329 PolarHBondContact O-N 3.35Å
1326E73.1Confident69.3Low90 Ų9069.6 Ų69.642%0.42136%0.364SS..Hα-helixtrans-60.2-40.1179-80.1-164.7-173.300111.7I1322 S1323 L1329 K1330I1322-E1326 HydrophobicContact CG2-CG 4.44Å; I1322-E1326 WeakPolarHBondContact O-CB 3.25Å; I1322-E1326 WeakPolarHBondContact O-CG 3.39Å; I1322-E1326 PolarHBondContact O-N 3.4Å; S1323-E1326 PolarHBondContact O-N 3.19Å; E1326-L1329 PolarHBondContact O-N 2.97Å; E1326-K1330 VanDerWaalsContact O-CB 3.29Å; E1326-K1330 WeakPolarHBondContact O-CB 3.31Å; E1326-K1330 WeakPolarHBondContact O-CD 3.33Å; E1326-K1330 WeakPolarHBondContact O-CG 3.27Å; E1326-K1330 PolarHBondContact O-N 3.47Å; E1326-K1330 IonicContact OE2-NZ 2.58Å; E1326-K1330 PolarHBondContact OE2-NZ 3.02Å
1327N76.5Confident72Confident94 Ų9467.4 Ų67.450%0.50335%0.348SS..Hα-helixtrans-64.8-42.5177.7-72.4-21.2000111.6S1323 I1324 F1325 K1330 E1331S1323-N1327 VanDerWaalsContact O-CB 3.28Å; S1323-N1327 WeakPolarHBondContact O-CB 3.42Å; S1323-N1327 PolarHBondContact O-N 3.21Å; S1323-N1327 PolarHBondContact O-ND2 3.13Å; S1323-N1327 VanDerWaalsContact O-ND2 3.13Å; I1324-N1327 PolarHBondContact O-N 3.45Å; F1325-N1327 VanDerWaalsContact C-N 3.27Å; F1325-N1327 PolarHBondContact O-N 2.92Å; N1327-K1330 PolarHBondContact O-N 2.72Å; N1327-E1331 WeakPolarHBondContact O-CB 3.48Å; N1327-E1331 PolarHBondContact O-N 2.82Å
1328S75.1Confident74.5Confident40 Ų4062.9 Ų62.928%0.2832%0.324SS..Hα-helixtrans-64.3-44.4176.3-61.90000111.9I1324 F1325 E1331 F1332I1324-S1328 WeakPolarHBondContact O-CB 3.46Å; I1324-S1328 PolarHBondContact O-N 2.93Å; I1324-S1328 PolarHBondContact O-OG 3.4Å; F1325-S1328 PolarHBondContact O-N 3.1Å; S1328-E1331 PolarHBondContact O-N 2.86Å; S1328-F1332 VanDerWaalsContact O-CD2 3.27Å; S1328-F1332 WeakPolarHBondContact O-CD2 3.23Å; S1328-F1332 PolarHBondContact O-N 2.66Å
1329L82.3Confident77.2Confident29 Ų2960.8 Ų60.815%0.15230%0.302CS..Hα-helixtrans-61.7-45.5175.4-178.865.6000111.1L1218 L1222 F1325 E1326 E1331 F1332 L1333L1218-L1329 HydrophobicContact CB-CD1 4.47Å; L1222-L1329 HydrophobicContact CD1-CB 3.91Å; L1222-L1329 HydrophobicContact CD1-CD1 3.48Å; L1222-L1329 VanDerWaalsContact CD1-CD1 3.48Å; L1222-L1329 HydrophobicContact CD1-CG 4.27Å; F1325-L1329 HydrophobicContact CE1-CD2 4.49Å; F1325-L1329 PolarHBondContact O-N 3.35Å; E1326-L1329 PolarHBondContact O-N 2.97Å; L1329-E1331 VanDerWaalsContact C-N 3.29Å; L1329-E1331 PolarHBondContact O-N 3.2Å; L1329-F1332 PolarHBondContact O-N 3.21Å; L1329-L1333 HydrophobicContact CD1-CD1 4.26Å; L1329-L1333 HydrophobicContact CD1-CG 4.35Å; L1329-L1333 HydrophobicContact CG-CD1 3.99Å; L1329-L1333 HydrophobicContact CG-CG 4.46Å; L1329-L1333 WeakPolarHBondContact O-CB 3.4Å; L1329-L1333 VanDerWaalsContact O-CG 3.29Å; L1329-L1333 WeakPolarHBondContact O-CG 3.39Å; L1329-L1333 PolarHBondContact O-N 3.1Å
1330K85.3Confident79.6Confident92 Ų9257.6 Ų57.640%0.428%0.28SS..Hα-helixtrans-58.6-41.3175.9-75.1165.9-167.9161.50111E1326 N1327 L1333 R1334E1326-K1330 VanDerWaalsContact O-CB 3.29Å; E1326-K1330 WeakPolarHBondContact O-CB 3.31Å; E1326-K1330 WeakPolarHBondContact O-CD 3.33Å; E1326-K1330 WeakPolarHBondContact O-CG 3.27Å; E1326-K1330 PolarHBondContact O-N 3.47Å; E1326-K1330 IonicContact OE2-NZ 2.58Å; E1326-K1330 PolarHBondContact OE2-NZ 3.02Å; N1327-K1330 PolarHBondContact O-N 2.72Å; K1330-L1333 PolarHBondContact O-N 3.49Å; K1330-R1334 WeakPolarHBondContact O-CB 3.46Å; K1330-R1334 VanDerWaalsContact O-CG 3.27Å; K1330-R1334 WeakPolarHBondContact O-CG 3.47Å; K1330-R1334 PolarHBondContact O-N 3Å
1331E85.4Confident81.9Confident89 Ų8953.6 Ų53.642%0.41626%0.261SS..Hα-helixtrans-63.7-48.2177.2-166.5-168.4151.600112.2N1327 S1328 L1329 L1333 R1334 K1335N1327-E1331 WeakPolarHBondContact O-CB 3.48Å; N1327-E1331 PolarHBondContact O-N 2.82Å; S1328-E1331 PolarHBondContact O-N 2.86Å; L1329-E1331 VanDerWaalsContact C-N 3.29Å; L1329-E1331 PolarHBondContact O-N 3.2Å; E1331-L1333 VanDerWaalsContact C-N 3.34Å; E1331-L1333 PolarHBondContact O-N 3.08Å; E1331-R1334 PolarHBondContact O-N 3.15Å; E1331-K1335 HydrophobicContact CG-CD 4.46Å; E1331-K1335 PolarHBondContact O-N 3.27Å; E1331-K1335 WeakPolarHBondContact OE1-CE 3.46Å; E1331-K1335 IonicContact OE1-NZ 2.89Å; E1331-K1335 PolarHBondContact OE1-NZ 3.36Å
1332F88.9Confident84.2Confident23 Ų2349.4 Ų49.410%0.10124%0.243CC..Hα-helixtrans-61.9-41.4176.6-83.1-68000112.1C1169 R1172 R1173 Y1176 L1218 S1328 L1329 K1335 R1336C1169-F1332 HydrophobicContact CB-CE2 4.37Å; C1169-F1332 HydrophobicContact CB-CZ 4.22Å; R1172-F1332 HydrophobicContact CB-CE1 4.27Å; R1172-F1332 HydrophobicContact CG-CD1 4.26Å; R1172-F1332 HydrophobicContact CG-CE1 4.04Å; R1173-F1332 HydrophobicContact CB-CE1 4.21Å; R1173-F1332 HydrophobicContact CB-CZ 4.36Å; Y1176-F1332 HydrophobicContact CD2-CD1 4.28Å; Y1176-F1332 AromaticContact CE2-CD1 3.99Å; Y1176-F1332 HydrophobicContact CE2-CD1 3.99Å; L1218-F1332 HydrophobicContact CD1-CB 4.35Å; L1218-F1332 HydrophobicContact CD2-CB 3.63Å; L1218-F1332 HydrophobicContact CD2-CD1 4.23Å; L1218-F1332 HydrophobicContact CD2-CD2 4.27Å; L1218-F1332 HydrophobicContact CD2-CG 3.81Å; S1328-F1332 VanDerWaalsContact O-CD2 3.27Å; S1328-F1332 WeakPolarHBondContact O-CD2 3.23Å; S1328-F1332 PolarHBondContact O-N 2.66Å; L1329-F1332 PolarHBondContact O-N 3.21Å; F1332-K1335 PolarHBondContact O-N 3.36Å; F1332-R1336 VanDerWaalsContact O-CB 3.24Å; F1332-R1336 WeakPolarHBondContact O-CB 3.38Å; F1332-R1336 PolarHBondContact O-N 2.95Å
1333L90.5Very high85.8Confident41 Ų4145.2 Ų45.222%0.21522%0.222CC..Hα-helixtrans-65.4-39.2177.4-71.6173.7000112.1K1215 L1218 L1329 K1330 E1331 N1337K1215-L1333 HydrophobicContact CG-CD2 4.25Å; L1218-L1333 HydrophobicContact CD1-CD2 4.33Å; L1329-L1333 HydrophobicContact CD1-CD1 4.26Å; L1329-L1333 HydrophobicContact CD1-CG 4.35Å; L1329-L1333 HydrophobicContact CG-CD1 3.99Å; L1329-L1333 HydrophobicContact CG-CG 4.46Å; L1329-L1333 WeakPolarHBondContact O-CB 3.4Å; L1329-L1333 VanDerWaalsContact O-CG 3.29Å; L1329-L1333 WeakPolarHBondContact O-CG 3.39Å; L1329-L1333 PolarHBondContact O-N 3.1Å; K1330-L1333 PolarHBondContact O-N 3.49Å; E1331-L1333 VanDerWaalsContact C-N 3.34Å; E1331-L1333 PolarHBondContact O-N 3.08Å; L1333-N1337 WeakPolarHBondContact O-CB 3.4Å; L1333-N1337 PolarHBondContact O-N 3.04Å; L1333-N1337 PolarHBondContact O-ND2 3.14Å
1334R91.2Very high87.3Confident136 Ų13643 Ų4351%0.51321%0.207SC..Hα-helixtrans-61.6-49.2173.8-75.4174.4-176.1-176.53.2111.4K1330 E1331 R1336 N1337 L1338 V1394K1330-R1334 WeakPolarHBondContact O-CB 3.46Å; K1330-R1334 VanDerWaalsContact O-CG 3.27Å; K1330-R1334 WeakPolarHBondContact O-CG 3.47Å; K1330-R1334 PolarHBondContact O-N 3Å; E1331-R1334 PolarHBondContact O-N 3.15Å; R1334-R1336 PolarHBondContact O-N 3.37Å; R1334-N1337 PolarHBondContact O-N 2.94Å; R1334-L1338 PolarHBondContact O-N 2.83Å; R1334-V1394 HydrophobicContact CB-CG1 4.24Å
1335K92Very high88.6Confident30 Ų3039 Ų3913%0.1319%0.187CC..Hα-helixtrans-61.4-43.1177.5-74.2174.7173171.60112.4Y1176 E1331 F1332 L1338 L1339 I1398Y1176-K1335 HydrophobicContact CD2-CB 3.83Å; Y1176-K1335 HydrophobicContact CE2-CB 4.3Å; E1331-K1335 HydrophobicContact CG-CD 4.46Å; E1331-K1335 PolarHBondContact O-N 3.27Å; E1331-K1335 WeakPolarHBondContact OE1-CE 3.46Å; E1331-K1335 IonicContact OE1-NZ 2.89Å; E1331-K1335 PolarHBondContact OE1-NZ 3.36Å; F1332-K1335 PolarHBondContact O-N 3.36Å; K1335-L1338 PolarHBondContact O-N 3.13Å; K1335-L1339 WeakPolarHBondContact O-CB 3.43Å; K1335-L1339 PolarHBondContact O-N 3Å; K1335-I1398 HydrophobicContact CG-CD1 3.74Å
1336R94.2Very high89.9Confident20 Ų2037.3 Ų37.38%0.07518%0.179CC..Hα-helixtrans-59-47.4175.1176.2-174.6164.7-85.62.1111.5Y1176 I1211 Q1212 F1332 R1334 L1339 L1340Y1176-R1336 HydrophobicContact CE2-CB 4.22Å; I1211-R1336 HydrophobicContact CG2-CG 3.78Å; I1211-R1336 PolarHBondContact O-NE 2.97Å; Q1212-R1336 PolarHBondContact O-NH2 2.81Å; F1332-R1336 VanDerWaalsContact O-CB 3.24Å; F1332-R1336 WeakPolarHBondContact O-CB 3.38Å; F1332-R1336 PolarHBondContact O-N 2.95Å; R1334-R1336 PolarHBondContact O-N 3.37Å; R1336-L1339 PolarHBondContact O-N 3.35Å; R1336-L1340 HydrophobicContact CG-CD1 4.36Å; R1336-L1340 WeakPolarHBondContact O-CG 3.5Å; R1336-L1340 PolarHBondContact O-N 3.21Å
1337N94Very high90.9Very high74 Ų7433.1 Ų33.140%0.39616%0.16SC..Hα-helixtrans-65.6-41-179.1-70-15.9000111.5L1333 R1334 L1339 L1340 L1341L1333-N1337 WeakPolarHBondContact O-CB 3.4Å; L1333-N1337 PolarHBondContact O-N 3.04Å; L1333-N1337 PolarHBondContact O-ND2 3.14Å; R1334-N1337 PolarHBondContact O-N 2.94Å; N1337-L1339 VanDerWaalsContact C-N 3.34Å; N1337-L1339 PolarHBondContact O-N 3.06Å; N1337-L1340 PolarHBondContact O-N 3.36Å; N1337-L1341 WeakPolarHBondContact O-CB 3.42Å; N1337-L1341 PolarHBondContact O-N 3.31Å; N1337-L1341 VanDerWaalsContact O-N 3.08Å
1338L95.4Very high91.7Very high0 Ų029.8 Ų29.80%014%0.141CC..Hα-helixtrans-60-43.6173.1177.563.1000111.8L1180 R1334 K1335 L1341 L1342 N1391 V1394 I1398 F1406L1180-L1338 HydrophobicContact CD2-CD2 4.01Å; L1180-L1338 HydrophobicContact CD2-CG 4.19Å; R1334-L1338 PolarHBondContact O-N 2.83Å; K1335-L1338 PolarHBondContact O-N 3.13Å; L1338-L1341 WeakPolarHBondContact O-CB 3.47Å; L1338-L1341 PolarHBondContact O-N 3.13Å; L1338-L1342 HydrophobicContact CD1-CD1 3.88Å; L1338-L1342 HydrophobicContact CD1-CG 4.14Å; L1338-L1342 HydrophobicContact CG-CD1 3.89Å; L1338-L1342 WeakPolarHBondContact O-CG 3.48Å; L1338-L1342 PolarHBondContact O-N 3.12Å; L1338-N1391 WeakPolarHBondContact CA-OD1 3.3Å; L1338-N1391 HydrophobicContact CD1-CB 4.12Å; L1338-V1394 HydrophobicContact CD2-CG1 4.21Å; L1338-I1398 HydrophobicContact CD2-CD1 3.75Å; L1338-F1406 HydrophobicContact CD1-CE2 3.81Å
1339L95.7Very high92.5Very high1 Ų128.4 Ų28.41%0.00513%0.13CC..Hα-helixtrans-62.3-45.5176-84.5171.3000112.6Y1176 A1179 L1180 I1211 K1335 R1336 N1337 L1341 L1342 V1343Y1176-L1339 HydrophobicContact CD1-CD1 3.75Å; Y1176-L1339 HydrophobicContact CD2-CD1 4.16Å; Y1176-L1339 HydrophobicContact CE1-CD1 4.36Å; Y1176-L1339 HydrophobicContact CG-CD1 3.65Å; A1179-L1339 HydrophobicContact CB-CD1 4.33Å; A1179-L1339 HydrophobicContact CB-CD2 3.56Å; L1180-L1339 HydrophobicContact CD2-CD2 3.63Å; L1180-L1339 HydrophobicContact CD2-CG 3.86Å; L1180-L1339 HydrophobicContact CG-CD1 4.48Å; L1180-L1339 HydrophobicContact CG-CD2 3.7Å; L1180-L1339 HydrophobicContact CG-CG 3.96Å; I1211-L1339 HydrophobicContact CG2-CB 4.49Å; K1335-L1339 WeakPolarHBondContact O-CB 3.43Å; K1335-L1339 PolarHBondContact O-N 3Å; R1336-L1339 PolarHBondContact O-N 3.35Å; N1337-L1339 VanDerWaalsContact C-N 3.34Å; N1337-L1339 PolarHBondContact O-N 3.06Å; L1339-L1341 PolarHBondContact O-N 3.08Å; L1339-L1342 PolarHBondContact O-N 3.05Å; L1339-V1343 HydrophobicContact CD2-CG2 4.48Å; L1339-V1343 VanDerWaalsContact O-CB 3.24Å; L1339-V1343 WeakPolarHBondContact O-CB 3.37Å; L1339-V1343 WeakPolarHBondContact O-CG2 3.25Å; L1339-V1343 PolarHBondContact O-N 3.07Å
1340L96.1Very high93.1Very high2 Ų227 Ų271%0.0112%0.123CC..Hα-helixtrans-58.5-39.1176.5-74171.4000111.9W1208 I1211 Q1212 R1336 N1337 G1344 W1373W1208-L1340 HydrophobicContact CD2-CD2 4.16Å; W1208-L1340 HydrophobicContact CG-CD2 4.19Å; W1208-L1340 HydrophobicContact CZ2-CD2 4.38Å; W1208-L1340 PolarHBondContact NE1-O 2.97Å; I1211-L1340 HydrophobicContact CB-CD2 4.13Å; I1211-L1340 HydrophobicContact CG2-CD2 3.73Å; I1211-L1340 HydrophobicContact CG2-CG 3.77Å; Q1212-L1340 HydrophobicContact CB-CD2 4.08Å; R1336-L1340 HydrophobicContact CG-CD1 4.36Å; R1336-L1340 WeakPolarHBondContact O-CG 3.5Å; R1336-L1340 PolarHBondContact O-N 3.21Å; N1337-L1340 PolarHBondContact O-N 3.36Å; L1340-G1344 WeakPolarHBondContact O-CA 3.49Å; L1340-G1344 PolarHBondContact O-N 3.47Å; L1340-W1373 HydrophobicContact CB-CH2 3.87Å; L1340-W1373 HydrophobicContact CB-CZ2 3.75Å; L1340-W1373 HydrophobicContact CD1-CZ2 4.33Å
1341L95.2Very high93.5Very high5 Ų523.4 Ų23.43%0.02611%0.107CC..Hα-helixtrans-65.2-53.2177.8-15790.7000111.5N1337 L1338 L1339 N1345 W1373 F1378 V1387 L1388 N1391 F1406 F1410N1337-L1341 WeakPolarHBondContact O-CB 3.42Å; N1337-L1341 PolarHBondContact O-N 3.31Å; N1337-L1341 VanDerWaalsContact O-N 3.08Å; L1338-L1341 WeakPolarHBondContact O-CB 3.47Å; L1338-L1341 PolarHBondContact O-N 3.13Å; L1339-L1341 PolarHBondContact O-N 3.08Å; L1341-N1345 WeakPolarHBondContact O-CB 3.1Å; L1341-N1345 PolarHBondContact O-N 3.33Å; L1341-W1373 HydrophobicContact CD1-CH2 4.27Å; L1341-F1378 HydrophobicContact CD1-CE1 4.14Å; L1341-F1378 HydrophobicContact CD1-CE2 4.32Å; L1341-F1378 HydrophobicContact CD1-CZ 3.47Å; L1341-F1378 VanDerWaalsContact CD1-CZ 3.47Å; L1341-F1378 HydrophobicContact CG-CZ 4.49Å; L1341-V1387 HydrophobicContact CD1-CG1 4.35Å; L1341-L1388 HydrophobicContact CD2-CD2 3.9Å; L1341-N1391 HydrophobicContact CD2-CB 4.14Å; L1341-F1406 HydrophobicContact CD2-CE1 4.42Å; L1341-F1406 HydrophobicContact CD2-CE2 4.16Å; L1341-F1406 HydrophobicContact CD2-CZ 3.51Å; L1341-F1410 HydrophobicContact CB-CZ 4.34Å; L1341-F1410 HydrophobicContact CD2-CE1 3.98Å; L1341-F1410 HydrophobicContact CD2-CE2 3.78Å; L1341-F1410 HydrophobicContact CD2-CZ 3.45Å; L1341-F1410 VanDerWaalsContact CD2-CZ 3.45Å; L1341-F1410 HydrophobicContact CG-CE1 3.84Å; L1341-F1410 HydrophobicContact CG-CE2 4.33Å; L1341-F1410 HydrophobicContact CG-CZ 3.51Å
1342L96.3Very high93.8Very high0 Ų019.4 Ų19.40%09%0.09CC..Hα-helixtrans-67.5-46.5-176.5-73.1171.1000112.1L1180 F1183 L1338 L1339 N1345 E1346 I1402 F1406 F1410L1180-L1342 HydrophobicContact CD2-CD1 3.91Å; F1183-L1342 HydrophobicContact CB-CD1 4.04Å; F1183-L1342 HydrophobicContact CD1-CB 3.85Å; F1183-L1342 HydrophobicContact CD1-CD1 4.5Å; F1183-L1342 HydrophobicContact CD1-CD2 4.21Å; F1183-L1342 HydrophobicContact CD1-CG 4.42Å; F1183-L1342 HydrophobicContact CD2-CB 4.02Å; F1183-L1342 HydrophobicContact CD2-CD1 4.04Å; F1183-L1342 HydrophobicContact CE1-CB 3.77Å; F1183-L1342 WeakPolarHBondContact CE1-O 3.31Å; F1183-L1342 HydrophobicContact CE2-CB 3.93Å; F1183-L1342 HydrophobicContact CG-CB 3.99Å; F1183-L1342 HydrophobicContact CG-CD1 3.94Å; F1183-L1342 HydrophobicContact CG-CD2 4.38Å; F1183-L1342 HydrophobicContact CG-CG 4.34Å; F1183-L1342 HydrophobicContact CZ-CB 3.82Å; L1338-L1342 HydrophobicContact CD1-CD1 3.88Å; L1338-L1342 HydrophobicContact CD1-CG 4.14Å; L1338-L1342 HydrophobicContact CG-CD1 3.89Å; L1338-L1342 WeakPolarHBondContact O-CG 3.48Å; L1338-L1342 PolarHBondContact O-N 3.12Å; L1339-L1342 PolarHBondContact O-N 3.05Å; L1342-N1345 PolarHBondContact O-N 2.74Å; L1342-E1346 WeakPolarHBondContact O-CB 3.46Å; L1342-E1346 PolarHBondContact O-N 3.05Å; L1342-I1402 HydrophobicContact CD1-CG2 4Å; L1342-F1406 HydrophobicContact CD2-CD2 4.27Å; L1342-F1406 HydrophobicContact CD2-CE2 4.23Å; L1342-F1410 HydrophobicContact CD2-CE2 4.05Å
1343V96.5Very high94Very high1 Ų118.8 Ų18.81%0.0069%0.087CC..Hα-helixtrans-66.8-40.3177.91780000110.4F1147 F1183 I1204 F1207 W1208 L1339 N1345 E1346 V1347F1147-V1343 HydrophobicContact CE1-CG2 4.31Å; F1183-V1343 HydrophobicContact CE2-CG2 3.84Å; F1183-V1343 HydrophobicContact CZ-CB 4.39Å; F1183-V1343 HydrophobicContact CZ-CG2 3.72Å; I1204-V1343 HydrophobicContact CG2-CG1 3.59Å; F1207-V1343 HydrophobicContact CD1-CG2 4.34Å; F1207-V1343 HydrophobicContact CE1-CG2 4.37Å; W1208-V1343 HydrophobicContact CB-CG1 3.8Å; W1208-V1343 HydrophobicContact CG-CG1 4.3Å; L1339-V1343 HydrophobicContact CD2-CG2 4.48Å; L1339-V1343 VanDerWaalsContact O-CB 3.24Å; L1339-V1343 WeakPolarHBondContact O-CB 3.37Å; L1339-V1343 WeakPolarHBondContact O-CG2 3.25Å; L1339-V1343 PolarHBondContact O-N 3.07Å; V1343-N1345 PolarHBondContact O-N 2.95Å; V1343-E1346 WeakPolarHBondContact O-CB 3.41Å; V1343-E1346 PolarHBondContact O-N 2.88Å; V1343-V1347 WeakPolarHBondContact O-CG2 3.42Å; V1343-V1347 PolarHBondContact O-N 2.87Å
1344G94.8Very high94.1Very high5 Ų517.5 Ų17.55%0.0528%0.079CC..Hα-helixtrans-63-40.5175.700000112.9L1340 V1347 E1348L1340-G1344 WeakPolarHBondContact O-CA 3.49Å; L1340-G1344 PolarHBondContact O-N 3.47Å; G1344-V1347 PolarHBondContact O-N 3.35Å; G1344-E1348 PolarHBondContact O-N 2.97Å
1345N93.9Very high94.1Very high10 Ų1011.7 Ų11.75%0.0536%0.058CC..Hα-helixtrans-63-41.1172.5177.7-99.9000112L1341 L1342 V1343 E1348 R1349 R1409 F1410L1341-N1345 WeakPolarHBondContact O-CB 3.1Å; L1341-N1345 PolarHBondContact O-N 3.33Å; L1342-N1345 PolarHBondContact O-N 2.74Å; V1343-N1345 PolarHBondContact O-N 2.95Å; N1345-E1348 PolarHBondContact O-N 3.37Å; N1345-R1349 VanDerWaalsContact O-CB 3.31Å; N1345-R1349 WeakPolarHBondContact O-CB 3.35Å; N1345-R1349 PolarHBondContact O-N 2.68Å; N1345-R1409 PolarHBondContact ND2-O 3.47Å; N1345-R1409 WeakPolarHBondContact OD1-CB 3.49Å; N1345-F1410 HydrophobicContact CB-CE1 3.85Å; N1345-F1410 HydrophobicContact CB-CZ 3.72Å
1346E95.4Very high93.8Very high1 Ų110.5 Ų10.51%0.0055%0.054CC..Hα-helixtrans-65.2-39.1178.4-168.368.2-178.900112.5Y1182 F1183 L1342 V1343 R1349 L1350 R1409Y1182-E1346 HydrophobicContact CE1-CG 3.95Å; Y1182-E1346 WeakPolarHBondContact CE1-OE1 3.48Å; Y1182-E1346 PolarHBondContact OH-OE1 3.22Å; F1183-E1346 HydrophobicContact CE1-CB 4.01Å; F1183-E1346 HydrophobicContact CE1-CG 4.4Å; F1183-E1346 HydrophobicContact CZ-CB 4.41Å; L1342-E1346 WeakPolarHBondContact O-CB 3.46Å; L1342-E1346 PolarHBondContact O-N 3.05Å; V1343-E1346 WeakPolarHBondContact O-CB 3.41Å; V1343-E1346 PolarHBondContact O-N 2.88Å; E1346-R1349 WeakPolarHBondContact O-CB 3.49Å; E1346-R1349 PolarHBondContact O-N 3.3Å; E1346-R1349 IonicContact OE1-CZ 2.67Å; E1346-R1349 IonicContact OE1-NE 3.09Å; E1346-R1349 PolarHBondContact OE1-NE 2.86Å; E1346-R1349 IonicContact OE1-NH2 3.77Å; E1346-R1349 PolarHBondContact OE1-NH2 2.97Å; E1346-R1349 IonicContact OE2-CZ 3.69Å; E1346-R1349 IonicContact OE2-NE 3.54Å; E1346-R1349 PolarHBondContact OE2-NE 3.39Å; E1346-R1349 IonicContact OE2-NH2 3.58Å; E1346-L1350 HydrophobicContact CG-CD1 4.15Å; E1346-L1350 HydrophobicContact CG-CG 4.45Å; E1346-L1350 WeakPolarHBondContact O-CB 3.38Å; E1346-L1350 VanDerWaalsContact O-CG 3.3Å; E1346-L1350 WeakPolarHBondContact O-CG 3.24Å; E1346-L1350 PolarHBondContact O-N 3.48Å; E1346-R1409 IonicContact OE2-CZ 2.63Å; E1346-R1409 IonicContact OE2-NH1 2.65Å; E1346-R1409 PolarHBondContact OE2-NH1 3.33Å
1347V94.9Very high93.5Very high2 Ų210.9 Ų10.91%0.0126%0.056CC..Hα-helixtrans-59.9-51.1173.7170.10000110.6I1201 I1204 M1205 V1343 G1344 R1349 L1350 L1351 V1370I1201-V1347 HydrophobicContact CG2-CG1 4.5Å; I1204-V1347 HydrophobicContact CB-CG2 4.3Å; I1204-V1347 HydrophobicContact CG2-CG2 3.54Å; M1205-V1347 HydrophobicContact CG-CB 4.35Å; M1205-V1347 HydrophobicContact CG-CG1 3.61Å; M1205-V1347 HydrophobicContact CG-CG2 3.71Å; M1205-V1347 HydrophobicContact SD-CG1 3.97Å; V1343-V1347 WeakPolarHBondContact O-CG2 3.42Å; V1343-V1347 PolarHBondContact O-N 2.87Å; G1344-V1347 PolarHBondContact O-N 3.35Å; V1347-R1349 VanDerWaalsContact C-N 3.3Å; V1347-R1349 PolarHBondContact O-N 2.91Å; V1347-L1350 PolarHBondContact O-N 2.8Å; V1347-L1351 HydrophobicContact CG1-CD1 3.68Å; V1347-L1351 HydrophobicContact CG1-CG 4.32Å; V1347-L1351 WeakPolarHBondContact O-CB 3.39Å; V1347-L1351 VanDerWaalsContact O-CG 3.23Å; V1347-L1351 WeakPolarHBondContact O-CG 3.4Å; V1347-L1351 PolarHBondContact O-N 3.48Å; V1347-V1370 HydrophobicContact CG1-CG2 4.49Å
1348E91.9Very high93.1Very high25 Ų259.7 Ų9.712%0.1176%0.061CC..Hα-helixtrans-58.8-44.2178-172.6-156.1174.500111.5G1344 N1345 L1351 A1352 R1374 S1851 K1853G1344-E1348 PolarHBondContact O-N 2.97Å; N1345-E1348 PolarHBondContact O-N 3.37Å; E1348-L1351 PolarHBondContact O-N 2.96Å; E1348-A1352 PolarHBondContact O-N 3.04Å; E1348-R1374 IonicContact OE2-CZ 3.54Å; E1348-R1374 IonicContact OE2-NH1 2.69Å; E1348-R1374 PolarHBondContact OE2-NH1 3.46Å; E1348-R1374 IonicContact OE2-NH2 2.83Å; E1348-R1374 PolarHBondContact OE2-NH2 3.06Å; E1348-S1851 PolarHBondContact OE1-OG 2.7Å; E1348-K1853 HydrophobicContact CG-CB 4.22Å; E1348-K1853 HydrophobicContact CG-CD 3.92Å; E1348-K1853 WeakPolarHBondContact OE1-CB 3.33Å
1349R93.4Very high92.7Very high10 Ų1010.7 Ų10.74%0.0387%0.066CC..Hα-helixtrans-57.2-55.7178.1-169.2-172.271.682.5-6.2110.7Q1188 N1345 E1346 V1347 L1351 A1352 W1353 E1852Q1188-R1349 PolarHBondContact O-NH1 3.27Å; Q1188-R1349 PolarHBondContact O-NH2 3.02Å; N1345-R1349 VanDerWaalsContact O-CB 3.31Å; N1345-R1349 WeakPolarHBondContact O-CB 3.35Å; N1345-R1349 PolarHBondContact O-N 2.68Å; E1346-R1349 WeakPolarHBondContact O-CB 3.49Å; E1346-R1349 PolarHBondContact O-N 3.3Å; E1346-R1349 IonicContact OE1-CZ 2.67Å; E1346-R1349 IonicContact OE1-NE 3.09Å; E1346-R1349 PolarHBondContact OE1-NE 2.86Å; E1346-R1349 IonicContact OE1-NH2 3.77Å; E1346-R1349 PolarHBondContact OE1-NH2 2.97Å; E1346-R1349 IonicContact OE2-CZ 3.69Å; E1346-R1349 IonicContact OE2-NE 3.54Å; E1346-R1349 PolarHBondContact OE2-NE 3.39Å; E1346-R1349 IonicContact OE2-NH2 3.58Å; V1347-R1349 VanDerWaalsContact C-N 3.3Å; V1347-R1349 PolarHBondContact O-N 2.91Å; R1349-L1351 VanDerWaalsContact C-N 3.32Å; R1349-L1351 PolarHBondContact O-N 3.47Å; R1349-A1352 WeakPolarHBondContact O-CB 3.39Å; R1349-A1352 PolarHBondContact O-N 3.15Å; R1349-A1352 VanDerWaalsContact O-N 3.11Å; R1349-W1353 PolarHBondContact O-N 3.19Å; R1349-E1852 HydrophobicContact CG-CG 4.3Å; R1349-E1852 WeakPolarHBondContact CG-OE1 3.16Å; R1349-E1852 WeakPolarHBondContact CG-OE2 3.31Å
1350L94.9Very high92.2Very high1 Ų115.2 Ų15.21%0.00510%0.096CC..Hα-helixtrans-65.6-34.1-178.5-66.2176.9000112.5V1140 P1190 L1197 I1201 I1204 E1346 V1347 A1352 W1353 Y1354V1140-L1350 HydrophobicContact CG2-CD2 4.06Å; P1190-L1350 HydrophobicContact CG-CD2 3.73Å; L1197-L1350 HydrophobicContact CD1-CD2 4.23Å; I1201-L1350 HydrophobicContact CD1-CB 3.9Å; I1201-L1350 HydrophobicContact CG1-CB 3.69Å; I1201-L1350 HydrophobicContact CG1-CD1 4.21Å; I1204-L1350 HydrophobicContact CD1-CD1 3.54Å; E1346-L1350 HydrophobicContact CG-CD1 4.15Å; E1346-L1350 HydrophobicContact CG-CG 4.45Å; E1346-L1350 WeakPolarHBondContact O-CB 3.38Å; E1346-L1350 VanDerWaalsContact O-CG 3.3Å; E1346-L1350 WeakPolarHBondContact O-CG 3.24Å; E1346-L1350 PolarHBondContact O-N 3.48Å; V1347-L1350 PolarHBondContact O-N 2.8Å; L1350-A1352 VanDerWaalsContact C-N 3.3Å; L1350-A1352 PolarHBondContact O-N 2.96Å; L1350-W1353 PolarHBondContact O-N 3.21Å; L1350-W1353 VanDerWaalsContact O-N 3.13Å; L1350-Y1354 PolarHBondContact O-N 2.89Å
1351L93Very high91.7Very high15 Ų1521 Ų218%0.07912%0.123CC..Hα-helixtrans-62.2-37172.6-76.2168.9000112.1I1201 V1347 E1348 R1349 W1353 Y1354 N1355 I1364 E1367I1201-L1351 HydrophobicContact CD1-CD2 4.41Å; I1201-L1351 HydrophobicContact CG2-CD2 4.08Å; I1201-L1351 HydrophobicContact CG2-CG 4.22Å; V1347-L1351 HydrophobicContact CG1-CD1 3.68Å; V1347-L1351 HydrophobicContact CG1-CG 4.32Å; V1347-L1351 WeakPolarHBondContact O-CB 3.39Å; V1347-L1351 VanDerWaalsContact O-CG 3.23Å; V1347-L1351 WeakPolarHBondContact O-CG 3.4Å; V1347-L1351 PolarHBondContact O-N 3.48Å; E1348-L1351 PolarHBondContact O-N 2.96Å; R1349-L1351 VanDerWaalsContact C-N 3.32Å; R1349-L1351 PolarHBondContact O-N 3.47Å; L1351-W1353 PolarHBondContact O-N 2.58Å; L1351-Y1354 HydrophobicContact CD2-CD1 4.44Å; L1351-Y1354 PolarHBondContact O-N 2.82Å; L1351-N1355 CarbonylContact O-C 3.6Å; L1351-N1355 PolarHBondContact O-N 3.24Å; L1351-I1364 HydrophobicContact CD2-CD1 4.01Å; L1351-I1364 HydrophobicContact CD2-CG1 4.39Å; L1351-E1367 HydrophobicContact CD1-CB 4.38Å; L1351-E1367 HydrophobicContact CD1-CG 3.64Å
1352A91.6Very high91.4Very high5 Ų523.3 Ų23.34%0.04113%0.132CC..Hα-helixtrans-63.2-26.217500000112.9E1348 R1349 L1350 P1356 E1852 K1853E1348-A1352 PolarHBondContact O-N 3.04Å; R1349-A1352 WeakPolarHBondContact O-CB 3.39Å; R1349-A1352 PolarHBondContact O-N 3.15Å; R1349-A1352 VanDerWaalsContact O-N 3.11Å; L1350-A1352 VanDerWaalsContact C-N 3.3Å; L1350-A1352 PolarHBondContact O-N 2.96Å; A1352-P1356 VanDerWaalsContact O-CA 3.31Å; A1352-P1356 WeakPolarHBondContact O-CA 3.45Å; A1352-P1356 VanDerWaalsContact O-CB 3.29Å; A1352-P1356 WeakPolarHBondContact O-CB 3.47Å; A1352-E1852 HydrophobicContact CB-CB 4.11Å; A1352-K1853 HydrophobicContact CB-CB 4.32Å
1353W92.5Very high91Very high10 Ų1027.6 Ų27.64%0.03815%0.153CC..Hα-helixtrans-85.4-38173.8-7582.3000113.5C1189 P1190 R1349 L1350 L1351 I1720 R1807 L1810 A1811 E1852C1189-W1353 HydrophobicContact CB-CH2 3.92Å; C1189-W1353 HydrophobicContact CB-CZ2 4.15Å; C1189-W1353 HydrophobicContact CB-CZ3 4.46Å; P1190-W1353 VanDerWaalsContact CD-CD2 3.46Å; P1190-W1353 HydrophobicContact CG-CB 3.82Å; P1190-W1353 HydrophobicContact CG-CD2 3.99Å; P1190-W1353 HydrophobicContact CG-CE3 4.39Å; P1190-W1353 HydrophobicContact CG-CG 3.71Å; R1349-W1353 PolarHBondContact O-N 3.19Å; L1350-W1353 PolarHBondContact O-N 3.21Å; L1350-W1353 VanDerWaalsContact O-N 3.13Å; L1351-W1353 PolarHBondContact O-N 2.58Å; W1353-I1720 HydrophobicContact CH2-CD1 4.23Å; W1353-I1720 HydrophobicContact CZ3-CD1 4.13Å; W1353-R1807 HydrophobicContact CE3-CB 4.27Å; W1353-R1807 HydrophobicContact CE3-CG 3.88Å; W1353-R1807 HydrophobicContact CZ3-CB 3.94Å; W1353-R1807 HydrophobicContact CZ3-CG 4.08Å; W1353-R1807 PolarHBondContact O-NE 2.7Å; W1353-R1807 PolarHBondContact O-NH2 3.41Å; W1353-L1810 HydrophobicContact CD2-CD1 4.31Å; W1353-L1810 HydrophobicContact CG-CD1 4.46Å; W1353-L1810 HydrophobicContact CH2-CB 4.01Å; W1353-L1810 HydrophobicContact CZ2-CB 3.56Å; W1353-L1810 HydrophobicContact CZ2-CD1 4.49Å; W1353-A1811 HydrophobicContact CH2-CB 4Å; W1353-E1852 VanDerWaalsContact CD1-OE2 3.26Å; W1353-E1852 PolarHBondContact NE1-OE2 3.27Å
1354Y93Very high90.6Very high14 Ų1427.8 Ų27.86%0.05515%0.154CC..Hα-helixtrans-74-46.2-178.7171.8-112000112.2I1194 R1198 I1201 L1350 L1351 P1356 R1362 I1364I1194-Y1354 HydrophobicContact CG2-CD2 4.04Å; I1194-Y1354 HydrophobicContact CG2-CE2 3.63Å; R1198-Y1354 HydrophobicContact CB-CD2 4.37Å; R1198-Y1354 HydrophobicContact CB-CE2 3.73Å; R1198-Y1354 WeakPolarHBondContact CD-OH 3.47Å; R1198-Y1354 HydrophobicContact CG-CE1 4.39Å; R1198-Y1354 HydrophobicContact CG-CE2 4.24Å; I1201-Y1354 HydrophobicContact CD1-CD1 4.38Å; I1201-Y1354 HydrophobicContact CD1-CG 4.12Å; L1350-Y1354 PolarHBondContact O-N 2.89Å; L1351-Y1354 HydrophobicContact CD2-CD1 4.44Å; L1351-Y1354 PolarHBondContact O-N 2.82Å; Y1354-P1356 VanDerWaalsContact C-CD 3.49Å; Y1354-R1362 HydrophobicContact CE1-CB 3.99Å; Y1354-R1362 WeakPolarHBondContact CE1-O 3.46Å; Y1354-R1362 PolarHBondContact O-NH1 3.42Å; Y1354-I1364 HydrophobicContact CD1-CD1 3.92Å; Y1354-I1364 HydrophobicContact CD1-CG1 4.32Å; Y1354-I1364 HydrophobicContact CE1-CD1 3.75Å; Y1354-I1364 HydrophobicContact CE1-CG1 3.77Å
1355N91.8Very high90.1Very high15 Ų1532.1 Ų32.18%0.0818%0.181CC..  trans-130.360.7-177.7-166.314.4000112.2L1351 Q1357 G1358 L1359 R1362L1351-N1355 CarbonylContact O-C 3.6Å; L1351-N1355 PolarHBondContact O-N 3.24Å; N1355-Q1357 PolarHBondContact O-N 3.21Å; N1355-Q1357 VanDerWaalsContact O-N 3.13Å; N1355-G1358 PolarHBondContact O-N 3.3Å; N1355-G1358 VanDerWaalsContact O-N 3.08Å; N1355-G1358 PolarHBondContact OD1-N 3.39Å; N1355-L1359 PolarHBondContact ND2-N 3.03Å; N1355-L1359 PolarHBondContact ND2-O 3.49Å; N1355-L1359 PolarHBondContact OD1-N 3.13Å; N1355-R1362 HydrophobicContact CB-CB 3.94Å; N1355-R1362 VanDerWaalsContact CG-CB 3.47Å; N1355-R1362 PolarHBondContact ND2-O 3.49Å
1356P86.3Confident89.6Confident5 Ų532.7 Ų32.73%0.03219%0.19CC..THydrogen-bonded Turntrans-57.8-31.5-177.422.8-33.6000113A1352 Y1354 D1803 V1806 A1856 L1860A1352-P1356 VanDerWaalsContact O-CA 3.31Å; A1352-P1356 WeakPolarHBondContact O-CA 3.45Å; A1352-P1356 VanDerWaalsContact O-CB 3.29Å; A1352-P1356 WeakPolarHBondContact O-CB 3.47Å; Y1354-P1356 VanDerWaalsContact C-CD 3.49Å; P1356-D1803 VanDerWaalsContact CG-OD1 3.26Å; P1356-D1803 WeakPolarHBondContact CG-OD1 3.48Å; P1356-V1806 HydrophobicContact CB-CB 4.1Å; P1356-V1806 HydrophobicContact CB-CG1 3.58Å; P1356-V1806 HydrophobicContact CB-CG2 4.37Å; P1356-V1806 HydrophobicContact CG-CG1 4.47Å; P1356-A1856 HydrophobicContact CB-CB 4.31Å; P1356-L1860 VanDerWaalsContact O-CD1 3.26Å; P1356-L1860 WeakPolarHBondContact O-CD1 3.19Å
1357Q87.3Confident89.3Confident27 Ų2734.8 Ų34.813%0.12620%0.199CC..THydrogen-bonded Turntrans-84.5-12.8-178.1-67.3-178.857.100114.3N1355 L1359 R1799 D1803 L1860N1355-Q1357 PolarHBondContact O-N 3.21Å; N1355-Q1357 VanDerWaalsContact O-N 3.13Å; Q1357-L1359 HydrophobicContact CB-CD2 4.36Å; Q1357-L1359 HydrophobicContact CB-CG 4.01Å; Q1357-R1799 PolarHBondContact NE2-O 2.84Å; Q1357-D1803 PolarHBondContact NE2-OD1 2.9Å; Q1357-L1860 HydrophobicContact CB-CD1 4.49Å; Q1357-L1860 HydrophobicContact CG-CD1 4.15Å; Q1357-L1860 HydrophobicContact CG-CD2 4.01Å
1358G85.6Confident88.9Confident49 Ų4941.1 Ų41.151%0.50523%0.229SC..  trans67.836.5-174.800000113.5N1355N1355-G1358 PolarHBondContact O-N 3.3Å; N1355-G1358 VanDerWaalsContact O-N 3.08Å; N1355-G1358 PolarHBondContact OD1-N 3.39Å
1359L86.8Confident88.8Confident21 Ų2142.8 Ų42.811%0.1124%0.243CC..  trans-66.2134.4178.2-63.6173.7000110.6N1355 Q1357 E1361 R1362N1355-L1359 PolarHBondContact ND2-N 3.03Å; N1355-L1359 PolarHBondContact ND2-O 3.49Å; N1355-L1359 PolarHBondContact OD1-N 3.13Å; Q1357-L1359 HydrophobicContact CB-CD2 4.36Å; Q1357-L1359 HydrophobicContact CB-CG 4.01Å; L1359-E1361 VanDerWaalsContact C-N 3.31Å; L1359-E1361 HydrophobicContact CB-CG 4.22Å; L1359-E1361 PolarHBondContact O-N 3.06Å; L1359-R1362 HydrophobicContact CB-CB 4.46Å; L1359-R1362 PolarHBondContact O-N 2.95Å
1360P85Confident88.7Confident96 Ų9642.8 Ų42.862%0.62324%0.244SC*.G310 helixtrans-63.3-34.9-178.523.1-30.6000112.6R1362 I1363P1360-R1362 PolarHBondContact O-N 3.49Å; P1360-I1363 HydrophobicContact CB-CD1 4.43Å; P1360-I1363 PolarHBondContact O-N 3.27Å
1361E85.2Confident88.3Confident125 Ų12545.5 Ų45.558%0.58426%0.257SS*.G310 helixtrans-64.8-17.1175.258.7-97.1-151.400114.4L1359 R1799L1359-E1361 VanDerWaalsContact C-N 3.31Å; L1359-E1361 HydrophobicContact CB-CG 4.22Å; L1359-E1361 PolarHBondContact O-N 3.06Å; E1361-R1799 IonicContact OE1-NH1 3.57Å; E1361-R1799 PolarHBondContact OE1-NH1 2.76Å; E1361-R1799 VanDerWaalsContact OE1-NH1 3.11Å
1362R88.2Confident88.2Confident53 Ų5349.4 Ų49.420%0.227%0.274CS..G310 helixtrans-107.515.5178.5-67.5-171.9-174.4171.78.3112.7Y1354 N1355 L1359 P1360 D1803Y1354-R1362 HydrophobicContact CE1-CB 3.99Å; Y1354-R1362 WeakPolarHBondContact CE1-O 3.46Å; Y1354-R1362 PolarHBondContact O-NH1 3.42Å; N1355-R1362 HydrophobicContact CB-CB 3.94Å; N1355-R1362 VanDerWaalsContact CG-CB 3.47Å; N1355-R1362 PolarHBondContact ND2-O 3.49Å; L1359-R1362 HydrophobicContact CB-CB 4.46Å; L1359-R1362 PolarHBondContact O-N 2.95Å; P1360-R1362 PolarHBondContact O-N 3.49Å; R1362-D1803 IonicContact CZ-OD2 2.71Å; R1362-D1803 IonicContact NH1-OD2 3.99Å; R1362-D1803 PolarHBondContact NH1-OD2 2.78Å; R1362-D1803 IonicContact NH2-OD2 3.08Å; R1362-D1803 PolarHBondContact NH2-OD2 2.93Å
1363I88.4Confident88.3Confident90 Ų9051.4 Ų51.446%0.46228%0.281SS..PPolyproline II helixtrans-74.5133.7173.9-65173.5000109.7P1360P1360-I1363 HydrophobicContact CB-CD1 4.43Å; P1360-I1363 PolarHBondContact O-N 3.27Å
1364I88.6Confident88.1Confident4 Ų453.4 Ų53.42%0.02129%0.289CS..PPolyproline II helixtrans-97.2128176.6-59.2179.9000109.1R1198 I1201 A1202 M1205 L1351 Y1354 G1366 E1367R1198-I1364 HydrophobicContact CG-CD1 3.89Å; R1198-I1364 HydrophobicContact CG-CG1 4.19Å; I1201-I1364 HydrophobicContact CB-CD1 3.85Å; I1201-I1364 HydrophobicContact CD1-CD1 4.14Å; I1201-I1364 HydrophobicContact CG2-CD1 3.65Å; A1202-I1364 HydrophobicContact CB-CG2 4.46Å; M1205-I1364 HydrophobicContact CE-CG2 4.21Å; M1205-I1364 HydrophobicContact SD-CG2 4.03Å; L1351-I1364 HydrophobicContact CD2-CD1 4.01Å; L1351-I1364 HydrophobicContact CD2-CG1 4.39Å; Y1354-I1364 HydrophobicContact CD1-CD1 3.92Å; Y1354-I1364 HydrophobicContact CD1-CG1 4.32Å; Y1354-I1364 HydrophobicContact CE1-CD1 3.75Å; Y1354-I1364 HydrophobicContact CE1-CG1 3.77Å; I1364-G1366 PolarHBondContact O-N 3Å; I1364-E1367 WeakPolarHBondContact O-CB 3.41Å; I1364-E1367 PolarHBondContact O-N 3.45Å
1365P84.3Confident87.9Confident96 Ų9658.4 Ų58.462%0.62331%0.312SS*.THydrogen-bonded Turntrans-54.4126.9177.5-26.634.4000112.7M1205M1205-P1365 WeakPolarHBondContact CE-O 3.38Å
1366G83.8Confident87.9Confident22 Ų2265.4 Ų65.423%0.22734%0.342CS..THydrogen-bonded Turntrans99.3-5.8-179.800000115.2I1364 E1368 C1369I1364-G1366 PolarHBondContact O-N 3Å; G1366-E1368 VanDerWaalsContact C-N 3.26Å; G1366-E1368 PolarHBondContact O-N 3.12Å; G1366-C1369 WeakPolarHBondContact O-CB 3.47Å; G1366-C1369 PolarHBondContact O-N 3.38Å; G1366-C1369 VanDerWaalsContact O-N 3.08Å
1367E88Confident88Confident45 Ų4566.8 Ų66.821%0.2135%0.351CS..Hα-helixtrans-54.8-43.6177.2173.5176.1170.500111.4L1351 I1364 C1369 V1370 E1371L1351-E1367 HydrophobicContact CD1-CB 4.38Å; L1351-E1367 HydrophobicContact CD1-CG 3.64Å; I1364-E1367 WeakPolarHBondContact O-CB 3.41Å; I1364-E1367 PolarHBondContact O-N 3.45Å; E1367-C1369 PolarHBondContact O-N 2.86Å; E1367-V1370 PolarHBondContact O-N 3.38Å; E1367-V1370 VanDerWaalsContact O-N 3.15Å; E1367-E1371 PolarHBondContact O-N 2.64Å
1368E88.3Confident88.1Confident135 Ų13566.7 Ų66.763%0.63135%0.35SS*.Hα-helixtrans-57.7-32.3178.4-62.2179.8-175.300113.2G1366 E1371 Q1372G1366-E1368 VanDerWaalsContact C-N 3.26Å; G1366-E1368 PolarHBondContact O-N 3.12Å; E1368-E1371 PolarHBondContact O-N 3.27Å; E1368-Q1372 VanDerWaalsContact O-CB 3.3Å; E1368-Q1372 WeakPolarHBondContact O-CB 3.26Å; E1368-Q1372 WeakPolarHBondContact O-CG 3.33Å; E1368-Q1372 PolarHBondContact O-N 3.41Å
1369C89.1Confident88.2Confident60 Ų6068.5 Ų68.541%0.40535%0.353SS..Hα-helixtrans-67.3-39.2-179.4-67.50000111.8G1366 E1367 W1373G1366-C1369 WeakPolarHBondContact O-CB 3.47Å; G1366-C1369 PolarHBondContact O-N 3.38Å; G1366-C1369 VanDerWaalsContact O-N 3.08Å; E1367-C1369 PolarHBondContact O-N 2.86Å; C1369-W1373 WeakPolarHBondContact O-CB 3.2Å; C1369-W1373 PolarHBondContact O-N 3.12Å
1370V90.2Very high88.3Confident11 Ų1171 Ų717%0.06737%0.366CS..Hα-helixtrans-70.6-43.3178.6-176.60000109.7W1208 V1347 E1367 W1373 R1374W1208-V1370 HydrophobicContact CD2-CG2 4.03Å; W1208-V1370 HydrophobicContact CE3-CG2 3.9Å; W1208-V1370 HydrophobicContact CH2-CG2 4.43Å; W1208-V1370 HydrophobicContact CZ2-CG1 4.49Å; W1208-V1370 HydrophobicContact CZ3-CG2 4.12Å; V1347-V1370 HydrophobicContact CG1-CG2 4.49Å; E1367-V1370 PolarHBondContact O-N 3.38Å; E1367-V1370 VanDerWaalsContact O-N 3.15Å; V1370-W1373 PolarHBondContact O-N 3.32Å; V1370-R1374 WeakPolarHBondContact O-CB 3.23Å; V1370-R1374 PolarHBondContact O-N 2.91Å
1371E88.2Confident88.4Confident58 Ų5871.4 Ų71.427%0.27136%0.362SS..Hα-helixtrans-61.9-48.5176.9-175.965.4-134.100111.6E1367 E1368 W1373 R1374 Q1375 K1853E1367-E1371 PolarHBondContact O-N 2.64Å; E1368-E1371 PolarHBondContact O-N 3.27Å; E1371-W1373 VanDerWaalsContact C-N 3.34Å; E1371-W1373 PolarHBondContact O-N 2.92Å; E1371-R1374 WeakPolarHBondContact O-CB 3.42Å; E1371-R1374 PolarHBondContact O-N 3.22Å; E1371-R1374 VanDerWaalsContact O-N 3.16Å; E1371-Q1375 WeakPolarHBondContact O-CG 3.25Å; E1371-Q1375 PolarHBondContact O-N 3.3Å; E1371-Q1375 PolarHBondContact OE1-NE2 2.9Å; E1371-K1853 IonicContact OE2-NZ 2.71Å; E1371-K1853 PolarHBondContact OE2-NZ 3.12Å
1372Q90.8Very high88.5Confident96 Ų9670.9 Ų70.945%0.44937%0.367SS..Hα-helixtrans-62.2-39.2176.6-73.7174.916.200112.5E1368 R1374 K1376E1368-Q1372 VanDerWaalsContact O-CB 3.3Å; E1368-Q1372 WeakPolarHBondContact O-CB 3.26Å; E1368-Q1372 WeakPolarHBondContact O-CG 3.33Å; E1368-Q1372 PolarHBondContact O-N 3.41Å; Q1372-R1374 VanDerWaalsContact C-N 3.33Å; Q1372-K1376 VanDerWaalsContact O-CG 3.3Å; Q1372-K1376 WeakPolarHBondContact O-CG 3.29Å; Q1372-K1376 PolarHBondContact O-N 3.34Å; Q1372-K1376 VanDerWaalsContact O-N 3.07Å
1373W92.7Very high88.5Confident47 Ų4770.7 Ų70.718%0.17837%0.372CS..Hα-helixtrans-64.6-40.2175.4173.984.9000111.6W1208 L1340 L1341 C1369 V1370 E1371 K1376 T1377W1208-W1373 HydrophobicContact CH2-CB 3.55Å; W1208-W1373 HydrophobicContact CH2-CD2 4.3Å; W1208-W1373 AromaticContact CH2-CG 3.76Å; W1208-W1373 HydrophobicContact CH2-CG 3.76Å; W1208-W1373 HydrophobicContact CZ2-CB 3.67Å; W1208-W1373 AromaticContact CZ2-CD2 3.53Å; W1208-W1373 HydrophobicContact CZ2-CD2 3.53Å; W1208-W1373 AromaticContact CZ2-CE3 3.74Å; W1208-W1373 HydrophobicContact CZ2-CE3 3.74Å; W1208-W1373 AromaticContact CZ2-CG 3.49Å; W1208-W1373 HydrophobicContact CZ2-CG 3.49Å; W1208-W1373 VanDerWaalsContact CZ2-CG 3.49Å; L1340-W1373 HydrophobicContact CB-CH2 3.87Å; L1340-W1373 HydrophobicContact CB-CZ2 3.75Å; L1340-W1373 HydrophobicContact CD1-CZ2 4.33Å; L1341-W1373 HydrophobicContact CD1-CH2 4.27Å; C1369-W1373 WeakPolarHBondContact O-CB 3.2Å; C1369-W1373 PolarHBondContact O-N 3.12Å; V1370-W1373 PolarHBondContact O-N 3.32Å; E1371-W1373 VanDerWaalsContact C-N 3.34Å; E1371-W1373 PolarHBondContact O-N 2.92Å; W1373-K1376 PolarHBondContact O-N 3.13Å; W1373-T1377 VanDerWaalsContact CE2-OG1 3.27Å; W1373-T1377 HydrophobicContact CH2-CG2 4.26Å; W1373-T1377 HydrophobicContact CZ2-CG2 4.26Å; W1373-T1377 WeakPolarHBondContact O-CB 3.48Å; W1373-T1377 PolarHBondContact O-N 3.49Å; W1373-T1377 PolarHBondContact O-OG1 2.96Å
1374R87.9Confident88.6Confident53 Ų5368.4 Ų68.420%0.236%0.36CS..Hα-helixtrans-62.8-48.7176.7-173.6-168.7-173.1126.6-17.7111.2E1348 V1370 E1371 Q1372 K1376 T1377 F1378E1348-R1374 IonicContact OE2-CZ 3.54Å; E1348-R1374 IonicContact OE2-NH1 2.69Å; E1348-R1374 PolarHBondContact OE2-NH1 3.46Å; E1348-R1374 IonicContact OE2-NH2 2.83Å; E1348-R1374 PolarHBondContact OE2-NH2 3.06Å; V1370-R1374 WeakPolarHBondContact O-CB 3.23Å; V1370-R1374 PolarHBondContact O-N 2.91Å; E1371-R1374 WeakPolarHBondContact O-CB 3.42Å; E1371-R1374 PolarHBondContact O-N 3.22Å; E1371-R1374 VanDerWaalsContact O-N 3.16Å; Q1372-R1374 VanDerWaalsContact C-N 3.33Å; R1374-K1376 PolarHBondContact O-N 3.13Å; R1374-T1377 CarbonylContact O-C 3.54Å; R1374-T1377 PolarHBondContact O-N 3.24Å; R1374-F1378 HydrophobicContact CG-CD2 3.6Å; R1374-F1378 HydrophobicContact CG-CE2 3.99Å; R1374-F1378 PolarHBondContact O-N 3.39Å
1375Q88.9Confident88.7Confident118 Ų11869.7 Ų69.755%0.55137%0.367SS*.Hα-helixtrans-58.6-36.1177.3-70175.36.700112.2E1371 F1378 P1379E1371-Q1375 WeakPolarHBondContact O-CG 3.25Å; E1371-Q1375 PolarHBondContact O-N 3.3Å; E1371-Q1375 PolarHBondContact OE1-NE2 2.9Å; Q1375-F1378 CarbonylContact O-C 3.36Å; Q1375-P1379 WeakPolarHBondContact O-CA 3.27Å
1376K91.6Very high89.1Confident163 Ų16371.4 Ų71.471%0.70936%0.364SS*.Hα-helixtrans-71.6-33.2173.4-72.5172.7-177.9174.60113.4Q1372 W1373 R1374Q1372-K1376 VanDerWaalsContact O-CG 3.3Å; Q1372-K1376 WeakPolarHBondContact O-CG 3.29Å; Q1372-K1376 PolarHBondContact O-N 3.34Å; Q1372-K1376 VanDerWaalsContact O-N 3.07Å; W1373-K1376 PolarHBondContact O-N 3.13Å; R1374-K1376 PolarHBondContact O-N 3.13Å
1377T89.6Confident89.5Confident34 Ų3471.8 Ų71.821%0.20936%0.362CS..Hα-helixtrans-79.4-31.5-178.8-56.10000111.6W1373 R1374 P1379W1373-T1377 VanDerWaalsContact CE2-OG1 3.27Å; W1373-T1377 HydrophobicContact CH2-CG2 4.26Å; W1373-T1377 HydrophobicContact CZ2-CG2 4.26Å; W1373-T1377 WeakPolarHBondContact O-CB 3.48Å; W1373-T1377 PolarHBondContact O-N 3.49Å; W1373-T1377 PolarHBondContact O-OG1 2.96Å; R1374-T1377 CarbonylContact O-C 3.54Å; R1374-T1377 PolarHBondContact O-N 3.24Å; T1377-P1379 WeakPolarHBondContact O-CD 3.49Å
1378F89.6Confident89.7Confident25 Ų2569.7 Ų69.711%0.1135%0.352CS..  trans-122.666.7179.1-53.2-45.9000110.5L1341 R1374 Q1375 D1380 E1384 V1387 L1388L1341-F1378 HydrophobicContact CD1-CE1 4.14Å; L1341-F1378 HydrophobicContact CD1-CE2 4.32Å; L1341-F1378 HydrophobicContact CD1-CZ 3.47Å; L1341-F1378 VanDerWaalsContact CD1-CZ 3.47Å; L1341-F1378 HydrophobicContact CG-CZ 4.49Å; R1374-F1378 HydrophobicContact CG-CD2 3.6Å; R1374-F1378 HydrophobicContact CG-CE2 3.99Å; R1374-F1378 PolarHBondContact O-N 3.39Å; Q1375-F1378 CarbonylContact O-C 3.36Å; F1378-D1380 PolarHBondContact O-N 3.26Å; F1378-E1384 HydrophobicContact CB-CB 4.14Å; F1378-E1384 HydrophobicContact CB-CG 4.4Å; F1378-E1384 HydrophobicContact CD1-CB 3.75Å; F1378-E1384 HydrophobicContact CD1-CG 3.73Å; F1378-E1384 HydrophobicContact CE1-CB 4.39Å; F1378-E1384 HydrophobicContact CE1-CG 3.99Å; F1378-E1384 HydrophobicContact CG-CB 4.13Å; F1378-E1384 HydrophobicContact CG-CG 4.01Å; F1378-V1387 HydrophobicContact CE1-CB 4.14Å; F1378-V1387 HydrophobicContact CE1-CG1 3.88Å; F1378-L1388 HydrophobicContact CE1-CD2 4.28Å; F1378-L1388 HydrophobicContact CE1-CG 4.45Å; F1378-L1388 HydrophobicContact CZ-CD2 3.99Å
1379P87.6Confident89.9Confident87 Ų8768.2 Ų68.257%0.56534%0.341SS*.SBendtrans-68-27.718028.8-35.2000112.3Q1375 T1377 T1383Q1375-P1379 WeakPolarHBondContact O-CA 3.27Å; T1377-P1379 WeakPolarHBondContact O-CD 3.49Å; P1379-T1383 HydrophobicContact CG-CG2 4.21Å
1380D88.7Confident90.1Very high73 Ų7370 Ų7039%0.3934%0.343SS..SBendtrans-149.4162.4179.567.470.7000110.6F1378 V1382 T1383 E1384F1378-D1380 PolarHBondContact O-N 3.26Å; D1380-V1382 VanDerWaalsContact C-N 3.28Å; D1380-V1382 PolarHBondContact O-N 3.14Å; D1380-V1382 WeakPolarHBondContact OD1-CA 3.4Å; D1380-V1382 VanDerWaalsContact OD1-CB 3.3Å; D1380-V1382 WeakPolarHBondContact OD1-CB 3.36Å; D1380-V1382 PolarHBondContact OD1-N 3.49Å; D1380-T1383 PolarHBondContact O-N 2.88Å; D1380-T1383 PolarHBondContact OD1-N 2.89Å; D1380-T1383 PolarHBondContact OD1-OG1 3.39Å; D1380-T1383 PolarHBondContact OD2-OG1 3.45Å; D1380-E1384 PolarHBondContact O-N 3.47Å
1381L86Confident90.2Very high104 Ų10470.2 Ų70.255%0.54534%0.344SS..Hα-helixtrans-65.7-27.1-176.8-175.363.2000113.4N1385L1381-N1385 WeakPolarHBondContact O-CB 3.47Å; L1381-N1385 PolarHBondContact O-N 3.42Å; L1381-N1385 PolarHBondContact O-ND2 3.04Å
1382V87.7Confident90.5Very high114 Ų11467.5 Ų67.569%0.69133%0.331SS*.Hα-helixtrans-71.7-46179.6179.40000109.6D1380 N1385 K1386D1380-V1382 VanDerWaalsContact C-N 3.28Å; D1380-V1382 PolarHBondContact O-N 3.14Å; D1380-V1382 WeakPolarHBondContact OD1-CA 3.4Å; D1380-V1382 VanDerWaalsContact OD1-CB 3.3Å; D1380-V1382 WeakPolarHBondContact OD1-CB 3.36Å; D1380-V1382 PolarHBondContact OD1-N 3.49Å; V1382-N1385 PolarHBondContact O-N 3.41Å; V1382-K1386 PolarHBondContact O-N 2.86Å
1383T89.5Confident90.7Very high49 Ų4967.7 Ų67.730%0.30133%0.328SS..Hα-helixtrans-63.2-44.9175.8-59.60000110.8P1379 D1380 N1385 K1386 V1387P1379-T1383 HydrophobicContact CG-CG2 4.21Å; D1380-T1383 PolarHBondContact O-N 2.88Å; D1380-T1383 PolarHBondContact OD1-N 2.89Å; D1380-T1383 PolarHBondContact OD1-OG1 3.39Å; D1380-T1383 PolarHBondContact OD2-OG1 3.45Å; T1383-N1385 PolarHBondContact O-N 3.02Å; T1383-K1386 PolarHBondContact O-N 2.99Å; T1383-V1387 HydrophobicContact CG2-CG2 4.29Å; T1383-V1387 WeakPolarHBondContact O-CB 3.49Å; T1383-V1387 VanDerWaalsContact O-CG2 3.3Å; T1383-V1387 WeakPolarHBondContact O-CG2 3.48Å; T1383-V1387 PolarHBondContact O-N 2.73Å
1384E90.4Very high90.7Very high43 Ų4366.4 Ų66.420%0.20133%0.325CS..Hα-helixtrans-56.2-52.6174.6-178.5173.9-163.500111.7F1378 D1380 K1386 V1387 L1388F1378-E1384 HydrophobicContact CB-CB 4.14Å; F1378-E1384 HydrophobicContact CB-CG 4.4Å; F1378-E1384 HydrophobicContact CD1-CB 3.75Å; F1378-E1384 HydrophobicContact CD1-CG 3.73Å; F1378-E1384 HydrophobicContact CE1-CB 4.39Å; F1378-E1384 HydrophobicContact CE1-CG 3.99Å; F1378-E1384 HydrophobicContact CG-CB 4.13Å; F1378-E1384 HydrophobicContact CG-CG 4.01Å; D1380-E1384 PolarHBondContact O-N 3.47Å; E1384-K1386 VanDerWaalsContact C-N 3.28Å; E1384-K1386 PolarHBondContact O-N 2.89Å; E1384-V1387 PolarHBondContact O-N 3.16Å; E1384-L1388 HydrophobicContact CG-CD1 3.7Å; E1384-L1388 HydrophobicContact CG-CG 4.13Å; E1384-L1388 WeakPolarHBondContact O-CB 3.42Å; E1384-L1388 VanDerWaalsContact O-CG 3.24Å; E1384-L1388 WeakPolarHBondContact O-CG 3.4Å; E1384-L1388 PolarHBondContact O-N 2.94Å
1385N90.6Very high91Very high31 Ų3163.9 Ų63.917%0.16632%0.316CS..Hα-helixtrans-59.3-37.6178.9-82.5-53.1000113.2L1381 V1382 T1383 R1389 V1415L1381-N1385 WeakPolarHBondContact O-CB 3.47Å; L1381-N1385 PolarHBondContact O-N 3.42Å; L1381-N1385 PolarHBondContact O-ND2 3.04Å; V1382-N1385 PolarHBondContact O-N 3.41Å; T1383-N1385 PolarHBondContact O-N 3.02Å; N1385-R1389 VanDerWaalsContact O-CB 3.25Å; N1385-R1389 WeakPolarHBondContact O-CB 3.24Å; N1385-R1389 PolarHBondContact O-N 3.33Å; N1385-V1415 HydrophobicContact CB-CB 4.49Å; N1385-V1415 HydrophobicContact CB-CG2 4.12Å
1386K91.3Very high91.2Very high131 Ų13160 Ų6057%0.5730%0.296SS*.Hα-helixtrans-65.8-51.1175.8-176.9-177.2175.3-175.20111.3V1382 T1383 E1384 L1388 R1389 E1390V1382-K1386 PolarHBondContact O-N 2.86Å; T1383-K1386 PolarHBondContact O-N 2.99Å; E1384-K1386 VanDerWaalsContact C-N 3.28Å; E1384-K1386 PolarHBondContact O-N 2.89Å; K1386-L1388 VanDerWaalsContact C-N 3.35Å; K1386-L1388 PolarHBondContact O-N 3.07Å; K1386-R1389 PolarHBondContact O-N 3.14Å; K1386-E1390 VanDerWaalsContact CE-OE1 3.23Å; K1386-E1390 WeakPolarHBondContact CE-OE1 3.23Å; K1386-E1390 PolarHBondContact O-N 3.02Å
1387V92.2Very high91.2Very high31 Ų3158.8 Ų58.819%0.18829%0.293CS..Hα-helixtrans-60.8-44.8-179.4171.20000110.7L1341 F1378 T1383 E1384 E1390 N1391L1341-V1387 HydrophobicContact CD1-CG1 4.35Å; F1378-V1387 HydrophobicContact CE1-CB 4.14Å; F1378-V1387 HydrophobicContact CE1-CG1 3.88Å; T1383-V1387 HydrophobicContact CG2-CG2 4.29Å; T1383-V1387 WeakPolarHBondContact O-CB 3.49Å; T1383-V1387 VanDerWaalsContact O-CG2 3.3Å; T1383-V1387 WeakPolarHBondContact O-CG2 3.48Å; T1383-V1387 PolarHBondContact O-N 2.73Å; E1384-V1387 PolarHBondContact O-N 3.16Å; V1387-E1390 PolarHBondContact O-N 3.4Å; V1387-N1391 WeakPolarHBondContact O-CB 3.38Å; V1387-N1391 PolarHBondContact O-N 3.06Å; V1387-N1391 PolarHBondContact O-ND2 3.02Å
1388L92.7Very high91.2Very high0 Ų059.3 Ų59.30%029%0.294CS..Hα-helixtrans-66.9-40179.3-64.2179.9000111.9L1341 F1378 E1384 K1386 E1390 N1391 V1392 F1406 F1410 A1413 V1416L1341-L1388 HydrophobicContact CD2-CD2 3.9Å; F1378-L1388 HydrophobicContact CE1-CD2 4.28Å; F1378-L1388 HydrophobicContact CE1-CG 4.45Å; F1378-L1388 HydrophobicContact CZ-CD2 3.99Å; E1384-L1388 HydrophobicContact CG-CD1 3.7Å; E1384-L1388 HydrophobicContact CG-CG 4.13Å; E1384-L1388 WeakPolarHBondContact O-CB 3.42Å; E1384-L1388 VanDerWaalsContact O-CG 3.24Å; E1384-L1388 WeakPolarHBondContact O-CG 3.4Å; E1384-L1388 PolarHBondContact O-N 2.94Å; K1386-L1388 VanDerWaalsContact C-N 3.35Å; K1386-L1388 PolarHBondContact O-N 3.07Å; L1388-E1390 PolarHBondContact O-N 3.36Å; L1388-N1391 PolarHBondContact O-N 3.07Å; L1388-V1392 WeakPolarHBondContact O-CB 3.43Å; L1388-V1392 VanDerWaalsContact O-CG2 3.27Å; L1388-V1392 WeakPolarHBondContact O-CG2 3.27Å; L1388-V1392 PolarHBondContact O-N 3.17Å; L1388-F1406 HydrophobicContact CB-CE1 4.43Å; L1388-F1406 HydrophobicContact CD2-CE1 3.96Å; L1388-F1406 HydrophobicContact CD2-CZ 4.3Å; L1388-F1410 HydrophobicContact CD1-CB 4.11Å; L1388-F1410 HydrophobicContact CD2-CB 4.2Å; L1388-F1410 HydrophobicContact CD2-CD1 3.77Å; L1388-F1410 HydrophobicContact CD2-CD2 4.35Å; L1388-F1410 HydrophobicContact CD2-CE1 4.25Å; L1388-F1410 HydrophobicContact CD2-CG 3.83Å; L1388-A1413 HydrophobicContact CD1-CB 3.68Å; L1388-V1416 HydrophobicContact CB-CG2 3.56Å; L1388-V1416 HydrophobicContact CD1-CG2 4.47Å
1389R93Very high91.2Very high104 Ų10458.2 Ų58.239%0.39229%0.289SS..Hα-helixtrans-59.4-45.7175-173.4-171.9-60.8176.8-0.5111.7N1385 K1386 R1393 V1415 E1419N1385-R1389 VanDerWaalsContact O-CB 3.25Å; N1385-R1389 WeakPolarHBondContact O-CB 3.24Å; N1385-R1389 PolarHBondContact O-N 3.33Å; K1386-R1389 PolarHBondContact O-N 3.14Å; R1389-R1393 PolarHBondContact O-N 3.4Å; R1389-V1415 HydrophobicContact CB-CG1 3.9Å; R1389-V1415 HydrophobicContact CG-CG1 4.11Å; R1389-V1415 VanDerWaalsContact NH2-CG1 3.27Å; R1389-E1419 HydrophobicContact CG-CB 4.49Å; R1389-E1419 HydrophobicContact CG-CG 4.26Å
1390E92.4Very high91.4Very high98 Ų9855.3 Ų55.346%0.45827%0.271SS..Hα-helixtrans-64.7-46.3177.9-71.9174.6-167.500111.2K1386 V1387 L1388 V1392 R1393 V1394K1386-E1390 VanDerWaalsContact CE-OE1 3.23Å; K1386-E1390 WeakPolarHBondContact CE-OE1 3.23Å; K1386-E1390 PolarHBondContact O-N 3.02Å; V1387-E1390 PolarHBondContact O-N 3.4Å; L1388-E1390 PolarHBondContact O-N 3.36Å; E1390-V1392 VanDerWaalsContact C-N 3.31Å; E1390-V1392 PolarHBondContact O-N 3.26Å; E1390-R1393 WeakPolarHBondContact O-CB 3.44Å; E1390-R1393 PolarHBondContact O-N 3.28Å; E1390-R1393 VanDerWaalsContact O-N 3.15Å; E1390-V1394 WeakPolarHBondContact O-CG2 3.38Å; E1390-V1394 PolarHBondContact O-N 3.28Å
1391N93.8Very high91.5Very high16 Ų1652.4 Ų52.49%0.08626%0.255CS..Hα-helixtrans-67.7-28.3-179.1-80.6-83.8000113.7L1338 L1341 V1387 L1388 V1394 S1395 F1406L1338-N1391 WeakPolarHBondContact CA-OD1 3.3Å; L1338-N1391 HydrophobicContact CD1-CB 4.12Å; L1341-N1391 HydrophobicContact CD2-CB 4.14Å; V1387-N1391 WeakPolarHBondContact O-CB 3.38Å; V1387-N1391 PolarHBondContact O-N 3.06Å; V1387-N1391 PolarHBondContact O-ND2 3.02Å; L1388-N1391 PolarHBondContact O-N 3.07Å; N1391-V1394 PolarHBondContact O-N 2.86Å; N1391-S1395 WeakPolarHBondContact O-CB 3.37Å; N1391-S1395 PolarHBondContact O-N 2.92Å; N1391-S1395 PolarHBondContact O-OG 3.48Å; N1391-F1406 HydrophobicContact CB-CE2 4.33Å; N1391-F1406 HydrophobicContact CB-CZ 3.89Å
1392V94.7Very high91.8Very high0 Ų047.6 Ų47.60%023%0.23CC..Hα-helixtrans-68.1-35172.4162.10000112.3L1388 E1390 S1395 W1396 F1406 V1416 L1420 M1423L1388-V1392 WeakPolarHBondContact O-CB 3.43Å; L1388-V1392 VanDerWaalsContact O-CG2 3.27Å; L1388-V1392 WeakPolarHBondContact O-CG2 3.27Å; L1388-V1392 PolarHBondContact O-N 3.17Å; E1390-V1392 VanDerWaalsContact C-N 3.31Å; E1390-V1392 PolarHBondContact O-N 3.26Å; V1392-S1395 WeakPolarHBondContact CA-OG 3.4Å; V1392-S1395 PolarHBondContact O-OG 3.16Å; V1392-W1396 WeakPolarHBondContact O-CB 3.3Å; V1392-W1396 PolarHBondContact O-N 3.03Å; V1392-F1406 HydrophobicContact CG2-CB 4.11Å; V1392-F1406 HydrophobicContact CG2-CD1 3.19Å; V1392-F1406 HydrophobicContact CG2-CD2 4.16Å; V1392-F1406 HydrophobicContact CG2-CE1 3.42Å; V1392-F1406 VanDerWaalsContact CG2-CE1 3.42Å; V1392-F1406 HydrophobicContact CG2-CE2 4.36Å; V1392-F1406 HydrophobicContact CG2-CG 3.57Å; V1392-F1406 HydrophobicContact CG2-CZ 4Å; V1392-V1416 HydrophobicContact CG2-CB 4.2Å; V1392-V1416 HydrophobicContact CG2-CG1 3.56Å; V1392-V1416 HydrophobicContact CG2-CG2 3.88Å; V1392-L1420 HydrophobicContact CG1-CB 4.49Å; V1392-M1423 HydrophobicContact CG1-CE 3.45Å; V1392-M1423 VanDerWaalsContact CG1-CE 3.45Å
1393R94.4Very high92.1Very high100 Ų10042.1 Ų42.138%0.37720%0.197SC..Hα-helixtrans-69.3-44.8173.1-67173.9177.9174.42.8110.8R1389 E1390 S1395 W1396 E1397 E1419 M1423R1389-R1393 PolarHBondContact O-N 3.4Å; E1390-R1393 WeakPolarHBondContact O-CB 3.44Å; E1390-R1393 PolarHBondContact O-N 3.28Å; E1390-R1393 VanDerWaalsContact O-N 3.15Å; R1393-S1395 VanDerWaalsContact C-N 3.32Å; R1393-S1395 PolarHBondContact O-N 3.43Å; R1393-W1396 WeakPolarHBondContact O-CB 3.45Å; R1393-W1396 PolarHBondContact O-N 3.19Å; R1393-E1397 WeakPolarHBondContact O-CG 3.5Å; R1393-E1397 PolarHBondContact O-N 3.2Å; R1393-E1419 HydrophobicContact CG-CG 4.22Å; R1393-E1419 IonicContact CZ-OE1 2.65Å; R1393-E1419 IonicContact CZ-OE2 3.04Å; R1393-E1419 VanDerWaalsContact NE-CD 3.3Å; R1393-E1419 IonicContact NE-OE1 2.92Å; R1393-E1419 PolarHBondContact NE-OE1 2.99Å; R1393-E1419 IonicContact NE-OE2 3.95Å; R1393-E1419 VanDerWaalsContact NH2-CD 3.28Å; R1393-E1419 IonicContact NH2-OE1 2.99Å; R1393-E1419 PolarHBondContact NH2-OE1 2.8Å; R1393-E1419 VanDerWaalsContact NH2-OE1 3.13Å; R1393-E1419 IonicContact NH2-OE2 3.46Å; R1393-E1419 PolarHBondContact NH2-OE2 3.04Å; R1393-M1423 HydrophobicContact CG-SD 4.31Å
1394V93.2Very high92.3Very high20 Ų2040 Ų4012%0.12118%0.184CC..Hα-helixtrans-61-41.7176.1177.30000111.1R1334 L1338 E1390 N1391 E1397 I1398R1334-V1394 HydrophobicContact CB-CG1 4.24Å; L1338-V1394 HydrophobicContact CD2-CG1 4.21Å; E1390-V1394 WeakPolarHBondContact O-CG2 3.38Å; E1390-V1394 PolarHBondContact O-N 3.28Å; N1391-V1394 PolarHBondContact O-N 2.86Å; V1394-E1397 PolarHBondContact O-N 3.47Å; V1394-I1398 HydrophobicContact CG1-CD1 3.73Å; V1394-I1398 WeakPolarHBondContact O-CD1 3.46Å; V1394-I1398 VanDerWaalsContact O-CG1 3.24Å; V1394-I1398 WeakPolarHBondContact O-CG1 3.42Å; V1394-I1398 PolarHBondContact O-N 3.49Å
1395S93.6Very high92.4Very high0 Ų039.5 Ų39.50%018%0.18CC..Hα-helixtrans-66.4-38.4176.766.90000111.7N1391 V1392 R1393 I1398 C1399 A1403N1391-S1395 WeakPolarHBondContact O-CB 3.37Å; N1391-S1395 PolarHBondContact O-N 2.92Å; N1391-S1395 PolarHBondContact O-OG 3.48Å; V1392-S1395 WeakPolarHBondContact CA-OG 3.4Å; V1392-S1395 PolarHBondContact O-OG 3.16Å; R1393-S1395 VanDerWaalsContact C-N 3.32Å; R1393-S1395 PolarHBondContact O-N 3.43Å; S1395-I1398 PolarHBondContact O-N 3.15Å; S1395-C1399 CarbonylContact O-C 3.56Å; S1395-C1399 VanDerWaalsContact O-C 3.23Å; S1395-C1399 PolarHBondContact O-N 3.19Å; S1395-A1403 WeakPolarHBondContact OG-CA 3.18Å; S1395-A1403 WeakPolarHBondContact OG-CB 3.41Å
1396W93.8Very high92.5Very high38 Ų3838 Ų3814%0.14417%0.172CC..Hα-helixtrans-63.2-42.9174-176.1-88.7000112.9V1392 R1393 I1398 P1400 A1403 L1420 M1423 I1424 N1427 V1431V1392-W1396 WeakPolarHBondContact O-CB 3.3Å; V1392-W1396 PolarHBondContact O-N 3.03Å; R1393-W1396 WeakPolarHBondContact O-CB 3.45Å; R1393-W1396 PolarHBondContact O-N 3.19Å; W1396-I1398 VanDerWaalsContact C-N 3.29Å; W1396-I1398 PolarHBondContact O-N 3.08Å; W1396-P1400 HydrophobicContact CD2-CB 4.27Å; W1396-P1400 HydrophobicContact CD2-CG 4.4Å; W1396-P1400 HydrophobicContact CE3-CB 3.95Å; W1396-P1400 HydrophobicContact CH2-CB 4.14Å; W1396-P1400 HydrophobicContact CZ2-CB 4.46Å; W1396-P1400 HydrophobicContact CZ3-CB 3.87Å; W1396-A1403 HydrophobicContact CB-CB 4.05Å; W1396-A1403 HydrophobicContact CE3-CB 3.89Å; W1396-L1420 HydrophobicContact CE3-CD1 4.09Å; W1396-L1420 HydrophobicContact CZ3-CD1 4.2Å; W1396-M1423 HydrophobicContact CB-CE 3.87Å; W1396-M1423 HydrophobicContact CB-SD 3.72Å; W1396-M1423 HydrophobicContact CD2-CB 3.9Å; W1396-M1423 HydrophobicContact CD2-CE 4.28Å; W1396-M1423 HydrophobicContact CD2-SD 4.12Å; W1396-M1423 HydrophobicContact CE3-CB 4.11Å; W1396-M1423 HydrophobicContact CE3-CE 4.3Å; W1396-M1423 HydrophobicContact CG-CB 4.39Å; W1396-M1423 HydrophobicContact CG-CE 4.11Å; W1396-M1423 HydrophobicContact CG-SD 3.65Å; W1396-M1423 HydrophobicContact CH2-CB 4.41Å; W1396-M1423 HydrophobicContact CZ2-CB 4.19Å; W1396-M1423 HydrophobicContact CZ3-CB 4.36Å; W1396-I1424 HydrophobicContact CH2-CG1 3.9Å; W1396-I1424 HydrophobicContact CZ3-CG1 3.65Å; W1396-N1427 HydrophobicContact CZ2-CB 4.31Å; W1396-V1431 HydrophobicContact CH2-CG1 3.95Å; W1396-V1431 HydrophobicContact CZ3-CG1 3.91Å
1397E90.8Very high92.4Very high137 Ų13732.2 Ų32.264%0.6415%0.148SC*.Hα-helixtrans-61.8-35.9175.3-73.7171.4-17000112.3R1393 V1394R1393-E1397 WeakPolarHBondContact O-CG 3.5Å; R1393-E1397 PolarHBondContact O-N 3.2Å; V1394-E1397 PolarHBondContact O-N 3.47Å
1398I89.2Confident92.3Very high45 Ų4533.2 Ų33.223%0.23115%0.154CC..Hα-helixtrans-80.2-53.3-180-67.9165.2000111.8I1117 L1180 K1335 L1338 V1394 S1395 W1396I1117-I1398 HydrophobicContact CD1-CG2 3.3Å; L1180-I1398 HydrophobicContact CD1-CD1 4.27Å; L1180-I1398 HydrophobicContact CD1-CG2 4.1Å; K1335-I1398 HydrophobicContact CG-CD1 3.74Å; L1338-I1398 HydrophobicContact CD2-CD1 3.75Å; V1394-I1398 HydrophobicContact CG1-CD1 3.73Å; V1394-I1398 WeakPolarHBondContact O-CD1 3.46Å; V1394-I1398 VanDerWaalsContact O-CG1 3.24Å; V1394-I1398 WeakPolarHBondContact O-CG1 3.42Å; V1394-I1398 PolarHBondContact O-N 3.49Å; S1395-I1398 PolarHBondContact O-N 3.15Å; W1396-I1398 VanDerWaalsContact C-N 3.29Å; W1396-I1398 PolarHBondContact O-N 3.08Å
1399C89.8Confident92.2Very high2 Ų234 Ų341%0.01416%0.157CC..  trans-161.5109.4-178-175.90000110.1I1117 S1395 D1401 I1402I1117-C1399 HydrophobicContact CB-CB 4.47Å; I1117-C1399 HydrophobicContact CD1-CB 4.09Å; I1117-C1399 HydrophobicContact CG2-CB 4.05Å; S1395-C1399 CarbonylContact O-C 3.56Å; S1395-C1399 VanDerWaalsContact O-C 3.23Å; S1395-C1399 PolarHBondContact O-N 3.19Å; C1399-D1401 PolarHBondContact O-N 2.86Å; C1399-D1401 VanDerWaalsContact O-N 3.09Å; C1399-I1402 HydrophobicContact CB-CD1 3.91Å; C1399-I1402 HydrophobicContact CB-CG1 4.04Å; C1399-I1402 PolarHBondContact O-N 3.47Å
1400P91.8Very high92Very high26 Ų2629.4 Ų29.417%0.16914%0.14CC..Hα-helixtrans-51.8-33179-30.137.2000114.3W1396 I1402 A1403 V1404 V1431W1396-P1400 HydrophobicContact CD2-CB 4.27Å; W1396-P1400 HydrophobicContact CD2-CG 4.4Å; W1396-P1400 HydrophobicContact CE3-CB 3.95Å; W1396-P1400 HydrophobicContact CH2-CB 4.14Å; W1396-P1400 HydrophobicContact CZ2-CB 4.46Å; W1396-P1400 HydrophobicContact CZ3-CB 3.87Å; P1400-I1402 VanDerWaalsContact C-N 3.3Å; P1400-I1402 PolarHBondContact O-N 3.37Å; P1400-A1403 WeakPolarHBondContact O-CB 3.4Å; P1400-A1403 PolarHBondContact O-N 3.47Å; P1400-V1404 WeakPolarHBondContact O-CG2 3.35Å; P1400-V1404 PolarHBondContact O-N 2.94Å; P1400-V1431 HydrophobicContact CB-CG1 3.69Å
1401D91.2Very high91.5Very high12 Ų1226.9 Ų26.96%0.06413%0.127CC..Hα-helixtrans-58.3-40.1178-56.940.2000111.9A1184 C1399 V1404 Y1405 H1433 I1434A1184-D1401 HydrophobicContact CB-CB 4.09Å; C1399-D1401 PolarHBondContact O-N 2.86Å; C1399-D1401 VanDerWaalsContact O-N 3.09Å; D1401-V1404 PolarHBondContact O-N 3.38Å; D1401-Y1405 VanDerWaalsContact O-CD2 3.25Å; D1401-Y1405 WeakPolarHBondContact O-CD2 3.35Å; D1401-H1433 IonicContact OD1-CE1 3.84Å; D1401-H1433 IonicContact OD1-NE2 2.68Å; D1401-H1433 IonicContact OD2-CE1 3.82Å; D1401-H1433 IonicContact OD2-NE2 2.74Å; D1401-H1433 PolarHBondContact OD2-NE2 3.05Å; D1401-I1434 HydrophobicContact CB-CD1 3.92Å
1402I92.9Very high90.5Very high2 Ų230.1 Ų30.11%0.0114%0.144CC..Hα-helixtrans-66.8-40.6176-58.6175.5000110.3I1117 L1180 F1183 A1184 L1342 C1399 P1400 V1404 Y1405 F1406I1117-I1402 HydrophobicContact CD1-CD1 4.14Å; L1180-I1402 HydrophobicContact CB-CD1 3.88Å; L1180-I1402 HydrophobicContact CD2-CD1 4.36Å; L1180-I1402 WeakPolarHBondContact O-CD1 3.36Å; F1183-I1402 HydrophobicContact CB-CG2 4.22Å; A1184-I1402 HydrophobicContact CB-CG1 4Å; L1342-I1402 HydrophobicContact CD1-CG2 4Å; C1399-I1402 HydrophobicContact CB-CD1 3.91Å; C1399-I1402 HydrophobicContact CB-CG1 4.04Å; C1399-I1402 PolarHBondContact O-N 3.47Å; P1400-I1402 VanDerWaalsContact C-N 3.3Å; P1400-I1402 PolarHBondContact O-N 3.37Å; I1402-V1404 VanDerWaalsContact C-N 3.34Å; I1402-V1404 PolarHBondContact O-N 2.92Å; I1402-Y1405 PolarHBondContact O-N 3.39Å; I1402-F1406 PolarHBondContact O-N 2.95Å
1403A93.5Very high89.8Confident0 Ų030.4 Ų30.40%015%0.147CC..Hα-helixtrans-64.6-37.5-179.600000112.1S1395 W1396 P1400 Y1405 F1406 L1420S1395-A1403 WeakPolarHBondContact OG-CA 3.18Å; S1395-A1403 WeakPolarHBondContact OG-CB 3.41Å; W1396-A1403 HydrophobicContact CB-CB 4.05Å; W1396-A1403 HydrophobicContact CE3-CB 3.89Å; P1400-A1403 WeakPolarHBondContact O-CB 3.4Å; P1400-A1403 PolarHBondContact O-N 3.47Å; A1403-Y1405 VanDerWaalsContact C-N 3.29Å; A1403-Y1405 PolarHBondContact O-N 3.44Å; A1403-F1406 VanDerWaalsContact O-CB 3.23Å; A1403-F1406 WeakPolarHBondContact O-CB 3.39Å; A1403-F1406 PolarHBondContact O-N 3.17Å; A1403-L1420 HydrophobicContact CB-CD1 3.99Å; A1403-L1420 WeakPolarHBondContact O-CD2 3.4Å
1404V92.6Very high89.2Confident4 Ų431.5 Ų31.52%0.02416%0.161CC..Hα-helixtrans-59.2-38.8177.7170.30000112.3P1400 D1401 I1402 P1407 I1424 V1431 I1434 A1437P1400-V1404 WeakPolarHBondContact O-CG2 3.35Å; P1400-V1404 PolarHBondContact O-N 2.94Å; D1401-V1404 PolarHBondContact O-N 3.38Å; I1402-V1404 VanDerWaalsContact C-N 3.34Å; I1402-V1404 PolarHBondContact O-N 2.92Å; V1404-P1407 WeakPolarHBondContact O-CD 3.38Å; V1404-I1424 HydrophobicContact CG2-CD1 4.26Å; V1404-V1431 HydrophobicContact CG2-CB 4.09Å; V1404-V1431 HydrophobicContact CG2-CG1 3.66Å; V1404-I1434 HydrophobicContact CB-CD1 4.35Å; V1404-I1434 HydrophobicContact CG1-CG2 3.89Å; V1404-I1434 HydrophobicContact CG2-CD1 4.14Å; V1404-A1437 HydrophobicContact CG1-CB 3.86Å; V1404-A1437 HydrophobicContact CG2-CB 3.95Å
1405Y92.5Very high88.9Confident32 Ų3231.9 Ų31.913%0.12516%0.163CC..Hα-helixtrans-90.9-2.8-179.1-64.2-62.1000114.3A1184 V1185 H1186 D1401 I1402 A1403 P1407 V1408 R1409 I1434 A1436A1184-Y1405 WeakPolarHBondContact O-CE2 3.31Å; V1185-Y1405 VanDerWaalsContact C-CD2 3.44Å; H1186-Y1405 HydrophobicContact CB-CD1 3.85Å; H1186-Y1405 HydrophobicContact CB-CE1 3.59Å; H1186-Y1405 AromaticContact CD2-CD1 3.97Å; H1186-Y1405 AromaticContact CD2-CE1 4Å; D1401-Y1405 VanDerWaalsContact O-CD2 3.25Å; D1401-Y1405 WeakPolarHBondContact O-CD2 3.35Å; I1402-Y1405 PolarHBondContact O-N 3.39Å; A1403-Y1405 VanDerWaalsContact C-N 3.29Å; A1403-Y1405 PolarHBondContact O-N 3.44Å; Y1405-P1407 VanDerWaalsContact C-CD 3.49Å; Y1405-V1408 PolarHBondContact O-N 3Å; Y1405-R1409 PolarHBondContact O-N 2.92Å; Y1405-I1434 HydrophobicContact CE2-CG2 4.23Å; Y1405-I1434 WeakPolarHBondContact OH-CG2 3.48Å; Y1405-A1436 HydrophobicContact CE1-CB 4Å
1406F92.8Very high88.7Confident0 Ų031.9 Ų31.90%016%0.163CC..Hα-helixtrans-58.2-43.7178.3-153.3-82.6000114L1338 L1341 L1342 L1388 N1391 V1392 I1402 A1403 V1408 R1409 F1410 V1416L1338-F1406 HydrophobicContact CD1-CE2 3.81Å; L1341-F1406 HydrophobicContact CD2-CE1 4.42Å; L1341-F1406 HydrophobicContact CD2-CE2 4.16Å; L1341-F1406 HydrophobicContact CD2-CZ 3.51Å; L1342-F1406 HydrophobicContact CD2-CD2 4.27Å; L1342-F1406 HydrophobicContact CD2-CE2 4.23Å; L1388-F1406 HydrophobicContact CB-CE1 4.43Å; L1388-F1406 HydrophobicContact CD2-CE1 3.96Å; L1388-F1406 HydrophobicContact CD2-CZ 4.3Å; N1391-F1406 HydrophobicContact CB-CE2 4.33Å; N1391-F1406 HydrophobicContact CB-CZ 3.89Å; V1392-F1406 HydrophobicContact CG2-CB 4.11Å; V1392-F1406 HydrophobicContact CG2-CD1 3.19Å; V1392-F1406 HydrophobicContact CG2-CD2 4.16Å; V1392-F1406 HydrophobicContact CG2-CE1 3.42Å; V1392-F1406 VanDerWaalsContact CG2-CE1 3.42Å; V1392-F1406 HydrophobicContact CG2-CE2 4.36Å; V1392-F1406 HydrophobicContact CG2-CG 3.57Å; V1392-F1406 HydrophobicContact CG2-CZ 4Å; I1402-F1406 PolarHBondContact O-N 2.95Å; A1403-F1406 VanDerWaalsContact O-CB 3.23Å; A1403-F1406 WeakPolarHBondContact O-CB 3.39Å; A1403-F1406 PolarHBondContact O-N 3.17Å; F1406-V1408 VanDerWaalsContact C-N 3.25Å; F1406-V1408 PolarHBondContact O-N 3.37Å; F1406-R1409 PolarHBondContact O-N 3.46Å; F1406-F1410 AromaticContact CD1-CD2 3.54Å; F1406-F1410 HydrophobicContact CD1-CD2 3.54Å; F1406-F1410 HydrophobicContact CD1-CE2 4.21Å; F1406-F1410 HydrophobicContact CD1-CG 4.4Å; F1406-F1410 HydrophobicContact CD2-CD2 4.43Å; F1406-F1410 HydrophobicContact CD2-CE2 4.36Å; F1406-F1410 HydrophobicContact CE1-CB 4.41Å; F1406-F1410 AromaticContact CE1-CD2 3.32Å; F1406-F1410 HydrophobicContact CE1-CD2 3.32Å; F1406-F1410 AromaticContact CE1-CE2 3.79Å; F1406-F1410 HydrophobicContact CE1-CE2 3.79Å; F1406-F1410 HydrophobicContact CE1-CG 4.04Å; F1406-F1410 HydrophobicContact CE2-CD2 4.24Å; F1406-F1410 AromaticContact CE2-CE2 3.93Å; F1406-F1410 HydrophobicContact CE2-CE2 3.93Å; F1406-F1410 HydrophobicContact CG-CD2 4.13Å; F1406-F1410 AromaticContact CZ-CD2 3.71Å; F1406-F1410 HydrophobicContact CZ-CD2 3.71Å; F1406-F1410 AromaticContact CZ-CE2 3.65Å; F1406-F1410 HydrophobicContact CZ-CE2 3.65Å; F1406-F1410 PolarHBondContact O-N 3.2Å; F1406-V1416 HydrophobicContact CD1-CG1 4.02Å
1407P90.2Very high88.5Confident9 Ų934.7 Ų34.76%0.05818%0.176CC..Hα-helixtrans-67.3-22.4180-16.229.3000114.2V1404 Y1405 V1416 K1417 L1420 Y1440V1404-P1407 WeakPolarHBondContact O-CD 3.38Å; Y1405-P1407 VanDerWaalsContact C-CD 3.49Å; P1407-V1416 HydrophobicContact CB-CG1 4.22Å; P1407-V1416 HydrophobicContact CG-CG1 3.83Å; P1407-K1417 HydrophobicContact CB-CG 3.96Å; P1407-K1417 HydrophobicContact CG-CG 4.4Å; P1407-L1420 HydrophobicContact CG-CD2 3.56Å; P1407-Y1440 WeakPolarHBondContact CG-OH 3.15Å
1408V89Confident88.4Confident52 Ų5231.6 Ų31.632%0.31517%0.169SC..Hα-helixtrans-77.7-31.2177.1-171.60000110.9P1187 Y1405 F1406 K1411P1187-V1408 HydrophobicContact CG-CG1 4.36Å; Y1405-V1408 PolarHBondContact O-N 3Å; F1406-V1408 VanDerWaalsContact C-N 3.25Å; F1406-V1408 PolarHBondContact O-N 3.37Å; V1408-K1411 VanDerWaalsContact O-CE 3.29Å; V1408-K1411 WeakPolarHBondContact O-CE 3.31Å
1409R91Very high88.5Confident16 Ų1630.3 Ų30.36%0.0616%0.162CC..Hα-helixtrans-78-46177.2-69.4179-176.1-77.7-1.4111.8V1185 P1187 N1345 E1346 Y1405 F1406V1185-R1409 PolarHBondContact O-NH2 3.23Å; P1187-R1409 HydrophobicContact CG-CG 3.74Å; N1345-R1409 PolarHBondContact ND2-O 3.47Å; N1345-R1409 WeakPolarHBondContact OD1-CB 3.49Å; E1346-R1409 IonicContact OE2-CZ 2.63Å; E1346-R1409 IonicContact OE2-NH1 2.65Å; E1346-R1409 PolarHBondContact OE2-NH1 3.33Å; Y1405-R1409 PolarHBondContact O-N 2.92Å; F1406-R1409 PolarHBondContact O-N 3.46Å
1410F90Very high88.6Confident8 Ų830.2 Ų30.24%0.03516%0.162CC..SBendtrans-10884.3179.3-58.2-82.4000110.4L1341 L1342 N1345 L1388 F1406L1341-F1410 HydrophobicContact CB-CZ 4.34Å; L1341-F1410 HydrophobicContact CD2-CE1 3.98Å; L1341-F1410 HydrophobicContact CD2-CE2 3.78Å; L1341-F1410 HydrophobicContact CD2-CZ 3.45Å; L1341-F1410 VanDerWaalsContact CD2-CZ 3.45Å; L1341-F1410 HydrophobicContact CG-CE1 3.84Å; L1341-F1410 HydrophobicContact CG-CE2 4.33Å; L1341-F1410 HydrophobicContact CG-CZ 3.51Å; L1342-F1410 HydrophobicContact CD2-CE2 4.05Å; N1345-F1410 HydrophobicContact CB-CE1 3.85Å; N1345-F1410 HydrophobicContact CB-CZ 3.72Å; L1388-F1410 HydrophobicContact CD1-CB 4.11Å; L1388-F1410 HydrophobicContact CD2-CB 4.2Å; L1388-F1410 HydrophobicContact CD2-CD1 3.77Å; L1388-F1410 HydrophobicContact CD2-CD2 4.35Å; L1388-F1410 HydrophobicContact CD2-CE1 4.25Å; L1388-F1410 HydrophobicContact CD2-CG 3.83Å; F1406-F1410 AromaticContact CD1-CD2 3.54Å; F1406-F1410 HydrophobicContact CD1-CD2 3.54Å; F1406-F1410 HydrophobicContact CD1-CE2 4.21Å; F1406-F1410 HydrophobicContact CD1-CG 4.4Å; F1406-F1410 HydrophobicContact CD2-CD2 4.43Å; F1406-F1410 HydrophobicContact CD2-CE2 4.36Å; F1406-F1410 HydrophobicContact CE1-CB 4.41Å; F1406-F1410 AromaticContact CE1-CD2 3.32Å; F1406-F1410 HydrophobicContact CE1-CD2 3.32Å; F1406-F1410 AromaticContact CE1-CE2 3.79Å; F1406-F1410 HydrophobicContact CE1-CE2 3.79Å; F1406-F1410 HydrophobicContact CE1-CG 4.04Å; F1406-F1410 HydrophobicContact CE2-CD2 4.24Å; F1406-F1410 AromaticContact CE2-CE2 3.93Å; F1406-F1410 HydrophobicContact CE2-CE2 3.93Å; F1406-F1410 HydrophobicContact CG-CD2 4.13Å; F1406-F1410 AromaticContact CZ-CD2 3.71Å; F1406-F1410 HydrophobicContact CZ-CD2 3.71Å; F1406-F1410 AromaticContact CZ-CE2 3.65Å; F1406-F1410 HydrophobicContact CZ-CE2 3.65Å; F1406-F1410 PolarHBondContact O-N 3.2Å
1411K81Confident88.6Confident45 Ų4530.1 Ų30.120%0.19616%0.162CC..THydrogen-bonded Turntrans-72.8158.8176.9-56.6176.9174.4-178.10109.6V1408 Q1849 K1850V1408-K1411 VanDerWaalsContact O-CE 3.29Å; V1408-K1411 WeakPolarHBondContact O-CE 3.31Å; K1411-Q1849 WeakPolarHBondContact CB-O 3.17Å; K1411-K1850 WeakPolarHBondContact CD-O 3.49Å
1412N73.3Confident88.6Confident84 Ų8435.9 Ų35.945%0.44918%0.183SC..THydrogen-bonded Turntrans73.611.7-172.9-55.6-41.7000117.5Q1849N1412-Q1849 PolarHBondContact ND2-O 3.19Å; N1412-Q1849 WeakPolarHBondContact OD1-CB 3.3Å; N1412-Q1849 PolarHBondContact OD1-O 3.26Å
1413A79.1Confident88.6Confident7 Ų736.2 Ų36.26%0.05818%0.184CC..  trans-110.977178.600000112.3L1388 V1415 V1416 K1417L1388-A1413 HydrophobicContact CD1-CB 3.68Å; A1413-V1415 PolarHBondContact O-N 3.48Å; A1413-V1415 VanDerWaalsContact O-N 3.16Å; A1413-V1416 HydrophobicContact CB-CB 3.94Å; A1413-V1416 HydrophobicContact CB-CG2 3.66Å; A1413-V1416 VanDerWaalsContact O-CB 3.32Å; A1413-V1416 WeakPolarHBondContact O-CB 3.46Å; A1413-V1416 PolarHBondContact O-N 2.89Å; A1413-K1417 PolarHBondContact O-N 2.91Å
1414D82.2Confident88.5Confident123 Ų12336.2 Ų36.266%0.65818%0.184SC*.Hα-helixtrans-59.4-28.7176.5-71.6-33.1000112.3V1416 K1417 S1418D1414-V1416 VanDerWaalsContact C-N 3.29Å; D1414-V1416 PolarHBondContact O-N 3.37Å; D1414-K1417 PolarHBondContact O-N 2.63Å; D1414-S1418 PolarHBondContact O-N 2.99Å
1415V87.5Confident88.3Confident28 Ų2840.2 Ų40.217%0.1720%0.199CC..Hα-helixtrans-55.7-43.8171.4175.10000111.6N1385 R1389 A1413 S1418 E1419N1385-V1415 HydrophobicContact CB-CB 4.49Å; N1385-V1415 HydrophobicContact CB-CG2 4.12Å; R1389-V1415 HydrophobicContact CB-CG1 3.9Å; R1389-V1415 HydrophobicContact CG-CG1 4.11Å; R1389-V1415 VanDerWaalsContact NH2-CG1 3.27Å; A1413-V1415 PolarHBondContact O-N 3.48Å; A1413-V1415 VanDerWaalsContact O-N 3.16Å; V1415-S1418 PolarHBondContact O-N 3.32Å; V1415-S1418 PolarHBondContact O-OG 3.26Å; V1415-E1419 WeakPolarHBondContact O-CB 3.34Å; V1415-E1419 PolarHBondContact O-N 3.27Å
1416V89.6Confident88.2Confident0 Ų042.8 Ų42.80%022%0.221CC..Hα-helixtrans-64.3-45.7178.4161.20000110.9L1388 V1392 F1406 P1407 A1413 D1414 S1418 E1419 L1420L1388-V1416 HydrophobicContact CB-CG2 3.56Å; L1388-V1416 HydrophobicContact CD1-CG2 4.47Å; V1392-V1416 HydrophobicContact CG2-CB 4.2Å; V1392-V1416 HydrophobicContact CG2-CG1 3.56Å; V1392-V1416 HydrophobicContact CG2-CG2 3.88Å; F1406-V1416 HydrophobicContact CD1-CG1 4.02Å; P1407-V1416 HydrophobicContact CB-CG1 4.22Å; P1407-V1416 HydrophobicContact CG-CG1 3.83Å; A1413-V1416 HydrophobicContact CB-CB 3.94Å; A1413-V1416 HydrophobicContact CB-CG2 3.66Å; A1413-V1416 VanDerWaalsContact O-CB 3.32Å; A1413-V1416 WeakPolarHBondContact O-CB 3.46Å; A1413-V1416 PolarHBondContact O-N 2.89Å; D1414-V1416 VanDerWaalsContact C-N 3.29Å; D1414-V1416 PolarHBondContact O-N 3.37Å; V1416-S1418 VanDerWaalsContact C-N 3.33Å; V1416-S1418 PolarHBondContact O-N 3.44Å; V1416-E1419 PolarHBondContact O-N 3.18Å; V1416-L1420 VanDerWaalsContact O-CB 3.23Å; V1416-L1420 WeakPolarHBondContact O-CB 3.37Å; V1416-L1420 PolarHBondContact O-N 3.37Å
1417K88Confident88.1Confident97 Ų9746 Ų4642%0.42224%0.238SC..Hα-helixtrans-61.4-41.9177.2-70.2-177.1178.5179.60111.8P1407 A1413 D1414 S1421P1407-K1417 HydrophobicContact CB-CG 3.96Å; P1407-K1417 HydrophobicContact CG-CG 4.4Å; A1413-K1417 PolarHBondContact O-N 2.91Å; D1414-K1417 PolarHBondContact O-N 2.63Å; K1417-S1421 WeakPolarHBondContact O-CB 3.31Å; K1417-S1421 PolarHBondContact O-N 2.91Å; K1417-S1421 PolarHBondContact O-OG 3.45Å
1418S88.3Confident88.1Confident71 Ų7145.8 Ų45.850%0.49724%0.237SC..Hα-helixtrans-64.6-44.1178.772.10000112.4D1414 V1415 V1416 S1421 R1422D1414-S1418 PolarHBondContact O-N 2.99Å; V1415-S1418 PolarHBondContact O-N 3.32Å; V1415-S1418 PolarHBondContact O-OG 3.26Å; V1416-S1418 VanDerWaalsContact C-N 3.33Å; V1416-S1418 PolarHBondContact O-N 3.44Å; S1418-S1421 WeakPolarHBondContact O-CB 3.31Å; S1418-S1421 PolarHBondContact O-N 3.4Å; S1418-R1422 PolarHBondContact O-N 2.96Å; S1418-R1422 VanDerWaalsContact O-N 3.14Å
1419E93.2Very high88.1Confident18 Ų1847.3 Ų47.38%0.08424%0.243CC..Hα-helixtrans-67.8-43.8178.7-173.866-15400111.2R1389 R1393 V1415 V1416 S1421 R1422 M1423R1389-E1419 HydrophobicContact CG-CB 4.49Å; R1389-E1419 HydrophobicContact CG-CG 4.26Å; R1393-E1419 HydrophobicContact CG-CG 4.22Å; R1393-E1419 IonicContact CZ-OE1 2.65Å; R1393-E1419 IonicContact CZ-OE2 3.04Å; R1393-E1419 VanDerWaalsContact NE-CD 3.3Å; R1393-E1419 IonicContact NE-OE1 2.92Å; R1393-E1419 PolarHBondContact NE-OE1 2.99Å; R1393-E1419 IonicContact NE-OE2 3.95Å; R1393-E1419 VanDerWaalsContact NH2-CD 3.28Å; R1393-E1419 IonicContact NH2-OE1 2.99Å; R1393-E1419 PolarHBondContact NH2-OE1 2.8Å; R1393-E1419 VanDerWaalsContact NH2-OE1 3.13Å; R1393-E1419 IonicContact NH2-OE2 3.46Å; R1393-E1419 PolarHBondContact NH2-OE2 3.04Å; V1415-E1419 WeakPolarHBondContact O-CB 3.34Å; V1415-E1419 PolarHBondContact O-N 3.27Å; V1416-E1419 PolarHBondContact O-N 3.18Å; E1419-S1421 VanDerWaalsContact C-N 3.35Å; E1419-S1421 PolarHBondContact O-N 3.13Å; E1419-R1422 WeakPolarHBondContact O-CB 3.48Å; E1419-R1422 PolarHBondContact O-N 3.27Å; E1419-R1422 IonicContact OE1-CZ 3.94Å; E1419-R1422 IonicContact OE1-NE 3.62Å; E1419-R1422 PolarHBondContact OE1-NE 2.87Å; E1419-R1422 IonicContact OE1-NH2 2.92Å; E1419-R1422 PolarHBondContact OE1-NH2 3.02Å; E1419-R1422 IonicContact OE2-NE 2.7Å; E1419-M1423 HydrophobicContact CG-CE 4.31Å; E1419-M1423 WeakPolarHBondContact O-CG 3.35Å; E1419-M1423 PolarHBondContact O-N 3.37Å; E1419-M1423 VanDerWaalsContact O-N 3.08Å
1420L91.9Very high87.9Confident0 Ų047.9 Ų47.90%025%0.25CC..Hα-helixtrans-62.4-41.4175.6-177.364.4000111.7V1392 W1396 A1403 P1407 V1416 R1422 M1423 I1424 Y1440V1392-L1420 HydrophobicContact CG1-CB 4.49Å; W1396-L1420 HydrophobicContact CE3-CD1 4.09Å; W1396-L1420 HydrophobicContact CZ3-CD1 4.2Å; A1403-L1420 HydrophobicContact CB-CD1 3.99Å; A1403-L1420 WeakPolarHBondContact O-CD2 3.4Å; P1407-L1420 HydrophobicContact CG-CD2 3.56Å; V1416-L1420 VanDerWaalsContact O-CB 3.23Å; V1416-L1420 WeakPolarHBondContact O-CB 3.37Å; V1416-L1420 PolarHBondContact O-N 3.37Å; L1420-R1422 VanDerWaalsContact C-N 3.3Å; L1420-R1422 PolarHBondContact O-N 3.32Å; L1420-M1423 HydrophobicContact CD1-CE 4.14Å; L1420-M1423 PolarHBondContact O-N 3.15Å; L1420-I1424 HydrophobicContact CD1-CD1 3.87Å; L1420-I1424 HydrophobicContact CD1-CG1 4.05Å; L1420-I1424 HydrophobicContact CD2-CD1 4.25Å; L1420-I1424 HydrophobicContact CG-CD1 3.68Å; L1420-I1424 HydrophobicContact CG-CG1 4.24Å; L1420-I1424 WeakPolarHBondContact O-CB 3.03Å; L1420-I1424 WeakPolarHBondContact O-CG1 3.37Å; L1420-I1424 PolarHBondContact O-N 3.2Å; L1420-Y1440 HydrophobicContact CD2-CE1 4.03Å; L1420-Y1440 HydrophobicContact CD2-CE2 3.92Å; L1420-Y1440 HydrophobicContact CG-CE1 4.46Å
1421S90.2Very high88Confident24 Ų2447.5 Ų47.517%0.16825%0.248CC..Hα-helixtrans-56.8-45.2175-590000111.5K1417 S1418 E1419 R1425 Y1440K1417-S1421 WeakPolarHBondContact O-CB 3.31Å; K1417-S1421 PolarHBondContact O-N 2.91Å; K1417-S1421 PolarHBondContact O-OG 3.45Å; S1418-S1421 WeakPolarHBondContact O-CB 3.31Å; S1418-S1421 PolarHBondContact O-N 3.4Å; E1419-S1421 VanDerWaalsContact C-N 3.35Å; E1419-S1421 PolarHBondContact O-N 3.13Å; S1421-R1425 WeakPolarHBondContact O-CB 3.27Å; S1421-R1425 VanDerWaalsContact O-CG 3.27Å; S1421-R1425 WeakPolarHBondContact O-CG 3.34Å; S1421-R1425 PolarHBondContact O-N 3.21Å; S1421-Y1440 WeakPolarHBondContact OG-CD1 3.09Å
1422R91Very high88.4Confident134 Ų13445.9 Ų45.951%0.50624%0.242SC..Hα-helixtrans-60.6-45.6177.2-171.5-168.66771.82111.5S1418 E1419 L1420 S1426S1418-R1422 PolarHBondContact O-N 2.96Å; S1418-R1422 VanDerWaalsContact O-N 3.14Å; E1419-R1422 WeakPolarHBondContact O-CB 3.48Å; E1419-R1422 PolarHBondContact O-N 3.27Å; E1419-R1422 IonicContact OE1-CZ 3.94Å; E1419-R1422 IonicContact OE1-NE 3.62Å; E1419-R1422 PolarHBondContact OE1-NE 2.87Å; E1419-R1422 IonicContact OE1-NH2 2.92Å; E1419-R1422 PolarHBondContact OE1-NH2 3.02Å; E1419-R1422 IonicContact OE2-NE 2.7Å; L1420-R1422 VanDerWaalsContact C-N 3.3Å; L1420-R1422 PolarHBondContact O-N 3.32Å; R1422-S1426 WeakPolarHBondContact O-CB 3.36Å; R1422-S1426 PolarHBondContact O-N 3.02Å; R1422-S1426 VanDerWaalsContact O-N 3.1Å; R1422-S1426 PolarHBondContact O-OG 3.47Å
1423M93.6Very high89.1Confident8 Ų844.1 Ų44.14%0.03923%0.231CC..Hα-helixtrans-67.5-45.6-179.4-66.4-173.9-59.400112.2V1392 R1393 W1396 E1419 L1420 R1425 S1426 N1427V1392-M1423 HydrophobicContact CG1-CE 3.45Å; V1392-M1423 VanDerWaalsContact CG1-CE 3.45Å; R1393-M1423 HydrophobicContact CG-SD 4.31Å; W1396-M1423 HydrophobicContact CB-CE 3.87Å; W1396-M1423 HydrophobicContact CB-SD 3.72Å; W1396-M1423 HydrophobicContact CD2-CB 3.9Å; W1396-M1423 HydrophobicContact CD2-CE 4.28Å; W1396-M1423 HydrophobicContact CD2-SD 4.12Å; W1396-M1423 HydrophobicContact CE3-CB 4.11Å; W1396-M1423 HydrophobicContact CE3-CE 4.3Å; W1396-M1423 HydrophobicContact CG-CB 4.39Å; W1396-M1423 HydrophobicContact CG-CE 4.11Å; W1396-M1423 HydrophobicContact CG-SD 3.65Å; W1396-M1423 HydrophobicContact CH2-CB 4.41Å; W1396-M1423 HydrophobicContact CZ2-CB 4.19Å; W1396-M1423 HydrophobicContact CZ3-CB 4.36Å; E1419-M1423 HydrophobicContact CG-CE 4.31Å; E1419-M1423 WeakPolarHBondContact O-CG 3.35Å; E1419-M1423 PolarHBondContact O-N 3.37Å; E1419-M1423 VanDerWaalsContact O-N 3.08Å; L1420-M1423 HydrophobicContact CD1-CE 4.14Å; L1420-M1423 PolarHBondContact O-N 3.15Å; M1423-R1425 PolarHBondContact O-N 2.94Å; M1423-S1426 WeakPolarHBondContact CA-OG 3.36Å; M1423-S1426 PolarHBondContact O-N 3.13Å; M1423-S1426 PolarHBondContact O-OG 3.11Å; M1423-N1427 PolarHBondContact O-N 3.46Å; M1423-N1427 VanDerWaalsContact O-N 3.1Å
1424I91.9Very high89.6Confident0 Ų044.1 Ų44.10%023%0.229CC..Hα-helixtrans-62-45.7177.9-68.5173.7000110.8W1396 V1404 L1420 S1426 N1427 P1428 V1431 A1437 Y1440 V1441 W1460W1396-I1424 HydrophobicContact CH2-CG1 3.9Å; W1396-I1424 HydrophobicContact CZ3-CG1 3.65Å; V1404-I1424 HydrophobicContact CG2-CD1 4.26Å; L1420-I1424 HydrophobicContact CD1-CD1 3.87Å; L1420-I1424 HydrophobicContact CD1-CG1 4.05Å; L1420-I1424 HydrophobicContact CD2-CD1 4.25Å; L1420-I1424 HydrophobicContact CG-CD1 3.68Å; L1420-I1424 HydrophobicContact CG-CG1 4.24Å; L1420-I1424 WeakPolarHBondContact O-CB 3.03Å; L1420-I1424 WeakPolarHBondContact O-CG1 3.37Å; L1420-I1424 PolarHBondContact O-N 3.2Å; I1424-S1426 VanDerWaalsContact C-N 3.26Å; I1424-S1426 PolarHBondContact O-N 3.43Å; I1424-N1427 CarbonylContact O-C 3.58Å; I1424-N1427 PolarHBondContact O-N 2.9Å; I1424-N1427 VanDerWaalsContact O-N 3.13Å; I1424-P1428 VanDerWaalsContact O-CA 3.27Å; I1424-P1428 WeakPolarHBondContact O-CA 3.23Å; I1424-P1428 VanDerWaalsContact O-CD 3.29Å; I1424-P1428 WeakPolarHBondContact O-CD 3.1Å; I1424-P1428 VanDerWaalsContact O-CG 3.31Å; I1424-P1428 WeakPolarHBondContact O-CG 3.25Å; I1424-V1431 HydrophobicContact CB-CG2 4.49Å; I1424-V1431 HydrophobicContact CG1-CG2 4.13Å; I1424-V1431 HydrophobicContact CG2-CG2 3.81Å; I1424-A1437 HydrophobicContact CD1-CB 4.24Å; I1424-Y1440 HydrophobicContact CD1-CD2 3.39Å; I1424-Y1440 HydrophobicContact CD1-CE2 4.09Å; I1424-Y1440 HydrophobicContact CD1-CG 3.68Å; I1424-V1441 HydrophobicContact CG2-CG2 3.62Å; I1424-W1460 HydrophobicContact CG2-CH2 4.46Å
1425R88.9Confident89.9Confident88 Ų8840.5 Ų40.533%0.33221%0.213SC..Hα-helixtrans-63.6-32.7177.7-70.5178.3-166.2177.95.2112.8S1421 M1423 N1427 Y1440 T1446 E1453S1421-R1425 WeakPolarHBondContact O-CB 3.27Å; S1421-R1425 VanDerWaalsContact O-CG 3.27Å; S1421-R1425 WeakPolarHBondContact O-CG 3.34Å; S1421-R1425 PolarHBondContact O-N 3.21Å; M1423-R1425 PolarHBondContact O-N 2.94Å; R1425-N1427 VanDerWaalsContact C-N 3.34Å; R1425-Y1440 PolarHBondContact NE-O 3.21Å; R1425-Y1440 PolarHBondContact NH2-O 3.02Å; R1425-T1446 VanDerWaalsContact NH2-CG2 3.26Å; R1425-E1453 HydrophobicContact CB-CG 4.3Å; R1425-E1453 HydrophobicContact CG-CG 4.49Å
1426S89.8Confident89.8Confident86 Ų8641.5 Ų41.560%0.60122%0.224SC*.Hα-helixtrans-71.6-26.3175.270.90000113.8R1422 M1423 I1424R1422-S1426 WeakPolarHBondContact O-CB 3.36Å; R1422-S1426 PolarHBondContact O-N 3.02Å; R1422-S1426 VanDerWaalsContact O-N 3.1Å; R1422-S1426 PolarHBondContact O-OG 3.47Å; M1423-S1426 WeakPolarHBondContact CA-OG 3.36Å; M1423-S1426 PolarHBondContact O-N 3.13Å; M1423-S1426 PolarHBondContact O-OG 3.11Å; I1424-S1426 VanDerWaalsContact C-N 3.26Å; I1424-S1426 PolarHBondContact O-N 3.43Å
1427N90.9Very high89.9Confident67 Ų6741.5 Ų41.536%0.35822%0.224SC..  trans-147.872.4178-172.15.9000112.6W1396 M1423 I1424 R1425 L1429 S1430W1396-N1427 HydrophobicContact CZ2-CB 4.31Å; M1423-N1427 PolarHBondContact O-N 3.46Å; M1423-N1427 VanDerWaalsContact O-N 3.1Å; I1424-N1427 CarbonylContact O-C 3.58Å; I1424-N1427 PolarHBondContact O-N 2.9Å; I1424-N1427 VanDerWaalsContact O-N 3.13Å; R1425-N1427 VanDerWaalsContact C-N 3.34Å; N1427-L1429 VanDerWaalsContact C-N 3.31Å; N1427-L1429 PolarHBondContact O-N 2.89Å; N1427-S1430 PolarHBondContact ND2-OG 3.35Å; N1427-S1430 PolarHBondContact O-N 3.31Å
1428P89.2Confident90Very high6 Ų636.9 Ų36.94%0.03920%0.204CC..G310 helixtrans-66.6-30-174.3-22.334000113.7I1424 S1430 V1431 N1432 Y1456 W1460I1424-P1428 VanDerWaalsContact O-CA 3.27Å; I1424-P1428 WeakPolarHBondContact O-CA 3.23Å; I1424-P1428 VanDerWaalsContact O-CD 3.29Å; I1424-P1428 WeakPolarHBondContact O-CD 3.1Å; I1424-P1428 VanDerWaalsContact O-CG 3.31Å; I1424-P1428 WeakPolarHBondContact O-CG 3.25Å; P1428-S1430 PolarHBondContact O-N 3.12Å; P1428-V1431 PolarHBondContact O-N 2.96Å; P1428-V1431 VanDerWaalsContact O-N 3.12Å; P1428-N1432 PolarHBondContact O-N 3.42Å; P1428-N1432 VanDerWaalsContact O-N 3.13Å; P1428-Y1456 HydrophobicContact CB-CD2 4.03Å; P1428-Y1456 HydrophobicContact CB-CG 4.11Å; P1428-Y1456 HydrophobicContact CG-CD2 3.75Å; P1428-Y1456 HydrophobicContact CG-CE2 4.01Å; P1428-Y1456 HydrophobicContact CG-CG 4.33Å; P1428-W1460 HydrophobicContact CB-CZ3 4.16Å
1429L89.1Confident89.8Confident84 Ų8435.3 Ų35.344%0.4419%0.193SC..G310 helixtrans-67-16.6-178.9-65177.2000113.4N1427 V1431 N1432 Y1456N1427-L1429 VanDerWaalsContact C-N 3.31Å; N1427-L1429 PolarHBondContact O-N 2.89Å; L1429-V1431 VanDerWaalsContact C-N 3.27Å; L1429-N1432 PolarHBondContact O-OD1 2.76Å; L1429-Y1456 HydrophobicContact CD1-CE1 4.22Å; L1429-Y1456 HydrophobicContact CD2-CD1 3.76Å; L1429-Y1456 HydrophobicContact CD2-CE1 4.03Å; L1429-Y1456 HydrophobicContact CG-CD1 4.12Å; L1429-Y1456 HydrophobicContact CG-CE1 3.98Å
1430S88Confident89.5Confident28 Ų2835.8 Ų35.820%0.19619%0.194CC..G310 helixtrans-74-16.5174-80.10000113.5N1427 P1428 H1433N1427-S1430 PolarHBondContact ND2-OG 3.35Å; N1427-S1430 PolarHBondContact O-N 3.31Å; P1428-S1430 PolarHBondContact O-N 3.12Å; S1430-H1433 PolarHBondContact O-CE1 3.25Å
1431V90.8Very high89.2Confident0 Ų035.9 Ų35.90%020%0.195CC..THydrogen-bonded Turntrans-1377.4-172.8-61.20000114.1W1396 P1400 V1404 I1424 P1428 L1429 H1433 I1434 A1437 W1460W1396-V1431 HydrophobicContact CH2-CG1 3.95Å; W1396-V1431 HydrophobicContact CZ3-CG1 3.91Å; P1400-V1431 HydrophobicContact CB-CG1 3.69Å; V1404-V1431 HydrophobicContact CG2-CB 4.09Å; V1404-V1431 HydrophobicContact CG2-CG1 3.66Å; I1424-V1431 HydrophobicContact CB-CG2 4.49Å; I1424-V1431 HydrophobicContact CG1-CG2 4.13Å; I1424-V1431 HydrophobicContact CG2-CG2 3.81Å; P1428-V1431 PolarHBondContact O-N 2.96Å; P1428-V1431 VanDerWaalsContact O-N 3.12Å; L1429-V1431 VanDerWaalsContact C-N 3.27Å; V1431-H1433 PolarHBondContact O-N 3.43Å; V1431-I1434 HydrophobicContact CB-CD1 4.37Å; V1431-I1434 HydrophobicContact CG1-CD1 4.45Å; V1431-I1434 WeakPolarHBondContact O-CB 3.4Å; V1431-I1434 PolarHBondContact O-N 2.82Å; V1431-A1437 HydrophobicContact CB-CB 4.05Å; V1431-A1437 HydrophobicContact CG2-CB 3.9Å; V1431-W1460 HydrophobicContact CG2-CH2 4.03Å; V1431-W1460 HydrophobicContact CG2-CZ2 4.18Å
1432N89.9Confident88.8Confident11 Ų1134.9 Ų34.96%0.05919%0.188CC..THydrogen-bonded Turntrans-64.7-19.9-177.671.8-33.9000113.5P1428 L1429 I1434 W1460 A1461P1428-N1432 PolarHBondContact O-N 3.42Å; P1428-N1432 VanDerWaalsContact O-N 3.13Å; L1429-N1432 PolarHBondContact O-OD1 2.76Å; N1432-I1434 PolarHBondContact O-N 2.89Å; N1432-W1460 HydrophobicContact CB-CD2 4.1Å; N1432-W1460 HydrophobicContact CB-CE3 3.9Å; N1432-W1460 HydrophobicContact CB-CZ3 4.14Å; N1432-A1461 PolarHBondContact O-N 2.89Å
1433H87.3Confident88Confident47 Ų4730.1 Ų30.122%0.21818%0.175CC..THydrogen-bonded Turntrans-75-9.3172.264.4-71.1000113.4D1401 S1430 V1431 P1435 A1461D1401-H1433 IonicContact OD1-CE1 3.84Å; D1401-H1433 IonicContact OD1-NE2 2.68Å; D1401-H1433 IonicContact OD2-CE1 3.82Å; D1401-H1433 IonicContact OD2-NE2 2.74Å; D1401-H1433 PolarHBondContact OD2-NE2 3.05Å; S1430-H1433 PolarHBondContact O-CE1 3.25Å; V1431-H1433 PolarHBondContact O-N 3.43Å; H1433-P1435 WeakPolarHBondContact O-CD 3.39Å; H1433-A1461 WeakPolarHBondContact O-CB 3.41Å
1434I89.5Confident86.7Confident6 Ų632.2 Ų32.23%0.03119%0.188CC..  trans-104.9106.5-177.6-51.1176000109D1401 V1404 Y1405 V1431 N1432 A1436 A1437 W1460D1401-I1434 HydrophobicContact CB-CD1 3.92Å; V1404-I1434 HydrophobicContact CB-CD1 4.35Å; V1404-I1434 HydrophobicContact CG1-CG2 3.89Å; V1404-I1434 HydrophobicContact CG2-CD1 4.14Å; Y1405-I1434 HydrophobicContact CE2-CG2 4.23Å; Y1405-I1434 WeakPolarHBondContact OH-CG2 3.48Å; V1431-I1434 HydrophobicContact CB-CD1 4.37Å; V1431-I1434 HydrophobicContact CG1-CD1 4.45Å; V1431-I1434 WeakPolarHBondContact O-CB 3.4Å; V1431-I1434 PolarHBondContact O-N 2.82Å; N1432-I1434 PolarHBondContact O-N 2.89Å; I1434-A1436 HydrophobicContact CG2-CB 4.23Å; I1434-A1436 PolarHBondContact O-N 3.27Å; I1434-A1436 VanDerWaalsContact O-N 3.15Å; I1434-A1437 HydrophobicContact CB-CB 4.35Å; I1434-A1437 PolarHBondContact O-N 2.76Å; I1434-W1460 PolarHBondContact O-NE1 2.93Å
1435P88.6Confident85.4Confident47 Ų4736.1 Ų36.131%0.30522%0.216SC..G310 helixtrans-54.9-37.9-178.1-26.534.2000113.2H1433 A1437 L1438 A1461 P1462 V1463H1433-P1435 WeakPolarHBondContact O-CD 3.39Å; P1435-A1437 PolarHBondContact O-N 3.39Å; P1435-A1437 VanDerWaalsContact O-N 3.16Å; P1435-L1438 WeakPolarHBondContact O-CB 3.22Å; P1435-L1438 PolarHBondContact O-N 2.94Å; P1435-L1438 VanDerWaalsContact O-N 3.17Å; P1435-A1461 HydrophobicContact CG-CB 3.85Å; P1435-P1462 WeakPolarHBondContact CB-O 3.45Å; P1435-P1462 WeakPolarHBondContact CG-O 3.48Å; P1435-V1463 HydrophobicContact CB-CG1 3.86Å
1436A86.1Confident84.6Confident49 Ų4932.2 Ų32.241%0.40520%0.202SC..G310 helixtrans-63.2-20.1-179.400000114.3Y1405 I1434 S1439Y1405-A1436 HydrophobicContact CE1-CB 4Å; I1434-A1436 HydrophobicContact CG2-CB 4.23Å; I1434-A1436 PolarHBondContact O-N 3.27Å; I1434-A1436 VanDerWaalsContact O-N 3.15Å; A1436-S1439 PolarHBondContact O-OG 3.49Å
1437A90.9Very high83.7Confident0 Ų028.4 Ų28.40%017%0.174CC..G310 helixtrans-83.4-11.9179.500000113.5V1404 I1424 V1431 I1434 P1435 S1439 Y1440 W1460V1404-A1437 HydrophobicContact CG1-CB 3.86Å; V1404-A1437 HydrophobicContact CG2-CB 3.95Å; I1424-A1437 HydrophobicContact CD1-CB 4.24Å; V1431-A1437 HydrophobicContact CB-CB 4.05Å; V1431-A1437 HydrophobicContact CG2-CB 3.9Å; I1434-A1437 HydrophobicContact CB-CB 4.35Å; I1434-A1437 PolarHBondContact O-N 2.76Å; P1435-A1437 PolarHBondContact O-N 3.39Å; P1435-A1437 VanDerWaalsContact O-N 3.16Å; A1437-S1439 PolarHBondContact O-N 3.43Å; A1437-Y1440 WeakPolarHBondContact O-CD2 3.34Å; A1437-Y1440 PolarHBondContact O-N 3.18Å; A1437-W1460 VanDerWaalsContact C-CZ2 3.49Å; A1437-W1460 HydrophobicContact CB-CZ2 3.66Å
1438L90Very high82.6Confident0 Ų030.2 Ų30.20%018%0.181CC..Hα-helixtrans-60-35.8-17818061.2000112.2P1435 Y1440 V1441 A1442 V1457 W1460 V1463 M1467 F1471 Y1485P1435-L1438 WeakPolarHBondContact O-CB 3.22Å; P1435-L1438 PolarHBondContact O-N 2.94Å; P1435-L1438 VanDerWaalsContact O-N 3.17Å; L1438-Y1440 PolarHBondContact O-N 3.41Å; L1438-Y1440 VanDerWaalsContact O-N 3.1Å; L1438-V1441 PolarHBondContact O-N 3.49Å; L1438-A1442 HydrophobicContact CD1-CB 3.9Å; L1438-A1442 HydrophobicContact CG-CB 4.32Å; L1438-A1442 PolarHBondContact O-N 3.12Å; L1438-V1457 HydrophobicContact CD1-CG1 4.09Å; L1438-V1457 HydrophobicContact CD1-CG2 4.15Å; L1438-W1460 HydrophobicContact CB-CD2 4.3Å; L1438-W1460 HydrophobicContact CB-CG 4.3Å; L1438-W1460 HydrophobicContact CD1-CB 4.36Å; L1438-W1460 HydrophobicContact CD1-CD2 3.86Å; L1438-W1460 HydrophobicContact CD1-CE3 4.16Å; L1438-W1460 HydrophobicContact CD1-CG 3.95Å; L1438-V1463 HydrophobicContact CD2-CG1 3.94Å; L1438-M1467 HydrophobicContact CB-CE 4.14Å; L1438-M1467 HydrophobicContact CD2-CE 4.07Å; L1438-M1467 HydrophobicContact CG-CE 4.23Å; L1438-F1471 HydrophobicContact CD2-CE2 4.2Å; L1438-F1471 HydrophobicContact CD2-CZ 4.03Å; L1438-Y1485 HydrophobicContact CD2-CD1 4.31Å; L1438-Y1485 HydrophobicContact CD2-CE1 3.42Å; L1438-Y1485 VanDerWaalsContact CD2-CE1 3.42Å; L1438-Y1485 WeakPolarHBondContact CD2-OH 3.06Å
1439S85.7Confident81.7Confident39 Ų3933.4 Ų33.427%0.27320%0.204SC..Hα-helixtrans-61.4-20.4-17859.20000113.8A1436 A1437 S1443A1436-S1439 PolarHBondContact O-OG 3.49Å; A1437-S1439 PolarHBondContact O-N 3.43Å; S1439-S1443 WeakPolarHBondContact O-CB 3.32Å; S1439-S1443 PolarHBondContact O-N 3.28Å
1440Y86.2Confident80.6Confident28 Ų2834.7 Ų34.711%0.1121%0.214CC..Hα-helixtrans-81-24.5176.3-61.6-74.6000113.6P1407 L1420 S1421 I1424 R1425 A1437 L1438P1407-Y1440 WeakPolarHBondContact CG-OH 3.15Å; L1420-Y1440 HydrophobicContact CD2-CE1 4.03Å; L1420-Y1440 HydrophobicContact CD2-CE2 3.92Å; L1420-Y1440 HydrophobicContact CG-CE1 4.46Å; S1421-Y1440 WeakPolarHBondContact OG-CD1 3.09Å; I1424-Y1440 HydrophobicContact CD1-CD2 3.39Å; I1424-Y1440 HydrophobicContact CD1-CE2 4.09Å; I1424-Y1440 HydrophobicContact CD1-CG 3.68Å; R1425-Y1440 PolarHBondContact NE-O 3.21Å; R1425-Y1440 PolarHBondContact NH2-O 3.02Å; A1437-Y1440 WeakPolarHBondContact O-CD2 3.34Å; A1437-Y1440 PolarHBondContact O-N 3.18Å; L1438-Y1440 PolarHBondContact O-N 3.41Å; L1438-Y1440 VanDerWaalsContact O-N 3.1Å
1441V85.1Confident79.8Confident1 Ų134.7 Ų34.71%0.00621%0.213CC..Hα-helixtrans-97.2-44.7178.3-177.80000110.7I1424 L1438 E1453 V1457 W1460I1424-V1441 HydrophobicContact CG2-CG2 3.62Å; L1438-V1441 PolarHBondContact O-N 3.49Å; V1441-E1453 HydrophobicContact CG1-CB 3.96Å; V1441-V1457 HydrophobicContact CG1-CG2 4.22Å; V1441-W1460 HydrophobicContact CB-CZ3 4.48Å; V1441-W1460 HydrophobicContact CG2-CH2 3.79Å; V1441-W1460 HydrophobicContact CG2-CZ3 3.95Å
1442A81.8Confident79.2Confident3 Ų339.1 Ų39.13%0.02524%0.244CC..SBendtrans-127.866.9-174.200000111.6L1438 V1447 M1454 V1457 F1471L1438-A1442 HydrophobicContact CD1-CB 3.9Å; L1438-A1442 HydrophobicContact CG-CB 4.32Å; L1438-A1442 PolarHBondContact O-N 3.12Å; A1442-V1447 HydrophobicContact CB-CG2 4.32Å; A1442-M1454 HydrophobicContact CB-SD 4.06Å; A1442-V1457 HydrophobicContact CB-CG2 3.9Å; A1442-F1471 HydrophobicContact CB-CE1 4.18Å; A1442-F1471 HydrophobicContact CB-CZ 4.32Å
1443S74Confident78.7Confident34 Ų3440.5 Ų40.524%0.23825%0.251CS..  trans-80159.2160.380.70000111.2S1439 S1445 T1446 V1447S1439-S1443 WeakPolarHBondContact O-CB 3.32Å; S1439-S1443 PolarHBondContact O-N 3.28Å; S1443-S1445 PolarHBondContact O-N 3.48Å; S1443-S1445 PolarHBondContact OG-N 3.27Å; S1443-S1445 PolarHBondContact OG-OG 2.67Å; S1443-T1446 WeakPolarHBondContact CA-OG1 3.3Å; S1443-T1446 WeakPolarHBondContact CB-OG1 3.49Å; S1443-T1446 PolarHBondContact N-OG1 2.94Å; S1443-T1446 PolarHBondContact O-N 3.39Å; S1443-T1446 PolarHBondContact O-OG1 3.16Å; S1443-T1446 PolarHBondContact OG-N 2.92Å; S1443-T1446 PolarHBondContact OG-OG1 3.05Å; S1443-V1447 WeakPolarHBondContact O-CG2 3.29Å; S1443-V1447 PolarHBondContact O-N 3.01Å
1444V66.1Low78.5Confident53 Ų5338.5 Ų38.532%0.32124%0.241SC..Hα-helixtrans-46.3-48.2174.3-179.70000111.3T1446 V1447 E1448 A1476V1444-T1446 PolarHBondContact O-N 2.75Å; V1444-V1447 PolarHBondContact O-N 3.41Å; V1444-E1448 WeakPolarHBondContact O-CG 3.38Å; V1444-E1448 PolarHBondContact O-N 2.81Å; V1444-A1476 HydrophobicContact CG1-CB 4.29Å
1445S65.6Low78.4Confident82 Ų8245 Ų4557%0.57327%0.269SS*.Hα-helixtrans-67.5-27.4179.265.50000115.5S1443S1443-S1445 PolarHBondContact O-N 3.48Å; S1443-S1445 PolarHBondContact OG-N 3.27Å; S1443-S1445 PolarHBondContact OG-OG 2.67Å
1446T71.5Confident78.4Confident6 Ų645.8 Ų45.84%0.03727%0.267CS..Hα-helixtrans-86.4-28.6178.520.80000113R1425 S1443 V1444 E1448 S1449 T1451R1425-T1446 VanDerWaalsContact NH2-CG2 3.26Å; S1443-T1446 WeakPolarHBondContact CA-OG1 3.3Å; S1443-T1446 WeakPolarHBondContact CB-OG1 3.49Å; S1443-T1446 PolarHBondContact N-OG1 2.94Å; S1443-T1446 PolarHBondContact O-N 3.39Å; S1443-T1446 PolarHBondContact O-OG1 3.16Å; S1443-T1446 PolarHBondContact OG-N 2.92Å; S1443-T1446 PolarHBondContact OG-OG1 3.05Å; V1444-T1446 PolarHBondContact O-N 2.75Å; T1446-E1448 PolarHBondContact O-N 3.23Å; T1446-S1449 PolarHBondContact O-N 3.39Å; T1446-S1449 PolarHBondContact O-OG 3.38Å; T1446-S1449 VanDerWaalsContact O-OG 3.12Å; T1446-T1451 HydrophobicContact CG2-CG2 4.47Å
1447V70.5Confident78.5Confident5 Ų543.5 Ų43.53%0.0325%0.247CC..Hα-helixtrans-64.5-35.8174.7175.60000109.5A1442 S1443 V1444 S1449 M1454 F1471 A1476 H1479 A1482A1442-V1447 HydrophobicContact CB-CG2 4.32Å; S1443-V1447 WeakPolarHBondContact O-CG2 3.29Å; S1443-V1447 PolarHBondContact O-N 3.01Å; V1444-V1447 PolarHBondContact O-N 3.41Å; V1447-S1449 VanDerWaalsContact C-N 3.33Å; V1447-S1449 PolarHBondContact O-N 3.35Å; V1447-M1454 HydrophobicContact CB-CE 4.3Å; V1447-M1454 HydrophobicContact CG1-CE 4.1Å; V1447-M1454 HydrophobicContact CG2-CE 3.76Å; V1447-M1454 HydrophobicContact CG2-SD 4.32Å; V1447-F1471 HydrophobicContact CG2-CD1 4.49Å; V1447-F1471 HydrophobicContact CG2-CE1 4.28Å; V1447-A1476 HydrophobicContact CB-CB 4.33Å; V1447-A1476 HydrophobicContact CG1-CB 4.11Å; V1447-H1479 HydrophobicContact CG1-CB 3.34Å; V1447-A1482 HydrophobicContact CG1-CB 4.24Å
1448E68.1Low78.4Confident105 Ų10546 Ų4649%0.49126%0.264SS..THydrogen-bonded Turntrans-64.3-30.9175.1-68.9170-174.700113.7V1444 T1446 V1450 P1475V1444-E1448 WeakPolarHBondContact O-CG 3.38Å; V1444-E1448 PolarHBondContact O-N 2.81Å; T1446-E1448 PolarHBondContact O-N 3.23Å; E1448-V1450 PolarHBondContact O-N 2.83Å; E1448-P1475 HydrophobicContact CG-CG 4.47Å; E1448-P1475 WeakPolarHBondContact OE1-CD 3.33Å
1449S70.3Confident78.3Confident74 Ų7448.3 Ų48.352%0.51728%0.28SS..THydrogen-bonded Turntrans-88.43.8-175.660.20000115.2T1446 V1447 T1451T1446-S1449 PolarHBondContact O-N 3.39Å; T1446-S1449 PolarHBondContact O-OG 3.38Å; T1446-S1449 VanDerWaalsContact O-OG 3.12Å; V1447-S1449 VanDerWaalsContact C-N 3.33Å; V1447-S1449 PolarHBondContact O-N 3.35Å; S1449-T1451 PolarHBondContact O-N 2.68Å; S1449-T1451 VanDerWaalsContact OG-CG2 3.29Å; S1449-T1451 WeakPolarHBondContact OG-CG2 3.39Å
1450V67.1Low78.5Confident110 Ų11046.6 Ų46.667%0.66727%0.268SS*.THydrogen-bonded Turntrans48.356.9176.7-1650000112.3E1448E1448-V1450 PolarHBondContact O-N 2.83Å
1451T71.5Confident78.8Confident29 Ų2945.9 Ų45.918%0.17827%0.268CS..  trans-75.7148.9-176.863.80000112.7T1446 S1449 E1453 M1454T1446-T1451 HydrophobicContact CG2-CG2 4.47Å; S1449-T1451 PolarHBondContact O-N 2.68Å; S1449-T1451 VanDerWaalsContact OG-CG2 3.29Å; S1449-T1451 WeakPolarHBondContact OG-CG2 3.39Å; T1451-E1453 VanDerWaalsContact CB-OE2 3.29Å; T1451-E1453 WeakPolarHBondContact CB-OE2 3.5Å; T1451-E1453 PolarHBondContact O-N 2.81Å; T1451-E1453 VanDerWaalsContact O-N 3.13Å; T1451-M1454 WeakPolarHBondContact O-CB 3.34Å; T1451-M1454 WeakPolarHBondContact O-CG 3.35Å; T1451-M1454 PolarHBondContact O-N 2.86Å
1452S77.9Confident79Confident93 Ų9349.2 Ų49.265%0.6529%0.289SS*.G310 helixtrans-61.2-20.8179.769.10000114M1454 K1455S1452-M1454 VanDerWaalsContact C-N 3.3Å; S1452-M1454 PolarHBondContact O-N 3.46Å; S1452-K1455 WeakPolarHBondContact O-CG 3.34Å
1453E79.1Confident79.4Confident40 Ų4049.3 Ų49.319%0.18729%0.289CS..G310 helixtrans-75.6-18.2-176.5-60.790.9131.100112.2R1425 V1441 T1451 K1455 Y1456R1425-E1453 HydrophobicContact CB-CG 4.3Å; R1425-E1453 HydrophobicContact CG-CG 4.49Å; V1441-E1453 HydrophobicContact CG1-CB 3.96Å; T1451-E1453 VanDerWaalsContact CB-OE2 3.29Å; T1451-E1453 WeakPolarHBondContact CB-OE2 3.5Å; T1451-E1453 PolarHBondContact O-N 2.81Å; T1451-E1453 VanDerWaalsContact O-N 3.13Å; E1453-K1455 PolarHBondContact O-N 3.1Å; E1453-Y1456 WeakPolarHBondContact O-CD2 3.34Å; E1453-Y1456 PolarHBondContact O-N 3.28Å; E1453-Y1456 VanDerWaalsContact O-N 3.13Å
1454M83.7Confident80Confident5 Ų548.5 Ų48.53%0.02528%0.284CS..G310 helixtrans-59.2-23179.5-71.6-66.1-80.900113.3A1442 V1447 T1451 S1452 Y1456 V1457 A1482A1442-M1454 HydrophobicContact CB-SD 4.06Å; V1447-M1454 HydrophobicContact CB-CE 4.3Å; V1447-M1454 HydrophobicContact CG1-CE 4.1Å; V1447-M1454 HydrophobicContact CG2-CE 3.76Å; V1447-M1454 HydrophobicContact CG2-SD 4.32Å; T1451-M1454 WeakPolarHBondContact O-CB 3.34Å; T1451-M1454 WeakPolarHBondContact O-CG 3.35Å; T1451-M1454 PolarHBondContact O-N 2.86Å; S1452-M1454 VanDerWaalsContact C-N 3.3Å; S1452-M1454 PolarHBondContact O-N 3.46Å; M1454-Y1456 PolarHBondContact O-N 2.94Å; M1454-Y1456 VanDerWaalsContact O-N 3.14Å; M1454-V1457 WeakPolarHBondContact O-CB 3.27Å; M1454-V1457 PolarHBondContact O-N 3.21Å; M1454-V1457 VanDerWaalsContact O-N 3.14Å; M1454-V1457 HydrophobicContact SD-CG2 3.99Å; M1454-A1482 HydrophobicContact CE-CB 4.1Å
1455K86.2Confident81.2Confident143 Ų14346 Ų4662%0.62227%0.268SS*.G310 helixtrans-60.1-21.7176.571.1-172.8177.1-177.60114.3S1452 E1453S1452-K1455 WeakPolarHBondContact O-CG 3.34Å; E1453-K1455 PolarHBondContact O-N 3.1Å
1456Y88.6Confident82.3Confident63 Ų6342 Ų4225%0.24724%0.241CC..G310 helixtrans-85.6-21.8179.2-60.7-72.8000113.1P1428 L1429 E1453 M1454 P1458 S1459P1428-Y1456 HydrophobicContact CB-CD2 4.03Å; P1428-Y1456 HydrophobicContact CB-CG 4.11Å; P1428-Y1456 HydrophobicContact CG-CD2 3.75Å; P1428-Y1456 HydrophobicContact CG-CE2 4.01Å; P1428-Y1456 HydrophobicContact CG-CG 4.33Å; L1429-Y1456 HydrophobicContact CD1-CE1 4.22Å; L1429-Y1456 HydrophobicContact CD2-CD1 3.76Å; L1429-Y1456 HydrophobicContact CD2-CE1 4.03Å; L1429-Y1456 HydrophobicContact CG-CD1 4.12Å; L1429-Y1456 HydrophobicContact CG-CE1 3.98Å; E1453-Y1456 WeakPolarHBondContact O-CD2 3.34Å; E1453-Y1456 PolarHBondContact O-N 3.28Å; E1453-Y1456 VanDerWaalsContact O-N 3.13Å; M1454-Y1456 PolarHBondContact O-N 2.94Å; M1454-Y1456 VanDerWaalsContact O-N 3.14Å; Y1456-P1458 VanDerWaalsContact C-CD 3.5Å; Y1456-S1459 PolarHBondContact O-N 3.47Å; Y1456-S1459 PolarHBondContact O-OG 3.13Å
1457V88.9Confident83.1Confident0 Ų042.7 Ų42.70%024%0.244CC..G310 helixtrans-55.8-42.1-174.9175.30000113.2L1438 V1441 A1442 M1454 S1459 W1460 V1481 Y1485L1438-V1457 HydrophobicContact CD1-CG1 4.09Å; L1438-V1457 HydrophobicContact CD1-CG2 4.15Å; V1441-V1457 HydrophobicContact CG1-CG2 4.22Å; A1442-V1457 HydrophobicContact CB-CG2 3.9Å; M1454-V1457 WeakPolarHBondContact O-CB 3.27Å; M1454-V1457 PolarHBondContact O-N 3.21Å; M1454-V1457 VanDerWaalsContact O-N 3.14Å; M1454-V1457 HydrophobicContact SD-CG2 3.99Å; V1457-S1459 PolarHBondContact O-N 3.13Å; V1457-W1460 VanDerWaalsContact O-CB 3.31Å; V1457-W1460 WeakPolarHBondContact O-CB 3.37Å; V1457-W1460 PolarHBondContact O-N 3.2Å; V1457-V1481 HydrophobicContact CB-CG1 4.48Å; V1457-Y1485 HydrophobicContact CG1-CD1 4.12Å; V1457-Y1485 HydrophobicContact CG1-CD2 4.1Å; V1457-Y1485 HydrophobicContact CG1-CG 3.75Å; V1457-Y1485 WeakPolarHBondContact O-CD2 3.44Å; V1457-Y1485 WeakPolarHBondContact O-CE2 3.32Å
1458P88Confident84Confident52 Ų5242.4 Ų42.434%0.33824%0.242SC..G310 helixtrans-62.2-16.9178.6-2738.1000115.4Y1456 V1481 R1488Y1456-P1458 VanDerWaalsContact C-CD 3.5Å; P1458-V1481 HydrophobicContact CG-CG1 3.34Å; P1458-R1488 PolarHBondContact O-NH1 3.33Å
1459S87.6Confident85.1Confident50 Ų5037.4 Ų37.435%0.3522%0.219SC..G310 helixtrans-97.1-2.3178.672.90000113.7Y1456 V1457Y1456-S1459 PolarHBondContact O-N 3.47Å; Y1456-S1459 PolarHBondContact O-OG 3.13Å; V1457-S1459 PolarHBondContact O-N 3.13Å
1460W91.9Very high85.9Confident2 Ų234.2 Ų34.21%0.00820%0.196CC..SBendtrans-68.3153.3-175.8-143.9-82.8000112.1I1424 P1428 V1431 N1432 I1434 A1437 L1438 V1441 V1457 Y1485 R1488I1424-W1460 HydrophobicContact CG2-CH2 4.46Å; P1428-W1460 HydrophobicContact CB-CZ3 4.16Å; V1431-W1460 HydrophobicContact CG2-CH2 4.03Å; V1431-W1460 HydrophobicContact CG2-CZ2 4.18Å; N1432-W1460 HydrophobicContact CB-CD2 4.1Å; N1432-W1460 HydrophobicContact CB-CE3 3.9Å; N1432-W1460 HydrophobicContact CB-CZ3 4.14Å; I1434-W1460 PolarHBondContact O-NE1 2.93Å; A1437-W1460 VanDerWaalsContact C-CZ2 3.49Å; A1437-W1460 HydrophobicContact CB-CZ2 3.66Å; L1438-W1460 HydrophobicContact CB-CD2 4.3Å; L1438-W1460 HydrophobicContact CB-CG 4.3Å; L1438-W1460 HydrophobicContact CD1-CB 4.36Å; L1438-W1460 HydrophobicContact CD1-CD2 3.86Å; L1438-W1460 HydrophobicContact CD1-CE3 4.16Å; L1438-W1460 HydrophobicContact CD1-CG 3.95Å; V1441-W1460 HydrophobicContact CB-CZ3 4.48Å; V1441-W1460 HydrophobicContact CG2-CH2 3.79Å; V1441-W1460 HydrophobicContact CG2-CZ3 3.95Å; V1457-W1460 VanDerWaalsContact O-CB 3.31Å; V1457-W1460 WeakPolarHBondContact O-CB 3.37Å; V1457-W1460 PolarHBondContact O-N 3.2Å; W1460-Y1485 HydrophobicContact CB-CE2 3.76Å; W1460-R1488 PolarHBondContact O-NH1 3.1Å; W1460-R1488 PolarHBondContact O-NH2 3.36Å
1461A90.4Very high86.9Confident14 Ų1429.2 Ų29.212%0.11617%0.166CC..PPolyproline II helixtrans-61.5142.917200000111.3N1432 H1433 P1435 Y1485N1432-A1461 PolarHBondContact O-N 2.89Å; H1433-A1461 WeakPolarHBondContact O-CB 3.41Å; P1435-A1461 HydrophobicContact CG-CB 3.85Å; A1461-Y1485 PolarHBondContact O-OH 3.26Å
1462P89.8Confident87.6Confident70 Ų7027.9 Ų27.946%0.45516%0.157SC..PPolyproline II helixtrans-56141.2-179.4-23.833.3000113.5P1435 V1489P1435-P1462 WeakPolarHBondContact CB-O 3.45Å; P1435-P1462 WeakPolarHBondContact CG-O 3.48Å; P1462-V1489 HydrophobicContact CB-CG1 4.41Å; P1462-V1489 HydrophobicContact CB-CG2 4.29Å
1463V89.8Confident87.6Confident5 Ų524.4 Ų24.43%0.0313%0.133CC..  trans-106.7173.6176.6-67.50000110.9P1435 L1438 M1467 A1468 Y1485 V1489 Y1493P1435-V1463 HydrophobicContact CB-CG1 3.86Å; L1438-V1463 HydrophobicContact CD2-CG1 3.94Å; V1463-M1467 HydrophobicContact CB-CB 3.96Å; V1463-M1467 HydrophobicContact CB-CG 4.12Å; V1463-M1467 HydrophobicContact CB-SD 3.7Å; V1463-M1467 HydrophobicContact CG1-CE 4.44Å; V1463-M1467 HydrophobicContact CG1-SD 3.57Å; V1463-M1467 VanDerWaalsContact CG1-SD 3.57Å; V1463-M1467 HydrophobicContact CG2-CB 3.8Å; V1463-M1467 HydrophobicContact CG2-CG 3.93Å; V1463-M1467 HydrophobicContact CG2-SD 4.08Å; V1463-A1468 HydrophobicContact CG2-CB 4.4Å; V1463-Y1485 WeakPolarHBondContact CG1-OH 3.2Å; V1463-Y1485 HydrophobicContact CG2-CE1 3.92Å; V1463-V1489 HydrophobicContact CG2-CG1 4.15Å; V1463-V1489 HydrophobicContact CG2-CG2 4.37Å; V1463-V1489 WeakPolarHBondContact O-CG1 3.36Å; V1463-Y1493 PolarHBondContact O-OH 2.58Å
1464S88.6Confident87.1Confident17 Ų1730 Ų3012%0.11915%0.153CC..  trans-58.8153.2177.469.40000112.4D1060 A1466 M1467 A1468D1060-S1464 WeakPolarHBondContact OD2-CB 3.46Å; S1464-A1466 PolarHBondContact O-N 2.89Å; S1464-M1467 PolarHBondContact O-N 2.93Å; S1464-M1467 PolarHBondContact OG-N 3.3Å; S1464-A1468 PolarHBondContact O-N 3.15Å
1465P90.6Very high85.8Confident0 Ų033.1 Ų33.10%017%0.173CC..Hα-helixtrans-55.3-38174.2-25.134000112.4A1063 M1467 A1468 L1469 L1490 Y1493 V1497 Y1501A1063-P1465 HydrophobicContact CB-CG 3.94Å; P1465-M1467 PolarHBondContact O-N 2.9Å; P1465-A1468 PolarHBondContact O-N 3.46Å; P1465-L1469 WeakPolarHBondContact O-CB 3.26Å; P1465-L1469 VanDerWaalsContact O-CG 3.26Å; P1465-L1469 WeakPolarHBondContact O-CG 3.39Å; P1465-L1469 PolarHBondContact O-N 3.19Å; P1465-L1490 HydrophobicContact CB-CD2 4.17Å; P1465-Y1493 HydrophobicContact CG-CD1 4.38Å; P1465-Y1493 HydrophobicContact CG-CD2 3.92Å; P1465-Y1493 HydrophobicContact CG-CE1 4.3Å; P1465-Y1493 HydrophobicContact CG-CE2 3.81Å; P1465-Y1493 HydrophobicContact CG-CG 4.2Å; P1465-V1497 HydrophobicContact CG-CG1 4.46Å; P1465-Y1501 HydrophobicContact CB-CD1 4.48Å; P1465-Y1501 HydrophobicContact CB-CD2 4.02Å; P1465-Y1501 HydrophobicContact CB-CE1 4.27Å; P1465-Y1501 HydrophobicContact CB-CE2 3.79Å; P1465-Y1501 HydrophobicContact CB-CG 4.35Å; P1465-Y1501 HydrophobicContact CG-CE2 3.99Å
1466A89.2Confident84.5Confident0 Ų026.4 Ų26.40%015%0.145CC..Hα-helixtrans-60.2-44.3175.600000112.3S1464 S1470 Y1501 W1821 L1822S1464-A1466 PolarHBondContact O-N 2.89Å; A1466-S1470 PolarHBondContact O-N 3.39Å; A1466-S1470 VanDerWaalsContact O-N 3.07Å; A1466-Y1501 HydrophobicContact CB-CE1 4.44Å; A1466-W1821 HydrophobicContact CB-CE3 4.46Å; A1466-L1822 HydrophobicContact CB-CD1 4.2Å; A1466-L1822 HydrophobicContact CB-CD2 3.88Å; A1466-L1822 HydrophobicContact CB-CG 3.87Å
1467M87.7Confident83.1Confident19 Ų1923.9 Ų23.99%0.09414%0.136CC..Hα-helixtrans-68.7-41.6176.8-167.6171.1-179.100111.9L1438 V1463 S1464 P1465 L1469 S1470 W1821L1438-M1467 HydrophobicContact CB-CE 4.14Å; L1438-M1467 HydrophobicContact CD2-CE 4.07Å; L1438-M1467 HydrophobicContact CG-CE 4.23Å; V1463-M1467 HydrophobicContact CB-CB 3.96Å; V1463-M1467 HydrophobicContact CB-CG 4.12Å; V1463-M1467 HydrophobicContact CB-SD 3.7Å; V1463-M1467 HydrophobicContact CG1-CE 4.44Å; V1463-M1467 HydrophobicContact CG1-SD 3.57Å; V1463-M1467 VanDerWaalsContact CG1-SD 3.57Å; V1463-M1467 HydrophobicContact CG2-CB 3.8Å; V1463-M1467 HydrophobicContact CG2-CG 3.93Å; V1463-M1467 HydrophobicContact CG2-SD 4.08Å; S1464-M1467 PolarHBondContact O-N 2.93Å; S1464-M1467 PolarHBondContact OG-N 3.3Å; P1465-M1467 PolarHBondContact O-N 2.9Å; M1467-L1469 VanDerWaalsContact C-N 3.34Å; M1467-L1469 PolarHBondContact O-N 3.32Å; M1467-S1470 WeakPolarHBondContact O-CB 3.35Å; M1467-S1470 PolarHBondContact O-N 3.36Å; M1467-S1470 VanDerWaalsContact O-N 3.15Å; M1467-S1470 PolarHBondContact O-OG 2.61Å; M1467-W1821 VanDerWaalsContact CA-CE3 3.43Å; M1467-W1821 HydrophobicContact CB-CE3 3.83Å; M1467-W1821 HydrophobicContact CB-CH2 4Å; M1467-W1821 HydrophobicContact CB-CZ3 3.35Å; M1467-W1821 HydrophobicContact CE-CH2 4.33Å; M1467-W1821 HydrophobicContact CG-CE3 4.2Å; M1467-W1821 HydrophobicContact CG-CH2 3.61Å; M1467-W1821 HydrophobicContact CG-CZ2 4.36Å; M1467-W1821 HydrophobicContact CG-CZ3 3.52Å; M1467-W1821 HydrophobicContact SD-CH2 3.89Å; M1467-W1821 HydrophobicContact SD-CZ3 4.16Å
1468A90.2Very high82.2Confident0 Ų030.7 Ų30.70%017%0.168CC..Hα-helixtrans-60.7-44.6176.800000111.4V1463 S1464 P1465 S1470 F1471 A1486 V1489 L1490V1463-A1468 HydrophobicContact CG2-CB 4.4Å; S1464-A1468 PolarHBondContact O-N 3.15Å; P1465-A1468 PolarHBondContact O-N 3.46Å; A1468-S1470 VanDerWaalsContact C-N 3.25Å; A1468-S1470 PolarHBondContact O-N 3.46Å; A1468-F1471 PolarHBondContact O-N 3.02Å; A1468-A1486 HydrophobicContact CB-CB 4.43Å; A1468-A1486 VanDerWaalsContact O-CB 3.27Å; A1468-A1486 WeakPolarHBondContact O-CB 3.35Å; A1468-V1489 HydrophobicContact CB-CB 4.01Å; A1468-V1489 HydrophobicContact CB-CG1 3.77Å; A1468-L1490 HydrophobicContact CB-CD2 4.02Å; A1468-L1490 HydrophobicContact CB-CG 3.98Å
1469L90.6Very high81.9Confident0 Ų029.4 Ų29.40%016%0.157CC..Hα-helixtrans-65.5-27.7176.2-71.5168000112.7P1465 M1467 F1471 F1472 L1490 Y1501 Q1504 I1505 A1508 M1517 L1825P1465-L1469 WeakPolarHBondContact O-CB 3.26Å; P1465-L1469 VanDerWaalsContact O-CG 3.26Å; P1465-L1469 WeakPolarHBondContact O-CG 3.39Å; P1465-L1469 PolarHBondContact O-N 3.19Å; M1467-L1469 VanDerWaalsContact C-N 3.34Å; M1467-L1469 PolarHBondContact O-N 3.32Å; L1469-F1471 PolarHBondContact O-N 3.34Å; L1469-F1472 PolarHBondContact O-N 2.93Å; L1469-L1490 HydrophobicContact CD2-CD1 3.83Å; L1469-L1490 HydrophobicContact CD2-CD2 4.4Å; L1469-L1490 HydrophobicContact CG-CD1 4.33Å; L1469-L1490 HydrophobicContact CG-CD2 4.12Å; L1469-Y1501 HydrophobicContact CD1-CD1 4.03Å; L1469-Y1501 HydrophobicContact CD1-CG 4.33Å; L1469-Q1504 HydrophobicContact CD1-CB 4.02Å; L1469-I1505 HydrophobicContact CD1-CG1 4.26Å; L1469-I1505 HydrophobicContact CD2-CG1 3.89Å; L1469-A1508 HydrophobicContact CD2-CB 4.45Å; L1469-M1517 HydrophobicContact CD2-CE 3.84Å; L1469-L1825 HydrophobicContact CB-CD1 3.62Å
1470S87.2Confident81.7Confident6 Ų629.9 Ų29.94%0.04216%0.159CC..Hα-helixtrans-60.2-26.6177.482.40000113.4A1466 M1467 A1468 F1472 S1473A1466-S1470 PolarHBondContact O-N 3.39Å; A1466-S1470 VanDerWaalsContact O-N 3.07Å; M1467-S1470 WeakPolarHBondContact O-CB 3.35Å; M1467-S1470 PolarHBondContact O-N 3.36Å; M1467-S1470 VanDerWaalsContact O-N 3.15Å; M1467-S1470 PolarHBondContact O-OG 2.61Å; A1468-S1470 VanDerWaalsContact C-N 3.25Å; A1468-S1470 PolarHBondContact O-N 3.46Å; S1470-F1472 PolarHBondContact O-N 3.49Å; S1470-S1473 WeakPolarHBondContact O-CB 3.27Å; S1470-S1473 PolarHBondContact O-N 3.02Å; S1470-S1473 VanDerWaalsContact O-N 3.16Å; S1470-S1473 PolarHBondContact O-OG 3.2Å
1471F86.9Confident81.5Confident5 Ų531.5 Ų31.52%0.02217%0.169CC..THydrogen-bonded Turntrans-69.2-13.1174-68.2-66.5000113.5L1438 A1442 V1447 A1468 L1469 A1476 S1477 A1482 Y1485 A1486L1438-F1471 HydrophobicContact CD2-CE2 4.2Å; L1438-F1471 HydrophobicContact CD2-CZ 4.03Å; A1442-F1471 HydrophobicContact CB-CE1 4.18Å; A1442-F1471 HydrophobicContact CB-CZ 4.32Å; V1447-F1471 HydrophobicContact CG2-CD1 4.49Å; V1447-F1471 HydrophobicContact CG2-CE1 4.28Å; A1468-F1471 PolarHBondContact O-N 3.02Å; L1469-F1471 PolarHBondContact O-N 3.34Å; F1471-A1476 CarbonylContact O-C 3.5Å; F1471-S1477 VanDerWaalsContact O-CA 3.31Å; F1471-S1477 WeakPolarHBondContact O-CA 3.29Å; F1471-S1477 PolarHBondContact O-N 3.11Å; F1471-A1482 HydrophobicContact CD1-CB 3.97Å; F1471-A1482 HydrophobicContact CG-CB 4.39Å; F1471-Y1485 HydrophobicContact CD2-CD1 4.46Å; F1471-Y1485 HydrophobicContact CE2-CD1 4.02Å; F1471-Y1485 HydrophobicContact CE2-CE1 4.01Å; F1471-A1486 HydrophobicContact CB-CB 4.07Å; F1471-A1486 HydrophobicContact CD2-CB 4.09Å; F1471-A1486 HydrophobicContact CG-CB 4.49Å
1472F86.6Confident81.3Confident1 Ų130.9 Ų30.90%0.00416%0.164CC..THydrogen-bonded Turntrans-101.133.3171.3-65.5-85.6000111.8L1469 S1470 A1483 A1486 I1487 A1508 Y1511 M1517 L1825L1469-F1472 PolarHBondContact O-N 2.93Å; S1470-F1472 PolarHBondContact O-N 3.49Å; F1472-A1483 HydrophobicContact CE1-CB 4.18Å; F1472-A1483 HydrophobicContact CZ-CB 4.05Å; F1472-A1486 HydrophobicContact CD2-CB 4.23Å; F1472-A1486 HydrophobicContact CE2-CB 3.57Å; F1472-A1486 HydrophobicContact CZ-CB 4.43Å; F1472-I1487 HydrophobicContact CE2-CD1 3.78Å; F1472-I1487 HydrophobicContact CE2-CG1 4.37Å; F1472-I1487 HydrophobicContact CZ-CD1 3.59Å; F1472-I1487 HydrophobicContact CZ-CG1 3.92Å; F1472-A1508 HydrophobicContact CB-CB 3.67Å; F1472-A1508 HydrophobicContact CG-CB 4.26Å; F1472-Y1511 WeakPolarHBondContact O-CD2 3.23Å; F1472-M1517 HydrophobicContact CB-CE 4.45Å; F1472-M1517 HydrophobicContact CD1-CB 4.37Å; F1472-M1517 HydrophobicContact CD1-CE 4.15Å; F1472-M1517 HydrophobicContact CD2-CE 3.33Å; F1472-M1517 HydrophobicContact CE1-CB 4.1Å; F1472-M1517 HydrophobicContact CE1-CE 4.22Å; F1472-M1517 HydrophobicContact CE2-CE 3.39Å; F1472-M1517 HydrophobicContact CG-CE 3.73Å; F1472-M1517 HydrophobicContact CZ-CB 4.49Å; F1472-M1517 HydrophobicContact CZ-CE 3.86Å; F1472-L1825 VanDerWaalsContact O-CD2 3.3Å; F1472-L1825 WeakPolarHBondContact O-CD2 3.5Å
1473S79.2Confident81.2Confident20 Ų2027.7 Ų27.714%0.1414%0.143CC..SBendtrans-109.5154.817067.10000111S1470 A1476S1470-S1473 WeakPolarHBondContact O-CB 3.27Å; S1470-S1473 PolarHBondContact O-N 3.02Å; S1470-S1473 VanDerWaalsContact O-N 3.16Å; S1470-S1473 PolarHBondContact O-OG 3.2Å; S1473-A1476 PolarHBondContact O-N 3.49Å; S1473-A1476 VanDerWaalsContact O-N 3.15Å
1474R68.3Low81.2Confident158 Ų15831.7 Ų31.760%0.59616%0.162SC*.THydrogen-bonded Turntrans-54.2135-175.6-63.9-175.2-176.7-157.5-2.6111.7Y1511 D1828R1474-Y1511 HydrophobicContact CB-CE1 4.42Å; R1474-Y1511 HydrophobicContact CG-CD1 3.65Å; R1474-Y1511 HydrophobicContact CG-CE1 3.11Å; R1474-D1828 IonicContact CZ-OD1 3.28Å; R1474-D1828 IonicContact CZ-OD2 2.77Å; R1474-D1828 IonicContact NE-OD2 3.99Å; R1474-D1828 PolarHBondContact NE-OD2 3.06Å; R1474-D1828 VanDerWaalsContact NH2-CG 3.25Å; R1474-D1828 IonicContact NH2-OD1 3.44Å; R1474-D1828 PolarHBondContact NH2-OD1 3.18Å; R1474-D1828 IonicContact NH2-OD2 3.42Å; R1474-D1828 PolarHBondContact NH2-OD2 2.89Å
1475P55.6Low81.3Confident71 Ų7131 Ų3146%0.46116%0.157SC..THydrogen-bonded Turncis-96.614.2-25.813.98.5000114E1448 S1477 E1478E1448-P1475 HydrophobicContact CG-CG 4.47Å; E1448-P1475 WeakPolarHBondContact OE1-CD 3.33Å; P1475-S1477 PolarHBondContact O-N 3.24Å; P1475-E1478 PolarHBondContact O-N 2.7Å
1476A58.4Low81.3Confident2 Ų231 Ų312%0.01716%0.157CC..G310 helixtrans-58.2-17179.400000114.2V1444 V1447 F1471 S1473 E1478 H1479V1444-A1476 HydrophobicContact CG1-CB 4.29Å; V1447-A1476 HydrophobicContact CB-CB 4.33Å; V1447-A1476 HydrophobicContact CG1-CB 4.11Å; F1471-A1476 CarbonylContact O-C 3.5Å; S1473-A1476 PolarHBondContact O-N 3.49Å; S1473-A1476 VanDerWaalsContact O-N 3.15Å; A1476-E1478 VanDerWaalsContact C-N 3.26Å; A1476-E1478 PolarHBondContact O-N 2.82Å; A1476-H1479 PolarHBondContact O-N 3.3Å
1477S60.6Low81.6Confident10 Ų1031.5 Ų31.57%0.0716%0.159CC..G310 helixtrans-67.1-16.8-177.168.30000115.3F1471 P1475 H1479 Y1511F1471-S1477 VanDerWaalsContact O-CA 3.31Å; F1471-S1477 WeakPolarHBondContact O-CA 3.29Å; F1471-S1477 PolarHBondContact O-N 3.11Å; P1475-S1477 PolarHBondContact O-N 3.24Å; S1477-H1479 VanDerWaalsContact C-N 3.33Å; S1477-Y1511 WeakPolarHBondContact CB-O 3.37Å; S1477-Y1511 WeakPolarHBondContact OG-CB 3.37Å; S1477-Y1511 PolarHBondContact OG-O 3.28Å
1478E69.2Low81.8Confident142 Ų14235.2 Ų35.266%0.66417%0.172SC*.G310 helixtrans-78.2-16.6179.6-65.2-172.8175.800113.3P1475 A1476 P1480P1475-E1478 PolarHBondContact O-N 2.7Å; A1476-E1478 VanDerWaalsContact C-N 3.26Å; A1476-E1478 PolarHBondContact O-N 2.82Å; E1478-P1480 VanDerWaalsContact O-CD 3.27Å; E1478-P1480 WeakPolarHBondContact O-CD 3.4Å
1479H81Confident82Confident26 Ų2635.2 Ų35.212%0.1217%0.172CC..  trans-81.1111.7-175.9-165.4-62000111.6V1447 A1476 S1477 V1481 A1482 A1483V1447-H1479 HydrophobicContact CG1-CB 3.34Å; A1476-H1479 PolarHBondContact O-N 3.3Å; S1477-H1479 VanDerWaalsContact C-N 3.33Å; H1479-V1481 VanDerWaalsContact C-N 3.33Å; H1479-V1481 PolarHBondContact ND1-N 3.25Å; H1479-V1481 PolarHBondContact O-N 3.45Å; H1479-A1482 HydrophobicContact CB-CB 4.18Å; H1479-A1482 PolarHBondContact O-N 2.56Å; H1479-A1482 VanDerWaalsContact O-N 3.13Å; H1479-A1483 PolarHBondContact O-N 2.92Å; H1479-A1483 VanDerWaalsContact O-N 3.13Å
1480P84.6Confident82.1Confident59 Ų5935.2 Ų35.238%0.38317%0.172SC..Hα-helixtrans-60.9-38.2-170.522.1-33.2000113.3E1478 A1483 Q1484 L1514E1478-P1480 VanDerWaalsContact O-CD 3.27Å; E1478-P1480 WeakPolarHBondContact O-CD 3.4Å; P1480-A1483 PolarHBondContact O-N 3.24Å; P1480-Q1484 WeakPolarHBondContact O-CB 3.46Å; P1480-Q1484 VanDerWaalsContact O-CG 3.26Å; P1480-Q1484 WeakPolarHBondContact O-CG 3.37Å; P1480-Q1484 PolarHBondContact O-N 2.92Å; P1480-L1514 HydrophobicContact CB-CD1 3.88Å
1481V87Confident82.4Confident37 Ų3739.6 Ų39.622%0.22419%0.191CC..Hα-helixtrans-66.1-40.3179.6-173.70000112.4V1457 P1458 H1479 Q1484 Y1485V1457-V1481 HydrophobicContact CB-CG1 4.48Å; P1458-V1481 HydrophobicContact CG-CG1 3.34Å; H1479-V1481 VanDerWaalsContact C-N 3.33Å; H1479-V1481 PolarHBondContact ND1-N 3.25Å; H1479-V1481 PolarHBondContact O-N 3.45Å; V1481-Q1484 PolarHBondContact O-N 3.49Å; V1481-Y1485 WeakPolarHBondContact O-CB 3.36Å; V1481-Y1485 PolarHBondContact O-N 2.84Å
1482A86Confident82.5Confident1 Ų142.8 Ų42.81%0.00821%0.214CC..Hα-helixtrans-67.4-43.9178.600000110.3V1447 M1454 F1471 H1479 Y1485 A1486V1447-A1482 HydrophobicContact CG1-CB 4.24Å; M1454-A1482 HydrophobicContact CE-CB 4.1Å; F1471-A1482 HydrophobicContact CD1-CB 3.97Å; F1471-A1482 HydrophobicContact CG-CB 4.39Å; H1479-A1482 HydrophobicContact CB-CB 4.18Å; H1479-A1482 PolarHBondContact O-N 2.56Å; H1479-A1482 VanDerWaalsContact O-N 3.13Å; A1482-Y1485 PolarHBondContact O-N 3.24Å; A1482-A1486 WeakPolarHBondContact O-CB 3.29Å; A1482-A1486 PolarHBondContact O-N 3.01Å
1483A87.7Confident82.7Confident2 Ų245 Ų452%0.01722%0.222CC..Hα-helixtrans-60.8-45.8175.100000112.1F1472 H1479 P1480 Y1485 A1486 I1487 Y1516F1472-A1483 HydrophobicContact CE1-CB 4.18Å; F1472-A1483 HydrophobicContact CZ-CB 4.05Å; H1479-A1483 PolarHBondContact O-N 2.92Å; H1479-A1483 VanDerWaalsContact O-N 3.13Å; P1480-A1483 PolarHBondContact O-N 3.24Å; A1483-Y1485 PolarHBondContact O-N 3.2Å; A1483-A1486 PolarHBondContact O-N 3.35Å; A1483-I1487 WeakPolarHBondContact O-CG1 3.26Å; A1483-I1487 PolarHBondContact O-N 3.47Å; A1483-Y1516 HydrophobicContact CB-CD2 3.69Å; A1483-Y1516 HydrophobicContact CB-CE2 4.31Å; A1483-Y1516 HydrophobicContact CB-CG 4.31Å
1484Q89.8Confident83Confident90 Ų9045.3 Ų45.342%0.42122%0.224SC..Hα-helixtrans-60.8-44.8176.9-75.3175.318.600112.4P1480 V1481 I1487 R1488 Y1516P1480-Q1484 WeakPolarHBondContact O-CB 3.46Å; P1480-Q1484 VanDerWaalsContact O-CG 3.26Å; P1480-Q1484 WeakPolarHBondContact O-CG 3.37Å; P1480-Q1484 PolarHBondContact O-N 2.92Å; V1481-Q1484 PolarHBondContact O-N 3.49Å; Q1484-I1487 PolarHBondContact O-N 3.43Å; Q1484-R1488 WeakPolarHBondContact O-CB 3.37Å; Q1484-R1488 PolarHBondContact O-N 3.3Å; Q1484-Y1516 HydrophobicContact CG-CE1 3.86Å; Q1484-Y1516 HydrophobicContact CG-CE2 4.22Å; Q1484-Y1516 PolarHBondContact NE2-OH 2.95Å
1485Y91.3Very high83.9Confident2 Ų239.4 Ų39.41%0.00821%0.206CC..Hα-helixtrans-60.3-48.2175.3170.1-95.9000111.4L1438 V1457 W1460 A1461 V1463 F1471 V1481 A1482 A1483 I1487 R1488 V1489L1438-Y1485 HydrophobicContact CD2-CD1 4.31Å; L1438-Y1485 HydrophobicContact CD2-CE1 3.42Å; L1438-Y1485 VanDerWaalsContact CD2-CE1 3.42Å; L1438-Y1485 WeakPolarHBondContact CD2-OH 3.06Å; V1457-Y1485 HydrophobicContact CG1-CD1 4.12Å; V1457-Y1485 HydrophobicContact CG1-CD2 4.1Å; V1457-Y1485 HydrophobicContact CG1-CG 3.75Å; V1457-Y1485 WeakPolarHBondContact O-CD2 3.44Å; V1457-Y1485 WeakPolarHBondContact O-CE2 3.32Å; W1460-Y1485 HydrophobicContact CB-CE2 3.76Å; A1461-Y1485 PolarHBondContact O-OH 3.26Å; V1463-Y1485 WeakPolarHBondContact CG1-OH 3.2Å; V1463-Y1485 HydrophobicContact CG2-CE1 3.92Å; F1471-Y1485 HydrophobicContact CD2-CD1 4.46Å; F1471-Y1485 HydrophobicContact CE2-CD1 4.02Å; F1471-Y1485 HydrophobicContact CE2-CE1 4.01Å; V1481-Y1485 WeakPolarHBondContact O-CB 3.36Å; V1481-Y1485 PolarHBondContact O-N 2.84Å; A1482-Y1485 PolarHBondContact O-N 3.24Å; A1483-Y1485 PolarHBondContact O-N 3.2Å; Y1485-I1487 PolarHBondContact O-N 3.06Å; Y1485-R1488 WeakPolarHBondContact O-CB 2.96Å; Y1485-R1488 PolarHBondContact O-N 2.69Å; Y1485-R1488 VanDerWaalsContact O-N 3.17Å; Y1485-V1489 HydrophobicContact CD1-CG2 4.34Å; Y1485-V1489 HydrophobicContact CD2-CG2 4.41Å; Y1485-V1489 HydrophobicContact CE1-CG2 3.84Å; Y1485-V1489 HydrophobicContact CE2-CG2 3.95Å; Y1485-V1489 WeakPolarHBondContact O-CG2 3.39Å; Y1485-V1489 PolarHBondContact O-N 3.09Å
1486A91.2Very high85.2Confident0 Ų036.7 Ų36.70%019%0.189CC..Hα-helixtrans-58.6-46178.800000112A1468 F1471 F1472 A1482 A1483 R1488 V1489 L1490A1468-A1486 HydrophobicContact CB-CB 4.43Å; A1468-A1486 VanDerWaalsContact O-CB 3.27Å; A1468-A1486 WeakPolarHBondContact O-CB 3.35Å; F1471-A1486 HydrophobicContact CB-CB 4.07Å; F1471-A1486 HydrophobicContact CD2-CB 4.09Å; F1471-A1486 HydrophobicContact CG-CB 4.49Å; F1472-A1486 HydrophobicContact CD2-CB 4.23Å; F1472-A1486 HydrophobicContact CE2-CB 3.57Å; F1472-A1486 HydrophobicContact CZ-CB 4.43Å; A1482-A1486 WeakPolarHBondContact O-CB 3.29Å; A1482-A1486 PolarHBondContact O-N 3.01Å; A1483-A1486 PolarHBondContact O-N 3.35Å; A1486-R1488 PolarHBondContact O-N 2.85Å; A1486-V1489 PolarHBondContact O-N 3.36Å; A1486-L1490 WeakPolarHBondContact O-CG 3.43Å; A1486-L1490 PolarHBondContact O-N 3.33Å
1487I93.6Very high86.6Confident11 Ų1136.7 Ų36.76%0.05619%0.189CC..Hα-helixtrans-64.4-39.3175.7-64.9-45.6000112F1472 A1483 Q1484 Y1485 V1489 L1490 K1491 M1517 F1520F1472-I1487 HydrophobicContact CE2-CD1 3.78Å; F1472-I1487 HydrophobicContact CE2-CG1 4.37Å; F1472-I1487 HydrophobicContact CZ-CD1 3.59Å; F1472-I1487 HydrophobicContact CZ-CG1 3.92Å; A1483-I1487 WeakPolarHBondContact O-CG1 3.26Å; A1483-I1487 PolarHBondContact O-N 3.47Å; Q1484-I1487 PolarHBondContact O-N 3.43Å; Y1485-I1487 PolarHBondContact O-N 3.06Å; I1487-V1489 VanDerWaalsContact C-N 3.3Å; I1487-V1489 PolarHBondContact O-N 3.43Å; I1487-L1490 HydrophobicContact CD1-CD1 4.29Å; I1487-L1490 PolarHBondContact O-N 3.34Å; I1487-K1491 HydrophobicContact CG2-CD 3.93Å; I1487-K1491 HydrophobicContact CG2-CG 4.18Å; I1487-K1491 WeakPolarHBondContact O-CB 3.31Å; I1487-K1491 VanDerWaalsContact O-CG 3.31Å; I1487-K1491 WeakPolarHBondContact O-CG 3.26Å; I1487-K1491 PolarHBondContact O-N 3.49Å; I1487-M1517 HydrophobicContact CD1-CE 4.04Å; I1487-M1517 HydrophobicContact CD1-SD 4.2Å; I1487-F1520 HydrophobicContact CD1-CB 3.76Å; I1487-F1520 HydrophobicContact CD1-CG 4.08Å; I1487-F1520 HydrophobicContact CG2-CB 4.18Å; I1487-F1520 HydrophobicContact CG2-CD2 4.26Å
1488R93.7Very high88Confident96 Ų9636.3 Ų36.336%0.36219%0.186SC..Hα-helixtrans-59.2-43.5175.1-178.6-162.867.4142.920.5111P1458 W1460 Q1484 Y1485 A1486 S1492P1458-R1488 PolarHBondContact O-NH1 3.33Å; W1460-R1488 PolarHBondContact O-NH1 3.1Å; W1460-R1488 PolarHBondContact O-NH2 3.36Å; Q1484-R1488 WeakPolarHBondContact O-CB 3.37Å; Q1484-R1488 PolarHBondContact O-N 3.3Å; Y1485-R1488 WeakPolarHBondContact O-CB 2.96Å; Y1485-R1488 PolarHBondContact O-N 2.69Å; Y1485-R1488 VanDerWaalsContact O-N 3.17Å; A1486-R1488 PolarHBondContact O-N 2.85Å; R1488-S1492 PolarHBondContact O-N 3.13Å
1489V92.7Very high88.8Confident0 Ų030.8 Ų30.80%016%0.161CC..Hα-helixtrans-64.5-50.3176.7173.50000110.8P1462 V1463 A1468 Y1485 A1486 I1487 K1491 S1492 Y1493P1462-V1489 HydrophobicContact CB-CG1 4.41Å; P1462-V1489 HydrophobicContact CB-CG2 4.29Å; V1463-V1489 HydrophobicContact CG2-CG1 4.15Å; V1463-V1489 HydrophobicContact CG2-CG2 4.37Å; V1463-V1489 WeakPolarHBondContact O-CG1 3.36Å; A1468-V1489 HydrophobicContact CB-CB 4.01Å; A1468-V1489 HydrophobicContact CB-CG1 3.77Å; Y1485-V1489 HydrophobicContact CD1-CG2 4.34Å; Y1485-V1489 HydrophobicContact CD2-CG2 4.41Å; Y1485-V1489 HydrophobicContact CE1-CG2 3.84Å; Y1485-V1489 HydrophobicContact CE2-CG2 3.95Å; Y1485-V1489 WeakPolarHBondContact O-CG2 3.39Å; Y1485-V1489 PolarHBondContact O-N 3.09Å; A1486-V1489 PolarHBondContact O-N 3.36Å; I1487-V1489 VanDerWaalsContact C-N 3.3Å; I1487-V1489 PolarHBondContact O-N 3.43Å; V1489-K1491 VanDerWaalsContact C-N 3.3Å; V1489-K1491 PolarHBondContact O-N 3.12Å; V1489-S1492 WeakPolarHBondContact O-CB 3.41Å; V1489-S1492 PolarHBondContact O-N 3.03Å; V1489-S1492 PolarHBondContact O-OG 3.17Å; V1489-Y1493 HydrophobicContact CG1-CE2 3.95Å; V1489-Y1493 VanDerWaalsContact O-CD2 3.31Å; V1489-Y1493 WeakPolarHBondContact O-CD2 3.38Å
1490L93.3Very high89.1Confident0 Ų033 Ų330%017%0.169CC..Hα-helixtrans-60.5-38.2179.3-67.7173.1000112.7P1465 A1468 L1469 A1486 I1487 S1492 Y1493 L1498 M1517 F1520P1465-L1490 HydrophobicContact CB-CD2 4.17Å; A1468-L1490 HydrophobicContact CB-CD2 4.02Å; A1468-L1490 HydrophobicContact CB-CG 3.98Å; L1469-L1490 HydrophobicContact CD2-CD1 3.83Å; L1469-L1490 HydrophobicContact CD2-CD2 4.4Å; L1469-L1490 HydrophobicContact CG-CD1 4.33Å; L1469-L1490 HydrophobicContact CG-CD2 4.12Å; A1486-L1490 WeakPolarHBondContact O-CG 3.43Å; A1486-L1490 PolarHBondContact O-N 3.33Å; I1487-L1490 HydrophobicContact CD1-CD1 4.29Å; I1487-L1490 PolarHBondContact O-N 3.34Å; L1490-S1492 PolarHBondContact O-N 3.35Å; L1490-Y1493 PolarHBondContact O-N 3.18Å; L1490-L1498 HydrophobicContact CD2-CD2 4.26Å; L1490-M1517 HydrophobicContact CD1-CE 3.94Å; L1490-F1520 HydrophobicContact CB-CD2 4.42Å; L1490-F1520 HydrophobicContact CB-CE1 4.3Å; L1490-F1520 HydrophobicContact CB-CE2 3.68Å; L1490-F1520 HydrophobicContact CB-CZ 3.6Å; L1490-F1520 HydrophobicContact CD1-CE1 4.27Å; L1490-F1520 HydrophobicContact CD1-CZ 4.39Å
1491K92.9Very high89.4Confident99 Ų9930.3 Ų30.343%0.4315%0.15SC..Hα-helixtrans-67.6-18.5175.1-75.6-177.2176.7-179.50114I1487 V1489 Y1493 F1520 M1524I1487-K1491 HydrophobicContact CG2-CD 3.93Å; I1487-K1491 HydrophobicContact CG2-CG 4.18Å; I1487-K1491 WeakPolarHBondContact O-CB 3.31Å; I1487-K1491 VanDerWaalsContact O-CG 3.31Å; I1487-K1491 WeakPolarHBondContact O-CG 3.26Å; I1487-K1491 PolarHBondContact O-N 3.49Å; V1489-K1491 VanDerWaalsContact C-N 3.3Å; V1489-K1491 PolarHBondContact O-N 3.12Å; K1491-Y1493 VanDerWaalsContact C-N 3.31Å; K1491-F1520 HydrophobicContact CG-CD2 3.7Å; K1491-F1520 HydrophobicContact CG-CE2 3.84Å; K1491-M1524 HydrophobicContact CG-CE 4.18Å
1492S90.7Very high89.7Confident72 Ų7228.9 Ų28.950%0.50314%0.142SC..Hα-helixtrans-77.7-18.8176.576.50000112.9R1488 V1489 L1490R1488-S1492 PolarHBondContact O-N 3.13Å; V1489-S1492 WeakPolarHBondContact O-CB 3.41Å; V1489-S1492 PolarHBondContact O-N 3.03Å; V1489-S1492 PolarHBondContact O-OG 3.17Å; L1490-S1492 PolarHBondContact O-N 3.35Å
1493Y89.5Confident90Very high46 Ų4629.5 Ų29.518%0.1815%0.145CC..SBendtrans-89.1146176.3-70.1-79.9000111.8A1063 V1463 P1465 V1489 L1490 K1491 V1497A1063-Y1493 HydrophobicContact CB-CD1 4.08Å; A1063-Y1493 HydrophobicContact CB-CE1 3.53Å; V1463-Y1493 PolarHBondContact O-OH 2.58Å; P1465-Y1493 HydrophobicContact CG-CD1 4.38Å; P1465-Y1493 HydrophobicContact CG-CD2 3.92Å; P1465-Y1493 HydrophobicContact CG-CE1 4.3Å; P1465-Y1493 HydrophobicContact CG-CE2 3.81Å; P1465-Y1493 HydrophobicContact CG-CG 4.2Å; V1489-Y1493 HydrophobicContact CG1-CE2 3.95Å; V1489-Y1493 VanDerWaalsContact O-CD2 3.31Å; V1489-Y1493 WeakPolarHBondContact O-CD2 3.38Å; L1490-Y1493 PolarHBondContact O-N 3.18Å; K1491-Y1493 VanDerWaalsContact C-N 3.31Å; Y1493-V1497 HydrophobicContact CD1-CG1 4.24Å
1494P86.7Confident90.3Very high27 Ų2729.4 Ų29.418%0.17515%0.145CC..  trans-71.3155.6177.533.7-39.8000111.7R1065 S1496 V1497 L1498R1065-P1494 HydrophobicContact CG-CG 3.97Å; P1494-S1496 PolarHBondContact O-N 3.13Å; P1494-S1496 VanDerWaalsContact O-N 3.17Å; P1494-V1497 HydrophobicContact CG-CB 4.1Å; P1494-V1497 HydrophobicContact CG-CG2 3.65Å; P1494-V1497 PolarHBondContact O-N 2.94Å; P1494-V1497 VanDerWaalsContact O-N 3.12Å; P1494-L1498 PolarHBondContact O-N 2.62Å
1495P85.6Confident90.5Very high34 Ų3425.3 Ų25.322%0.22113%0.126CC..Hα-helixtrans-53.1-36.7177.6-2936.7000114.5V1497 L1498 L1499 L1531P1495-V1497 VanDerWaalsContact C-N 3.32Å; P1495-V1497 PolarHBondContact O-N 3.33Å; P1495-L1498 PolarHBondContact O-N 3.5Å; P1495-L1498 VanDerWaalsContact O-N 3.1Å; P1495-L1499 PolarHBondContact O-N 3.28Å; P1495-L1531 HydrophobicContact CB-CB 4.49Å; P1495-L1531 HydrophobicContact CB-CD2 3.93Å
1496S83.1Confident90.7Very high15 Ų1525.2 Ų25.211%0.10513%0.125CC..Hα-helixtrans-61.6-34.6179.751.40000113.8P1494P1494-S1496 PolarHBondContact O-N 3.13Å; P1494-S1496 VanDerWaalsContact O-N 3.17Å
1497V87.5Confident90.7Very high2 Ų225.2 Ų25.21%0.01213%0.125CC..Hα-helixtrans-72.7-40.6173.5171.60000110.5A1063 R1065 P1465 Y1493 P1494 P1495 L1499 Y1500 Y1501A1063-V1497 HydrophobicContact CB-CG1 4Å; A1063-V1497 WeakPolarHBondContact O-CG2 3.47Å; R1065-V1497 HydrophobicContact CG-CG2 3.82Å; P1465-V1497 HydrophobicContact CG-CG1 4.46Å; Y1493-V1497 HydrophobicContact CD1-CG1 4.24Å; P1494-V1497 HydrophobicContact CG-CB 4.1Å; P1494-V1497 HydrophobicContact CG-CG2 3.65Å; P1494-V1497 PolarHBondContact O-N 2.94Å; P1494-V1497 VanDerWaalsContact O-N 3.12Å; P1495-V1497 VanDerWaalsContact C-N 3.32Å; P1495-V1497 PolarHBondContact O-N 3.33Å; V1497-L1499 VanDerWaalsContact C-N 3.27Å; V1497-L1499 PolarHBondContact O-N 3.38Å; V1497-Y1500 PolarHBondContact O-N 3.03Å; V1497-Y1501 HydrophobicContact CG1-CE2 4.43Å; V1497-Y1501 WeakPolarHBondContact O-CD2 3.38Å
1498L90.1Very high90.7Very high1 Ų124.7 Ų24.71%0.00512%0.123CC..Hα-helixtrans-68.9-22.8-177.5-62.5174.1000113.3L1490 P1494 P1495 Y1500 Y1501 I1502 I1505 F1520 M1524L1490-L1498 HydrophobicContact CD2-CD2 4.26Å; P1494-L1498 PolarHBondContact O-N 2.62Å; P1495-L1498 PolarHBondContact O-N 3.5Å; P1495-L1498 VanDerWaalsContact O-N 3.1Å; L1498-Y1500 PolarHBondContact O-N 3.21Å; L1498-Y1501 PolarHBondContact O-N 3.43Å; L1498-I1502 PolarHBondContact O-N 2.92Å; L1498-I1505 HydrophobicContact CB-CD1 4.39Å; L1498-I1505 HydrophobicContact CD2-CD1 4.49Å; L1498-F1520 HydrophobicContact CD1-CE2 4.44Å; L1498-F1520 HydrophobicContact CD1-CZ 3.77Å; L1498-M1524 HydrophobicContact CD1-CG 4.3Å; L1498-M1524 HydrophobicContact CD1-SD 4.3Å
1499L87.1Confident90.6Very high27 Ų2720.1 Ų20.114%0.14111%0.105CC..G310 helixtrans-51.9-38.2173-76.3173.7000112.1P1495 V1497 Y1501 I1502 L1531 Q1534 P1628 V1662P1495-L1499 PolarHBondContact O-N 3.28Å; V1497-L1499 VanDerWaalsContact C-N 3.27Å; V1497-L1499 PolarHBondContact O-N 3.38Å; L1499-Y1501 PolarHBondContact O-N 3.05Å; L1499-I1502 HydrophobicContact CD2-CD1 3.98Å; L1499-I1502 WeakPolarHBondContact O-CG1 3.32Å; L1499-L1531 HydrophobicContact CD2-CB 4.24Å; L1499-L1531 HydrophobicContact CD2-CD1 3.79Å; L1499-L1531 HydrophobicContact CG-CD1 4.35Å; L1499-Q1534 HydrophobicContact CD2-CB 4.26Å; L1499-Q1534 HydrophobicContact CD2-CG 4.08Å; L1499-P1628 HydrophobicContact CD1-CG 4.42Å; L1499-V1662 HydrophobicContact CD1-CG1 4.01Å; L1499-V1662 HydrophobicContact CD1-CG2 4.22Å
1500Y86.2Confident90.5Very high73 Ų7321.1 Ų21.129%0.28611%0.109SC..G310 helixtrans-71.4-16.1179.2-69.1-78000113.7V1497 L1498 Q1708 Q1711V1497-Y1500 PolarHBondContact O-N 3.03Å; L1498-Y1500 PolarHBondContact O-N 3.21Å; Y1500-Q1708 PolarHBondContact O-NE2 2.98Å; Y1500-Q1711 HydrophobicContact CE1-CG 4.25Å
1501Y92.3Very high90.2Very high1 Ų122.5 Ų22.50%0.00412%0.115CC..G310 helixtrans-108.46.3-175.5-68.7-80.1000113.5L1062 P1465 A1466 L1469 V1497 L1498 L1499 P1503 Q1504 I1505 L1822L1062-Y1501 WeakPolarHBondContact CB-OH 3.4Å; L1062-Y1501 WeakPolarHBondContact O-CE2 3.27Å; L1062-Y1501 PolarHBondContact O-OH 3.08Å; P1465-Y1501 HydrophobicContact CB-CD1 4.48Å; P1465-Y1501 HydrophobicContact CB-CD2 4.02Å; P1465-Y1501 HydrophobicContact CB-CE1 4.27Å; P1465-Y1501 HydrophobicContact CB-CE2 3.79Å; P1465-Y1501 HydrophobicContact CB-CG 4.35Å; P1465-Y1501 HydrophobicContact CG-CE2 3.99Å; A1466-Y1501 HydrophobicContact CB-CE1 4.44Å; L1469-Y1501 HydrophobicContact CD1-CD1 4.03Å; L1469-Y1501 HydrophobicContact CD1-CG 4.33Å; V1497-Y1501 HydrophobicContact CG1-CE2 4.43Å; V1497-Y1501 WeakPolarHBondContact O-CD2 3.38Å; L1498-Y1501 PolarHBondContact O-N 3.43Å; L1499-Y1501 PolarHBondContact O-N 3.05Å; Y1501-P1503 VanDerWaalsContact C-CD 3.48Å; Y1501-Q1504 PolarHBondContact O-N 3.28Å; Y1501-Q1504 VanDerWaalsContact O-N 3.11Å; Y1501-Q1504 PolarHBondContact O-OE1 3.4Å; Y1501-I1505 WeakPolarHBondContact O-CG1 3.06Å; Y1501-I1505 PolarHBondContact O-N 2.73Å; Y1501-L1822 HydrophobicContact CD1-CD2 3.55Å; Y1501-L1822 HydrophobicContact CE1-CD1 3.86Å; Y1501-L1822 HydrophobicContact CE1-CD2 3.5Å; Y1501-L1822 VanDerWaalsContact CE1-CD2 3.5Å; Y1501-L1822 HydrophobicContact CE1-CG 4.28Å
1502I92.4Very high90Very high8 Ų818 Ų184%0.04110%0.095CC..Hα-helixtrans-50.3-48.3-178.7-72.4174.7000113.1L1498 L1499 Q1504 I1505 V1506 L1531 Q1534 L1535 N1538L1498-I1502 PolarHBondContact O-N 2.92Å; L1499-I1502 HydrophobicContact CD2-CD1 3.98Å; L1499-I1502 WeakPolarHBondContact O-CG1 3.32Å; I1502-Q1504 VanDerWaalsContact C-N 3.27Å; I1502-Q1504 PolarHBondContact O-N 3.49Å; I1502-I1505 PolarHBondContact O-N 2.94Å; I1502-V1506 HydrophobicContact CG2-CG2 4.23Å; I1502-V1506 WeakPolarHBondContact O-CG2 3.41Å; I1502-V1506 PolarHBondContact O-N 3.43Å; I1502-L1531 HydrophobicContact CD1-CD1 3.88Å; I1502-L1531 HydrophobicContact CG1-CD1 4.01Å; I1502-Q1534 HydrophobicContact CD1-CB 3.35Å; I1502-Q1534 HydrophobicContact CD1-CG 4.42Å; I1502-L1535 HydrophobicContact CG1-CD2 4.28Å; I1502-L1535 HydrophobicContact CG1-CG 4.45Å; I1502-L1535 HydrophobicContact CG2-CD2 4.18Å; I1502-N1538 HydrophobicContact CG2-CB 3.48Å; I1502-N1538 VanDerWaalsContact CG2-CB 3.48Å
1503P92.8Very high89.6Confident13 Ų1317.4 Ų17.48%0.0849%0.091CC..Hα-helixtrans-56.4-43.2-179.4-2534.9000112.2Y1501 Q1507 M1704 M1826Y1501-P1503 VanDerWaalsContact C-CD 3.48Å; P1503-Q1507 WeakPolarHBondContact O-CG 3.48Å; P1503-Q1507 PolarHBondContact O-N 3.27Å; P1503-Q1507 VanDerWaalsContact O-N 3.08Å; P1503-M1704 HydrophobicContact CG-CE 4.39Å; P1503-M1826 HydrophobicContact CB-CE 3.82Å; P1503-M1826 HydrophobicContact CB-SD 3.92Å
1504Q93.7Very high89.4Confident0 Ų019.1 Ų19.10%010%0.103CC..Hα-helixtrans-73.7-36.5179.4-66.780.714.400112.7L1469 Y1501 I1502 Q1507 A1508 L1822 L1825 M1826L1469-Q1504 HydrophobicContact CD1-CB 4.02Å; Y1501-Q1504 PolarHBondContact O-N 3.28Å; Y1501-Q1504 VanDerWaalsContact O-N 3.11Å; Y1501-Q1504 PolarHBondContact O-OE1 3.4Å; I1502-Q1504 VanDerWaalsContact C-N 3.27Å; I1502-Q1504 PolarHBondContact O-N 3.49Å; Q1504-Q1507 PolarHBondContact O-N 2.66Å; Q1504-A1508 WeakPolarHBondContact O-CB 3.46Å; Q1504-A1508 PolarHBondContact O-N 3Å; Q1504-L1822 HydrophobicContact CB-CD2 4.41Å; Q1504-L1822 HydrophobicContact CG-CB 4.32Å; Q1504-L1822 HydrophobicContact CG-CD2 3.84Å; Q1504-L1822 WeakPolarHBondContact CG-O 2.88Å; Q1504-L1825 HydrophobicContact CB-CB 4.34Å; Q1504-L1825 HydrophobicContact CB-CD1 3.96Å; Q1504-L1825 HydrophobicContact CG-CB 4.21Å; Q1504-L1825 HydrophobicContact CG-CD1 4.3Å; Q1504-M1826 HydrophobicContact CG-CG 4.36Å; Q1504-M1826 HydrophobicContact CG-SD 4.37Å
1505I94.6Very high89.6Confident4 Ų422.2 Ų22.22%0.02112%0.118CC..Hα-helixtrans-62.3-43.9174.9-70.2164.6000110.5L1469 L1498 Y1501 I1502 A1508 M1517 F1520 I1521 L1535L1469-I1505 HydrophobicContact CD1-CG1 4.26Å; L1469-I1505 HydrophobicContact CD2-CG1 3.89Å; L1498-I1505 HydrophobicContact CB-CD1 4.39Å; L1498-I1505 HydrophobicContact CD2-CD1 4.49Å; Y1501-I1505 WeakPolarHBondContact O-CG1 3.06Å; Y1501-I1505 PolarHBondContact O-N 2.73Å; I1502-I1505 PolarHBondContact O-N 2.94Å; I1505-A1508 WeakPolarHBondContact O-CB 3.19Å; I1505-A1508 PolarHBondContact O-N 3.4Å; I1505-M1517 HydrophobicContact CG2-SD 4.12Å; I1505-F1520 HydrophobicContact CD1-CE1 4.43Å; I1505-F1520 HydrophobicContact CG2-CE1 4.41Å; I1505-I1521 HydrophobicContact CG2-CD1 3.92Å; I1505-I1521 HydrophobicContact CG2-CG1 3.77Å; I1505-L1535 HydrophobicContact CG2-CD2 4.37Å
1506V94.6Very high89.9Confident0 Ų024.2 Ų24.20%012%0.122CC..Hα-helixtrans-65.9-42.7177.4172.10000110.8I1502 A1508 V1509 L1535 N1538 M1539 N1542 L1560I1502-V1506 HydrophobicContact CG2-CG2 4.23Å; I1502-V1506 WeakPolarHBondContact O-CG2 3.41Å; I1502-V1506 PolarHBondContact O-N 3.43Å; V1506-A1508 VanDerWaalsContact C-N 3.33Å; V1506-A1508 PolarHBondContact O-N 3.41Å; V1506-V1509 WeakPolarHBondContact O-CB 3.3Å; V1506-V1509 PolarHBondContact O-N 3.27Å; V1506-L1535 HydrophobicContact CG2-CD2 4.12Å; V1506-N1538 HydrophobicContact CG2-CB 4.25Å; V1506-M1539 HydrophobicContact CG1-CG 4.04Å; V1506-M1539 HydrophobicContact CG2-CG 3.79Å; V1506-N1542 HydrophobicContact CG1-CB 3.93Å; V1506-L1560 HydrophobicContact CG1-CD1 3.88Å; V1506-L1560 HydrophobicContact CG1-CD2 4.25Å
1507Q92.3Very high90.4Very high1 Ų123.5 Ų23.51%0.00512%0.117CC..Hα-helixtrans-67.3-31.3176.3-72.6-59-43.400113.3P1503 Q1504 V1509 R1510 N1542 L1825 M1826 T1829P1503-Q1507 WeakPolarHBondContact O-CG 3.48Å; P1503-Q1507 PolarHBondContact O-N 3.27Å; P1503-Q1507 VanDerWaalsContact O-N 3.08Å; Q1504-Q1507 PolarHBondContact O-N 2.66Å; Q1507-V1509 PolarHBondContact O-N 3.44Å; Q1507-V1509 VanDerWaalsContact O-N 3.16Å; Q1507-R1510 WeakPolarHBondContact O-CB 3.48Å; Q1507-R1510 PolarHBondContact O-N 3.3Å; Q1507-N1542 PolarHBondContact NE2-OD1 3.36Å; Q1507-L1825 VanDerWaalsContact CB-O 3.24Å; Q1507-L1825 WeakPolarHBondContact CB-O 3.11Å; Q1507-M1826 HydrophobicContact CB-SD 4.49Å; Q1507-M1826 HydrophobicContact CG-SD 3.77Å; Q1507-T1829 HydrophobicContact CG-CG2 3.81Å
1508A92.3Very high90.7Very high0 Ų024 Ų240%012%0.12CC..Hα-helixtrans-59.3-26.4175.300000113.1L1469 F1472 Q1504 I1505 V1506 R1510 Y1511 D1512 M1517L1469-A1508 HydrophobicContact CD2-CB 4.45Å; F1472-A1508 HydrophobicContact CB-CB 3.67Å; F1472-A1508 HydrophobicContact CG-CB 4.26Å; Q1504-A1508 WeakPolarHBondContact O-CB 3.46Å; Q1504-A1508 PolarHBondContact O-N 3Å; I1505-A1508 WeakPolarHBondContact O-CB 3.19Å; I1505-A1508 PolarHBondContact O-N 3.4Å; V1506-A1508 VanDerWaalsContact C-N 3.33Å; V1506-A1508 PolarHBondContact O-N 3.41Å; A1508-R1510 PolarHBondContact O-N 3.3Å; A1508-Y1511 PolarHBondContact O-N 2.92Å; A1508-Y1511 VanDerWaalsContact O-N 3.13Å; A1508-D1512 PolarHBondContact O-N 3.43Å; A1508-M1517 HydrophobicContact CB-CE 3.73Å; A1508-M1517 HydrophobicContact CB-CG 4.08Å; A1508-M1517 HydrophobicContact CB-SD 4.46Å
1509V92.8Very high90.9Very high0 Ų029 Ų290%014%0.143CC..G310 helixtrans-61.4-25174.4-1790000112.2V1506 Q1507 Y1511 D1512 M1517 I1521 L1556 R1559 L1560 L1563V1506-V1509 WeakPolarHBondContact O-CB 3.3Å; V1506-V1509 PolarHBondContact O-N 3.27Å; Q1507-V1509 PolarHBondContact O-N 3.44Å; Q1507-V1509 VanDerWaalsContact O-N 3.16Å; V1509-Y1511 PolarHBondContact O-N 3.03Å; V1509-D1512 PolarHBondContact O-N 3.06Å; V1509-M1517 HydrophobicContact CG2-CG 4.03Å; V1509-I1521 HydrophobicContact CG2-CD1 3.43Å; V1509-I1521 VanDerWaalsContact CG2-CD1 3.43Å; V1509-L1556 HydrophobicContact CB-CD2 4.19Å; V1509-L1556 HydrophobicContact CG1-CD2 4.4Å; V1509-R1559 HydrophobicContact CG1-CB 4.01Å; V1509-R1559 PolarHBondContact O-NH1 3.31Å; V1509-L1560 HydrophobicContact CB-CD2 4.19Å; V1509-L1560 HydrophobicContact CG1-CD2 4.05Å; V1509-L1560 HydrophobicContact CG2-CD2 4.31Å; V1509-L1563 HydrophobicContact CG1-CD1 4.15Å; V1509-L1563 HydrophobicContact CG2-CD1 4.26Å
1510R90.9Very high91.2Very high21 Ų2127.8 Ų27.88%0.07914%0.137CC..G310 helixtrans-56.6-35.2175.9-173.6-179.2-73-74.610.2111.3Q1507 A1508 D1553 V1555 L1556 D1828Q1507-R1510 WeakPolarHBondContact O-CB 3.48Å; Q1507-R1510 PolarHBondContact O-N 3.3Å; A1508-R1510 PolarHBondContact O-N 3.3Å; R1510-D1553 IonicContact CZ-OD1 3.94Å; R1510-D1553 IonicContact CZ-OD2 2.63Å; R1510-D1553 IonicContact NH1-OD1 2.97Å; R1510-D1553 PolarHBondContact NH1-OD1 3.35Å; R1510-D1553 IonicContact NH1-OD2 2.85Å; R1510-D1553 PolarHBondContact NH1-OD2 2.73Å; R1510-D1553 IonicContact NH2-OD1 3.63Å; R1510-D1553 IonicContact NH2-OD2 3.88Å; R1510-D1553 PolarHBondContact NH2-OD2 3.09Å; R1510-V1555 HydrophobicContact CG-CB 4.25Å; R1510-V1555 HydrophobicContact CG-CG1 3.9Å; R1510-L1556 HydrophobicContact CB-CD2 3.86Å; R1510-L1556 HydrophobicContact CB-CG 4.29Å; R1510-D1828 PolarHBondContact NH2-O 3.23Å
1511Y87.1Confident91.7Very high29 Ų2924.4 Ų24.411%0.11412%0.124CC..G310 helixtrans-109.24.5-174.4-43.9-68.1000113.3F1472 R1474 S1477 A1508 V1509 S1513 D1828F1472-Y1511 WeakPolarHBondContact O-CD2 3.23Å; R1474-Y1511 HydrophobicContact CB-CE1 4.42Å; R1474-Y1511 HydrophobicContact CG-CD1 3.65Å; R1474-Y1511 HydrophobicContact CG-CE1 3.11Å; S1477-Y1511 WeakPolarHBondContact CB-O 3.37Å; S1477-Y1511 WeakPolarHBondContact OG-CB 3.37Å; S1477-Y1511 PolarHBondContact OG-O 3.28Å; A1508-Y1511 PolarHBondContact O-N 2.92Å; A1508-Y1511 VanDerWaalsContact O-N 3.13Å; V1509-Y1511 PolarHBondContact O-N 3.03Å; Y1511-S1513 PolarHBondContact O-N 2.93Å; Y1511-D1828 PolarHBondContact OH-OD2 3.36Å
1512D87.4Confident91.8Very high3 Ų326 Ų262%0.01613%0.132CC..  trans-78.277.9-179.7-174.735.3000111A1508 V1509 N1515 Y1516 M1517 S1518 R1559A1508-D1512 PolarHBondContact O-N 3.43Å; V1509-D1512 PolarHBondContact O-N 3.06Å; D1512-N1515 WeakPolarHBondContact OD1-CA 3.36Å; D1512-N1515 PolarHBondContact OD1-N 2.83Å; D1512-N1515 VanDerWaalsContact OD2-C 3.27Å; D1512-N1515 WeakPolarHBondContact OD2-CA 3.1Å; D1512-Y1516 PolarHBondContact OD1-N 3.48Å; D1512-M1517 HydrophobicContact CB-CB 3.89Å; D1512-M1517 VanDerWaalsContact CG-CB 3.48Å; D1512-M1517 VanDerWaalsContact CG-N 3.32Å; D1512-M1517 PolarHBondContact OD1-N 3.47Å; D1512-M1517 WeakPolarHBondContact OD2-CB 3.44Å; D1512-M1517 PolarHBondContact OD2-N 3.27Å; D1512-M1517 VanDerWaalsContact OD2-N 3.17Å; D1512-S1518 WeakPolarHBondContact OD2-CB 3.27Å; D1512-S1518 PolarHBondContact OD2-N 3.3Å; D1512-S1518 PolarHBondContact OD2-OG 2.86Å; D1512-R1559 PolarHBondContact O-NH1 2.89Å
1513S82.5Confident91.8Very high60 Ų6027.2 Ų27.242%0.4214%0.142SC..SBendtrans-71.7-31.5179.553.40000112.9Y1511Y1511-S1513 PolarHBondContact O-N 2.93Å
1514L86.3Confident91.8Very high82 Ų8226.8 Ų26.843%0.42914%0.139SC..SBendtrans-95.86.1-177-60.5176.7000114P1480 Y1516P1480-L1514 HydrophobicContact CB-CD1 3.88Å; L1514-Y1516 HydrophobicContact CB-CD2 3.66Å; L1514-Y1516 HydrophobicContact CB-CE2 3.85Å; L1514-Y1516 HydrophobicContact CD1-CD2 4.22Å; L1514-Y1516 HydrophobicContact CD1-CE2 3.88Å; L1514-Y1516 PolarHBondContact O-N 3.38Å
1515N90.2Very high91.7Very high93 Ų9326.9 Ų26.950%0.49714%0.14SC..SBendtrans61.316.2-178.7-58.8-52.3000115.9D1512 S1518 E1519D1512-N1515 WeakPolarHBondContact OD1-CA 3.36Å; D1512-N1515 PolarHBondContact OD1-N 2.83Å; D1512-N1515 VanDerWaalsContact OD2-C 3.27Å; D1512-N1515 WeakPolarHBondContact OD2-CA 3.1Å; N1515-S1518 PolarHBondContact O-N 2.92Å; N1515-E1519 WeakPolarHBondContact O-CB 3.09Å; N1515-E1519 WeakPolarHBondContact O-CG 3.17Å; N1515-E1519 PolarHBondContact O-N 2.96Å
1516Y91.6Very high91.5Very high76 Ų7630.4 Ų30.430%0.29816%0.164SC..Hα-helixtrans-65.2-41.1178.4-81.8-60.8000112.3A1483 Q1484 D1512 L1514 F1520A1483-Y1516 HydrophobicContact CB-CD2 3.69Å; A1483-Y1516 HydrophobicContact CB-CE2 4.31Å; A1483-Y1516 HydrophobicContact CB-CG 4.31Å; Q1484-Y1516 HydrophobicContact CG-CE1 3.86Å; Q1484-Y1516 HydrophobicContact CG-CE2 4.22Å; Q1484-Y1516 PolarHBondContact NE2-OH 2.95Å; D1512-Y1516 PolarHBondContact OD1-N 3.48Å; L1514-Y1516 HydrophobicContact CB-CD2 3.66Å; L1514-Y1516 HydrophobicContact CB-CE2 3.85Å; L1514-Y1516 HydrophobicContact CD1-CD2 4.22Å; L1514-Y1516 HydrophobicContact CD1-CE2 3.88Å; L1514-Y1516 PolarHBondContact O-N 3.38Å; Y1516-F1520 WeakPolarHBondContact O-CB 3.26Å; Y1516-F1520 PolarHBondContact O-N 3.37Å
1517M93.1Very high91.2Very high0 Ų036.4 Ų36.40%019%0.19CC..Hα-helixtrans-70.2-40.1176.7-171.156.57300111L1469 F1472 I1487 L1490 I1505 A1508 V1509 D1512 F1520 I1521L1469-M1517 HydrophobicContact CD2-CE 3.84Å; F1472-M1517 HydrophobicContact CB-CE 4.45Å; F1472-M1517 HydrophobicContact CD1-CB 4.37Å; F1472-M1517 HydrophobicContact CD1-CE 4.15Å; F1472-M1517 HydrophobicContact CD2-CE 3.33Å; F1472-M1517 HydrophobicContact CE1-CB 4.1Å; F1472-M1517 HydrophobicContact CE1-CE 4.22Å; F1472-M1517 HydrophobicContact CE2-CE 3.39Å; F1472-M1517 HydrophobicContact CG-CE 3.73Å; F1472-M1517 HydrophobicContact CZ-CB 4.49Å; F1472-M1517 HydrophobicContact CZ-CE 3.86Å; I1487-M1517 HydrophobicContact CD1-CE 4.04Å; I1487-M1517 HydrophobicContact CD1-SD 4.2Å; L1490-M1517 HydrophobicContact CD1-CE 3.94Å; I1505-M1517 HydrophobicContact CG2-SD 4.12Å; A1508-M1517 HydrophobicContact CB-CE 3.73Å; A1508-M1517 HydrophobicContact CB-CG 4.08Å; A1508-M1517 HydrophobicContact CB-SD 4.46Å; V1509-M1517 HydrophobicContact CG2-CG 4.03Å; D1512-M1517 HydrophobicContact CB-CB 3.89Å; D1512-M1517 VanDerWaalsContact CG-CB 3.48Å; D1512-M1517 VanDerWaalsContact CG-N 3.32Å; D1512-M1517 PolarHBondContact OD1-N 3.47Å; D1512-M1517 WeakPolarHBondContact OD2-CB 3.44Å; D1512-M1517 PolarHBondContact OD2-N 3.27Å; D1512-M1517 VanDerWaalsContact OD2-N 3.17Å; M1517-F1520 WeakPolarHBondContact O-CB 3.45Å; M1517-F1520 PolarHBondContact O-N 2.63Å; M1517-F1520 HydrophobicContact SD-CD1 3.62Å; M1517-F1520 HydrophobicContact SD-CE1 4.29Å; M1517-F1520 HydrophobicContact SD-CG 4.44Å; M1517-I1521 HydrophobicContact CG-CD1 4.23Å; M1517-I1521 WeakPolarHBondContact O-CG1 3.32Å; M1517-I1521 PolarHBondContact O-N 3.41Å
1518S94.3Very high91.2Very high12 Ų1236.6 Ų36.68%0.08419%0.192CC..Hα-helixtrans-59.3-47.6176.6-61.60000111.5D1512 N1515 I1521 L1522D1512-S1518 WeakPolarHBondContact OD2-CB 3.27Å; D1512-S1518 PolarHBondContact OD2-N 3.3Å; D1512-S1518 PolarHBondContact OD2-OG 2.86Å; N1515-S1518 PolarHBondContact O-N 2.92Å; S1518-I1521 PolarHBondContact O-N 2.98Å; S1518-L1522 WeakPolarHBondContact O-CG 3.4Å; S1518-L1522 PolarHBondContact O-N 3.23Å; S1518-L1522 VanDerWaalsContact O-N 3.07Å
1519E94Very high91.2Very high105 Ų10537.4 Ų37.449%0.49120%0.196SC..Hα-helixtrans-68-33.3175.1-71.6-59.7136.900112.7N1515 S1523N1515-E1519 WeakPolarHBondContact O-CB 3.09Å; N1515-E1519 WeakPolarHBondContact O-CG 3.17Å; N1515-E1519 PolarHBondContact O-N 2.96Å; E1519-S1523 VanDerWaalsContact O-CB 3.26Å; E1519-S1523 WeakPolarHBondContact O-CB 3.46Å; E1519-S1523 PolarHBondContact O-N 3.34Å
1520F94.6Very high91Very high3 Ų337.4 Ų37.41%0.01320%0.196CC..Hα-helixtrans-62.6-46.6172167.9-102.8000111.9I1487 L1490 K1491 L1498 I1505 Y1516 M1517 L1522 S1523 M1524I1487-F1520 HydrophobicContact CD1-CB 3.76Å; I1487-F1520 HydrophobicContact CD1-CG 4.08Å; I1487-F1520 HydrophobicContact CG2-CB 4.18Å; I1487-F1520 HydrophobicContact CG2-CD2 4.26Å; L1490-F1520 HydrophobicContact CB-CD2 4.42Å; L1490-F1520 HydrophobicContact CB-CE1 4.3Å; L1490-F1520 HydrophobicContact CB-CE2 3.68Å; L1490-F1520 HydrophobicContact CB-CZ 3.6Å; L1490-F1520 HydrophobicContact CD1-CE1 4.27Å; L1490-F1520 HydrophobicContact CD1-CZ 4.39Å; K1491-F1520 HydrophobicContact CG-CD2 3.7Å; K1491-F1520 HydrophobicContact CG-CE2 3.84Å; L1498-F1520 HydrophobicContact CD1-CE2 4.44Å; L1498-F1520 HydrophobicContact CD1-CZ 3.77Å; I1505-F1520 HydrophobicContact CD1-CE1 4.43Å; I1505-F1520 HydrophobicContact CG2-CE1 4.41Å; Y1516-F1520 WeakPolarHBondContact O-CB 3.26Å; Y1516-F1520 PolarHBondContact O-N 3.37Å; M1517-F1520 WeakPolarHBondContact O-CB 3.45Å; M1517-F1520 PolarHBondContact O-N 2.63Å; M1517-F1520 HydrophobicContact SD-CD1 3.62Å; M1517-F1520 HydrophobicContact SD-CE1 4.29Å; M1517-F1520 HydrophobicContact SD-CG 4.44Å; F1520-L1522 PolarHBondContact O-N 3.31Å; F1520-S1523 PolarHBondContact O-N 2.88Å; F1520-M1524 HydrophobicContact CD2-CG 3.82Å; F1520-M1524 HydrophobicContact CE1-CG 4.14Å; F1520-M1524 HydrophobicContact CE2-CE 4.39Å; F1520-M1524 HydrophobicContact CE2-CG 3.36Å; F1520-M1524 HydrophobicContact CE2-SD 3.9Å; F1520-M1524 HydrophobicContact CG-CG 4.4Å; F1520-M1524 HydrophobicContact CZ-CG 3.55Å; F1520-M1524 HydrophobicContact CZ-SD 4.42Å; F1520-M1524 WeakPolarHBondContact O-CG 3.18Å; F1520-M1524 PolarHBondContact O-N 2.83Å
1521I95.6Very high91Very high1 Ų136.5 Ų36.51%0.00519%0.192CC..Hα-helixtrans-58.8-48.1176.8-73.1169.5000110.4I1505 V1509 M1517 S1518 S1523 M1524 A1525 L1535 L1563 I1567I1505-I1521 HydrophobicContact CG2-CD1 3.92Å; I1505-I1521 HydrophobicContact CG2-CG1 3.77Å; V1509-I1521 HydrophobicContact CG2-CD1 3.43Å; V1509-I1521 VanDerWaalsContact CG2-CD1 3.43Å; M1517-I1521 HydrophobicContact CG-CD1 4.23Å; M1517-I1521 WeakPolarHBondContact O-CG1 3.32Å; M1517-I1521 PolarHBondContact O-N 3.41Å; S1518-I1521 PolarHBondContact O-N 2.98Å; I1521-S1523 VanDerWaalsContact C-N 3.34Å; I1521-S1523 PolarHBondContact O-N 3.44Å; I1521-M1524 PolarHBondContact O-N 2.87Å; I1521-A1525 WeakPolarHBondContact O-CB 3.15Å; I1521-A1525 PolarHBondContact O-N 3.42Å; I1521-L1535 HydrophobicContact CG2-CD1 4.28Å; I1521-L1563 HydrophobicContact CD1-CD1 4.34Å; I1521-I1567 HydrophobicContact CG2-CD1 4.05Å
1522L94.8Very high91.4Very high34 Ų3435.1 Ų35.118%0.17819%0.187CC..Hα-helixtrans-59.9-44.9176.9-67174.3000111.7S1518 F1520 S1526 L1563 K1566 I1567S1518-L1522 WeakPolarHBondContact O-CG 3.4Å; S1518-L1522 PolarHBondContact O-N 3.23Å; S1518-L1522 VanDerWaalsContact O-N 3.07Å; F1520-L1522 PolarHBondContact O-N 3.31Å; L1522-S1526 PolarHBondContact O-N 3.47Å; L1522-S1526 VanDerWaalsContact O-N 3.09Å; L1522-L1563 HydrophobicContact CD1-CD2 4.16Å; L1522-L1563 HydrophobicContact CD2-CD2 3.95Å; L1522-L1563 HydrophobicContact CG-CD2 3.82Å; L1522-K1566 HydrophobicContact CD1-CD 3.8Å; L1522-K1566 HydrophobicContact CD2-CB 3.65Å; L1522-K1566 HydrophobicContact CD2-CD 4.29Å; L1522-I1567 HydrophobicContact CD2-CG1 3.78Å
1523S93.3Very high91.7Very high35 Ų3535 Ų3525%0.24519%0.186CC..Hα-helixtrans-62.6-44.1177.9-175.50000112.1E1519 F1520 I1521 S1526 K1527E1519-S1523 VanDerWaalsContact O-CB 3.26Å; E1519-S1523 WeakPolarHBondContact O-CB 3.46Å; E1519-S1523 PolarHBondContact O-N 3.34Å; F1520-S1523 PolarHBondContact O-N 2.88Å; I1521-S1523 VanDerWaalsContact C-N 3.34Å; I1521-S1523 PolarHBondContact O-N 3.44Å; S1523-S1526 PolarHBondContact O-N 2.96Å; S1523-S1526 PolarHBondContact O-OG 3.28Å; S1523-K1527 WeakPolarHBondContact O-CG 3.38Å
1524M91.8Very high92.2Very high4 Ų433 Ų332%0.0217%0.17CC..Hα-helixtrans-74.2-38.1-179.3-66.9-5495.300112.6K1491 L1498 F1520 I1521 S1526 K1527 S1528 L1531K1491-M1524 HydrophobicContact CG-CE 4.18Å; L1498-M1524 HydrophobicContact CD1-CG 4.3Å; L1498-M1524 HydrophobicContact CD1-SD 4.3Å; F1520-M1524 HydrophobicContact CD2-CG 3.82Å; F1520-M1524 HydrophobicContact CE1-CG 4.14Å; F1520-M1524 HydrophobicContact CE2-CE 4.39Å; F1520-M1524 HydrophobicContact CE2-CG 3.36Å; F1520-M1524 HydrophobicContact CE2-SD 3.9Å; F1520-M1524 HydrophobicContact CG-CG 4.4Å; F1520-M1524 HydrophobicContact CZ-CG 3.55Å; F1520-M1524 HydrophobicContact CZ-SD 4.42Å; F1520-M1524 WeakPolarHBondContact O-CG 3.18Å; F1520-M1524 PolarHBondContact O-N 2.83Å; I1521-M1524 PolarHBondContact O-N 2.87Å; M1524-S1526 PolarHBondContact O-N 3.38Å; M1524-K1527 HydrophobicContact CE-CD 3.76Å; M1524-K1527 PolarHBondContact O-N 2.93Å; M1524-K1527 HydrophobicContact SD-CD 4.36Å; M1524-S1528 PolarHBondContact O-N 3.45Å; M1524-S1528 VanDerWaalsContact O-N 3.13Å; M1524-L1531 HydrophobicContact CB-CD2 3.78Å
1525A92.5Very high92.6Very high2 Ų229.2 Ų29.22%0.01715%0.151CC..Hα-helixtrans-61.5-32.5174.200000112.1I1521 K1527 A1532 I1567I1521-A1525 WeakPolarHBondContact O-CB 3.15Å; I1521-A1525 PolarHBondContact O-N 3.42Å; A1525-K1527 VanDerWaalsContact C-N 3.27Å; A1525-K1527 PolarHBondContact O-N 2.9Å; A1525-A1532 HydrophobicContact CB-CB 3.83Å; A1525-I1567 HydrophobicContact CB-CD1 3.93Å; A1525-I1567 HydrophobicContact CB-CG1 4.01Å; A1525-I1567 HydrophobicContact CB-CG2 4.13Å
1526S89.8Confident92.8Very high77 Ų7724.9 Ų24.954%0.53813%0.127SC..Hα-helixtrans-70.2-21.7173.875.70000114L1522 S1523 M1524L1522-S1526 PolarHBondContact O-N 3.47Å; L1522-S1526 VanDerWaalsContact O-N 3.09Å; S1523-S1526 PolarHBondContact O-N 2.96Å; S1523-S1526 PolarHBondContact O-OG 3.28Å; M1524-S1526 PolarHBondContact O-N 3.38Å
1527K89Confident93Very high127 Ų12721.5 Ų21.555%0.55211%0.114SC*.Hα-helixtrans-93.5-27.4-177.3-68.9-178.9-174.6-172.20113.9S1523 M1524 A1525S1523-K1527 WeakPolarHBondContact O-CG 3.38Å; M1524-K1527 HydrophobicContact CE-CD 3.76Å; M1524-K1527 PolarHBondContact O-N 2.93Å; M1524-K1527 HydrophobicContact SD-CD 4.36Å; A1525-K1527 VanDerWaalsContact C-N 3.27Å; A1525-K1527 PolarHBondContact O-N 2.9Å
1528S91.7Very high93Very high5 Ų521.6 Ų21.64%0.03512%0.115CC..  trans-140.2120.2177.4171.40000111.2M1524 L1531 A1532 E1666M1524-S1528 PolarHBondContact O-N 3.45Å; M1524-S1528 VanDerWaalsContact O-N 3.13Å; S1528-L1531 PolarHBondContact O-N 3.49Å; S1528-L1531 PolarHBondContact OG-N 2.79Å; S1528-A1532 WeakPolarHBondContact O-CB 3.36Å; S1528-A1532 PolarHBondContact O-N 3.18Å; S1528-E1666 VanDerWaalsContact CA-OE1 3.23Å; S1528-E1666 WeakPolarHBondContact CA-OE1 3.06Å; S1528-E1666 WeakPolarHBondContact CB-OE2 3.3Å; S1528-E1666 PolarHBondContact OG-OE2 3.18Å
1529Q91.3Very high93.1Very high16 Ų1621 Ų218%0.07511%0.111CC..Hα-helixtrans-69.7-36.4178.4-57.6-49.8-50.200111.7A1532 H1533 A1575 F1578 E1666 M1670Q1529-A1532 WeakPolarHBondContact O-CB 3.31Å; Q1529-A1532 PolarHBondContact O-N 3.02Å; Q1529-H1533 PolarHBondContact O-CD2 3.28Å; Q1529-H1533 VanDerWaalsContact O-CD2 3.23Å; Q1529-H1533 PolarHBondContact O-N 2.86Å; Q1529-A1575 HydrophobicContact CG-CB 4.08Å; Q1529-F1578 HydrophobicContact CB-CD1 3.95Å; Q1529-F1578 HydrophobicContact CB-CE1 4.1Å; Q1529-E1666 HydrophobicContact CB-CG 4.38Å; Q1529-E1666 PolarHBondContact N-OE1 3.4Å; Q1529-M1670 HydrophobicContact CG-CE 4.47Å; Q1529-M1670 HydrophobicContact CG-SD 3.89Å
1530L89.8Confident93.1Very high0 Ų019.1 Ų19.10%010%0.102CC..Hα-helixtrans-62.1-45173.9-80.7164.6000111.3A1532 H1533 Q1534 F1578 Y1623 P1628 V1662 V1665 E1666L1530-A1532 VanDerWaalsContact C-N 3.35Å; L1530-H1533 PolarHBondContact O-N 3.23Å; L1530-Q1534 VanDerWaalsContact O-CG 3.29Å; L1530-Q1534 WeakPolarHBondContact O-CG 3.47Å; L1530-Q1534 PolarHBondContact O-N 3.32Å; L1530-Q1534 VanDerWaalsContact O-N 3.14Å; L1530-F1578 HydrophobicContact CD2-CZ 4.42Å; L1530-Y1623 HydrophobicContact CD2-CD1 3.55Å; L1530-Y1623 HydrophobicContact CD2-CD2 4.1Å; L1530-Y1623 HydrophobicContact CD2-CE1 3.26Å; L1530-Y1623 HydrophobicContact CD2-CE2 3.85Å; L1530-Y1623 HydrophobicContact CD2-CG 3.95Å; L1530-Y1623 VanDerWaalsContact CD2-CZ 3.41Å; L1530-P1628 HydrophobicContact CD2-CB 4.27Å; L1530-V1662 HydrophobicContact CB-CG1 4.43Å; L1530-V1662 HydrophobicContact CD1-CB 4.48Å; L1530-V1662 HydrophobicContact CD1-CG1 3.61Å; L1530-V1662 WeakPolarHBondContact CD1-O 3.2Å; L1530-V1665 HydrophobicContact CD1-CB 4.12Å; L1530-V1665 HydrophobicContact CD1-CG1 4.11Å; L1530-V1665 HydrophobicContact CD2-CG1 4.33Å; L1530-E1666 HydrophobicContact CD1-CB 3.79Å; L1530-E1666 HydrophobicContact CD1-CG 4.42Å; L1530-E1666 HydrophobicContact CG-CB 4.41Å
1531L91.3Very high93Very high3 Ų319.1 Ų19.12%0.01610%0.102CC..Hα-helixtrans-63.3-41.7174.4-178.860.3000111.2P1495 L1499 I1502 M1524 S1528 Q1534 L1535P1495-L1531 HydrophobicContact CB-CB 4.49Å; P1495-L1531 HydrophobicContact CB-CD2 3.93Å; L1499-L1531 HydrophobicContact CD2-CB 4.24Å; L1499-L1531 HydrophobicContact CD2-CD1 3.79Å; L1499-L1531 HydrophobicContact CG-CD1 4.35Å; I1502-L1531 HydrophobicContact CD1-CD1 3.88Å; I1502-L1531 HydrophobicContact CG1-CD1 4.01Å; M1524-L1531 HydrophobicContact CB-CD2 3.78Å; S1528-L1531 PolarHBondContact O-N 3.49Å; S1528-L1531 PolarHBondContact OG-N 2.79Å; L1531-Q1534 PolarHBondContact O-N 3.48Å; L1531-L1535 HydrophobicContact CD1-CD1 4.1Å; L1531-L1535 HydrophobicContact CD1-CG 4.21Å; L1531-L1535 HydrophobicContact CG-CD1 3.82Å; L1531-L1535 HydrophobicContact CG-CG 4.4Å; L1531-L1535 VanDerWaalsContact O-CB 3.3Å; L1531-L1535 WeakPolarHBondContact O-CB 3.42Å; L1531-L1535 WeakPolarHBondContact O-CD1 3.42Å; L1531-L1535 VanDerWaalsContact O-CG 3.26Å; L1531-L1535 WeakPolarHBondContact O-CG 3.4Å; L1531-L1535 PolarHBondContact O-N 3.24Å
1532A94.2Very high92.9Very high0 Ų019.3 Ų19.30%010%0.103CC..Hα-helixtrans-59.6-46.5176.500000112.4A1525 S1528 Q1529 L1530 L1535 I1536 I1567A1525-A1532 HydrophobicContact CB-CB 3.83Å; S1528-A1532 WeakPolarHBondContact O-CB 3.36Å; S1528-A1532 PolarHBondContact O-N 3.18Å; Q1529-A1532 WeakPolarHBondContact O-CB 3.31Å; Q1529-A1532 PolarHBondContact O-N 3.02Å; L1530-A1532 VanDerWaalsContact C-N 3.35Å; A1532-L1535 PolarHBondContact O-N 3.02Å; A1532-I1536 WeakPolarHBondContact O-CD1 3.07Å; A1532-I1536 VanDerWaalsContact O-CG1 3.22Å; A1532-I1536 WeakPolarHBondContact O-CG1 3.42Å; A1532-I1536 PolarHBondContact O-N 2.66Å; A1532-I1567 HydrophobicContact CB-CG2 4.28Å
1533H94.1Very high92.9Very high0 Ų018.5 Ų18.50%010%0.098CC..Hα-helixtrans-60.8-48.1178.6-65.6174.6000112Q1529 L1530 L1535 I1536 W1537 F1578 H1579 F1583 Y1623Q1529-H1533 PolarHBondContact O-CD2 3.28Å; Q1529-H1533 VanDerWaalsContact O-CD2 3.23Å; Q1529-H1533 PolarHBondContact O-N 2.86Å; L1530-H1533 PolarHBondContact O-N 3.23Å; H1533-L1535 PolarHBondContact O-N 3.26Å; H1533-I1536 PolarHBondContact O-N 3.16Å; H1533-W1537 PolarHBondContact O-N 2.84Å; H1533-W1537 VanDerWaalsContact O-N 3.08Å; H1533-F1578 AromaticContact CE1-CD1 3.48Å; H1533-F1578 VanDerWaalsContact CE1-CD1 3.48Å; H1533-F1578 WeakPolarHBondContact CE1-CD1 3.39Å; H1533-F1578 AromaticContact CE1-CE1 3.5Å; H1533-F1578 AromaticContact CE1-CG 3.76Å; H1533-F1578 AromaticContact CE1-CZ 3.8Å; H1533-F1578 AromaticContact ND1-CE1 3.99Å; H1533-H1579 AromaticContact CD2-CD2 3.96Å; H1533-H1579 VanDerWaalsContact NE2-CA 3.25Å; H1533-H1579 WeakPolarHBondContact NE2-CA 3.17Å; H1533-H1579 WeakPolarHBondContact NE2-CB 3Å; H1533-F1583 HydrophobicContact CB-CE2 3.89Å; H1533-F1583 HydrophobicContact CB-CZ 4.36Å; H1533-F1583 AromaticContact CD2-CE2 3.94Å; H1533-F1583 AromaticContact CG-CE2 3.86Å; H1533-Y1623 WeakPolarHBondContact CB-OH 3.27Å; H1533-Y1623 AromaticContact ND1-CE1 3.85Å
1534Q93Very high92.8Very high18 Ų1819.6 Ų19.68%0.08410%0.098CC..Hα-helixtrans-65-38.9179.5-67-76.5-4.200111.9L1499 I1502 L1530 L1531 N1538 P1625 V1732L1499-Q1534 HydrophobicContact CD2-CB 4.26Å; L1499-Q1534 HydrophobicContact CD2-CG 4.08Å; I1502-Q1534 HydrophobicContact CD1-CB 3.35Å; I1502-Q1534 HydrophobicContact CD1-CG 4.42Å; L1530-Q1534 VanDerWaalsContact O-CG 3.29Å; L1530-Q1534 WeakPolarHBondContact O-CG 3.47Å; L1530-Q1534 PolarHBondContact O-N 3.32Å; L1530-Q1534 VanDerWaalsContact O-N 3.14Å; L1531-Q1534 PolarHBondContact O-N 3.48Å; Q1534-N1538 WeakPolarHBondContact O-CB 3.45Å; Q1534-N1538 PolarHBondContact O-N 3.2Å; Q1534-N1538 VanDerWaalsContact O-N 3.08Å; Q1534-P1625 PolarHBondContact NE2-O 3.28Å; Q1534-V1732 VanDerWaalsContact OE1-CG2 3.3Å
1535L94.7Very high92.5Very high3 Ų322.4 Ų22.42%0.01612%0.115CC..Hα-helixtrans-61.4-44.9172.4-79.9165.3000111.2I1502 I1505 V1506 I1521 L1531 A1532 H1533 N1538 M1539I1502-L1535 HydrophobicContact CG1-CD2 4.28Å; I1502-L1535 HydrophobicContact CG1-CG 4.45Å; I1502-L1535 HydrophobicContact CG2-CD2 4.18Å; I1505-L1535 HydrophobicContact CG2-CD2 4.37Å; V1506-L1535 HydrophobicContact CG2-CD2 4.12Å; I1521-L1535 HydrophobicContact CG2-CD1 4.28Å; L1531-L1535 HydrophobicContact CD1-CD1 4.1Å; L1531-L1535 HydrophobicContact CD1-CG 4.21Å; L1531-L1535 HydrophobicContact CG-CD1 3.82Å; L1531-L1535 HydrophobicContact CG-CG 4.4Å; L1531-L1535 VanDerWaalsContact O-CB 3.3Å; L1531-L1535 WeakPolarHBondContact O-CB 3.42Å; L1531-L1535 WeakPolarHBondContact O-CD1 3.42Å; L1531-L1535 VanDerWaalsContact O-CG 3.26Å; L1531-L1535 WeakPolarHBondContact O-CG 3.4Å; L1531-L1535 PolarHBondContact O-N 3.24Å; A1532-L1535 PolarHBondContact O-N 3.02Å; H1533-L1535 PolarHBondContact O-N 3.26Å; L1535-N1538 PolarHBondContact O-N 2.92Å; L1535-M1539 HydrophobicContact CB-CE 3.98Å; L1535-M1539 VanDerWaalsContact O-CB 3.28Å; L1535-M1539 WeakPolarHBondContact O-CB 3.18Å; L1535-M1539 WeakPolarHBondContact O-CE 3.36Å; L1535-M1539 VanDerWaalsContact O-CG 3.22Å; L1535-M1539 WeakPolarHBondContact O-CG 3.35Å; L1535-M1539 PolarHBondContact O-N 3.19Å
1536I95.4Very high92.1Very high1 Ų123.7 Ų23.71%0.00512%0.122CC..Hα-helixtrans-60.2-49.6179.5-70.2162.7000110.8A1532 H1533 N1538 M1539 Q1540 V1564 I1567 V1568 F1583A1532-I1536 WeakPolarHBondContact O-CD1 3.07Å; A1532-I1536 VanDerWaalsContact O-CG1 3.22Å; A1532-I1536 WeakPolarHBondContact O-CG1 3.42Å; A1532-I1536 PolarHBondContact O-N 2.66Å; H1533-I1536 PolarHBondContact O-N 3.16Å; I1536-N1538 VanDerWaalsContact C-N 3.34Å; I1536-N1538 PolarHBondContact O-N 3.07Å; I1536-M1539 HydrophobicContact CG1-CE 4.49Å; I1536-M1539 PolarHBondContact O-N 2.84Å; I1536-Q1540 HydrophobicContact CG2-CG 4.25Å; I1536-Q1540 WeakPolarHBondContact O-CB 3.44Å; I1536-Q1540 VanDerWaalsContact O-CG 3.27Å; I1536-Q1540 WeakPolarHBondContact O-CG 3.28Å; I1536-Q1540 PolarHBondContact O-N 2.74Å; I1536-V1564 HydrophobicContact CG2-CG1 4.28Å; I1536-I1567 HydrophobicContact CD1-CG2 3.98Å; I1536-I1567 HydrophobicContact CG1-CG2 4.39Å; I1536-V1568 HydrophobicContact CD1-CG2 4.12Å; I1536-F1583 HydrophobicContact CB-CE1 4.42Å; I1536-F1583 HydrophobicContact CB-CZ 3.99Å; I1536-F1583 HydrophobicContact CG2-CE1 3.71Å; I1536-F1583 HydrophobicContact CG2-CZ 3.77Å
1537W94.5Very high91.7Very high5 Ų523.6 Ų23.62%0.01911%0.113CC..Hα-helixtrans-57.3-46.5177-77.9-32.5000112.5H1533 Q1540 T1541 Q1582 F1583 Y1623 P1625 V1732 T1734H1533-W1537 PolarHBondContact O-N 2.84Å; H1533-W1537 VanDerWaalsContact O-N 3.08Å; W1537-Q1540 PolarHBondContact O-N 3.22Å; W1537-T1541 PolarHBondContact O-N 3.19Å; W1537-T1541 PolarHBondContact O-OG1 3.47Å; W1537-Q1582 HydrophobicContact CH2-CG 4.15Å; W1537-Q1582 HydrophobicContact CZ2-CG 4.18Å; W1537-F1583 AromaticContact CD1-CE1 3.39Å; W1537-F1583 AromaticContact CD1-CZ 3.8Å; W1537-F1583 HydrophobicContact CD2-CZ 4.28Å; W1537-F1583 AromaticContact CE2-CE1 3.9Å; W1537-F1583 AromaticContact CE2-CZ 3.77Å; W1537-F1583 HydrophobicContact CG-CE1 4.25Å; W1537-F1583 HydrophobicContact CG-CZ 4.26Å; W1537-F1583 HydrophobicContact CZ2-CE2 4.23Å; W1537-F1583 HydrophobicContact CZ2-CZ 4.28Å; W1537-F1583 AromaticContact NE1-CD1 3.55Å; W1537-F1583 AromaticContact NE1-CE1 3.11Å; W1537-F1583 AromaticContact NE1-CZ 3.45Å; W1537-Y1623 HydrophobicContact CH2-CE2 4.35Å; W1537-Y1623 WeakPolarHBondContact CH2-OH 3.46Å; W1537-Y1623 HydrophobicContact CZ3-CE2 4.31Å; W1537-Y1623 WeakPolarHBondContact CZ3-OH 3.28Å; W1537-P1625 HydrophobicContact CE3-CB 4.34Å; W1537-P1625 HydrophobicContact CH2-CB 3.59Å; W1537-P1625 HydrophobicContact CH2-CG 3.73Å; W1537-P1625 HydrophobicContact CZ2-CB 4.24Å; W1537-P1625 HydrophobicContact CZ2-CG 4.12Å; W1537-P1625 HydrophobicContact CZ3-CB 3.63Å; W1537-P1625 HydrophobicContact CZ3-CG 4.29Å; W1537-V1732 HydrophobicContact CE3-CG2 4.28Å; W1537-T1734 HydrophobicContact CD2-CG2 4.22Å; W1537-T1734 HydrophobicContact CG-CG2 4.26Å
1538N94.2Very high91.3Very high3 Ų322.9 Ų22.92%0.01612%0.115CC..Hα-helixtrans-68-38.7179.8-159.5-82.9000111.8I1502 V1506 Q1534 L1535 I1536 T1541 N1542I1502-N1538 HydrophobicContact CG2-CB 3.48Å; I1502-N1538 VanDerWaalsContact CG2-CB 3.48Å; V1506-N1538 HydrophobicContact CG2-CB 4.25Å; Q1534-N1538 WeakPolarHBondContact O-CB 3.45Å; Q1534-N1538 PolarHBondContact O-N 3.2Å; Q1534-N1538 VanDerWaalsContact O-N 3.08Å; L1535-N1538 PolarHBondContact O-N 2.92Å; I1536-N1538 VanDerWaalsContact C-N 3.34Å; I1536-N1538 PolarHBondContact O-N 3.07Å; N1538-T1541 PolarHBondContact O-N 2.68Å; N1538-N1542 PolarHBondContact O-N 2.92Å; N1538-N1542 PolarHBondContact O-ND2 3.44Å; N1538-N1542 PolarHBondContact OD1-ND2 3.1Å
1539M95.8Very high91Very high0 Ų023.6 Ų23.60%012%0.123CC..Hα-helixtrans-65.7-46.2175.6-76-171-73.200111.9V1506 L1535 I1536 T1541 N1542 M1543 L1560 L1563 V1564 I1567V1506-M1539 HydrophobicContact CG1-CG 4.04Å; V1506-M1539 HydrophobicContact CG2-CG 3.79Å; L1535-M1539 HydrophobicContact CB-CE 3.98Å; L1535-M1539 VanDerWaalsContact O-CB 3.28Å; L1535-M1539 WeakPolarHBondContact O-CB 3.18Å; L1535-M1539 WeakPolarHBondContact O-CE 3.36Å; L1535-M1539 VanDerWaalsContact O-CG 3.22Å; L1535-M1539 WeakPolarHBondContact O-CG 3.35Å; L1535-M1539 PolarHBondContact O-N 3.19Å; I1536-M1539 HydrophobicContact CG1-CE 4.49Å; I1536-M1539 PolarHBondContact O-N 2.84Å; M1539-T1541 PolarHBondContact O-N 3.29Å; M1539-N1542 CarbonylContact O-C 3.37Å; M1539-N1542 PolarHBondContact O-N 3.31Å; M1539-N1542 VanDerWaalsContact O-N 3.15Å; M1539-M1543 VanDerWaalsContact O-CG 3.3Å; M1539-M1543 WeakPolarHBondContact O-CG 3.21Å; M1539-M1543 PolarHBondContact O-N 3.38Å; M1539-L1560 HydrophobicContact CB-CB 4.34Å; M1539-L1560 HydrophobicContact CB-CD1 4.29Å; M1539-L1560 HydrophobicContact CG-CD1 4.37Å; M1539-L1560 HydrophobicContact CG-CD2 3.9Å; M1539-L1560 HydrophobicContact CG-CG 4.5Å; M1539-L1560 HydrophobicContact SD-CD2 3.95Å; M1539-L1563 HydrophobicContact SD-CB 4.07Å; M1539-L1563 HydrophobicContact SD-CD1 4.46Å; M1539-V1564 HydrophobicContact CB-CG2 3.8Å; M1539-V1564 HydrophobicContact CE-CG2 3.85Å; M1539-V1564 HydrophobicContact SD-CG2 4.15Å; M1539-I1567 HydrophobicContact CE-CD1 3.6Å
1540Q93.6Very high90.8Very high65 Ų6529.7 Ų29.730%0.30415%0.15SC..Hα-helixtrans-58.2-38.7176-75.4174.2-15.300111.7I1536 W1537I1536-Q1540 HydrophobicContact CG2-CG 4.25Å; I1536-Q1540 WeakPolarHBondContact O-CB 3.44Å; I1536-Q1540 VanDerWaalsContact O-CG 3.27Å; I1536-Q1540 WeakPolarHBondContact O-CG 3.28Å; I1536-Q1540 PolarHBondContact O-N 2.74Å; W1537-Q1540 PolarHBondContact O-N 3.22Å
1541T92.5Very high90.7Very high3 Ų335.7 Ų35.72%0.01818%0.177CC..Hα-helixtrans-65.3-48.3174.3-53.80000111.4W1537 N1538 M1539 M1543 Y1544 R1701 A1733 A1735W1537-T1541 PolarHBondContact O-N 3.19Å; W1537-T1541 PolarHBondContact O-OG1 3.47Å; N1538-T1541 PolarHBondContact O-N 2.68Å; M1539-T1541 PolarHBondContact O-N 3.29Å; T1541-M1543 VanDerWaalsContact C-N 3.28Å; T1541-M1543 PolarHBondContact O-N 2.94Å; T1541-Y1544 PolarHBondContact O-N 2.74Å; T1541-R1701 HydrophobicContact CG2-CG 4.09Å; T1541-A1733 HydrophobicContact CG2-CB 3.82Å; T1541-A1735 WeakPolarHBondContact OG1-CA 3.4Å; T1541-A1735 PolarHBondContact OG1-N 3.05Å
1542N93.4Very high90.8Very high4 Ų441.4 Ų41.42%0.02120%0.202CC..Hα-helixtrans-78.9-3.5-176.2-73.8-77.3000114.8V1506 Q1507 N1538 M1539 Y1544 L1560 R1701V1506-N1542 HydrophobicContact CG1-CB 3.93Å; Q1507-N1542 PolarHBondContact NE2-OD1 3.36Å; N1538-N1542 PolarHBondContact O-N 2.92Å; N1538-N1542 PolarHBondContact O-ND2 3.44Å; N1538-N1542 PolarHBondContact OD1-ND2 3.1Å; M1539-N1542 CarbonylContact O-C 3.37Å; M1539-N1542 PolarHBondContact O-N 3.31Å; M1539-N1542 VanDerWaalsContact O-N 3.15Å; N1542-Y1544 PolarHBondContact O-N 3.42Å; N1542-L1560 HydrophobicContact CB-CD1 4Å; N1542-R1701 PolarHBondContact OD1-NH1 3.1Å
1543M94.3Very high90.7Very high17 Ų1742 Ų428%0.08421%0.205CC..THydrogen-bonded Turntrans-65-21.4168.9-79.4173.266.600112.1M1539 T1541 D1553 F1557 L1560M1539-M1543 VanDerWaalsContact O-CG 3.3Å; M1539-M1543 WeakPolarHBondContact O-CG 3.21Å; M1539-M1543 PolarHBondContact O-N 3.38Å; T1541-M1543 VanDerWaalsContact C-N 3.28Å; T1541-M1543 PolarHBondContact O-N 2.94Å; M1543-D1553 PolarHBondContact O-N 3Å; M1543-F1557 HydrophobicContact CB-CD2 3.91Å; M1543-F1557 HydrophobicContact CB-CE2 4.42Å; M1543-F1557 HydrophobicContact CE-CD2 3.77Å; M1543-F1557 HydrophobicContact CE-CE1 4.36Å; M1543-F1557 HydrophobicContact CE-CE2 3.46Å; M1543-F1557 VanDerWaalsContact CE-CE2 3.46Å; M1543-F1557 HydrophobicContact CE-CG 4.34Å; M1543-F1557 HydrophobicContact CE-CZ 3.78Å; M1543-F1557 HydrophobicContact CG-CD2 4.48Å; M1543-F1557 WeakPolarHBondContact O-CD2 3.26Å; M1543-L1560 HydrophobicContact CG-CB 3.77Å; M1543-L1560 HydrophobicContact CG-CD1 4.33Å; M1543-L1560 HydrophobicContact SD-CB 4.48Å
1544Y92Very high90.4Very high59 Ų5947.7 Ų47.723%0.23124%0.242CC..BIsolated β-bridgetrans-125.1151.1-176-55.4-91.7000111.1T1541 N1542 G1549 H1551 K1552 F1557 P1736T1541-Y1544 PolarHBondContact O-N 2.74Å; N1542-Y1544 PolarHBondContact O-N 3.42Å; Y1544-G1549 WeakPolarHBondContact CD1-O 3.3Å; Y1544-G1549 WeakPolarHBondContact CE1-O 3.49Å; Y1544-H1551 CarbonylContact C-O 3.59Å; Y1544-H1551 VanDerWaalsContact CA-O 3.29Å; Y1544-H1551 WeakPolarHBondContact CA-O 3.35Å; Y1544-K1552 HydrophobicContact CD1-CG 4.28Å; Y1544-K1552 HydrophobicContact CE1-CG 4.06Å; Y1544-F1557 HydrophobicContact CE1-CD2 4.24Å; Y1544-F1557 AromaticContact CE1-CE2 3.74Å; Y1544-F1557 HydrophobicContact CE1-CE2 3.74Å; Y1544-F1557 HydrophobicContact CE2-CE2 4.29Å; Y1544-F1557 AromaticContact CZ-CE2 3.63Å; Y1544-P1736 HydrophobicContact CD2-CB 4.41Å; Y1544-P1736 HydrophobicContact CD2-CG 3.32Å; Y1544-P1736 HydrophobicContact CE2-CG 4.03Å; Y1544-P1736 HydrophobicContact CG-CG 3.92Å
1545T85.3Confident90.3Very high63 Ų6349.5 Ų49.539%0.38725%0.254SS..SBendtrans-95-20.8178.954.60000112.9H1551 D1553T1545-H1551 PolarHBondContact N-O 3.14Å; T1545-H1551 WeakPolarHBondContact OG1-CB 3.39Å; T1545-H1551 PolarHBondContact OG1-O 2.78Å; T1545-D1553 HydrophobicContact CG2-CB 4.15Å
1546D84.3Confident90.2Very high29 Ų2949.3 Ų49.316%0.15525%0.253CS..SBendtrans-107.2155.8-177.766.5-48.8000112.3D1548 G1549 K1550 H1551D1546-D1548 PolarHBondContact O-N 2.86Å; D1546-D1548 WeakPolarHBondContact OD2-CB 3.38Å; D1546-G1549 PolarHBondContact O-N 3.41Å; D1546-G1549 PolarHBondContact OD2-N 3.19Å; D1546-K1550 PolarHBondContact OD1-N 3.17Å; D1546-K1550 VanDerWaalsContact OD1-N 3.1Å; D1546-K1550 WeakPolarHBondContact OD2-CB 3.37Å; D1546-K1550 PolarHBondContact OD2-N 3.47Å; D1546-H1551 HydrophobicContact CB-CB 4.26Å; D1546-H1551 WeakPolarHBondContact OD1-CA 3.31Å; D1546-H1551 WeakPolarHBondContact OD1-CB 3.26Å; D1546-H1551 PolarHBondContact OD1-N 3.26Å; D1546-H1551 PolarHBondContact OD2-N 3.21Å
1547E81Confident90.2Very high74 Ų7450.4 Ų50.435%0.34626%0.258SS..THydrogen-bonded Turntrans-67-25.1179.3-54.2-173.8142.100112.9K1648 D1699 P1736 G1737E1547-K1648 IonicContact OE1-NZ 2.6Å; E1547-K1648 IonicContact OE2-NZ 2.76Å; E1547-K1648 PolarHBondContact OE2-NZ 3.11Å; E1547-D1699 HydrophobicContact CG-CB 4.04Å; E1547-D1699 PolarHBondContact OE1-N 2.9Å; E1547-P1736 CarbonylContact O-C 3.57Å; E1547-P1736 VanDerWaalsContact O-C 3.24Å; E1547-G1737 WeakPolarHBondContact O-CA 3.49Å; E1547-G1737 PolarHBondContact O-N 3.22Å
1548D80.8Confident90.2Very high112 Ų11255.6 Ų55.660%0.59928%0.283SS*.THydrogen-bonded Turntrans-83.3-9.8-179.5-79.6-10.4000113.2D1546 K1550D1546-D1548 PolarHBondContact O-N 2.86Å; D1546-D1548 WeakPolarHBondContact OD2-CB 3.38Å; D1548-K1550 HydrophobicContact CB-CD 4.04Å; D1548-K1550 HydrophobicContact CB-CG 4.11Å; D1548-K1550 IonicContact OD2-NZ 3.96Å; D1548-K1550 PolarHBondContact OD2-NZ 2.99Å
1549G84.9Confident90.2Very high21 Ų2159.7 Ų59.722%0.21630%0.298CS..SBendtrans66.930.6-177.100000114.7Y1544 D1546Y1544-G1549 WeakPolarHBondContact CD1-O 3.3Å; Y1544-G1549 WeakPolarHBondContact CE1-O 3.49Å; D1546-G1549 PolarHBondContact O-N 3.41Å; D1546-G1549 PolarHBondContact OD2-N 3.19Å
1550K87.5Confident90.2Very high144 Ų14459.7 Ų59.763%0.62630%0.298SS*.  trans-99-33.5179.3-65.7171.3-174.7148.70112.7D1546 D1548D1546-K1550 PolarHBondContact OD1-N 3.17Å; D1546-K1550 VanDerWaalsContact OD1-N 3.1Å; D1546-K1550 WeakPolarHBondContact OD2-CB 3.37Å; D1546-K1550 PolarHBondContact OD2-N 3.47Å; D1548-K1550 HydrophobicContact CB-CD 4.04Å; D1548-K1550 HydrophobicContact CB-CG 4.11Å; D1548-K1550 IonicContact OD2-NZ 3.96Å; D1548-K1550 PolarHBondContact OD2-NZ 2.99Å
1551H88Confident90.3Very high126 Ų12658.9 Ų58.958%0.58330%0.3SS*.SBendtrans-97.4101.8-178.1-60.8160.1000110Y1544 T1545 D1546Y1544-H1551 CarbonylContact C-O 3.59Å; Y1544-H1551 VanDerWaalsContact CA-O 3.29Å; Y1544-H1551 WeakPolarHBondContact CA-O 3.35Å; T1545-H1551 PolarHBondContact N-O 3.14Å; T1545-H1551 WeakPolarHBondContact OG1-CB 3.39Å; T1545-H1551 PolarHBondContact OG1-O 2.78Å; D1546-H1551 HydrophobicContact CB-CB 4.26Å; D1546-H1551 WeakPolarHBondContact OD1-CA 3.31Å; D1546-H1551 WeakPolarHBondContact OD1-CB 3.26Å; D1546-H1551 PolarHBondContact OD1-N 3.26Å; D1546-H1551 PolarHBondContact OD2-N 3.21Å
1552K92.5Very high90.4Very high123 Ų12365 Ų6554%0.53533%0.326SS..BIsolated β-bridgetrans-64.7136.8176.7-60-177.7174-171.90110.4Y1544 F1557Y1544-K1552 HydrophobicContact CD1-CG 4.28Å; Y1544-K1552 HydrophobicContact CE1-CG 4.06Å; K1552-F1557 HydrophobicContact CB-CB 4Å; K1552-F1557 HydrophobicContact CB-CD2 3.62Å; K1552-F1557 HydrophobicContact CB-CE2 4.27Å; K1552-F1557 HydrophobicContact CB-CG 3.78Å; K1552-F1557 HydrophobicContact CD-CD1 3.79Å; K1552-F1557 HydrophobicContact CD-CD2 3.72Å; K1552-F1557 HydrophobicContact CD-CE1 3.7Å; K1552-F1557 HydrophobicContact CD-CE2 3.61Å; K1552-F1557 HydrophobicContact CD-CG 3.82Å; K1552-F1557 HydrophobicContact CD-CZ 3.62Å; K1552-F1557 HydrophobicContact CG-CD1 4.42Å; K1552-F1557 HydrophobicContact CG-CD2 3.47Å; K1552-F1557 VanDerWaalsContact CG-CD2 3.47Å; K1552-F1557 HydrophobicContact CG-CE2 3.58Å; K1552-F1557 HydrophobicContact CG-CG 3.94Å; K1552-F1557 HydrophobicContact CG-CZ 4.14Å
1553D92.9Very high90.5Very high12 Ų1265.2 Ų65.26%0.06433%0.327CS..  trans-63.5127.9170.9-173.4-76.3000109.7R1510 M1543 T1545 V1555 L1556 F1557R1510-D1553 IonicContact CZ-OD1 3.94Å; R1510-D1553 IonicContact CZ-OD2 2.63Å; R1510-D1553 IonicContact NH1-OD1 2.97Å; R1510-D1553 PolarHBondContact NH1-OD1 3.35Å; R1510-D1553 IonicContact NH1-OD2 2.85Å; R1510-D1553 PolarHBondContact NH1-OD2 2.73Å; R1510-D1553 IonicContact NH2-OD1 3.63Å; R1510-D1553 IonicContact NH2-OD2 3.88Å; R1510-D1553 PolarHBondContact NH2-OD2 3.09Å; M1543-D1553 PolarHBondContact O-N 3Å; T1545-D1553 HydrophobicContact CG2-CB 4.15Å; D1553-V1555 PolarHBondContact O-N 3.39Å; D1553-V1555 VanDerWaalsContact O-N 3.16Å; D1553-V1555 PolarHBondContact OD1-N 3.22Å; D1553-L1556 HydrophobicContact CB-CB 4.04Å; D1553-L1556 PolarHBondContact OD1-N 2.83Å; D1553-F1557 WeakPolarHBondContact O-CB 3.28Å; D1553-F1557 PolarHBondContact O-N 3.13Å
1554P88.9Confident90.6Very high120 Ų12065.3 Ų65.378%0.77933%0.328SS*.THydrogen-bonded Turntrans-65.5-20.7-172.625.5-34.9000113.8
1555V90Very high90.8Very high55 Ų5565.7 Ų65.733%0.33334%0.34SS..THydrogen-bonded Turntrans-110.1-45.4-178.6-174.10000111.3R1510 D1553R1510-V1555 HydrophobicContact CG-CB 4.25Å; R1510-V1555 HydrophobicContact CG-CG1 3.9Å; D1553-V1555 PolarHBondContact O-N 3.39Å; D1553-V1555 VanDerWaalsContact O-N 3.16Å; D1553-V1555 PolarHBondContact OD1-N 3.22Å
1556L93Very high91.3Very high0 Ų067.9 Ų67.90%034%0.344CS..Hα-helixtrans-83-30.9-169.7-71.9176.6000113.4V1509 R1510 D1553 E1558 R1559 L1560V1509-L1556 HydrophobicContact CB-CD2 4.19Å; V1509-L1556 HydrophobicContact CG1-CD2 4.4Å; R1510-L1556 HydrophobicContact CB-CD2 3.86Å; R1510-L1556 HydrophobicContact CB-CG 4.29Å; D1553-L1556 HydrophobicContact CB-CB 4.04Å; D1553-L1556 PolarHBondContact OD1-N 2.83Å; L1556-E1558 PolarHBondContact O-N 3.08Å; L1556-R1559 PolarHBondContact O-N 3.35Å; L1556-L1560 HydrophobicContact CB-CD1 3.88Å; L1556-L1560 HydrophobicContact CB-CG 4.09Å; L1556-L1560 HydrophobicContact CD1-CD1 4.44Å; L1556-L1560 HydrophobicContact CD2-CD1 4.36Å; L1556-L1560 HydrophobicContact CD2-CD2 4.46Å; L1556-L1560 HydrophobicContact CD2-CG 4.28Å; L1556-L1560 HydrophobicContact CG-CD1 4.46Å; L1556-L1560 WeakPolarHBondContact O-CB 3.49Å; L1556-L1560 VanDerWaalsContact O-CG 3.3Å; L1556-L1560 WeakPolarHBondContact O-CG 3.5Å; L1556-L1560 PolarHBondContact O-N 3.24Å
1557F94.6Very high91.8Very high23 Ų2366.6 Ų66.610%0.10134%0.337CS..Hα-helixtrans-53.2-55.2-171.2-177.5-86.5000112.8M1543 Y1544 K1552 D1553 S1561M1543-F1557 HydrophobicContact CB-CD2 3.91Å; M1543-F1557 HydrophobicContact CB-CE2 4.42Å; M1543-F1557 HydrophobicContact CE-CD2 3.77Å; M1543-F1557 HydrophobicContact CE-CE1 4.36Å; M1543-F1557 HydrophobicContact CE-CE2 3.46Å; M1543-F1557 VanDerWaalsContact CE-CE2 3.46Å; M1543-F1557 HydrophobicContact CE-CG 4.34Å; M1543-F1557 HydrophobicContact CE-CZ 3.78Å; M1543-F1557 HydrophobicContact CG-CD2 4.48Å; M1543-F1557 WeakPolarHBondContact O-CD2 3.26Å; Y1544-F1557 HydrophobicContact CE1-CD2 4.24Å; Y1544-F1557 AromaticContact CE1-CE2 3.74Å; Y1544-F1557 HydrophobicContact CE1-CE2 3.74Å; Y1544-F1557 HydrophobicContact CE2-CE2 4.29Å; Y1544-F1557 AromaticContact CZ-CE2 3.63Å; K1552-F1557 HydrophobicContact CB-CB 4Å; K1552-F1557 HydrophobicContact CB-CD2 3.62Å; K1552-F1557 HydrophobicContact CB-CE2 4.27Å; K1552-F1557 HydrophobicContact CB-CG 3.78Å; K1552-F1557 HydrophobicContact CD-CD1 3.79Å; K1552-F1557 HydrophobicContact CD-CD2 3.72Å; K1552-F1557 HydrophobicContact CD-CE1 3.7Å; K1552-F1557 HydrophobicContact CD-CE2 3.61Å; K1552-F1557 HydrophobicContact CD-CG 3.82Å; K1552-F1557 HydrophobicContact CD-CZ 3.62Å; K1552-F1557 HydrophobicContact CG-CD1 4.42Å; K1552-F1557 HydrophobicContact CG-CD2 3.47Å; K1552-F1557 VanDerWaalsContact CG-CD2 3.47Å; K1552-F1557 HydrophobicContact CG-CE2 3.58Å; K1552-F1557 HydrophobicContact CG-CG 3.94Å; K1552-F1557 HydrophobicContact CG-CZ 4.14Å; D1553-F1557 WeakPolarHBondContact O-CB 3.28Å; D1553-F1557 PolarHBondContact O-N 3.13Å; F1557-S1561 WeakPolarHBondContact O-CB 3.32Å; F1557-S1561 PolarHBondContact O-N 2.83Å
1558E94.2Very high92.4Very high115 Ų11565.2 Ų65.254%0.53733%0.334SS..Hα-helixtrans-65.7-39.4-179.1-74.5-64.4146.500112.5L1556 K1562L1556-E1558 PolarHBondContact O-N 3.08Å; E1558-K1562 VanDerWaalsContact O-CG 3.31Å; E1558-K1562 WeakPolarHBondContact O-CG 3.34Å; E1558-K1562 PolarHBondContact O-N 3.07Å
1559R94.4Very high93Very high88 Ų8865 Ų6533%0.33234%0.336SS..Hα-helixtrans-67.7-49.9-178.6-65-179.5179.6-139-6.9111.2V1509 D1512 L1556 K1562 L1563V1509-R1559 HydrophobicContact CG1-CB 4.01Å; V1509-R1559 PolarHBondContact O-NH1 3.31Å; D1512-R1559 PolarHBondContact O-NH1 2.89Å; L1556-R1559 PolarHBondContact O-N 3.35Å; R1559-K1562 PolarHBondContact O-N 3Å; R1559-L1563 PolarHBondContact O-N 3.47Å
1560L96.3Very high93.3Very high0 Ų067.5 Ų67.50%035%0.35CS..Hα-helixtrans-69.8-37.8-179.1-62-173000111.5V1506 V1509 M1539 N1542 M1543 L1556 K1562 L1563 V1564V1506-L1560 HydrophobicContact CG1-CD1 3.88Å; V1506-L1560 HydrophobicContact CG1-CD2 4.25Å; V1509-L1560 HydrophobicContact CB-CD2 4.19Å; V1509-L1560 HydrophobicContact CG1-CD2 4.05Å; V1509-L1560 HydrophobicContact CG2-CD2 4.31Å; M1539-L1560 HydrophobicContact CB-CB 4.34Å; M1539-L1560 HydrophobicContact CB-CD1 4.29Å; M1539-L1560 HydrophobicContact CG-CD1 4.37Å; M1539-L1560 HydrophobicContact CG-CD2 3.9Å; M1539-L1560 HydrophobicContact CG-CG 4.5Å; M1539-L1560 HydrophobicContact SD-CD2 3.95Å; N1542-L1560 HydrophobicContact CB-CD1 4Å; M1543-L1560 HydrophobicContact CG-CB 3.77Å; M1543-L1560 HydrophobicContact CG-CD1 4.33Å; M1543-L1560 HydrophobicContact SD-CB 4.48Å; L1556-L1560 HydrophobicContact CB-CD1 3.88Å; L1556-L1560 HydrophobicContact CB-CG 4.09Å; L1556-L1560 HydrophobicContact CD1-CD1 4.44Å; L1556-L1560 HydrophobicContact CD2-CD1 4.36Å; L1556-L1560 HydrophobicContact CD2-CD2 4.46Å; L1556-L1560 HydrophobicContact CD2-CG 4.28Å; L1556-L1560 HydrophobicContact CG-CD1 4.46Å; L1556-L1560 WeakPolarHBondContact O-CB 3.49Å; L1556-L1560 VanDerWaalsContact O-CG 3.3Å; L1556-L1560 WeakPolarHBondContact O-CG 3.5Å; L1556-L1560 PolarHBondContact O-N 3.24Å; L1560-K1562 VanDerWaalsContact C-N 3.33Å; L1560-K1562 PolarHBondContact O-N 2.98Å; L1560-L1563 HydrophobicContact CD2-CD1 4.33Å; L1560-L1563 PolarHBondContact O-N 3.38Å; L1560-V1564 WeakPolarHBondContact O-CB 3.49Å; L1560-V1564 VanDerWaalsContact O-CG2 3.31Å; L1560-V1564 WeakPolarHBondContact O-CG2 3.26Å; L1560-V1564 PolarHBondContact O-N 3.37Å
1561S96.1Very high93.5Very high49 Ų4961.2 Ų61.234%0.34332%0.324SS..Hα-helixtrans-57.9-45.6174.7-175.40000111.8F1557 S1565F1557-S1561 WeakPolarHBondContact O-CB 3.32Å; F1557-S1561 PolarHBondContact O-N 2.83Å; S1561-S1565 WeakPolarHBondContact O-CB 3.43Å; S1561-S1565 PolarHBondContact O-N 3.5Å
1562K95.1Very high93.4Very high132 Ų13259.5 Ų59.557%0.57433%0.326SS*.Hα-helixtrans-62.9-42.8175.1-72.6172.8-175.3175.20112.2E1558 R1559 L1560 S1565 K1566E1558-K1562 VanDerWaalsContact O-CG 3.31Å; E1558-K1562 WeakPolarHBondContact O-CG 3.34Å; E1558-K1562 PolarHBondContact O-N 3.07Å; R1559-K1562 PolarHBondContact O-N 3Å; L1560-K1562 VanDerWaalsContact C-N 3.33Å; L1560-K1562 PolarHBondContact O-N 2.98Å; K1562-S1565 PolarHBondContact O-N 3.24Å; K1562-K1566 WeakPolarHBondContact O-CB 3.46Å; K1562-K1566 WeakPolarHBondContact O-CG 3.26Å; K1562-K1566 PolarHBondContact O-N 2.89Å
1563L95.4Very high93.3Very high8 Ų856.3 Ų56.34%0.04233%0.328CS..Hα-helixtrans-64.3-48.4178-80.2173.4000112.3V1509 I1521 L1522 M1539 R1559 L1560 S1565 K1566 I1567V1509-L1563 HydrophobicContact CG1-CD1 4.15Å; V1509-L1563 HydrophobicContact CG2-CD1 4.26Å; I1521-L1563 HydrophobicContact CD1-CD1 4.34Å; L1522-L1563 HydrophobicContact CD1-CD2 4.16Å; L1522-L1563 HydrophobicContact CD2-CD2 3.95Å; L1522-L1563 HydrophobicContact CG-CD2 3.82Å; M1539-L1563 HydrophobicContact SD-CB 4.07Å; M1539-L1563 HydrophobicContact SD-CD1 4.46Å; R1559-L1563 PolarHBondContact O-N 3.47Å; L1560-L1563 HydrophobicContact CD2-CD1 4.33Å; L1560-L1563 PolarHBondContact O-N 3.38Å; L1563-S1565 VanDerWaalsContact C-N 3.31Å; L1563-S1565 PolarHBondContact O-N 2.95Å; L1563-K1566 PolarHBondContact O-N 3.03Å; L1563-I1567 WeakPolarHBondContact O-CG1 3.41Å; L1563-I1567 PolarHBondContact O-N 2.7Å
1564V95.7Very high93Very high18 Ų1857.5 Ų57.511%0.10933%0.333CS..Hα-helixtrans-57.5-46.4176.1171.80000110.2I1536 M1539 L1560 K1566 I1567 V1568I1536-V1564 HydrophobicContact CG2-CG1 4.28Å; M1539-V1564 HydrophobicContact CB-CG2 3.8Å; M1539-V1564 HydrophobicContact CE-CG2 3.85Å; M1539-V1564 HydrophobicContact SD-CG2 4.15Å; L1560-V1564 WeakPolarHBondContact O-CB 3.49Å; L1560-V1564 VanDerWaalsContact O-CG2 3.31Å; L1560-V1564 WeakPolarHBondContact O-CG2 3.26Å; L1560-V1564 PolarHBondContact O-N 3.37Å; V1564-K1566 PolarHBondContact O-N 3.05Å; V1564-I1567 PolarHBondContact O-N 3.36Å; V1564-V1568 HydrophobicContact CG1-CG2 4.3Å; V1564-V1568 WeakPolarHBondContact O-CB 3.35Å; V1564-V1568 VanDerWaalsContact O-CG2 3.32Å; V1564-V1568 WeakPolarHBondContact O-CG2 3.21Å; V1564-V1568 PolarHBondContact O-N 2.66Å
1565S96.5Very high93Very high67 Ų6752.3 Ų52.347%0.46930%0.3SS..Hα-helixtrans-59-46176.7-179.50000112.1S1561 K1562 L1563 V1568 T1569S1561-S1565 WeakPolarHBondContact O-CB 3.43Å; S1561-S1565 PolarHBondContact O-N 3.5Å; K1562-S1565 PolarHBondContact O-N 3.24Å; L1563-S1565 VanDerWaalsContact C-N 3.31Å; L1563-S1565 PolarHBondContact O-N 2.95Å; S1565-V1568 PolarHBondContact O-N 2.84Å; S1565-T1569 WeakPolarHBondContact O-CB 3.35Å; S1565-T1569 VanDerWaalsContact O-CG2 3.25Å; S1565-T1569 WeakPolarHBondContact O-CG2 3.49Å; S1565-T1569 PolarHBondContact O-N 3.37Å; S1565-T1569 PolarHBondContact O-OG1 2.88Å
1566K95.4Very high93Very high109 Ų10954 Ų5447%0.47430%0.303SS..Hα-helixtrans-61.9-43.6176.3-77.7-177.3176.5-173.10112.7L1522 K1562 L1563 V1564 T1569 S1570L1522-K1566 HydrophobicContact CD1-CD 3.8Å; L1522-K1566 HydrophobicContact CD2-CB 3.65Å; L1522-K1566 HydrophobicContact CD2-CD 4.29Å; K1562-K1566 WeakPolarHBondContact O-CB 3.46Å; K1562-K1566 WeakPolarHBondContact O-CG 3.26Å; K1562-K1566 PolarHBondContact O-N 2.89Å; L1563-K1566 PolarHBondContact O-N 3.03Å; V1564-K1566 PolarHBondContact O-N 3.05Å; K1566-T1569 WeakPolarHBondContact CA-OG1 3.33Å; K1566-T1569 PolarHBondContact O-OG1 3.32Å; K1566-T1569 VanDerWaalsContact O-OG1 3.14Å; K1566-S1570 VanDerWaalsContact O-CB 3.32Å; K1566-S1570 WeakPolarHBondContact O-CB 3.42Å; K1566-S1570 PolarHBondContact O-N 3.4Å; K1566-S1570 PolarHBondContact O-OG 3.14Å
1567I94.5Very high92.9Very high2 Ų260.8 Ų60.81%0.0133%0.329CS..Hα-helixtrans-61.3-55.4177.3-66.4170000109.3I1521 L1522 A1525 A1532 I1536 M1539 L1563 V1564 T1569 S1570 L1571I1521-I1567 HydrophobicContact CG2-CD1 4.05Å; L1522-I1567 HydrophobicContact CD2-CG1 3.78Å; A1525-I1567 HydrophobicContact CB-CD1 3.93Å; A1525-I1567 HydrophobicContact CB-CG1 4.01Å; A1525-I1567 HydrophobicContact CB-CG2 4.13Å; A1532-I1567 HydrophobicContact CB-CG2 4.28Å; I1536-I1567 HydrophobicContact CD1-CG2 3.98Å; I1536-I1567 HydrophobicContact CG1-CG2 4.39Å; M1539-I1567 HydrophobicContact CE-CD1 3.6Å; L1563-I1567 WeakPolarHBondContact O-CG1 3.41Å; L1563-I1567 PolarHBondContact O-N 2.7Å; V1564-I1567 PolarHBondContact O-N 3.36Å; I1567-T1569 VanDerWaalsContact C-N 3.33Å; I1567-T1569 PolarHBondContact O-N 3.3Å; I1567-S1570 PolarHBondContact O-N 2.93Å; I1567-S1570 PolarHBondContact O-OG 2.98Å; I1567-L1571 WeakPolarHBondContact O-CG 3.43Å; I1567-L1571 PolarHBondContact O-N 3.19Å
1568V93.6Very high92.7Very high46 Ų4659.7 Ų59.728%0.27932%0.324SS..Hα-helixtrans-61.7-39.1-176.3174.70000112.1I1536 V1564 S1565 S1570 L1571I1536-V1568 HydrophobicContact CD1-CG2 4.12Å; V1564-V1568 HydrophobicContact CG1-CG2 4.3Å; V1564-V1568 WeakPolarHBondContact O-CB 3.35Å; V1564-V1568 VanDerWaalsContact O-CG2 3.32Å; V1564-V1568 WeakPolarHBondContact O-CG2 3.21Å; V1564-V1568 PolarHBondContact O-N 2.66Å; S1565-V1568 PolarHBondContact O-N 2.84Å; V1568-S1570 VanDerWaalsContact C-N 3.32Å; V1568-L1571 PolarHBondContact O-N 3.23Å
1569T93.5Very high92.6Very high106 Ų10655.4 Ų55.465%0.6530%0.304SS*.Hα-helixtrans-71.3-25.9176.9520000113.2S1565 K1566 I1567S1565-T1569 WeakPolarHBondContact O-CB 3.35Å; S1565-T1569 VanDerWaalsContact O-CG2 3.25Å; S1565-T1569 WeakPolarHBondContact O-CG2 3.49Å; S1565-T1569 PolarHBondContact O-N 3.37Å; S1565-T1569 PolarHBondContact O-OG1 2.88Å; K1566-T1569 WeakPolarHBondContact CA-OG1 3.33Å; K1566-T1569 PolarHBondContact O-OG1 3.32Å; K1566-T1569 VanDerWaalsContact O-OG1 3.14Å; I1567-T1569 VanDerWaalsContact C-N 3.33Å; I1567-T1569 PolarHBondContact O-N 3.3Å
1570S91.9Very high92.5Very high74 Ų7455.3 Ų55.352%0.51731%0.307SS..Hα-helixtrans-76.8-2017475.90000113.7K1566 I1567 V1568 S1572K1566-S1570 VanDerWaalsContact O-CB 3.32Å; K1566-S1570 WeakPolarHBondContact O-CB 3.42Å; K1566-S1570 PolarHBondContact O-N 3.4Å; K1566-S1570 PolarHBondContact O-OG 3.14Å; I1567-S1570 PolarHBondContact O-N 2.93Å; I1567-S1570 PolarHBondContact O-OG 2.98Å; V1568-S1570 VanDerWaalsContact C-N 3.32Å; S1570-S1572 PolarHBondContact O-N 3.21Å
1571L90.3Very high92.3Very high12 Ų1258 Ų586%0.06332%0.317CS..  trans-69131177.3-59.2-176.7000110.6I1567 V1568 A1575 K1576 H1579I1567-L1571 WeakPolarHBondContact O-CG 3.43Å; I1567-L1571 PolarHBondContact O-N 3.19Å; V1568-L1571 PolarHBondContact O-N 3.23Å; L1571-A1575 HydrophobicContact CD2-CB 4.41Å; L1571-K1576 HydrophobicContact CB-CB 3.96Å; L1571-K1576 HydrophobicContact CB-CG 4.42Å; L1571-H1579 HydrophobicContact CD1-CB 3.68Å
1572S87.1Confident92.2Very high90 Ų9055.6 Ų55.663%0.62930%0.301SS*.  trans-140.5165.6176.764.60000111.4S1570 E1574 A1575 K1576S1570-S1572 PolarHBondContact O-N 3.21Å; S1572-E1574 PolarHBondContact O-N 2.9Å; S1572-A1575 PolarHBondContact O-N 3.47Å; S1572-K1576 PolarHBondContact O-N 3.48Å
1573G89.6Confident92.1Very high56 Ų5650 Ų5058%0.57728%0.276SS*.Hα-helixtrans55.6-132.6177.400000113.3A1575 K1576 R1577G1573-A1575 VanDerWaalsContact C-N 3.35Å; G1573-K1576 PolarHBondContact O-N 3.14Å; G1573-R1577 PolarHBondContact O-N 3.27Å
1574E86.7Confident92Very high38 Ų3854.7 Ų54.718%0.17830%0.302CS..Hα-helixtrans-71.3-28.3-176.5-161.951.4-136.700113.2S1572 K1576 R1577 F1578 R1581 M1670S1572-E1574 PolarHBondContact O-N 2.9Å; E1574-K1576 VanDerWaalsContact C-N 3.34Å; E1574-K1576 PolarHBondContact O-N 3.01Å; E1574-R1577 PolarHBondContact O-N 3.48Å; E1574-R1577 VanDerWaalsContact OE2-CD 3.27Å; E1574-R1577 WeakPolarHBondContact OE2-CD 3.29Å; E1574-R1577 IonicContact OE2-NH1 3.21Å; E1574-R1577 PolarHBondContact OE2-NH1 3.35Å; E1574-F1578 WeakPolarHBondContact O-CB 3.46Å; E1574-F1578 PolarHBondContact O-N 3.28Å; E1574-R1581 IonicContact OE1-CZ 2.94Å; E1574-R1581 IonicContact OE1-NH2 2.67Å; E1574-R1581 PolarHBondContact OE1-NH2 2.93Å; E1574-M1670 VanDerWaalsContact CG-O 3.32Å; E1574-M1670 WeakPolarHBondContact CG-O 3.3Å
1575A88.5Confident91.9Very high10 Ų1054 Ų548%0.08330%0.297CS..Hα-helixtrans-60.4-44.617400000111.6Q1529 L1571 S1572 G1573 F1578 H1579 M1670Q1529-A1575 HydrophobicContact CG-CB 4.08Å; L1571-A1575 HydrophobicContact CD2-CB 4.41Å; S1572-A1575 PolarHBondContact O-N 3.47Å; G1573-A1575 VanDerWaalsContact C-N 3.35Å; A1575-F1578 PolarHBondContact O-N 2.92Å; A1575-H1579 PolarHBondContact O-N 2.81Å; A1575-M1670 VanDerWaalsContact CA-SD 3.6Å; A1575-M1670 HydrophobicContact CB-CE 3.93Å; A1575-M1670 HydrophobicContact CB-SD 4.04Å
1576K90.7Very high91.7Very high90 Ų9051 Ų5139%0.39128%0.276SS..Hα-helixtrans-65.7-41.4177.1-174.7170.3176.9173.90112L1571 S1572 G1573 E1574 F1578 H1579 E1580L1571-K1576 HydrophobicContact CB-CB 3.96Å; L1571-K1576 HydrophobicContact CB-CG 4.42Å; S1572-K1576 PolarHBondContact O-N 3.48Å; G1573-K1576 PolarHBondContact O-N 3.14Å; E1574-K1576 VanDerWaalsContact C-N 3.34Å; E1574-K1576 PolarHBondContact O-N 3.01Å; K1576-F1578 VanDerWaalsContact C-N 3.34Å; K1576-H1579 PolarHBondContact O-N 2.73Å; K1576-E1580 WeakPolarHBondContact CE-OE1 3.48Å; K1576-E1580 HydrophobicContact CG-CG 4.49Å; K1576-E1580 WeakPolarHBondContact O-CG 3.46Å; K1576-E1580 PolarHBondContact O-N 3.28Å
1577R89.9Confident91.5Very high144 Ų14450.1 Ų50.154%0.54328%0.276SS..Hα-helixtrans-64.2-39.4175.6-72.5175.7175.2172.6-1.3112G1573 E1574 E1580 R1581G1573-R1577 PolarHBondContact O-N 3.27Å; E1574-R1577 PolarHBondContact O-N 3.48Å; E1574-R1577 VanDerWaalsContact OE2-CD 3.27Å; E1574-R1577 WeakPolarHBondContact OE2-CD 3.29Å; E1574-R1577 IonicContact OE2-NH1 3.21Å; E1574-R1577 PolarHBondContact OE2-NH1 3.35Å; R1577-E1580 PolarHBondContact O-N 3.33Å; R1577-R1581 VanDerWaalsContact O-CB 3.23Å; R1577-R1581 WeakPolarHBondContact O-CB 3.43Å; R1577-R1581 WeakPolarHBondContact O-CG 3.42Å; R1577-R1581 PolarHBondContact O-N 3.36Å; R1577-R1581 PolarHBondContact O-NE 2.94Å
1578F91.8Very high91.3Very high0 Ų054.1 Ų54.10%030%0.295CS..Hα-helixtrans-62.4-46.9175.9178.2-148.4000110.8Q1529 L1530 H1533 E1574 A1575 K1576 R1581 Q1582 G1621 Y1623 C1669 M1670Q1529-F1578 HydrophobicContact CB-CD1 3.95Å; Q1529-F1578 HydrophobicContact CB-CE1 4.1Å; L1530-F1578 HydrophobicContact CD2-CZ 4.42Å; H1533-F1578 AromaticContact CE1-CD1 3.48Å; H1533-F1578 VanDerWaalsContact CE1-CD1 3.48Å; H1533-F1578 WeakPolarHBondContact CE1-CD1 3.39Å; H1533-F1578 AromaticContact CE1-CE1 3.5Å; H1533-F1578 AromaticContact CE1-CG 3.76Å; H1533-F1578 AromaticContact CE1-CZ 3.8Å; H1533-F1578 AromaticContact ND1-CE1 3.99Å; E1574-F1578 WeakPolarHBondContact O-CB 3.46Å; E1574-F1578 PolarHBondContact O-N 3.28Å; A1575-F1578 PolarHBondContact O-N 2.92Å; K1576-F1578 VanDerWaalsContact C-N 3.34Å; F1578-R1581 PolarHBondContact O-N 3.24Å; F1578-Q1582 HydrophobicContact CD2-CB 4.5Å; F1578-Q1582 HydrophobicContact CE2-CB 4.39Å; F1578-Q1582 WeakPolarHBondContact O-CB 3.19Å; F1578-Q1582 PolarHBondContact O-N 3.45Å; F1578-G1621 WeakPolarHBondContact CE2-O 3.23Å; F1578-Y1623 HydrophobicContact CE2-CD1 4.08Å; F1578-Y1623 HydrophobicContact CE2-CE1 4.25Å; F1578-Y1623 AromaticContact CZ-CD1 3.75Å; F1578-Y1623 HydrophobicContact CZ-CD1 3.75Å; F1578-Y1623 AromaticContact CZ-CE1 3.77Å; F1578-Y1623 HydrophobicContact CZ-CE1 3.77Å; F1578-C1669 HydrophobicContact CD1-CB 4Å; F1578-C1669 HydrophobicContact CD2-CB 3.71Å; F1578-C1669 HydrophobicContact CE1-CB 3.79Å; F1578-C1669 HydrophobicContact CE2-CB 3.5Å; F1578-C1669 VanDerWaalsContact CE2-CB 3.5Å; F1578-C1669 VanDerWaalsContact CE2-SG 3.54Å; F1578-C1669 HydrophobicContact CG-CB 3.97Å; F1578-C1669 HydrophobicContact CZ-CB 3.53Å; F1578-M1670 HydrophobicContact CD1-SD 4.5Å
1579H92.3Very high91.2Very high25 Ų2551.9 Ų51.912%0.11628%0.281CS..Hα-helixtrans-56.3-53.8173168.7-88.7000112.4H1533 L1571 A1575 K1576 R1581 Q1582 F1583H1533-H1579 AromaticContact CD2-CD2 3.96Å; H1533-H1579 VanDerWaalsContact NE2-CA 3.25Å; H1533-H1579 WeakPolarHBondContact NE2-CA 3.17Å; H1533-H1579 WeakPolarHBondContact NE2-CB 3Å; L1571-H1579 HydrophobicContact CD1-CB 3.68Å; A1575-H1579 PolarHBondContact O-N 2.81Å; K1576-H1579 PolarHBondContact O-N 2.73Å; H1579-R1581 PolarHBondContact O-N 3.11Å; H1579-Q1582 PolarHBondContact O-N 3.35Å; H1579-F1583 AromaticContact CD2-CD2 3.65Å; H1579-F1583 AromaticContact CD2-CE2 3.51Å; H1579-F1583 AromaticContact NE2-CD2 3.86Å; H1579-F1583 AromaticContact NE2-CE2 3.84Å; H1579-F1583 WeakPolarHBondContact O-CB 3.48Å; H1579-F1583 VanDerWaalsContact O-CD2 3.25Å; H1579-F1583 WeakPolarHBondContact O-CD2 3.42Å; H1579-F1583 PolarHBondContact O-N 3.22Å
1580E92.7Very high91Very high86 Ų8647.9 Ų47.940%0.40226%0.256SS..Hα-helixtrans-61.4-43.6-178.8-72.2172.317600111.8K1576 R1577 N1584K1576-E1580 WeakPolarHBondContact CE-OE1 3.48Å; K1576-E1580 HydrophobicContact CG-CG 4.49Å; K1576-E1580 WeakPolarHBondContact O-CG 3.46Å; K1576-E1580 PolarHBondContact O-N 3.28Å; R1577-E1580 PolarHBondContact O-N 3.33Å; E1580-N1584 WeakPolarHBondContact O-CB 3.25Å; E1580-N1584 PolarHBondContact O-N 2.89Å; E1580-N1584 PolarHBondContact O-ND2 3.43Å; E1580-N1584 VanDerWaalsContact O-ND2 3.14Å
1581R92.2Very high90.8Very high55 Ų5547.3 Ų47.321%0.20825%0.252CS..Hα-helixtrans-59.8-50.7176-76.8-173.2-68.3156.4-5.9111.6E1574 R1577 F1578 H1579 F1585 V1619 K1620 C1669E1574-R1581 IonicContact OE1-CZ 2.94Å; E1574-R1581 IonicContact OE1-NH2 2.67Å; E1574-R1581 PolarHBondContact OE1-NH2 2.93Å; R1577-R1581 VanDerWaalsContact O-CB 3.23Å; R1577-R1581 WeakPolarHBondContact O-CB 3.43Å; R1577-R1581 WeakPolarHBondContact O-CG 3.42Å; R1577-R1581 PolarHBondContact O-N 3.36Å; R1577-R1581 PolarHBondContact O-NE 2.94Å; F1578-R1581 PolarHBondContact O-N 3.24Å; H1579-R1581 PolarHBondContact O-N 3.11Å; R1581-F1585 VanDerWaalsContact O-CB 3.31Å; R1581-F1585 WeakPolarHBondContact O-CB 3.23Å; R1581-F1585 PolarHBondContact O-N 3.23Å; R1581-F1585 VanDerWaalsContact O-N 3.13Å; R1581-V1619 HydrophobicContact CG-CG1 4.48Å; R1581-K1620 PolarHBondContact NH1-O 3.45Å; R1581-C1669 PolarHBondContact NH2-O 2.99Å
1582Q93Very high90.9Very high0 Ų046.9 Ų46.90%025%0.25CS..Hα-helixtrans-61.7-49.3-177-179.465.728.700111.7W1537 F1578 H1579 F1586 C1622 Y1623W1537-Q1582 HydrophobicContact CH2-CG 4.15Å; W1537-Q1582 HydrophobicContact CZ2-CG 4.18Å; F1578-Q1582 HydrophobicContact CD2-CB 4.5Å; F1578-Q1582 HydrophobicContact CE2-CB 4.39Å; F1578-Q1582 WeakPolarHBondContact O-CB 3.19Å; F1578-Q1582 PolarHBondContact O-N 3.45Å; H1579-Q1582 PolarHBondContact O-N 3.35Å; Q1582-F1586 WeakPolarHBondContact O-CD2 3.37Å; Q1582-F1586 PolarHBondContact O-N 3.44Å; Q1582-C1622 VanDerWaalsContact OE1-CA 3.24Å; Q1582-Y1623 VanDerWaalsContact CD-CE1 3.48Å; Q1582-Y1623 HydrophobicContact CG-CD1 4.47Å; Q1582-Y1623 HydrophobicContact CG-CE1 3.87Å; Q1582-Y1623 PolarHBondContact NE2-O 3.24Å; Q1582-Y1623 PolarHBondContact OE1-O 2.9Å
1583F94Very high90.9Very high13 Ų1342.6 Ų42.66%0.05722%0.221CC..Hα-helixtrans-72.2-41.6-176.3-80.3-111.6000111.8H1533 I1536 W1537 H1579 F1585 N1587H1533-F1583 HydrophobicContact CB-CE2 3.89Å; H1533-F1583 HydrophobicContact CB-CZ 4.36Å; H1533-F1583 AromaticContact CD2-CE2 3.94Å; H1533-F1583 AromaticContact CG-CE2 3.86Å; I1536-F1583 HydrophobicContact CB-CE1 4.42Å; I1536-F1583 HydrophobicContact CB-CZ 3.99Å; I1536-F1583 HydrophobicContact CG2-CE1 3.71Å; I1536-F1583 HydrophobicContact CG2-CZ 3.77Å; W1537-F1583 AromaticContact CD1-CE1 3.39Å; W1537-F1583 AromaticContact CD1-CZ 3.8Å; W1537-F1583 HydrophobicContact CD2-CZ 4.28Å; W1537-F1583 AromaticContact CE2-CE1 3.9Å; W1537-F1583 AromaticContact CE2-CZ 3.77Å; W1537-F1583 HydrophobicContact CG-CE1 4.25Å; W1537-F1583 HydrophobicContact CG-CZ 4.26Å; W1537-F1583 HydrophobicContact CZ2-CE2 4.23Å; W1537-F1583 HydrophobicContact CZ2-CZ 4.28Å; W1537-F1583 AromaticContact NE1-CD1 3.55Å; W1537-F1583 AromaticContact NE1-CE1 3.11Å; W1537-F1583 AromaticContact NE1-CZ 3.45Å; H1579-F1583 AromaticContact CD2-CD2 3.65Å; H1579-F1583 AromaticContact CD2-CE2 3.51Å; H1579-F1583 AromaticContact NE2-CD2 3.86Å; H1579-F1583 AromaticContact NE2-CE2 3.84Å; H1579-F1583 WeakPolarHBondContact O-CB 3.48Å; H1579-F1583 VanDerWaalsContact O-CD2 3.25Å; H1579-F1583 WeakPolarHBondContact O-CD2 3.42Å; H1579-F1583 PolarHBondContact O-N 3.22Å; F1583-F1585 PolarHBondContact O-N 3.37Å; F1583-N1587 WeakPolarHBondContact O-CB 3.5Å; F1583-N1587 PolarHBondContact O-N 3.14Å; F1583-N1587 PolarHBondContact O-ND2 3Å; F1583-N1587 VanDerWaalsContact O-ND2 3.16Å
1584N93.2Very high90.6Very high108 Ų10843 Ų4358%0.57822%0.219SC*.Hα-helixtrans-62.1-44.9178.7-70.3-17.3000111.5E1580 N1587 E1588E1580-N1584 WeakPolarHBondContact O-CB 3.25Å; E1580-N1584 PolarHBondContact O-N 2.89Å; E1580-N1584 PolarHBondContact O-ND2 3.43Å; E1580-N1584 VanDerWaalsContact O-ND2 3.14Å; N1584-N1587 PolarHBondContact O-N 2.86Å; N1584-E1588 WeakPolarHBondContact O-CB 3.47Å; N1584-E1588 PolarHBondContact O-N 2.78Å
1585F92.9Very high90.6Very high3 Ų344.8 Ų44.81%0.01323%0.227CC..Hα-helixtrans-62.2-47.8-179.1177.5-118.8000112.6R1581 F1583 E1588 I1589 V1616 V1619 C1622 V1632 I1635R1581-F1585 VanDerWaalsContact O-CB 3.31Å; R1581-F1585 WeakPolarHBondContact O-CB 3.23Å; R1581-F1585 PolarHBondContact O-N 3.23Å; R1581-F1585 VanDerWaalsContact O-N 3.13Å; F1583-F1585 PolarHBondContact O-N 3.37Å; F1585-E1588 WeakPolarHBondContact O-CB 3.45Å; F1585-E1588 PolarHBondContact O-N 3.03Å; F1585-I1589 HydrophobicContact CD1-CD1 4.18Å; F1585-I1589 HydrophobicContact CD2-CD1 4.34Å; F1585-I1589 HydrophobicContact CE1-CD1 3.73Å; F1585-I1589 HydrophobicContact CE2-CD1 3.91Å; F1585-I1589 HydrophobicContact CG-CD1 4.47Å; F1585-I1589 HydrophobicContact CZ-CD1 3.6Å; F1585-I1589 WeakPolarHBondContact O-CG1 3.22Å; F1585-I1589 PolarHBondContact O-N 2.91Å; F1585-I1589 VanDerWaalsContact O-N 3.14Å; F1585-V1616 HydrophobicContact CD2-CG1 4.39Å; F1585-V1616 HydrophobicContact CE2-CG1 3.91Å; F1585-V1619 HydrophobicContact CD2-CB 4.22Å; F1585-V1619 HydrophobicContact CD2-CG2 3.96Å; F1585-V1619 HydrophobicContact CG-CB 4.4Å; F1585-V1619 HydrophobicContact CG-CG2 4.46Å; F1585-C1622 HydrophobicContact CD1-CB 3.85Å; F1585-C1622 HydrophobicContact CE1-CB 4.28Å; F1585-V1632 HydrophobicContact CE1-CG1 4.46Å; F1585-I1635 HydrophobicContact CE2-CD1 4.31Å; F1585-I1635 HydrophobicContact CZ-CD1 3.99Å
1586F92.4Very high90.6Very high4 Ų444.3 Ų44.32%0.01822%0.223CC..Hα-helixtrans-78.3-23.5-179.7-76-74000113.9Q1582 I1589 T1590 C1622 Y1623 L1624 P1625 V1632 F1694Q1582-F1586 WeakPolarHBondContact O-CD2 3.37Å; Q1582-F1586 PolarHBondContact O-N 3.44Å; F1586-I1589 HydrophobicContact CD1-CD1 3.98Å; F1586-I1589 HydrophobicContact CE1-CD1 4Å; F1586-T1590 VanDerWaalsContact O-CB 3.28Å; F1586-T1590 WeakPolarHBondContact O-CB 3.16Å; F1586-T1590 PolarHBondContact O-N 2.93Å; F1586-T1590 PolarHBondContact O-OG1 2.65Å; F1586-C1622 HydrophobicContact CE2-CB 4.23Å; F1586-Y1623 WeakPolarHBondContact CE2-O 3.25Å; F1586-Y1623 VanDerWaalsContact CZ-O 3.32Å; F1586-Y1623 WeakPolarHBondContact CZ-O 3.32Å; F1586-L1624 HydrophobicContact CE1-CD1 4Å; F1586-L1624 HydrophobicContact CZ-CD1 4.21Å; F1586-P1625 HydrophobicContact CB-CG 4.16Å; F1586-P1625 HydrophobicContact CD1-CG 3.65Å; F1586-P1625 HydrophobicContact CD2-CG 3.68Å; F1586-P1625 HydrophobicContact CE1-CG 3.95Å; F1586-P1625 HydrophobicContact CE2-CG 3.99Å; F1586-P1625 HydrophobicContact CG-CG 3.51Å; F1586-P1625 HydrophobicContact CZ-CG 4.12Å; F1586-V1632 HydrophobicContact CZ-CG2 4.17Å; F1586-F1694 AromaticContact CD1-CE1 3.98Å; F1586-F1694 HydrophobicContact CD1-CE1 3.98Å; F1586-F1694 HydrophobicContact CD1-CZ 4.17Å; F1586-F1694 HydrophobicContact CE1-CZ 4.27Å
1587N90.8Very high90.2Very high91 Ų9145.7 Ų45.749%0.48723%0.229SC..Hα-helixtrans-67-40.8168.5-73.6-17.7000111.2F1583 N1584 T1590 S1591F1583-N1587 WeakPolarHBondContact O-CB 3.5Å; F1583-N1587 PolarHBondContact O-N 3.14Å; F1583-N1587 PolarHBondContact O-ND2 3Å; F1583-N1587 VanDerWaalsContact O-ND2 3.16Å; N1584-N1587 PolarHBondContact O-N 2.86Å; N1587-T1590 PolarHBondContact O-N 3.41Å; N1587-S1591 WeakPolarHBondContact O-CB 3.38Å; N1587-S1591 PolarHBondContact O-N 3.35Å
1588E90.8Very high90Very high85 Ų8544 Ų4440%0.39724%0.236SC..Hα-helixtrans-59.9-47.7174.1-168.4-176.417400111N1584 F1585 S1591 V1616N1584-E1588 WeakPolarHBondContact O-CB 3.47Å; N1584-E1588 PolarHBondContact O-N 2.78Å; F1585-E1588 WeakPolarHBondContact O-CB 3.45Å; F1585-E1588 PolarHBondContact O-N 3.03Å; E1588-S1591 PolarHBondContact O-N 3.42Å; E1588-S1591 PolarHBondContact O-OG 2.76Å; E1588-V1616 HydrophobicContact CG-CG2 4.19Å
1589I91.2Very high89.6Confident0 Ų047.5 Ų47.50%025%0.252CS..Hα-helixtrans-62.8-45.4176.6-64.8167.8000111.6F1585 F1586 S1591 I1592 V1616 I1635 F1651 F1655 F1694F1585-I1589 HydrophobicContact CD1-CD1 4.18Å; F1585-I1589 HydrophobicContact CD2-CD1 4.34Å; F1585-I1589 HydrophobicContact CE1-CD1 3.73Å; F1585-I1589 HydrophobicContact CE2-CD1 3.91Å; F1585-I1589 HydrophobicContact CG-CD1 4.47Å; F1585-I1589 HydrophobicContact CZ-CD1 3.6Å; F1585-I1589 WeakPolarHBondContact O-CG1 3.22Å; F1585-I1589 PolarHBondContact O-N 2.91Å; F1585-I1589 VanDerWaalsContact O-N 3.14Å; F1586-I1589 HydrophobicContact CD1-CD1 3.98Å; F1586-I1589 HydrophobicContact CE1-CD1 4Å; I1589-S1591 VanDerWaalsContact C-N 3.26Å; I1589-S1591 PolarHBondContact O-N 2.8Å; I1589-I1592 VanDerWaalsContact O-CB 3.29Å; I1589-I1592 WeakPolarHBondContact O-CB 3.44Å; I1589-I1592 WeakPolarHBondContact O-CG1 3.03Å; I1589-I1592 PolarHBondContact O-N 3.16Å; I1589-V1616 HydrophobicContact CD1-CG1 4.5Å; I1589-V1616 HydrophobicContact CG1-CG1 3.88Å; I1589-I1635 HydrophobicContact CD1-CD1 4.43Å; I1589-F1651 HydrophobicContact CG2-CZ 3.87Å; I1589-F1651 WeakPolarHBondContact O-CZ 3.43Å; I1589-F1655 HydrophobicContact CD1-CE1 3.88Å; I1589-F1655 HydrophobicContact CD1-CZ 4.16Å; I1589-F1694 HydrophobicContact CB-CE1 4.32Å; I1589-F1694 HydrophobicContact CB-CZ 4.41Å; I1589-F1694 HydrophobicContact CG2-CD1 3.96Å; I1589-F1694 HydrophobicContact CG2-CD2 3.97Å; I1589-F1694 HydrophobicContact CG2-CE1 3.59Å; I1589-F1694 HydrophobicContact CG2-CE2 3.61Å; I1589-F1694 HydrophobicContact CG2-CG 4.15Å; I1589-F1694 HydrophobicContact CG2-CZ 3.41Å; I1589-F1694 VanDerWaalsContact CG2-CZ 3.41Å
1590T89.1Confident89.1Confident21 Ų2149.8 Ų49.813%0.12927%0.269CS..Hα-helixtrans-64.3-33.6-179-56.70000111.5F1586 N1587 I1592 S1593 V1696F1586-T1590 VanDerWaalsContact O-CB 3.28Å; F1586-T1590 WeakPolarHBondContact O-CB 3.16Å; F1586-T1590 PolarHBondContact O-N 2.93Å; F1586-T1590 PolarHBondContact O-OG1 2.65Å; N1587-T1590 PolarHBondContact O-N 3.41Å; T1590-I1592 PolarHBondContact O-N 3.02Å; T1590-I1592 VanDerWaalsContact O-N 3.17Å; T1590-S1593 PolarHBondContact O-N 2.96Å; T1590-S1593 VanDerWaalsContact O-N 3.14Å; T1590-V1696 HydrophobicContact CG2-CG2 3.56Å
1591S88.6Confident88.2Confident62 Ų6251.3 Ų51.343%0.43427%0.274SS..Hα-helixtrans-62.5-21.4179.278.30000114.1N1587 E1588 I1589 S1593 A1594 E1595N1587-S1591 WeakPolarHBondContact O-CB 3.38Å; N1587-S1591 PolarHBondContact O-N 3.35Å; E1588-S1591 PolarHBondContact O-N 3.42Å; E1588-S1591 PolarHBondContact O-OG 2.76Å; I1589-S1591 VanDerWaalsContact C-N 3.26Å; I1589-S1591 PolarHBondContact O-N 2.8Å; S1591-S1593 PolarHBondContact O-N 2.88Å; S1591-A1594 WeakPolarHBondContact O-CB 3.01Å; S1591-A1594 PolarHBondContact O-N 3.45Å; S1591-E1595 PolarHBondContact O-N 3.27Å; S1591-E1595 VanDerWaalsContact O-N 3.12Å
1592I90.9Very high87.7Confident3 Ų351 Ų512%0.01529%0.289CS..Hα-helixtrans-55.5-38.3174.1-63.5174.2000110.8I1589 T1590 A1594 E1595 I1596 A1612 L1613 V1616 F1651I1589-I1592 VanDerWaalsContact O-CB 3.29Å; I1589-I1592 WeakPolarHBondContact O-CB 3.44Å; I1589-I1592 WeakPolarHBondContact O-CG1 3.03Å; I1589-I1592 PolarHBondContact O-N 3.16Å; T1590-I1592 PolarHBondContact O-N 3.02Å; T1590-I1592 VanDerWaalsContact O-N 3.17Å; I1592-A1594 VanDerWaalsContact C-N 3.31Å; I1592-A1594 PolarHBondContact O-N 2.95Å; I1592-E1595 PolarHBondContact O-N 3.41Å; I1592-E1595 VanDerWaalsContact O-N 3.16Å; I1592-I1596 HydrophobicContact CG2-CG2 4.11Å; I1592-I1596 WeakPolarHBondContact O-CG1 3.3Å; I1592-I1596 WeakPolarHBondContact O-CG2 3.4Å; I1592-I1596 PolarHBondContact O-N 2.97Å; I1592-A1612 HydrophobicContact CB-CB 4.37Å; I1592-A1612 HydrophobicContact CG1-CB 4.04Å; I1592-A1612 HydrophobicContact CG2-CB 3.77Å; I1592-L1613 HydrophobicContact CD1-CB 4.21Å; I1592-L1613 HydrophobicContact CD1-CD1 3.81Å; I1592-V1616 HydrophobicContact CD1-CG2 3.99Å; I1592-F1651 HydrophobicContact CB-CE1 3.8Å; I1592-F1651 HydrophobicContact CB-CZ 3.84Å; I1592-F1651 HydrophobicContact CD1-CE2 4.31Å; I1592-F1651 HydrophobicContact CD1-CZ 3.98Å; I1592-F1651 HydrophobicContact CG1-CZ 4.43Å; I1592-F1651 HydrophobicContact CG2-CD1 4.28Å; I1592-F1651 HydrophobicContact CG2-CE1 4Å; I1592-F1651 HydrophobicContact CG2-CE2 4.35Å; I1592-F1651 HydrophobicContact CG2-CZ 4.05Å
1593S87.6Confident87.2Confident1 Ų160.8 Ų60.81%0.00733%0.325CS..Hα-helixtrans-61.6-39.8179-177.70000112T1590 S1591 I1596 K1597 K1648 A1649 V1696T1590-S1593 PolarHBondContact O-N 2.96Å; T1590-S1593 VanDerWaalsContact O-N 3.14Å; S1591-S1593 PolarHBondContact O-N 2.88Å; S1593-I1596 WeakPolarHBondContact O-CG1 3.28Å; S1593-K1597 WeakPolarHBondContact O-CB 3.06Å; S1593-K1597 PolarHBondContact O-N 3.29Å; S1593-K1648 PolarHBondContact OG-O 3.19Å; S1593-A1649 PolarHBondContact OG-O 3.01Å; S1593-V1696 WeakPolarHBondContact OG-CB 3.31Å
1594A83.7Confident86.8Confident65 Ų6565.9 Ų65.954%0.53735%0.349SS..Hα-helixtrans-68-37.6175.700000111.8S1591 I1592S1591-A1594 WeakPolarHBondContact O-CB 3.01Å; S1591-A1594 PolarHBondContact O-N 3.45Å; I1592-A1594 VanDerWaalsContact C-N 3.31Å; I1592-A1594 PolarHBondContact O-N 2.95Å
1595E87.1Confident86.5Confident74 Ų7461.6 Ų61.635%0.34633%0.325SS..Hα-helixtrans-67.5-39.1178.1-172.4-177.917000112.9S1591 I1592 P1598 F1599 A1612 R1615S1591-E1595 PolarHBondContact O-N 3.27Å; S1591-E1595 VanDerWaalsContact O-N 3.12Å; I1592-E1595 PolarHBondContact O-N 3.41Å; I1592-E1595 VanDerWaalsContact O-N 3.16Å; E1595-P1598 VanDerWaalsContact O-CD 3.26Å; E1595-P1598 WeakPolarHBondContact O-CD 3.35Å; E1595-F1599 WeakPolarHBondContact O-CE2 3.48Å; E1595-A1612 WeakPolarHBondContact OE2-CB 3.22Å; E1595-R1615 IonicContact OE1-CZ 2.66Å; E1595-R1615 IonicContact OE1-NH1 2.78Å; E1595-R1615 PolarHBondContact OE1-NH1 2.97Å; E1595-R1615 IonicContact OE1-NH2 3.42Å; E1595-R1615 PolarHBondContact OE1-NH2 3.04Å; E1595-R1615 IonicContact OE2-CZ 2.65Å; E1595-R1615 IonicContact OE2-NH2 3.49Å; E1595-R1615 PolarHBondContact OE2-NH2 3.4Å
1596I88.1Confident86.2Confident0 Ų066.3 Ų66.30%035%0.346CS..Hα-helixtrans-83.9-15.8-177.568.6-179.9000113.3I1592 S1593 P1598 F1599 R1605 A1608 C1609 P1642 A1649 F1651I1592-I1596 HydrophobicContact CG2-CG2 4.11Å; I1592-I1596 WeakPolarHBondContact O-CG1 3.3Å; I1592-I1596 WeakPolarHBondContact O-CG2 3.4Å; I1592-I1596 PolarHBondContact O-N 2.97Å; S1593-I1596 WeakPolarHBondContact O-CG1 3.28Å; I1596-P1598 VanDerWaalsContact C-CD 3.44Å; I1596-F1599 PolarHBondContact O-N 2.84Å; I1596-F1599 VanDerWaalsContact O-N 3.14Å; I1596-R1605 HydrophobicContact CB-CG 4.14Å; I1596-A1608 HydrophobicContact CG2-CB 4.26Å; I1596-C1609 HydrophobicContact CD1-CB 4.24Å; I1596-C1609 HydrophobicContact CG2-CB 3.89Å; I1596-P1642 HydrophobicContact CD1-CB 4.14Å; I1596-A1649 HydrophobicContact CG1-CB 4.19Å; I1596-F1651 HydrophobicContact CD1-CB 4.15Å
1597K83Confident86Confident120 Ų12069.8 Ų69.852%0.52236%0.364SS..THydrogen-bonded Turntrans-53.8-42-177.4-172.8175.8-178.9172.80114S1593 F1599 A1647 A1649S1593-K1597 WeakPolarHBondContact O-CB 3.06Å; S1593-K1597 PolarHBondContact O-N 3.29Å; K1597-F1599 VanDerWaalsContact C-N 3.3Å; K1597-F1599 PolarHBondContact O-N 3.15Å; K1597-A1647 WeakPolarHBondContact CE-O 3.18Å; K1597-A1649 HydrophobicContact CB-CB 4.1Å; K1597-A1649 HydrophobicContact CG-CB 4.34Å
1598P83.9Confident85.9Confident108 Ų10865.5 Ų65.570%0.70134%0.342SS*.THydrogen-bonded Turntrans-69.6-20.6179.6-19.534000114.6E1595 I1596E1595-P1598 VanDerWaalsContact O-CD 3.26Å; E1595-P1598 WeakPolarHBondContact O-CD 3.35Å; I1596-P1598 VanDerWaalsContact C-CD 3.44Å
1599F85.1Confident85.9Confident74 Ų7461.5 Ų61.533%0.32532%0.323SS..SBendtrans-77.2139.8-176.3-67.4-91.6000111.5E1595 I1596 K1597 R1605 A1608E1595-F1599 WeakPolarHBondContact O-CE2 3.48Å; I1596-F1599 PolarHBondContact O-N 2.84Å; I1596-F1599 VanDerWaalsContact O-N 3.14Å; K1597-F1599 VanDerWaalsContact C-N 3.3Å; K1597-F1599 PolarHBondContact O-N 3.15Å; F1599-R1605 HydrophobicContact CB-CB 4.04Å; F1599-R1605 HydrophobicContact CB-CG 4.39Å; F1599-R1605 PolarHBondContact O-NE 3.34Å; F1599-R1605 PolarHBondContact O-NH2 3.21Å; F1599-A1608 HydrophobicContact CD1-CB 4.07Å; F1599-A1608 HydrophobicContact CD2-CB 3.78Å; F1599-A1608 HydrophobicContact CE1-CB 4.13Å; F1599-A1608 HydrophobicContact CE2-CB 3.83Å; F1599-A1608 HydrophobicContact CG-CB 3.89Å; F1599-A1608 HydrophobicContact CZ-CB 4.01Å
1600P80.4Confident85.9Confident72 Ų7264.1 Ų64.147%0.46834%0.336SS..PPolyproline II helixtrans-64.7149.3178.426.9-33.5000112G1602 E1604 R1605P1600-G1602 PolarHBondContact O-N 3.02Å; P1600-E1604 WeakPolarHBondContact CD-OE2 3.46Å; P1600-E1604 HydrophobicContact CG-CB 4.38Å; P1600-E1604 WeakPolarHBondContact CG-OE2 3.37Å; P1600-R1605 VanDerWaalsContact O-CB 3.26Å; P1600-R1605 WeakPolarHBondContact O-CB 3.37Å; P1600-R1605 PolarHBondContact O-N 2.87Å
1601K74.9Confident86Confident118 Ų11869.8 Ų69.851%0.51336%0.355SS..THydrogen-bonded Turntrans-60.5138.1179.8-65.5-175.8-172.2-177.50110.5Q1644 A1646K1601-Q1644 WeakPolarHBondContact CE-O 3.39Å; K1601-Q1644 PolarHBondContact NZ-O 3Å; K1601-A1646 VanDerWaalsContact CE-CA 3.43Å; K1601-A1646 VanDerWaalsContact NZ-CB 3.34Å
1602G81.2Confident86.1Confident50 Ų5067 Ų6752%0.51534%0.335SS..THydrogen-bonded Turntrans125.5-147.8179.200000111.7P1600 E1604 K1606P1600-G1602 PolarHBondContact O-N 3.02Å; G1602-E1604 PolarHBondContact O-N 2.88Å; G1602-K1606 PolarHBondContact O-N 3.13Å
1603R82.1Confident86.1Confident204 Ų20466.8 Ų66.877%0.7733%0.334SS*.Hα-helixtrans-63.7-39.2-173.8-160164.1-174.2164.90.1112.4R1605 K1606 D1607R1603-R1605 PolarHBondContact O-N 3Å; R1603-K1606 WeakPolarHBondContact O-CB 3.44Å; R1603-K1606 PolarHBondContact O-N 3.21Å; R1603-D1607 WeakPolarHBondContact O-CB 3.44Å; R1603-D1607 PolarHBondContact O-N 3.35Å
1604E86.3Confident86.3Confident120 Ų12070.2 Ų70.256%0.56136%0.358SS*.Hα-helixtrans-60.3-48.8179.1-66.7-177.1-165.100113.2P1600 G1602 K1606 D1607 A1608P1600-E1604 WeakPolarHBondContact CD-OE2 3.46Å; P1600-E1604 HydrophobicContact CG-CB 4.38Å; P1600-E1604 WeakPolarHBondContact CG-OE2 3.37Å; G1602-E1604 PolarHBondContact O-N 2.88Å; E1604-K1606 VanDerWaalsContact C-N 3.31Å; E1604-K1606 PolarHBondContact O-N 2.67Å; E1604-D1607 PolarHBondContact O-N 2.81Å; E1604-A1608 WeakPolarHBondContact O-CB 3.42Å; E1604-A1608 PolarHBondContact O-N 3.33Å
1605R86.9Confident86.6Confident19 Ų1973.3 Ų73.37%0.07236%0.356CS..Hα-helixtrans-64.8-36175.7-172.7-178.6-66.2-170-7112I1596 F1599 P1600 R1603 C1609 P1642I1596-R1605 HydrophobicContact CB-CG 4.14Å; F1599-R1605 HydrophobicContact CB-CB 4.04Å; F1599-R1605 HydrophobicContact CB-CG 4.39Å; F1599-R1605 PolarHBondContact O-NE 3.34Å; F1599-R1605 PolarHBondContact O-NH2 3.21Å; P1600-R1605 VanDerWaalsContact O-CB 3.26Å; P1600-R1605 WeakPolarHBondContact O-CB 3.37Å; P1600-R1605 PolarHBondContact O-N 2.87Å; R1603-R1605 PolarHBondContact O-N 3Å; R1605-C1609 VanDerWaalsContact O-CB 3.27Å; R1605-C1609 WeakPolarHBondContact O-CB 3.38Å; R1605-C1609 PolarHBondContact O-N 3.29Å; R1605-P1642 HydrophobicContact CB-CG 4.5Å; R1605-P1642 HydrophobicContact CG-CB 3.93Å; R1605-P1642 HydrophobicContact CG-CG 4.07Å
1606K85.5Confident86.7Confident102 Ų10270 Ų7044%0.44334%0.34SS..Hα-helixtrans-64.5-46.9175.7-171.8177.5-179179.40111.3G1602 R1603 E1604 A1608 C1609 M1610 P1642G1602-K1606 PolarHBondContact O-N 3.13Å; R1603-K1606 WeakPolarHBondContact O-CB 3.44Å; R1603-K1606 PolarHBondContact O-N 3.21Å; E1604-K1606 VanDerWaalsContact C-N 3.31Å; E1604-K1606 PolarHBondContact O-N 2.67Å; K1606-A1608 VanDerWaalsContact C-N 3.34Å; K1606-A1608 PolarHBondContact O-N 3.48Å; K1606-C1609 WeakPolarHBondContact O-CB 3.32Å; K1606-C1609 PolarHBondContact O-N 3.11Å; K1606-M1610 WeakPolarHBondContact O-CB 3.36Å; K1606-M1610 VanDerWaalsContact O-CG 3.27Å; K1606-M1610 WeakPolarHBondContact O-CG 3.49Å; K1606-M1610 PolarHBondContact O-N 3.18Å; K1606-P1642 HydrophobicContact CB-CG 4.14Å
1607D88.8Confident86.7Confident77 Ų7778 Ų7841%0.41238%0.375SS..Hα-helixtrans-66.4-37.5179.3-65-17.6000111.3R1603 E1604 R1611R1603-D1607 WeakPolarHBondContact O-CB 3.44Å; R1603-D1607 PolarHBondContact O-N 3.35Å; E1604-D1607 PolarHBondContact O-N 2.81Å; D1607-R1611 WeakPolarHBondContact O-CB 3.42Å; D1607-R1611 PolarHBondContact O-N 3.48Å
1608A89.4Confident86.9Confident1 Ų174 Ų741%0.00836%0.361CS..Hα-helixtrans-63.1-45.4171.900000112I1596 F1599 E1604 K1606 M1610 R1611 A1612I1596-A1608 HydrophobicContact CG2-CB 4.26Å; F1599-A1608 HydrophobicContact CD1-CB 4.07Å; F1599-A1608 HydrophobicContact CD2-CB 3.78Å; F1599-A1608 HydrophobicContact CE1-CB 4.13Å; F1599-A1608 HydrophobicContact CE2-CB 3.83Å; F1599-A1608 HydrophobicContact CG-CB 3.89Å; F1599-A1608 HydrophobicContact CZ-CB 4.01Å; E1604-A1608 WeakPolarHBondContact O-CB 3.42Å; E1604-A1608 PolarHBondContact O-N 3.33Å; K1606-A1608 VanDerWaalsContact C-N 3.34Å; K1606-A1608 PolarHBondContact O-N 3.48Å; A1608-M1610 VanDerWaalsContact C-N 3.35Å; A1608-M1610 PolarHBondContact O-N 3.44Å; A1608-R1611 PolarHBondContact O-N 3.36Å; A1608-A1612 WeakPolarHBondContact O-CB 3.39Å; A1608-A1612 PolarHBondContact O-N 2.87Å
1609C90.2Very high86.9Confident0 Ų071.3 Ų71.30%034%0.343CS..Hα-helixtrans-60.6-43.6177.3-1680000112.3I1596 R1605 K1606 A1612 L1613 P1642I1596-C1609 HydrophobicContact CD1-CB 4.24Å; I1596-C1609 HydrophobicContact CG2-CB 3.89Å; R1605-C1609 VanDerWaalsContact O-CB 3.27Å; R1605-C1609 WeakPolarHBondContact O-CB 3.38Å; R1605-C1609 PolarHBondContact O-N 3.29Å; K1606-C1609 WeakPolarHBondContact O-CB 3.32Å; K1606-C1609 PolarHBondContact O-N 3.11Å; C1609-A1612 PolarHBondContact O-N 3.47Å; C1609-L1613 WeakPolarHBondContact O-CB 3.36Å; C1609-L1613 PolarHBondContact O-N 3.16Å; C1609-P1642 HydrophobicContact CB-CG 4.34Å
1610M90.4Very high86.7Confident55 Ų5574 Ų7427%0.27135%0.354SS..Hα-helixtrans-62.6-44.6175.8-77.6-70.2-49.800112.2K1606 A1608 A1612 L1613 S1614 Y1637 A1640K1606-M1610 WeakPolarHBondContact O-CB 3.36Å; K1606-M1610 VanDerWaalsContact O-CG 3.27Å; K1606-M1610 WeakPolarHBondContact O-CG 3.49Å; K1606-M1610 PolarHBondContact O-N 3.18Å; A1608-M1610 VanDerWaalsContact C-N 3.35Å; A1608-M1610 PolarHBondContact O-N 3.44Å; M1610-A1612 VanDerWaalsContact C-N 3.32Å; M1610-A1612 PolarHBondContact O-N 2.97Å; M1610-L1613 PolarHBondContact O-N 3.28Å; M1610-S1614 WeakPolarHBondContact O-CB 3.32Å; M1610-S1614 PolarHBondContact O-N 3.36Å; M1610-S1614 PolarHBondContact O-OG 3.42Å; M1610-Y1637 WeakPolarHBondContact CE-O 3.48Å; M1610-A1640 HydrophobicContact CG-CB 4.21Å; M1610-A1640 HydrophobicContact SD-CB 3.67Å
1611R91.2Very high86.9Confident141 Ų14170.7 Ų70.753%0.53233%0.333SS..Hα-helixtrans-66.2-34.9177.2-167.8-174.2-57.8117.32.5112.2D1607 A1608 S1614D1607-R1611 WeakPolarHBondContact O-CB 3.42Å; D1607-R1611 PolarHBondContact O-N 3.48Å; A1608-R1611 PolarHBondContact O-N 3.36Å; R1611-S1614 PolarHBondContact O-OG 3.07Å
1612A91.1Very high87.6Confident2 Ų265.1 Ų65.12%0.01731%0.309CS..Hα-helixtrans-70.8-45.4176.600000111.4I1592 E1595 A1608 C1609 M1610 S1614 R1615I1592-A1612 HydrophobicContact CB-CB 4.37Å; I1592-A1612 HydrophobicContact CG1-CB 4.04Å; I1592-A1612 HydrophobicContact CG2-CB 3.77Å; E1595-A1612 WeakPolarHBondContact OE2-CB 3.22Å; A1608-A1612 WeakPolarHBondContact O-CB 3.39Å; A1608-A1612 PolarHBondContact O-N 2.87Å; C1609-A1612 PolarHBondContact O-N 3.47Å; M1610-A1612 VanDerWaalsContact C-N 3.32Å; M1610-A1612 PolarHBondContact O-N 2.97Å; A1612-S1614 VanDerWaalsContact C-N 3.33Å; A1612-S1614 PolarHBondContact O-N 2.86Å; A1612-R1615 PolarHBondContact O-N 3.08Å
1613L91.7Very high88.2Confident0 Ų062.7 Ų62.70%028%0.284CS..Hα-helixtrans-63.7-36.7177.9-169.865.7000112.3I1592 C1609 M1610 R1615 V1616 I1635 Y1637 A1640 A1653I1592-L1613 HydrophobicContact CD1-CB 4.21Å; I1592-L1613 HydrophobicContact CD1-CD1 3.81Å; C1609-L1613 WeakPolarHBondContact O-CB 3.36Å; C1609-L1613 PolarHBondContact O-N 3.16Å; M1610-L1613 PolarHBondContact O-N 3.28Å; L1613-R1615 PolarHBondContact O-N 3.46Å; L1613-V1616 PolarHBondContact O-N 3.38Å; L1613-V1616 VanDerWaalsContact O-N 3.12Å; L1613-I1635 HydrophobicContact CD1-CG2 4.17Å; L1613-I1635 HydrophobicContact CD2-CG2 4.05Å; L1613-I1635 HydrophobicContact CG-CG2 4.23Å; L1613-Y1637 HydrophobicContact CG-CD1 4.26Å; L1613-Y1637 WeakPolarHBondContact O-CD1 3.22Å; L1613-A1640 HydrophobicContact CB-CB 4.16Å; L1613-A1640 HydrophobicContact CD2-CB 3.64Å; L1613-A1653 HydrophobicContact CD2-CB 4.31Å
1614S90.4Very high88.6Confident73 Ų7353 Ų5351%0.5125%0.248SC..THydrogen-bonded Turntrans-67-15.1179.270.70000114.6M1610 R1611 A1612M1610-S1614 WeakPolarHBondContact O-CB 3.32Å; M1610-S1614 PolarHBondContact O-N 3.36Å; M1610-S1614 PolarHBondContact O-OG 3.42Å; R1611-S1614 PolarHBondContact O-OG 3.07Å; A1612-S1614 VanDerWaalsContact C-N 3.33Å; A1612-S1614 PolarHBondContact O-N 2.86Å
1615R90.8Very high88.8Confident129 Ų12947.3 Ų47.349%0.48722%0.221SC..THydrogen-bonded Turntrans-84.3-22.6173.7-67.3-175.6-56.2-132.5-5.9113E1595 A1612 L1613 K1617E1595-R1615 IonicContact OE1-CZ 2.66Å; E1595-R1615 IonicContact OE1-NH1 2.78Å; E1595-R1615 PolarHBondContact OE1-NH1 2.97Å; E1595-R1615 IonicContact OE1-NH2 3.42Å; E1595-R1615 PolarHBondContact OE1-NH2 3.04Å; E1595-R1615 IonicContact OE2-CZ 2.65Å; E1595-R1615 IonicContact OE2-NH2 3.49Å; E1595-R1615 PolarHBondContact OE2-NH2 3.4Å; A1612-R1615 PolarHBondContact O-N 3.08Å; L1613-R1615 PolarHBondContact O-N 3.46Å; R1615-K1617 PolarHBondContact O-N 3.21Å
1616V89.5Confident88.9Confident4 Ų446.7 Ų46.72%0.02422%0.22CC..PPolyproline II helixtrans-72.3125.5178.2-178.30000108.8F1585 E1588 I1589 I1592 L1613 I1635 Y1637F1585-V1616 HydrophobicContact CD2-CG1 4.39Å; F1585-V1616 HydrophobicContact CE2-CG1 3.91Å; E1588-V1616 HydrophobicContact CG-CG2 4.19Å; I1589-V1616 HydrophobicContact CD1-CG1 4.5Å; I1589-V1616 HydrophobicContact CG1-CG1 3.88Å; I1592-V1616 HydrophobicContact CD1-CG2 3.99Å; L1613-V1616 PolarHBondContact O-N 3.38Å; L1613-V1616 VanDerWaalsContact O-N 3.12Å; V1616-I1635 HydrophobicContact CG1-CD1 4.25Å; V1616-Y1637 VanDerWaalsContact O-CE1 3.29Å; V1616-Y1637 WeakPolarHBondContact O-CE1 3.33Å; V1616-Y1637 PolarHBondContact O-OH 2.89Å
1617K87.2Confident89Confident168 Ų16842.2 Ų42.273%0.7320%0.201SC*.PPolyproline II helixtrans-99.3135.5174-68.5-177.8-179.21780110.1R1615 V1619R1615-K1617 PolarHBondContact O-N 3.21Å; K1617-V1619 PolarHBondContact O-N 3.37Å
1618V86.9Confident89Confident36 Ų3639.3 Ų39.322%0.21819%0.186CC..PPolyproline II helixtrans-64.7122.6177.7-173.20000110.8V1632 I1635 Y1637V1618-V1632 HydrophobicContact CG1-CG1 3.99Å; V1618-I1635 HydrophobicContact CG2-CB 4.1Å; V1618-I1635 HydrophobicContact CG2-CD1 3.88Å; V1618-I1635 HydrophobicContact CG2-CG1 3.66Å; V1618-Y1637 WeakPolarHBondContact CG2-OH 3Å
1619V84.3Confident88.9Confident53 Ų5341.2 Ų41.232%0.32120%0.195SC..  trans-96.5112.6174-1780000108.7R1581 F1585 K1617 C1622R1581-V1619 HydrophobicContact CG-CG1 4.48Å; F1585-V1619 HydrophobicContact CD2-CB 4.22Å; F1585-V1619 HydrophobicContact CD2-CG2 3.96Å; F1585-V1619 HydrophobicContact CG-CB 4.4Å; F1585-V1619 HydrophobicContact CG-CG2 4.46Å; K1617-V1619 PolarHBondContact O-N 3.37Å; V1619-C1622 PolarHBondContact O-SG 2.99Å; V1619-C1622 VanDerWaalsContact O-SG 3.39Å
1620K81.9Confident88.9Confident130 Ų13041.2 Ų41.257%0.56520%0.195SC*.THydrogen-bonded Turntrans-61.6144.6176.1-69.3-173.2179.2-177.30111.1R1581R1581-K1620 PolarHBondContact NH1-O 3.45Å
1621G84Confident88.9Confident3 Ų339.4 Ų39.43%0.03119%0.186CC..THydrogen-bonded Turntrans84.521.6-178.400000113.9F1578 C1669F1578-G1621 WeakPolarHBondContact CE2-O 3.23Å; G1621-C1669 PolarHBondContact O-SG 3.17Å
1622C90.4Very high89Confident0 Ų032.9 Ų32.90%016%0.162CC..  trans-108.6143.2169.1-56.80000109.6Q1582 F1585 F1586 V1619 L1631 V1632Q1582-C1622 VanDerWaalsContact OE1-CA 3.24Å; F1585-C1622 HydrophobicContact CD1-CB 3.85Å; F1585-C1622 HydrophobicContact CE1-CB 4.28Å; F1586-C1622 HydrophobicContact CE2-CB 4.23Å; V1619-C1622 PolarHBondContact O-SG 2.99Å; V1619-C1622 VanDerWaalsContact O-SG 3.39Å; C1622-L1631 WeakPolarHBondContact O-CD1 3.49Å; C1622-V1632 WeakPolarHBondContact O-CB 3.41Å; C1622-V1632 PolarHBondContact O-N 3.32Å
1623Y92.5Very high88.9Confident0 Ų035.6 Ų35.60%018%0.178CC..EExtended strand (participates in β ladder)trans-107.8159.6173.971-84.2000110.3L1530 H1533 W1537 F1578 Q1582 F1586 P1625 P1628 A1630 V1665L1530-Y1623 HydrophobicContact CD2-CD1 3.55Å; L1530-Y1623 HydrophobicContact CD2-CD2 4.1Å; L1530-Y1623 HydrophobicContact CD2-CE1 3.26Å; L1530-Y1623 HydrophobicContact CD2-CE2 3.85Å; L1530-Y1623 HydrophobicContact CD2-CG 3.95Å; L1530-Y1623 VanDerWaalsContact CD2-CZ 3.41Å; H1533-Y1623 WeakPolarHBondContact CB-OH 3.27Å; H1533-Y1623 AromaticContact ND1-CE1 3.85Å; W1537-Y1623 HydrophobicContact CH2-CE2 4.35Å; W1537-Y1623 WeakPolarHBondContact CH2-OH 3.46Å; W1537-Y1623 HydrophobicContact CZ3-CE2 4.31Å; W1537-Y1623 WeakPolarHBondContact CZ3-OH 3.28Å; F1578-Y1623 HydrophobicContact CE2-CD1 4.08Å; F1578-Y1623 HydrophobicContact CE2-CE1 4.25Å; F1578-Y1623 AromaticContact CZ-CD1 3.75Å; F1578-Y1623 HydrophobicContact CZ-CD1 3.75Å; F1578-Y1623 AromaticContact CZ-CE1 3.77Å; F1578-Y1623 HydrophobicContact CZ-CE1 3.77Å; Q1582-Y1623 VanDerWaalsContact CD-CE1 3.48Å; Q1582-Y1623 HydrophobicContact CG-CD1 4.47Å; Q1582-Y1623 HydrophobicContact CG-CE1 3.87Å; Q1582-Y1623 PolarHBondContact NE2-O 3.24Å; Q1582-Y1623 PolarHBondContact OE1-O 2.9Å; F1586-Y1623 WeakPolarHBondContact CE2-O 3.25Å; F1586-Y1623 VanDerWaalsContact CZ-O 3.32Å; F1586-Y1623 WeakPolarHBondContact CZ-O 3.32Å; Y1623-P1625 WeakPolarHBondContact O-CD 3.5Å; Y1623-P1628 HydrophobicContact CD2-CB 4.37Å; Y1623-P1628 HydrophobicContact CE2-CB 4.3Å; Y1623-A1630 CarbonylContact C-O 3.24Å; Y1623-A1630 VanDerWaalsContact CA-O 3.26Å; Y1623-A1630 WeakPolarHBondContact CA-O 3.28Å; Y1623-A1630 WeakPolarHBondContact CB-O 3.37Å; Y1623-V1665 HydrophobicContact CD1-CG1 4.49Å; Y1623-V1665 HydrophobicContact CG-CG1 4.39Å
1624L91.2Very high88.9Confident0 Ų038.8 Ų38.80%020%0.195CC..EExtended strand (participates in β ladder)trans-71.8126.5178.7-166.371.1000110.6F1586 S1626 D1627 A1630 F1655 Q1690 A1692F1586-L1624 HydrophobicContact CE1-CD1 4Å; F1586-L1624 HydrophobicContact CZ-CD1 4.21Å; L1624-S1626 VanDerWaalsContact C-N 3.26Å; L1624-S1626 WeakPolarHBondContact CD2-OG 3.27Å; L1624-S1626 PolarHBondContact O-N 3.41Å; L1624-S1626 VanDerWaalsContact O-N 3.14Å; L1624-D1627 HydrophobicContact CB-CB 4.33Å; L1624-D1627 HydrophobicContact CD2-CB 4.28Å; L1624-D1627 CarbonylContact O-C 3.57Å; L1624-D1627 WeakPolarHBondContact O-CA 3.3Å; L1624-D1627 PolarHBondContact O-N 2.92Å; L1624-A1630 HydrophobicContact CB-CB 4.36Å; L1624-A1630 PolarHBondContact N-O 3.18Å; L1624-F1655 HydrophobicContact CD1-CD2 3.88Å; L1624-F1655 HydrophobicContact CD1-CE2 4.1Å; L1624-F1655 HydrophobicContact CD1-CG 4.16Å; L1624-Q1690 HydrophobicContact CD2-CG 3.98Å; L1624-A1692 HydrophobicContact CD1-CB 4.34Å; L1624-A1692 HydrophobicContact CD2-CB 4.35Å
1625P90.8Very high88.9Confident1 Ų135.5 Ų35.51%0.00617%0.172CC..THydrogen-bonded Turntrans-54.8-39.4-175.8-31.435.6000114.1Q1534 W1537 F1586 Y1623 D1627 V1732 T1734 V1740Q1534-P1625 PolarHBondContact NE2-O 3.28Å; W1537-P1625 HydrophobicContact CE3-CB 4.34Å; W1537-P1625 HydrophobicContact CH2-CB 3.59Å; W1537-P1625 HydrophobicContact CH2-CG 3.73Å; W1537-P1625 HydrophobicContact CZ2-CB 4.24Å; W1537-P1625 HydrophobicContact CZ2-CG 4.12Å; W1537-P1625 HydrophobicContact CZ3-CB 3.63Å; W1537-P1625 HydrophobicContact CZ3-CG 4.29Å; F1586-P1625 HydrophobicContact CB-CG 4.16Å; F1586-P1625 HydrophobicContact CD1-CG 3.65Å; F1586-P1625 HydrophobicContact CD2-CG 3.68Å; F1586-P1625 HydrophobicContact CE1-CG 3.95Å; F1586-P1625 HydrophobicContact CE2-CG 3.99Å; F1586-P1625 HydrophobicContact CG-CG 3.51Å; F1586-P1625 HydrophobicContact CZ-CG 4.12Å; Y1623-P1625 WeakPolarHBondContact O-CD 3.5Å; P1625-D1627 PolarHBondContact O-N 3.45Å; P1625-V1732 VanDerWaalsContact C-CG1 3.48Å; P1625-V1732 HydrophobicContact CB-CG1 3.74Å; P1625-V1732 WeakPolarHBondContact O-CG1 3.45Å; P1625-T1734 HydrophobicContact CB-CG2 4.36Å; P1625-V1740 HydrophobicContact CB-CB 4.49Å; P1625-V1740 HydrophobicContact CB-CG2 4.26Å; P1625-V1740 HydrophobicContact CG-CG2 4.44Å
1626S88.5Confident89Confident5 Ų530.7 Ų30.74%0.03516%0.156CC..THydrogen-bonded Turntrans-72.9-13.917754.70000113L1624 R1730L1624-S1626 VanDerWaalsContact C-N 3.26Å; L1624-S1626 WeakPolarHBondContact CD2-OG 3.27Å; L1624-S1626 PolarHBondContact O-N 3.41Å; L1624-S1626 VanDerWaalsContact O-N 3.14Å; S1626-R1730 WeakPolarHBondContact O-CB 3.19Å; S1626-R1730 WeakPolarHBondContact O-CD 3.43Å
1627D88.3Confident89Confident8 Ų834.3 Ų34.34%0.04317%0.17CC..EExtended strand (participates in β ladder)trans-142.889.7-174.4-164.7-7.5000111.8L1624 P1625 E1629 A1630 Q1690 R1730L1624-D1627 HydrophobicContact CB-CB 4.33Å; L1624-D1627 HydrophobicContact CD2-CB 4.28Å; L1624-D1627 CarbonylContact O-C 3.57Å; L1624-D1627 WeakPolarHBondContact O-CA 3.3Å; L1624-D1627 PolarHBondContact O-N 2.92Å; P1625-D1627 PolarHBondContact O-N 3.45Å; D1627-E1629 PolarHBondContact O-N 3.33Å; D1627-E1629 PolarHBondContact OD1-N 2.88Å; D1627-A1630 HydrophobicContact CB-CB 3.89Å; D1627-A1630 PolarHBondContact O-N 3.07Å; D1627-Q1690 PolarHBondContact OD2-NE2 2.91Å; D1627-Q1690 PolarHBondContact OD2-OE1 3.13Å; D1627-R1730 IonicContact OD1-CZ 3.88Å; D1627-R1730 IonicContact OD1-NH1 3.21Å; D1627-R1730 PolarHBondContact OD1-NH1 3.31Å
1628P87.5Confident88.9Confident16 Ų1630.6 Ų30.610%0.10416%0.164CC..EExtended strand (participates in β ladder)trans-63.5-7.2-178.326.4-35.4000115L1499 L1530 Y1623 V1665L1499-P1628 HydrophobicContact CD1-CG 4.42Å; L1530-P1628 HydrophobicContact CD2-CB 4.27Å; Y1623-P1628 HydrophobicContact CD2-CB 4.37Å; Y1623-P1628 HydrophobicContact CE2-CB 4.3Å; P1628-V1665 WeakPolarHBondContact O-CG2 3.38Å
1629E87.7Confident88.8Confident42 Ų4229.4 Ų29.420%0.19616%0.158CC..EExtended strand (participates in β ladder)trans-98.1-4177.8-69.6171.314100112.4D1627 Y1660 V1662 R1730D1627-E1629 PolarHBondContact O-N 3.33Å; D1627-E1629 PolarHBondContact OD1-N 2.88Å; E1629-Y1660 WeakPolarHBondContact CA-O 2.98Å; E1629-Y1660 WeakPolarHBondContact CB-O 3.49Å; E1629-Y1660 PolarHBondContact O-N 3.43Å; E1629-Y1660 VanDerWaalsContact O-O 3.13Å; E1629-V1662 HydrophobicContact CG-CG2 3.82Å; E1629-R1730 IonicContact OE2-CZ 3.67Å; E1629-R1730 VanDerWaalsContact OE2-CZ 3.32Å; E1629-R1730 IonicContact OE2-NH1 3.73Å; E1629-R1730 PolarHBondContact OE2-NH1 3.44Å; E1629-R1730 IonicContact OE2-NH2 2.99Å; E1629-R1730 PolarHBondContact OE2-NH2 2.86Å
1630A90.4Very high88.9Confident0 Ų026.9 Ų26.90%014%0.143CC..EExtended strand (participates in β ladder)trans-110.2101.2-174.500000111.3Y1623 L1624 D1627 V1657Y1623-A1630 CarbonylContact C-O 3.24Å; Y1623-A1630 VanDerWaalsContact CA-O 3.26Å; Y1623-A1630 WeakPolarHBondContact CA-O 3.28Å; Y1623-A1630 WeakPolarHBondContact CB-O 3.37Å; L1624-A1630 HydrophobicContact CB-CB 4.36Å; L1624-A1630 PolarHBondContact N-O 3.18Å; D1627-A1630 HydrophobicContact CB-CB 3.89Å; D1627-A1630 PolarHBondContact O-N 3.07Å; A1630-V1657 HydrophobicContact CB-CB 3.99Å; A1630-V1657 HydrophobicContact CB-CG1 4.16Å; A1630-V1657 HydrophobicContact CB-CG2 4.15Å
1631L90.9Very high89.2Confident17 Ų1723.8 Ų23.89%0.08914%0.135CC..EExtended strand (participates in β ladder)trans-79.7127.9175.7-167.175.7000110.2C1622 V1633 V1657 R1658 Y1660 V1665 I1668C1622-L1631 WeakPolarHBondContact O-CD1 3.49Å; L1631-V1633 PolarHBondContact O-N 3.47Å; L1631-V1657 CarbonylContact O-C 3.59Å; L1631-V1657 WeakPolarHBondContact O-CA 3.49Å; L1631-R1658 PolarHBondContact N-O 3.22Å; L1631-R1658 PolarHBondContact O-N 3Å; L1631-Y1660 HydrophobicContact CB-CD2 3.91Å; L1631-Y1660 HydrophobicContact CB-CE2 4.06Å; L1631-Y1660 HydrophobicContact CD2-CD2 4.46Å; L1631-Y1660 HydrophobicContact CD2-CE2 3.96Å; L1631-V1665 HydrophobicContact CD1-CG1 4.34Å; L1631-I1668 HydrophobicContact CD2-CG2 3.99Å
1632V92.1Very high89.2Confident3 Ų324.9 Ų24.92%0.01814%0.141CC..EExtended strand (participates in β ladder)trans-74.1122.9-179.3-177.50000110F1585 F1586 V1618 C1622 F1655F1585-V1632 HydrophobicContact CE1-CG1 4.46Å; F1586-V1632 HydrophobicContact CZ-CG2 4.17Å; V1618-V1632 HydrophobicContact CG1-CG1 3.99Å; C1622-V1632 WeakPolarHBondContact O-CB 3.41Å; C1622-V1632 PolarHBondContact O-N 3.32Å; V1632-F1655 HydrophobicContact CG1-CD1 4.08Å; V1632-F1655 HydrophobicContact CG2-CD1 4.49Å
1633V90Very high88.6Confident60 Ų6028.7 Ų28.736%0.36416%0.16SC..EExtended strand (participates in β ladder)trans-103.1-42.4176.9-178.50000110.8L1631 K1656 R1658 L1687L1631-V1633 PolarHBondContact O-N 3.47Å; V1633-K1656 WeakPolarHBondContact CA-O 3.32Å; V1633-K1656 WeakPolarHBondContact CB-O 3.47Å; V1633-K1656 PolarHBondContact N-O 3.49Å; V1633-R1658 HydrophobicContact CG2-CB 4.03Å; V1633-L1687 HydrophobicContact CB-CD1 4.47Å; V1633-L1687 HydrophobicContact CG2-CD1 3.99Å
1634D91.6Very high87.3Confident67 Ų6734.8 Ų34.836%0.35819%0.189SC..EExtended strand (participates in β ladder)trans-155.9170.5-179.3-154.5-1.5000112.4F1655 K1656D1634-F1655 CarbonylContact O-C 3.43Å; D1634-F1655 WeakPolarHBondContact O-CA 3.2Å; D1634-K1656 HydrophobicContact CB-CB 3.84Å; D1634-K1656 HydrophobicContact CB-CD 4.36Å; D1634-K1656 PolarHBondContact N-O 2.91Å; D1634-K1656 PolarHBondContact O-N 3.36Å
1635I91.4Very high85.9Confident3 Ų337.1 Ų37.12%0.01521%0.205CC..EExtended strand (participates in β ladder)trans-119.2135.6173.7-63.1173.1000109.3F1585 I1589 L1613 V1616 V1618 Y1637 F1655F1585-I1635 HydrophobicContact CE2-CD1 4.31Å; F1585-I1635 HydrophobicContact CZ-CD1 3.99Å; I1589-I1635 HydrophobicContact CD1-CD1 4.43Å; L1613-I1635 HydrophobicContact CD1-CG2 4.17Å; L1613-I1635 HydrophobicContact CD2-CG2 4.05Å; L1613-I1635 HydrophobicContact CG-CG2 4.23Å; V1616-I1635 HydrophobicContact CG1-CD1 4.25Å; V1618-I1635 HydrophobicContact CG2-CB 4.1Å; V1618-I1635 HydrophobicContact CG2-CD1 3.88Å; V1618-I1635 HydrophobicContact CG2-CG1 3.66Å; I1635-Y1637 HydrophobicContact CB-CE1 4.15Å; I1635-Y1637 HydrophobicContact CB-CE2 4.46Å; I1635-Y1637 HydrophobicContact CG2-CD1 4.23Å; I1635-Y1637 HydrophobicContact CG2-CE1 4.23Å; I1635-Y1637 VanDerWaalsContact O-CD2 3.3Å; I1635-Y1637 WeakPolarHBondContact O-CD2 3.42Å; I1635-Y1637 WeakPolarHBondContact O-CE2 3.45Å; I1635-Y1637 PolarHBondContact O-N 2.95Å; I1635-Y1637 VanDerWaalsContact O-N 3.15Å; I1635-F1655 HydrophobicContact CD1-CD1 4.38Å; I1635-F1655 HydrophobicContact CD1-CE1 3.96Å; I1635-F1655 HydrophobicContact CG1-CD1 3.7Å; I1635-F1655 HydrophobicContact CG1-CE1 3.76Å
1636D91.4Very high83.9Confident28 Ų2840.6 Ų40.615%0.1523%0.234CC..EExtended strand (participates in β ladder)trans-80.294167.2177.52.7000108.7S1638 S1639 R1654 W1689D1636-S1638 PolarHBondContact O-N 3.44Å; D1636-S1638 WeakPolarHBondContact OD1-CA 3.4Å; D1636-S1638 WeakPolarHBondContact OD1-CB 3.5Å; D1636-S1638 PolarHBondContact OD1-N 3.28Å; D1636-S1638 PolarHBondContact OD1-OG 3.11Å; D1636-S1639 WeakPolarHBondContact O-CB 3.45Å; D1636-S1639 PolarHBondContact O-N 2.91Å; D1636-S1639 PolarHBondContact O-OG 3.2Å; D1636-S1639 PolarHBondContact OD1-N 3.47Å; D1636-S1639 WeakPolarHBondContact OD2-CB 3.25Å; D1636-R1654 HydrophobicContact CB-CB 3.94Å; D1636-R1654 PolarHBondContact N-O 3.22Å; D1636-R1654 IonicContact OD2-NH1 3.71Å; D1636-W1689 HydrophobicContact CB-CE3 4.13Å; D1636-W1689 HydrophobicContact CB-CH2 3.8Å; D1636-W1689 HydrophobicContact CB-CZ3 3.47Å; D1636-W1689 VanDerWaalsContact CB-CZ3 3.47Å
1637Y90.2Very high82.5Confident81 Ų8143.7 Ų43.732%0.31826%0.26SS..EExtended strand (participates in β ladder)trans-61.8-14179.1-59.1-76.5000113.5M1610 L1613 V1616 V1618 I1635M1610-Y1637 WeakPolarHBondContact CE-O 3.48Å; L1613-Y1637 HydrophobicContact CG-CD1 4.26Å; L1613-Y1637 WeakPolarHBondContact O-CD1 3.22Å; V1616-Y1637 VanDerWaalsContact O-CE1 3.29Å; V1616-Y1637 WeakPolarHBondContact O-CE1 3.33Å; V1616-Y1637 PolarHBondContact O-OH 2.89Å; V1618-Y1637 WeakPolarHBondContact CG2-OH 3Å; I1635-Y1637 HydrophobicContact CB-CE1 4.15Å; I1635-Y1637 HydrophobicContact CB-CE2 4.46Å; I1635-Y1637 HydrophobicContact CG2-CD1 4.23Å; I1635-Y1637 HydrophobicContact CG2-CE1 4.23Å; I1635-Y1637 VanDerWaalsContact O-CD2 3.3Å; I1635-Y1637 WeakPolarHBondContact O-CD2 3.42Å; I1635-Y1637 WeakPolarHBondContact O-CE2 3.45Å; I1635-Y1637 PolarHBondContact O-N 2.95Å; I1635-Y1637 VanDerWaalsContact O-N 3.15Å
1638S85.9Confident81.6Confident89 Ų8945.6 Ų45.662%0.62227%0.267SS*.EExtended strand (participates in β ladder)trans-88.2-8.4175.277.60000114.8D1636D1636-S1638 PolarHBondContact O-N 3.44Å; D1636-S1638 WeakPolarHBondContact OD1-CA 3.4Å; D1636-S1638 WeakPolarHBondContact OD1-CB 3.5Å; D1636-S1638 PolarHBondContact OD1-N 3.28Å; D1636-S1638 PolarHBondContact OD1-OG 3.11Å
1639S84.8Confident81.3Confident12 Ų1244.9 Ų44.98%0.08426%0.263CS..EExtended strand (participates in β ladder)trans-84.2-12.2-174.467.40000115.3D1636 T1641 R1654D1636-S1639 WeakPolarHBondContact O-CB 3.45Å; D1636-S1639 PolarHBondContact O-N 2.91Å; D1636-S1639 PolarHBondContact O-OG 3.2Å; D1636-S1639 PolarHBondContact OD1-N 3.47Å; D1636-S1639 WeakPolarHBondContact OD2-CB 3.25Å; S1639-T1641 PolarHBondContact O-N 2.68Å; S1639-T1641 PolarHBondContact O-OG1 3.1Å; S1639-R1654 PolarHBondContact OG-N 2.93Å
1640A86.5Confident81.3Confident0 Ų043 Ų430%025%0.254CS..EExtended strand (participates in β ladder)trans-59.6109.8-170.500000111.5M1610 L1613 L1652M1610-A1640 HydrophobicContact CG-CB 4.21Å; M1610-A1640 HydrophobicContact SD-CB 3.67Å; L1613-A1640 HydrophobicContact CB-CB 4.16Å; L1613-A1640 HydrophobicContact CD2-CB 3.64Å; A1640-L1652 WeakPolarHBondContact CA-O 3.17Å
1641T86.6Confident81.2Confident65 Ų6543 Ų4340%0.39925%0.254SS..EExtended strand (participates in β ladder)trans-127.5105.3-176.2-54.40000110.6S1639 F1651 L1652S1639-T1641 PolarHBondContact O-N 2.68Å; S1639-T1641 PolarHBondContact O-OG1 3.1Å; T1641-F1651 WeakPolarHBondContact O-CA 2.86Å; T1641-L1652 PolarHBondContact N-O 3.41Å; T1641-L1652 PolarHBondContact O-N 2.94Å
1642P84.8Confident81.1Confident26 Ų2644.2 Ų44.217%0.16926%0.261CS..EExtended strand (participates in β ladder)trans-68.7132.7173.727-32.1000110.5I1596 R1605 K1606 C1609I1596-P1642 HydrophobicContact CD1-CB 4.14Å; R1605-P1642 HydrophobicContact CB-CG 4.5Å; R1605-P1642 HydrophobicContact CG-CB 3.93Å; R1605-P1642 HydrophobicContact CG-CG 4.07Å; K1606-P1642 HydrophobicContact CB-CG 4.14Å; C1609-P1642 HydrophobicContact CB-CG 4.34Å
1643M77.9Confident81.1Confident80 Ų8044 Ų4439%0.39426%0.26SS..  trans-89.7166.5-176.7-61.1-177.571.300112.3S1645 P1650 I1693M1643-S1645 PolarHBondContact O-N 3.45Å; M1643-P1650 HydrophobicContact CB-CG 4.16Å; M1643-P1650 PolarHBondContact N-O 3.48Å; M1643-I1693 HydrophobicContact CE-CD1 4.19Å; M1643-I1693 HydrophobicContact SD-CB 4.47Å; M1643-I1693 HydrophobicContact SD-CD1 3.83Å; M1643-I1693 HydrophobicContact SD-CG1 3.98Å; M1643-I1693 HydrophobicContact SD-CG2 3.64Å
1644Q65.2Low81.2Confident128 Ų12845.6 Ų45.660%0.59826%0.259SS*.SBendtrans-75.6-9.6-164.3-67.4-174.6-15.200116K1601 A1646K1601-Q1644 WeakPolarHBondContact CE-O 3.39Å; K1601-Q1644 PolarHBondContact NZ-O 3Å; Q1644-A1646 PolarHBondContact O-N 3.42Å
1645S62.2Low81.3Confident48 Ų4842.4 Ų42.434%0.33624%0.242SC..  trans-64.6121.3-17629.20000112M1643 A1647 P1650M1643-S1645 PolarHBondContact O-N 3.45Å; S1645-A1647 PolarHBondContact O-N 3.45Å; S1645-P1650 WeakPolarHBondContact OG-CD 3.07Å; S1645-P1650 WeakPolarHBondContact OG-CG 3.44Å
1646A48.7Very low81.4Confident75 Ų7545.4 Ų45.462%0.6226%0.255SS*.THydrogen-bonded Turntrans-66.3-39.7-165.500000114.7K1601 Q1644K1601-A1646 VanDerWaalsContact CE-CA 3.43Å; K1601-A1646 VanDerWaalsContact NZ-CB 3.34Å; Q1644-A1646 PolarHBondContact O-N 3.42Å
1647A59.1Low81.4Confident70 Ų7044.1 Ų44.158%0.57925%0.248SC*.THydrogen-bonded Turntrans-92-18.3-168.600000114.7K1597 S1645K1597-A1647 WeakPolarHBondContact CE-O 3.18Å; S1645-A1647 PolarHBondContact O-N 3.45Å
1648K69.3Low81.4Confident47 Ų4744.9 Ų44.920%0.20425%0.25CS..THydrogen-bonded Turntrans-125.1-16.8-157.7-73.5-179.5-174.9-1650114.7E1547 S1593 P1650 V1696 G1697 D1698E1547-K1648 IonicContact OE1-NZ 2.6Å; E1547-K1648 IonicContact OE2-NZ 2.76Å; E1547-K1648 PolarHBondContact OE2-NZ 3.11Å; S1593-K1648 PolarHBondContact OG-O 3.19Å; K1648-P1650 VanDerWaalsContact C-CD 3.41Å; K1648-V1696 VanDerWaalsContact CB-O 3.26Å; K1648-V1696 WeakPolarHBondContact CB-O 3.48Å; K1648-V1696 VanDerWaalsContact O-O 3.11Å; K1648-G1697 VanDerWaalsContact CD-C 3.46Å; K1648-G1697 VanDerWaalsContact CD-O 3.24Å; K1648-G1697 WeakPolarHBondContact CD-O 3.37Å; K1648-G1697 WeakPolarHBondContact CE-O 3.24Å; K1648-G1697 PolarHBondContact NZ-O 2.84Å; K1648-D1698 HydrophobicContact CD-CB 4.26Å; K1648-D1698 WeakPolarHBondContact CD-OD1 3.39Å; K1648-D1698 VanDerWaalsContact CE-OD1 3.28Å; K1648-D1698 WeakPolarHBondContact CE-OD1 3.47Å; K1648-D1698 IonicContact NZ-OD1 3.96Å; K1648-D1698 PolarHBondContact NZ-OD1 2.91Å
1649A81.3Confident81.4Confident1 Ų146 Ų461%0.00824%0.244CC..  trans46.249.3175.500000116.3S1593 I1596 K1597S1593-A1649 PolarHBondContact OG-O 3.01Å; I1596-A1649 HydrophobicContact CG1-CB 4.19Å; K1597-A1649 HydrophobicContact CB-CB 4.1Å; K1597-A1649 HydrophobicContact CG-CB 4.34Å
1650P86.5Confident81.4Confident3 Ų348.3 Ų48.32%0.01925%0.251CS..  trans-67.2154.6172.528.9-31.1000111.1M1643 S1645 K1648 I1693 F1694 K1695M1643-P1650 HydrophobicContact CB-CG 4.16Å; M1643-P1650 PolarHBondContact N-O 3.48Å; S1645-P1650 WeakPolarHBondContact OG-CD 3.07Å; S1645-P1650 WeakPolarHBondContact OG-CG 3.44Å; K1648-P1650 VanDerWaalsContact C-CD 3.41Å; P1650-I1693 HydrophobicContact CB-CG2 4.35Å; P1650-F1694 WeakPolarHBondContact CA-O 3.36Å; P1650-F1694 WeakPolarHBondContact CB-O 3.49Å; P1650-K1695 HydrophobicContact CB-CB 4.47Å; P1650-K1695 HydrophobicContact CB-CG 4.22Å
1651F89.4Confident81.3Confident0 Ų051.5 Ų51.50%027%0.271CS..EExtended strand (participates in β ladder)trans-138.9152178.877.5-79.5000112I1589 I1592 I1596 T1641 A1653 I1693 F1694I1589-F1651 HydrophobicContact CG2-CZ 3.87Å; I1589-F1651 WeakPolarHBondContact O-CZ 3.43Å; I1592-F1651 HydrophobicContact CB-CE1 3.8Å; I1592-F1651 HydrophobicContact CB-CZ 3.84Å; I1592-F1651 HydrophobicContact CD1-CE2 4.31Å; I1592-F1651 HydrophobicContact CD1-CZ 3.98Å; I1592-F1651 HydrophobicContact CG1-CZ 4.43Å; I1592-F1651 HydrophobicContact CG2-CD1 4.28Å; I1592-F1651 HydrophobicContact CG2-CE1 4Å; I1592-F1651 HydrophobicContact CG2-CE2 4.35Å; I1592-F1651 HydrophobicContact CG2-CZ 4.05Å; I1596-F1651 HydrophobicContact CD1-CB 4.15Å; T1641-F1651 WeakPolarHBondContact O-CA 2.86Å; F1651-A1653 HydrophobicContact CD2-CB 4.42Å; F1651-A1653 HydrophobicContact CE2-CB 3.99Å; F1651-I1693 WeakPolarHBondContact O-CA 3.47Å; F1651-F1694 HydrophobicContact CD1-CB 4.04Å; F1651-F1694 HydrophobicContact CE1-CB 3.58Å; F1651-F1694 HydrophobicContact CE1-CD2 4.22Å; F1651-F1694 HydrophobicContact CE1-CG 4.06Å; F1651-F1694 HydrophobicContact CE2-CD2 4.07Å; F1651-F1694 HydrophobicContact CZ-CB 4.02Å; F1651-F1694 AromaticContact CZ-CD2 3.77Å; F1651-F1694 HydrophobicContact CZ-CD2 3.77Å; F1651-F1694 AromaticContact CZ-CG 3.98Å; F1651-F1694 HydrophobicContact CZ-CG 3.98Å; F1651-F1694 PolarHBondContact N-O 3.39Å; F1651-F1694 PolarHBondContact O-N 2.86Å
1652L89.3Confident81Confident42 Ų4249 Ų4922%0.2226%0.256CS..EExtended strand (participates in β ladder)trans-98.1136.1174.9-179.7153.1000109.8A1640 T1641 R1654 A1691 A1692 I1693 C1743A1640-L1652 WeakPolarHBondContact CA-O 3.17Å; T1641-L1652 PolarHBondContact N-O 3.41Å; T1641-L1652 PolarHBondContact O-N 2.94Å; L1652-R1654 HydrophobicContact CD2-CG 4.38Å; L1652-A1691 HydrophobicContact CD1-CB 4.43Å; L1652-A1691 HydrophobicContact CD2-CB 4.33Å; L1652-A1691 HydrophobicContact CG-CB 4.41Å; L1652-A1692 WeakPolarHBondContact CA-O 3.41Å; L1652-I1693 HydrophobicContact CB-CG1 4.31Å; L1652-I1693 HydrophobicContact CD1-CG1 4.32Å; L1652-I1693 HydrophobicContact CG-CG1 4.48Å; L1652-C1743 VanDerWaalsContact CD1-SG 3.59Å
1653A91.4Very high80.9Confident0 Ų052.3 Ų52.30%027%0.272CS..EExtended strand (participates in β ladder)trans-134.3152.8168.900000110.6L1613 F1651 F1655 A1691 A1692 F1694L1613-A1653 HydrophobicContact CD2-CB 4.31Å; F1651-A1653 HydrophobicContact CD2-CB 4.42Å; F1651-A1653 HydrophobicContact CE2-CB 3.99Å; A1653-F1655 HydrophobicContact CB-CE2 3.97Å; A1653-F1655 HydrophobicContact CB-CZ 4.14Å; A1653-A1691 CarbonylContact O-C 3.32Å; A1653-A1691 WeakPolarHBondContact O-CA 3.42Å; A1653-A1692 PolarHBondContact N-O 2.93Å; A1653-A1692 PolarHBondContact O-N 2.79Å; A1653-F1694 HydrophobicContact CB-CE2 4.38Å
1654R92.1Very high81.3Confident93 Ų9352.8 Ų52.835%0.35127%0.273SS..EExtended strand (participates in β ladder)trans-110.8135.9177.6-74175.670.7-161.75.3111.1D1636 S1639 L1652 W1689 Q1690 A1691D1636-R1654 HydrophobicContact CB-CB 3.94Å; D1636-R1654 PolarHBondContact N-O 3.22Å; D1636-R1654 IonicContact OD2-NH1 3.71Å; S1639-R1654 PolarHBondContact OG-N 2.93Å; L1652-R1654 HydrophobicContact CD2-CG 4.38Å; R1654-W1689 HydrophobicContact CB-CE3 4.24Å; R1654-W1689 VanDerWaalsContact NH2-CB 3.27Å; R1654-Q1690 WeakPolarHBondContact CA-O 3.38Å; R1654-A1691 HydrophobicContact CG-CB 3.73Å
1655F93.2Very high82.2Confident0 Ų046.7 Ų46.70%025%0.245CC..EExtended strand (participates in β ladder)trans-117.5136-179.9-59-92.6000108.8I1589 L1624 V1632 D1634 I1635 A1653 V1657 W1689 Q1690 A1692 F1694I1589-F1655 HydrophobicContact CD1-CE1 3.88Å; I1589-F1655 HydrophobicContact CD1-CZ 4.16Å; L1624-F1655 HydrophobicContact CD1-CD2 3.88Å; L1624-F1655 HydrophobicContact CD1-CE2 4.1Å; L1624-F1655 HydrophobicContact CD1-CG 4.16Å; V1632-F1655 HydrophobicContact CG1-CD1 4.08Å; V1632-F1655 HydrophobicContact CG2-CD1 4.49Å; D1634-F1655 CarbonylContact O-C 3.43Å; D1634-F1655 WeakPolarHBondContact O-CA 3.2Å; I1635-F1655 HydrophobicContact CD1-CD1 4.38Å; I1635-F1655 HydrophobicContact CD1-CE1 3.96Å; I1635-F1655 HydrophobicContact CG1-CD1 3.7Å; I1635-F1655 HydrophobicContact CG1-CE1 3.76Å; A1653-F1655 HydrophobicContact CB-CE2 3.97Å; A1653-F1655 HydrophobicContact CB-CZ 4.14Å; F1655-V1657 HydrophobicContact CB-CG1 3.89Å; F1655-W1689 CarbonylContact O-C 3.21Å; F1655-W1689 WeakPolarHBondContact O-CA 3.31Å; F1655-Q1690 PolarHBondContact N-O 3Å; F1655-Q1690 PolarHBondContact O-N 2.8Å; F1655-A1692 HydrophobicContact CD2-CB 4.4Å; F1655-A1692 HydrophobicContact CE2-CB 4.1Å; F1655-F1694 AromaticContact CE2-CE2 3.74Å; F1655-F1694 HydrophobicContact CE2-CE2 3.74Å; F1655-F1694 HydrophobicContact CE2-CZ 4.01Å; F1655-F1694 AromaticContact CZ-CE2 3.69Å; F1655-F1694 HydrophobicContact CZ-CE2 3.69Å; F1655-F1694 AromaticContact CZ-CZ 3.72Å; F1655-F1694 HydrophobicContact CZ-CZ 3.72Å
1656K92.7Very high83.4Confident66 Ų6645.7 Ų45.729%0.28724%0.235SC..EExtended strand (participates in β ladder)trans-81.3117.2165.1-164174.1-173.8-175.10106.3V1633 D1634 L1687 W1689V1633-K1656 WeakPolarHBondContact CA-O 3.32Å; V1633-K1656 WeakPolarHBondContact CB-O 3.47Å; V1633-K1656 PolarHBondContact N-O 3.49Å; D1634-K1656 HydrophobicContact CB-CB 3.84Å; D1634-K1656 HydrophobicContact CB-CD 4.36Å; D1634-K1656 PolarHBondContact N-O 2.91Å; D1634-K1656 PolarHBondContact O-N 3.36Å; K1656-L1687 HydrophobicContact CG-CD1 4.27Å; K1656-L1687 HydrophobicContact CG-CG 4.35Å; K1656-W1689 HydrophobicContact CB-CD2 4.25Å; K1656-W1689 HydrophobicContact CB-CE3 3.9Å; K1656-W1689 HydrophobicContact CB-CH2 3.76Å; K1656-W1689 HydrophobicContact CB-CZ2 4.12Å; K1656-W1689 HydrophobicContact CB-CZ3 3.63Å; K1656-W1689 HydrophobicContact CD-CH2 4.39Å; K1656-W1689 HydrophobicContact CD-CZ2 4.09Å; K1656-W1689 HydrophobicContact CG-CD2 4.49Å; K1656-W1689 HydrophobicContact CG-CH2 4.43Å; K1656-W1689 HydrophobicContact CG-CZ2 4.29Å; K1656-W1689 VanDerWaalsContact N-CE3 3.33Å; K1656-W1689 VanDerWaalsContact N-CZ3 3.28Å
1657V92.2Very high85.2Confident0 Ų048.9 Ų48.90%024%0.237CC..EExtended strand (participates in β ladder)trans-123150.3-175.7-63.20000110.3A1630 L1631 F1655 Y1688 Q1690A1630-V1657 HydrophobicContact CB-CB 3.99Å; A1630-V1657 HydrophobicContact CB-CG1 4.16Å; A1630-V1657 HydrophobicContact CB-CG2 4.15Å; L1631-V1657 CarbonylContact O-C 3.59Å; L1631-V1657 WeakPolarHBondContact O-CA 3.49Å; F1655-V1657 HydrophobicContact CB-CG1 3.89Å; V1657-Y1688 HydrophobicContact CG2-CD1 4.39Å; V1657-Y1688 HydrophobicContact CG2-CD2 4.03Å; V1657-Y1688 HydrophobicContact CG2-CE1 4.01Å; V1657-Y1688 HydrophobicContact CG2-CE2 3.63Å; V1657-Y1688 HydrophobicContact CG2-CG 4.38Å; V1657-Y1688 PolarHBondContact N-O 3.38Å; V1657-Y1688 PolarHBondContact O-N 3.29Å; V1657-Q1690 HydrophobicContact CG1-CB 4.4Å; V1657-Q1690 HydrophobicContact CG2-CB 3.73Å
1658R89.6Confident86.5Confident97 Ų9747.8 Ų47.837%0.36622%0.221SC..EExtended strand (participates in β ladder)trans-109.7131.1168.3-174.1176.1-76.9170.7-1.9109L1631 V1633 Y1660 D1686 L1687L1631-R1658 PolarHBondContact N-O 3.22Å; L1631-R1658 PolarHBondContact O-N 3Å; V1633-R1658 HydrophobicContact CG2-CB 4.03Å; R1658-Y1660 HydrophobicContact CB-CD2 4.38Å; R1658-Y1660 HydrophobicContact CB-CE2 3.84Å; R1658-Y1660 WeakPolarHBondContact CD-OH 3.26Å; R1658-Y1660 HydrophobicContact CG-CD2 4.22Å; R1658-Y1660 HydrophobicContact CG-CE2 3.62Å; R1658-Y1660 PolarHBondContact NH1-OH 3.34Å; R1658-D1686 WeakPolarHBondContact CA-O 3.24Å; R1658-D1686 HydrophobicContact CG-CB 4.47Å; R1658-L1687 HydrophobicContact CB-CD1 4.06Å
1659K87Confident87.2Confident114 Ų11445.6 Ų45.650%0.49621%0.211SC..EExtended strand (participates in β ladder)trans-74.3134177.4-151.6170.8177.5174.90110.7D1686 Y1688K1659-D1686 PolarHBondContact N-O 3.14Å; K1659-Y1688 HydrophobicContact CB-CE1 4.02Å; K1659-Y1688 HydrophobicContact CD-CE1 4.45Å; K1659-Y1688 HydrophobicContact CG-CE1 4.45Å
1660Y85.2Confident87.3Confident59 Ų5948.9 Ų48.923%0.23123%0.227CC..  trans-143.1165.8171.5-70.2-74.6000108.8E1629 L1631 R1658 E1664 V1665 I1668E1629-Y1660 WeakPolarHBondContact CA-O 2.98Å; E1629-Y1660 WeakPolarHBondContact CB-O 3.49Å; E1629-Y1660 PolarHBondContact O-N 3.43Å; E1629-Y1660 VanDerWaalsContact O-O 3.13Å; L1631-Y1660 HydrophobicContact CB-CD2 3.91Å; L1631-Y1660 HydrophobicContact CB-CE2 4.06Å; L1631-Y1660 HydrophobicContact CD2-CD2 4.46Å; L1631-Y1660 HydrophobicContact CD2-CE2 3.96Å; R1658-Y1660 HydrophobicContact CB-CD2 4.38Å; R1658-Y1660 HydrophobicContact CB-CE2 3.84Å; R1658-Y1660 WeakPolarHBondContact CD-OH 3.26Å; R1658-Y1660 HydrophobicContact CG-CD2 4.22Å; R1658-Y1660 HydrophobicContact CG-CE2 3.62Å; R1658-Y1660 PolarHBondContact NH1-OH 3.34Å; Y1660-E1664 HydrophobicContact CD1-CB 4.24Å; Y1660-E1664 HydrophobicContact CG-CB 4.47Å; Y1660-V1665 HydrophobicContact CD2-CG2 4.49Å; Y1660-V1665 HydrophobicContact CG-CG2 4.45Å; Y1660-I1668 HydrophobicContact CD1-CD1 3.81Å; Y1660-I1668 HydrophobicContact CD2-CD1 4.08Å; Y1660-I1668 HydrophobicContact CE1-CD1 3.61Å; Y1660-I1668 HydrophobicContact CE2-CD1 3.86Å; Y1660-I1668 HydrophobicContact CG-CD1 4.02Å
1661T82.7Confident86.8Confident67 Ų6750.7 Ų50.741%0.41124%0.24SC..  trans-72.5157.8165.6620000110.7D1663 E1664 V1665T1661-D1663 PolarHBondContact O-N 3.4Å; T1661-E1664 PolarHBondContact N-OE2 2.95Å; T1661-E1664 PolarHBondContact O-N 3.22Å; T1661-E1664 VanDerWaalsContact O-N 3.12Å; T1661-E1664 WeakPolarHBondContact OG1-CB 3.44Å; T1661-E1664 WeakPolarHBondContact OG1-CG 3.49Å; T1661-E1664 PolarHBondContact OG1-N 3.32Å; T1661-E1664 PolarHBondContact OG1-OE2 3.22Å; T1661-V1665 WeakPolarHBondContact O-CG2 3.42Å; T1661-V1665 PolarHBondContact O-N 2.97Å
1662V82Confident85.4Confident14 Ų1457.1 Ų57.19%0.08527%0.274CS..Hα-helixtrans-53-43.8176.7176.40000111.2L1499 L1530 E1629 V1665 E1666L1499-V1662 HydrophobicContact CD1-CG1 4.01Å; L1499-V1662 HydrophobicContact CD1-CG2 4.22Å; L1530-V1662 HydrophobicContact CB-CG1 4.43Å; L1530-V1662 HydrophobicContact CD1-CB 4.48Å; L1530-V1662 HydrophobicContact CD1-CG1 3.61Å; L1530-V1662 WeakPolarHBondContact CD1-O 3.2Å; E1629-V1662 HydrophobicContact CG-CG2 3.82Å; V1662-V1665 PolarHBondContact O-N 2.9Å; V1662-E1666 PolarHBondContact O-N 2.88Å
1663D82.4Confident83.6Confident95 Ų9558.4 Ų58.451%0.50829%0.287SS..Hα-helixtrans-66.8-39.4-179.7-62-32.6000111.8T1661 E1666 Q1667T1661-D1663 PolarHBondContact O-N 3.4Å; D1663-E1666 PolarHBondContact O-N 3.39Å; D1663-Q1667 WeakPolarHBondContact O-CG 3.41Å; D1663-Q1667 PolarHBondContact O-N 2.94Å
1664E85Confident81.7Confident89 Ų8960.2 Ų60.242%0.41630%0.299SS..Hα-helixtrans-66.3-44175.5-75.5163.916300112.2Y1660 T1661 E1666 Q1667 I1668Y1660-E1664 HydrophobicContact CD1-CB 4.24Å; Y1660-E1664 HydrophobicContact CG-CB 4.47Å; T1661-E1664 PolarHBondContact N-OE2 2.95Å; T1661-E1664 PolarHBondContact O-N 3.22Å; T1661-E1664 VanDerWaalsContact O-N 3.12Å; T1661-E1664 WeakPolarHBondContact OG1-CB 3.44Å; T1661-E1664 WeakPolarHBondContact OG1-CG 3.49Å; T1661-E1664 PolarHBondContact OG1-N 3.32Å; T1661-E1664 PolarHBondContact OG1-OE2 3.22Å; E1664-E1666 VanDerWaalsContact C-N 3.27Å; E1664-E1666 PolarHBondContact O-N 3.33Å; E1664-Q1667 PolarHBondContact O-N 2.94Å; E1664-I1668 WeakPolarHBondContact O-CB 3.41Å; E1664-I1668 WeakPolarHBondContact O-CD1 3.11Å; E1664-I1668 WeakPolarHBondContact O-CG1 3.47Å; E1664-I1668 PolarHBondContact O-N 3.22Å
1665V85.9Confident79.7Confident0 Ų059.9 Ų59.90%031%0.311CS..Hα-helixtrans-57.9-46.2175.1173.80000109.7L1530 Y1623 P1628 L1631 Y1660 T1661 V1662 Q1667 I1668 C1669L1530-V1665 HydrophobicContact CD1-CB 4.12Å; L1530-V1665 HydrophobicContact CD1-CG1 4.11Å; L1530-V1665 HydrophobicContact CD2-CG1 4.33Å; Y1623-V1665 HydrophobicContact CD1-CG1 4.49Å; Y1623-V1665 HydrophobicContact CG-CG1 4.39Å; P1628-V1665 WeakPolarHBondContact O-CG2 3.38Å; L1631-V1665 HydrophobicContact CD1-CG1 4.34Å; Y1660-V1665 HydrophobicContact CD2-CG2 4.49Å; Y1660-V1665 HydrophobicContact CG-CG2 4.45Å; T1661-V1665 WeakPolarHBondContact O-CG2 3.42Å; T1661-V1665 PolarHBondContact O-N 2.97Å; V1662-V1665 PolarHBondContact O-N 2.9Å; V1665-Q1667 PolarHBondContact O-N 2.99Å; V1665-I1668 PolarHBondContact O-N 3.44Å; V1665-C1669 VanDerWaalsContact O-CB 3.26Å; V1665-C1669 WeakPolarHBondContact O-CB 3.39Å; V1665-C1669 PolarHBondContact O-N 2.96Å; V1665-C1669 PolarHBondContact O-SG 3.42Å
1666E86.9Confident77.2Confident28 Ų2866 Ų6613%0.13134%0.344CS..Hα-helixtrans-61.3-46.1179.3-160.1168.5158.100111.3S1528 Q1529 L1530 V1662 D1663 E1664 C1669 M1670S1528-E1666 VanDerWaalsContact CA-OE1 3.23Å; S1528-E1666 WeakPolarHBondContact CA-OE1 3.06Å; S1528-E1666 WeakPolarHBondContact CB-OE2 3.3Å; S1528-E1666 PolarHBondContact OG-OE2 3.18Å; Q1529-E1666 HydrophobicContact CB-CG 4.38Å; Q1529-E1666 PolarHBondContact N-OE1 3.4Å; L1530-E1666 HydrophobicContact CD1-CB 3.79Å; L1530-E1666 HydrophobicContact CD1-CG 4.42Å; L1530-E1666 HydrophobicContact CG-CB 4.41Å; V1662-E1666 PolarHBondContact O-N 2.88Å; D1663-E1666 PolarHBondContact O-N 3.39Å; E1664-E1666 VanDerWaalsContact C-N 3.27Å; E1664-E1666 PolarHBondContact O-N 3.33Å; E1666-C1669 PolarHBondContact O-N 3.08Å; E1666-M1670 HydrophobicContact CG-CG 4.34Å; E1666-M1670 WeakPolarHBondContact O-CB 3.31Å; E1666-M1670 WeakPolarHBondContact O-CG 3.34Å; E1666-M1670 PolarHBondContact O-N 3.41Å
1667Q86.8Confident74.9Confident141 Ų14166.9 Ų66.966%0.65936%0.363SS*.Hα-helixtrans-62.9-44.5177.2-74.6-174.62.300112.9D1663 E1664 V1665 M1670 S1671D1663-Q1667 WeakPolarHBondContact O-CG 3.41Å; D1663-Q1667 PolarHBondContact O-N 2.94Å; E1664-Q1667 PolarHBondContact O-N 2.94Å; V1665-Q1667 PolarHBondContact O-N 2.99Å; Q1667-M1670 PolarHBondContact O-N 3.31Å; Q1667-S1671 VanDerWaalsContact O-CB 3.32Å; Q1667-S1671 WeakPolarHBondContact O-CB 3.49Å; Q1667-S1671 PolarHBondContact O-N 3.48Å
1668I85.2Confident72.5Confident48 Ų4872.4 Ų72.425%0.24640%0.397CS..Hα-helixtrans-61.8-48.4179.1-69.3163.8000109.9L1631 Y1660 E1664 V1665 M1670 S1671L1631-I1668 HydrophobicContact CD2-CG2 3.99Å; Y1660-I1668 HydrophobicContact CD1-CD1 3.81Å; Y1660-I1668 HydrophobicContact CD2-CD1 4.08Å; Y1660-I1668 HydrophobicContact CE1-CD1 3.61Å; Y1660-I1668 HydrophobicContact CE2-CD1 3.86Å; Y1660-I1668 HydrophobicContact CG-CD1 4.02Å; E1664-I1668 WeakPolarHBondContact O-CB 3.41Å; E1664-I1668 WeakPolarHBondContact O-CD1 3.11Å; E1664-I1668 WeakPolarHBondContact O-CG1 3.47Å; E1664-I1668 PolarHBondContact O-N 3.22Å; V1665-I1668 PolarHBondContact O-N 3.44Å; I1668-M1670 VanDerWaalsContact C-N 3.31Å; I1668-M1670 PolarHBondContact O-N 2.92Å; I1668-S1671 PolarHBondContact O-N 3.03Å; I1668-S1671 PolarHBondContact O-OG 3.4Å
1669C84.5Confident70.3Confident0 Ų072.5 Ų72.50%041%0.413CS..Hα-helixtrans-66.8-30.8-179.6-72.60000113.2F1578 R1581 G1621 V1665 E1666F1578-C1669 HydrophobicContact CD1-CB 4Å; F1578-C1669 HydrophobicContact CD2-CB 3.71Å; F1578-C1669 HydrophobicContact CE1-CB 3.79Å; F1578-C1669 HydrophobicContact CE2-CB 3.5Å; F1578-C1669 VanDerWaalsContact CE2-CB 3.5Å; F1578-C1669 VanDerWaalsContact CE2-SG 3.54Å; F1578-C1669 HydrophobicContact CG-CB 3.97Å; F1578-C1669 HydrophobicContact CZ-CB 3.53Å; R1581-C1669 PolarHBondContact NH2-O 2.99Å; G1621-C1669 PolarHBondContact O-SG 3.17Å; V1665-C1669 VanDerWaalsContact O-CB 3.26Å; V1665-C1669 WeakPolarHBondContact O-CB 3.39Å; V1665-C1669 PolarHBondContact O-N 2.96Å; V1665-C1669 PolarHBondContact O-SG 3.42Å; E1666-C1669 PolarHBondContact O-N 3.08Å
1670M83.1Confident68.2Low70 Ų7075 Ų7535%0.34543%0.431SS..Hα-helixtrans-84.3-13.6175.8-71.2-67.9-69.400113.8Q1529 E1574 A1575 F1578 E1666 Q1667 I1668Q1529-M1670 HydrophobicContact CG-CE 4.47Å; Q1529-M1670 HydrophobicContact CG-SD 3.89Å; E1574-M1670 VanDerWaalsContact CG-O 3.32Å; E1574-M1670 WeakPolarHBondContact CG-O 3.3Å; A1575-M1670 VanDerWaalsContact CA-SD 3.6Å; A1575-M1670 HydrophobicContact CB-CE 3.93Å; A1575-M1670 HydrophobicContact CB-SD 4.04Å; F1578-M1670 HydrophobicContact CD1-SD 4.5Å; E1666-M1670 HydrophobicContact CG-CG 4.34Å; E1666-M1670 WeakPolarHBondContact O-CB 3.31Å; E1666-M1670 WeakPolarHBondContact O-CG 3.34Å; E1666-M1670 PolarHBondContact O-N 3.41Å; Q1667-M1670 PolarHBondContact O-N 3.31Å; I1668-M1670 VanDerWaalsContact C-N 3.31Å; I1668-M1670 PolarHBondContact O-N 2.92Å
1671S76.7Confident66.4Low42 Ų4278.9 Ų78.929%0.29446%0.456SS..SBendtrans-82.8136.9177.275.40000111.1Q1667 I1668 S1673Q1667-S1671 VanDerWaalsContact O-CB 3.32Å; Q1667-S1671 WeakPolarHBondContact O-CB 3.49Å; Q1667-S1671 PolarHBondContact O-N 3.48Å; I1668-S1671 PolarHBondContact O-N 3.03Å; I1668-S1671 PolarHBondContact O-OG 3.4Å; S1671-S1673 PolarHBondContact O-N 3.28Å
1672N60.2Low64.6Low134 Ų13480.9 Ų80.972%0.71747%0.473SS*.THydrogen-bonded Turntrans-58.9-11.9175.2-111.6-6.9000113.1C1674N1672-C1674 VanDerWaalsContact C-N 3.34Å; N1672-C1674 PolarHBondContact O-N 3.26Å
1673S51.2Low63.1Low70 Ų7083.4 Ų83.449%0.4949%0.491SS..THydrogen-bonded Turntrans-85.914.6-166.2-50.10000115.2S1671 S1675 N1676S1671-S1673 PolarHBondContact O-N 3.28Å; S1673-S1675 PolarHBondContact O-N 3.42Å; S1673-N1676 PolarHBondContact O-N 3.48Å
1674C52.2Low62Low37 Ų3784.2 Ų84.225%0.2550%0.504CS..THydrogen-bonded Turntrans-55.2-11.5179.2-79.30000114.4N1672N1672-C1674 VanDerWaalsContact C-N 3.34Å; N1672-C1674 PolarHBondContact O-N 3.26Å
1675S49.2Very low61Low86 Ų8687.1 Ų87.160%0.60152%0.523SS*.THydrogen-bonded Turntrans-89.2-27.5173.444.80000116S1673S1673-S1675 PolarHBondContact O-N 3.42Å
1676N40.9Very low60.7Low130 Ų13090.3 Ų90.370%0.69554%0.54SS*.THydrogen-bonded Turntrans-115.37.4-163.8-77.64.7000116.6S1673 T1678S1673-N1676 PolarHBondContact O-N 3.48Å; N1676-T1678 PolarHBondContact O-N 2.97Å
1677A43.1Very low60.7Low83 Ų8391.8 Ų91.869%0.68655%0.548SS*.  trans-78.553177.400000113.5
1678T41.8Very low60.8Low116 Ų11688.7 Ų88.771%0.71253%0.531SS*.  trans-111.430.217454.80000113N1676N1676-T1678 PolarHBondContact O-N 2.97Å
1679S43.4Very low61Low99 Ų9991.1 Ų91.169%0.69254%0.537SS*.  trans-88.5124.1168.351.50000110.6D1681S1679-D1681 VanDerWaalsContact C-N 3.32Å; S1679-D1681 PolarHBondContact O-N 3.33Å
1680D44.4Very low61.3Low166 Ų16691.5 Ų91.589%0.88854%0.539SS*.  trans-62.758.3-171.3-75.9-43.8000116.8S1682D1680-S1682 PolarHBondContact O-N 3.4Å
1681D45.9Very low61.7Low141 Ų14189.1 Ų89.175%0.75453%0.53SS*.  trans-9693174.6-80.4-27.2000113.2S1679S1679-D1681 VanDerWaalsContact C-N 3.32Å; S1679-D1681 PolarHBondContact O-N 3.33Å
1682S45.1Very low62.4Low109 Ų10987.1 Ų87.176%0.76252%0.516SS*.SBendtrans38.974.9131.166.50000121.5D1680D1680-S1682 PolarHBondContact O-N 3.4Å
1683S52Low63.8Low68 Ų6882 Ų8248%0.47649%0.489SS..  trans-173.3111.6133.252.40000109.2D1685 D1686S1683-D1685 PolarHBondContact O-N 2.79Å; S1683-D1686 PolarHBondContact OG-OD2 3.45Å
1684S58Low65.6Low111 Ų11178.7 Ų78.778%0.77647%0.466SS*.G310 helixtrans-65.4-17.8173.9-176.90000112.5D1686S1684-D1686 PolarHBondContact O-N 2.86Å
1685D64.6Low67.3Low151 Ų15179.4 Ų79.481%0.80746%0.464SS*.G310 helixtrans-74.9-19.3-171.9-75.4-14.1000114.2S1683S1683-D1685 PolarHBondContact O-N 2.79Å
1686D78.8Confident68.9Low66 Ų6676.8 Ų76.835%0.35345%0.445SS..G310 helixtrans-88.4-6.2-175.9-67.1-47.9000114.2R1658 K1659 S1683 S1684R1658-D1686 WeakPolarHBondContact CA-O 3.24Å; R1658-D1686 HydrophobicContact CG-CB 4.47Å; K1659-D1686 PolarHBondContact N-O 3.14Å; S1683-D1686 PolarHBondContact OG-OD2 3.45Å; S1684-D1686 PolarHBondContact O-N 2.86Å
1687L87.1Confident70.7Confident60 Ų6071.5 Ų71.531%0.31442%0.421SS..EExtended strand (participates in β ladder)trans-106.1110.8-178.8-167.573.2000110.6V1633 K1656 R1658V1633-L1687 HydrophobicContact CB-CD1 4.47Å; V1633-L1687 HydrophobicContact CG2-CD1 3.99Å; K1656-L1687 HydrophobicContact CG-CD1 4.27Å; K1656-L1687 HydrophobicContact CG-CG 4.35Å; R1658-L1687 HydrophobicContact CB-CD1 4.06Å
1688Y88.7Confident72.4Confident75 Ų7569.2 Ų69.229%0.29440%0.397SS..EExtended strand (participates in β ladder)trans-140167.9-176.565.1-83.1000112.5V1657 K1659 Q1690V1657-Y1688 HydrophobicContact CG2-CD1 4.39Å; V1657-Y1688 HydrophobicContact CG2-CD2 4.03Å; V1657-Y1688 HydrophobicContact CG2-CE1 4.01Å; V1657-Y1688 HydrophobicContact CG2-CE2 3.63Å; V1657-Y1688 HydrophobicContact CG2-CG 4.38Å; V1657-Y1688 PolarHBondContact N-O 3.38Å; V1657-Y1688 PolarHBondContact O-N 3.29Å; K1659-Y1688 HydrophobicContact CB-CE1 4.02Å; K1659-Y1688 HydrophobicContact CD-CE1 4.45Å; K1659-Y1688 HydrophobicContact CG-CE1 4.45Å; Y1688-Q1690 HydrophobicContact CD2-CB 4.48Å; Y1688-Q1690 HydrophobicContact CE2-CB 4.05Å; Y1688-Q1690 PolarHBondContact OH-OE1 3.14Å
1689W90.6Very high74.4Confident100 Ų10065.3 Ų65.338%0.37937%0.372SS..EExtended strand (participates in β ladder)trans-94.7127.5176.5-73.4100.6000110.7D1636 R1654 F1655 K1656D1636-W1689 HydrophobicContact CB-CE3 4.13Å; D1636-W1689 HydrophobicContact CB-CH2 3.8Å; D1636-W1689 HydrophobicContact CB-CZ3 3.47Å; D1636-W1689 VanDerWaalsContact CB-CZ3 3.47Å; R1654-W1689 HydrophobicContact CB-CE3 4.24Å; R1654-W1689 VanDerWaalsContact NH2-CB 3.27Å; F1655-W1689 CarbonylContact O-C 3.21Å; F1655-W1689 WeakPolarHBondContact O-CA 3.31Å; K1656-W1689 HydrophobicContact CB-CD2 4.25Å; K1656-W1689 HydrophobicContact CB-CE3 3.9Å; K1656-W1689 HydrophobicContact CB-CH2 3.76Å; K1656-W1689 HydrophobicContact CB-CZ2 4.12Å; K1656-W1689 HydrophobicContact CB-CZ3 3.63Å; K1656-W1689 HydrophobicContact CD-CH2 4.39Å; K1656-W1689 HydrophobicContact CD-CZ2 4.09Å; K1656-W1689 HydrophobicContact CG-CD2 4.49Å; K1656-W1689 HydrophobicContact CG-CH2 4.43Å; K1656-W1689 HydrophobicContact CG-CZ2 4.29Å; K1656-W1689 VanDerWaalsContact N-CE3 3.33Å; K1656-W1689 VanDerWaalsContact N-CZ3 3.28Å
1690Q90.2Very high76.5Confident8 Ų860.6 Ų60.64%0.03734%0.339CS..EExtended strand (participates in β ladder)trans-120.1121.1178.7-173.9155.9-22.900109.9L1624 D1627 R1654 F1655 V1657 Y1688 Q1742L1624-Q1690 HydrophobicContact CD2-CG 3.98Å; D1627-Q1690 PolarHBondContact OD2-NE2 2.91Å; D1627-Q1690 PolarHBondContact OD2-OE1 3.13Å; R1654-Q1690 WeakPolarHBondContact CA-O 3.38Å; F1655-Q1690 PolarHBondContact N-O 3Å; F1655-Q1690 PolarHBondContact O-N 2.8Å; V1657-Q1690 HydrophobicContact CG1-CB 4.4Å; V1657-Q1690 HydrophobicContact CG2-CB 3.73Å; Y1688-Q1690 HydrophobicContact CD2-CB 4.48Å; Y1688-Q1690 HydrophobicContact CE2-CB 4.05Å; Y1688-Q1690 PolarHBondContact OH-OE1 3.14Å; Q1690-Q1742 HydrophobicContact CG-CG 4.42Å
1691A90.9Very high78.6Confident19 Ų1953.4 Ų53.416%0.15730%0.3CS..EExtended strand (participates in β ladder)trans-85.7140.9173.400000110.2L1652 A1653 R1654 C1743L1652-A1691 HydrophobicContact CD1-CB 4.43Å; L1652-A1691 HydrophobicContact CD2-CB 4.33Å; L1652-A1691 HydrophobicContact CG-CB 4.41Å; A1653-A1691 CarbonylContact O-C 3.32Å; A1653-A1691 WeakPolarHBondContact O-CA 3.42Å; R1654-A1691 HydrophobicContact CG-CB 3.73Å; A1691-C1743 HydrophobicContact CB-CB 3.59Å; A1691-C1743 VanDerWaalsContact CB-SG 3.58Å; A1691-C1743 PolarHBondContact O-N 3.47Å
1692A91.4Very high80.5Confident0 Ų048.8 Ų48.80%027%0.273CS..EExtended strand (participates in β ladder)trans-133.7141.5172.700000110.4L1624 L1652 A1653 F1655 F1694 V1740 I1741L1624-A1692 HydrophobicContact CD1-CB 4.34Å; L1624-A1692 HydrophobicContact CD2-CB 4.35Å; L1652-A1692 WeakPolarHBondContact CA-O 3.41Å; A1653-A1692 PolarHBondContact N-O 2.93Å; A1653-A1692 PolarHBondContact O-N 2.79Å; F1655-A1692 HydrophobicContact CD2-CB 4.4Å; F1655-A1692 HydrophobicContact CE2-CB 4.1Å; A1692-F1694 HydrophobicContact CB-CE2 4.27Å; A1692-V1740 HydrophobicContact CB-CG1 3.95Å; A1692-I1741 CarbonylContact C-O 3.6Å; A1692-I1741 VanDerWaalsContact CA-O 3.26Å; A1692-I1741 WeakPolarHBondContact CA-O 3.34Å
1693I89.5Confident82.4Confident27 Ų2746 Ų4614%0.13825%0.25CS..EExtended strand (participates in β ladder)trans-99.8123.5173.2-59.1163.3000107.6M1643 P1650 F1651 L1652 V1740 I1741M1643-I1693 HydrophobicContact CE-CD1 4.19Å; M1643-I1693 HydrophobicContact SD-CB 4.47Å; M1643-I1693 HydrophobicContact SD-CD1 3.83Å; M1643-I1693 HydrophobicContact SD-CG1 3.98Å; M1643-I1693 HydrophobicContact SD-CG2 3.64Å; P1650-I1693 HydrophobicContact CB-CG2 4.35Å; F1651-I1693 WeakPolarHBondContact O-CA 3.47Å; L1652-I1693 HydrophobicContact CB-CG1 4.31Å; L1652-I1693 HydrophobicContact CD1-CG1 4.32Å; L1652-I1693 HydrophobicContact CG-CG1 4.48Å; I1693-V1740 WeakPolarHBondContact O-CA 3.38Å; I1693-I1741 HydrophobicContact CB-CB 4.25Å; I1693-I1741 PolarHBondContact N-O 3.45Å; I1693-I1741 PolarHBondContact O-N 3.32Å
1694F90.5Very high84.1Confident1 Ų144 Ų440%0.00423%0.234CC..EExtended strand (participates in β ladder)trans-91.1102.6170.9-67-92.6000107.6F1586 I1589 P1650 F1651 A1653 F1655 A1692 V1740F1586-F1694 AromaticContact CD1-CE1 3.98Å; F1586-F1694 HydrophobicContact CD1-CE1 3.98Å; F1586-F1694 HydrophobicContact CD1-CZ 4.17Å; F1586-F1694 HydrophobicContact CE1-CZ 4.27Å; I1589-F1694 HydrophobicContact CB-CE1 4.32Å; I1589-F1694 HydrophobicContact CB-CZ 4.41Å; I1589-F1694 HydrophobicContact CG2-CD1 3.96Å; I1589-F1694 HydrophobicContact CG2-CD2 3.97Å; I1589-F1694 HydrophobicContact CG2-CE1 3.59Å; I1589-F1694 HydrophobicContact CG2-CE2 3.61Å; I1589-F1694 HydrophobicContact CG2-CG 4.15Å; I1589-F1694 HydrophobicContact CG2-CZ 3.41Å; I1589-F1694 VanDerWaalsContact CG2-CZ 3.41Å; P1650-F1694 WeakPolarHBondContact CA-O 3.36Å; P1650-F1694 WeakPolarHBondContact CB-O 3.49Å; F1651-F1694 HydrophobicContact CD1-CB 4.04Å; F1651-F1694 HydrophobicContact CE1-CB 3.58Å; F1651-F1694 HydrophobicContact CE1-CD2 4.22Å; F1651-F1694 HydrophobicContact CE1-CG 4.06Å; F1651-F1694 HydrophobicContact CE2-CD2 4.07Å; F1651-F1694 HydrophobicContact CZ-CB 4.02Å; F1651-F1694 AromaticContact CZ-CD2 3.77Å; F1651-F1694 HydrophobicContact CZ-CD2 3.77Å; F1651-F1694 AromaticContact CZ-CG 3.98Å; F1651-F1694 HydrophobicContact CZ-CG 3.98Å; F1651-F1694 PolarHBondContact N-O 3.39Å; F1651-F1694 PolarHBondContact O-N 2.86Å; A1653-F1694 HydrophobicContact CB-CE2 4.38Å; F1655-F1694 AromaticContact CE2-CE2 3.74Å; F1655-F1694 HydrophobicContact CE2-CE2 3.74Å; F1655-F1694 HydrophobicContact CE2-CZ 4.01Å; F1655-F1694 AromaticContact CZ-CE2 3.69Å; F1655-F1694 HydrophobicContact CZ-CE2 3.69Å; F1655-F1694 AromaticContact CZ-CZ 3.72Å; F1655-F1694 HydrophobicContact CZ-CZ 3.72Å; A1692-F1694 HydrophobicContact CB-CE2 4.27Å; F1694-V1740 HydrophobicContact CD1-CG2 3.84Å; F1694-V1740 HydrophobicContact CE1-CG1 4.21Å; F1694-V1740 HydrophobicContact CE1-CG2 3.74Å; F1694-V1740 HydrophobicContact CZ-CG1 4.36Å
1695K86.3Confident85.6Confident51 Ų5139.4 Ų39.422%0.22220%0.2CC..EExtended strand (participates in β ladder)trans-99111.7-175.7-157.5175.2173.7-171.80108.7P1650 D1698 V1700 D1703 C1738 G1739 I1741P1650-K1695 HydrophobicContact CB-CB 4.47Å; P1650-K1695 HydrophobicContact CB-CG 4.22Å; K1695-D1698 HydrophobicContact CD-CB 4.08Å; K1695-D1698 WeakPolarHBondContact CE-OD2 3.15Å; K1695-D1698 HydrophobicContact CG-CB 4.06Å; K1695-D1698 IonicContact NZ-OD2 3.5Å; K1695-V1700 HydrophobicContact CB-CG1 4.35Å; K1695-V1700 HydrophobicContact CD-CG1 3.93Å; K1695-D1703 IonicContact NZ-OD2 2.67Å; K1695-C1738 CarbonylContact O-C 3.57Å; K1695-C1738 WeakPolarHBondContact O-CA 3.42Å; K1695-G1739 PolarHBondContact N-O 3Å; K1695-G1739 PolarHBondContact O-N 3.46Å; K1695-I1741 HydrophobicContact CB-CD1 4.2Å; K1695-I1741 HydrophobicContact CD-CD1 3.55Å
1696V83.3Confident86.5Confident31 Ų3132.8 Ų32.819%0.18817%0.166CC..EExtended strand (participates in β ladder)trans-119.4135.8-176.1176.80000109.4T1590 S1593 K1648 G1737T1590-V1696 HydrophobicContact CG2-CG2 3.56Å; S1593-V1696 WeakPolarHBondContact OG-CB 3.31Å; K1648-V1696 VanDerWaalsContact CB-O 3.26Å; K1648-V1696 WeakPolarHBondContact CB-O 3.48Å; K1648-V1696 VanDerWaalsContact O-O 3.11Å; V1696-G1737 CarbonylContact C-O 3.58Å; V1696-G1737 WeakPolarHBondContact CA-O 3.38Å
1697G78.4Confident87Confident20 Ų2030.4 Ų30.421%0.20615%0.154CC..SBendtrans85.8-5.3-170.700000115.8K1648 G1737K1648-G1697 VanDerWaalsContact CD-C 3.46Å; K1648-G1697 VanDerWaalsContact CD-O 3.24Å; K1648-G1697 WeakPolarHBondContact CD-O 3.37Å; K1648-G1697 WeakPolarHBondContact CE-O 3.24Å; K1648-G1697 PolarHBondContact NZ-O 2.84Å; G1697-G1737 CarbonylContact C-O 3.27Å; G1697-G1737 VanDerWaalsContact C-O 3.32Å; G1697-G1737 VanDerWaalsContact CA-O 3.28Å; G1697-G1737 WeakPolarHBondContact CA-O 3.49Å; G1697-G1737 PolarHBondContact N-O 3.06Å
1698D80.1Confident87.1Confident35 Ų3528.3 Ų28.319%0.18714%0.142CC..SBendtrans-114.8135.7178.4-77.9-48.1000110.6K1648 K1695 V1700 G1737K1648-D1698 HydrophobicContact CD-CB 4.26Å; K1648-D1698 WeakPolarHBondContact CD-OD1 3.39Å; K1648-D1698 VanDerWaalsContact CE-OD1 3.28Å; K1648-D1698 WeakPolarHBondContact CE-OD1 3.47Å; K1648-D1698 IonicContact NZ-OD1 3.96Å; K1648-D1698 PolarHBondContact NZ-OD1 2.91Å; K1695-D1698 HydrophobicContact CD-CB 4.08Å; K1695-D1698 WeakPolarHBondContact CE-OD2 3.15Å; K1695-D1698 HydrophobicContact CG-CB 4.06Å; K1695-D1698 IonicContact NZ-OD2 3.5Å; D1698-V1700 PolarHBondContact O-N 2.81Å; D1698-G1737 PolarHBondContact N-O 3.36Å; D1698-G1737 CarbonylContact O-C 3.28Å; D1698-G1737 VanDerWaalsContact O-O 3.09Å
1699D83Confident87Confident33 Ų3326.2 Ų26.218%0.17614%0.136CC..  trans-74.7111.3171.3-171.5-4.9000111.6E1547 R1701E1547-D1699 HydrophobicContact CG-CB 4.04Å; E1547-D1699 PolarHBondContact OE1-N 2.9Å; D1699-R1701 WeakPolarHBondContact OD1-CB 3.27Å; D1699-R1701 WeakPolarHBondContact OD1-CG 3.38Å; D1699-R1701 PolarHBondContact OD1-N 3.26Å; D1699-R1701 IonicContact OD1-NE 2.92Å; D1699-R1701 PolarHBondContact OD1-NE 3.18Å; D1699-R1701 VanDerWaalsContact OD1-NE 3.08Å; D1699-R1701 IonicContact OD2-CZ 3.81Å; D1699-R1701 IonicContact OD2-NE 2.62Å; D1699-R1701 PolarHBondContact OD2-NE 2.8Å; D1699-R1701 IonicContact OD2-NH2 2.85Å; D1699-R1701 PolarHBondContact OD2-NH2 2.78Å
1700V87.4Confident86.8Confident1 Ų124 Ų241%0.00613%0.13CC..  trans-91.21.9179.3-57.90000113.6K1695 D1698 Q1702 D1703 M1704 V1731 A1733 I1741K1695-V1700 HydrophobicContact CB-CG1 4.35Å; K1695-V1700 HydrophobicContact CD-CG1 3.93Å; D1698-V1700 PolarHBondContact O-N 2.81Å; V1700-Q1702 PolarHBondContact O-N 2.88Å; V1700-D1703 WeakPolarHBondContact O-CB 3.43Å; V1700-D1703 PolarHBondContact O-N 2.49Å; V1700-D1703 VanDerWaalsContact O-N 3.08Å; V1700-M1704 WeakPolarHBondContact O-CG 3.37Å; V1700-M1704 PolarHBondContact O-N 3.38Å; V1700-V1731 HydrophobicContact CB-CG1 3.75Å; V1700-V1731 HydrophobicContact CG2-CG1 3.75Å; V1700-A1733 HydrophobicContact CG2-CB 3.84Å; V1700-I1741 HydrophobicContact CG1-CD1 4.19Å; V1700-I1741 HydrophobicContact CG1-CG1 4.48Å
1701R88.8Confident86.7Confident14 Ų1425 Ų255%0.05314%0.135CC..Hα-helixtrans-62.1-31.4-178.4-69.7178.7-65.4173.20.9112.6T1541 N1542 D1699 M1704 L1705 A1733 L1831T1541-R1701 HydrophobicContact CG2-CG 4.09Å; N1542-R1701 PolarHBondContact OD1-NH1 3.1Å; D1699-R1701 WeakPolarHBondContact OD1-CB 3.27Å; D1699-R1701 WeakPolarHBondContact OD1-CG 3.38Å; D1699-R1701 PolarHBondContact OD1-N 3.26Å; D1699-R1701 IonicContact OD1-NE 2.92Å; D1699-R1701 PolarHBondContact OD1-NE 3.18Å; D1699-R1701 VanDerWaalsContact OD1-NE 3.08Å; D1699-R1701 IonicContact OD2-CZ 3.81Å; D1699-R1701 IonicContact OD2-NE 2.62Å; D1699-R1701 PolarHBondContact OD2-NE 2.8Å; D1699-R1701 IonicContact OD2-NH2 2.85Å; D1699-R1701 PolarHBondContact OD2-NH2 2.78Å; R1701-M1704 WeakPolarHBondContact O-CB 3.49Å; R1701-M1704 PolarHBondContact O-N 3.28Å; R1701-L1705 PolarHBondContact O-N 3.39Å; R1701-A1733 HydrophobicContact CG-CB 4.04Å; R1701-L1831 HydrophobicContact CB-CD1 4.33Å; R1701-L1831 HydrophobicContact CB-CD2 4.18Å
1702Q86.4Confident86.6Confident44 Ų4424.3 Ų24.321%0.20613%0.129CC..Hα-helixtrans-63.7-45.2173.1-178.5175.5-24.300111.4V1700 L1705 A1706 L1831V1700-Q1702 PolarHBondContact O-N 2.88Å; Q1702-L1705 PolarHBondContact O-N 2.99Å; Q1702-A1706 WeakPolarHBondContact O-CB 3.4Å; Q1702-A1706 PolarHBondContact O-N 3.17Å; Q1702-L1831 HydrophobicContact CB-CD1 4.45Å; Q1702-L1831 HydrophobicContact CB-CD2 4.27Å
1703D84.8Confident86.5Confident51 Ų5125 Ų2527%0.27313%0.133SC..Hα-helixtrans-63.8-42.2176.3-62.2-39.6000110.8K1695 V1700 L1705 A1706 L1707 V1731K1695-D1703 IonicContact NZ-OD2 2.67Å; V1700-D1703 WeakPolarHBondContact O-CB 3.43Å; V1700-D1703 PolarHBondContact O-N 2.49Å; V1700-D1703 VanDerWaalsContact O-N 3.08Å; D1703-L1705 PolarHBondContact O-N 2.98Å; D1703-A1706 PolarHBondContact O-N 3.29Å; D1703-L1707 WeakPolarHBondContact O-CB 3.4Å; D1703-L1707 WeakPolarHBondContact O-CD1 3.41Å; D1703-L1707 WeakPolarHBondContact O-CG 3.38Å; D1703-L1707 PolarHBondContact O-N 3.11Å; D1703-V1731 HydrophobicContact CB-CG1 4.41Å
1704M88Confident86.5Confident26 Ų2623.9 Ų23.913%0.12813%0.127CC..Hα-helixtrans-56.3-48.8174.9-68.1-177.968.600111.9P1503 V1700 R1701 L1707 Q1708 V1731 V1732 A1733P1503-M1704 HydrophobicContact CG-CE 4.39Å; V1700-M1704 WeakPolarHBondContact O-CG 3.37Å; V1700-M1704 PolarHBondContact O-N 3.38Å; R1701-M1704 WeakPolarHBondContact O-CB 3.49Å; R1701-M1704 PolarHBondContact O-N 3.28Å; M1704-L1707 PolarHBondContact O-N 3.21Å; M1704-Q1708 VanDerWaalsContact O-CB 3.27Å; M1704-Q1708 WeakPolarHBondContact O-CB 3.44Å; M1704-Q1708 PolarHBondContact O-N 3.23Å; M1704-V1731 HydrophobicContact CG-CB 3.96Å; M1704-V1731 HydrophobicContact CG-CG1 3.63Å; M1704-V1731 WeakPolarHBondContact CG-O 3.49Å; M1704-V1732 HydrophobicContact CE-CG2 4.5Å; M1704-A1733 HydrophobicContact SD-CB 3.62Å; M1704-A1733 PolarHBondContact SD-N 3.04Å
1705L87.9Confident86.5Confident14 Ų1424.5 Ų24.57%0.07313%0.131CC..Hα-helixtrans-63.4-45.8179.6179.861.5000110.9R1701 Q1702 D1703 L1707 Q1708 I1709 M1826 F1834R1701-L1705 PolarHBondContact O-N 3.39Å; Q1702-L1705 PolarHBondContact O-N 2.99Å; D1703-L1705 PolarHBondContact O-N 2.98Å; L1705-L1707 PolarHBondContact O-N 3.44Å; L1705-Q1708 WeakPolarHBondContact O-CB 3.09Å; L1705-Q1708 PolarHBondContact O-N 3.32Å; L1705-I1709 HydrophobicContact CD1-CD1 4.46Å; L1705-I1709 HydrophobicContact CD1-CG1 4.4Å; L1705-I1709 WeakPolarHBondContact O-CG1 3.45Å; L1705-I1709 PolarHBondContact O-N 3.05Å; L1705-M1826 HydrophobicContact CD1-CG 4.16Å; L1705-M1826 HydrophobicContact CD2-CB 4.2Å; L1705-M1826 HydrophobicContact CD2-CG 4.26Å; L1705-F1834 HydrophobicContact CD2-CZ 3.74Å
1706A84.8Confident86.7Confident12 Ų1222.1 Ų22.110%0.09912%0.121CC..Hα-helixtrans-56.4-49.5177.500000112.4Q1702 D1703 I1709 M1710 F1765Q1702-A1706 WeakPolarHBondContact O-CB 3.4Å; Q1702-A1706 PolarHBondContact O-N 3.17Å; D1703-A1706 PolarHBondContact O-N 3.29Å; A1706-I1709 PolarHBondContact O-N 3.18Å; A1706-M1710 WeakPolarHBondContact O-CG 3.33Å; A1706-M1710 PolarHBondContact O-N 3.22Å; A1706-F1765 HydrophobicContact CB-CD2 4.21Å; A1706-F1765 HydrophobicContact CB-CE2 3.26Å; A1706-F1765 HydrophobicContact CB-CZ 3.63Å
1707L88.6Confident86.9Confident16 Ų1620.8 Ų20.88%0.08411%0.113CC..Hα-helixtrans-70.5-33.7-178.3-69.2161000112.3D1703 M1704 L1705 M1710 Q1711 P1728 Y1729 V1731D1703-L1707 WeakPolarHBondContact O-CB 3.4Å; D1703-L1707 WeakPolarHBondContact O-CD1 3.41Å; D1703-L1707 WeakPolarHBondContact O-CG 3.38Å; D1703-L1707 PolarHBondContact O-N 3.11Å; M1704-L1707 PolarHBondContact O-N 3.21Å; L1705-L1707 PolarHBondContact O-N 3.44Å; L1707-M1710 HydrophobicContact CD2-SD 4.22Å; L1707-M1710 PolarHBondContact O-N 3.32Å; L1707-Q1711 WeakPolarHBondContact O-CB 3.43Å; L1707-Q1711 PolarHBondContact O-N 3.18Å; L1707-P1728 HydrophobicContact CD2-CB 4.48Å; L1707-Y1729 HydrophobicContact CD1-CD2 3.81Å; L1707-Y1729 HydrophobicContact CD1-CE1 4.48Å; L1707-Y1729 HydrophobicContact CD1-CE2 3.42Å; L1707-Y1729 VanDerWaalsContact CD1-CE2 3.42Å; L1707-Y1729 HydrophobicContact CD1-CG 4.48Å; L1707-Y1729 WeakPolarHBondContact CD1-O 3.5Å; L1707-Y1729 HydrophobicContact CD2-CD1 4.09Å; L1707-Y1729 HydrophobicContact CD2-CD2 4.47Å; L1707-Y1729 HydrophobicContact CD2-CE1 3.86Å; L1707-Y1729 HydrophobicContact CD2-CE2 4.28Å; L1707-Y1729 HydrophobicContact CD2-CG 4.38Å; L1707-Y1729 HydrophobicContact CG-CE2 4.47Å; L1707-V1731 HydrophobicContact CD1-CB 4.07Å; L1707-V1731 HydrophobicContact CD1-CG2 3.32Å
1708Q88.7Confident87.4Confident17 Ų1724.3 Ų24.38%0.07912%0.12CC..Hα-helixtrans-58.2-52.2169.9-177.7-165.114.400110.3Y1500 M1704 L1705 M1710 Q1711 L1712Y1500-Q1708 PolarHBondContact O-NE2 2.98Å; M1704-Q1708 VanDerWaalsContact O-CB 3.27Å; M1704-Q1708 WeakPolarHBondContact O-CB 3.44Å; M1704-Q1708 PolarHBondContact O-N 3.23Å; L1705-Q1708 WeakPolarHBondContact O-CB 3.09Å; L1705-Q1708 PolarHBondContact O-N 3.32Å; Q1708-M1710 VanDerWaalsContact C-N 3.34Å; Q1708-M1710 PolarHBondContact O-N 2.83Å; Q1708-Q1711 PolarHBondContact O-N 3.38Å; Q1708-L1712 HydrophobicContact CG-CD1 4.45Å; Q1708-L1712 WeakPolarHBondContact O-CG 3.21Å; Q1708-L1712 PolarHBondContact O-N 2.99Å
1709I87.9Confident87.7Confident31 Ų3124.2 Ų24.216%0.15912%0.122CC..Hα-helixtrans-60.6-44.5178.4-61-46.1000110.7L1705 A1706 Q1711 L1712 C1713 F1819L1705-I1709 HydrophobicContact CD1-CD1 4.46Å; L1705-I1709 HydrophobicContact CD1-CG1 4.4Å; L1705-I1709 WeakPolarHBondContact O-CG1 3.45Å; L1705-I1709 PolarHBondContact O-N 3.05Å; A1706-I1709 PolarHBondContact O-N 3.18Å; I1709-Q1711 VanDerWaalsContact C-N 3.33Å; I1709-Q1711 PolarHBondContact O-N 3.41Å; I1709-L1712 HydrophobicContact CD1-CD1 4.35Å; I1709-L1712 WeakPolarHBondContact O-CB 3.44Å; I1709-L1712 PolarHBondContact O-N 2.95Å; I1709-C1713 PolarHBondContact O-N 2.83Å; I1709-C1713 PolarHBondContact O-SG 2.95Å; I1709-F1819 HydrophobicContact CD1-CD1 4.17Å; I1709-F1819 HydrophobicContact CG2-CD1 4.02Å; I1709-F1819 HydrophobicContact CG2-CE1 4.05Å
1710M86.9Confident87.8Confident53 Ų5323.7 Ų23.726%0.26112%0.119SC..Hα-helixtrans-58.8-42176.3-72.9176.864.600112.8A1706 L1707 Q1708 C1713 L1714 P1728 M1764A1706-M1710 WeakPolarHBondContact O-CG 3.33Å; A1706-M1710 PolarHBondContact O-N 3.22Å; L1707-M1710 HydrophobicContact CD2-SD 4.22Å; L1707-M1710 PolarHBondContact O-N 3.32Å; Q1708-M1710 VanDerWaalsContact C-N 3.34Å; Q1708-M1710 PolarHBondContact O-N 2.83Å; M1710-C1713 WeakPolarHBondContact O-CB 3.14Å; M1710-C1713 PolarHBondContact O-N 2.85Å; M1710-L1714 WeakPolarHBondContact O-CB 3.41Å; M1710-L1714 PolarHBondContact O-N 2.88Å; M1710-P1728 HydrophobicContact CB-CB 4.4Å; M1710-M1764 HydrophobicContact SD-CE 4.42Å; M1710-M1764 HydrophobicContact SD-SD 4.04Å
1711Q87.7Confident87.7Confident30 Ų3029.9 Ų29.914%0.1415%0.152CC..Hα-helixtrans-64.6-41.2176.6-178.860.27300111.6Y1500 L1707 Q1708 I1709 L1714 N1715 P1728Y1500-Q1711 HydrophobicContact CE1-CG 4.25Å; L1707-Q1711 WeakPolarHBondContact O-CB 3.43Å; L1707-Q1711 PolarHBondContact O-N 3.18Å; Q1708-Q1711 PolarHBondContact O-N 3.38Å; I1709-Q1711 VanDerWaalsContact C-N 3.33Å; I1709-Q1711 PolarHBondContact O-N 3.41Å; Q1711-L1714 PolarHBondContact O-N 2.8Å; Q1711-N1715 PolarHBondContact NE2-OD1 3.33Å; Q1711-N1715 VanDerWaalsContact O-CG 3.23Å; Q1711-N1715 PolarHBondContact O-N 3.31Å; Q1711-N1715 PolarHBondContact O-OD1 3.41Å; Q1711-N1715 VanDerWaalsContact O-OD1 3.14Å; Q1711-P1728 HydrophobicContact CB-CB 4.38Å; Q1711-P1728 HydrophobicContact CB-CG 4.22Å
1712L89.2Confident87.6Confident4 Ų430.2 Ų30.22%0.02116%0.155CC..Hα-helixtrans-63-41.6174.9-68.5177.7000111.6L1062 Q1708 I1709 L1714 N1715 V1716 F1819 L1822L1062-L1712 HydrophobicContact CB-CD2 4.26Å; L1062-L1712 HydrophobicContact CD2-CB 3.92Å; L1062-L1712 HydrophobicContact CD2-CD2 4.01Å; L1062-L1712 HydrophobicContact CD2-CG 4.39Å; Q1708-L1712 HydrophobicContact CG-CD1 4.45Å; Q1708-L1712 WeakPolarHBondContact O-CG 3.21Å; Q1708-L1712 PolarHBondContact O-N 2.99Å; I1709-L1712 HydrophobicContact CD1-CD1 4.35Å; I1709-L1712 WeakPolarHBondContact O-CB 3.44Å; I1709-L1712 PolarHBondContact O-N 2.95Å; L1712-L1714 VanDerWaalsContact C-N 3.35Å; L1712-L1714 PolarHBondContact O-N 2.96Å; L1712-N1715 WeakPolarHBondContact O-CB 3.49Å; L1712-N1715 PolarHBondContact O-N 2.88Å; L1712-V1716 WeakPolarHBondContact O-CG2 3.5Å; L1712-V1716 PolarHBondContact O-N 3.28Å; L1712-V1716 VanDerWaalsContact O-N 3.13Å; L1712-F1819 HydrophobicContact CB-CE1 3.87Å; L1712-F1819 HydrophobicContact CB-CZ 4.39Å; L1712-F1819 HydrophobicContact CD1-CE1 4.43Å; L1712-L1822 HydrophobicContact CD1-CD1 3.62Å
1713C89.1Confident87.4Confident14 Ų1433.5 Ų33.510%0.09517%0.174CC..Hα-helixtrans-61.2-42.5173.2-60.90000112.1I1709 M1710 N1715 V1716 A1717 M1808 M1812I1709-C1713 PolarHBondContact O-N 2.83Å; I1709-C1713 PolarHBondContact O-SG 2.95Å; M1710-C1713 WeakPolarHBondContact O-CB 3.14Å; M1710-C1713 PolarHBondContact O-N 2.85Å; C1713-N1715 VanDerWaalsContact C-N 3.3Å; C1713-N1715 PolarHBondContact O-N 3.29Å; C1713-V1716 PolarHBondContact O-N 3.43Å; C1713-A1717 PolarHBondContact O-N 3.41Å; C1713-M1808 HydrophobicContact CB-CE 4.1Å; C1713-M1812 HydrophobicContact CB-CE 4.04Å; C1713-M1812 HydrophobicContact CB-SD 4.01Å; C1713-M1812 WeakPolarHBondContact SG-CE 3.5Å
1714L88.9Confident87.3Confident3 Ų333 Ų332%0.01617%0.172CC..Hα-helixtrans-64.4-36.1176.1178.757.4000111.7M1710 Q1711 L1712 V1716 A1717 R1718 L1726 P1728M1710-L1714 WeakPolarHBondContact O-CB 3.41Å; M1710-L1714 PolarHBondContact O-N 2.88Å; Q1711-L1714 PolarHBondContact O-N 2.8Å; L1712-L1714 VanDerWaalsContact C-N 3.35Å; L1712-L1714 PolarHBondContact O-N 2.96Å; L1714-V1716 VanDerWaalsContact C-N 3.33Å; L1714-A1717 PolarHBondContact O-N 3.08Å; L1714-R1718 HydrophobicContact CD1-CG 4.29Å; L1714-R1718 WeakPolarHBondContact O-CG 3.47Å; L1714-R1718 PolarHBondContact O-N 3.09Å; L1714-L1726 HydrophobicContact CB-CD1 4.3Å; L1714-L1726 HydrophobicContact CD1-CB 4.09Å; L1714-L1726 HydrophobicContact CD1-CD1 4.39Å; L1714-L1726 HydrophobicContact CD2-CB 4.09Å; L1714-L1726 WeakPolarHBondContact CD2-O 3.37Å; L1714-L1726 HydrophobicContact CG-CB 4.49Å; L1714-P1728 HydrophobicContact CD2-CG 3.93Å
1715N90.7Very high87.1Confident14 Ų1440.9 Ų40.98%0.07520%0.202CC..Hα-helixtrans-63.7-42.1175.6-67.4-5.3000111.5P1061 L1070 Q1711 L1712 C1713 R1718 S1719P1061-N1715 HydrophobicContact CB-CB 4.43Å; P1061-N1715 WeakPolarHBondContact O-CB 3.29Å; P1061-N1715 PolarHBondContact O-ND2 2.74Å; L1070-N1715 HydrophobicContact CD1-CB 3.71Å; L1070-N1715 HydrophobicContact CD2-CB 4.38Å; L1070-N1715 WeakPolarHBondContact CD2-O 3.39Å; Q1711-N1715 PolarHBondContact NE2-OD1 3.33Å; Q1711-N1715 VanDerWaalsContact O-CG 3.23Å; Q1711-N1715 PolarHBondContact O-N 3.31Å; Q1711-N1715 PolarHBondContact O-OD1 3.41Å; Q1711-N1715 VanDerWaalsContact O-OD1 3.14Å; L1712-N1715 WeakPolarHBondContact O-CB 3.49Å; L1712-N1715 PolarHBondContact O-N 2.88Å; C1713-N1715 VanDerWaalsContact C-N 3.3Å; C1713-N1715 PolarHBondContact O-N 3.29Å; N1715-R1718 PolarHBondContact O-N 2.84Å; N1715-S1719 PolarHBondContact O-N 3.49Å
1716V90Very high86.8Confident2 Ų242.9 Ų42.91%0.01221%0.212CC..Hα-helixtrans-60.5-45.4173.5175.50000110.7P1061 L1062 L1712 C1713 L1714 R1718 S1719 A1811 M1812P1061-V1716 HydrophobicContact CB-CG2 4.02Å; P1061-V1716 HydrophobicContact CG-CG2 3.88Å; L1062-V1716 HydrophobicContact CD2-CG2 4.11Å; L1712-V1716 WeakPolarHBondContact O-CG2 3.5Å; L1712-V1716 PolarHBondContact O-N 3.28Å; L1712-V1716 VanDerWaalsContact O-N 3.13Å; C1713-V1716 PolarHBondContact O-N 3.43Å; L1714-V1716 VanDerWaalsContact C-N 3.33Å; V1716-R1718 VanDerWaalsContact C-N 3.35Å; V1716-R1718 PolarHBondContact O-N 3Å; V1716-S1719 WeakPolarHBondContact O-CB 3.49Å; V1716-S1719 PolarHBondContact O-N 3.45Å; V1716-S1719 PolarHBondContact O-OG 3.44Å; V1716-A1811 HydrophobicContact CG1-CB 3.88Å; V1716-A1811 WeakPolarHBondContact CG1-O 3.45Å; V1716-M1812 HydrophobicContact CG1-CG 4.32Å
1717A88.5Confident86.6Confident2 Ų246.9 Ų46.92%0.01723%0.226CC..Hα-helixtrans-61-41.9177.500000112.6C1713 L1714 S1719 I1720 D1721 L1722 M1808C1713-A1717 PolarHBondContact O-N 3.41Å; L1714-A1717 PolarHBondContact O-N 3.08Å; A1717-S1719 VanDerWaalsContact C-N 3.35Å; A1717-S1719 PolarHBondContact O-N 3.47Å; A1717-I1720 VanDerWaalsContact O-CG1 3.3Å; A1717-I1720 WeakPolarHBondContact O-CG1 3.29Å; A1717-I1720 PolarHBondContact O-N 2.91Å; A1717-D1721 PolarHBondContact O-N 2.82Å; A1717-L1722 HydrophobicContact CB-CB 4.4Å; A1717-L1722 PolarHBondContact O-N 3.04Å; A1717-M1808 HydrophobicContact CB-CE 4.35Å
1718R88.1Confident86.4Confident94 Ų9447 Ų4736%0.35523%0.227SC..Hα-helixtrans-65.1-36.9175.8-73.1172.9175.6166.3-2.6112.5L1070 L1714 N1715 V1716 I1720 D1721L1070-R1718 HydrophobicContact CB-CB 3.88Å; L1070-R1718 HydrophobicContact CD1-CB 4.08Å; L1070-R1718 CarbonylContact O-C 3.57Å; L1714-R1718 HydrophobicContact CD1-CG 4.29Å; L1714-R1718 WeakPolarHBondContact O-CG 3.47Å; L1714-R1718 PolarHBondContact O-N 3.09Å; N1715-R1718 PolarHBondContact O-N 2.84Å; V1716-R1718 VanDerWaalsContact C-N 3.35Å; V1716-R1718 PolarHBondContact O-N 3Å; R1718-I1720 PolarHBondContact O-N 3.44Å; R1718-D1721 PolarHBondContact O-N 3.36Å
1719S86Confident86.3Confident34 Ų3449.9 Ų49.924%0.23824%0.238CC..Hα-helixtrans-58.5-18.917978.50000114.6L1070 N1715 V1716 A1717L1070-S1719 WeakPolarHBondContact O-CA 3.34Å; N1715-S1719 PolarHBondContact O-N 3.49Å; V1716-S1719 WeakPolarHBondContact O-CB 3.49Å; V1716-S1719 PolarHBondContact O-N 3.45Å; V1716-S1719 PolarHBondContact O-OG 3.44Å; A1717-S1719 VanDerWaalsContact C-N 3.35Å; A1717-S1719 PolarHBondContact O-N 3.47Å
1720I86.2Confident86.3Confident22 Ų2251.2 Ų51.211%0.11324%0.241CC..THydrogen-bonded Turntrans-120.213.3179.662.4159.9000112.6C1189 W1353 A1717 R1718 L1722 A1811C1189-I1720 HydrophobicContact CB-CB 4.39Å; C1189-I1720 HydrophobicContact CB-CG2 3.5Å; C1189-I1720 VanDerWaalsContact CB-CG2 3.5Å; W1353-I1720 HydrophobicContact CH2-CD1 4.23Å; W1353-I1720 HydrophobicContact CZ3-CD1 4.13Å; A1717-I1720 VanDerWaalsContact O-CG1 3.3Å; A1717-I1720 WeakPolarHBondContact O-CG1 3.29Å; A1717-I1720 PolarHBondContact O-N 2.91Å; R1718-I1720 PolarHBondContact O-N 3.44Å; I1720-L1722 VanDerWaalsContact C-N 3.26Å; I1720-L1722 HydrophobicContact CD1-CB 4.13Å; I1720-L1722 HydrophobicContact CG1-CB 4.06Å; I1720-L1722 PolarHBondContact O-N 2.95Å; I1720-A1811 HydrophobicContact CD1-CB 3.54Å; I1720-A1811 HydrophobicContact CG1-CB 4.49Å
1721D84.8Confident86.5Confident130 Ų13049.4 Ų49.470%0.69523%0.233SC*.THydrogen-bonded Turntrans49.943.9-177.8-16538.4000113.4P1072 A1717 R1718P1072-D1721 HydrophobicContact CG-CB 3.6Å; A1717-D1721 PolarHBondContact O-N 2.82Å; R1718-D1721 PolarHBondContact O-N 3.36Å
1722L86.2Confident86.6Confident21 Ų2148.3 Ų48.311%0.1123%0.228CC..  trans-79.8126.1175.4-161.772.5000109.6A1717 I1720 V1724 L1804 R1807 M1808A1717-L1722 HydrophobicContact CB-CB 4.4Å; A1717-L1722 PolarHBondContact O-N 3.04Å; I1720-L1722 VanDerWaalsContact C-N 3.26Å; I1720-L1722 HydrophobicContact CD1-CB 4.13Å; I1720-L1722 HydrophobicContact CG1-CB 4.06Å; I1720-L1722 PolarHBondContact O-N 2.95Å; L1722-V1724 HydrophobicContact CB-CG2 4.43Å; L1722-V1724 HydrophobicContact CD2-CG2 3.62Å; L1722-V1724 HydrophobicContact CG-CG2 3.82Å; L1722-V1724 PolarHBondContact O-N 3.32Å; L1722-L1804 HydrophobicContact CD1-CD2 3.82Å; L1722-L1804 HydrophobicContact CG-CD2 3.97Å; L1722-R1807 HydrophobicContact CD1-CB 3.79Å; L1722-R1807 HydrophobicContact CD2-CB 4.32Å; L1722-M1808 HydrophobicContact CD2-CB 3.67Å; L1722-M1808 HydrophobicContact CD2-CG 4.37Å
1723D83.3Confident86.7Confident114 Ų11448.1 Ų48.161%0.6123%0.228SC*.  trans-71.672.1178.8-172.320.8000111.7W1800D1723-W1800 HydrophobicContact CB-CZ2 4.5Å; D1723-W1800 WeakPolarHBondContact OD2-CZ2 3.35Å
1724V83.1Confident86.8Confident39 Ų3948 Ų4824%0.23623%0.227CC..  trans-123.2124.8177.71790000109L1722 L1726 M1808L1722-V1724 HydrophobicContact CB-CG2 4.43Å; L1722-V1724 HydrophobicContact CD2-CG2 3.62Å; L1722-V1724 HydrophobicContact CG-CG2 3.82Å; L1722-V1724 PolarHBondContact O-N 3.32Å; V1724-L1726 HydrophobicContact CG1-CD1 4.34Å; V1724-L1726 HydrophobicContact CG1-CG 4.1Å; V1724-M1808 HydrophobicContact CG1-SD 4.09Å; V1724-M1808 HydrophobicContact CG2-SD 4.29Å
1725Y82Confident86.8Confident193 Ų19349.4 Ų49.476%0.75724%0.238SC*.  trans-95.1114175.5-175.8-98.8000111.2
1726L82.2Confident86.7Confident55 Ų5549.9 Ų49.929%0.28824%0.242SC..  trans-130.7137.3168.9-65.9170.1000109.3L1714 V1724 P1728 M1808L1714-L1726 HydrophobicContact CB-CD1 4.3Å; L1714-L1726 HydrophobicContact CD1-CB 4.09Å; L1714-L1726 HydrophobicContact CD1-CD1 4.39Å; L1714-L1726 HydrophobicContact CD2-CB 4.09Å; L1714-L1726 WeakPolarHBondContact CD2-O 3.37Å; L1714-L1726 HydrophobicContact CG-CB 4.49Å; V1724-L1726 HydrophobicContact CG1-CD1 4.34Å; V1724-L1726 HydrophobicContact CG1-CG 4.1Å; L1726-P1728 VanDerWaalsContact C-CD 3.46Å; L1726-P1728 WeakPolarHBondContact O-CD 3.47Å; L1726-M1808 HydrophobicContact CD1-CE 4.03Å
1727Y81.2Confident86.5Confident96 Ų9649.9 Ų49.938%0.37624%0.243SC..  trans-118.177.9174.2-165.7-86.6000109.9Y1729 V1744Y1727-Y1729 PolarHBondContact O-N 3.01Å; Y1727-V1744 HydrophobicContact CD1-CB 4.36Å; Y1727-V1744 HydrophobicContact CD1-CG1 3.88Å; Y1727-V1744 HydrophobicContact CD1-CG2 3.92Å; Y1727-V1744 HydrophobicContact CE1-CB 4.45Å; Y1727-V1744 HydrophobicContact CE1-CG1 4.18Å; Y1727-V1744 HydrophobicContact CE1-CG2 4.23Å
1728P84.9Confident86.5Confident19 Ų1950.9 Ų50.912%0.12325%0.249CC..  trans-70.6100.7173.930.3-34.3000109L1707 M1710 Q1711 L1714 L1726L1707-P1728 HydrophobicContact CD2-CB 4.48Å; M1710-P1728 HydrophobicContact CB-CB 4.4Å; Q1711-P1728 HydrophobicContact CB-CB 4.38Å; Q1711-P1728 HydrophobicContact CB-CG 4.22Å; L1714-P1728 HydrophobicContact CD2-CG 3.93Å; L1726-P1728 VanDerWaalsContact C-CD 3.46Å; L1726-P1728 WeakPolarHBondContact O-CD 3.47Å
1729Y86.5Confident86.6Confident77 Ų7746.6 Ų46.630%0.30223%0.234SC..  trans-66.6156.7172.459.9-88.2000110.2L1707 Y1727 V1731 I1741 Q1742 V1744L1707-Y1729 HydrophobicContact CD1-CD2 3.81Å; L1707-Y1729 HydrophobicContact CD1-CE1 4.48Å; L1707-Y1729 HydrophobicContact CD1-CE2 3.42Å; L1707-Y1729 VanDerWaalsContact CD1-CE2 3.42Å; L1707-Y1729 HydrophobicContact CD1-CG 4.48Å; L1707-Y1729 WeakPolarHBondContact CD1-O 3.5Å; L1707-Y1729 HydrophobicContact CD2-CD1 4.09Å; L1707-Y1729 HydrophobicContact CD2-CD2 4.47Å; L1707-Y1729 HydrophobicContact CD2-CE1 3.86Å; L1707-Y1729 HydrophobicContact CD2-CE2 4.28Å; L1707-Y1729 HydrophobicContact CD2-CG 4.38Å; L1707-Y1729 HydrophobicContact CG-CE2 4.47Å; Y1727-Y1729 PolarHBondContact O-N 3.01Å; Y1729-V1731 HydrophobicContact CD2-CG2 3.95Å; Y1729-V1731 HydrophobicContact CE2-CG2 3.73Å; Y1729-I1741 HydrophobicContact CD2-CG2 3.94Å; Y1729-I1741 HydrophobicContact CE2-CG2 3.73Å; Y1729-Q1742 WeakPolarHBondContact CD2-O 3.31Å; Y1729-V1744 HydrophobicContact CD1-CG2 3.79Å; Y1729-V1744 HydrophobicContact CG-CG2 4.27Å
1730R88.1Confident86.9Confident59 Ų5945 Ų4522%0.22322%0.223CC..  trans-93143.1-176.7-61.9-177.8176.7173.9-2.4112.1S1626 D1627 E1629 Q1742S1626-R1730 WeakPolarHBondContact O-CB 3.19Å; S1626-R1730 WeakPolarHBondContact O-CD 3.43Å; D1627-R1730 IonicContact OD1-CZ 3.88Å; D1627-R1730 IonicContact OD1-NH1 3.21Å; D1627-R1730 PolarHBondContact OD1-NH1 3.31Å; E1629-R1730 IonicContact OE2-CZ 3.67Å; E1629-R1730 VanDerWaalsContact OE2-CZ 3.32Å; E1629-R1730 IonicContact OE2-NH1 3.73Å; E1629-R1730 PolarHBondContact OE2-NH1 3.44Å; E1629-R1730 IonicContact OE2-NH2 2.99Å; E1629-R1730 PolarHBondContact OE2-NH2 2.86Å; R1730-Q1742 HydrophobicContact CB-CB 4.49Å; R1730-Q1742 VanDerWaalsContact O-CB 3.29Å; R1730-Q1742 WeakPolarHBondContact O-CB 3.21Å; R1730-Q1742 PolarHBondContact O-N 2.94Å
1731V89.5Confident87.1Confident16 Ų1644.8 Ų44.810%0.09722%0.222CC..EExtended strand (participates in β ladder)trans-132.7138.7175.5178.90000108.5V1700 D1703 M1704 L1707 Y1729 V1740 I1741V1700-V1731 HydrophobicContact CB-CG1 3.75Å; V1700-V1731 HydrophobicContact CG2-CG1 3.75Å; D1703-V1731 HydrophobicContact CB-CG1 4.41Å; M1704-V1731 HydrophobicContact CG-CB 3.96Å; M1704-V1731 HydrophobicContact CG-CG1 3.63Å; M1704-V1731 WeakPolarHBondContact CG-O 3.49Å; L1707-V1731 HydrophobicContact CD1-CB 4.07Å; L1707-V1731 HydrophobicContact CD1-CG2 3.32Å; Y1729-V1731 HydrophobicContact CD2-CG2 3.95Å; Y1729-V1731 HydrophobicContact CE2-CG2 3.73Å; V1731-V1740 WeakPolarHBondContact CA-O 3.33Å; V1731-I1741 HydrophobicContact CG1-CG1 3.95Å; V1731-I1741 HydrophobicContact CG2-CB 4.21Å; V1731-I1741 HydrophobicContact CG2-CG1 3.94Å; V1731-I1741 HydrophobicContact CG2-CG2 3.95Å
1732V91.2Very high87.4Confident6 Ų639.3 Ų39.34%0.03619%0.192CC..EExtended strand (participates in β ladder)trans-133.7133.6172.666.50000110Q1534 W1537 P1625 M1704 T1734 G1739 V1740Q1534-V1732 VanDerWaalsContact OE1-CG2 3.3Å; W1537-V1732 HydrophobicContact CE3-CG2 4.28Å; P1625-V1732 VanDerWaalsContact C-CG1 3.48Å; P1625-V1732 HydrophobicContact CB-CG1 3.74Å; P1625-V1732 WeakPolarHBondContact O-CG1 3.45Å; M1704-V1732 HydrophobicContact CE-CG2 4.5Å; V1732-T1734 HydrophobicContact CG1-CG2 4.13Å; V1732-G1739 CarbonylContact O-C 3.56Å; V1732-G1739 WeakPolarHBondContact O-CA 3.42Å; V1732-V1740 HydrophobicContact CG1-CB 3.98Å; V1732-V1740 PolarHBondContact N-O 3.03Å; V1732-V1740 PolarHBondContact O-N 3.11Å
1733A91.4Very high87.4Confident1 Ų139.4 Ų39.41%0.00819%0.194CC..EExtended strand (participates in β ladder)trans-84.2122.3167.900000108.3T1541 V1700 R1701 M1704 C1738T1541-A1733 HydrophobicContact CG2-CB 3.82Å; V1700-A1733 HydrophobicContact CG2-CB 3.84Å; R1701-A1733 HydrophobicContact CG-CB 4.04Å; M1704-A1733 HydrophobicContact SD-CB 3.62Å; M1704-A1733 PolarHBondContact SD-N 3.04Å; A1733-C1738 WeakPolarHBondContact CA-O 3.3Å
1734T90.7Very high87.4Confident12 Ų1236.4 Ų36.47%0.07418%0.18CC..EExtended strand (participates in β ladder)trans-100.1-26.1-176510000112.6W1537 P1625 V1732 C1738 V1740W1537-T1734 HydrophobicContact CD2-CG2 4.22Å; W1537-T1734 HydrophobicContact CG-CG2 4.26Å; P1625-T1734 HydrophobicContact CB-CG2 4.36Å; V1732-T1734 HydrophobicContact CG1-CG2 4.13Å; T1734-C1738 PolarHBondContact N-O 2.95Å; T1734-C1738 PolarHBondContact OG1-O 3.32Å; T1734-V1740 HydrophobicContact CG2-CG2 4.01Å
1735A89.1Confident87.1Confident31 Ų3137.8 Ų37.826%0.25619%0.19SC..EExtended strand (participates in β ladder)trans-160.5172.3175.200000109.3T1541 G1737 C1738T1541-A1735 WeakPolarHBondContact OG1-CA 3.4Å; T1541-A1735 PolarHBondContact OG1-N 3.05Å; A1735-G1737 PolarHBondContact O-N 2.86Å; A1735-C1738 HydrophobicContact CB-CB 3.96Å; A1735-C1738 PolarHBondContact N-O 3.14Å; A1735-C1738 PolarHBondContact O-N 2.55Å
1736P87.2Confident86.7Confident25 Ų2537.2 Ų37.216%0.16220%0.2CC..THydrogen-bonded Turntrans-51.6126.6171.1-24.434.6000111.3Y1544 E1547 C1738Y1544-P1736 HydrophobicContact CD2-CB 4.41Å; Y1544-P1736 HydrophobicContact CD2-CG 3.32Å; Y1544-P1736 HydrophobicContact CE2-CG 4.03Å; Y1544-P1736 HydrophobicContact CG-CG 3.92Å; E1547-P1736 CarbonylContact O-C 3.57Å; E1547-P1736 VanDerWaalsContact O-C 3.24Å; P1736-C1738 PolarHBondContact O-N 3.27Å; P1736-C1738 VanDerWaalsContact O-N 3.08Å; P1736-C1738 PolarHBondContact O-SG 3.39Å
1737G86.7Confident86.3Confident2 Ų237.7 Ų37.72%0.02121%0.207CC..THydrogen-bonded Turntrans64.17.9-176.300000115.1E1547 V1696 G1697 D1698 A1735E1547-G1737 WeakPolarHBondContact O-CA 3.49Å; E1547-G1737 PolarHBondContact O-N 3.22Å; V1696-G1737 CarbonylContact C-O 3.58Å; V1696-G1737 WeakPolarHBondContact CA-O 3.38Å; G1697-G1737 CarbonylContact C-O 3.27Å; G1697-G1737 VanDerWaalsContact C-O 3.32Å; G1697-G1737 VanDerWaalsContact CA-O 3.28Å; G1697-G1737 WeakPolarHBondContact CA-O 3.49Å; G1697-G1737 PolarHBondContact N-O 3.06Å; D1698-G1737 PolarHBondContact N-O 3.36Å; D1698-G1737 CarbonylContact O-C 3.28Å; D1698-G1737 VanDerWaalsContact O-O 3.09Å; A1735-G1737 PolarHBondContact O-N 2.86Å
1738C88.9Confident85.5Confident23 Ų2339 Ų3916%0.15522%0.215CC..EExtended strand (participates in β ladder)trans-122.7136.5-177.2-58.80000111K1695 A1733 T1734 A1735 P1736K1695-C1738 CarbonylContact O-C 3.57Å; K1695-C1738 WeakPolarHBondContact O-CA 3.42Å; A1733-C1738 WeakPolarHBondContact CA-O 3.3Å; T1734-C1738 PolarHBondContact N-O 2.95Å; T1734-C1738 PolarHBondContact OG1-O 3.32Å; A1735-C1738 HydrophobicContact CB-CB 3.96Å; A1735-C1738 PolarHBondContact N-O 3.14Å; A1735-C1738 PolarHBondContact O-N 2.55Å; P1736-C1738 PolarHBondContact O-N 3.27Å; P1736-C1738 VanDerWaalsContact O-N 3.08Å; P1736-C1738 PolarHBondContact O-SG 3.39Å
1739G90.4Very high84.4Confident3 Ų340.6 Ų40.63%0.03123%0.227CC..EExtended strand (participates in β ladder)trans-159.2161.8175.800000114.2K1695 V1732K1695-G1739 PolarHBondContact N-O 3Å; K1695-G1739 PolarHBondContact O-N 3.46Å; V1732-G1739 CarbonylContact O-C 3.56Å; V1732-G1739 WeakPolarHBondContact O-CA 3.42Å
1740V91.9Very high83Confident1 Ų140.9 Ų40.91%0.00623%0.227CC..EExtended strand (participates in β ladder)trans-114.7122.4177.1-173.90000108.2P1625 A1692 I1693 F1694 V1731 V1732 T1734P1625-V1740 HydrophobicContact CB-CB 4.49Å; P1625-V1740 HydrophobicContact CB-CG2 4.26Å; P1625-V1740 HydrophobicContact CG-CG2 4.44Å; A1692-V1740 HydrophobicContact CB-CG1 3.95Å; I1693-V1740 WeakPolarHBondContact O-CA 3.38Å; F1694-V1740 HydrophobicContact CD1-CG2 3.84Å; F1694-V1740 HydrophobicContact CE1-CG1 4.21Å; F1694-V1740 HydrophobicContact CE1-CG2 3.74Å; F1694-V1740 HydrophobicContact CZ-CG1 4.36Å; V1731-V1740 WeakPolarHBondContact CA-O 3.33Å; V1732-V1740 HydrophobicContact CG1-CB 3.98Å; V1732-V1740 PolarHBondContact N-O 3.03Å; V1732-V1740 PolarHBondContact O-N 3.11Å; T1734-V1740 HydrophobicContact CG2-CG2 4.01Å
1741I90.5Very high81.4Confident18 Ų1840.5 Ų40.59%0.09223%0.23CC..EExtended strand (participates in β ladder)trans-112.6124.1-178.2-60172000108.5A1692 I1693 K1695 V1700 Y1729 V1731A1692-I1741 CarbonylContact C-O 3.6Å; A1692-I1741 VanDerWaalsContact CA-O 3.26Å; A1692-I1741 WeakPolarHBondContact CA-O 3.34Å; I1693-I1741 HydrophobicContact CB-CB 4.25Å; I1693-I1741 PolarHBondContact N-O 3.45Å; I1693-I1741 PolarHBondContact O-N 3.32Å; K1695-I1741 HydrophobicContact CB-CD1 4.2Å; K1695-I1741 HydrophobicContact CD-CD1 3.55Å; V1700-I1741 HydrophobicContact CG1-CD1 4.19Å; V1700-I1741 HydrophobicContact CG1-CG1 4.48Å; Y1729-I1741 HydrophobicContact CD2-CG2 3.94Å; Y1729-I1741 HydrophobicContact CE2-CG2 3.73Å; V1731-I1741 HydrophobicContact CG1-CG1 3.95Å; V1731-I1741 HydrophobicContact CG2-CB 4.21Å; V1731-I1741 HydrophobicContact CG2-CG1 3.94Å; V1731-I1741 HydrophobicContact CG2-CG2 3.95Å
1742Q90.9Very high79.8Confident15 Ų1544.6 Ų44.67%0.0725%0.248CC..EExtended strand (participates in β ladder)trans-69.6132.8171.9-176-174.32900110.2Q1690 Y1729 R1730Q1690-Q1742 HydrophobicContact CG-CG 4.42Å; Y1729-Q1742 WeakPolarHBondContact CD2-O 3.31Å; R1730-Q1742 HydrophobicContact CB-CB 4.49Å; R1730-Q1742 VanDerWaalsContact O-CB 3.29Å; R1730-Q1742 WeakPolarHBondContact O-CB 3.21Å; R1730-Q1742 PolarHBondContact O-N 2.94Å
1743C85.7Confident78.1Confident23 Ų2348.2 Ų48.216%0.15527%0.266CS..PPolyproline II helixtrans-81.8145.3172.4-56.80000111.1L1652 A1691L1652-C1743 VanDerWaalsContact CD1-SG 3.59Å; A1691-C1743 HydrophobicContact CB-CB 3.59Å; A1691-C1743 VanDerWaalsContact CB-SG 3.58Å; A1691-C1743 PolarHBondContact O-N 3.47Å
1744V83.4Confident76.1Confident50 Ų5048.6 Ų48.630%0.30327%0.271SS..PPolyproline II helixtrans-73.7120.2170.2-1780000109Y1727 Y1729 S1747Y1727-V1744 HydrophobicContact CD1-CB 4.36Å; Y1727-V1744 HydrophobicContact CD1-CG1 3.88Å; Y1727-V1744 HydrophobicContact CD1-CG2 3.92Å; Y1727-V1744 HydrophobicContact CE1-CB 4.45Å; Y1727-V1744 HydrophobicContact CE1-CG1 4.18Å; Y1727-V1744 HydrophobicContact CE1-CG2 4.23Å; Y1729-V1744 HydrophobicContact CD1-CG2 3.79Å; Y1729-V1744 HydrophobicContact CG-CG2 4.27Å; V1744-S1747 WeakPolarHBondContact CB-OG 3.15Å; V1744-S1747 PolarHBondContact O-OG 2.84Å
1745P77.7Confident74.3Confident69 Ų6954.9 Ų54.945%0.44829%0.293SS..THydrogen-bonded Turntrans-66.9146.6-174.927.7-34.4000111.4S1747P1745-S1747 PolarHBondContact O-N 2.9Å
1746N73.3Confident72.5Confident181 Ų18160 Ų6097%0.96831%0.312SS*.THydrogen-bonded Turntrans51.821.5179.2-56.2-37.2000114.6
1747S72.2Confident70.2Confident64 Ų6463.1 Ų63.145%0.44833%0.33SS..PPolyproline II helixtrans-101.6142.1177.974.60000110V1744 P1745V1744-S1747 WeakPolarHBondContact CB-OG 3.15Å; V1744-S1747 PolarHBondContact O-OG 2.84Å; P1745-S1747 PolarHBondContact O-N 2.9Å
1748K65.5Low67.7Low123 Ų12368.8 Ų68.854%0.53536%0.36SS..PPolyproline II helixtrans-101.8135.9159.4-71.5-179.6179.11770106.6R1750 Q1752 L1753K1748-R1750 PolarHBondContact O-N 2.93Å; K1748-Q1752 HydrophobicContact CB-CB 4.47Å; K1748-L1753 HydrophobicContact CB-CD1 4.12Å; K1748-L1753 HydrophobicContact CB-CG 4.26Å
1749S62.3Low65.2Low53 Ų5372.9 Ų72.937%0.37138%0.376SS..PPolyproline II helixtrans-57.6145172.665.10000109D1751 Q1752 L1753S1749-D1751 PolarHBondContact O-N 3.29Å; S1749-Q1752 VanDerWaalsContact N-OE1 3.17Å; S1749-Q1752 WeakPolarHBondContact O-CA 3.29Å; S1749-Q1752 WeakPolarHBondContact O-CB 3.3Å; S1749-Q1752 PolarHBondContact O-N 2.71Å; S1749-Q1752 VanDerWaalsContact OG-CB 3.32Å; S1749-Q1752 WeakPolarHBondContact OG-CB 3.49Å; S1749-Q1752 WeakPolarHBondContact OG-CG 3.49Å; S1749-Q1752 PolarHBondContact OG-N 2.83Å; S1749-Q1752 PolarHBondContact OG-OE1 2.99Å; S1749-L1753 PolarHBondContact O-N 3.19Å
1750R56.3Low62.7Low84 Ų8474.1 Ų74.132%0.31738%0.382SS..Hα-helixtrans-60.9-28.5176.8-162.3-16156.452.238.1111.4K1748 L1753 G1754 F1759 D1760 F1761K1748-R1750 PolarHBondContact O-N 2.93Å; R1750-L1753 CarbonylContact O-C 3.57Å; R1750-L1753 WeakPolarHBondContact O-CB 3.08Å; R1750-L1753 PolarHBondContact O-N 3.26Å; R1750-G1754 PolarHBondContact O-N 3.39Å; R1750-F1759 PolarHBondContact NH1-O 2.88Å; R1750-D1760 IonicContact CZ-OD1 3.78Å; R1750-D1760 VanDerWaalsContact NH1-C 3.28Å; R1750-D1760 IonicContact NH1-OD1 3.88Å; R1750-D1760 IonicContact NH2-OD1 3.14Å; R1750-D1760 PolarHBondContact NH2-OD1 3.15Å; R1750-F1761 VanDerWaalsContact CZ-CD2 3.45Å; R1750-F1761 VanDerWaalsContact NE-CB 3.28Å; R1750-F1761 VanDerWaalsContact NH1-CD2 3.35Å; R1750-F1761 PolarHBondContact NH2-O 3.3Å
1751D53.9Low60.2Low50 Ų5076.8 Ų76.827%0.26739%0.393SS..Hα-helixtrans-61.4-45.5167.7170.836.3000111.8S1749 L1753 G1754 R1755S1749-D1751 PolarHBondContact O-N 3.29Å; D1751-L1753 VanDerWaalsContact C-N 3.3Å; D1751-L1753 PolarHBondContact O-N 3.37Å; D1751-G1754 CarbonylContact O-C 2.99Å; D1751-G1754 WeakPolarHBondContact O-CA 3.37Å; D1751-G1754 PolarHBondContact O-N 3.01Å; D1751-G1754 VanDerWaalsContact O-N 3.12Å; D1751-R1755 WeakPolarHBondContact O-CG 3.34Å; D1751-R1755 PolarHBondContact O-N 3.24Å; D1751-R1755 IonicContact OD1-CZ 3.47Å; D1751-R1755 IonicContact OD1-NE 3.9Å; D1751-R1755 PolarHBondContact OD1-NE 2.67Å; D1751-R1755 IonicContact OD1-NH2 2.89Å; D1751-R1755 PolarHBondContact OD1-NH2 2.88Å; D1751-R1755 IonicContact OD2-CZ 2.76Å; D1751-R1755 IonicContact OD2-NE 3.61Å; D1751-R1755 PolarHBondContact OD2-NE 3.16Å; D1751-R1755 IonicContact OD2-NH2 3.36Å; D1751-R1755 PolarHBondContact OD2-NH2 3.46Å
1752Q57.5Low57.7Low103 Ų10378.6 Ų78.648%0.48142%0.416SS..Hα-helixtrans-62.2-35.3173.3-78.1167.9-15.700113.3K1748 S1749 Q1756K1748-Q1752 HydrophobicContact CB-CB 4.47Å; S1749-Q1752 VanDerWaalsContact N-OE1 3.17Å; S1749-Q1752 WeakPolarHBondContact O-CA 3.29Å; S1749-Q1752 WeakPolarHBondContact O-CB 3.3Å; S1749-Q1752 PolarHBondContact O-N 2.71Å; S1749-Q1752 VanDerWaalsContact OG-CB 3.32Å; S1749-Q1752 WeakPolarHBondContact OG-CB 3.49Å; S1749-Q1752 WeakPolarHBondContact OG-CG 3.49Å; S1749-Q1752 PolarHBondContact OG-N 2.83Å; S1749-Q1752 PolarHBondContact OG-OE1 2.99Å; Q1752-Q1756 WeakPolarHBondContact O-CG 3.25Å
1753L54Low55.5Low81 Ų8182.1 Ų82.142%0.42443%0.431SS..Hα-helixtrans-69.3-42.7171.4-80.6144.7000110.5K1748 S1749 R1750 D1751 R1755 Q1756 T1757K1748-L1753 HydrophobicContact CB-CD1 4.12Å; K1748-L1753 HydrophobicContact CB-CG 4.26Å; S1749-L1753 PolarHBondContact O-N 3.19Å; R1750-L1753 CarbonylContact O-C 3.57Å; R1750-L1753 WeakPolarHBondContact O-CB 3.08Å; R1750-L1753 PolarHBondContact O-N 3.26Å; D1751-L1753 VanDerWaalsContact C-N 3.3Å; D1751-L1753 PolarHBondContact O-N 3.37Å; L1753-R1755 VanDerWaalsContact C-N 3.32Å; L1753-R1755 PolarHBondContact O-N 2.83Å; L1753-Q1756 CarbonylContact O-C 3.55Å; L1753-Q1756 WeakPolarHBondContact O-CA 3.45Å; L1753-Q1756 WeakPolarHBondContact O-CB 3.19Å; L1753-Q1756 PolarHBondContact O-N 2.71Å; L1753-T1757 PolarHBondContact O-N 2.62Å; L1753-T1757 PolarHBondContact O-OG1 3.07Å
1754G50.7Low53.2Low10 Ų1087.2 Ų87.210%0.10346%0.455CS..Hα-helixtrans-58.3-38.2176.800000113.5R1750 D1751 Q1756 T1757 D1758 F1759R1750-G1754 PolarHBondContact O-N 3.39Å; D1751-G1754 CarbonylContact O-C 2.99Å; D1751-G1754 WeakPolarHBondContact O-CA 3.37Å; D1751-G1754 PolarHBondContact O-N 3.01Å; D1751-G1754 VanDerWaalsContact O-N 3.12Å; G1754-Q1756 PolarHBondContact O-N 2.89Å; G1754-T1757 CarbonylContact C-O 3.43Å; G1754-T1757 VanDerWaalsContact C-O 3.28Å; G1754-T1757 WeakPolarHBondContact CA-O 3.21Å; G1754-T1757 CarbonylContact O-C 3.2Å; G1754-T1757 PolarHBondContact O-N 3.38Å; G1754-D1758 PolarHBondContact O-N 3.06Å; G1754-F1759 WeakPolarHBondContact CA-O 3.43Å
1755R52.6Low51Low143 Ų14389.2 Ų89.254%0.5446%0.459SS..THydrogen-bonded Turntrans-72.2-16172.8-66.1176.5-161.6-160.49.9113.7D1751 L1753D1751-R1755 WeakPolarHBondContact O-CG 3.34Å; D1751-R1755 PolarHBondContact O-N 3.24Å; D1751-R1755 IonicContact OD1-CZ 3.47Å; D1751-R1755 IonicContact OD1-NE 3.9Å; D1751-R1755 PolarHBondContact OD1-NE 2.67Å; D1751-R1755 IonicContact OD1-NH2 2.89Å; D1751-R1755 PolarHBondContact OD1-NH2 2.88Å; D1751-R1755 IonicContact OD2-CZ 2.76Å; D1751-R1755 IonicContact OD2-NE 3.61Å; D1751-R1755 PolarHBondContact OD2-NE 3.16Å; D1751-R1755 IonicContact OD2-NH2 3.36Å; D1751-R1755 PolarHBondContact OD2-NH2 3.46Å; L1753-R1755 VanDerWaalsContact C-N 3.32Å; L1753-R1755 PolarHBondContact O-N 2.83Å
1756Q50.3Low49.5Very low139 Ų13988.3 Ų88.365%0.6545%0.449SS*.THydrogen-bonded Turntrans-96.3-18.2172.7-66.2-174.4-18.200111.9Q1752 L1753 G1754Q1752-Q1756 WeakPolarHBondContact O-CG 3.25Å; L1753-Q1756 CarbonylContact O-C 3.55Å; L1753-Q1756 WeakPolarHBondContact O-CA 3.45Å; L1753-Q1756 WeakPolarHBondContact O-CB 3.19Å; L1753-Q1756 PolarHBondContact O-N 2.71Å; G1754-Q1756 PolarHBondContact O-N 2.89Å
1757T39.5Very low47.8Very low90 Ų9083.2 Ų83.255%0.55243%0.427SS*.SBendtrans-153.6111.5179.153.60000108.7L1753 G1754 F1759L1753-T1757 PolarHBondContact O-N 2.62Å; L1753-T1757 PolarHBondContact O-OG1 3.07Å; G1754-T1757 CarbonylContact C-O 3.43Å; G1754-T1757 VanDerWaalsContact C-O 3.28Å; G1754-T1757 WeakPolarHBondContact CA-O 3.21Å; G1754-T1757 CarbonylContact O-C 3.2Å; G1754-T1757 PolarHBondContact O-N 3.38Å; T1757-F1759 VanDerWaalsContact C-N 3.33Å; T1757-F1759 PolarHBondContact O-N 3.36Å
1758D34.9Very low46.2Very low122 Ų12281.1 Ų81.165%0.65241%0.413SS*.SBendtrans-45.669.7-168.9-62-33.9000117.2G1754 Y1887G1754-D1758 PolarHBondContact O-N 3.06Å; D1758-Y1887 CarbonylContact C-O 3.12Å
1759F36.4Very low44.7Very low108 Ų10877.7 Ų77.747%0.47440%0.403SS..  trans-151.8123.7170.1-67.4-67000115.2R1750 G1754 T1757 Y1887R1750-F1759 PolarHBondContact NH1-O 2.88Å; G1754-F1759 WeakPolarHBondContact CA-O 3.43Å; T1757-F1759 VanDerWaalsContact C-N 3.33Å; T1757-F1759 PolarHBondContact O-N 3.36Å; F1759-Y1887 WeakPolarHBondContact CA-O 3.45Å; F1759-Y1887 WeakPolarHBondContact CA-OXT 3.07Å; F1759-Y1887 HydrophobicContact CE1-CD2 4.47Å; F1759-Y1887 PolarHBondContact N-O 2.87Å
1760D36.5Very low43.5Very low30 Ų3078 Ų7816%0.1641%0.414CS..  trans-123.4156.7-180-148.88.9000115.8R1750 I1885 P1886 Y1887R1750-D1760 IonicContact CZ-OD1 3.78Å; R1750-D1760 VanDerWaalsContact NH1-C 3.28Å; R1750-D1760 IonicContact NH1-OD1 3.88Å; R1750-D1760 IonicContact NH2-OD1 3.14Å; R1750-D1760 PolarHBondContact NH2-OD1 3.15Å; D1760-I1885 HydrophobicContact CB-CG2 3.96Å; D1760-I1885 WeakPolarHBondContact OD2-CG2 3.29Å; D1760-P1886 WeakPolarHBondContact CB-O 3.4Å; D1760-Y1887 PolarHBondContact N-OXT 3.08Å
1761F39.4Very low42.7Very low57 Ų5777 Ų7725%0.2543%0.431CS..  trans-161.3127.3-175.5-69.5-129.5000108.6R1750 K1780R1750-F1761 VanDerWaalsContact CZ-CD2 3.45Å; R1750-F1761 VanDerWaalsContact NE-CB 3.28Å; R1750-F1761 VanDerWaalsContact NH1-CD2 3.35Å; R1750-F1761 PolarHBondContact NH2-O 3.3Å; F1761-K1780 HydrophobicContact CD1-CB 4.48Å; F1761-K1780 HydrophobicContact CD1-CD 3.62Å; F1761-K1780 HydrophobicContact CD1-CG 4.25Å; F1761-K1780 HydrophobicContact CE1-CB 3.85Å; F1761-K1780 HydrophobicContact CE1-CD 3.13Å; F1761-K1780 HydrophobicContact CE1-CG 3.39Å; F1761-K1780 HydrophobicContact CG-CD 4.5Å; F1761-K1780 HydrophobicContact CZ-CD 3.62Å; F1761-K1780 HydrophobicContact CZ-CG 3.91Å
1762G39.2Very low42.2Very low55 Ų5578 Ų7857%0.56744%0.436SS*.  trans-144.690.4164.200000112.7
1763F44.6Very low41.7Very low90 Ų9079.4 Ų79.440%0.39545%0.446SS..  trans-148.7136.9175.5-67.7-72.1000113.4Y1875 Q1879F1763-Y1875 HydrophobicContact CD2-CE1 4.02Å; F1763-Y1875 AromaticContact CE1-CE1 3.95Å; F1763-Y1875 HydrophobicContact CE1-CE1 3.95Å; F1763-Y1875 AromaticContact CE1-CZ 3.76Å; F1763-Y1875 WeakPolarHBondContact CE1-OH 3.2Å; F1763-Y1875 HydrophobicContact CE2-CD1 4.24Å; F1763-Y1875 AromaticContact CE2-CE1 3.29Å; F1763-Y1875 HydrophobicContact CE2-CE1 3.29Å; F1763-Y1875 AromaticContact CE2-CZ 3.99Å; F1763-Y1875 AromaticContact CZ-CE1 3.27Å; F1763-Y1875 HydrophobicContact CZ-CE1 3.27Å; F1763-Y1875 AromaticContact CZ-CZ 3.5Å; F1763-Y1875 WeakPolarHBondContact CZ-OH 3.26Å; F1763-Q1879 HydrophobicContact CZ-CG 4.23Å
1764M36.8Very low41.4Very low130 Ų13078.2 Ų78.264%0.6445%0.454SS*.SBendtrans-153.6-22.3156.7-158.6170.7-81.400114.3M1710M1710-M1764 HydrophobicContact SD-CE 4.42Å; M1710-M1764 HydrophobicContact SD-SD 4.04Å
1765F37.6Very low41.3Very low91 Ų9182 Ų8240%0.39947%0.467SS..SBendtrans-137.9102-179.1-65.5-81.7000113.9A1706 S1767A1706-F1765 HydrophobicContact CB-CD2 4.21Å; A1706-F1765 HydrophobicContact CB-CE2 3.26Å; A1706-F1765 HydrophobicContact CB-CZ 3.63Å; F1765-S1767 PolarHBondContact O-N 3.4Å; F1765-S1767 PolarHBondContact O-OG 2.87Å
1766E46.1Very low41Very low51 Ų5178.1 Ų78.124%0.23846%0.455CS..SBendtrans35.725.1161.3-69.3-165.5167.300119.6S1768 R1835E1766-S1768 PolarHBondContact O-N 3.38Å; E1766-R1835 PolarHBondContact O-NH1 3.41Å; E1766-R1835 VanDerWaalsContact O-NH1 3.14Å; E1766-R1835 PolarHBondContact O-NH2 3.01Å
1767S37.1Very low41.1Very low73 Ų7372.6 Ų72.651%0.5143%0.431SS..  trans-104.653.8178.8-53.20000110.1F1765F1765-S1767 PolarHBondContact O-N 3.4Å; F1765-S1767 PolarHBondContact O-OG 2.87Å
1768S39.3Very low42.3Very low20 Ų2072.9 Ų72.914%0.1443%0.43CS..  trans-79.6122.2168.3-32.80000107.8E1766 E1776E1766-S1768 PolarHBondContact O-N 3.38Å; S1768-E1776 PolarHBondContact OG-OE2 3.33Å
1769P33.4Very low43.9Very low51 Ų5170 Ų7033%0.33141%0.412SS..THydrogen-bonded Turntrans-64.7138.5175.727.2-30.7000109.9Y1875 Q1879P1769-Y1875 WeakPolarHBondContact CD-OH 3.37Å; P1769-Q1879 VanDerWaalsContact CD-NE2 3.27Å; P1769-Q1879 VanDerWaalsContact CG-NE2 3.32Å
1770G37.6Very low45.4Very low59 Ų5967.4 Ų67.461%0.60840%0.4SS*.THydrogen-bonded Turntrans100.19.5-175.400000116.4
1771G39.3Very low47.2Very low64 Ų6466.3 Ų66.366%0.6639%0.394SS*.THydrogen-bonded Turntrans78.442.8167.200000115.6
1772N44.1Very low48.7Very low71 Ų7164.2 Ų64.238%0.3839%0.386SS..  trans58.456.4173.8-87.98.7000114.5G1774N1772-G1774 PolarHBondContact O-N 3.35Å
1773L45.4Very low50.4Low132 Ų13263.4 Ų63.469%0.69138%0.379SS*.  trans-63.80.1166.3-75.1161.1000113.7F1775L1773-F1775 VanDerWaalsContact C-N 3.27Å; L1773-F1775 HydrophobicContact CB-CD2 3.37Å; L1773-F1775 HydrophobicContact CB-CE2 3.42Å; L1773-F1775 VanDerWaalsContact CB-CE2 3.42Å; L1773-F1775 HydrophobicContact CB-CG 4.5Å; L1773-F1775 HydrophobicContact CD1-CD2 4.24Å; L1773-F1775 HydrophobicContact CD1-CE2 3.73Å; L1773-F1775 HydrophobicContact CG-CD2 4.4Å; L1773-F1775 HydrophobicContact CG-CE2 4.07Å; L1773-F1775 PolarHBondContact O-N 2.95Å
1774G48.7Very low51.8Low57 Ų5763.6 Ų63.659%0.58838%0.38SS*.SBendtrans68.322.7176.200000114.2N1772N1772-G1774 PolarHBondContact O-N 3.35Å
1775F48.8Very low53.9Low89 Ų8961.4 Ų61.439%0.3937%0.37SS..  trans-71.5-32.6-178.3-79.5-70.2000113.1L1773 R1871L1773-F1775 VanDerWaalsContact C-N 3.27Å; L1773-F1775 HydrophobicContact CB-CD2 3.37Å; L1773-F1775 HydrophobicContact CB-CE2 3.42Å; L1773-F1775 VanDerWaalsContact CB-CE2 3.42Å; L1773-F1775 HydrophobicContact CB-CG 4.5Å; L1773-F1775 HydrophobicContact CD1-CD2 4.24Å; L1773-F1775 HydrophobicContact CD1-CE2 3.73Å; L1773-F1775 HydrophobicContact CG-CD2 4.4Å; L1773-F1775 HydrophobicContact CG-CE2 4.07Å; L1773-F1775 PolarHBondContact O-N 2.95Å; F1775-R1871 WeakPolarHBondContact O-CB 3.33Å; F1775-R1871 WeakPolarHBondContact O-CD 3.35Å
1776E46.7Very low56.2Low61 Ų6157.2 Ų57.229%0.28535%0.352SS..SBendtrans-74.3141-172.3-71.2174.3127.600113.3S1768 Y1875S1768-E1776 PolarHBondContact OG-OE2 3.33Å; E1776-Y1875 HydrophobicContact CG-CD1 4.3Å; E1776-Y1875 HydrophobicContact CG-CD2 3.64Å; E1776-Y1875 HydrophobicContact CG-CE2 3.91Å; E1776-Y1875 HydrophobicContact CG-CG 3.83Å; E1776-Y1875 WeakPolarHBondContact OE1-CD1 3.44Å; E1776-Y1875 WeakPolarHBondContact OE1-CE1 3.29Å; E1776-Y1875 WeakPolarHBondContact OE1-CE2 3.21Å; E1776-Y1875 PolarHBondContact OE1-OH 3.48Å
1777P52.1Low57.9Low23 Ų2357.9 Ų57.915%0.14937%0.366CS..  trans-67.1157.8166.527.3-30.4000111.6F1779 N1869 S1872P1777-F1779 VanDerWaalsContact C-N 3.25Å; P1777-F1779 PolarHBondContact O-N 2.98Å; P1777-N1869 HydrophobicContact CB-CB 4.32Å; P1777-N1869 HydrophobicContact CG-CB 4.27Å; P1777-S1872 WeakPolarHBondContact CG-OG 3.29Å
1778D63.6Low60.1Low97 Ų9761.3 Ų61.352%0.51938%0.377SS..SBendtrans-55.9-35.9-175.2-64.9-61000114I1862D1778-I1862 HydrophobicContact CB-CG2 3.6Å
1779F69.7Low62.5Low62 Ų6261.7 Ų61.727%0.27238%0.377SS..SBendtrans-148.4159.9164.872.8-82.9000110.5P1777 L1781 F1801 M1859 I1862 V1863 C1866P1777-F1779 VanDerWaalsContact C-N 3.25Å; P1777-F1779 PolarHBondContact O-N 2.98Å; F1779-L1781 HydrophobicContact CD2-CG 4.17Å; F1779-L1781 HydrophobicContact CE2-CD1 3.79Å; F1779-L1781 HydrophobicContact CE2-CD2 3.77Å; F1779-L1781 HydrophobicContact CE2-CG 3.45Å; F1779-L1781 VanDerWaalsContact CE2-CG 3.45Å; F1779-L1781 HydrophobicContact CZ-CD1 3.9Å; F1779-L1781 HydrophobicContact CZ-CG 4.09Å; F1779-F1801 HydrophobicContact CE2-CZ 4.19Å; F1779-F1801 HydrophobicContact CZ-CZ 4.47Å; F1779-M1859 HydrophobicContact CE1-CE 4.41Å; F1779-I1862 HydrophobicContact CD1-CG2 3.89Å; F1779-I1862 HydrophobicContact CE1-CG2 3.81Å; F1779-V1863 HydrophobicContact CE1-CG2 4.09Å; F1779-V1863 HydrophobicContact CZ-CB 4.27Å; F1779-V1863 HydrophobicContact CZ-CG1 4.35Å; F1779-V1863 HydrophobicContact CZ-CG2 3.9Å; F1779-C1866 HydrophobicContact CD1-CB 4.16Å; F1779-C1866 WeakPolarHBondContact CD1-SG 3.28Å; F1779-C1866 HydrophobicContact CE1-CB 3.95Å; F1779-C1866 HydrophobicContact CE2-CB 4.36Å; F1779-C1866 HydrophobicContact CG-CB 4.45Å; F1779-C1866 HydrophobicContact CZ-CB 4.04Å; F1779-C1866 PolarHBondContact N-SG 3.15Å; F1779-C1866 VanDerWaalsContact N-SG 3.44Å; F1779-C1866 VanDerWaalsContact O-CB 3.25Å; F1779-C1866 WeakPolarHBondContact O-CB 3.37Å; F1779-C1866 PolarHBondContact O-SG 2.67Å
1780K67.7Low65.1Low52 Ų5261.5 Ų61.523%0.22638%0.384CS..  trans-98120.1-175.8-170.6164.7167.4-169.80111.1F1761 D1876F1761-K1780 HydrophobicContact CD1-CB 4.48Å; F1761-K1780 HydrophobicContact CD1-CD 3.62Å; F1761-K1780 HydrophobicContact CD1-CG 4.25Å; F1761-K1780 HydrophobicContact CE1-CB 3.85Å; F1761-K1780 HydrophobicContact CE1-CD 3.13Å; F1761-K1780 HydrophobicContact CE1-CG 3.39Å; F1761-K1780 HydrophobicContact CG-CD 4.5Å; F1761-K1780 HydrophobicContact CZ-CD 3.62Å; F1761-K1780 HydrophobicContact CZ-CG 3.91Å; K1780-D1876 IonicContact NZ-OD1 2.7Å; K1780-D1876 PolarHBondContact NZ-OD1 3.14Å; K1780-D1876 IonicContact NZ-OD2 3.39Å; K1780-D1876 PolarHBondContact NZ-OD2 2.73Å
1781L74.8Confident67.4Low8 Ų860.4 Ų60.44%0.04237%0.373CS..BIsolated β-bridgetrans-103.1101.8167.2-77.3169.6000109.1F1779 V1786 M1789 F1798 F1801 V1863 C1866F1779-L1781 HydrophobicContact CD2-CG 4.17Å; F1779-L1781 HydrophobicContact CE2-CD1 3.79Å; F1779-L1781 HydrophobicContact CE2-CD2 3.77Å; F1779-L1781 HydrophobicContact CE2-CG 3.45Å; F1779-L1781 VanDerWaalsContact CE2-CG 3.45Å; F1779-L1781 HydrophobicContact CZ-CD1 3.9Å; F1779-L1781 HydrophobicContact CZ-CG 4.09Å; L1781-V1786 HydrophobicContact CB-CG2 4.38Å; L1781-M1789 HydrophobicContact CD2-CE 4.02Å; L1781-F1798 HydrophobicContact CD1-CZ 4.23Å; L1781-F1801 HydrophobicContact CD1-CE1 4.31Å; L1781-F1801 HydrophobicContact CD2-CE1 3.9Å; L1781-F1801 HydrophobicContact CD2-CZ 3.84Å; L1781-V1863 HydrophobicContact CD1-CG1 4.12Å; L1781-C1866 HydrophobicContact CD1-CB 4.07Å; L1781-C1866 HydrophobicContact CG-CB 4.38Å
1782S71.1Confident69.7Low12 Ų1264.2 Ų64.28%0.08437%0.371CS..  trans-69.9160.8-177.594.50000112.2E1784 M1785 V1786S1782-E1784 WeakPolarHBondContact CB-OE2 3.26Å; S1782-E1784 PolarHBondContact O-N 2.94Å; S1782-E1784 PolarHBondContact OG-N 2.99Å; S1782-E1784 PolarHBondContact OG-OE2 3.18Å; S1782-M1785 PolarHBondContact O-N 3.08Å; S1782-M1785 WeakPolarHBondContact OG-CG 3.41Å; S1782-M1785 PolarHBondContact OG-N 3.44Å; S1782-V1786 WeakPolarHBondContact O-CG2 3.29Å; S1782-V1786 PolarHBondContact O-N 3.36Å
1783G74.2Confident71.7Confident39 Ų3962.8 Ų62.840%0.40236%0.363SS..Hα-helixtrans-58.8-37.6174.300000112V1786 A1787G1783-V1786 PolarHBondContact O-N 3.25Å; G1783-A1787 VanDerWaalsContact O-CB 3.29Å; G1783-A1787 WeakPolarHBondContact O-CB 3.43Å; G1783-A1787 PolarHBondContact O-N 2.88Å
1784E73.1Confident73.7Confident93 Ų9362.3 Ų62.344%0.43536%0.357SS..Hα-helixtrans-69.3-44.1178.2-52.671.7-151.600111.5S1782 V1786 A1787 I1788S1782-E1784 WeakPolarHBondContact CB-OE2 3.26Å; S1782-E1784 PolarHBondContact O-N 2.94Å; S1782-E1784 PolarHBondContact OG-N 2.99Å; S1782-E1784 PolarHBondContact OG-OE2 3.18Å; E1784-V1786 VanDerWaalsContact C-N 3.3Å; E1784-V1786 PolarHBondContact O-N 3.1Å; E1784-A1787 PolarHBondContact O-N 3.29Å; E1784-I1788 VanDerWaalsContact O-CG1 3.29Å; E1784-I1788 WeakPolarHBondContact O-CG1 3.34Å; E1784-I1788 PolarHBondContact O-N 3.08Å
1785M82.4Confident75.7Confident84 Ų8460.4 Ų60.441%0.41434%0.335SS..Hα-helixtrans-58.5-46.2174.3-70.3175.5179.600110.5S1782 I1788 M1789S1782-M1785 PolarHBondContact O-N 3.08Å; S1782-M1785 WeakPolarHBondContact OG-CG 3.41Å; S1782-M1785 PolarHBondContact OG-N 3.44Å; M1785-I1788 PolarHBondContact O-N 3.19Å; M1785-M1789 HydrophobicContact CB-CE 4.11Å; M1785-M1789 WeakPolarHBondContact O-CB 3.5Å; M1785-M1789 WeakPolarHBondContact O-CE 3.42Å; M1785-M1789 WeakPolarHBondContact O-CG 3.38Å; M1785-M1789 PolarHBondContact O-N 2.96Å
1786V84.6Confident77.6Confident4 Ų461.2 Ų61.22%0.02435%0.349CS..Hα-helixtrans-62.6-43.7176.4170.10000110.8L1781 S1782 G1783 E1784 M1789 G1790 G1791 F1798 F1867 L1868L1781-V1786 HydrophobicContact CB-CG2 4.38Å; S1782-V1786 WeakPolarHBondContact O-CG2 3.29Å; S1782-V1786 PolarHBondContact O-N 3.36Å; G1783-V1786 PolarHBondContact O-N 3.25Å; E1784-V1786 VanDerWaalsContact C-N 3.3Å; E1784-V1786 PolarHBondContact O-N 3.1Å; V1786-M1789 CarbonylContact O-C 3.6Å; V1786-M1789 PolarHBondContact O-N 3.36Å; V1786-G1790 PolarHBondContact O-N 3.1Å; V1786-G1791 WeakPolarHBondContact O-CA 3.45Å; V1786-G1791 PolarHBondContact O-N 3.33Å; V1786-F1798 HydrophobicContact CG2-CE2 4.29Å; V1786-F1867 HydrophobicContact CB-CE2 4.24Å; V1786-F1867 HydrophobicContact CG1-CD2 4.37Å; V1786-F1867 HydrophobicContact CG1-CE2 3.43Å; V1786-F1867 VanDerWaalsContact CG1-CE2 3.43Å; V1786-F1867 HydrophobicContact CG1-CZ 3.82Å; V1786-F1867 HydrophobicContact CG2-CD2 3.83Å; V1786-F1867 HydrophobicContact CG2-CE2 3.71Å; V1786-L1868 HydrophobicContact CB-CD2 4.29Å; V1786-L1868 HydrophobicContact CG1-CD2 4.5Å; V1786-L1868 HydrophobicContact CG2-CD2 4.09Å; V1786-L1868 HydrophobicContact CG2-CG 4.36Å
1787A82.5Confident79.6Confident64 Ų6461.3 Ų61.353%0.52936%0.356SS..Hα-helixtrans-62.1-44.7178.500000112.5G1783 E1784 M1789 G1790G1783-A1787 VanDerWaalsContact O-CB 3.29Å; G1783-A1787 WeakPolarHBondContact O-CB 3.43Å; G1783-A1787 PolarHBondContact O-N 2.88Å; E1784-A1787 PolarHBondContact O-N 3.29Å; A1787-M1789 PolarHBondContact O-N 3.42Å; A1787-G1790 PolarHBondContact O-N 2.92Å
1788I83.1Confident81.5Confident146 Ų14660.2 Ų60.275%0.74935%0.349SS*.Hα-helixtrans-60.7-36.9175-69.6166.5000110.7E1784 M1785 G1790E1784-I1788 VanDerWaalsContact O-CG1 3.29Å; E1784-I1788 WeakPolarHBondContact O-CG1 3.34Å; E1784-I1788 PolarHBondContact O-N 3.08Å; M1785-I1788 PolarHBondContact O-N 3.19Å; I1788-G1790 PolarHBondContact O-N 3.28Å
1789M90Very high82.8Confident27 Ų2759.3 Ų59.313%0.13334%0.339CS..THydrogen-bonded Turntrans-80.914.6174.7-66.5-175.5-77.700113.4L1781 M1785 V1786 A1787 S1795 F1798 F1801L1781-M1789 HydrophobicContact CD2-CE 4.02Å; M1785-M1789 HydrophobicContact CB-CE 4.11Å; M1785-M1789 WeakPolarHBondContact O-CB 3.5Å; M1785-M1789 WeakPolarHBondContact O-CE 3.42Å; M1785-M1789 WeakPolarHBondContact O-CG 3.38Å; M1785-M1789 PolarHBondContact O-N 2.96Å; V1786-M1789 CarbonylContact O-C 3.6Å; V1786-M1789 PolarHBondContact O-N 3.36Å; A1787-M1789 PolarHBondContact O-N 3.42Å; M1789-S1795 WeakPolarHBondContact O-CB 3.29Å; M1789-S1795 PolarHBondContact O-OG 3.25Å; M1789-F1798 HydrophobicContact CB-CB 4.22Å; M1789-F1798 HydrophobicContact CB-CD2 3.89Å; M1789-F1798 HydrophobicContact CE-CD2 3.99Å; M1789-F1798 HydrophobicContact CE-CE2 3.94Å; M1789-F1798 PolarHBondContact O-N 3.44Å; M1789-F1798 HydrophobicContact SD-CD2 4.06Å; M1789-F1798 HydrophobicContact SD-CE2 4.47Å; M1789-F1801 HydrophobicContact CE-CD1 4.3Å; M1789-F1801 HydrophobicContact CE-CE1 4.49Å; M1789-F1801 HydrophobicContact CE-CG 4.4Å; M1789-F1801 HydrophobicContact SD-CB 3.54Å; M1789-F1801 VanDerWaalsContact SD-CB 3.54Å; M1789-F1801 HydrophobicContact SD-CD1 3.81Å; M1789-F1801 HydrophobicContact SD-CD2 3.85Å; M1789-F1801 HydrophobicContact SD-CG 3.44Å; M1789-F1801 WeakPolarHBondContact SD-CG 3.28Å
1790G88.6Confident83.7Confident48 Ų4863 Ų6350%0.49535%0.351SS..THydrogen-bonded Turntrans95.19.1174.200000115.7V1786 A1787 I1788 K1792V1786-G1790 PolarHBondContact O-N 3.1Å; A1787-G1790 PolarHBondContact O-N 2.92Å; I1788-G1790 PolarHBondContact O-N 3.28Å; G1790-K1792 PolarHBondContact O-N 3.49Å
1791G84Confident84.7Confident35 Ų3562.9 Ų62.936%0.36135%0.35SS..SBendtrans77.3-18.5167.900000116.5V1786V1786-G1791 WeakPolarHBondContact O-CA 3.45Å; V1786-G1791 PolarHBondContact O-N 3.33Å
1792K88.8Confident85.5Confident145 Ų14562.9 Ų62.963%0.6335%0.35SS*.SBendtrans-133.2152.6-177.7-60-177-178.4178.60110.7G1790 E1794 S1795 F1798G1790-K1792 PolarHBondContact O-N 3.49Å; K1792-E1794 WeakPolarHBondContact CB-OE2 3.41Å; K1792-E1794 PolarHBondContact O-N 2.84Å; K1792-S1795 WeakPolarHBondContact O-CB 3.37Å; K1792-S1795 PolarHBondContact O-N 3.18Å; K1792-S1795 PolarHBondContact O-OG 2.78Å; K1792-S1795 VanDerWaalsContact O-OG 3.11Å; K1792-F1798 WeakPolarHBondContact O-CB 3.37Å
1793M85.5Confident86.4Confident40 Ų4062.8 Ų62.820%0.19735%0.349CS..THydrogen-bonded Turntrans-66.8-26.1-179.1-65.3-171.3125.600113.1S1795 F1798 R1864 F1867M1793-S1795 PolarHBondContact O-N 2.89Å; M1793-F1798 HydrophobicContact CB-CD1 4.02Å; M1793-F1798 HydrophobicContact CB-CE1 4.15Å; M1793-F1798 HydrophobicContact CE-CE1 3.86Å; M1793-F1798 HydrophobicContact CE-CZ 4.15Å; M1793-F1798 HydrophobicContact CG-CD1 4.13Å; M1793-F1798 HydrophobicContact CG-CE1 3.8Å; M1793-F1798 HydrophobicContact CG-CZ 4.36Å; M1793-R1864 HydrophobicContact CE-CB 4.26Å; M1793-R1864 HydrophobicContact CE-CG 3.86Å; M1793-F1867 HydrophobicContact CE-CB 3.45Å; M1793-F1867 VanDerWaalsContact CE-CB 3.45Å; M1793-F1867 HydrophobicContact CE-CD1 4.15Å; M1793-F1867 HydrophobicContact CE-CD2 3.89Å; M1793-F1867 HydrophobicContact CE-CG 3.57Å; M1793-F1867 HydrophobicContact CG-CD1 4.19Å; M1793-F1867 HydrophobicContact CG-CD2 3.87Å; M1793-F1867 HydrophobicContact CG-CE1 4.07Å; M1793-F1867 HydrophobicContact CG-CE2 3.7Å; M1793-F1867 HydrophobicContact CG-CG 4.1Å; M1793-F1867 HydrophobicContact CG-CZ 3.82Å; M1793-F1867 HydrophobicContact SD-CD1 4.23Å; M1793-F1867 HydrophobicContact SD-CG 4.2Å
1794E87.2Confident87.2Confident122 Ų12262.1 Ų62.157%0.5734%0.336SS*.THydrogen-bonded Turntrans-79.1-8.5-179.7-55.474.9-162.300113K1792 R1799K1792-E1794 WeakPolarHBondContact CB-OE2 3.41Å; K1792-E1794 PolarHBondContact O-N 2.84Å; E1794-R1799 PolarHBondContact O-NE 2.88Å
1795S91.4Very high88Confident17 Ų1759 Ų5912%0.11932%0.324CS..SBendtrans-62.1145.817977.80000110.4M1789 K1792 M1793 S1797 F1798 R1799M1789-S1795 WeakPolarHBondContact O-CB 3.29Å; M1789-S1795 PolarHBondContact O-OG 3.25Å; K1792-S1795 WeakPolarHBondContact O-CB 3.37Å; K1792-S1795 PolarHBondContact O-N 3.18Å; K1792-S1795 PolarHBondContact O-OG 2.78Å; K1792-S1795 VanDerWaalsContact O-OG 3.11Å; M1793-S1795 PolarHBondContact O-N 2.89Å; S1795-S1797 VanDerWaalsContact C-N 3.26Å; S1795-S1797 PolarHBondContact O-N 3.45Å; S1795-F1798 PolarHBondContact O-N 2.98Å; S1795-F1798 WeakPolarHBondContact OG-CB 3.05Å; S1795-F1798 PolarHBondContact OG-N 3.47Å; S1795-R1799 WeakPolarHBondContact O-CG 3.36Å; S1795-R1799 PolarHBondContact O-N 3.16Å
1796P88.7Confident88.4Confident107 Ų10755 Ų5570%0.69530%0.304SS*.Hα-helixtrans-55.9-41177-26.835000112.9R1799 W1800P1796-R1799 PolarHBondContact O-N 2.7Å; P1796-W1800 WeakPolarHBondContact O-CB 3.38Å; P1796-W1800 PolarHBondContact O-N 2.86Å
1797S89.7Confident88.8Confident63 Ų6357.1 Ų57.144%0.44131%0.312SS..Hα-helixtrans-67-40.1-179.9-50.60000112.7S1795 W1800 F1801S1795-S1797 VanDerWaalsContact C-N 3.26Å; S1795-S1797 PolarHBondContact O-N 3.45Å; S1797-W1800 PolarHBondContact O-N 3.21Å; S1797-F1801 PolarHBondContact O-N 2.82Å
1798F91.7Very high89.1Confident0 Ų055.6 Ų55.60%029%0.294CS..Hα-helixtrans-72.1-37.1177.3-163.2-85.4000111.4L1781 V1786 M1789 K1792 M1793 S1795 W1800 F1801 M1802 V1863 F1867L1781-F1798 HydrophobicContact CD1-CZ 4.23Å; V1786-F1798 HydrophobicContact CG2-CE2 4.29Å; M1789-F1798 HydrophobicContact CB-CB 4.22Å; M1789-F1798 HydrophobicContact CB-CD2 3.89Å; M1789-F1798 HydrophobicContact CE-CD2 3.99Å; M1789-F1798 HydrophobicContact CE-CE2 3.94Å; M1789-F1798 PolarHBondContact O-N 3.44Å; M1789-F1798 HydrophobicContact SD-CD2 4.06Å; M1789-F1798 HydrophobicContact SD-CE2 4.47Å; K1792-F1798 WeakPolarHBondContact O-CB 3.37Å; M1793-F1798 HydrophobicContact CB-CD1 4.02Å; M1793-F1798 HydrophobicContact CB-CE1 4.15Å; M1793-F1798 HydrophobicContact CE-CE1 3.86Å; M1793-F1798 HydrophobicContact CE-CZ 4.15Å; M1793-F1798 HydrophobicContact CG-CD1 4.13Å; M1793-F1798 HydrophobicContact CG-CE1 3.8Å; M1793-F1798 HydrophobicContact CG-CZ 4.36Å; S1795-F1798 PolarHBondContact O-N 2.98Å; S1795-F1798 WeakPolarHBondContact OG-CB 3.05Å; S1795-F1798 PolarHBondContact OG-N 3.47Å; F1798-W1800 VanDerWaalsContact C-N 3.33Å; F1798-W1800 PolarHBondContact O-N 3.06Å; F1798-F1801 HydrophobicContact CE2-CD1 4.34Å; F1798-F1801 HydrophobicContact CZ-CD1 4.39Å; F1798-F1801 WeakPolarHBondContact O-CB 3.2Å; F1798-F1801 PolarHBondContact O-N 3.01Å; F1798-M1802 HydrophobicContact CD1-CE 3.9Å; F1798-M1802 HydrophobicContact CD1-CG 3.99Å; F1798-M1802 HydrophobicContact CD1-SD 4.01Å; F1798-M1802 HydrophobicContact CE1-CE 4.22Å; F1798-M1802 HydrophobicContact CE1-CG 3.79Å; F1798-M1802 HydrophobicContact CE1-SD 3.73Å; F1798-M1802 WeakPolarHBondContact O-CG 3.46Å; F1798-M1802 PolarHBondContact O-N 2.65Å; F1798-V1863 HydrophobicContact CE1-CG1 4.36Å; F1798-V1863 HydrophobicContact CZ-CG1 4.25Å; F1798-F1867 HydrophobicContact CD2-CE2 4.46Å; F1798-F1867 HydrophobicContact CE1-CD2 4.29Å; F1798-F1867 AromaticContact CE2-CD2 3.74Å; F1798-F1867 HydrophobicContact CE2-CD2 3.74Å; F1798-F1867 AromaticContact CE2-CE2 3.89Å; F1798-F1867 HydrophobicContact CE2-CE2 3.89Å; F1798-F1867 AromaticContact CZ-CD2 3.5Å; F1798-F1867 HydrophobicContact CZ-CD2 3.5Å; F1798-F1867 VanDerWaalsContact CZ-CD2 3.5Å; F1798-F1867 AromaticContact CZ-CE2 3.97Å; F1798-F1867 HydrophobicContact CZ-CE2 3.97Å
1799R90Very high89.5Confident78 Ų7849.7 Ų49.729%0.29426%0.263SS..Hα-helixtrans-61.5-41.1171.5-71.8-178.1-175-171.11.4112Q1357 E1361 E1794 S1795 P1796 M1802 D1803Q1357-R1799 PolarHBondContact NE2-O 2.84Å; E1361-R1799 IonicContact OE1-NH1 3.57Å; E1361-R1799 PolarHBondContact OE1-NH1 2.76Å; E1361-R1799 VanDerWaalsContact OE1-NH1 3.11Å; E1794-R1799 PolarHBondContact O-NE 2.88Å; S1795-R1799 WeakPolarHBondContact O-CG 3.36Å; S1795-R1799 PolarHBondContact O-N 3.16Å; P1796-R1799 PolarHBondContact O-N 2.7Å; R1799-M1802 HydrophobicContact CB-CE 4.49Å; R1799-M1802 HydrophobicContact CG-CE 4.12Å; R1799-M1802 PolarHBondContact O-N 3.34Å; R1799-D1803 PolarHBondContact O-N 3.37Å
1800W88.9Confident89.7Confident138 Ų13848.6 Ų48.652%0.52326%0.257SS..Hα-helixtrans-64.1-43.1175.5-178.952.8000111.8D1723 P1796 S1797 F1798 M1802 D1803 L1804D1723-W1800 HydrophobicContact CB-CZ2 4.5Å; D1723-W1800 WeakPolarHBondContact OD2-CZ2 3.35Å; P1796-W1800 WeakPolarHBondContact O-CB 3.38Å; P1796-W1800 PolarHBondContact O-N 2.86Å; S1797-W1800 PolarHBondContact O-N 3.21Å; F1798-W1800 VanDerWaalsContact C-N 3.33Å; F1798-W1800 PolarHBondContact O-N 3.06Å; W1800-M1802 VanDerWaalsContact C-N 3.35Å; W1800-M1802 PolarHBondContact O-N 2.93Å; W1800-D1803 PolarHBondContact O-N 2.89Å; W1800-L1804 HydrophobicContact CD2-CD1 4.06Å; W1800-L1804 HydrophobicContact CE3-CD1 4.49Å; W1800-L1804 HydrophobicContact CH2-CD1 4.26Å; W1800-L1804 HydrophobicContact CZ2-CD1 3.8Å; W1800-L1804 WeakPolarHBondContact O-CG 3.35Å; W1800-L1804 PolarHBondContact O-N 2.84Å
1801F89.3Confident89.8Confident50 Ų5046.5 Ų46.522%0.21924%0.235CC..Hα-helixtrans-57-44.8172.2167.2-102.3000112.6F1779 L1781 M1789 S1797 F1798 L1804 C1805 V1863F1779-F1801 HydrophobicContact CE2-CZ 4.19Å; F1779-F1801 HydrophobicContact CZ-CZ 4.47Å; L1781-F1801 HydrophobicContact CD1-CE1 4.31Å; L1781-F1801 HydrophobicContact CD2-CE1 3.9Å; L1781-F1801 HydrophobicContact CD2-CZ 3.84Å; M1789-F1801 HydrophobicContact CE-CD1 4.3Å; M1789-F1801 HydrophobicContact CE-CE1 4.49Å; M1789-F1801 HydrophobicContact CE-CG 4.4Å; M1789-F1801 HydrophobicContact SD-CB 3.54Å; M1789-F1801 VanDerWaalsContact SD-CB 3.54Å; M1789-F1801 HydrophobicContact SD-CD1 3.81Å; M1789-F1801 HydrophobicContact SD-CD2 3.85Å; M1789-F1801 HydrophobicContact SD-CG 3.44Å; M1789-F1801 WeakPolarHBondContact SD-CG 3.28Å; S1797-F1801 PolarHBondContact O-N 2.82Å; F1798-F1801 HydrophobicContact CE2-CD1 4.34Å; F1798-F1801 HydrophobicContact CZ-CD1 4.39Å; F1798-F1801 WeakPolarHBondContact O-CB 3.2Å; F1798-F1801 PolarHBondContact O-N 3.01Å; F1801-L1804 PolarHBondContact O-N 3.46Å; F1801-C1805 WeakPolarHBondContact CE2-SG 2.93Å; F1801-C1805 WeakPolarHBondContact CZ-SG 3.13Å; F1801-C1805 PolarHBondContact O-N 3.2Å; F1801-C1805 PolarHBondContact O-SG 2.61Å; F1801-V1863 HydrophobicContact CE1-CG1 4.08Å
1802M91.5Very high90.1Very high9 Ų946.4 Ų46.44%0.04423%0.225CC..Hα-helixtrans-62.4-44175.7-72-168.7-6600112.2F1798 R1799 W1800 L1804 C1805 V1806 L1860 V1863F1798-M1802 HydrophobicContact CD1-CE 3.9Å; F1798-M1802 HydrophobicContact CD1-CG 3.99Å; F1798-M1802 HydrophobicContact CD1-SD 4.01Å; F1798-M1802 HydrophobicContact CE1-CE 4.22Å; F1798-M1802 HydrophobicContact CE1-CG 3.79Å; F1798-M1802 HydrophobicContact CE1-SD 3.73Å; F1798-M1802 WeakPolarHBondContact O-CG 3.46Å; F1798-M1802 PolarHBondContact O-N 2.65Å; R1799-M1802 HydrophobicContact CB-CE 4.49Å; R1799-M1802 HydrophobicContact CG-CE 4.12Å; R1799-M1802 PolarHBondContact O-N 3.34Å; W1800-M1802 VanDerWaalsContact C-N 3.35Å; W1800-M1802 PolarHBondContact O-N 2.93Å; M1802-L1804 VanDerWaalsContact C-N 3.35Å; M1802-L1804 PolarHBondContact O-N 3.12Å; M1802-C1805 PolarHBondContact O-N 3.05Å; M1802-V1806 WeakPolarHBondContact O-CG2 3.39Å; M1802-V1806 PolarHBondContact O-N 3Å; M1802-L1860 HydrophobicContact CB-CD2 4.03Å; M1802-L1860 HydrophobicContact CG-CD2 4.44Å; M1802-L1860 HydrophobicContact SD-CD2 4.21Å; M1802-V1863 HydrophobicContact CG-CG1 3.96Å; M1802-V1863 HydrophobicContact SD-CG1 4.42Å
1803D90Very high90.3Very high9 Ų939.8 Ų39.85%0.04820%0.197CC..Hα-helixtrans-59-45.4176-84.61.5000111.2P1356 Q1357 R1362 R1799 W1800 V1806 R1807P1356-D1803 VanDerWaalsContact CG-OD1 3.26Å; P1356-D1803 WeakPolarHBondContact CG-OD1 3.48Å; Q1357-D1803 PolarHBondContact NE2-OD1 2.9Å; R1362-D1803 IonicContact CZ-OD2 2.71Å; R1362-D1803 IonicContact NH1-OD2 3.99Å; R1362-D1803 PolarHBondContact NH1-OD2 2.78Å; R1362-D1803 IonicContact NH2-OD2 3.08Å; R1362-D1803 PolarHBondContact NH2-OD2 2.93Å; R1799-D1803 PolarHBondContact O-N 3.37Å; W1800-D1803 PolarHBondContact O-N 2.89Å; D1803-V1806 PolarHBondContact O-N 3.43Å; D1803-R1807 WeakPolarHBondContact O-CB 3.45Å; D1803-R1807 VanDerWaalsContact O-CG 3.26Å; D1803-R1807 WeakPolarHBondContact O-CG 3.32Å; D1803-R1807 PolarHBondContact O-N 2.59Å
1804L90Very high90.4Very high25 Ų2540.5 Ų40.513%0.13120%0.204CC..Hα-helixtrans-62.9-44.2177-71.7176.5000112.1L1722 W1800 F1801 M1802 V1806 R1807 M1808L1722-L1804 HydrophobicContact CD1-CD2 3.82Å; L1722-L1804 HydrophobicContact CG-CD2 3.97Å; W1800-L1804 HydrophobicContact CD2-CD1 4.06Å; W1800-L1804 HydrophobicContact CE3-CD1 4.49Å; W1800-L1804 HydrophobicContact CH2-CD1 4.26Å; W1800-L1804 HydrophobicContact CZ2-CD1 3.8Å; W1800-L1804 WeakPolarHBondContact O-CG 3.35Å; W1800-L1804 PolarHBondContact O-N 2.84Å; F1801-L1804 PolarHBondContact O-N 3.46Å; M1802-L1804 VanDerWaalsContact C-N 3.35Å; M1802-L1804 PolarHBondContact O-N 3.12Å; L1804-V1806 VanDerWaalsContact C-N 3.35Å; L1804-V1806 PolarHBondContact O-N 2.94Å; L1804-R1807 PolarHBondContact O-N 2.85Å; L1804-M1808 WeakPolarHBondContact O-CB 3.29Å; L1804-M1808 PolarHBondContact O-N 3.25Å
1805C89.4Confident90.6Very high27 Ų2736.6 Ų36.618%0.18219%0.186CC..Hα-helixtrans-59.4-45.7177.4-72.20000111.8F1801 M1802 Y1809 M1859 V1863F1801-C1805 WeakPolarHBondContact CE2-SG 2.93Å; F1801-C1805 WeakPolarHBondContact CZ-SG 3.13Å; F1801-C1805 PolarHBondContact O-N 3.2Å; F1801-C1805 PolarHBondContact O-SG 2.61Å; M1802-C1805 PolarHBondContact O-N 3.05Å; C1805-Y1809 VanDerWaalsContact O-CB 3.28Å; C1805-Y1809 WeakPolarHBondContact O-CB 3.35Å; C1805-Y1809 PolarHBondContact O-N 3.08Å; C1805-M1859 HydrophobicContact CB-CE 4.3Å; C1805-V1863 HydrophobicContact CB-CG2 4.31Å
1806V92.4Very high90.5Very high0 Ų038 Ų380%019%0.189CC..Hα-helixtrans-66.2-46.71791740000110.9P1356 M1802 D1803 L1804 M1808 Y1809 L1810 A1856 M1859 L1860P1356-V1806 HydrophobicContact CB-CB 4.1Å; P1356-V1806 HydrophobicContact CB-CG1 3.58Å; P1356-V1806 HydrophobicContact CB-CG2 4.37Å; P1356-V1806 HydrophobicContact CG-CG1 4.47Å; M1802-V1806 WeakPolarHBondContact O-CG2 3.39Å; M1802-V1806 PolarHBondContact O-N 3Å; D1803-V1806 PolarHBondContact O-N 3.43Å; L1804-V1806 VanDerWaalsContact C-N 3.35Å; L1804-V1806 PolarHBondContact O-N 2.94Å; V1806-M1808 PolarHBondContact O-N 3.07Å; V1806-Y1809 WeakPolarHBondContact O-CB 3.48Å; V1806-Y1809 PolarHBondContact O-N 3.49Å; V1806-L1810 HydrophobicContact CG1-CD1 3.93Å; V1806-L1810 HydrophobicContact CG1-CG 4.14Å; V1806-L1810 WeakPolarHBondContact O-CB 3.32Å; V1806-L1810 VanDerWaalsContact O-CG 3.31Å; V1806-L1810 WeakPolarHBondContact O-CG 3.35Å; V1806-L1810 PolarHBondContact O-N 2.9Å; V1806-A1856 HydrophobicContact CG1-CB 3.58Å; V1806-M1859 HydrophobicContact CG2-CB 4.33Å; V1806-M1859 HydrophobicContact CG2-CG 4.41Å; V1806-L1860 HydrophobicContact CG2-CD2 3.69Å; V1806-L1860 HydrophobicContact CG2-CG 3.71Å
1807R91.6Very high90.5Very high50 Ų5036.5 Ų36.519%0.18917%0.172CC..Hα-helixtrans-62.2-43.6179.7-73176.9-178.9-168.82.4112W1353 L1722 D1803 L1804 Y1809 L1810 A1811W1353-R1807 HydrophobicContact CE3-CB 4.27Å; W1353-R1807 HydrophobicContact CE3-CG 3.88Å; W1353-R1807 HydrophobicContact CZ3-CB 3.94Å; W1353-R1807 HydrophobicContact CZ3-CG 4.08Å; W1353-R1807 PolarHBondContact O-NE 2.7Å; W1353-R1807 PolarHBondContact O-NH2 3.41Å; L1722-R1807 HydrophobicContact CD1-CB 3.79Å; L1722-R1807 HydrophobicContact CD2-CB 4.32Å; D1803-R1807 WeakPolarHBondContact O-CB 3.45Å; D1803-R1807 VanDerWaalsContact O-CG 3.26Å; D1803-R1807 WeakPolarHBondContact O-CG 3.32Å; D1803-R1807 PolarHBondContact O-N 2.59Å; L1804-R1807 PolarHBondContact O-N 2.85Å; R1807-Y1809 VanDerWaalsContact C-N 3.34Å; R1807-Y1809 PolarHBondContact O-N 2.88Å; R1807-L1810 PolarHBondContact O-N 2.75Å; R1807-A1811 WeakPolarHBondContact O-CB 3.49Å; R1807-A1811 PolarHBondContact O-N 3.32Å
1808M89.5Confident90.5Very high32 Ų3234 Ų3416%0.15816%0.155CC..Hα-helixtrans-61.8-44.9175.5-172.1163.9-177.200111.1C1713 A1717 L1722 V1724 L1726 L1804 V1806 A1811 M1812C1713-M1808 HydrophobicContact CB-CE 4.1Å; A1717-M1808 HydrophobicContact CB-CE 4.35Å; L1722-M1808 HydrophobicContact CD2-CB 3.67Å; L1722-M1808 HydrophobicContact CD2-CG 4.37Å; V1724-M1808 HydrophobicContact CG1-SD 4.09Å; V1724-M1808 HydrophobicContact CG2-SD 4.29Å; L1726-M1808 HydrophobicContact CD1-CE 4.03Å; L1804-M1808 WeakPolarHBondContact O-CB 3.29Å; L1804-M1808 PolarHBondContact O-N 3.25Å; V1806-M1808 PolarHBondContact O-N 3.07Å; M1808-A1811 PolarHBondContact O-N 3.28Å; M1808-M1812 HydrophobicContact CE-SD 4.03Å; M1808-M1812 HydrophobicContact CG-SD 4.03Å; M1808-M1812 VanDerWaalsContact O-CG 3.28Å; M1808-M1812 WeakPolarHBondContact O-CG 3.39Å; M1808-M1812 PolarHBondContact O-N 3.22Å
1809Y92.2Very high90.4Very high22 Ų2234.2 Ų34.29%0.08616%0.156CC..Hα-helixtrans-59.6-49.6176.1178.3-117.4000111.7C1805 V1806 R1807 A1811 M1812 R1813 R1845 F1846 A1855 F1858 M1859C1805-Y1809 VanDerWaalsContact O-CB 3.28Å; C1805-Y1809 WeakPolarHBondContact O-CB 3.35Å; C1805-Y1809 PolarHBondContact O-N 3.08Å; V1806-Y1809 WeakPolarHBondContact O-CB 3.48Å; V1806-Y1809 PolarHBondContact O-N 3.49Å; R1807-Y1809 VanDerWaalsContact C-N 3.34Å; R1807-Y1809 PolarHBondContact O-N 2.88Å; Y1809-A1811 VanDerWaalsContact C-N 3.32Å; Y1809-A1811 PolarHBondContact O-N 2.73Å; Y1809-M1812 PolarHBondContact O-N 3.1Å; Y1809-R1813 HydrophobicContact CD2-CG 4.41Å; Y1809-R1813 HydrophobicContact CE1-CG 4.33Å; Y1809-R1813 HydrophobicContact CE2-CG 4.1Å; Y1809-R1813 VanDerWaalsContact O-CG 3.3Å; Y1809-R1813 WeakPolarHBondContact O-CG 3.41Å; Y1809-R1813 PolarHBondContact O-N 3.35Å; Y1809-R1813 VanDerWaalsContact O-N 3.09Å; Y1809-R1845 PolarHBondContact OH-O 2.72Å; Y1809-F1846 PolarHBondContact OH-O 3.26Å; Y1809-F1846 VanDerWaalsContact OH-O 3.07Å; Y1809-A1855 HydrophobicContact CE1-CB 3.88Å; Y1809-A1855 WeakPolarHBondContact CE1-O 3.32Å; Y1809-F1858 HydrophobicContact CE1-CD1 4.04Å; Y1809-F1858 AromaticContact CZ-CD1 3.86Å; Y1809-F1858 WeakPolarHBondContact OH-CD1 3.39Å; Y1809-F1858 WeakPolarHBondContact OH-CE1 3.16Å; Y1809-M1859 HydrophobicContact CD1-CB 3.59Å; Y1809-M1859 HydrophobicContact CD1-CG 4.04Å; Y1809-M1859 HydrophobicContact CD1-SD 4.42Å; Y1809-M1859 HydrophobicContact CD2-SD 4.24Å; Y1809-M1859 HydrophobicContact CE1-CB 4.04Å; Y1809-M1859 HydrophobicContact CG-CB 4.1Å; Y1809-M1859 HydrophobicContact CG-CG 4.02Å; Y1809-M1859 HydrophobicContact CG-SD 4.05Å
1810L92.8Very high90.4Very high4 Ų431.2 Ų31.22%0.02115%0.146CC..Hα-helixtrans-60.8-39.2177.7-68-179.3000112.4W1353 V1806 R1807 P1814 E1852 A1855W1353-L1810 HydrophobicContact CD2-CD1 4.31Å; W1353-L1810 HydrophobicContact CG-CD1 4.46Å; W1353-L1810 HydrophobicContact CH2-CB 4.01Å; W1353-L1810 HydrophobicContact CZ2-CB 3.56Å; W1353-L1810 HydrophobicContact CZ2-CD1 4.49Å; V1806-L1810 HydrophobicContact CG1-CD1 3.93Å; V1806-L1810 HydrophobicContact CG1-CG 4.14Å; V1806-L1810 WeakPolarHBondContact O-CB 3.32Å; V1806-L1810 VanDerWaalsContact O-CG 3.31Å; V1806-L1810 WeakPolarHBondContact O-CG 3.35Å; V1806-L1810 PolarHBondContact O-N 2.9Å; R1807-L1810 PolarHBondContact O-N 2.75Å; L1810-P1814 WeakPolarHBondContact O-CD 3.33Å; L1810-E1852 HydrophobicContact CD2-CB 4.1Å; L1810-E1852 HydrophobicContact CD2-CG 4.25Å; L1810-A1855 HydrophobicContact CD2-CB 3.96Å
1811A91.6Very high90.4Very high3 Ų327 Ų273%0.02513%0.13CC..Hα-helixtrans-65.1-37.2176.600000112.9W1353 V1716 I1720 R1807 M1808 Y1809 P1814W1353-A1811 HydrophobicContact CH2-CB 4Å; V1716-A1811 HydrophobicContact CG1-CB 3.88Å; V1716-A1811 WeakPolarHBondContact CG1-O 3.45Å; I1720-A1811 HydrophobicContact CD1-CB 3.54Å; I1720-A1811 HydrophobicContact CG1-CB 4.49Å; R1807-A1811 WeakPolarHBondContact O-CB 3.49Å; R1807-A1811 PolarHBondContact O-N 3.32Å; M1808-A1811 PolarHBondContact O-N 3.28Å; Y1809-A1811 VanDerWaalsContact C-N 3.32Å; Y1809-A1811 PolarHBondContact O-N 2.73Å; A1811-P1814 WeakPolarHBondContact O-CD 3.48Å
1812M90.5Very high90.4Very high33 Ų3324.7 Ų24.716%0.16312%0.12CC..Hα-helixtrans-76.9-29.7-179.3-71.7176.754.800113.2C1713 V1716 M1808 Y1809 H1815 F1846C1713-M1812 HydrophobicContact CB-CE 4.04Å; C1713-M1812 HydrophobicContact CB-SD 4.01Å; C1713-M1812 WeakPolarHBondContact SG-CE 3.5Å; V1716-M1812 HydrophobicContact CG1-CG 4.32Å; M1808-M1812 HydrophobicContact CE-SD 4.03Å; M1808-M1812 HydrophobicContact CG-SD 4.03Å; M1808-M1812 VanDerWaalsContact O-CG 3.28Å; M1808-M1812 WeakPolarHBondContact O-CG 3.39Å; M1808-M1812 PolarHBondContact O-N 3.22Å; Y1809-M1812 PolarHBondContact O-N 3.1Å; M1812-H1815 PolarHBondContact O-N 3.13Å; M1812-F1846 HydrophobicContact CB-CE1 4.2Å; M1812-F1846 HydrophobicContact CE-CE1 4.21Å; M1812-F1846 HydrophobicContact CE-CZ 4.35Å
1813R91.9Very high90.2Very high6 Ų625.2 Ų25.22%0.02312%0.122CC..G310 helixtrans-54.9-42.2-174.4-81179.878.5-139.4-2.7114.9Y1809 H1815 W1816 F1846 A1847 P1848 K1850 S1851Y1809-R1813 HydrophobicContact CD2-CG 4.41Å; Y1809-R1813 HydrophobicContact CE1-CG 4.33Å; Y1809-R1813 HydrophobicContact CE2-CG 4.1Å; Y1809-R1813 VanDerWaalsContact O-CG 3.3Å; Y1809-R1813 WeakPolarHBondContact O-CG 3.41Å; Y1809-R1813 PolarHBondContact O-N 3.35Å; Y1809-R1813 VanDerWaalsContact O-N 3.09Å; R1813-H1815 PolarHBondContact O-N 3.09Å; R1813-H1815 VanDerWaalsContact O-N 3.14Å; R1813-W1816 WeakPolarHBondContact O-CB 3.49Å; R1813-W1816 PolarHBondContact O-N 3.46Å; R1813-F1846 HydrophobicContact CG-CD1 4.38Å; R1813-F1846 PolarHBondContact NE-O 2.87Å; R1813-A1847 PolarHBondContact NH2-O 3.4Å; R1813-P1848 PolarHBondContact NH2-O 2.92Å; R1813-K1850 PolarHBondContact NH1-O 3.13Å; R1813-K1850 PolarHBondContact NH2-O 3.09Å; R1813-S1851 PolarHBondContact NH1-O 3.31Å
1814P89.1Confident90.1Very high55 Ų5526.2 Ų26.236%0.35713%0.13SC..G310 helixtrans-56.3-26175.6-28.135.5000114.4L1810 A1811L1810-P1814 WeakPolarHBondContact O-CD 3.33Å; A1811-P1814 WeakPolarHBondContact O-CD 3.48Å
1815H90.2Very high90Very high40 Ų4025 Ų2519%0.18512%0.124CC..G310 helixtrans-94.25.4-176.1-58.4-79.2000113.7L1062 M1812 R1813 E1817 S1818 F1819L1062-H1815 HydrophobicContact CD1-CB 4.28Å; M1812-H1815 PolarHBondContact O-N 3.13Å; R1813-H1815 PolarHBondContact O-N 3.09Å; R1813-H1815 VanDerWaalsContact O-N 3.14Å; H1815-E1817 VanDerWaalsContact C-N 3.3Å; H1815-E1817 PolarHBondContact O-N 3.08Å; H1815-S1818 WeakPolarHBondContact O-CB 2.96Å; H1815-S1818 PolarHBondContact O-N 2.57Å; H1815-F1819 HydrophobicContact CB-CD2 4.15Å; H1815-F1819 HydrophobicContact CB-CE2 3.75Å; H1815-F1819 WeakPolarHBondContact O-CD2 3.45Å; H1815-F1819 PolarHBondContact O-N 3.35Å
1816W89.7Confident90Very high47 Ų4724 Ų2418%0.17812%0.116CC..Hα-helixtrans-52.7-42.4-174.774.7-75.4000113.3R1813 S1818 F1819 L1820 R1843 F1846 P1848R1813-W1816 WeakPolarHBondContact O-CB 3.49Å; R1813-W1816 PolarHBondContact O-N 3.46Å; W1816-S1818 VanDerWaalsContact C-N 3.32Å; W1816-S1818 PolarHBondContact O-N 3.01Å; W1816-F1819 PolarHBondContact O-N 3.25Å; W1816-L1820 HydrophobicContact CE3-CD1 3.67Å; W1816-L1820 HydrophobicContact CE3-CD2 4.43Å; W1816-L1820 HydrophobicContact CZ3-CD1 4.19Å; W1816-L1820 HydrophobicContact CZ3-CD2 4.13Å; W1816-L1820 WeakPolarHBondContact O-CD1 3.45Å; W1816-L1820 PolarHBondContact O-N 2.63Å; W1816-R1843 HydrophobicContact CE3-CG 4.11Å; W1816-R1843 HydrophobicContact CZ3-CB 4.47Å; W1816-R1843 HydrophobicContact CZ3-CG 3.74Å; W1816-F1846 HydrophobicContact CB-CB 3.81Å; W1816-F1846 HydrophobicContact CB-CD1 3.85Å; W1816-F1846 HydrophobicContact CB-CD2 3.83Å; W1816-F1846 HydrophobicContact CB-CE1 4.35Å; W1816-F1846 HydrophobicContact CB-CE2 4.34Å; W1816-F1846 HydrophobicContact CB-CG 3.56Å; W1816-P1848 HydrophobicContact CD2-CB 3.81Å; W1816-P1848 HydrophobicContact CD2-CG 4.21Å; W1816-P1848 HydrophobicContact CE3-CB 4.34Å; W1816-P1848 HydrophobicContact CE3-CG 4.23Å; W1816-P1848 HydrophobicContact CG-CB 4.2Å; W1816-P1848 HydrophobicContact CH2-CG 4.5Å; W1816-P1848 HydrophobicContact CZ2-CB 4.06Å; W1816-P1848 HydrophobicContact CZ2-CG 4.4Å; W1816-P1848 HydrophobicContact CZ3-CG 4.4Å
1817E88.7Confident89.7Confident75 Ų7526.9 Ų26.935%0.3513%0.132SC..Hα-helixtrans-61.5-40.8178.1-64.3-173.3156.700112H1815 F1819 L1820 W1821H1815-E1817 VanDerWaalsContact C-N 3.3Å; H1815-E1817 PolarHBondContact O-N 3.08Å; E1817-F1819 PolarHBondContact O-N 2.92Å; E1817-L1820 PolarHBondContact O-N 2.63Å; E1817-W1821 HydrophobicContact CB-CD2 4.37Å; E1817-W1821 HydrophobicContact CB-CE3 4.44Å; E1817-W1821 HydrophobicContact CB-CH2 3.79Å; E1817-W1821 HydrophobicContact CB-CZ2 3.73Å; E1817-W1821 HydrophobicContact CB-CZ3 4.14Å; E1817-W1821 HydrophobicContact CG-CZ2 4.48Å; E1817-W1821 VanDerWaalsContact O-CD2 3.23Å; E1817-W1821 PolarHBondContact O-N 2.9Å
1818S89.9Confident89.4Confident12 Ų1226.7 Ų26.78%0.08413%0.134CC..Hα-helixtrans-62.9-43.4177.9-64.60000111.3L1062 H1815 W1816 L1820 W1821 L1822L1062-S1818 VanDerWaalsContact CD1-CB 3.44Å; H1815-S1818 WeakPolarHBondContact O-CB 2.96Å; H1815-S1818 PolarHBondContact O-N 2.57Å; W1816-S1818 VanDerWaalsContact C-N 3.32Å; W1816-S1818 PolarHBondContact O-N 3.01Å; S1818-L1820 VanDerWaalsContact C-N 3.34Å; S1818-L1820 PolarHBondContact O-N 3.26Å; S1818-W1821 PolarHBondContact O-N 3.05Å; S1818-L1822 VanDerWaalsContact O-CG 3.28Å; S1818-L1822 WeakPolarHBondContact O-CG 3.14Å; S1818-L1822 PolarHBondContact O-N 3.31Å; S1818-L1822 VanDerWaalsContact O-N 3.11Å
1819F89.7Confident89.1Confident4 Ų425.3 Ų25.32%0.01813%0.128CC..Hα-helixtrans-61.4-42.2174-68.6-66.9000112.1L1062 I1709 L1712 H1815 W1816 E1817 I1823 F1846L1062-F1819 HydrophobicContact CD2-CZ 4.44Å; I1709-F1819 HydrophobicContact CD1-CD1 4.17Å; I1709-F1819 HydrophobicContact CG2-CD1 4.02Å; I1709-F1819 HydrophobicContact CG2-CE1 4.05Å; L1712-F1819 HydrophobicContact CB-CE1 3.87Å; L1712-F1819 HydrophobicContact CB-CZ 4.39Å; L1712-F1819 HydrophobicContact CD1-CE1 4.43Å; H1815-F1819 HydrophobicContact CB-CD2 4.15Å; H1815-F1819 HydrophobicContact CB-CE2 3.75Å; H1815-F1819 WeakPolarHBondContact O-CD2 3.45Å; H1815-F1819 PolarHBondContact O-N 3.35Å; W1816-F1819 PolarHBondContact O-N 3.25Å; E1817-F1819 PolarHBondContact O-N 2.92Å; F1819-I1823 WeakPolarHBondContact O-CG1 2.92Å; F1819-I1823 PolarHBondContact O-N 3.35Å; F1819-F1846 HydrophobicContact CB-CE2 4.28Å; F1819-F1846 HydrophobicContact CB-CZ 4.34Å; F1819-F1846 HydrophobicContact CD2-CE1 4.25Å; F1819-F1846 HydrophobicContact CD2-CE2 4.35Å; F1819-F1846 AromaticContact CD2-CZ 3.62Å; F1819-F1846 HydrophobicContact CD2-CZ 3.62Å; F1819-F1846 HydrophobicContact CE2-CZ 4.21Å; F1819-F1846 HydrophobicContact CG-CZ 4.15Å
1820L89.2Confident88.4Confident15 Ų1527.3 Ų27.38%0.07916%0.155CC..Hα-helixtrans-64.3-43.2176.1-91.487.8000112.7W1816 E1817 S1818 L1822 I1823 S1824 I1839 L1842 R1843W1816-L1820 HydrophobicContact CE3-CD1 3.67Å; W1816-L1820 HydrophobicContact CE3-CD2 4.43Å; W1816-L1820 HydrophobicContact CZ3-CD1 4.19Å; W1816-L1820 HydrophobicContact CZ3-CD2 4.13Å; W1816-L1820 WeakPolarHBondContact O-CD1 3.45Å; W1816-L1820 PolarHBondContact O-N 2.63Å; E1817-L1820 PolarHBondContact O-N 2.63Å; S1818-L1820 VanDerWaalsContact C-N 3.34Å; S1818-L1820 PolarHBondContact O-N 3.26Å; L1820-L1822 VanDerWaalsContact C-N 3.34Å; L1820-L1822 PolarHBondContact O-N 3.49Å; L1820-I1823 PolarHBondContact O-N 2.78Å; L1820-S1824 VanDerWaalsContact O-CB 3.28Å; L1820-S1824 WeakPolarHBondContact O-CB 3.19Å; L1820-S1824 PolarHBondContact O-N 3.12Å; L1820-S1824 PolarHBondContact O-OG 3.29Å; L1820-I1839 HydrophobicContact CD2-CG2 3.53Å; L1820-I1839 HydrophobicContact CG-CG2 4.3Å; L1820-L1842 HydrophobicContact CD1-CD2 4.2Å; L1820-L1842 HydrophobicContact CD1-CG 4.27Å; L1820-L1842 HydrophobicContact CG-CD2 4.26Å; L1820-R1843 HydrophobicContact CD1-CB 4.48Å; L1820-R1843 HydrophobicContact CD2-CB 3.9Å
1821W88.6Confident87.7Confident50 Ų5027.4 Ų27.419%0.18916%0.155CC..Hα-helixtrans-62.1-42.7179.7-65.5-32.1000111.8A1466 M1467 E1817 S1818 I1823 S1824 L1825A1466-W1821 HydrophobicContact CB-CE3 4.46Å; M1467-W1821 VanDerWaalsContact CA-CE3 3.43Å; M1467-W1821 HydrophobicContact CB-CE3 3.83Å; M1467-W1821 HydrophobicContact CB-CH2 4Å; M1467-W1821 HydrophobicContact CB-CZ3 3.35Å; M1467-W1821 HydrophobicContact CE-CH2 4.33Å; M1467-W1821 HydrophobicContact CG-CE3 4.2Å; M1467-W1821 HydrophobicContact CG-CH2 3.61Å; M1467-W1821 HydrophobicContact CG-CZ2 4.36Å; M1467-W1821 HydrophobicContact CG-CZ3 3.52Å; M1467-W1821 HydrophobicContact SD-CH2 3.89Å; M1467-W1821 HydrophobicContact SD-CZ3 4.16Å; E1817-W1821 HydrophobicContact CB-CD2 4.37Å; E1817-W1821 HydrophobicContact CB-CE3 4.44Å; E1817-W1821 HydrophobicContact CB-CH2 3.79Å; E1817-W1821 HydrophobicContact CB-CZ2 3.73Å; E1817-W1821 HydrophobicContact CB-CZ3 4.14Å; E1817-W1821 HydrophobicContact CG-CZ2 4.48Å; E1817-W1821 VanDerWaalsContact O-CD2 3.23Å; E1817-W1821 PolarHBondContact O-N 2.9Å; S1818-W1821 PolarHBondContact O-N 3.05Å; W1821-I1823 VanDerWaalsContact C-N 3.34Å; W1821-I1823 PolarHBondContact O-N 3.14Å; W1821-S1824 PolarHBondContact O-N 3.23Å; W1821-L1825 PolarHBondContact O-N 2.89Å
1822L89.6Confident86.8Confident0 Ų031.7 Ų31.70%018%0.183CC..Hα-helixtrans-64.1-38.6177.9-65.8174.1000112.7A1466 Y1501 Q1504 L1712 S1818 L1820 M1826A1466-L1822 HydrophobicContact CB-CD1 4.2Å; A1466-L1822 HydrophobicContact CB-CD2 3.88Å; A1466-L1822 HydrophobicContact CB-CG 3.87Å; Y1501-L1822 HydrophobicContact CD1-CD2 3.55Å; Y1501-L1822 HydrophobicContact CE1-CD1 3.86Å; Y1501-L1822 HydrophobicContact CE1-CD2 3.5Å; Y1501-L1822 VanDerWaalsContact CE1-CD2 3.5Å; Y1501-L1822 HydrophobicContact CE1-CG 4.28Å; Q1504-L1822 HydrophobicContact CB-CD2 4.41Å; Q1504-L1822 HydrophobicContact CG-CB 4.32Å; Q1504-L1822 HydrophobicContact CG-CD2 3.84Å; Q1504-L1822 WeakPolarHBondContact CG-O 2.88Å; L1712-L1822 HydrophobicContact CD1-CD1 3.62Å; S1818-L1822 VanDerWaalsContact O-CG 3.28Å; S1818-L1822 WeakPolarHBondContact O-CG 3.14Å; S1818-L1822 PolarHBondContact O-N 3.31Å; S1818-L1822 VanDerWaalsContact O-N 3.11Å; L1820-L1822 VanDerWaalsContact C-N 3.34Å; L1820-L1822 PolarHBondContact O-N 3.49Å; L1822-M1826 WeakPolarHBondContact O-CG 2.83Å
1823I88.6Confident85.8Confident20 Ų2030.8 Ų30.810%0.10318%0.18CC..Hα-helixtrans-76.5-34.2178.2-68.6167000111F1819 L1820 W1821 L1825 M1826 L1827 F1834 I1839 L1842F1819-I1823 WeakPolarHBondContact O-CG1 2.92Å; F1819-I1823 PolarHBondContact O-N 3.35Å; L1820-I1823 PolarHBondContact O-N 2.78Å; W1821-I1823 VanDerWaalsContact C-N 3.34Å; W1821-I1823 PolarHBondContact O-N 3.14Å; I1823-L1825 VanDerWaalsContact C-N 3.29Å; I1823-L1825 PolarHBondContact O-N 3.43Å; I1823-M1826 PolarHBondContact O-N 3.04Å; I1823-L1827 PolarHBondContact O-N 3.31Å; I1823-F1834 HydrophobicContact CG2-CE1 3.87Å; I1823-F1834 HydrophobicContact CG2-CZ 4.43Å; I1823-I1839 HydrophobicContact CB-CD1 4.3Å; I1823-I1839 HydrophobicContact CG2-CD1 3.77Å; I1823-L1842 HydrophobicContact CD1-CD2 3.3Å; I1823-L1842 HydrophobicContact CG1-CD2 4.47Å
1824S87.4Confident85.2Confident31 Ų3132.2 Ų32.222%0.21719%0.186CC..Hα-helixtrans-61.2-38.3177.8-61.50000112.1L1820 W1821 M1826 L1827 I1839L1820-S1824 VanDerWaalsContact O-CB 3.28Å; L1820-S1824 WeakPolarHBondContact O-CB 3.19Å; L1820-S1824 PolarHBondContact O-N 3.12Å; L1820-S1824 PolarHBondContact O-OG 3.29Å; W1821-S1824 PolarHBondContact O-N 3.23Å; S1824-M1826 PolarHBondContact O-N 3.17Å; S1824-L1827 WeakPolarHBondContact O-CG 3.3Å; S1824-L1827 PolarHBondContact O-N 3.25Å; S1824-I1839 WeakPolarHBondContact OG-CD1 3.49Å
1825L88.6Confident84.4Confident0 Ų035.9 Ų35.90%019%0.193CC..THydrogen-bonded Turntrans-65.9-19.8174.6-74.1162.7000113.4L1469 F1472 Q1504 Q1507 W1821 I1823L1469-L1825 HydrophobicContact CB-CD1 3.62Å; F1472-L1825 VanDerWaalsContact O-CD2 3.3Å; F1472-L1825 WeakPolarHBondContact O-CD2 3.5Å; Q1504-L1825 HydrophobicContact CB-CB 4.34Å; Q1504-L1825 HydrophobicContact CB-CD1 3.96Å; Q1504-L1825 HydrophobicContact CG-CB 4.21Å; Q1504-L1825 HydrophobicContact CG-CD1 4.3Å; Q1507-L1825 VanDerWaalsContact CB-O 3.24Å; Q1507-L1825 WeakPolarHBondContact CB-O 3.11Å; W1821-L1825 PolarHBondContact O-N 2.89Å; I1823-L1825 VanDerWaalsContact C-N 3.29Å; I1823-L1825 PolarHBondContact O-N 3.43Å
1826M89.2Confident83.5Confident4 Ų437.8 Ų37.82%0.0222%0.224CC..THydrogen-bonded Turntrans-95.4-7.8-178.1-61.8-63.8-73.200113.2P1503 Q1504 Q1507 L1705 L1822 I1823 S1824 D1828 T1829 F1834P1503-M1826 HydrophobicContact CB-CE 3.82Å; P1503-M1826 HydrophobicContact CB-SD 3.92Å; Q1504-M1826 HydrophobicContact CG-CG 4.36Å; Q1504-M1826 HydrophobicContact CG-SD 4.37Å; Q1507-M1826 HydrophobicContact CB-SD 4.49Å; Q1507-M1826 HydrophobicContact CG-SD 3.77Å; L1705-M1826 HydrophobicContact CD1-CG 4.16Å; L1705-M1826 HydrophobicContact CD2-CB 4.2Å; L1705-M1826 HydrophobicContact CD2-CG 4.26Å; L1822-M1826 WeakPolarHBondContact O-CG 2.83Å; I1823-M1826 PolarHBondContact O-N 3.04Å; S1824-M1826 PolarHBondContact O-N 3.17Å; M1826-D1828 VanDerWaalsContact C-N 3.26Å; M1826-D1828 PolarHBondContact O-N 2.99Å; M1826-T1829 HydrophobicContact CB-CG2 4.3Å; M1826-T1829 HydrophobicContact CE-CG2 3.83Å; M1826-T1829 VanDerWaalsContact O-CB 3.29Å; M1826-T1829 WeakPolarHBondContact O-CB 3.36Å; M1826-T1829 WeakPolarHBondContact O-CG2 3.37Å; M1826-T1829 PolarHBondContact O-N 2.71Å; M1826-T1829 VanDerWaalsContact O-N 3.07Å; M1826-T1829 PolarHBondContact O-OG1 2.95Å; M1826-T1829 HydrophobicContact SD-CG2 4.15Å; M1826-F1834 HydrophobicContact CB-CE2 3.97Å; M1826-F1834 HydrophobicContact CB-CZ 3.87Å; M1826-F1834 WeakPolarHBondContact O-CE2 2.91Å
1827L85.8Confident82.9Confident62 Ų6244 Ų4433%0.32525%0.247SC..G310 helixtrans-58.5-35.1-173.7-69.4173000113.7I1823 S1824 T1829 F1834 I1839I1823-L1827 PolarHBondContact O-N 3.31Å; S1824-L1827 WeakPolarHBondContact O-CG 3.3Å; S1824-L1827 PolarHBondContact O-N 3.25Å; L1827-T1829 VanDerWaalsContact C-N 3.26Å; L1827-T1829 PolarHBondContact O-N 2.95Å; L1827-F1834 HydrophobicContact CD2-CB 4.34Å; L1827-F1834 HydrophobicContact CD2-CD1 3.78Å; L1827-F1834 HydrophobicContact CD2-CE1 4.26Å; L1827-F1834 HydrophobicContact CD2-CG 4.04Å; L1827-I1839 HydrophobicContact CD1-CD1 4.14Å; L1827-I1839 HydrophobicContact CD1-CG1 3.74Å; L1827-I1839 HydrophobicContact CD2-CD1 4.18Å; L1827-I1839 HydrophobicContact CD2-CG1 4.18Å; L1827-I1839 HydrophobicContact CG-CD1 4.38Å; L1827-I1839 HydrophobicContact CG-CG1 4.41Å
1828D84.2Confident82.3Confident45 Ų4541.6 Ų41.624%0.24124%0.238CC..G310 helixtrans-87.514-178.4-71.4-23.8000113.2R1474 R1510 Y1511 M1826 G1830R1474-D1828 IonicContact CZ-OD1 3.28Å; R1474-D1828 IonicContact CZ-OD2 2.77Å; R1474-D1828 IonicContact NE-OD2 3.99Å; R1474-D1828 PolarHBondContact NE-OD2 3.06Å; R1474-D1828 VanDerWaalsContact NH2-CG 3.25Å; R1474-D1828 IonicContact NH2-OD1 3.44Å; R1474-D1828 PolarHBondContact NH2-OD1 3.18Å; R1474-D1828 IonicContact NH2-OD2 3.42Å; R1474-D1828 PolarHBondContact NH2-OD2 2.89Å; R1510-D1828 PolarHBondContact NH2-O 3.23Å; Y1511-D1828 PolarHBondContact OH-OD2 3.36Å; M1826-D1828 VanDerWaalsContact C-N 3.26Å; M1826-D1828 PolarHBondContact O-N 2.99Å; D1828-G1830 VanDerWaalsContact C-N 3.28Å
1829T84Confident82Confident3 Ų343 Ų432%0.01824%0.244CC..G310 helixtrans-76.4-14.8177.753.90000113.5Q1507 M1826 L1827 L1831Q1507-T1829 HydrophobicContact CG-CG2 3.81Å; M1826-T1829 HydrophobicContact CB-CG2 4.3Å; M1826-T1829 HydrophobicContact CE-CG2 3.83Å; M1826-T1829 VanDerWaalsContact O-CB 3.29Å; M1826-T1829 WeakPolarHBondContact O-CB 3.36Å; M1826-T1829 WeakPolarHBondContact O-CG2 3.37Å; M1826-T1829 PolarHBondContact O-N 2.71Å; M1826-T1829 VanDerWaalsContact O-N 3.07Å; M1826-T1829 PolarHBondContact O-OG1 2.95Å; M1826-T1829 HydrophobicContact SD-CG2 4.15Å; L1827-T1829 VanDerWaalsContact C-N 3.26Å; L1827-T1829 PolarHBondContact O-N 2.95Å; T1829-L1831 VanDerWaalsContact C-N 3.3Å; T1829-L1831 VanDerWaalsContact OG1-CG 3.31Å; T1829-L1831 WeakPolarHBondContact OG1-CG 3.28Å
1830G76.8Confident81.6Confident64 Ų6448.7 Ų48.766%0.6627%0.271SS*.  trans78.79.2-173.700000114.3D1828D1828-G1830 VanDerWaalsContact C-N 3.28Å
1831L79.8Confident81.1Confident6 Ų651.3 Ų51.33%0.03128%0.284CS..  trans-63.8135.6179-70.3174.5000111.6R1701 Q1702 T1829 C1833 F1834R1701-L1831 HydrophobicContact CB-CD1 4.33Å; R1701-L1831 HydrophobicContact CB-CD2 4.18Å; Q1702-L1831 HydrophobicContact CB-CD1 4.45Å; Q1702-L1831 HydrophobicContact CB-CD2 4.27Å; T1829-L1831 VanDerWaalsContact C-N 3.3Å; T1829-L1831 VanDerWaalsContact OG1-CG 3.31Å; T1829-L1831 WeakPolarHBondContact OG1-CG 3.28Å; L1831-C1833 PolarHBondContact O-N 2.95Å; L1831-C1833 VanDerWaalsContact O-N 3.07Å; L1831-F1834 HydrophobicContact CB-CD2 3.86Å; L1831-F1834 HydrophobicContact CB-CE2 3.93Å; L1831-F1834 HydrophobicContact CD1-CE2 4.01Å; L1831-F1834 HydrophobicContact CG-CE2 4.46Å; L1831-F1834 PolarHBondContact O-N 3.02Å; L1831-F1834 VanDerWaalsContact O-N 3.08Å
1832P71Confident80.8Confident94 Ų9450.7 Ų50.761%0.6129%0.285SS*.THydrogen-bonded Turntrans-65.9-15.1-172.824.2-33.3000114.5F1834P1832-F1834 VanDerWaalsContact C-N 3.29Å; P1832-F1834 PolarHBondContact O-N 3.23Å
1833C70.2Confident80.7Confident14 Ų1456.8 Ų56.810%0.09531%0.308CS..THydrogen-bonded Turntrans-75.2-12175.261.20000113.9L1831L1831-C1833 PolarHBondContact O-N 2.95Å; L1831-C1833 VanDerWaalsContact O-N 3.07Å
1834F79.9Confident80.5Confident35 Ų3559.6 Ų59.615%0.15432%0.323CS..  trans-95.2104.1178.7-61-47.4000111.6L1705 I1823 M1826 L1827 L1831 P1832 T1838L1705-F1834 HydrophobicContact CD2-CZ 3.74Å; I1823-F1834 HydrophobicContact CG2-CE1 3.87Å; I1823-F1834 HydrophobicContact CG2-CZ 4.43Å; M1826-F1834 HydrophobicContact CB-CE2 3.97Å; M1826-F1834 HydrophobicContact CB-CZ 3.87Å; M1826-F1834 WeakPolarHBondContact O-CE2 2.91Å; L1827-F1834 HydrophobicContact CD2-CB 4.34Å; L1827-F1834 HydrophobicContact CD2-CD1 3.78Å; L1827-F1834 HydrophobicContact CD2-CE1 4.26Å; L1827-F1834 HydrophobicContact CD2-CG 4.04Å; L1831-F1834 HydrophobicContact CB-CD2 3.86Å; L1831-F1834 HydrophobicContact CB-CE2 3.93Å; L1831-F1834 HydrophobicContact CD1-CE2 4.01Å; L1831-F1834 HydrophobicContact CG-CE2 4.46Å; L1831-F1834 PolarHBondContact O-N 3.02Å; L1831-F1834 VanDerWaalsContact O-N 3.08Å; P1832-F1834 VanDerWaalsContact C-N 3.29Å; P1832-F1834 PolarHBondContact O-N 3.23Å; F1834-T1838 HydrophobicContact CD1-CG2 3.96Å; F1834-T1838 HydrophobicContact CE1-CG2 4.27Å
1835R71.2Confident80.5Confident132 Ų13264.8 Ų64.850%0.49834%0.337SS..  trans-113.933.1-175.8-63.2-174179.6157.43.7113.9E1766 R1837 T1838E1766-R1835 PolarHBondContact O-NH1 3.41Å; E1766-R1835 VanDerWaalsContact O-NH1 3.14Å; E1766-R1835 PolarHBondContact O-NH2 3.01Å; R1835-R1837 PolarHBondContact O-N 3.45Å; R1835-T1838 PolarHBondContact N-OG1 2.95Å
1836G70.7Confident80.5Confident81 Ų8165.7 Ų65.784%0.83534%0.341SS*.SBendtrans78.8-33.7175.200000116.3
1837R77.6Confident80.5Confident177 Ų17765.6 Ų65.667%0.66834%0.341SS*.  trans-95.93.5176.3-71-168.2-74.7-178.9-3.8114.9R1835 I1839 Q1840 L1841R1835-R1837 PolarHBondContact O-N 3.45Å; R1837-I1839 PolarHBondContact O-N 3.49Å; R1837-Q1840 PolarHBondContact O-N 3.37Å; R1837-L1841 HydrophobicContact CB-CD1 4.26Å; R1837-L1841 HydrophobicContact CB-CG 4.44Å; R1837-L1841 PolarHBondContact O-N 3.02Å
1838T77.3Confident80.6Confident24 Ų2463.6 Ų63.615%0.14733%0.332CS..Hα-helixtrans-55.6-44.8-170.8-51.50000113.2F1834 R1835 L1842F1834-T1838 HydrophobicContact CD1-CG2 3.96Å; F1834-T1838 HydrophobicContact CE1-CG2 4.27Å; R1835-T1838 PolarHBondContact N-OG1 2.95Å; T1838-L1842 WeakPolarHBondContact O-CB 3.24Å; T1838-L1842 PolarHBondContact O-N 3.47Å
1839I82.3Confident80.7Confident42 Ų4265.7 Ų65.722%0.21534%0.341CS..Hα-helixtrans-66-41.5-178.8-60.1-54.3000112L1820 I1823 S1824 L1827 R1837 R1843L1820-I1839 HydrophobicContact CD2-CG2 3.53Å; L1820-I1839 HydrophobicContact CG-CG2 4.3Å; I1823-I1839 HydrophobicContact CB-CD1 4.3Å; I1823-I1839 HydrophobicContact CG2-CD1 3.77Å; S1824-I1839 WeakPolarHBondContact OG-CD1 3.49Å; L1827-I1839 HydrophobicContact CD1-CD1 4.14Å; L1827-I1839 HydrophobicContact CD1-CG1 3.74Å; L1827-I1839 HydrophobicContact CD2-CD1 4.18Å; L1827-I1839 HydrophobicContact CD2-CG1 4.18Å; L1827-I1839 HydrophobicContact CG-CD1 4.38Å; L1827-I1839 HydrophobicContact CG-CG1 4.41Å; R1837-I1839 PolarHBondContact O-N 3.49Å; I1839-R1843 WeakPolarHBondContact O-CB 3.26Å; I1839-R1843 PolarHBondContact O-N 3.32Å
1840Q81.9Confident80.9Confident124 Ų12468.7 Ų68.758%0.57935%0.353SS*.Hα-helixtrans-64.8-49.2179-174.6178.64.700110.9R1837 L1842 R1843 D1844R1837-Q1840 PolarHBondContact O-N 3.37Å; Q1840-L1842 VanDerWaalsContact C-N 3.32Å; Q1840-L1842 PolarHBondContact O-N 3.01Å; Q1840-R1843 WeakPolarHBondContact O-CB 3.08Å; Q1840-R1843 PolarHBondContact O-N 3.36Å; Q1840-D1844 VanDerWaalsContact O-CG 3.22Å; Q1840-D1844 PolarHBondContact O-N 2.89Å
1841L78.8Confident81.5Confident69 Ų6966.6 Ų66.636%0.36133%0.329SS..Hα-helixtrans-62.6-39.1179.3-68.1172.5000112.2R1837 D1844 R1845R1837-L1841 HydrophobicContact CB-CD1 4.26Å; R1837-L1841 HydrophobicContact CB-CG 4.44Å; R1837-L1841 PolarHBondContact O-N 3.02Å; L1841-D1844 PolarHBondContact O-N 3.5Å; L1841-R1845 WeakPolarHBondContact O-CG 3.28Å; L1841-R1845 PolarHBondContact O-N 2.87Å; L1841-R1845 VanDerWaalsContact O-N 3.11Å
1842L82.5Confident82Confident38 Ų3867.8 Ų67.820%0.19933%0.334CS..Hα-helixtrans-64.7-43.1176.4-17865.8000111.8L1820 I1823 T1838 Q1840 D1844 R1845 F1846L1820-L1842 HydrophobicContact CD1-CD2 4.2Å; L1820-L1842 HydrophobicContact CD1-CG 4.27Å; L1820-L1842 HydrophobicContact CG-CD2 4.26Å; I1823-L1842 HydrophobicContact CD1-CD2 3.3Å; I1823-L1842 HydrophobicContact CG1-CD2 4.47Å; T1838-L1842 WeakPolarHBondContact O-CB 3.24Å; T1838-L1842 PolarHBondContact O-N 3.47Å; Q1840-L1842 VanDerWaalsContact C-N 3.32Å; Q1840-L1842 PolarHBondContact O-N 3.01Å; L1842-D1844 VanDerWaalsContact C-N 3.29Å; L1842-D1844 PolarHBondContact O-N 3.48Å; L1842-R1845 PolarHBondContact O-N 3.29Å; L1842-F1846 HydrophobicContact CD1-CE2 4.06Å; L1842-F1846 HydrophobicContact CG-CE2 4.26Å; L1842-F1846 WeakPolarHBondContact O-CD2 3.02Å; L1842-F1846 PolarHBondContact O-N 3.47Å
1843R86.6Confident82.8Confident128 Ų12867 Ų6748%0.48332%0.321SS..Hα-helixtrans-57.6-45173.6178.6177.8174.3-179.1-3.5111.2W1816 L1820 I1839 Q1840 R1845 F1846 A1847 P1848W1816-R1843 HydrophobicContact CE3-CG 4.11Å; W1816-R1843 HydrophobicContact CZ3-CB 4.47Å; W1816-R1843 HydrophobicContact CZ3-CG 3.74Å; L1820-R1843 HydrophobicContact CD1-CB 4.48Å; L1820-R1843 HydrophobicContact CD2-CB 3.9Å; I1839-R1843 WeakPolarHBondContact O-CB 3.26Å; I1839-R1843 PolarHBondContact O-N 3.32Å; Q1840-R1843 WeakPolarHBondContact O-CB 3.08Å; Q1840-R1843 PolarHBondContact O-N 3.36Å; R1843-R1845 VanDerWaalsContact C-N 3.27Å; R1843-R1845 PolarHBondContact O-N 3.14Å; R1843-F1846 PolarHBondContact O-N 3.02Å; R1843-A1847 PolarHBondContact O-N 3.08Å; R1843-P1848 HydrophobicContact CG-CG 4.03Å; R1843-P1848 WeakPolarHBondContact O-CD 3.02Å
1844D85.6Confident83.8Confident79 Ų7970.5 Ų70.542%0.42234%0.336SS..Hα-helixtrans-63.3-34.5-177.9-66.3-20.6000111.7Q1840 L1841 L1842 F1846 A1847Q1840-D1844 VanDerWaalsContact O-CG 3.22Å; Q1840-D1844 PolarHBondContact O-N 2.89Å; L1841-D1844 PolarHBondContact O-N 3.5Å; L1842-D1844 VanDerWaalsContact C-N 3.29Å; L1842-D1844 PolarHBondContact O-N 3.48Å; D1844-F1846 VanDerWaalsContact C-N 3.34Å; D1844-F1846 PolarHBondContact O-N 2.69Å; D1844-A1847 PolarHBondContact O-N 3.34Å; D1844-A1847 VanDerWaalsContact O-N 3.11Å
1845R86.4Confident84.4Confident139 Ų13968.8 Ų68.853%0.52533%0.328SS..Hα-helixtrans-64.2-31.6175.3-71.7175-175-128.14.3114.1Y1809 L1841 L1842 R1843 A1847Y1809-R1845 PolarHBondContact OH-O 2.72Å; L1841-R1845 WeakPolarHBondContact O-CG 3.28Å; L1841-R1845 PolarHBondContact O-N 2.87Å; L1841-R1845 VanDerWaalsContact O-N 3.11Å; L1842-R1845 PolarHBondContact O-N 3.29Å; R1843-R1845 VanDerWaalsContact C-N 3.27Å; R1843-R1845 PolarHBondContact O-N 3.14Å; R1845-A1847 VanDerWaalsContact C-N 3.29Å
1846F89.4Confident85.4Confident19 Ų1962.6 Ų62.68%0.08331%0.305CS..Hα-helixtrans-79.8-12.5175.1-80-75.8000113.4Y1809 M1812 R1813 W1816 F1819 L1842 R1843 D1844 P1848Y1809-F1846 PolarHBondContact OH-O 3.26Å; Y1809-F1846 VanDerWaalsContact OH-O 3.07Å; M1812-F1846 HydrophobicContact CB-CE1 4.2Å; M1812-F1846 HydrophobicContact CE-CE1 4.21Å; M1812-F1846 HydrophobicContact CE-CZ 4.35Å; R1813-F1846 HydrophobicContact CG-CD1 4.38Å; R1813-F1846 PolarHBondContact NE-O 2.87Å; W1816-F1846 HydrophobicContact CB-CB 3.81Å; W1816-F1846 HydrophobicContact CB-CD1 3.85Å; W1816-F1846 HydrophobicContact CB-CD2 3.83Å; W1816-F1846 HydrophobicContact CB-CE1 4.35Å; W1816-F1846 HydrophobicContact CB-CE2 4.34Å; W1816-F1846 HydrophobicContact CB-CG 3.56Å; F1819-F1846 HydrophobicContact CB-CE2 4.28Å; F1819-F1846 HydrophobicContact CB-CZ 4.34Å; F1819-F1846 HydrophobicContact CD2-CE1 4.25Å; F1819-F1846 HydrophobicContact CD2-CE2 4.35Å; F1819-F1846 AromaticContact CD2-CZ 3.62Å; F1819-F1846 HydrophobicContact CD2-CZ 3.62Å; F1819-F1846 HydrophobicContact CE2-CZ 4.21Å; F1819-F1846 HydrophobicContact CG-CZ 4.15Å; L1842-F1846 HydrophobicContact CD1-CE2 4.06Å; L1842-F1846 HydrophobicContact CG-CE2 4.26Å; L1842-F1846 WeakPolarHBondContact O-CD2 3.02Å; L1842-F1846 PolarHBondContact O-N 3.47Å; R1843-F1846 PolarHBondContact O-N 3.02Å; D1844-F1846 VanDerWaalsContact C-N 3.34Å; D1844-F1846 PolarHBondContact O-N 2.69Å; F1846-P1848 VanDerWaalsContact C-N 3.32Å
1847A89.5Confident86.4Confident2 Ų262.6 Ų62.62%0.01728%0.284CS..  trans38.555.2-174.500000112.7R1813 R1843 D1844 R1845 Q1849 K1850 F1858R1813-A1847 PolarHBondContact NH2-O 3.4Å; R1843-A1847 PolarHBondContact O-N 3.08Å; D1844-A1847 PolarHBondContact O-N 3.34Å; D1844-A1847 VanDerWaalsContact O-N 3.11Å; R1845-A1847 VanDerWaalsContact C-N 3.29Å; A1847-Q1849 PolarHBondContact O-N 2.91Å; A1847-K1850 HydrophobicContact CB-CB 4.41Å; A1847-K1850 HydrophobicContact CB-CD 3.86Å; A1847-K1850 HydrophobicContact CB-CG 4.09Å; A1847-K1850 PolarHBondContact O-N 3.2Å; A1847-F1858 HydrophobicContact CB-CD1 4.3Å; A1847-F1858 HydrophobicContact CB-CE1 4.19Å
1848P86.7Confident87Confident20 Ų2057.1 Ų57.113%0.1327%0.265CS..THydrogen-bonded Turntrans-59.7-23.5-167.324.4-35.9000113.9R1813 W1816 R1843 F1846R1813-P1848 PolarHBondContact NH2-O 2.92Å; W1816-P1848 HydrophobicContact CD2-CB 3.81Å; W1816-P1848 HydrophobicContact CD2-CG 4.21Å; W1816-P1848 HydrophobicContact CE3-CB 4.34Å; W1816-P1848 HydrophobicContact CE3-CG 4.23Å; W1816-P1848 HydrophobicContact CG-CB 4.2Å; W1816-P1848 HydrophobicContact CH2-CG 4.5Å; W1816-P1848 HydrophobicContact CZ2-CB 4.06Å; W1816-P1848 HydrophobicContact CZ2-CG 4.4Å; W1816-P1848 HydrophobicContact CZ3-CG 4.4Å; R1843-P1848 HydrophobicContact CG-CG 4.03Å; R1843-P1848 WeakPolarHBondContact O-CD 3.02Å; F1846-P1848 VanDerWaalsContact C-N 3.32Å
1849Q86.5Confident87.7Confident90 Ų9057.4 Ų57.442%0.42127%0.265SS..THydrogen-bonded Turntrans-76.1-24.5179.377-8111.800113.5K1411 N1412 A1847K1411-Q1849 WeakPolarHBondContact CB-O 3.17Å; N1412-Q1849 PolarHBondContact ND2-O 3.19Å; N1412-Q1849 WeakPolarHBondContact OD1-CB 3.3Å; N1412-Q1849 PolarHBondContact OD1-O 3.26Å; A1847-Q1849 PolarHBondContact O-N 2.91Å
1850K89.1Confident88.2Confident66 Ų6655.4 Ų55.429%0.28725%0.254SS..SBendtrans-71.8146.6-177.8-70.9-172.4177.5-68.60112.9K1411 R1813 A1847 E1854 A1855 F1858K1411-K1850 WeakPolarHBondContact CD-O 3.49Å; R1813-K1850 PolarHBondContact NH1-O 3.13Å; R1813-K1850 PolarHBondContact NH2-O 3.09Å; A1847-K1850 HydrophobicContact CB-CB 4.41Å; A1847-K1850 HydrophobicContact CB-CD 3.86Å; A1847-K1850 HydrophobicContact CB-CG 4.09Å; A1847-K1850 PolarHBondContact O-N 3.2Å; K1850-E1854 VanDerWaalsContact CA-OE2 3.27Å; K1850-E1854 WeakPolarHBondContact CA-OE2 3.14Å; K1850-E1854 HydrophobicContact CB-CB 3.87Å; K1850-E1854 HydrophobicContact CD-CB 4.32Å; K1850-E1854 HydrophobicContact CG-CB 4.28Å; K1850-A1855 HydrophobicContact CB-CB 4.33Å; K1850-F1858 HydrophobicContact CD-CB 4.14Å; K1850-F1858 HydrophobicContact CD-CG 4.42Å
1851S88.4Confident88.6Confident20 Ų2053.7 Ų53.714%0.1425%0.247CC..  trans-60.9171.3168.585.70000111.4E1348 R1813 K1853 E1854 A1855E1348-S1851 PolarHBondContact OE1-OG 2.7Å; R1813-S1851 PolarHBondContact NH1-O 3.31Å; S1851-K1853 PolarHBondContact OG-N 2.67Å; S1851-E1854 PolarHBondContact N-OE2 3.39Å; S1851-E1854 WeakPolarHBondContact OG-CG 3.42Å; S1851-E1854 PolarHBondContact OG-N 2.65Å; S1851-E1854 VanDerWaalsContact OG-N 3.1Å; S1851-A1855 WeakPolarHBondContact O-CB 3.45Å; S1851-A1855 PolarHBondContact O-N 2.76Å
1852E89.8Confident89Confident31 Ų3151.5 Ų51.515%0.14524%0.235CC..Hα-helixtrans-66-39173.9-71.4-171.6-161.100111.9R1349 A1352 W1353 L1810 A1855 A1856R1349-E1852 HydrophobicContact CG-CG 4.3Å; R1349-E1852 WeakPolarHBondContact CG-OE1 3.16Å; R1349-E1852 WeakPolarHBondContact CG-OE2 3.31Å; A1352-E1852 HydrophobicContact CB-CB 4.11Å; W1353-E1852 VanDerWaalsContact CD1-OE2 3.26Å; W1353-E1852 PolarHBondContact NE1-OE2 3.27Å; L1810-E1852 HydrophobicContact CD2-CB 4.1Å; L1810-E1852 HydrophobicContact CD2-CG 4.25Å; E1852-A1855 PolarHBondContact O-N 3.36Å; E1852-A1856 WeakPolarHBondContact O-CB 3.44Å; E1852-A1856 PolarHBondContact O-N 2.89Å
1853K89Confident89.2Confident78 Ų7849.7 Ų49.734%0.33923%0.226SC..Hα-helixtrans-61.1-48.5174.1-175.4175.4178.4173.90111.7E1348 A1352 E1371 S1851 A1855 A1856 Q1857E1348-K1853 HydrophobicContact CG-CB 4.22Å; E1348-K1853 HydrophobicContact CG-CD 3.92Å; E1348-K1853 WeakPolarHBondContact OE1-CB 3.33Å; A1352-K1853 HydrophobicContact CB-CB 4.32Å; E1371-K1853 IonicContact OE2-NZ 2.71Å; E1371-K1853 PolarHBondContact OE2-NZ 3.12Å; S1851-K1853 PolarHBondContact OG-N 2.67Å; K1853-A1855 VanDerWaalsContact C-N 3.31Å; K1853-A1855 PolarHBondContact O-N 3.47Å; K1853-A1856 PolarHBondContact O-N 2.76Å; K1853-Q1857 WeakPolarHBondContact O-CG 3.16Å; K1853-Q1857 PolarHBondContact O-N 3Å; K1853-Q1857 VanDerWaalsContact O-N 3.1Å
1854E91Very high89.2Confident86 Ų8648.6 Ų48.640%0.40222%0.221SC..Hα-helixtrans-64.8-35.9176.8-69.3174.7159.800112.6K1850 S1851 Q1857 F1858K1850-E1854 VanDerWaalsContact CA-OE2 3.27Å; K1850-E1854 WeakPolarHBondContact CA-OE2 3.14Å; K1850-E1854 HydrophobicContact CB-CB 3.87Å; K1850-E1854 HydrophobicContact CD-CB 4.32Å; K1850-E1854 HydrophobicContact CG-CB 4.28Å; S1851-E1854 PolarHBondContact N-OE2 3.39Å; S1851-E1854 WeakPolarHBondContact OG-CG 3.42Å; S1851-E1854 PolarHBondContact OG-N 2.65Å; S1851-E1854 VanDerWaalsContact OG-N 3.1Å; E1854-Q1857 PolarHBondContact O-N 2.6Å; E1854-F1858 WeakPolarHBondContact O-CB 3.35Å; E1854-F1858 PolarHBondContact O-N 2.7Å
1855A91.3Very high89.2Confident0 Ų048.5 Ų48.50%022%0.221CC..Hα-helixtrans-73.1-35.9178.200000112.4Y1809 L1810 K1850 S1851 E1852 K1853 Q1857 F1858 M1859Y1809-A1855 HydrophobicContact CE1-CB 3.88Å; Y1809-A1855 WeakPolarHBondContact CE1-O 3.32Å; L1810-A1855 HydrophobicContact CD2-CB 3.96Å; K1850-A1855 HydrophobicContact CB-CB 4.33Å; S1851-A1855 WeakPolarHBondContact O-CB 3.45Å; S1851-A1855 PolarHBondContact O-N 2.76Å; E1852-A1855 PolarHBondContact O-N 3.36Å; K1853-A1855 VanDerWaalsContact C-N 3.31Å; K1853-A1855 PolarHBondContact O-N 3.47Å; A1855-Q1857 VanDerWaalsContact C-N 3.35Å; A1855-F1858 WeakPolarHBondContact O-CB 3.47Å; A1855-F1858 PolarHBondContact O-N 3.47Å; A1855-M1859 PolarHBondContact O-N 2.96Å
1856A92.5Very high89Confident2 Ų241.9 Ų41.92%0.01720%0.196CC..Hα-helixtrans-59.1-48.2169.900000110.4P1356 V1806 E1852 K1853 F1858 M1859 L1860P1356-A1856 HydrophobicContact CB-CB 4.31Å; V1806-A1856 HydrophobicContact CG1-CB 3.58Å; E1852-A1856 WeakPolarHBondContact O-CB 3.44Å; E1852-A1856 PolarHBondContact O-N 2.89Å; K1853-A1856 PolarHBondContact O-N 2.76Å; A1856-F1858 VanDerWaalsContact C-N 3.35Å; A1856-F1858 PolarHBondContact O-N 2.7Å; A1856-M1859 PolarHBondContact O-N 3.39Å; A1856-L1860 WeakPolarHBondContact O-CB 3.43Å; A1856-L1860 VanDerWaalsContact O-CG 3.32Å; A1856-L1860 WeakPolarHBondContact O-CG 3.38Å; A1856-L1860 PolarHBondContact O-N 2.74Å
1857Q92.4Very high88.7Confident81 Ų8143.2 Ų43.238%0.37920%0.202SC..Hα-helixtrans-62.7-40175.8-68.5-62.3-27.900112.6K1853 E1854 A1855 L1860 Q1861K1853-Q1857 WeakPolarHBondContact O-CG 3.16Å; K1853-Q1857 PolarHBondContact O-N 3Å; K1853-Q1857 VanDerWaalsContact O-N 3.1Å; E1854-Q1857 PolarHBondContact O-N 2.6Å; A1855-Q1857 VanDerWaalsContact C-N 3.35Å; Q1857-L1860 PolarHBondContact O-N 3.18Å; Q1857-Q1861 WeakPolarHBondContact O-CB 3.47Å; Q1857-Q1861 PolarHBondContact O-N 2.87Å
1858F90.9Very high88.1Confident61 Ų6147.6 Ų47.627%0.26822%0.224SC..Hα-helixtrans-58.6-49174.2173.2-102.8000111.6Y1809 A1847 K1850 E1854 A1855 A1856 Q1861 I1862Y1809-F1858 HydrophobicContact CE1-CD1 4.04Å; Y1809-F1858 AromaticContact CZ-CD1 3.86Å; Y1809-F1858 WeakPolarHBondContact OH-CD1 3.39Å; Y1809-F1858 WeakPolarHBondContact OH-CE1 3.16Å; A1847-F1858 HydrophobicContact CB-CD1 4.3Å; A1847-F1858 HydrophobicContact CB-CE1 4.19Å; K1850-F1858 HydrophobicContact CD-CB 4.14Å; K1850-F1858 HydrophobicContact CD-CG 4.42Å; E1854-F1858 WeakPolarHBondContact O-CB 3.35Å; E1854-F1858 PolarHBondContact O-N 2.7Å; A1855-F1858 WeakPolarHBondContact O-CB 3.47Å; A1855-F1858 PolarHBondContact O-N 3.47Å; A1856-F1858 VanDerWaalsContact C-N 3.35Å; A1856-F1858 PolarHBondContact O-N 2.7Å; F1858-Q1861 WeakPolarHBondContact O-CB 3.16Å; F1858-Q1861 PolarHBondContact O-N 3.16Å; F1858-I1862 HydrophobicContact CD1-CD1 4Å; F1858-I1862 HydrophobicContact CE1-CD1 3.51Å; F1858-I1862 HydrophobicContact CE2-CD1 4.35Å; F1858-I1862 HydrophobicContact CZ-CD1 3.72Å; F1858-I1862 WeakPolarHBondContact O-CG1 3.27Å; F1858-I1862 PolarHBondContact O-N 2.84Å
1859M91.9Very high87.6Confident30 Ų3048.2 Ų48.215%0.14823%0.226CC..Hα-helixtrans-66.4-39.8178.8-170.862.2-159.600112.2F1779 C1805 V1806 Y1809 A1855 A1856 Q1861 I1862 V1863F1779-M1859 HydrophobicContact CE1-CE 4.41Å; C1805-M1859 HydrophobicContact CB-CE 4.3Å; V1806-M1859 HydrophobicContact CG2-CB 4.33Å; V1806-M1859 HydrophobicContact CG2-CG 4.41Å; Y1809-M1859 HydrophobicContact CD1-CB 3.59Å; Y1809-M1859 HydrophobicContact CD1-CG 4.04Å; Y1809-M1859 HydrophobicContact CD1-SD 4.42Å; Y1809-M1859 HydrophobicContact CD2-SD 4.24Å; Y1809-M1859 HydrophobicContact CE1-CB 4.04Å; Y1809-M1859 HydrophobicContact CG-CB 4.1Å; Y1809-M1859 HydrophobicContact CG-CG 4.02Å; Y1809-M1859 HydrophobicContact CG-SD 4.05Å; A1855-M1859 PolarHBondContact O-N 2.96Å; A1856-M1859 PolarHBondContact O-N 3.39Å; M1859-Q1861 VanDerWaalsContact C-N 3.29Å; M1859-Q1861 PolarHBondContact O-N 2.84Å; M1859-I1862 WeakPolarHBondContact O-CB 3.35Å; M1859-I1862 PolarHBondContact O-N 3.38Å; M1859-I1862 HydrophobicContact SD-CD1 4.25Å; M1859-V1863 HydrophobicContact CE-CG2 4.21Å; M1859-V1863 WeakPolarHBondContact O-CG2 3.45Å; M1859-V1863 PolarHBondContact O-N 2.99Å
1860L91.6Very high86.9Confident0 Ų049.2 Ų49.20%024%0.239CC..Hα-helixtrans-61.3-38.6173.4-72.4172.9000111.9P1356 Q1357 M1802 V1806 A1856 Q1857 I1862 V1863 R1864P1356-L1860 VanDerWaalsContact O-CD1 3.26Å; P1356-L1860 WeakPolarHBondContact O-CD1 3.19Å; Q1357-L1860 HydrophobicContact CB-CD1 4.49Å; Q1357-L1860 HydrophobicContact CG-CD1 4.15Å; Q1357-L1860 HydrophobicContact CG-CD2 4.01Å; M1802-L1860 HydrophobicContact CB-CD2 4.03Å; M1802-L1860 HydrophobicContact CG-CD2 4.44Å; M1802-L1860 HydrophobicContact SD-CD2 4.21Å; V1806-L1860 HydrophobicContact CG2-CD2 3.69Å; V1806-L1860 HydrophobicContact CG2-CG 3.71Å; A1856-L1860 WeakPolarHBondContact O-CB 3.43Å; A1856-L1860 VanDerWaalsContact O-CG 3.32Å; A1856-L1860 WeakPolarHBondContact O-CG 3.38Å; A1856-L1860 PolarHBondContact O-N 2.74Å; Q1857-L1860 PolarHBondContact O-N 3.18Å; L1860-I1862 VanDerWaalsContact C-N 3.33Å; L1860-V1863 PolarHBondContact O-N 3.26Å; L1860-R1864 WeakPolarHBondContact O-CB 3.41Å; L1860-R1864 VanDerWaalsContact O-CG 3.24Å; L1860-R1864 WeakPolarHBondContact O-CG 3.35Å; L1860-R1864 PolarHBondContact O-N 2.87Å
1861Q90.2Very high85.8Confident89 Ų8952.2 Ų52.242%0.41625%0.248SC..Hα-helixtrans-64.6-39.1175.7-169.459.240.500111.6Q1857 F1858 M1859 R1864 N1865Q1857-Q1861 WeakPolarHBondContact O-CB 3.47Å; Q1857-Q1861 PolarHBondContact O-N 2.87Å; F1858-Q1861 WeakPolarHBondContact O-CB 3.16Å; F1858-Q1861 PolarHBondContact O-N 3.16Å; M1859-Q1861 VanDerWaalsContact C-N 3.29Å; M1859-Q1861 PolarHBondContact O-N 2.84Å; Q1861-R1864 PolarHBondContact O-N 3.37Å; Q1861-N1865 PolarHBondContact NE2-OD1 3.42Å; Q1861-N1865 WeakPolarHBondContact O-CB 3.27Å; Q1861-N1865 PolarHBondContact O-N 2.9Å; Q1861-N1865 PolarHBondContact O-ND2 2.65Å; Q1861-N1865 PolarHBondContact O-OD1 2.66Å
1862I86.7Confident84.7Confident23 Ų2351.7 Ų51.712%0.11825%0.245CC..Hα-helixtrans-59.7-51.7172.5-65.6174000109.9D1778 F1779 F1858 M1859 L1860 R1864 N1865 C1866D1778-I1862 HydrophobicContact CB-CG2 3.6Å; F1779-I1862 HydrophobicContact CD1-CG2 3.89Å; F1779-I1862 HydrophobicContact CE1-CG2 3.81Å; F1858-I1862 HydrophobicContact CD1-CD1 4Å; F1858-I1862 HydrophobicContact CE1-CD1 3.51Å; F1858-I1862 HydrophobicContact CE2-CD1 4.35Å; F1858-I1862 HydrophobicContact CZ-CD1 3.72Å; F1858-I1862 WeakPolarHBondContact O-CG1 3.27Å; F1858-I1862 PolarHBondContact O-N 2.84Å; M1859-I1862 WeakPolarHBondContact O-CB 3.35Å; M1859-I1862 PolarHBondContact O-N 3.38Å; M1859-I1862 HydrophobicContact SD-CD1 4.25Å; L1860-I1862 VanDerWaalsContact C-N 3.33Å; I1862-R1864 VanDerWaalsContact C-N 3.28Å; I1862-R1864 PolarHBondContact O-N 3.4Å; I1862-N1865 PolarHBondContact O-N 3.12Å; I1862-N1865 VanDerWaalsContact O-N 3.1Å; I1862-C1866 WeakPolarHBondContact O-CB 3.42Å; I1862-C1866 PolarHBondContact O-N 2.92Å; I1862-C1866 PolarHBondContact O-SG 3.24Å
1863V87.6Confident83.5Confident0 Ų057.8 Ų57.80%027%0.271CS..Hα-helixtrans-57.4-42.3178.9178.50000111.5F1779 L1781 F1798 F1801 M1802 C1805 M1859 L1860 C1866 F1867F1779-V1863 HydrophobicContact CE1-CG2 4.09Å; F1779-V1863 HydrophobicContact CZ-CB 4.27Å; F1779-V1863 HydrophobicContact CZ-CG1 4.35Å; F1779-V1863 HydrophobicContact CZ-CG2 3.9Å; L1781-V1863 HydrophobicContact CD1-CG1 4.12Å; F1798-V1863 HydrophobicContact CE1-CG1 4.36Å; F1798-V1863 HydrophobicContact CZ-CG1 4.25Å; F1801-V1863 HydrophobicContact CE1-CG1 4.08Å; M1802-V1863 HydrophobicContact CG-CG1 3.96Å; M1802-V1863 HydrophobicContact SD-CG1 4.42Å; C1805-V1863 HydrophobicContact CB-CG2 4.31Å; M1859-V1863 HydrophobicContact CE-CG2 4.21Å; M1859-V1863 WeakPolarHBondContact O-CG2 3.45Å; M1859-V1863 PolarHBondContact O-N 2.99Å; L1860-V1863 PolarHBondContact O-N 3.26Å; V1863-C1866 PolarHBondContact O-N 3.28Å; V1863-F1867 PolarHBondContact O-N 3.48Å; V1863-F1867 VanDerWaalsContact O-N 3.1Å
1864R87.5Confident82.3Confident104 Ų10458.6 Ų58.639%0.39228%0.277SS..Hα-helixtrans-63.1-43.7176-73.2168.4-176.21572.5112.5M1793 L1860 Q1861 I1862 C1866 F1867M1793-R1864 HydrophobicContact CE-CB 4.26Å; M1793-R1864 HydrophobicContact CE-CG 3.86Å; L1860-R1864 WeakPolarHBondContact O-CB 3.41Å; L1860-R1864 VanDerWaalsContact O-CG 3.24Å; L1860-R1864 WeakPolarHBondContact O-CG 3.35Å; L1860-R1864 PolarHBondContact O-N 2.87Å; Q1861-R1864 PolarHBondContact O-N 3.37Å; I1862-R1864 VanDerWaalsContact C-N 3.28Å; I1862-R1864 PolarHBondContact O-N 3.4Å; R1864-C1866 PolarHBondContact O-N 2.98Å; R1864-F1867 PolarHBondContact O-N 2.9Å
1865N84.2Confident80.8Confident77 Ų7755.2 Ų55.241%0.41226%0.26SS..Hα-helixtrans-64.8-29.5177.1-68.2-12.7000111.8Q1861 I1862 N1869Q1861-N1865 PolarHBondContact NE2-OD1 3.42Å; Q1861-N1865 WeakPolarHBondContact O-CB 3.27Å; Q1861-N1865 PolarHBondContact O-N 2.9Å; Q1861-N1865 PolarHBondContact O-ND2 2.65Å; Q1861-N1865 PolarHBondContact O-OD1 2.66Å; I1862-N1865 PolarHBondContact O-N 3.12Å; I1862-N1865 VanDerWaalsContact O-N 3.1Å; N1865-N1869 WeakPolarHBondContact O-CB 3.47Å; N1865-N1869 PolarHBondContact O-ND2 2.82Å
1866C81.7Confident79.3Confident0 Ų056.4 Ų56.40%027%0.267CS..Hα-helixtrans-83-22.4-179.9-67.70000113.7F1779 L1781 I1862 V1863 R1864 L1868 N1869F1779-C1866 HydrophobicContact CD1-CB 4.16Å; F1779-C1866 WeakPolarHBondContact CD1-SG 3.28Å; F1779-C1866 HydrophobicContact CE1-CB 3.95Å; F1779-C1866 HydrophobicContact CE2-CB 4.36Å; F1779-C1866 HydrophobicContact CG-CB 4.45Å; F1779-C1866 HydrophobicContact CZ-CB 4.04Å; F1779-C1866 PolarHBondContact N-SG 3.15Å; F1779-C1866 VanDerWaalsContact N-SG 3.44Å; F1779-C1866 VanDerWaalsContact O-CB 3.25Å; F1779-C1866 WeakPolarHBondContact O-CB 3.37Å; F1779-C1866 PolarHBondContact O-SG 2.67Å; L1781-C1866 HydrophobicContact CD1-CB 4.07Å; L1781-C1866 HydrophobicContact CG-CB 4.38Å; I1862-C1866 WeakPolarHBondContact O-CB 3.42Å; I1862-C1866 PolarHBondContact O-N 2.92Å; I1862-C1866 PolarHBondContact O-SG 3.24Å; V1863-C1866 PolarHBondContact O-N 3.28Å; R1864-C1866 PolarHBondContact O-N 2.98Å; C1866-L1868 PolarHBondContact O-N 3.46Å; C1866-L1868 VanDerWaalsContact O-N 3.13Å; C1866-N1869 PolarHBondContact O-N 2.94Å
1867F83.9Confident77.9Confident48 Ų4861.7 Ų61.721%0.21129%0.291CS..BIsolated β-bridgetrans-62.4111.6-177.3-177.8-98.6000112V1786 M1793 F1798 V1863 R1864 N1869V1786-F1867 HydrophobicContact CB-CE2 4.24Å; V1786-F1867 HydrophobicContact CG1-CD2 4.37Å; V1786-F1867 HydrophobicContact CG1-CE2 3.43Å; V1786-F1867 VanDerWaalsContact CG1-CE2 3.43Å; V1786-F1867 HydrophobicContact CG1-CZ 3.82Å; V1786-F1867 HydrophobicContact CG2-CD2 3.83Å; V1786-F1867 HydrophobicContact CG2-CE2 3.71Å; M1793-F1867 HydrophobicContact CE-CB 3.45Å; M1793-F1867 VanDerWaalsContact CE-CB 3.45Å; M1793-F1867 HydrophobicContact CE-CD1 4.15Å; M1793-F1867 HydrophobicContact CE-CD2 3.89Å; M1793-F1867 HydrophobicContact CE-CG 3.57Å; M1793-F1867 HydrophobicContact CG-CD1 4.19Å; M1793-F1867 HydrophobicContact CG-CD2 3.87Å; M1793-F1867 HydrophobicContact CG-CE1 4.07Å; M1793-F1867 HydrophobicContact CG-CE2 3.7Å; M1793-F1867 HydrophobicContact CG-CG 4.1Å; M1793-F1867 HydrophobicContact CG-CZ 3.82Å; M1793-F1867 HydrophobicContact SD-CD1 4.23Å; M1793-F1867 HydrophobicContact SD-CG 4.2Å; F1798-F1867 HydrophobicContact CD2-CE2 4.46Å; F1798-F1867 HydrophobicContact CE1-CD2 4.29Å; F1798-F1867 AromaticContact CE2-CD2 3.74Å; F1798-F1867 HydrophobicContact CE2-CD2 3.74Å; F1798-F1867 AromaticContact CE2-CE2 3.89Å; F1798-F1867 HydrophobicContact CE2-CE2 3.89Å; F1798-F1867 AromaticContact CZ-CD2 3.5Å; F1798-F1867 HydrophobicContact CZ-CD2 3.5Å; F1798-F1867 VanDerWaalsContact CZ-CD2 3.5Å; F1798-F1867 AromaticContact CZ-CE2 3.97Å; F1798-F1867 HydrophobicContact CZ-CE2 3.97Å; V1863-F1867 PolarHBondContact O-N 3.48Å; V1863-F1867 VanDerWaalsContact O-N 3.1Å; R1864-F1867 PolarHBondContact O-N 2.9Å; F1867-N1869 PolarHBondContact O-N 3.37Å; F1867-N1869 VanDerWaalsContact O-N 3.09Å
1868L78Confident76.4Confident93 Ų9361 Ų6149%0.48729%0.29SS..THydrogen-bonded Turntrans49.934.7-179.7-58.1177.7000113.4V1786 C1866 V1870V1786-L1868 HydrophobicContact CB-CD2 4.29Å; V1786-L1868 HydrophobicContact CG1-CD2 4.5Å; V1786-L1868 HydrophobicContact CG2-CD2 4.09Å; V1786-L1868 HydrophobicContact CG2-CG 4.36Å; C1866-L1868 PolarHBondContact O-N 3.46Å; C1866-L1868 VanDerWaalsContact O-N 3.13Å; L1868-V1870 PolarHBondContact O-N 3.39Å
1869N75.3Confident74.8Confident33 Ų3359 Ų5918%0.17628%0.281CS..  trans-63.2124.5-174.8-168.1-36.3000111.5P1777 N1865 C1866 F1867 R1871 S1872P1777-N1869 HydrophobicContact CB-CB 4.32Å; P1777-N1869 HydrophobicContact CG-CB 4.27Å; N1865-N1869 WeakPolarHBondContact O-CB 3.47Å; N1865-N1869 PolarHBondContact O-ND2 2.82Å; C1866-N1869 PolarHBondContact O-N 2.94Å; F1867-N1869 PolarHBondContact O-N 3.37Å; F1867-N1869 VanDerWaalsContact O-N 3.09Å; N1869-R1871 PolarHBondContact O-N 2.78Å; N1869-R1871 WeakPolarHBondContact OD1-CB 3.35Å; N1869-R1871 WeakPolarHBondContact OD1-CG 3.49Å; N1869-R1871 PolarHBondContact OD1-N 2.79Å; N1869-S1872 VanDerWaalsContact O-CB 3.28Å; N1869-S1872 WeakPolarHBondContact O-CB 3.37Å; N1869-S1872 PolarHBondContact O-N 3.49Å; N1869-S1872 VanDerWaalsContact O-N 3.08Å; N1869-S1872 PolarHBondContact O-OG 3.02Å
1870V70.8Confident73.1Confident112 Ų11262.9 Ų62.968%0.67930%0.295SS*.Hα-helixtrans-57.9-32.5-179.5-178.50000112.1L1868 S1872 K1873 M1874L1868-V1870 PolarHBondContact O-N 3.39Å; V1870-S1872 PolarHBondContact O-N 3.04Å; V1870-K1873 PolarHBondContact O-N 3.46Å; V1870-K1873 VanDerWaalsContact O-N 3.09Å; V1870-M1874 PolarHBondContact O-N 3.18Å; V1870-M1874 VanDerWaalsContact O-N 3.13Å
1871R67.4Low71.5Confident128 Ų12870.7 Ų70.748%0.48333%0.329SS..Hα-helixtrans-63.1-28.9180-57.8-175.1-164.3177.9-0.5112.6F1775 N1869 M1874 Y1875F1775-R1871 WeakPolarHBondContact O-CB 3.33Å; F1775-R1871 WeakPolarHBondContact O-CD 3.35Å; N1869-R1871 PolarHBondContact O-N 2.78Å; N1869-R1871 WeakPolarHBondContact OD1-CB 3.35Å; N1869-R1871 WeakPolarHBondContact OD1-CG 3.49Å; N1869-R1871 PolarHBondContact OD1-N 2.79Å; R1871-M1874 PolarHBondContact O-N 3.37Å; R1871-Y1875 VanDerWaalsContact O-CB 3.3Å; R1871-Y1875 WeakPolarHBondContact O-CB 3.27Å; R1871-Y1875 PolarHBondContact O-N 2.92Å
1872S64.4Low69.7Low10 Ų1071 Ų717%0.0733%0.331CS..Hα-helixtrans-58.6-47.9172.7-56.60000111.1P1777 N1869 V1870 Y1875 D1876P1777-S1872 WeakPolarHBondContact CG-OG 3.29Å; N1869-S1872 VanDerWaalsContact O-CB 3.28Å; N1869-S1872 WeakPolarHBondContact O-CB 3.37Å; N1869-S1872 PolarHBondContact O-N 3.49Å; N1869-S1872 VanDerWaalsContact O-N 3.08Å; N1869-S1872 PolarHBondContact O-OG 3.02Å; V1870-S1872 PolarHBondContact O-N 3.04Å; S1872-Y1875 PolarHBondContact O-N 3.35Å; S1872-D1876 PolarHBondContact O-N 3.35Å
1873K65.3Low67.9Low158 Ų15873.9 Ų73.969%0.68735%0.347SS*.Hα-helixtrans-65.2-41177.5-73.7-172.6175.1-174.70112.4V1870 Y1875 D1876 Q1877V1870-K1873 PolarHBondContact O-N 3.46Å; V1870-K1873 VanDerWaalsContact O-N 3.09Å; K1873-Y1875 VanDerWaalsContact C-N 3.28Å; K1873-Y1875 PolarHBondContact O-N 3.38Å; K1873-D1876 PolarHBondContact O-N 3.31Å; K1873-Q1877 WeakPolarHBondContact O-CG 3.13Å; K1873-Q1877 PolarHBondContact O-N 2.83Å
1874M63.5Low65.9Low96 Ų9681.9 Ų81.947%0.47338%0.384SS..Hα-helixtrans-65.4-36.1-179.6-164.6177.5175.300111.6V1870 R1871 L1878V1870-M1874 PolarHBondContact O-N 3.18Å; V1870-M1874 VanDerWaalsContact O-N 3.13Å; R1871-M1874 PolarHBondContact O-N 3.37Å; M1874-L1878 PolarHBondContact O-N 2.98Å
1875Y58.7Low64Low14 Ų1479.8 Ų79.86%0.05538%0.38CS..Hα-helixtrans-70.5-42.6174.3-176.6-89.3000112.4F1763 P1769 E1776 R1871 S1872 K1873 Q1877 L1878 Q1879F1763-Y1875 HydrophobicContact CD2-CE1 4.02Å; F1763-Y1875 AromaticContact CE1-CE1 3.95Å; F1763-Y1875 HydrophobicContact CE1-CE1 3.95Å; F1763-Y1875 AromaticContact CE1-CZ 3.76Å; F1763-Y1875 WeakPolarHBondContact CE1-OH 3.2Å; F1763-Y1875 HydrophobicContact CE2-CD1 4.24Å; F1763-Y1875 AromaticContact CE2-CE1 3.29Å; F1763-Y1875 HydrophobicContact CE2-CE1 3.29Å; F1763-Y1875 AromaticContact CE2-CZ 3.99Å; F1763-Y1875 AromaticContact CZ-CE1 3.27Å; F1763-Y1875 HydrophobicContact CZ-CE1 3.27Å; F1763-Y1875 AromaticContact CZ-CZ 3.5Å; F1763-Y1875 WeakPolarHBondContact CZ-OH 3.26Å; P1769-Y1875 WeakPolarHBondContact CD-OH 3.37Å; E1776-Y1875 HydrophobicContact CG-CD1 4.3Å; E1776-Y1875 HydrophobicContact CG-CD2 3.64Å; E1776-Y1875 HydrophobicContact CG-CE2 3.91Å; E1776-Y1875 HydrophobicContact CG-CG 3.83Å; E1776-Y1875 WeakPolarHBondContact OE1-CD1 3.44Å; E1776-Y1875 WeakPolarHBondContact OE1-CE1 3.29Å; E1776-Y1875 WeakPolarHBondContact OE1-CE2 3.21Å; E1776-Y1875 PolarHBondContact OE1-OH 3.48Å; R1871-Y1875 VanDerWaalsContact O-CB 3.3Å; R1871-Y1875 WeakPolarHBondContact O-CB 3.27Å; R1871-Y1875 PolarHBondContact O-N 2.92Å; S1872-Y1875 PolarHBondContact O-N 3.35Å; K1873-Y1875 VanDerWaalsContact C-N 3.28Å; K1873-Y1875 PolarHBondContact O-N 3.38Å; Y1875-Q1877 VanDerWaalsContact C-N 3.26Å; Y1875-Q1877 PolarHBondContact O-N 2.75Å; Y1875-L1878 WeakPolarHBondContact O-CA 3.45Å; Y1875-L1878 WeakPolarHBondContact O-CB 3.26Å; Y1875-L1878 PolarHBondContact O-N 3.5Å; Y1875-Q1879 HydrophobicContact CD1-CG 4.07Å; Y1875-Q1879 HydrophobicContact CE1-CG 3.44Å; Y1875-Q1879 VanDerWaalsContact CE1-CG 3.44Å; Y1875-Q1879 PolarHBondContact O-N 3.45Å; Y1875-Q1879 PolarHBondContact OH-NE2 3.26Å
1876D60.5Low62Low26 Ų2680 Ų8014%0.13939%0.386CS..Hα-helixtrans-58.2-40.6174.9-62.4-23.3000110.9K1780 S1872 K1873 L1878 Q1879 Y1880K1780-D1876 IonicContact NZ-OD1 2.7Å; K1780-D1876 PolarHBondContact NZ-OD1 3.14Å; K1780-D1876 IonicContact NZ-OD2 3.39Å; K1780-D1876 PolarHBondContact NZ-OD2 2.73Å; S1872-D1876 PolarHBondContact O-N 3.35Å; K1873-D1876 PolarHBondContact O-N 3.31Å; D1876-L1878 PolarHBondContact O-N 3.49Å; D1876-Q1879 PolarHBondContact O-N 3.18Å; D1876-Y1880 PolarHBondContact O-N 3.39Å
1877Q63.1Low60.4Low112 Ų11286.5 Ų86.552%0.52341%0.411SS..Hα-helixtrans-61.1-43.3172.7-72.9174.9-11.100112.4K1873 Y1875 Y1880 F1881K1873-Q1877 WeakPolarHBondContact O-CG 3.13Å; K1873-Q1877 PolarHBondContact O-N 2.83Å; Y1875-Q1877 VanDerWaalsContact C-N 3.26Å; Y1875-Q1877 PolarHBondContact O-N 2.75Å; Q1877-Y1880 WeakPolarHBondContact O-CB 3.39Å; Q1877-Y1880 PolarHBondContact O-N 3.49Å; Q1877-F1881 WeakPolarHBondContact O-CD2 3.37Å; Q1877-F1881 PolarHBondContact O-N 3.18Å
1878L60.3Low59.2Low67 Ų6788.4 Ų88.435%0.35142%0.421SS..Hα-helixtrans-62.8-42.1177-107.4154.3000112.4M1874 Y1875 D1876 F1881 Q1882M1874-L1878 PolarHBondContact O-N 2.98Å; Y1875-L1878 WeakPolarHBondContact O-CA 3.45Å; Y1875-L1878 WeakPolarHBondContact O-CB 3.26Å; Y1875-L1878 PolarHBondContact O-N 3.5Å; D1876-L1878 PolarHBondContact O-N 3.49Å; L1878-F1881 PolarHBondContact O-N 3.45Å; L1878-Q1882 WeakPolarHBondContact O-CB 3.45Å; L1878-Q1882 WeakPolarHBondContact O-CG 3.45Å; L1878-Q1882 PolarHBondContact O-N 3.32Å
1879Q58.4Low58.2Low18 Ų1888.2 Ų88.28%0.08442%0.417CS..Hα-helixtrans-62.4-42.2174.5-81.9-77.6-26.200112F1763 P1769 Y1875 D1876 F1881 Q1882 N1883F1763-Q1879 HydrophobicContact CZ-CG 4.23Å; P1769-Q1879 VanDerWaalsContact CD-NE2 3.27Å; P1769-Q1879 VanDerWaalsContact CG-NE2 3.32Å; Y1875-Q1879 HydrophobicContact CD1-CG 4.07Å; Y1875-Q1879 HydrophobicContact CE1-CG 3.44Å; Y1875-Q1879 VanDerWaalsContact CE1-CG 3.44Å; Y1875-Q1879 PolarHBondContact O-N 3.45Å; Y1875-Q1879 PolarHBondContact OH-NE2 3.26Å; D1876-Q1879 PolarHBondContact O-N 3.18Å; Q1879-F1881 VanDerWaalsContact C-N 3.31Å; Q1879-F1881 PolarHBondContact O-N 2.85Å; Q1879-Q1882 PolarHBondContact O-N 2.94Å; Q1879-N1883 PolarHBondContact O-N 3.45Å; Q1879-N1883 PolarHBondContact OE1-ND2 3.01Å
1880Y57Low57.3Low113 Ų11391.2 Ų91.244%0.44343%0.431SS..Hα-helixtrans-58.3-44.5173179-104.4000111.7D1876 Q1877 E1884 I1885D1876-Y1880 PolarHBondContact O-N 3.39Å; Q1877-Y1880 WeakPolarHBondContact O-CB 3.39Å; Q1877-Y1880 PolarHBondContact O-N 3.49Å; Y1880-E1884 VanDerWaalsContact O-CA 3.29Å; Y1880-E1884 WeakPolarHBondContact O-CA 3.45Å; Y1880-E1884 PolarHBondContact O-N 3.33Å; Y1880-I1885 VanDerWaalsContact CA-O 3.27Å; Y1880-I1885 WeakPolarHBondContact CA-O 2.97Å; Y1880-I1885 WeakPolarHBondContact CD2-O 3.44Å
1881F57.1Low56.5Low164 Ų16490 Ų9072%0.71942%0.416SS*.Hα-helixtrans-69.1-33.8178.4-76-62.7000114.1Q1877 L1878 Q1879Q1877-F1881 WeakPolarHBondContact O-CD2 3.37Å; Q1877-F1881 PolarHBondContact O-N 3.18Å; L1878-F1881 PolarHBondContact O-N 3.45Å; Q1879-F1881 VanDerWaalsContact C-N 3.31Å; Q1879-F1881 PolarHBondContact O-N 2.85Å
1882Q52.6Low55.8Low95 Ų9587.6 Ų87.644%0.44441%0.412SS..Hα-helixtrans-93.8-39.4-173.1-73.7-178.8-19.900114L1878 Q1879L1878-Q1882 WeakPolarHBondContact O-CB 3.45Å; L1878-Q1882 WeakPolarHBondContact O-CG 3.45Å; L1878-Q1882 PolarHBondContact O-N 3.32Å; Q1879-Q1882 PolarHBondContact O-N 2.94Å
1883N48.2Very low55.2Low84 Ų8492.8 Ų92.845%0.44944%0.435SS..Hα-helixtrans-115.13-171.2-62.9-36.9000112.5Q1879 I1885Q1879-N1883 PolarHBondContact O-N 3.45Å; Q1879-N1883 PolarHBondContact OE1-ND2 3.01Å; N1883-I1885 HydrophobicContact CB-CD1 3.65Å; N1883-I1885 HydrophobicContact CB-CG1 3.67Å; N1883-I1885 PolarHBondContact O-N 3.25Å; N1883-I1885 VanDerWaalsContact O-N 3.08Å
1884E45.9Very low54.5Low168 Ų16888.1 Ų88.179%0.78542%0.417SS*.  trans51.228.2-172.7-62.3-175.4162.800112.7Y1880 P1886Y1880-E1884 VanDerWaalsContact O-CA 3.29Å; Y1880-E1884 WeakPolarHBondContact O-CA 3.45Å; Y1880-E1884 PolarHBondContact O-N 3.33Å; E1884-P1886 WeakPolarHBondContact O-CD 3.4Å
1885I46.9Very low53.8Low60 Ų6087.5 Ų87.531%0.30841%0.412SS..  trans-80.7109176.7-64.2176.5000106.4D1760 Y1880 N1883 Y1887D1760-I1885 HydrophobicContact CB-CG2 3.96Å; D1760-I1885 WeakPolarHBondContact OD2-CG2 3.29Å; Y1880-I1885 VanDerWaalsContact CA-O 3.27Å; Y1880-I1885 WeakPolarHBondContact CA-O 2.97Å; Y1880-I1885 WeakPolarHBondContact CD2-O 3.44Å; N1883-I1885 HydrophobicContact CB-CD1 3.65Å; N1883-I1885 HydrophobicContact CB-CG1 3.67Å; N1883-I1885 PolarHBondContact O-N 3.25Å; N1883-I1885 VanDerWaalsContact O-N 3.08Å; I1885-Y1887 PolarHBondContact O-N 3.22Å
1886P43.4Very low53.4Low82 Ų8293.7 Ų93.753%0.53244%0.442SS..  trans-54.8132.9178.5-19.933.4000109.8D1760 E1884D1760-P1886 WeakPolarHBondContact CB-O 3.4Å; E1884-P1886 WeakPolarHBondContact O-CD 3.4Å
1887Y47.9Very low52.8Low135 Ų13599.8 Ų99.853%0.52947%0.47SS..  trans-680-17861.6-97.2000112.4D1758 F1759 D1760 I1885D1758-Y1887 CarbonylContact C-O 3.12Å; F1759-Y1887 WeakPolarHBondContact CA-O 3.45Å; F1759-Y1887 WeakPolarHBondContact CA-OXT 3.07Å; F1759-Y1887 HydrophobicContact CE1-CD2 4.47Å; F1759-Y1887 PolarHBondContact N-O 2.87Å; D1760-Y1887 PolarHBondContact N-OXT 3.08Å; I1885-Y1887 PolarHBondContact O-N 3.22Å

Retrieved 1,887 of 1,887 residues in 3955.5 ms (Link to these results)

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