A0A3Q0KT50_SCHMA Loading...

Centrosomal protein of 70 kDa

AlphaFold DB , UniProt , Accession A0A3Q0KT50, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,483 aa.

>A0A3Q0KT50_SCHMA|A0A3Q0KT50
MRQLADFSSIDSSGSFEILVHVNPQNLPLMISVGCVQGGACLSSDLENSKACSQASCRRVANHCSNLLDAVLIFKTWFIQRQSDLPSTNPETDIKSNGDVSILPYNNITNGQQPVLLNQINQHSSYVERDWVMMHAKRTESQLDRLRNSVVGMRAQLQAGLRHKLECEQLRRDLEMHKDTITHYQNIINEGNRLRDDLREELLRVRKEAAIARSRLASATTQRPVNSPVTSTPHAPNHHHPFDEADKMATTMMVMTDHAELSQLHDLPPQDAIIQLRTQIEYRIRLSESLKSEVKSLRETIRGMLEKEVAQSHIIDSIRTEFKTLIEPFWRLLQKNYDLNQMRSLNAVLNIHCITRIAKLLTIPIPDHVTMELSQFTDCDPVVSDNKSQKLDKKASKSVNSSTVAKSPKKDFNKSNENIHLINSRAKPSIDQKAFEMDKSSNKTSTVKRDKPSINSDKVDLDEFGQDEIIKNDPPCEIDKVELMSDYSSSESSRCGSLKFPDISSSSSDHDDDGDGTFNNNDKNKSSNTNNNDNDNNNGNYNNDKASPESSEDIFQDQNVIIQSPLHQSNITTNESNGLKGNSINISSLSCNETSNNSFHSPVVLNDVQPDENTVSGLQSRHVKSDSKSLKQDLIISEVSSGGNVTEKNKGENEMTNCSNAKTLNSSSISKSSEKSHKMVTRSRLKTNSQVIDSSLNTSSFHSNDNFPINLCEKSSDSKAKLTLEETSYLETSTKPLVQQIKKLENKRSKTNVTLDDNVSSRVLTCPSTLSRSSNCPALSLSASLKSDVQLFSLLSDKYSSDILRWCDRLSSSSFLNEIPKICSSGQISSTSTNSKTHLQVPVVTVEAPQTHSSPIKNKQLCKLNDDEKINRKRKVTSESPGGKKMVLDCLSTDVSLPKTANHMITDNTKPDHQYDEIQQKCINFLLSDKDSIKTTPTDLSNELKQTNMPIQIILSSLNAILTSFNYLNCPLLLKSMDEKFVSLCHSVSVDHQIDMLHCYQQSTEWLLNTCNKFTEITQYSIACGVIFKLLSTNLDLVQVEWSRQFLIQYLSHLFHQAFTQQNFALYLMPHIIDNCLIAFPNLWCNVELIKDEIEFHSLTPAVVDNNDHFSFSYITTALKTLLAWQEAREARNACLKSNVQSNSNQVAVYRRLRQKGWLPAKASESSTPIEIHNFAFSQQAHRIRCLCLRLVDTCLNVCRDHITDDSSTHMTILSKTVVDLDIIYSLRLVLSAMAFVVGEEAMIGFHDEQPSNVSSRSRNHQRTRRYRQVERHRQHGLLGWLLTGRLIPWLTKCLKMKDLSSNNDILSLISRLSCLITDIIIYGSHLFKTNNPGKQCNSLKQLLFDAGNQLLNILNHNKSKEIMNNQLLFTYITCSIRLIAFNPKLIIQFIGKLPLEIIVKFIEQINHNELFSYLWPSSSLSSSSSSSLSTISSITHSYSLKDLIEQSISLVNNCNNNDSELSAELLQQYTQTCQIILTKLSL
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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
1M24.7Very low30.3Very low209 Ų209151.1 Ų151.1100%1.0379%0.785SS**  0-100.20-64.3-47.6-170.700111.2Q3 L4M1-Q3 VanDerWaalsContact C-N 3.35Å; M1-Q3 PolarHBondContact O-N 3.32Å; M1-Q3 VanDerWaalsContact O-N 3.13Å; M1-L4 PolarHBondContact O-N 2.69Å; M1-L4 VanDerWaalsContact O-N 3.07Å
2R26.3Very low30.1Very low234 Ų234147.8 Ų147.888%0.88379%0.785SS**G310 helixtrans-53-40-169-86.2-174.2175.1160.9-0.1116L4 A5R2-L4 PolarHBondContact O-N 2.67Å; R2-A5 PolarHBondContact O-N 2.97Å
3Q33.6Very low29.9Very low177 Ų177145.8 Ų145.883%0.82779%0.791SS**G310 helixtrans-67.5-0.5-179.7-74.5172.6-38.700115.8M1M1-Q3 VanDerWaalsContact C-N 3.35Å; M1-Q3 PolarHBondContact O-N 3.32Å; M1-Q3 VanDerWaalsContact O-N 3.13Å
4L29Very low29.7Very low151 Ų151139.5 Ų139.579%0.79178%0.776SS**G310 helixtrans-96.2-1.6174.3-76.9166.5000113.9M1 R2M1-L4 PolarHBondContact O-N 2.69Å; M1-L4 VanDerWaalsContact O-N 3.07Å; R2-L4 PolarHBondContact O-N 2.67Å
5A35.6Very low29.4Very low70 Ų70138.5 Ų138.558%0.57978%0.783SS**SBendtrans-84.6-34.2-176.300000114.1R2R2-A5 PolarHBondContact O-N 2.97Å
6D34Very low29.1Very low130 Ų130140.8 Ų140.870%0.69578%0.782SS**SBendtrans-91-2.6-163.7-57.3-40.9000114.6S8D6-S8 PolarHBondContact O-N 3.11Å; D6-S8 VanDerWaalsContact O-N 3.17Å
7F27.2Very low28.8Very low171 Ų171143.8 Ų143.875%0.7579%0.788SS**THydrogen-bonded Turntrans-84.424.7-177.4-83.1-77.3000114.9
8S33.3Very low28.5Very low104 Ų104143.8 Ų143.873%0.72779%0.785SS**THydrogen-bonded Turntrans-87.6-8.6176.9560000114.4D6 I10D6-S8 PolarHBondContact O-N 3.11Å; D6-S8 VanDerWaalsContact O-N 3.17Å; S8-I10 PolarHBondContact O-N 3.1Å; S8-I10 VanDerWaalsContact O-N 3.16Å
9S32.1Very low28.2Very low103 Ų103144.2 Ų144.272%0.7279%0.786SS**  trans-82.386.8171.3620000111D11S9-D11 PolarHBondContact O-N 3.39Å
10I26.8Very low28.1Very low159 Ų159142.4 Ų142.482%0.81578%0.779SS**  trans-69.4119.4175.1-61.7165.4000109.4S8S8-I10 PolarHBondContact O-N 3.1Å; S8-I10 VanDerWaalsContact O-N 3.16Å
11D30.4Very low27.8Very low154 Ų154144 Ų14482%0.82478%0.781SS**  trans-143.5142.3155.8-140.9-24000111.6S9 S13S9-D11 PolarHBondContact O-N 3.39Å; D11-S13 PolarHBondContact O-N 3.05Å
12S28.3Very low27.9Very low112 Ų112139.5 Ų139.578%0.78377%0.765SS**SBendtrans-106.465.9-147.659.80000115.8
13S26.7Very low27.9Very low122 Ų122134.2 Ų134.285%0.85375%0.754SS**  trans-159.866.5168.359.30000114.8D11D11-S13 PolarHBondContact O-N 3.05Å
14G27.8Very low27.7Very low57 Ų57130.6 Ų130.659%0.58875%0.746SS**  trans-146.8115.3174.300000113.2F16G14-F16 PolarHBondContact O-N 3.27Å
15S24.9Very low27.6Very low125 Ų125131.5 Ų131.587%0.87475%0.746SS**  trans-83.2104.7171.451.20000110
16F24.4Very low27.3Very low175 Ų175135.3 Ų135.377%0.76876%0.757SS**  trans-90.3115.1177.6-76.8-89.2000111.5G14 I18G14-F16 PolarHBondContact O-N 3.27Å; F16-I18 PolarHBondContact O-N 3.07Å
17E23.5Very low26.8Very low192 Ų192136.9 Ų136.990%0.89777%0.765SS**  trans-77.5107.5165.3-68.4-172.8129.400109.5L19E17-L19 PolarHBondContact O-N 2.81Å
18I24.5Very low26.7Very low143 Ų143134.2 Ų134.273%0.73376%0.764SS**  trans-84.896.6174-54.3-179.7000108.2F16 V20F16-I18 PolarHBondContact O-N 3.07Å; I18-V20 VanDerWaalsContact C-N 3.32Å; I18-V20 HydrophobicContact CG2-CG2 3.81Å; I18-V20 PolarHBondContact O-N 3.13Å
19L22.6Very low26.2Very low152 Ų152137 Ų13780%0.79677%0.77SS**  trans-76.678.8-178.5-162.1122.3000111.3E17 H21E17-L19 PolarHBondContact O-N 2.81Å; L19-H21 PolarHBondContact O-N 3.28Å
20V25.5Very low25.8Very low107 Ų107140.7 Ų140.765%0.64878%0.778SS**  trans-73.2108.7-179.3-173.60000110.7I18 V22I18-V20 VanDerWaalsContact C-N 3.32Å; I18-V20 HydrophobicContact CG2-CG2 3.81Å; I18-V20 PolarHBondContact O-N 3.13Å; V20-V22 HydrophobicContact CG1-CG2 3.84Å; V20-V22 PolarHBondContact O-N 3.04Å
21H23Very low25.6Very low178 Ų178140.3 Ų140.382%0.82478%0.776SS**  trans-78.482.5178.6-134.9-70.4000110.8L19 N23L19-H21 PolarHBondContact O-N 3.28Å; H21-N23 PolarHBondContact O-N 3.06Å
22V26Very low25.2Very low114 Ų114137.5 Ų137.569%0.69177%0.768SS**  trans-76.3118.8-178.7-175.50000110.8V20V20-V22 HydrophobicContact CG1-CG2 3.84Å; V20-V22 PolarHBondContact O-N 3.04Å
23N26.4Very low25.1Very low122 Ų122137.9 Ų137.965%0.65277%0.766SS**  trans-74.1119.9175.4-174.23.3000110H21 Q25H21-N23 PolarHBondContact O-N 3.06Å; N23-Q25 VanDerWaalsContact C-N 3.26Å; N23-Q25 PolarHBondContact O-N 3.25Å
24P29.2Very low24.9Very low101 Ų101135.1 Ų135.166%0.65676%0.757SS**THydrogen-bonded Turntrans-75.58.7-16028.7-37.8000117.2N26P24-N26 PolarHBondContact O-N 2.82Å
25Q28.2Very low24.8Very low170 Ų170137.7 Ų137.779%0.79476%0.764SS**THydrogen-bonded Turntrans-84.80.4-172.3-72.2-170.8-28.200116.1N23N23-Q25 VanDerWaalsContact C-N 3.26Å; N23-Q25 PolarHBondContact O-N 3.25Å
26N27.5Very low24.9Very low151 Ų151137.9 Ų137.981%0.80776%0.76SS**  trans-120.6100.5174.3-81.7-40.9000111.2P24 P28P24-N26 PolarHBondContact O-N 2.82Å; N26-P28 WeakPolarHBondContact O-CD 3.41Å
27L25Very low25.1Very low163 Ų163139.1 Ų139.185%0.85377%0.768SS**  trans-100.9102.3170.9-85.186.9000111.9
28P24.8Very low25.4Very low114 Ų114133.9 Ų133.974%0.7477%0.765SS**  trans-94.8102.3159.733.2-29000110.6N26 M30N26-P28 WeakPolarHBondContact O-CD 3.41Å; P28-M30 PolarHBondContact O-N 3.26Å
29L22.6Very low25.8Very low162 Ų162130.2 Ų130.285%0.84876%0.763SS**  trans32.786.4157.6-76.9158.4000116.9I31L29-I31 VanDerWaalsContact C-N 3.29Å; L29-I31 PolarHBondContact O-N 3.27Å
30M24Very low26.6Very low181 Ų181126.7 Ų126.789%0.89276%0.756SS**  trans-63.791.2156.3-90.6-176.358.200109.9P28 S32P28-M30 PolarHBondContact O-N 3.26Å; M30-S32 VanDerWaalsContact C-N 3.29Å; M30-S32 PolarHBondContact O-N 2.9Å
31I22.8Very low27.6Very low152 Ų152125.5 Ų125.578%0.77975%0.751SS**  trans-64.898.8158.1-61.4179.2000106.2L29 V33L29-I31 VanDerWaalsContact C-N 3.29Å; L29-I31 PolarHBondContact O-N 3.27Å; I31-V33 PolarHBondContact O-N 2.83Å
32S22.2Very low28.9Very low94 Ų94120.7 Ų120.766%0.65773%0.731SS**  trans-60.6109.1-179.8-172.90000109.3M30 G34M30-S32 VanDerWaalsContact C-N 3.29Å; M30-S32 PolarHBondContact O-N 2.9Å; S32-G34 PolarHBondContact O-N 3.36Å
33V25Very low30.2Very low121 Ų121118.4 Ų118.473%0.73372%0.72SS**  trans-62.6107.3164.3175.50000105.7I31 C35I31-V33 PolarHBondContact O-N 2.83Å; V33-C35 VanDerWaalsContact C-N 3.29Å; V33-C35 PolarHBondContact O-N 2.83Å
34G24Very low31.7Very low64 Ų64114.6 Ų114.666%0.6670%0.703SS**  trans-61.785-172.900000112.4S32 V36S32-G34 PolarHBondContact O-N 3.36Å; G34-V36 PolarHBondContact O-N 3.28Å
35C25.1Very low32.8Very low110 Ų110111.4 Ų111.474%0.74368%0.681SS**  trans-69.179.3172.3-77.50000109.5V33 Q37V33-C35 VanDerWaalsContact C-N 3.29Å; V33-C35 PolarHBondContact O-N 2.83Å; C35-Q37 PolarHBondContact O-N 2.91Å
36V27.6Very low34.2Very low129 Ų129104.1 Ų104.178%0.78265%0.647SS**  trans-53.8106.2170.9179.80000108.2G34 G38 G39G34-V36 PolarHBondContact O-N 3.28Å; V36-G38 PolarHBondContact O-N 2.73Å; V36-G39 PolarHBondContact O-N 2.77Å
37Q27.9Very low36.2Very low202 Ų202103.3 Ų103.394%0.94464%0.638SS**THydrogen-bonded Turntrans-62.6105-173.8-74.1174.6-37.500109.7C35C35-Q37 PolarHBondContact O-N 2.91Å
38G29.4Very low38Very low81 Ų81100.8 Ų100.884%0.83563%0.626SS**THydrogen-bonded Turntrans148.4-23.3-172.100000113.8V36V36-G38 PolarHBondContact O-N 2.73Å
39G33.4Very low39.8Very low67 Ų6797.2 Ų97.269%0.69160%0.603SS**SBendtrans-73.2131.2170.600000112.5V36V36-G39 PolarHBondContact O-N 2.77Å
40A39.4Very low41.8Very low77 Ų7793.2 Ų93.264%0.63658%0.579SS**PPolyproline II helixtrans-65.6138.6174.300000111.2L42A40-L42 PolarHBondContact O-N 2.86Å
41C46.2Very low43.8Very low82 Ų8288.6 Ų88.655%0.55457%0.57SS**PPolyproline II helixtrans-73.4129.3-174.6-166.10000111.5S43 S44 D45C41-S43 PolarHBondContact O-N 2.9Å; C41-S43 PolarHBondContact SG-OG 3.07Å; C41-S43 VanDerWaalsContact SG-OG 3.38Å; C41-S44 PolarHBondContact O-N 2.99Å; C41-S44 PolarHBondContact O-OG 3.41Å; C41-D45 PolarHBondContact O-N 3.31Å
42L51.2Low46Very low78 Ų7883 Ų8341%0.40854%0.544SS..Hα-helixtrans-56.1-36.9-172.3-171.573.6000113A40 D45 L46 L68A40-L42 PolarHBondContact O-N 2.86Å; L42-D45 PolarHBondContact O-N 2.94Å; L42-L46 PolarHBondContact O-N 2.94Å; L42-L68 HydrophobicContact CD2-CD1 4.27Å
43S51.8Low48.1Very low65 Ų6583.9 Ų83.946%0.45555%0.55SS..Hα-helixtrans-59.3-46.9176.548.50000112.2C41 D45 L46 E47C41-S43 PolarHBondContact O-N 2.9Å; C41-S43 PolarHBondContact SG-OG 3.07Å; C41-S43 VanDerWaalsContact SG-OG 3.38Å; S43-D45 VanDerWaalsContact C-N 3.33Å; S43-D45 PolarHBondContact O-N 2.81Å; S43-L46 CarbonylContact O-C 3.59Å; S43-L46 WeakPolarHBondContact O-CA 3.44Å; S43-L46 VanDerWaalsContact O-CB 3.27Å; S43-L46 WeakPolarHBondContact O-CB 3.15Å; S43-L46 PolarHBondContact O-N 2.76Å; S43-E47 PolarHBondContact O-N 3.27Å
44S58.1Low49.8Very low43 Ų4382.4 Ų82.430%0.30154%0.535SS..Hα-helixtrans-64.1-36178.870.90000112.6C41 L46 N48C41-S44 PolarHBondContact O-N 2.99Å; C41-S44 PolarHBondContact O-OG 3.41Å; S44-L46 VanDerWaalsContact C-N 3.33Å; S44-N48 WeakPolarHBondContact O-CB 3.42Å; S44-N48 PolarHBondContact O-N 3.41Å; S44-N48 VanDerWaalsContact O-N 3.08Å; S44-N48 PolarHBondContact O-ND2 2.98Å
45D53.5Low51.7Low33 Ų3381.9 Ų81.918%0.17652%0.524CS..Hα-helixtrans-69.2-32.9172.7-87.8-20.1000111.9C41 L42 S43 S49 R154C41-D45 PolarHBondContact O-N 3.31Å; L42-D45 PolarHBondContact O-N 2.94Å; S43-D45 VanDerWaalsContact C-N 3.33Å; S43-D45 PolarHBondContact O-N 2.81Å; D45-S49 VanDerWaalsContact O-CB 3.3Å; D45-S49 WeakPolarHBondContact O-CB 3.35Å; D45-S49 PolarHBondContact O-N 2.88Å; D45-S49 VanDerWaalsContact O-N 3.07Å; D45-S49 PolarHBondContact O-OG 3.31Å; D45-R154 IonicContact OD1-CZ 3.19Å; D45-R154 IonicContact OD1-NH1 3.72Å; D45-R154 PolarHBondContact OD1-NH1 3.49Å; D45-R154 IonicContact OD1-NH2 2.79Å; D45-R154 PolarHBondContact OD1-NH2 3.3Å; D45-R154 IonicContact OD2-CZ 3.66Å; D45-R154 IonicContact OD2-NH1 2.7Å; D45-R154 PolarHBondContact OD2-NH1 2.96Å; D45-R154 IonicContact OD2-NH2 3.6Å
46L57.6Low53.1Low18 Ų1879.1 Ų79.19%0.09451%0.506CS..Hα-helixtrans-67.5-46.1174.2-128.673.9000112.1L42 S43 S44 S49 K50 C64L42-L46 PolarHBondContact O-N 2.94Å; S43-L46 CarbonylContact O-C 3.59Å; S43-L46 WeakPolarHBondContact O-CA 3.44Å; S43-L46 VanDerWaalsContact O-CB 3.27Å; S43-L46 WeakPolarHBondContact O-CB 3.15Å; S43-L46 PolarHBondContact O-N 2.76Å; S44-L46 VanDerWaalsContact C-N 3.33Å; L46-S49 CarbonylContact O-C 3.57Å; L46-S49 WeakPolarHBondContact O-CB 3.41Å; L46-S49 PolarHBondContact O-N 3.33Å; L46-S49 VanDerWaalsContact O-N 3.13Å; L46-K50 WeakPolarHBondContact O-CG 3.33Å; L46-K50 PolarHBondContact O-N 3.34Å; L46-C64 HydrophobicContact CD1-CB 3.91Å
47E68Low54.3Low133 Ų13373.6 Ų73.662%0.62147%0.473SS*.Hα-helixtrans-62.5-47.3177.4-71.1-178.4133.800111.6S43 S49 K50 A51S43-E47 PolarHBondContact O-N 3.27Å; E47-S49 PolarHBondContact O-N 3.21Å; E47-K50 PolarHBondContact O-N 3.04Å; E47-K50 VanDerWaalsContact O-N 3.14Å; E47-A51 WeakPolarHBondContact O-CB 3.17Å; E47-A51 PolarHBondContact O-N 2.91Å
48N63.8Low55.9Low111 Ų11168.7 Ų68.759%0.59445%0.446SS*.Hα-helixtrans-57.2-34.6172.9-80.2-64.1000112.1S44 C52S44-N48 WeakPolarHBondContact O-CB 3.42Å; S44-N48 PolarHBondContact O-N 3.41Å; S44-N48 VanDerWaalsContact O-N 3.08Å; S44-N48 PolarHBondContact O-ND2 2.98Å; N48-C52 PolarHBondContact O-N 2.94Å
49S62.6Low57.5Low38 Ų3873.7 Ų73.727%0.26644%0.44SS..Hα-helixtrans-77.9-33.4177.4-580000113.2D45 L46 E47 C52D45-S49 VanDerWaalsContact O-CB 3.3Å; D45-S49 WeakPolarHBondContact O-CB 3.35Å; D45-S49 PolarHBondContact O-N 2.88Å; D45-S49 VanDerWaalsContact O-N 3.07Å; D45-S49 PolarHBondContact O-OG 3.31Å; L46-S49 CarbonylContact O-C 3.57Å; L46-S49 WeakPolarHBondContact O-CB 3.41Å; L46-S49 PolarHBondContact O-N 3.33Å; L46-S49 VanDerWaalsContact O-N 3.13Å; E47-S49 PolarHBondContact O-N 3.21Å; S49-C52 VanDerWaalsContact O-CB 3.24Å; S49-C52 WeakPolarHBondContact O-CB 3.49Å; S49-C52 PolarHBondContact O-N 2.69Å
50K64.3Low58.6Low79 Ų7972.2 Ų72.234%0.34342%0.417SS..Hα-helixtrans-67.2-35.6170.2-73.1178.8179.3176.30111.5L46 E47 C52 R58 A61 S65L46-K50 WeakPolarHBondContact O-CG 3.33Å; L46-K50 PolarHBondContact O-N 3.34Å; E47-K50 PolarHBondContact O-N 3.04Å; E47-K50 VanDerWaalsContact O-N 3.14Å; K50-C52 VanDerWaalsContact C-N 3.28Å; K50-C52 PolarHBondContact O-N 3.13Å; K50-R58 WeakPolarHBondContact O-CD 3.34Å; K50-R58 VanDerWaalsContact O-CG 3.29Å; K50-R58 WeakPolarHBondContact O-CG 3.32Å; K50-A61 HydrophobicContact CG-CB 3.77Å; K50-S65 PolarHBondContact NZ-OG 2.89Å
51A66.8Low59.7Low83 Ų8368.7 Ų68.769%0.68639%0.388SS*.SBendtrans-75.8-10.7174.800000114E47E47-A51 WeakPolarHBondContact O-CB 3.17Å; E47-A51 PolarHBondContact O-N 2.91Å
52C68Low60.8Low36 Ų3668.6 Ų68.624%0.24338%0.382CS..  trans-61.7139.4-177.4-172.40000112.2N48 S49 K50 Q54 C57 R58N48-C52 PolarHBondContact O-N 2.94Å; S49-C52 VanDerWaalsContact O-CB 3.24Å; S49-C52 WeakPolarHBondContact O-CB 3.49Å; S49-C52 PolarHBondContact O-N 2.69Å; K50-C52 VanDerWaalsContact C-N 3.28Å; K50-C52 PolarHBondContact O-N 3.13Å; C52-Q54 VanDerWaalsContact C-N 3.25Å; C52-Q54 PolarHBondContact O-N 3.23Å; C52-C57 HydrophobicContact CB-CB 3.65Å; C52-C57 VanDerWaalsContact SG-SG 3.66Å; C52-R58 WeakPolarHBondContact O-CD 3.41Å; C52-R58 VanDerWaalsContact O-CG 3.32Å; C52-R58 WeakPolarHBondContact O-CG 3.09Å; C52-R58 PolarHBondContact O-NH1 3.42Å
53S66.1Low61.3Low111 Ų11169.7 Ų69.778%0.77639%0.385SS*.SBendtrans-65.8-23.2179.758.80000113.9R58S53-R58 PolarHBondContact O-NH1 3.31Å
54Q60.3Low61.5Low91 Ų9167.3 Ų67.343%0.42537%0.368SS..SBendtrans-83.9131.9179.4-60.6-169.49.700113.2C52 S56 C57 R58C52-Q54 VanDerWaalsContact C-N 3.25Å; C52-Q54 PolarHBondContact O-N 3.23Å; Q54-S56 VanDerWaalsContact C-N 3.27Å; Q54-S56 PolarHBondContact O-N 2.94Å; Q54-S56 PolarHBondContact OE1-OG 3.3Å; Q54-C57 HydrophobicContact CB-CB 4.45Å; Q54-C57 PolarHBondContact O-N 3.4Å; Q54-R58 PolarHBondContact O-N 3.37Å
55A65.3Low61.9Low53 Ų5366 Ų6644%0.43836%0.359SS..Hα-helixtrans-72.2-13.6-17900000114.8R59A55-R59 WeakPolarHBondContact O-CG 3.47Å; A55-R59 PolarHBondContact O-N 2.97Å; A55-R59 PolarHBondContact O-NE 3.28Å; A55-R59 VanDerWaalsContact O-NE 3.12Å
56S54.2Low62.5Low52 Ų5269.5 Ų69.536%0.36438%0.377SS..Hα-helixtrans-68.2-54.3167.343.90000110.6Q54 R58 R59 V60Q54-S56 VanDerWaalsContact C-N 3.27Å; Q54-S56 PolarHBondContact O-N 2.94Å; Q54-S56 PolarHBondContact OE1-OG 3.3Å; S56-R58 PolarHBondContact O-N 2.85Å; S56-R59 PolarHBondContact O-N 3.45Å; S56-R59 VanDerWaalsContact O-N 3.15Å; S56-V60 PolarHBondContact O-N 3.3Å; S56-V60 VanDerWaalsContact O-N 3.08Å
57C52Low62.5Low13 Ų1369.8 Ų69.89%0.08838%0.379CS..Hα-helixtrans-56.6-47.3-178.9-59.50000111.7C52 Q54 R59 V60 A61 L157C52-C57 HydrophobicContact CB-CB 3.65Å; C52-C57 VanDerWaalsContact SG-SG 3.66Å; Q54-C57 HydrophobicContact CB-CB 4.45Å; Q54-C57 PolarHBondContact O-N 3.4Å; C57-R59 PolarHBondContact O-N 2.71Å; C57-V60 PolarHBondContact O-N 2.68Å; C57-A61 WeakPolarHBondContact O-CB 3.32Å; C57-A61 PolarHBondContact O-N 2.74Å; C57-L157 WeakPolarHBondContact SG-CD1 3.44Å
58R63.1Low62.3Low98 Ų9866.3 Ų66.337%0.3736%0.364SS..Hα-helixtrans-63.1-39.1178-60.4-162.5-63.1-84.73.3113.2K50 C52 S53 Q54 S56 A61 N62K50-R58 WeakPolarHBondContact O-CD 3.34Å; K50-R58 VanDerWaalsContact O-CG 3.29Å; K50-R58 WeakPolarHBondContact O-CG 3.32Å; C52-R58 WeakPolarHBondContact O-CD 3.41Å; C52-R58 VanDerWaalsContact O-CG 3.32Å; C52-R58 WeakPolarHBondContact O-CG 3.09Å; C52-R58 PolarHBondContact O-NH1 3.42Å; S53-R58 PolarHBondContact O-NH1 3.31Å; Q54-R58 PolarHBondContact O-N 3.37Å; S56-R58 PolarHBondContact O-N 2.85Å; R58-A61 PolarHBondContact O-N 2.93Å; R58-N62 WeakPolarHBondContact O-CB 3.46Å; R58-N62 VanDerWaalsContact O-CG 3.28Å; R58-N62 PolarHBondContact O-N 3.42Å; R58-N62 PolarHBondContact O-OD1 3.01Å
59R62.5Low62.4Low186 Ų18664.3 Ų64.370%0.70235%0.354SS*.Hα-helixtrans-63.7-44175.9-83.7-174.8-73.3168.9-6111.9A55 S56 C57 H63A55-R59 WeakPolarHBondContact O-CG 3.47Å; A55-R59 PolarHBondContact O-N 2.97Å; A55-R59 PolarHBondContact O-NE 3.28Å; A55-R59 VanDerWaalsContact O-NE 3.12Å; S56-R59 PolarHBondContact O-N 3.45Å; S56-R59 VanDerWaalsContact O-N 3.15Å; C57-R59 PolarHBondContact O-N 2.71Å; R59-H63 WeakPolarHBondContact O-CB 3.13Å; R59-H63 PolarHBondContact O-N 2.98Å
60V56.2Low62.1Low36 Ų3665 Ų6522%0.21836%0.362CS..Hα-helixtrans-65.9-45.2177.2175.60000111S56 C57 N62 H63 C64 V150 M153S56-V60 PolarHBondContact O-N 3.3Å; S56-V60 VanDerWaalsContact O-N 3.08Å; C57-V60 PolarHBondContact O-N 2.68Å; V60-N62 VanDerWaalsContact C-N 3.35Å; V60-N62 PolarHBondContact O-N 3.24Å; V60-H63 PolarHBondContact O-N 2.69Å; V60-C64 WeakPolarHBondContact O-CB 3.42Å; V60-C64 PolarHBondContact O-N 3Å; V60-C64 PolarHBondContact O-SG 3.47Å; V60-V150 HydrophobicContact CG1-CG2 3.63Å; V60-M153 HydrophobicContact CB-CE 4.37Å; V60-M153 HydrophobicContact CG1-CE 3.7Å; V60-M153 HydrophobicContact CG2-CE 3.85Å; V60-M153 HydrophobicContact CG2-SD 3.89Å
61A62.4Low61.7Low3 Ų363 Ų633%0.02536%0.356CS..Hα-helixtrans-63-38.8178.800000112.6K50 C57 R58 S65K50-A61 HydrophobicContact CG-CB 3.77Å; C57-A61 WeakPolarHBondContact O-CB 3.32Å; C57-A61 PolarHBondContact O-N 2.74Å; R58-A61 PolarHBondContact O-N 2.93Å; A61-S65 WeakPolarHBondContact O-CB 3.46Å; A61-S65 PolarHBondContact O-N 3.34Å
62N70Confident61.5Low81 Ų8163.7 Ų63.743%0.43335%0.348SS..Hα-helixtrans-67-45.9172.9-74.14.6000111.5R58 V60 C64 S65 N66R58-N62 WeakPolarHBondContact O-CB 3.46Å; R58-N62 VanDerWaalsContact O-CG 3.28Å; R58-N62 PolarHBondContact O-N 3.42Å; R58-N62 PolarHBondContact O-OD1 3.01Å; V60-N62 VanDerWaalsContact C-N 3.35Å; V60-N62 PolarHBondContact O-N 3.24Å; N62-C64 VanDerWaalsContact C-N 3.31Å; N62-C64 PolarHBondContact O-N 3.08Å; N62-S65 WeakPolarHBondContact O-CA 3.17Å; N62-S65 VanDerWaalsContact O-CB 3.26Å; N62-S65 WeakPolarHBondContact O-CB 3.48Å; N62-S65 PolarHBondContact O-N 2.91Å; N62-N66 PolarHBondContact O-N 3.43Å; N62-N66 PolarHBondContact O-OD1 3.4Å
63H61.9Low61.2Low101 Ų10167.7 Ų67.747%0.46837%0.365SS..Hα-helixtrans-59.2-42.5177.2-177.440.8000112.2R59 V60 S65 N66 L67R59-H63 WeakPolarHBondContact O-CB 3.13Å; R59-H63 PolarHBondContact O-N 2.98Å; V60-H63 PolarHBondContact O-N 2.69Å; H63-S65 VanDerWaalsContact C-N 3.32Å; H63-S65 PolarHBondContact O-N 3.34Å; H63-N66 PolarHBondContact O-N 3.46Å; H63-L67 WeakPolarHBondContact O-CD1 3.26Å; H63-L67 PolarHBondContact O-N 3.23Å; H63-L67 VanDerWaalsContact O-N 3.1Å
64C54.1Low60.8Low15 Ų1565.6 Ų65.610%0.10134%0.342CS..Hα-helixtrans-67-31175-62.30000112.9L46 V60 N62 L68L46-C64 HydrophobicContact CD1-CB 3.91Å; V60-C64 WeakPolarHBondContact O-CB 3.42Å; V60-C64 PolarHBondContact O-N 3Å; V60-C64 PolarHBondContact O-SG 3.47Å; N62-C64 VanDerWaalsContact C-N 3.31Å; N62-C64 PolarHBondContact O-N 3.08Å; C64-L68 PolarHBondContact O-N 2.78Å; C64-L68 VanDerWaalsContact O-N 3.09Å
65S67.8Low60.6Low15 Ų1567.4 Ų67.411%0.10535%0.349CS..Hα-helixtrans-62.7-59171.3-161.60000109.8K50 A61 N62 H63 L67 L68 D69K50-S65 PolarHBondContact NZ-OG 2.89Å; A61-S65 WeakPolarHBondContact O-CB 3.46Å; A61-S65 PolarHBondContact O-N 3.34Å; N62-S65 WeakPolarHBondContact O-CA 3.17Å; N62-S65 VanDerWaalsContact O-CB 3.26Å; N62-S65 WeakPolarHBondContact O-CB 3.48Å; N62-S65 PolarHBondContact O-N 2.91Å; H63-S65 VanDerWaalsContact C-N 3.32Å; H63-S65 PolarHBondContact O-N 3.34Å; S65-L67 PolarHBondContact O-N 2.74Å; S65-L68 CarbonylContact O-C 3.59Å; S65-L68 WeakPolarHBondContact O-CA 3.37Å; S65-L68 WeakPolarHBondContact O-CB 3.43Å; S65-L68 PolarHBondContact O-N 2.67Å; S65-D69 PolarHBondContact O-N 2.66Å; S65-D69 PolarHBondContact OG-OD2 3.35Å
66N66.4Low60.6Low106 Ų10669 Ų6957%0.56735%0.353SS*.Hα-helixtrans-56.2-30.8-177.5-62.825000112.6N62 H63 D69 A70N62-N66 PolarHBondContact O-N 3.43Å; N62-N66 PolarHBondContact O-OD1 3.4Å; H63-N66 PolarHBondContact O-N 3.46Å; N66-D69 PolarHBondContact N-OD2 3.14Å; N66-A70 VanDerWaalsContact O-CB 3.23Å; N66-A70 WeakPolarHBondContact O-CB 3.32Å; N66-A70 PolarHBondContact O-N 3.06Å
67L57Low61.2Low25 Ų2571.2 Ų71.213%0.13135%0.354CS..Hα-helixtrans-72.7-41.2173.2-88.9155.7000113.4H63 S65 D69 A70 V71 L143 L146H63-L67 WeakPolarHBondContact O-CD1 3.26Å; H63-L67 PolarHBondContact O-N 3.23Å; H63-L67 VanDerWaalsContact O-N 3.1Å; S65-L67 PolarHBondContact O-N 2.74Å; L67-D69 VanDerWaalsContact C-N 3.35Å; L67-A70 PolarHBondContact O-N 3.03Å; L67-V71 WeakPolarHBondContact O-CG2 3.22Å; L67-V71 PolarHBondContact O-N 3.32Å; L67-L143 HydrophobicContact CB-CD1 3.88Å; L67-L146 HydrophobicContact CD1-CD1 3.49Å; L67-L146 VanDerWaalsContact CD1-CD1 3.49Å; L67-L146 HydrophobicContact CD1-CD2 4.26Å; L67-L146 HydrophobicContact CD1-CG 4.41Å
68L63.6Low61.6Low59 Ų5973 Ų7331%0.30936%0.36SS..Hα-helixtrans-63.5-44.5172.9-163.577.2000110.5L42 C64 S65 V71 L72L42-L68 HydrophobicContact CD2-CD1 4.27Å; C64-L68 PolarHBondContact O-N 2.78Å; C64-L68 VanDerWaalsContact O-N 3.09Å; S65-L68 CarbonylContact O-C 3.59Å; S65-L68 WeakPolarHBondContact O-CA 3.37Å; S65-L68 WeakPolarHBondContact O-CB 3.43Å; S65-L68 PolarHBondContact O-N 2.67Å; L68-V71 PolarHBondContact O-N 3.12Å; L68-L72 HydrophobicContact CG-CD1 4.45Å; L68-L72 WeakPolarHBondContact O-CG 3.39Å; L68-L72 PolarHBondContact O-N 3.08Å
69D65.7Low61.4Low70 Ų7072.9 Ų72.937%0.37437%0.366SS..Hα-helixtrans-61.4-44.1177.2-56.2-38.2000110.5S65 N66 L67 L72 I73S65-D69 PolarHBondContact O-N 2.66Å; S65-D69 PolarHBondContact OG-OD2 3.35Å; N66-D69 PolarHBondContact N-OD2 3.14Å; L67-D69 VanDerWaalsContact C-N 3.35Å; D69-L72 PolarHBondContact O-N 3.45Å; D69-I73 VanDerWaalsContact O-CG1 3.29Å; D69-I73 WeakPolarHBondContact O-CG1 3.43Å; D69-I73 PolarHBondContact O-N 3.24Å
70A55.7Low61.4Low52 Ų5270.4 Ų70.443%0.4336%0.362SS..Hα-helixtrans-63.1-40.6174.400000113.2N66 L67 I73 F74N66-A70 VanDerWaalsContact O-CB 3.23Å; N66-A70 WeakPolarHBondContact O-CB 3.32Å; N66-A70 PolarHBondContact O-N 3.06Å; L67-A70 PolarHBondContact O-N 3.03Å; A70-I73 PolarHBondContact O-N 3.42Å; A70-F74 VanDerWaalsContact O-CB 3.29Å; A70-F74 WeakPolarHBondContact O-CB 3.24Å; A70-F74 PolarHBondContact O-N 3.27Å
71V57.5Low61.6Low38 Ų3873.2 Ų73.223%0.2337%0.369CS..Hα-helixtrans-67.3-37.8175.6168.70000111.3L67 L68 F74 K75L67-V71 WeakPolarHBondContact O-CG2 3.22Å; L67-V71 PolarHBondContact O-N 3.32Å; L68-V71 PolarHBondContact O-N 3.12Å; V71-F74 PolarHBondContact O-N 3.36Å; V71-K75 VanDerWaalsContact O-CB 3.26Å; V71-K75 WeakPolarHBondContact O-CB 3.46Å; V71-K75 PolarHBondContact O-N 3.44Å
72L61.8Low61.2Low97 Ų9777.9 Ų77.951%0.50839%0.39SS..Hα-helixtrans-64.9-45.2174.9-74.3167.7000111.8L68 D69 K75 T76L68-L72 HydrophobicContact CG-CD1 4.45Å; L68-L72 WeakPolarHBondContact O-CG 3.39Å; L68-L72 PolarHBondContact O-N 3.08Å; D69-L72 PolarHBondContact O-N 3.45Å; L72-K75 PolarHBondContact O-N 2.99Å; L72-T76 WeakPolarHBondContact O-CB 3.45Å; L72-T76 PolarHBondContact O-N 3.08Å; L72-T76 PolarHBondContact O-OG1 3.05Å
73I62.7Low60.5Low119 Ų11978.7 Ų78.761%0.6140%0.402SS*.Hα-helixtrans-60-48.6174.2-68.7163.8000110.4D69 A70 K75 T76 W77D69-I73 VanDerWaalsContact O-CG1 3.29Å; D69-I73 WeakPolarHBondContact O-CG1 3.43Å; D69-I73 PolarHBondContact O-N 3.24Å; A70-I73 PolarHBondContact O-N 3.42Å; I73-K75 PolarHBondContact O-N 3.28Å; I73-T76 PolarHBondContact O-N 3.45Å; I73-W77 WeakPolarHBondContact O-CB 3.42Å; I73-W77 PolarHBondContact O-N 2.68Å
74F56.5Low59.9Low67 Ų6779.6 Ų79.629%0.29441%0.41SS..Hα-helixtrans-62.5-41.4-179.2-163-90000112.3A70 V71 F78 V132 H135 A136A70-F74 VanDerWaalsContact O-CB 3.29Å; A70-F74 WeakPolarHBondContact O-CB 3.24Å; A70-F74 PolarHBondContact O-N 3.27Å; V71-F74 PolarHBondContact O-N 3.36Å; F74-F78 WeakPolarHBondContact O-CB 3Å; F74-F78 PolarHBondContact O-N 3.28Å; F74-V132 HydrophobicContact CE1-CG1 3.8Å; F74-V132 HydrophobicContact CZ-CB 4.49Å; F74-V132 HydrophobicContact CZ-CG1 3.84Å; F74-H135 HydrophobicContact CZ-CB 4.4Å; F74-A136 HydrophobicContact CE1-CB 4.07Å
75K57.2Low59.5Low130 Ų13082.2 Ų82.257%0.56542%0.423SS*.Hα-helixtrans-67.6-38.5176.2-172.4171.7-176.9174.70112.2V71 L72 I73 F78 I79V71-K75 VanDerWaalsContact O-CB 3.26Å; V71-K75 WeakPolarHBondContact O-CB 3.46Å; V71-K75 PolarHBondContact O-N 3.44Å; L72-K75 PolarHBondContact O-N 2.99Å; I73-K75 PolarHBondContact O-N 3.28Å; K75-F78 PolarHBondContact O-N 3.38Å; K75-I79 HydrophobicContact CG-CD1 4.06Å; K75-I79 WeakPolarHBondContact O-CD1 3.36Å; K75-I79 VanDerWaalsContact O-CG1 3.27Å; K75-I79 WeakPolarHBondContact O-CG1 3.49Å; K75-I79 PolarHBondContact O-N 3.32Å
76T65.3Low58.2Low85 Ų8586.9 Ų86.952%0.52145%0.453SS..Hα-helixtrans-66.3-45.3176.8-53.40000110.8L72 I73 F78 I79 Q80L72-T76 WeakPolarHBondContact O-CB 3.45Å; L72-T76 PolarHBondContact O-N 3.08Å; L72-T76 PolarHBondContact O-OG1 3.05Å; I73-T76 PolarHBondContact O-N 3.45Å; T76-F78 PolarHBondContact O-N 3.18Å; T76-I79 PolarHBondContact O-N 2.98Å; T76-Q80 WeakPolarHBondContact O-CB 3.23Å; T76-Q80 PolarHBondContact O-N 3.07Å
77W65.7Low56.9Low100 Ų10087.1 Ų87.138%0.37946%0.463SS..Hα-helixtrans-59.8-42.4174.2177.286000112.4I73 Q80 R81 V132I73-W77 WeakPolarHBondContact O-CB 3.42Å; I73-W77 PolarHBondContact O-N 2.68Å; W77-Q80 PolarHBondContact O-N 2.75Å; W77-R81 PolarHBondContact O-N 3.03Å; W77-V132 HydrophobicContact CH2-CG2 4.02Å; W77-V132 HydrophobicContact CZ3-CG1 4.17Å; W77-V132 HydrophobicContact CZ3-CG2 3.85Å
78F59.9Low55.9Low51 Ų5191.9 Ų91.922%0.22449%0.493CS..Hα-helixtrans-62.2-46.6176.2-174.7-97.1000112.2F74 K75 T76 Q80 R81 Q82 V132 M133F74-F78 WeakPolarHBondContact O-CB 3Å; F74-F78 PolarHBondContact O-N 3.28Å; K75-F78 PolarHBondContact O-N 3.38Å; T76-F78 PolarHBondContact O-N 3.18Å; F78-Q80 VanDerWaalsContact C-N 3.34Å; F78-Q80 PolarHBondContact O-N 3.14Å; F78-R81 PolarHBondContact O-N 2.8Å; F78-Q82 PolarHBondContact O-N 2.93Å; F78-V132 HydrophobicContact CD2-CG1 3.66Å; F78-V132 HydrophobicContact CE2-CG1 3.94Å; F78-M133 HydrophobicContact CE2-SD 4.47Å; F78-M133 HydrophobicContact CZ-SD 4.28Å
79I60.6Low54.5Low95 Ų9596.1 Ų96.149%0.48752%0.516SS..Hα-helixtrans-62.3-42.5176.7-68.8164.6000110.7K75 T76 R81 Q82K75-I79 HydrophobicContact CG-CD1 4.06Å; K75-I79 WeakPolarHBondContact O-CD1 3.36Å; K75-I79 VanDerWaalsContact O-CG1 3.27Å; K75-I79 WeakPolarHBondContact O-CG1 3.49Å; K75-I79 PolarHBondContact O-N 3.32Å; T76-I79 PolarHBondContact O-N 2.98Å; I79-R81 PolarHBondContact O-N 3.44Å; I79-Q82 WeakPolarHBondContact O-CB 3.42Å; I79-Q82 PolarHBondContact O-N 3.42Å
80Q61.3Low53.3Low134 Ų13498.4 Ų98.463%0.62654%0.535SS*.Hα-helixtrans-64.7-36.8179.7-170.5172.26.400112.7T76 W77 F78 Q82 S83T76-Q80 WeakPolarHBondContact O-CB 3.23Å; T76-Q80 PolarHBondContact O-N 3.07Å; W77-Q80 PolarHBondContact O-N 2.75Å; F78-Q80 VanDerWaalsContact C-N 3.34Å; F78-Q80 PolarHBondContact O-N 3.14Å; Q80-Q82 VanDerWaalsContact C-N 3.34Å; Q80-S83 PolarHBondContact O-OG 2.84Å
81R59.7Low52.1Low95 Ų95105.2 Ų105.236%0.35856%0.558SS.*Hα-helixtrans-76.7-17.4170.9-94.9-179.6154-159.9-10.2114W77 F78 I79 S83 D84 L85 E128W77-R81 PolarHBondContact O-N 3.03Å; F78-R81 PolarHBondContact O-N 2.8Å; I79-R81 PolarHBondContact O-N 3.44Å; R81-S83 PolarHBondContact O-N 3.29Å; R81-D84 PolarHBondContact O-N 2.77Å; R81-D84 VanDerWaalsContact O-N 3.08Å; R81-L85 PolarHBondContact O-N 3.08Å; R81-E128 IonicContact CZ-OE1 3.57Å; R81-E128 IonicContact CZ-OE2 3.9Å; R81-E128 IonicContact NH1-OE1 2.7Å; R81-E128 PolarHBondContact NH1-OE1 2.96Å; R81-E128 IonicContact NH1-OE2 3.36Å; R81-E128 PolarHBondContact NH1-OE2 2.93Å; R81-E128 IonicContact NH2-OE1 3.5Å; R81-E128 PolarHBondContact NH2-OE1 3.3Å; R81-E128 IonicContact NH2-OE2 3.75Å
82Q55.5Low50.8Low101 Ų101109.1 Ų109.147%0.47258%0.582SS.*Hα-helixtrans-68.6-24.3176.4-164.5171.3-8.600112.2F78 I79 Q80F78-Q82 PolarHBondContact O-N 2.93Å; I79-Q82 WeakPolarHBondContact O-CB 3.42Å; I79-Q82 PolarHBondContact O-N 3.42Å; Q80-Q82 VanDerWaalsContact C-N 3.34Å
83S55.3Low49.3Very low98 Ų98111.4 Ų111.469%0.68560%0.595SS**THydrogen-bonded Turntrans-77.5-20.3168.2320000114.7Q80 R81 L85Q80-S83 PolarHBondContact O-OG 2.84Å; R81-S83 PolarHBondContact O-N 3.29Å; S83-L85 VanDerWaalsContact C-N 3.33Å
84D49.4Very low47.8Very low120 Ų120112.3 Ų112.364%0.64260%0.599SS**THydrogen-bonded Turntrans-84.3-10.1176.6-60.9-30.6000112.4R81 P86R81-D84 PolarHBondContact O-N 2.77Å; R81-D84 VanDerWaalsContact O-N 3.08Å; D84-P86 WeakPolarHBondContact O-CD 3.33Å
85L44.5Very low46.5Very low69 Ų69118.2 Ų118.236%0.36163%0.625SS.*SBendtrans-92.3109.6-179.8-77.3164.1000110.2R81 S83 S87R81-L85 PolarHBondContact O-N 3.08Å; S83-L85 VanDerWaalsContact C-N 3.33Å; L85-S87 PolarHBondContact O-N 3.04Å
86P40.3Very low45.4Very low113 Ų113116.6 Ų116.673%0.73463%0.63SS**  trans-63.1133.4-17825.2-33.9000111.5D84 T88D84-P86 WeakPolarHBondContact O-CD 3.33Å; P86-T88 PolarHBondContact O-N 3.29Å; P86-T88 VanDerWaalsContact O-N 3.1Å
87S39.3Very low43.6Very low111 Ų111120.9 Ų120.978%0.77665%0.65SS**  trans-71.2103.2-175.446.10000112.2L85 N89L85-S87 PolarHBondContact O-N 3.04Å; S87-N89 VanDerWaalsContact C-N 3.3Å; S87-N89 PolarHBondContact O-N 3.11Å
88T37.4Very low41.8Very low125 Ų125119.6 Ų119.677%0.76767%0.667SS**  trans-75.275.817551.90000111.8P86P86-T88 PolarHBondContact O-N 3.29Å; P86-T88 VanDerWaalsContact O-N 3.1Å
89N32.7Very low40.3Very low148 Ų148124.8 Ų124.879%0.79170%0.697SS**  trans-76.5125.4158.5-85.21.7000108.7S87S87-N89 VanDerWaalsContact C-N 3.3Å; S87-N89 PolarHBondContact O-N 3.11Å
90P40.9Very low38.8Very low119 Ų119126.7 Ų126.777%0.77371%0.713SS**  trans-93.2108.8-17233.8-32.6000113
91E29.9Very low37.1Very low194 Ų194125.1 Ų125.191%0.90772%0.717SS**  trans-117.883.7163.7-72.4-169.2144.800110.2
92T32Very low35.7Very low120 Ų120128.1 Ų128.174%0.73674%0.739SS**  trans-137.3107161.729.90000109.7I94T92-I94 PolarHBondContact O-N 2.86Å
93D29.6Very low34.3Very low145 Ų145130.9 Ų130.978%0.77576%0.756SS**  trans-65.9117.1175.2-140.4-30000109.2
94I30.4Very low33.6Very low138 Ų138131 Ų13171%0.70875%0.754SS**  trans-121.569.1173.6-51.4-176.3000109.2T92T92-I94 PolarHBondContact O-N 2.86Å
95K30.4Very low32.5Very low191 Ų191135.9 Ų135.983%0.8377%0.765SS**  trans-90.284.9156.8-78.4177.3178.7163.20109.8
96S33.2Very low31.7Very low97 Ų97139.8 Ų139.868%0.67879%0.786SS**  trans-149.2138.9163.2450000111.1
97N27.4Very low31.1Very low174 Ų174140.9 Ų140.993%0.9379%0.786SS**  trans-81.2157.7179.2-51.9-39.8000110.5
98G27.8Very low30.7Very low73 Ų73143.6 Ų143.675%0.75379%0.79SS**  trans149112.3159.500000113.7
99D29Very low30.4Very low160 Ų160143.1 Ų143.186%0.85679%0.787SS**  trans-61.8150.7161.8-53.2-90.1000110.9
100V28.3Very low30.3Very low136 Ų136143.5 Ų143.582%0.82479%0.789SS**  168.1129.9119155.20000111.5
101S26.5Very low29.8Very low101 Ų101141.6 Ų141.671%0.70679%0.791SS**  trans26.4122.8153.9-151.30000121.4
102I29.1Very low29.9Very low157 Ų157141.2 Ų141.281%0.80579%0.789SS**  trans-42.1135.9143.3-58.5156.2000110.9
103L27.7Very low29.9Very low160 Ų160144.2 Ų144.284%0.83880%0.795SS**  trans-153.6142.9150-101.1174.1000109.3
104P39.7Very low30.6Very low99 Ų99142.2 Ų142.264%0.64379%0.79SS**  trans-102.2164.2-167.939.1-35.7000114.9
105Y26.9Very low31.3Very low224 Ų224141.1 Ų141.188%0.87879%0.79SS**  trans29113.1150.1-83.5-95.6000119
106N26.2Very low31.8Very low150 Ų150137.8 Ų137.880%0.80278%0.78SS**  -160.3157.4125.3-107.7-50.8000114
107N29.4Very low32Very low136 Ų136138.3 Ų138.373%0.72778%0.775SS**  trans-24.9144.2177.3-53-46.1000119.1
108I30.5Very low32.6Very low169 Ų169135.2 Ų135.287%0.86776%0.758SS**  -166.1157.5110.9-99.1157.1000111.1
109T31.2Very low33.4Very low114 Ų114136.8 Ų136.870%0.69975%0.746SS**  trans-89.7176.3-177.346.40000113.6
110N29.3Very low34.1Very low156 Ų156134.1 Ų134.183%0.83473%0.73SS**  trans73.277.2164-60-12.3000118.4
111G31.7Very low34.8Very low79 Ų79132.1 Ų132.181%0.81472%0.715SS**  77.373.311600000119.6
112Q32.5Very low35.8Very low187 Ų187133 Ų13387%0.87471%0.708SS**  trans-148.4101.3152.9-114.6171.11500113.3
113Q31.3Very low36.6Very low183 Ų183132 Ų13286%0.85570%0.7SS**  trans56.1159.5153.9-79.6-174.4-24.300121.6V115Q113-V115 PolarHBondContact O-N 3.46Å
114P44.5Very low37.6Very low103 Ų103127.7 Ų127.767%0.66968%0.683SS**  trans-100.588.9-153.337.5-33.9000114.7
115V44.9Very low38.2Very low115 Ų115125 Ų12570%0.69767%0.667SS**SBendtrans-95.7-40.7164.5-178.50000111.5Q113 L117 N118Q113-V115 PolarHBondContact O-N 3.46Å; V115-L117 VanDerWaalsContact C-N 3.3Å; V115-L117 PolarHBondContact O-N 3.3Å; V115-N118 PolarHBondContact O-N 3.3Å
116L40.2Very low39.5Very low121 Ų121120.9 Ų120.963%0.63465%0.651SS**Hα-helixtrans-64.6-25.4-174.4-79.1167000114.9N118 Q119 I120L116-N118 VanDerWaalsContact C-N 3.29Å; L116-N118 PolarHBondContact O-N 3.27Å; L116-Q119 PolarHBondContact O-N 3.49Å; L116-I120 WeakPolarHBondContact O-CG1 3.49Å; L116-I120 PolarHBondContact O-N 2.92Å
117L39Very low41.1Very low107 Ų107118.3 Ų118.356%0.5664%0.64SS**Hα-helixtrans-65.3-32.7-176.8-162.270.7000112.4V115 N121V115-L117 VanDerWaalsContact C-N 3.3Å; V115-L117 PolarHBondContact O-N 3.3Å; L117-N121 WeakPolarHBondContact O-CB 3.3Å; L117-N121 PolarHBondContact O-N 3.47Å
118N39.7Very low42.3Very low110 Ų110115.6 Ų115.659%0.58862%0.623SS**Hα-helixtrans-72-38.6176.6-79.1-5.6000112.2V115 L116 N121 Q122V115-N118 PolarHBondContact O-N 3.3Å; L116-N118 VanDerWaalsContact C-N 3.29Å; L116-N118 PolarHBondContact O-N 3.27Å; N118-N121 PolarHBondContact O-N 3.17Å; N118-Q122 WeakPolarHBondContact O-CG 3.34Å; N118-Q122 PolarHBondContact O-N 3.34Å
119Q43.9Very low43.5Very low105 Ų105113 Ų11349%0.49160%0.602SS.*Hα-helixtrans-67.5-39.8174.3-75.6-178.6-29.100111.7L116 N121 Q122 H123L116-Q119 PolarHBondContact O-N 3.49Å; Q119-N121 VanDerWaalsContact C-N 3.35Å; Q119-N121 PolarHBondContact O-N 2.85Å; Q119-Q122 PolarHBondContact O-N 2.91Å; Q119-H123 PolarHBondContact O-CD2 3.4Å; Q119-H123 VanDerWaalsContact O-CD2 3.28Å; Q119-H123 PolarHBondContact O-N 3.03Å
120I44.3Very low45Very low104 Ų104111.4 Ų111.453%0.53359%0.589SS.*Hα-helixtrans-62.3-41.9174.4-67.8167.1000110.8L116 H123 S124L116-I120 WeakPolarHBondContact O-CG1 3.49Å; L116-I120 PolarHBondContact O-N 2.92Å; I120-H123 PolarHBondContact O-N 3.49Å; I120-S124 VanDerWaalsContact O-CB 3.25Å; I120-S124 WeakPolarHBondContact O-CB 3.49Å; I120-S124 PolarHBondContact O-N 3Å
121N43.4Very low46.7Very low94 Ų94111.1 Ų111.150%0.50358%0.577SS.*Hα-helixtrans-66.5-36175.3-80.6-16000113.3L117 N118 Q119 S124 S125L117-N121 WeakPolarHBondContact O-CB 3.3Å; L117-N121 PolarHBondContact O-N 3.47Å; N118-N121 PolarHBondContact O-N 3.17Å; Q119-N121 VanDerWaalsContact C-N 3.35Å; Q119-N121 PolarHBondContact O-N 2.85Å; N121-S124 PolarHBondContact O-N 3.43Å; N121-S125 PolarHBondContact O-N 2.88Å; N121-S125 PolarHBondContact O-OG 3.46Å
122Q46Very low48Very low121 Ų121107.6 Ų107.657%0.56554%0.54SS*.Hα-helixtrans-69.3-41.9175-75.6177.2-8.700112.4N118 Q119 S125 Y126N118-Q122 WeakPolarHBondContact O-CG 3.34Å; N118-Q122 PolarHBondContact O-N 3.34Å; Q119-Q122 PolarHBondContact O-N 2.91Å; Q122-S125 PolarHBondContact O-OG 2.85Å; Q122-Y126 WeakPolarHBondContact O-CB 3.22Å; Q122-Y126 PolarHBondContact O-N 3.23Å
123H46.6Very low49.6Very low136 Ų136102.4 Ų102.463%0.6352%0.516SS*.Hα-helixtrans-66-38.7172.7-79.6-67.3000112.1Q119 I120 Y126 V127Q119-H123 PolarHBondContact O-CD2 3.4Å; Q119-H123 VanDerWaalsContact O-CD2 3.28Å; Q119-H123 PolarHBondContact O-N 3.03Å; I120-H123 PolarHBondContact O-N 3.49Å; H123-Y126 PolarHBondContact O-N 2.9Å; H123-V127 WeakPolarHBondContact O-CB 3.5Å; H123-V127 VanDerWaalsContact O-CG2 3.32Å; H123-V127 WeakPolarHBondContact O-CG2 3.33Å; H123-V127 PolarHBondContact O-N 2.89Å
124S48.9Very low51.1Low69 Ų6999.6 Ų99.648%0.48350%0.504SS..Hα-helixtrans-60.6-50.2175.3-170.30000111.7I120 N121 Y126 V127 E128I120-S124 VanDerWaalsContact O-CB 3.25Å; I120-S124 WeakPolarHBondContact O-CB 3.49Å; I120-S124 PolarHBondContact O-N 3Å; N121-S124 PolarHBondContact O-N 3.43Å; S124-Y126 PolarHBondContact O-N 3.44Å; S124-V127 PolarHBondContact O-N 3.29Å; S124-E128 VanDerWaalsContact O-CB 3.3Å; S124-E128 WeakPolarHBondContact O-CB 3.47Å; S124-E128 PolarHBondContact O-N 3.34Å
125S52.3Low51.8Low43 Ų4398 Ų9830%0.30149%0.488SS..Hα-helixtrans-68.8-31.4-179.667.80000113.2N121 Q122 R129N121-S125 PolarHBondContact O-N 2.88Å; N121-S125 PolarHBondContact O-OG 3.46Å; Q122-S125 PolarHBondContact O-OG 2.85Å; S125-R129 WeakPolarHBondContact O-CB 3.47Å; S125-R129 PolarHBondContact O-N 3.41Å
126Y54.8Low52.5Low137 Ų13793.5 Ų93.554%0.53746%0.463SS..Hα-helixtrans-66.5-48.6172.2-173.1-81000111.7Q122 H123 S124 E128 R129 D130Q122-Y126 WeakPolarHBondContact O-CB 3.22Å; Q122-Y126 PolarHBondContact O-N 3.23Å; H123-Y126 PolarHBondContact O-N 2.9Å; S124-Y126 PolarHBondContact O-N 3.44Å; Y126-E128 PolarHBondContact O-N 3.14Å; Y126-R129 WeakPolarHBondContact O-CB 3.27Å; Y126-R129 PolarHBondContact O-N 3.28Å; Y126-D130 WeakPolarHBondContact CE1-OD2 3.45Å; Y126-D130 PolarHBondContact O-N 2.63Å; Y126-D130 PolarHBondContact OH-OD2 2.92Å
127V60Low53.7Low96 Ų9694.4 Ų94.458%0.58246%0.462SS*.Hα-helixtrans-64.8-40178.2171.50000111.3H123 S124 R129 D130 W131H123-V127 WeakPolarHBondContact O-CB 3.5Å; H123-V127 VanDerWaalsContact O-CG2 3.32Å; H123-V127 WeakPolarHBondContact O-CG2 3.33Å; H123-V127 PolarHBondContact O-N 2.89Å; S124-V127 PolarHBondContact O-N 3.29Å; V127-R129 VanDerWaalsContact C-N 3.34Å; V127-D130 PolarHBondContact O-N 3.39Å; V127-W131 VanDerWaalsContact O-CB 3.26Å; V127-W131 WeakPolarHBondContact O-CB 3.3Å; V127-W131 PolarHBondContact O-N 3.24Å
128E54.2Low55Low79 Ų7996.2 Ų96.237%0.36946%0.461SS..Hα-helixtrans-62.9-40.6174.2-167.2175.8-159.300111R81 S124 Y126 W131 V132R81-E128 IonicContact CZ-OE1 3.57Å; R81-E128 IonicContact CZ-OE2 3.9Å; R81-E128 IonicContact NH1-OE1 2.7Å; R81-E128 PolarHBondContact NH1-OE1 2.96Å; R81-E128 IonicContact NH1-OE2 3.36Å; R81-E128 PolarHBondContact NH1-OE2 2.93Å; R81-E128 IonicContact NH2-OE1 3.5Å; R81-E128 PolarHBondContact NH2-OE1 3.3Å; R81-E128 IonicContact NH2-OE2 3.75Å; S124-E128 VanDerWaalsContact O-CB 3.3Å; S124-E128 WeakPolarHBondContact O-CB 3.47Å; S124-E128 PolarHBondContact O-N 3.34Å; Y126-E128 PolarHBondContact O-N 3.14Å; E128-W131 PolarHBondContact O-N 3.03Å; E128-V132 VanDerWaalsContact O-CB 3.26Å; E128-V132 WeakPolarHBondContact O-CB 3.47Å; E128-V132 WeakPolarHBondContact O-CG2 3.45Å; E128-V132 PolarHBondContact O-N 3.36Å
129R56.1Low55.7Low114 Ų11493.1 Ų93.143%0.4345%0.446SS..Hα-helixtrans-63.4-47.6176.1-174.9179-171138.91.3112.7S125 Y126 V127 V132 M133S125-R129 WeakPolarHBondContact O-CB 3.47Å; S125-R129 PolarHBondContact O-N 3.41Å; Y126-R129 WeakPolarHBondContact O-CB 3.27Å; Y126-R129 PolarHBondContact O-N 3.28Å; V127-R129 VanDerWaalsContact C-N 3.34Å; R129-V132 PolarHBondContact O-N 3.41Å; R129-M133 WeakPolarHBondContact O-CB 3.26Å; R129-M133 VanDerWaalsContact O-CG 3.29Å; R129-M133 WeakPolarHBondContact O-CG 3.07Å; R129-M133 PolarHBondContact O-N 2.95Å
130D61.8Low56.5Low80 Ų8093.6 Ų93.643%0.42845%0.448SS..Hα-helixtrans-68-36.8178.7-91-5.5000111.9Y126 V127 M133 M134Y126-D130 WeakPolarHBondContact CE1-OD2 3.45Å; Y126-D130 PolarHBondContact O-N 2.63Å; Y126-D130 PolarHBondContact OH-OD2 2.92Å; V127-D130 PolarHBondContact O-N 3.39Å; D130-M133 PolarHBondContact O-N 3.11Å; D130-M134 WeakPolarHBondContact O-CB 3.45Å; D130-M134 PolarHBondContact O-N 2.87Å
131W65.5Low57.6Low151 Ų15191 Ų9157%0.57244%0.439SS*.Hα-helixtrans-62.8-46.1172.9-174.388.9000111.9V127 E128 M134 H135V127-W131 VanDerWaalsContact O-CB 3.26Å; V127-W131 WeakPolarHBondContact O-CB 3.3Å; V127-W131 PolarHBondContact O-N 3.24Å; E128-W131 PolarHBondContact O-N 3.03Å; W131-M134 PolarHBondContact O-N 3.3Å; W131-H135 AromaticContact CD2-CD2 3.9Å; W131-H135 AromaticContact CE2-CD2 3.56Å; W131-H135 AromaticContact CE2-NE2 3.59Å; W131-H135 AromaticContact CZ2-CD2 3.71Å; W131-H135 AromaticContact CZ2-CE1 3.9Å; W131-H135 AromaticContact CZ2-NE2 3.44Å; W131-H135 WeakPolarHBondContact CZ2-NE2 3.23Å; W131-H135 AromaticContact NE1-CD2 3.9Å; W131-H135 AromaticContact NE1-NE2 3.81Å; W131-H135 WeakPolarHBondContact O-CB 3.46Å; W131-H135 PolarHBondContact O-CD2 2.75Å; W131-H135 PolarHBondContact O-N 3.31Å
132V58.9Low58.5Low5 Ų590.8 Ų90.83%0.0344%0.435CS..Hα-helixtrans-61.5-43.9175.3163.30000111.5F74 W77 F78 E128 R129 H135 A136F74-V132 HydrophobicContact CE1-CG1 3.8Å; F74-V132 HydrophobicContact CZ-CB 4.49Å; F74-V132 HydrophobicContact CZ-CG1 3.84Å; W77-V132 HydrophobicContact CH2-CG2 4.02Å; W77-V132 HydrophobicContact CZ3-CG1 4.17Å; W77-V132 HydrophobicContact CZ3-CG2 3.85Å; F78-V132 HydrophobicContact CD2-CG1 3.66Å; F78-V132 HydrophobicContact CE2-CG1 3.94Å; E128-V132 VanDerWaalsContact O-CB 3.26Å; E128-V132 WeakPolarHBondContact O-CB 3.47Å; E128-V132 WeakPolarHBondContact O-CG2 3.45Å; E128-V132 PolarHBondContact O-N 3.36Å; R129-V132 PolarHBondContact O-N 3.41Å; V132-H135 PolarHBondContact O-N 3.46Å; V132-A136 WeakPolarHBondContact O-CB 3.38Å; V132-A136 PolarHBondContact O-N 3.18Å
133M65.5Low59Low77 Ų7787.4 Ų87.438%0.37942%0.421SS..Hα-helixtrans-66.9-37.1176.7-74.4-62.4-63.100112.6F78 R129 D130 A136 K137F78-M133 HydrophobicContact CE2-SD 4.47Å; F78-M133 HydrophobicContact CZ-SD 4.28Å; R129-M133 WeakPolarHBondContact O-CB 3.26Å; R129-M133 VanDerWaalsContact O-CG 3.29Å; R129-M133 WeakPolarHBondContact O-CG 3.07Å; R129-M133 PolarHBondContact O-N 2.95Å; D130-M133 PolarHBondContact O-N 3.11Å; M133-A136 PolarHBondContact O-N 2.8Å; M133-K137 WeakPolarHBondContact O-CG 3.38Å; M133-K137 PolarHBondContact O-N 3.11Å
134M63.1Low59.8Low124 Ų12484.8 Ų84.861%0.61141%0.411SS*.Hα-helixtrans-66.9-38.7173.4-171.3-176-7900111.1D130 W131 R138D130-M134 WeakPolarHBondContact O-CB 3.45Å; D130-M134 PolarHBondContact O-N 2.87Å; W131-M134 PolarHBondContact O-N 3.3Å; M134-R138 WeakPolarHBondContact O-CB 3.44Å; M134-R138 PolarHBondContact O-N 3.44Å
135H60Low60.5Low70 Ų7090.5 Ų90.532%0.32442%0.423SS..Hα-helixtrans-66.4-41.4174.1-94.3-99.9000112.7F74 W131 V132 R138 T139F74-H135 HydrophobicContact CZ-CB 4.4Å; W131-H135 AromaticContact CD2-CD2 3.9Å; W131-H135 AromaticContact CE2-CD2 3.56Å; W131-H135 AromaticContact CE2-NE2 3.59Å; W131-H135 AromaticContact CZ2-CD2 3.71Å; W131-H135 AromaticContact CZ2-CE1 3.9Å; W131-H135 AromaticContact CZ2-NE2 3.44Å; W131-H135 WeakPolarHBondContact CZ2-NE2 3.23Å; W131-H135 AromaticContact NE1-CD2 3.9Å; W131-H135 AromaticContact NE1-NE2 3.81Å; W131-H135 WeakPolarHBondContact O-CB 3.46Å; W131-H135 PolarHBondContact O-CD2 2.75Å; W131-H135 PolarHBondContact O-N 3.31Å; V132-H135 PolarHBondContact O-N 3.46Å; H135-R138 WeakPolarHBondContact O-CB 3.07Å; H135-R138 PolarHBondContact O-N 2.92Å; H135-T139 PolarHBondContact O-N 3.17Å; H135-T139 PolarHBondContact O-OG1 3.28Å
136A58.5Low60.5Low21 Ų2190.2 Ų90.217%0.17442%0.417CS..Hα-helixtrans-59.9-50.8174.300000112F74 V132 M133 R138 T139 E140F74-A136 HydrophobicContact CE1-CB 4.07Å; V132-A136 WeakPolarHBondContact O-CB 3.38Å; V132-A136 PolarHBondContact O-N 3.18Å; M133-A136 PolarHBondContact O-N 2.8Å; A136-R138 PolarHBondContact O-N 3.08Å; A136-T139 PolarHBondContact O-N 3.06Å; A136-T139 VanDerWaalsContact O-N 3.15Å; A136-T139 PolarHBondContact O-OG1 3Å; A136-E140 WeakPolarHBondContact O-CG 3.49Å; A136-E140 PolarHBondContact O-N 3.15Å
137K65.7Low60.7Low139 Ų13990.8 Ų90.860%0.60442%0.418SS*.Hα-helixtrans-59.2-33.4175-72.5176.9177.8177.80112M133 S141M133-K137 WeakPolarHBondContact O-CG 3.38Å; M133-K137 PolarHBondContact O-N 3.11Å; K137-S141 WeakPolarHBondContact O-CB 3.42Å; K137-S141 PolarHBondContact O-N 3.49Å
138R65.1Low60.9Low146 Ų14691.4 Ų91.455%0.55142%0.419SS*.Hα-helixtrans-67.8-45.2176.2-156.1-177.6-147.497.8-0.8111.6M134 H135 A136 S141 Q142M134-R138 WeakPolarHBondContact O-CB 3.44Å; M134-R138 PolarHBondContact O-N 3.44Å; H135-R138 WeakPolarHBondContact O-CB 3.07Å; H135-R138 PolarHBondContact O-N 2.92Å; A136-R138 PolarHBondContact O-N 3.08Å; R138-S141 PolarHBondContact O-N 3.28Å; R138-S141 PolarHBondContact O-OG 3.46Å; R138-Q142 WeakPolarHBondContact O-CG 3.41Å; R138-Q142 PolarHBondContact O-N 3.47Å; R138-Q142 VanDerWaalsContact O-N 3.13Å
139T56.3Low60.8Low44 Ų4490.7 Ų90.727%0.2742%0.422SS..Hα-helixtrans-70.6-37.5178.252.90000112.3H135 A136 Q142 L143H135-T139 PolarHBondContact O-N 3.17Å; H135-T139 PolarHBondContact O-OG1 3.28Å; A136-T139 PolarHBondContact O-N 3.06Å; A136-T139 VanDerWaalsContact O-N 3.15Å; A136-T139 PolarHBondContact O-OG1 3Å; T139-Q142 WeakPolarHBondContact O-CB 3.4Å; T139-Q142 PolarHBondContact O-N 3.46Å; T139-L143 PolarHBondContact O-N 2.85Å
140E59.9Low60.5Low115 Ų11587 Ų8754%0.53741%0.413SS..Hα-helixtrans-58.1-47.6169.7-72.7179.2150.200111.4A136 Q142 L143 D144A136-E140 WeakPolarHBondContact O-CG 3.49Å; A136-E140 PolarHBondContact O-N 3.15Å; E140-Q142 PolarHBondContact O-N 2.98Å; E140-L143 WeakPolarHBondContact O-CA 3.34Å; E140-L143 WeakPolarHBondContact O-CB 3.5Å; E140-L143 PolarHBondContact O-N 3.25Å; E140-D144 PolarHBondContact O-N 2.88Å
141S66.9Low60.2Low49 Ų4987.4 Ų87.434%0.34342%0.418SS..Hα-helixtrans-63.1-25.7177.581.20000113.7K137 R138 R145K137-S141 WeakPolarHBondContact O-CB 3.42Å; K137-S141 PolarHBondContact O-N 3.49Å; R138-S141 PolarHBondContact O-N 3.28Å; R138-S141 PolarHBondContact O-OG 3.46Å; S141-R145 VanDerWaalsContact O-CD 3.3Å; S141-R145 WeakPolarHBondContact O-CD 3.3Å; S141-R145 WeakPolarHBondContact O-CG 3.36Å; S141-R145 PolarHBondContact O-N 2.8Å
142Q62.9Low59.8Low91 Ų9182.1 Ų82.143%0.42541%0.41SS..Hα-helixtrans-76.9-43170.4-72.4177.9-16.900110.9R138 T139 E140 D144 R145 L146R138-Q142 WeakPolarHBondContact O-CG 3.41Å; R138-Q142 PolarHBondContact O-N 3.47Å; R138-Q142 VanDerWaalsContact O-N 3.13Å; T139-Q142 WeakPolarHBondContact O-CB 3.4Å; T139-Q142 PolarHBondContact O-N 3.46Å; E140-Q142 PolarHBondContact O-N 2.98Å; Q142-D144 VanDerWaalsContact C-N 3.33Å; Q142-D144 PolarHBondContact O-N 3.46Å; Q142-R145 PolarHBondContact O-N 2.69Å; Q142-L146 HydrophobicContact CB-CD1 4.5Å; Q142-L146 WeakPolarHBondContact O-CB 3.19Å; Q142-L146 VanDerWaalsContact O-CD1 3.25Å; Q142-L146 WeakPolarHBondContact O-CD1 3.46Å; Q142-L146 PolarHBondContact O-N 2.75Å
143L55.7Low59.1Low49 Ų4984.6 Ų84.626%0.25742%0.422SS..Hα-helixtrans-57.3-44178-152.184.1000111.7L67 T139 E140 L146 R147L67-L143 HydrophobicContact CB-CD1 3.88Å; T139-L143 PolarHBondContact O-N 2.85Å; E140-L143 WeakPolarHBondContact O-CA 3.34Å; E140-L143 WeakPolarHBondContact O-CB 3.5Å; E140-L143 PolarHBondContact O-N 3.25Å; L143-L146 PolarHBondContact O-N 2.96Å; L143-R147 WeakPolarHBondContact O-CB 3.47Å; L143-R147 PolarHBondContact O-N 3.18Å
144D64.1Low58.4Low81 Ų8186.2 Ų86.243%0.43342%0.424SS..Hα-helixtrans-69-37.3176.8-86.4-32.7000113.1E140 Q142 L146 R147 N148E140-D144 PolarHBondContact O-N 2.88Å; Q142-D144 VanDerWaalsContact C-N 3.33Å; Q142-D144 PolarHBondContact O-N 3.46Å; D144-L146 VanDerWaalsContact C-N 3.3Å; D144-L146 PolarHBondContact O-N 3.13Å; D144-R147 PolarHBondContact O-N 2.99Å; D144-R147 IonicContact OD1-NH1 3.57Å; D144-N148 WeakPolarHBondContact O-CB 3.45Å; D144-N148 VanDerWaalsContact O-CG 3.31Å; D144-N148 PolarHBondContact O-N 2.57Å; D144-N148 PolarHBondContact O-ND2 3.08Å; D144-N148 VanDerWaalsContact O-ND2 3.1Å
145R62.6Low58.2Low190 Ų19083.1 Ų83.172%0.71742%0.417SS*.Hα-helixtrans-62.1-40.1172.3-72.7169.9-175.2-161.11.2111.2S141 Q142 S149S141-R145 VanDerWaalsContact O-CD 3.3Å; S141-R145 WeakPolarHBondContact O-CD 3.3Å; S141-R145 WeakPolarHBondContact O-CG 3.36Å; S141-R145 PolarHBondContact O-N 2.8Å; Q142-R145 PolarHBondContact O-N 2.69Å; R145-S149 WeakPolarHBondContact O-CB 3.28Å; R145-S149 PolarHBondContact O-N 3.01Å
146L53.6Low58.1Low36 Ų3686.8 Ų86.819%0.18844%0.435CS..Hα-helixtrans-69.4-41175.2-86132.8000112.4L67 Q142 L143 D144 N148 S149 V150L67-L146 HydrophobicContact CD1-CD1 3.49Å; L67-L146 VanDerWaalsContact CD1-CD1 3.49Å; L67-L146 HydrophobicContact CD1-CD2 4.26Å; L67-L146 HydrophobicContact CD1-CG 4.41Å; Q142-L146 HydrophobicContact CB-CD1 4.5Å; Q142-L146 WeakPolarHBondContact O-CB 3.19Å; Q142-L146 VanDerWaalsContact O-CD1 3.25Å; Q142-L146 WeakPolarHBondContact O-CD1 3.46Å; Q142-L146 PolarHBondContact O-N 2.75Å; L143-L146 PolarHBondContact O-N 2.96Å; D144-L146 VanDerWaalsContact C-N 3.3Å; D144-L146 PolarHBondContact O-N 3.13Å; L146-N148 PolarHBondContact O-N 3.01Å; L146-S149 CarbonylContact O-C 3.54Å; L146-S149 WeakPolarHBondContact O-CB 3.44Å; L146-S149 PolarHBondContact O-N 3.01Å; L146-S149 VanDerWaalsContact O-N 3.14Å; L146-V150 WeakPolarHBondContact O-CG2 3.35Å; L146-V150 PolarHBondContact O-N 3.33Å
147R58.9Low57.6Low149 Ų14988.3 Ų88.356%0.56244%0.44SS*.Hα-helixtrans-57.5-47.3172.8-173.2-177.7-175.2-175.33111.4L143 D144 S149 V150 V151L143-R147 WeakPolarHBondContact O-CB 3.47Å; L143-R147 PolarHBondContact O-N 3.18Å; D144-R147 PolarHBondContact O-N 2.99Å; D144-R147 IonicContact OD1-NH1 3.57Å; R147-S149 VanDerWaalsContact C-N 3.34Å; R147-S149 PolarHBondContact O-N 3.29Å; R147-V150 PolarHBondContact O-N 3.31Å; R147-V151 WeakPolarHBondContact O-CG2 3.46Å; R147-V151 PolarHBondContact O-N 2.94Å
148N64.5Low57.2Low110 Ų11086.5 Ų86.559%0.58843%0.433SS*.Hα-helixtrans-64-37.9175.4-71.9-35.4000112.1D144 L146 V151 G152D144-N148 WeakPolarHBondContact O-CB 3.45Å; D144-N148 VanDerWaalsContact O-CG 3.31Å; D144-N148 PolarHBondContact O-N 2.57Å; D144-N148 PolarHBondContact O-ND2 3.08Å; D144-N148 VanDerWaalsContact O-ND2 3.1Å; L146-N148 PolarHBondContact O-N 3.01Å; N148-V151 PolarHBondContact O-N 3.2Å; N148-G152 PolarHBondContact O-N 2.68Å
149S52.1Low57Low63 Ų6381.3 Ų81.344%0.44142%0.422SS..Hα-helixtrans-64.1-42.6174.1-165.80000112.6R145 L146 R147 G152 M153R145-S149 WeakPolarHBondContact O-CB 3.28Å; R145-S149 PolarHBondContact O-N 3.01Å; L146-S149 CarbonylContact O-C 3.54Å; L146-S149 WeakPolarHBondContact O-CB 3.44Å; L146-S149 PolarHBondContact O-N 3.01Å; L146-S149 VanDerWaalsContact O-N 3.14Å; R147-S149 VanDerWaalsContact C-N 3.34Å; R147-S149 PolarHBondContact O-N 3.29Å; S149-G152 PolarHBondContact O-N 3.4Å; S149-M153 VanDerWaalsContact O-CE 3.29Å; S149-M153 WeakPolarHBondContact O-CE 3.33Å; S149-M153 PolarHBondContact O-N 3.04Å; S149-M153 WeakPolarHBondContact OG-CE 3.46Å
150V48.3Very low56.9Low38 Ų3881.2 Ų81.223%0.2343%0.43CS..Hα-helixtrans-61.8-44.3174.3168.80000111.3V60 L146 R147 M153 R154V60-V150 HydrophobicContact CG1-CG2 3.63Å; L146-V150 WeakPolarHBondContact O-CG2 3.35Å; L146-V150 PolarHBondContact O-N 3.33Å; R147-V150 PolarHBondContact O-N 3.31Å; V150-M153 PolarHBondContact O-N 2.96Å; V150-R154 WeakPolarHBondContact O-CB 3.21Å; V150-R154 PolarHBondContact O-N 2.86Å
151V56.6Low56.8Low88 Ų8881 Ų8153%0.53343%0.432SS..Hα-helixtrans-62.6-42.9175.6171.70000111.2R147 N148 R154 A155R147-V151 WeakPolarHBondContact O-CG2 3.46Å; R147-V151 PolarHBondContact O-N 2.94Å; N148-V151 PolarHBondContact O-N 3.2Å; V151-R154 PolarHBondContact O-N 3.43Å; V151-A155 PolarHBondContact O-N 3.22Å
152G55.5Low56.6Low39 Ų3986.2 Ų86.240%0.40244%0.444SS..Hα-helixtrans-59.8-47.8174.800000112.9N148 S149 R154 A155 Q156N148-G152 PolarHBondContact O-N 2.68Å; S149-G152 PolarHBondContact O-N 3.4Å; G152-R154 PolarHBondContact O-N 2.91Å; G152-A155 PolarHBondContact O-N 3.28Å; G152-Q156 PolarHBondContact O-N 3.49Å
153M45.5Very low56.7Low58 Ų5886.7 Ų86.729%0.28645%0.446SS..Hα-helixtrans-63.4-39.8175.4-79.2179-81.600112.3V60 S149 V150 A155 Q156 L157V60-M153 HydrophobicContact CB-CE 4.37Å; V60-M153 HydrophobicContact CG1-CE 3.7Å; V60-M153 HydrophobicContact CG2-CE 3.85Å; V60-M153 HydrophobicContact CG2-SD 3.89Å; S149-M153 VanDerWaalsContact O-CE 3.29Å; S149-M153 WeakPolarHBondContact O-CE 3.33Å; S149-M153 PolarHBondContact O-N 3.04Å; S149-M153 WeakPolarHBondContact OG-CE 3.46Å; V150-M153 PolarHBondContact O-N 2.96Å; M153-A155 VanDerWaalsContact C-N 3.32Å; M153-A155 PolarHBondContact O-N 3.5Å; M153-Q156 PolarHBondContact O-N 2.93Å; M153-L157 WeakPolarHBondContact O-CB 3.41Å; M153-L157 WeakPolarHBondContact O-CD1 3.46Å; M153-L157 WeakPolarHBondContact O-CG 3.29Å; M153-L157 PolarHBondContact O-N 3.18Å
154R50.6Low57.1Low111 Ų11190.3 Ų90.342%0.41946%0.459SS..Hα-helixtrans-59-43.4174.6-169.6-173.9-163.5158.113.9111.5D45 V150 V151 G152 Q158D45-R154 IonicContact OD1-CZ 3.19Å; D45-R154 IonicContact OD1-NH1 3.72Å; D45-R154 PolarHBondContact OD1-NH1 3.49Å; D45-R154 IonicContact OD1-NH2 2.79Å; D45-R154 PolarHBondContact OD1-NH2 3.3Å; D45-R154 IonicContact OD2-CZ 3.66Å; D45-R154 IonicContact OD2-NH1 2.7Å; D45-R154 PolarHBondContact OD2-NH1 2.96Å; D45-R154 IonicContact OD2-NH2 3.6Å; V150-R154 WeakPolarHBondContact O-CB 3.21Å; V150-R154 PolarHBondContact O-N 2.86Å; V151-R154 PolarHBondContact O-N 3.43Å; G152-R154 PolarHBondContact O-N 2.91Å; R154-Q158 WeakPolarHBondContact O-CB 3.24Å; R154-Q158 WeakPolarHBondContact O-CG 3.32Å; R154-Q158 PolarHBondContact O-N 3.25Å
155A59.3Low57.4Low58 Ų5892.3 Ų92.348%0.47947%0.469SS..Hα-helixtrans-64.1-45.4176.300000111.8V151 G152 M153 L157 Q158 A159V151-A155 PolarHBondContact O-N 3.22Å; G152-A155 PolarHBondContact O-N 3.28Å; M153-A155 VanDerWaalsContact C-N 3.32Å; M153-A155 PolarHBondContact O-N 3.5Å; A155-L157 PolarHBondContact O-N 3.45Å; A155-Q158 PolarHBondContact O-N 2.93Å; A155-A159 PolarHBondContact O-N 3.02Å
156Q57.6Low57.9Low148 Ų14887.9 Ų87.969%0.69246%0.457SS*.Hα-helixtrans-63.6-39.1178.2-166.5177.816.700112.4G152 M153 A159 G160G152-Q156 PolarHBondContact O-N 3.49Å; M153-Q156 PolarHBondContact O-N 2.93Å; Q156-A159 PolarHBondContact O-N 2.83Å; Q156-G160 PolarHBondContact O-N 3.5Å
157L48.1Very low58.5Low52 Ų5290 Ų9027%0.27247%0.474SS..Hα-helixtrans-66.9-39.6174.7-69.9161.3000112C57 M153 A155 A159 G160 L161C57-L157 WeakPolarHBondContact SG-CD1 3.44Å; M153-L157 WeakPolarHBondContact O-CB 3.41Å; M153-L157 WeakPolarHBondContact O-CD1 3.46Å; M153-L157 WeakPolarHBondContact O-CG 3.29Å; M153-L157 PolarHBondContact O-N 3.18Å; A155-L157 PolarHBondContact O-N 3.45Å; L157-A159 VanDerWaalsContact C-N 3.34Å; L157-G160 PolarHBondContact O-N 3.1Å; L157-L161 WeakPolarHBondContact O-CB 3.31Å; L157-L161 VanDerWaalsContact O-CG 3.3Å; L157-L161 WeakPolarHBondContact O-CG 3.47Å; L157-L161 PolarHBondContact O-N 3.45Å
158Q57.4Low59.2Low101 Ų10186.8 Ų86.847%0.47247%0.465SS..Hα-helixtrans-66.7-34.7174.2-75.5-177.90.500112.4R154 A155 R162R154-Q158 WeakPolarHBondContact O-CB 3.24Å; R154-Q158 WeakPolarHBondContact O-CG 3.32Å; R154-Q158 PolarHBondContact O-N 3.25Å; A155-Q158 PolarHBondContact O-N 2.93Å; Q158-R162 WeakPolarHBondContact O-CD 3.35Å; Q158-R162 VanDerWaalsContact O-CG 3.24Å; Q158-R162 WeakPolarHBondContact O-CG 3.17Å; Q158-R162 PolarHBondContact O-N 2.97Å; Q158-R162 VanDerWaalsContact O-N 3.1Å
159A61.2Low60Low37 Ų3785 Ų8531%0.30645%0.454SS..Hα-helixtrans-65-52.8171.200000111.1A155 Q156 L157 L161 R162 H163A155-A159 PolarHBondContact O-N 3.02Å; Q156-A159 PolarHBondContact O-N 2.83Å; L157-A159 VanDerWaalsContact C-N 3.34Å; A159-L161 VanDerWaalsContact C-N 3.27Å; A159-L161 PolarHBondContact O-N 3.24Å; A159-R162 WeakPolarHBondContact O-CA 3.42Å; A159-R162 WeakPolarHBondContact O-CB 3.46Å; A159-R162 PolarHBondContact O-N 3.46Å; A159-H163 PolarHBondContact O-CD2 3Å; A159-H163 PolarHBondContact O-N 2.93Å
160G53Low61.1Low43 Ų4387.5 Ų87.544%0.44346%0.461SS..Hα-helixtrans-59-34178.500000114.1Q156 L157 K164Q156-G160 PolarHBondContact O-N 3.5Å; L157-G160 PolarHBondContact O-N 3.1Å; G160-K164 WeakPolarHBondContact O-CB 3.32Å; G160-K164 PolarHBondContact O-N 3.49Å
161L57.9Low62.6Low111 Ų11193.3 Ų93.358%0.58148%0.479SS*.Hα-helixtrans-72.2-34.7173.3-73.7171.1000113.1L157 A159 L165L157-L161 WeakPolarHBondContact O-CB 3.31Å; L157-L161 VanDerWaalsContact O-CG 3.3Å; L157-L161 WeakPolarHBondContact O-CG 3.47Å; L157-L161 PolarHBondContact O-N 3.45Å; A159-L161 VanDerWaalsContact C-N 3.27Å; A159-L161 PolarHBondContact O-N 3.24Å; L161-L165 WeakPolarHBondContact O-CG 3.48Å; L161-L165 PolarHBondContact O-N 3.44Å; L161-L165 VanDerWaalsContact O-N 3.08Å
162R62.8Low63.7Low158 Ų15895.7 Ų95.760%0.59648%0.478SS*.Hα-helixtrans-64.5-51.2171.7-73.6163-178.6-93.11.6110.6Q158 A159 K164 L165 E166Q158-R162 WeakPolarHBondContact O-CD 3.35Å; Q158-R162 VanDerWaalsContact O-CG 3.24Å; Q158-R162 WeakPolarHBondContact O-CG 3.17Å; Q158-R162 PolarHBondContact O-N 2.97Å; Q158-R162 VanDerWaalsContact O-N 3.1Å; A159-R162 WeakPolarHBondContact O-CA 3.42Å; A159-R162 WeakPolarHBondContact O-CB 3.46Å; A159-R162 PolarHBondContact O-N 3.46Å; R162-K164 VanDerWaalsContact C-N 3.28Å; R162-K164 PolarHBondContact O-N 3.44Å; R162-L165 CarbonylContact O-C 3.59Å; R162-L165 WeakPolarHBondContact O-CA 3.34Å; R162-L165 WeakPolarHBondContact O-CB 3.12Å; R162-L165 PolarHBondContact O-N 2.67Å; R162-E166 WeakPolarHBondContact O-CB 3.21Å; R162-E166 WeakPolarHBondContact O-CG 3.46Å; R162-E166 PolarHBondContact O-N 3.36Å
163H65.6Low64.9Low101 Ų10196.5 Ų96.547%0.46847%0.474SS..Hα-helixtrans-59.8-37.8177.9-61.2-39.8000112.2A159 E166 C167A159-H163 PolarHBondContact O-CD2 3Å; A159-H163 PolarHBondContact O-N 2.93Å; H163-E166 WeakPolarHBondContact CA-OE2 3.37Å; H163-E166 IonicContact CE1-OE2 3.55Å; H163-E166 IonicContact CG-OE2 3.13Å; H163-E166 IonicContact ND1-OE2 2.73Å; H163-E166 PolarHBondContact ND1-OE2 3.37Å; H163-E166 PolarHBondContact O-N 3.43Å; H163-C167 WeakPolarHBondContact O-CB 3.43Å; H163-C167 PolarHBondContact O-N 3.06Å; H163-C167 PolarHBondContact O-SG 3.39Å
164K64.1Low66.5Low124 Ų12499.4 Ų99.454%0.53949%0.49SS..Hα-helixtrans-61.9-45171.6-174175.9179.6-172.10112.2G160 R162 E166 C167 E168G160-K164 WeakPolarHBondContact O-CB 3.32Å; G160-K164 PolarHBondContact O-N 3.49Å; R162-K164 VanDerWaalsContact C-N 3.28Å; R162-K164 PolarHBondContact O-N 3.44Å; K164-E166 VanDerWaalsContact C-N 3.32Å; K164-C167 PolarHBondContact O-N 2.96Å; K164-E168 WeakPolarHBondContact CE-OE1 3.49Å; K164-E168 HydrophobicContact CG-CG 4.15Å; K164-E168 IonicContact NZ-OE1 3.79Å; K164-E168 WeakPolarHBondContact O-CB 3.4Å; K164-E168 WeakPolarHBondContact O-CG 3.4Å; K164-E168 PolarHBondContact O-N 2.81Å
165L69.7Low68.1Low123 Ų12397.5 Ų97.564%0.64449%0.486SS*.Hα-helixtrans-66.1-35178.1-72.8168.2000112.3L161 R162 Q169L161-L165 WeakPolarHBondContact O-CG 3.48Å; L161-L165 PolarHBondContact O-N 3.44Å; L161-L165 VanDerWaalsContact O-N 3.08Å; R162-L165 CarbonylContact O-C 3.59Å; R162-L165 WeakPolarHBondContact O-CA 3.34Å; R162-L165 WeakPolarHBondContact O-CB 3.12Å; R162-L165 PolarHBondContact O-N 2.67Å; L165-Q169 WeakPolarHBondContact O-CB 3.4Å; L165-Q169 PolarHBondContact O-N 3.18Å
166E73.9Confident69.5Low97 Ų9799 Ų9945%0.45348%0.484SS..Hα-helixtrans-65.8-48.2174.2-71.7157.3-178.600110.6R162 H163 K164 E168 Q169 L170R162-E166 WeakPolarHBondContact O-CB 3.21Å; R162-E166 WeakPolarHBondContact O-CG 3.46Å; R162-E166 PolarHBondContact O-N 3.36Å; H163-E166 WeakPolarHBondContact CA-OE2 3.37Å; H163-E166 IonicContact CE1-OE2 3.55Å; H163-E166 IonicContact CG-OE2 3.13Å; H163-E166 IonicContact ND1-OE2 2.73Å; H163-E166 PolarHBondContact ND1-OE2 3.37Å; H163-E166 PolarHBondContact O-N 3.43Å; K164-E166 VanDerWaalsContact C-N 3.32Å; E166-E168 PolarHBondContact O-N 2.81Å; E166-Q169 WeakPolarHBondContact O-CB 3.42Å; E166-Q169 PolarHBondContact O-N 2.82Å; E166-Q169 VanDerWaalsContact O-N 3.09Å; E166-L170 WeakPolarHBondContact O-CG 3.26Å; E166-L170 PolarHBondContact O-N 3.19Å
167C66.7Low70.7Confident81 Ų8196.9 Ų96.955%0.54747%0.474SS..Hα-helixtrans-62.7-41174.1-67.60000113H163 K164 Q169 R171H163-C167 WeakPolarHBondContact O-CB 3.43Å; H163-C167 PolarHBondContact O-N 3.06Å; H163-C167 PolarHBondContact O-SG 3.39Å; K164-C167 PolarHBondContact O-N 2.96Å; C167-Q169 PolarHBondContact O-N 3.16Å; C167-R171 VanDerWaalsContact O-CB 3.24Å; C167-R171 WeakPolarHBondContact O-CB 3.13Å; C167-R171 PolarHBondContact O-N 3.42Å
168E72.9Confident72.5Confident82 Ų8299.7 Ų99.738%0.38348%0.484SS..Hα-helixtrans-71.1-14175.3-65.4-89.9-155.100112.4K164 E166 R172K164-E168 WeakPolarHBondContact CE-OE1 3.49Å; K164-E168 HydrophobicContact CG-CG 4.15Å; K164-E168 IonicContact NZ-OE1 3.79Å; K164-E168 WeakPolarHBondContact O-CB 3.4Å; K164-E168 WeakPolarHBondContact O-CG 3.4Å; K164-E168 PolarHBondContact O-N 2.81Å; E166-E168 PolarHBondContact O-N 2.81Å; E168-R172 VanDerWaalsContact O-CZ 3.25Å; E168-R172 PolarHBondContact O-NE 3.2Å; E168-R172 PolarHBondContact O-NH2 3Å
169Q81.6Confident73.8Confident73 Ų7399.9 Ų99.934%0.34149%0.488SS..Hα-helixtrans-87.5-52.7170.3-175.257.649.800110.6L165 E166 C167 R171 R172 D173L165-Q169 WeakPolarHBondContact O-CB 3.4Å; L165-Q169 PolarHBondContact O-N 3.18Å; E166-Q169 WeakPolarHBondContact O-CB 3.42Å; E166-Q169 PolarHBondContact O-N 2.82Å; E166-Q169 VanDerWaalsContact O-N 3.09Å; C167-Q169 PolarHBondContact O-N 3.16Å; Q169-R171 PolarHBondContact O-N 2.94Å; Q169-R172 WeakPolarHBondContact O-CA 3.43Å; Q169-R172 WeakPolarHBondContact O-CB 3.5Å; Q169-R172 PolarHBondContact O-N 3.14Å; Q169-D173 WeakPolarHBondContact CG-OD2 3.46Å; Q169-D173 VanDerWaalsContact NE2-CG 3.31Å; Q169-D173 PolarHBondContact NE2-OD1 2.85Å; Q169-D173 PolarHBondContact NE2-OD2 3.26Å; Q169-D173 VanDerWaalsContact NE2-OD2 3.12Å; Q169-D173 PolarHBondContact O-N 3.18Å
170L75.3Confident75Confident115 Ų115100.4 Ų100.460%0.60249%0.488SS*.Hα-helixtrans-52.7-39.6174-70.6169.4000112.1E166 R172 D173 L174E166-L170 WeakPolarHBondContact O-CG 3.26Å; E166-L170 PolarHBondContact O-N 3.19Å; L170-R172 VanDerWaalsContact C-N 3.31Å; L170-R172 PolarHBondContact O-N 3.33Å; L170-D173 PolarHBondContact O-N 2.98Å; L170-L174 WeakPolarHBondContact O-CB 3.43Å; L170-L174 PolarHBondContact O-N 2.98Å
171R80.3Confident76.5Confident160 Ų160103.5 Ų103.560%0.60449%0.493SS*.Hα-helixtrans-63.9-31.5175.7-168-17811764.97.7113.4C167 Q169 E175C167-R171 VanDerWaalsContact O-CB 3.24Å; C167-R171 WeakPolarHBondContact O-CB 3.13Å; C167-R171 PolarHBondContact O-N 3.42Å; Q169-R171 PolarHBondContact O-N 2.94Å; R171-E175 PolarHBondContact O-N 3.24Å
172R79.3Confident77.9Confident137 Ų137101.4 Ų101.452%0.51749%0.485SS..Hα-helixtrans-80.3-38.3175.2-79.9177.7-76.3126.48.1111.7E168 Q169 L170 E175 M176E168-R172 VanDerWaalsContact O-CZ 3.25Å; E168-R172 PolarHBondContact O-NE 3.2Å; E168-R172 PolarHBondContact O-NH2 3Å; Q169-R172 WeakPolarHBondContact O-CA 3.43Å; Q169-R172 WeakPolarHBondContact O-CB 3.5Å; Q169-R172 PolarHBondContact O-N 3.14Å; L170-R172 VanDerWaalsContact C-N 3.31Å; L170-R172 PolarHBondContact O-N 3.33Å; R172-E175 PolarHBondContact O-N 2.98Å; R172-M176 WeakPolarHBondContact O-CB 3.43Å; R172-M176 PolarHBondContact O-N 3.35Å
173D79.5Confident79.1Confident56 Ų5699.2 Ų99.230%0.29948%0.481SS..Hα-helixtrans-67.4-39.1177.1-58.9-30.2000110.9Q169 L170 M176 H177Q169-D173 WeakPolarHBondContact CG-OD2 3.46Å; Q169-D173 VanDerWaalsContact NE2-CG 3.31Å; Q169-D173 PolarHBondContact NE2-OD1 2.85Å; Q169-D173 PolarHBondContact NE2-OD2 3.26Å; Q169-D173 VanDerWaalsContact NE2-OD2 3.12Å; Q169-D173 PolarHBondContact O-N 3.18Å; L170-D173 PolarHBondContact O-N 2.98Å; D173-M176 PolarHBondContact O-N 3Å; D173-H177 PolarHBondContact O-CD2 3Å; D173-H177 PolarHBondContact O-N 3.1Å
174L79.1Confident80.1Confident119 Ų119101.2 Ų101.262%0.62349%0.485SS*.Hα-helixtrans-66.5-40.5176.1-165.8157.8000112.4L170 H177 K178L170-L174 WeakPolarHBondContact O-CB 3.43Å; L170-L174 PolarHBondContact O-N 2.98Å; L174-H177 PolarHBondContact O-N 3.25Å; L174-K178 WeakPolarHBondContact O-CB 3.43Å; L174-K178 PolarHBondContact O-N 2.8Å
175E85.9Confident81.2Confident72 Ų72100.9 Ų100.934%0.33649%0.486SS..Hα-helixtrans-64.6-42.1173.2-157.781.5-115.100111R171 R172 H177 K178 D179R171-E175 PolarHBondContact O-N 3.24Å; R172-E175 PolarHBondContact O-N 2.98Å; E175-H177 PolarHBondContact O-N 3.31Å; E175-K178 WeakPolarHBondContact O-CB 3.3Å; E175-K178 PolarHBondContact O-N 2.99Å; E175-K178 VanDerWaalsContact O-N 3.16Å; E175-K178 IonicContact OE1-NZ 3.3Å; E175-K178 PolarHBondContact OE1-NZ 3.34Å; E175-D179 PolarHBondContact O-N 2.95Å
176M88Confident82.2Confident90 Ų9099.1 Ų99.144%0.44348%0.477SS..Hα-helixtrans-61.6-40.3174.3179.2-78.7-5700112.4R172 D173 T180R172-M176 WeakPolarHBondContact O-CB 3.43Å; R172-M176 PolarHBondContact O-N 3.35Å; D173-M176 PolarHBondContact O-N 3Å; M176-T180 VanDerWaalsContact O-CB 3.31Å; M176-T180 WeakPolarHBondContact O-CB 3.37Å; M176-T180 PolarHBondContact O-N 3.34Å; M176-T180 PolarHBondContact O-OG1 3.2Å
177H82Confident82.8Confident103 Ų10398.2 Ų98.248%0.47747%0.474SS..Hα-helixtrans-65.2-39.5173.2-74.4-54.3000112.2D173 L174 E175 T180 I181D173-H177 PolarHBondContact O-CD2 3Å; D173-H177 PolarHBondContact O-N 3.1Å; L174-H177 PolarHBondContact O-N 3.25Å; E175-H177 PolarHBondContact O-N 3.31Å; H177-T180 WeakPolarHBondContact O-CB 3.38Å; H177-T180 PolarHBondContact O-N 3.46Å; H177-I181 WeakPolarHBondContact O-CB 3.3Å; H177-I181 WeakPolarHBondContact O-CD1 3.47Å; H177-I181 VanDerWaalsContact O-CG1 3.24Å; H177-I181 WeakPolarHBondContact O-CG1 3.47Å; H177-I181 PolarHBondContact O-N 3.47Å
178K86.4Confident83.8Confident111 Ų11199.1 Ų99.148%0.48347%0.473SS..Hα-helixtrans-65.6-42.6176.1175.3-177.1153.7-144.50112.3L174 E175 T180 I181 T182L174-K178 WeakPolarHBondContact O-CB 3.43Å; L174-K178 PolarHBondContact O-N 2.8Å; E175-K178 WeakPolarHBondContact O-CB 3.3Å; E175-K178 PolarHBondContact O-N 2.99Å; E175-K178 VanDerWaalsContact O-N 3.16Å; E175-K178 IonicContact OE1-NZ 3.3Å; E175-K178 PolarHBondContact OE1-NZ 3.34Å; K178-T180 VanDerWaalsContact C-N 3.32Å; K178-T180 PolarHBondContact O-N 3.12Å; K178-I181 PolarHBondContact O-N 2.93Å; K178-T182 WeakPolarHBondContact O-CB 3.24Å; K178-T182 PolarHBondContact O-N 3.42Å; K178-T182 PolarHBondContact O-OG1 3.01Å
179D85.8Confident84.5Confident104 Ų10498.7 Ų98.756%0.55647%0.473SS*.Hα-helixtrans-61-42.4171.9-74-20.1000111E175 T182 H183E175-D179 PolarHBondContact O-N 2.95Å; D179-T182 WeakPolarHBondContact O-CB 3.18Å; D179-T182 PolarHBondContact O-N 3.09Å; D179-H183 WeakPolarHBondContact O-CB 3.26Å; D179-H183 PolarHBondContact O-N 3.33Å
180T84.9Confident84.9Confident49 Ų49100.3 Ų100.330%0.30148%0.481SS..Hα-helixtrans-65.2-42.9178.1-59.80000112.4M176 H177 K178 T182 H183 Y184M176-T180 VanDerWaalsContact O-CB 3.31Å; M176-T180 WeakPolarHBondContact O-CB 3.37Å; M176-T180 PolarHBondContact O-N 3.34Å; M176-T180 PolarHBondContact O-OG1 3.2Å; H177-T180 WeakPolarHBondContact O-CB 3.38Å; H177-T180 PolarHBondContact O-N 3.46Å; K178-T180 VanDerWaalsContact C-N 3.32Å; K178-T180 PolarHBondContact O-N 3.12Å; T180-T182 VanDerWaalsContact C-N 3.34Å; T180-H183 PolarHBondContact O-N 3.34Å; T180-Y184 HydrophobicContact CG2-CD2 3.84Å; T180-Y184 HydrophobicContact CG2-CE2 3.47Å; T180-Y184 VanDerWaalsContact CG2-CE2 3.47Å; T180-Y184 VanDerWaalsContact O-CD2 3.28Å; T180-Y184 WeakPolarHBondContact O-CD2 3.35Å; T180-Y184 PolarHBondContact O-N 3.04Å
181I84.8Confident85.6Confident108 Ų10896.1 Ų96.155%0.55447%0.465SS*.Hα-helixtrans-62.4-43.5174-71.2162.2000110.2H177 K178 H183 Y184 Q185H177-I181 WeakPolarHBondContact O-CB 3.3Å; H177-I181 WeakPolarHBondContact O-CD1 3.47Å; H177-I181 VanDerWaalsContact O-CG1 3.24Å; H177-I181 WeakPolarHBondContact O-CG1 3.47Å; H177-I181 PolarHBondContact O-N 3.47Å; K178-I181 PolarHBondContact O-N 2.93Å; I181-H183 VanDerWaalsContact C-N 3.31Å; I181-H183 PolarHBondContact O-N 3.32Å; I181-Y184 PolarHBondContact O-N 3.11Å; I181-Q185 WeakPolarHBondContact O-CB 3.15Å; I181-Q185 PolarHBondContact O-N 2.68Å
182T86.5Confident86Confident67 Ų6791 Ų9141%0.41145%0.45SS..Hα-helixtrans-61.3-40.4176.5-53.80000111.3K178 D179 T180 Q185 N186K178-T182 WeakPolarHBondContact O-CB 3.24Å; K178-T182 PolarHBondContact O-N 3.42Å; K178-T182 PolarHBondContact O-OG1 3.01Å; D179-T182 WeakPolarHBondContact O-CB 3.18Å; D179-T182 PolarHBondContact O-N 3.09Å; T180-T182 VanDerWaalsContact C-N 3.34Å; T182-Q185 PolarHBondContact O-N 3.25Å; T182-N186 PolarHBondContact O-N 3.39Å; T182-N186 PolarHBondContact O-ND2 2.88Å
183H88.7Confident86.4Confident112 Ų11292.8 Ų92.852%0.51946%0.456SS..Hα-helixtrans-64.9-45.9175.1-178.850.7000112.5D179 T180 I181 Q185 N186 I187D179-H183 WeakPolarHBondContact O-CB 3.26Å; D179-H183 PolarHBondContact O-N 3.33Å; T180-H183 PolarHBondContact O-N 3.34Å; I181-H183 VanDerWaalsContact C-N 3.31Å; I181-H183 PolarHBondContact O-N 3.32Å; H183-Q185 VanDerWaalsContact C-N 3.34Å; H183-Q185 PolarHBondContact O-N 2.88Å; H183-N186 WeakPolarHBondContact O-CB 3.32Å; H183-N186 PolarHBondContact O-N 3.3Å; H183-I187 WeakPolarHBondContact O-CG1 3.41Å; H183-I187 PolarHBondContact O-N 3.4Å
184Y86.9Confident87Confident142 Ų14294.9 Ų94.956%0.55747%0.467SS*.Hα-helixtrans-63.7-38.3174.8-74.3-51.9000112.6T180 I181 N186 I187 I188T180-Y184 HydrophobicContact CG2-CD2 3.84Å; T180-Y184 HydrophobicContact CG2-CE2 3.47Å; T180-Y184 VanDerWaalsContact CG2-CE2 3.47Å; T180-Y184 VanDerWaalsContact O-CD2 3.28Å; T180-Y184 WeakPolarHBondContact O-CD2 3.35Å; T180-Y184 PolarHBondContact O-N 3.04Å; I181-Y184 PolarHBondContact O-N 3.11Å; Y184-N186 VanDerWaalsContact C-N 3.29Å; Y184-N186 PolarHBondContact O-N 3.48Å; Y184-I187 HydrophobicContact CD1-CD1 4.37Å; Y184-I187 PolarHBondContact O-N 2.82Å; Y184-I188 VanDerWaalsContact O-CG1 3.3Å; Y184-I188 WeakPolarHBondContact O-CG1 3.42Å; Y184-I188 PolarHBondContact O-N 3.47Å
185Q88Confident87.4Confident118 Ų11895.5 Ų95.555%0.55146%0.461SS*.Hα-helixtrans-64.5-35.4176.3-165.5168.310.600111.6I181 T182 H183 N189I181-Q185 WeakPolarHBondContact O-CB 3.15Å; I181-Q185 PolarHBondContact O-N 2.68Å; T182-Q185 PolarHBondContact O-N 3.25Å; H183-Q185 VanDerWaalsContact C-N 3.34Å; H183-Q185 PolarHBondContact O-N 2.88Å; Q185-N189 WeakPolarHBondContact O-CB 3.41Å; Q185-N189 PolarHBondContact O-N 3.11Å; Q185-N189 PolarHBondContact O-ND2 2.99Å; Q185-N189 VanDerWaalsContact O-ND2 3.13Å
186N89.9Confident87.6Confident85 Ų8596 Ų9646%0.45547%0.466SS..Hα-helixtrans-66-45.3170.9-71.4-22.7000112.4T182 H183 Y184 I188 N189 E190T182-N186 PolarHBondContact O-N 3.39Å; T182-N186 PolarHBondContact O-ND2 2.88Å; H183-N186 WeakPolarHBondContact O-CB 3.32Å; H183-N186 PolarHBondContact O-N 3.3Å; Y184-N186 VanDerWaalsContact C-N 3.29Å; Y184-N186 PolarHBondContact O-N 3.48Å; N186-I188 VanDerWaalsContact C-N 3.3Å; N186-I188 PolarHBondContact O-N 3.35Å; N186-N189 WeakPolarHBondContact O-CB 3.35Å; N186-N189 PolarHBondContact O-N 3.4Å; N186-N189 VanDerWaalsContact O-N 3.11Å; N186-E190 PolarHBondContact O-N 3.43Å
187I87.1Confident87.8Confident79 Ų7996.4 Ų96.441%0.40547%0.47SS..Hα-helixtrans-59.9-40.8175.4-68.4168.7000111.2H183 Y184 E190 G191H183-I187 WeakPolarHBondContact O-CG1 3.41Å; H183-I187 PolarHBondContact O-N 3.4Å; Y184-I187 HydrophobicContact CD1-CD1 4.37Å; Y184-I187 PolarHBondContact O-N 2.82Å; I187-E190 PolarHBondContact O-N 2.85Å; I187-G191 PolarHBondContact O-N 3.39Å
188I86.3Confident88.1Confident99 Ų9996.7 Ų96.751%0.50847%0.474SS..Hα-helixtrans-63.1-43175.2-70.2163.9000110.4Y184 N186 G191 N192Y184-I188 VanDerWaalsContact O-CG1 3.3Å; Y184-I188 WeakPolarHBondContact O-CG1 3.42Å; Y184-I188 PolarHBondContact O-N 3.47Å; N186-I188 VanDerWaalsContact C-N 3.3Å; N186-I188 PolarHBondContact O-N 3.35Å; I188-G191 PolarHBondContact O-N 3.09Å; I188-N192 WeakPolarHBondContact O-CB 3.06Å; I188-N192 PolarHBondContact O-N 3.02Å; I188-N192 PolarHBondContact O-ND2 3.47Å; I188-N192 PolarHBondContact O-OD1 2.96Å
189N89.4Confident88.3Confident74 Ų7498.8 Ų98.840%0.39648%0.479SS..Hα-helixtrans-65.8-38.9177.5-72-28.5000112.9Q185 N186 N192 R193Q185-N189 WeakPolarHBondContact O-CB 3.41Å; Q185-N189 PolarHBondContact O-N 3.11Å; Q185-N189 PolarHBondContact O-ND2 2.99Å; Q185-N189 VanDerWaalsContact O-ND2 3.13Å; N186-N189 WeakPolarHBondContact O-CB 3.35Å; N186-N189 PolarHBondContact O-N 3.4Å; N186-N189 VanDerWaalsContact O-N 3.11Å; N189-N192 PolarHBondContact O-N 3.03Å; N189-R193 WeakPolarHBondContact O-CG 3.47Å; N189-R193 PolarHBondContact O-N 3.21Å; N189-R193 VanDerWaalsContact O-N 3.08Å
190E88.1Confident88.5Confident107 Ų107100.7 Ų100.750%0.549%0.485SS..Hα-helixtrans-66.5-45.5172.7-71.7-179.8166.800111.5N186 I187 N192 R193 L194N186-E190 PolarHBondContact O-N 3.43Å; I187-E190 PolarHBondContact O-N 2.85Å; E190-N192 PolarHBondContact O-N 3.16Å; E190-R193 PolarHBondContact O-N 3.11Å; E190-L194 PolarHBondContact O-N 3.36Å
191G90.1Very high88.6Confident26 Ų26102 Ų10227%0.26849%0.488SS..Hα-helixtrans-63.7-27.8174.800000113.4I187 I188 R195I187-G191 PolarHBondContact O-N 3.39Å; I188-G191 PolarHBondContact O-N 3.09Å; G191-R195 WeakPolarHBondContact O-CG 3.44Å; G191-R195 PolarHBondContact O-N 3.42Å; G191-R195 PolarHBondContact O-NH1 3.24Å
192N88.9Confident88.8Confident53 Ų53101 Ų10128%0.28348%0.483SS..Hα-helixtrans-69.4-51.6171.7-68.8-16000110.6I188 N189 E190 L194 R195 D196I188-N192 WeakPolarHBondContact O-CB 3.06Å; I188-N192 PolarHBondContact O-N 3.02Å; I188-N192 PolarHBondContact O-ND2 3.47Å; I188-N192 PolarHBondContact O-OD1 2.96Å; N189-N192 PolarHBondContact O-N 3.03Å; E190-N192 PolarHBondContact O-N 3.16Å; N192-L194 VanDerWaalsContact C-N 3.34Å; N192-L194 PolarHBondContact O-N 3.39Å; N192-R195 PolarHBondContact O-N 2.93Å; N192-R195 VanDerWaalsContact OD1-CZ 3.31Å; N192-R195 PolarHBondContact OD1-NH1 2.76Å; N192-R195 PolarHBondContact OD1-NH2 3.08Å; N192-D196 PolarHBondContact O-N 2.95Å; N192-D196 VanDerWaalsContact O-N 3.14Å
193R89.3Confident88.9Confident175 Ų175103.1 Ų103.166%0.6649%0.491SS*.Hα-helixtrans-53.3-49.9175.5-72171.7177.7170.4-0.8111.7N189 E190 R195 D196 D197N189-R193 WeakPolarHBondContact O-CG 3.47Å; N189-R193 PolarHBondContact O-N 3.21Å; N189-R193 VanDerWaalsContact O-N 3.08Å; E190-R193 PolarHBondContact O-N 3.11Å; R193-R195 PolarHBondContact O-N 3.37Å; R193-D196 CarbonylContact O-C 3.55Å; R193-D196 WeakPolarHBondContact O-CA 3.26Å; R193-D196 PolarHBondContact O-N 3.33Å; R193-D197 VanDerWaalsContact O-CG 3.24Å; R193-D197 PolarHBondContact O-N 2.93Å
194L90.3Very high89Confident99 Ų99103.1 Ų103.152%0.51849%0.486SS..Hα-helixtrans-57.2-35178.1-179.262.6000113E190 N192 L198E190-L194 PolarHBondContact O-N 3.36Å; N192-L194 VanDerWaalsContact C-N 3.34Å; N192-L194 PolarHBondContact O-N 3.39Å; L194-L198 HydrophobicContact CD1-CD1 4.37Å; L194-L198 HydrophobicContact CD1-CG 4.43Å; L194-L198 HydrophobicContact CG-CD1 4.17Å; L194-L198 VanDerWaalsContact O-CB 3.31Å; L194-L198 WeakPolarHBondContact O-CB 3.5Å; L194-L198 WeakPolarHBondContact O-CD1 3.41Å; L194-L198 WeakPolarHBondContact O-CG 3.41Å; L194-L198 PolarHBondContact O-N 3.39Å
195R88.7Confident89Confident133 Ų13399.5 Ų99.550%0.50248%0.479SS..Hα-helixtrans-72.8-30.3175.8-70.7-169.3-41.2-81.69.8112.6G191 N192 R193 R199G191-R195 WeakPolarHBondContact O-CG 3.44Å; G191-R195 PolarHBondContact O-N 3.42Å; G191-R195 PolarHBondContact O-NH1 3.24Å; N192-R195 PolarHBondContact O-N 2.93Å; N192-R195 VanDerWaalsContact OD1-CZ 3.31Å; N192-R195 PolarHBondContact OD1-NH1 2.76Å; N192-R195 PolarHBondContact OD1-NH2 3.08Å; R193-R195 PolarHBondContact O-N 3.37Å; R195-R199 VanDerWaalsContact O-CD 3.28Å; R195-R199 WeakPolarHBondContact O-CD 3.43Å; R195-R199 WeakPolarHBondContact O-CG 3.36Å; R195-R199 PolarHBondContact O-N 3.47Å; R195-R199 VanDerWaalsContact O-N 3.1Å
196D89.9Confident89.1Confident83 Ų83101.5 Ų101.544%0.44448%0.482SS..Hα-helixtrans-78.6-38.6175.4-66.9-35.5000111.7N192 R193 L198 R199 E200N192-D196 PolarHBondContact O-N 2.95Å; N192-D196 VanDerWaalsContact O-N 3.14Å; R193-D196 CarbonylContact O-C 3.55Å; R193-D196 WeakPolarHBondContact O-CA 3.26Å; R193-D196 PolarHBondContact O-N 3.33Å; D196-L198 VanDerWaalsContact C-N 3.34Å; D196-L198 PolarHBondContact O-N 3.18Å; D196-R199 WeakPolarHBondContact O-CB 3.5Å; D196-R199 PolarHBondContact O-N 3.35Å; D196-R199 VanDerWaalsContact O-N 3.11Å; D196-R199 WeakPolarHBondContact OD1-CD 3.05Å; D196-R199 IonicContact OD1-CZ 2.95Å; D196-R199 IonicContact OD1-NE 2.67Å; D196-R199 IonicContact OD1-NH1 3.6Å; D196-R199 PolarHBondContact OD1-NH1 3.16Å; D196-E200 PolarHBondContact O-N 3.04Å
197D91.2Very high89Confident98 Ų98104.7 Ų104.752%0.52449%0.491SS..Hα-helixtrans-57.3-46.2169.2-60.1-30.6000110.9R193 R199 E200 E201R193-D197 VanDerWaalsContact O-CG 3.24Å; R193-D197 PolarHBondContact O-N 2.93Å; D197-R199 VanDerWaalsContact C-N 3.32Å; D197-R199 PolarHBondContact O-N 2.88Å; D197-E200 PolarHBondContact O-N 3Å; D197-E201 PolarHBondContact O-N 2.86Å
198L88.8Confident89.1Confident108 Ų108105.3 Ų105.357%0.56549%0.493SS*.Hα-helixtrans-65.8-30.6175.9-75.2169.3000113L194 D196 L202L194-L198 HydrophobicContact CD1-CD1 4.37Å; L194-L198 HydrophobicContact CD1-CG 4.43Å; L194-L198 HydrophobicContact CG-CD1 4.17Å; L194-L198 VanDerWaalsContact O-CB 3.31Å; L194-L198 WeakPolarHBondContact O-CB 3.5Å; L194-L198 WeakPolarHBondContact O-CD1 3.41Å; L194-L198 WeakPolarHBondContact O-CG 3.41Å; L194-L198 PolarHBondContact O-N 3.39Å; D196-L198 VanDerWaalsContact C-N 3.34Å; D196-L198 PolarHBondContact O-N 3.18Å; L198-L202 WeakPolarHBondContact O-CB 3.38Å; L198-L202 PolarHBondContact O-N 2.87Å
199R90.8Very high88.9Confident156 Ų156102.3 Ų102.359%0.58948%0.483SS*.Hα-helixtrans-69.2-42.1173.1-77.4158.8167.3178.7-7.5111.1R195 D196 D197 L202 L203R195-R199 VanDerWaalsContact O-CD 3.28Å; R195-R199 WeakPolarHBondContact O-CD 3.43Å; R195-R199 WeakPolarHBondContact O-CG 3.36Å; R195-R199 PolarHBondContact O-N 3.47Å; R195-R199 VanDerWaalsContact O-N 3.1Å; D196-R199 WeakPolarHBondContact O-CB 3.5Å; D196-R199 PolarHBondContact O-N 3.35Å; D196-R199 VanDerWaalsContact O-N 3.11Å; D196-R199 WeakPolarHBondContact OD1-CD 3.05Å; D196-R199 IonicContact OD1-CZ 2.95Å; D196-R199 IonicContact OD1-NE 2.67Å; D196-R199 IonicContact OD1-NH1 3.6Å; D196-R199 PolarHBondContact OD1-NH1 3.16Å; D197-R199 VanDerWaalsContact C-N 3.32Å; D197-R199 PolarHBondContact O-N 2.88Å; R199-L202 PolarHBondContact O-N 2.92Å; R199-L203 VanDerWaalsContact O-CG 3.31Å; R199-L203 WeakPolarHBondContact O-CG 3.38Å; R199-L203 PolarHBondContact O-N 3.39Å
200E89.5Confident88.6Confident143 Ų143101.5 Ų101.567%0.66849%0.486SS*.Hα-helixtrans-66-45.5176.1-173167.4-178.800111.4D196 D197 L202 L203 R204D196-E200 PolarHBondContact O-N 3.04Å; D197-E200 PolarHBondContact O-N 3Å; E200-L202 PolarHBondContact O-N 3.38Å; E200-L203 WeakPolarHBondContact O-CB 3.34Å; E200-L203 PolarHBondContact O-N 3.39Å; E200-L203 VanDerWaalsContact O-N 3.14Å; E200-R204 WeakPolarHBondContact O-CB 3.33Å; E200-R204 PolarHBondContact O-N 2.89Å
201E88.5Confident88.5Confident78 Ų78100.3 Ų100.336%0.36448%0.482SS..Hα-helixtrans-63.4-39.1176.1-176.459.5-163.800111.9D197 L203 R204 V205D197-E201 PolarHBondContact O-N 2.86Å; E201-L203 VanDerWaalsContact C-N 3.32Å; E201-L203 PolarHBondContact O-N 3.25Å; E201-R204 WeakPolarHBondContact O-CB 3.39Å; E201-R204 PolarHBondContact O-N 2.82Å; E201-R204 VanDerWaalsContact O-N 3.16Å; E201-R204 IonicContact OE1-CZ 3.81Å; E201-R204 IonicContact OE1-NE 3.84Å; E201-R204 PolarHBondContact OE1-NE 3.11Å; E201-R204 IonicContact OE1-NH2 2.93Å; E201-R204 PolarHBondContact OE1-NH2 3.27Å; E201-R204 WeakPolarHBondContact OE2-CD 3.24Å; E201-R204 IonicContact OE2-CZ 3.32Å; E201-R204 IonicContact OE2-NE 2.59Å; E201-R204 PolarHBondContact OE2-NE 3.34Å; E201-R204 IonicContact OE2-NH2 2.69Å; E201-V205 HydrophobicContact CG-CG2 4.41Å; E201-V205 WeakPolarHBondContact O-CB 3.38Å; E201-V205 WeakPolarHBondContact O-CG2 3.36Å; E201-V205 PolarHBondContact O-N 3.47Å
202L88.6Confident88.1Confident85 Ų85101.7 Ų101.745%0.44549%0.491SS..Hα-helixtrans-62.3-38.7173.7-175.569.4000112L198 R199 E200 R206L198-L202 WeakPolarHBondContact O-CB 3.38Å; L198-L202 PolarHBondContact O-N 2.87Å; R199-L202 PolarHBondContact O-N 2.92Å; E200-L202 PolarHBondContact O-N 3.38Å; L202-R206 VanDerWaalsContact O-CB 3.29Å; L202-R206 WeakPolarHBondContact O-CB 3.43Å; L202-R206 WeakPolarHBondContact O-CD 3.39Å; L202-R206 WeakPolarHBondContact O-CG 3.48Å; L202-R206 PolarHBondContact O-N 2.96Å
203L87.6Confident87.6Confident113 Ų113108 Ų10859%0.59251%0.511SS*.Hα-helixtrans-67.1-39.2173.1-71.6168.1000111.5R199 E200 E201 R206 K207R199-L203 VanDerWaalsContact O-CG 3.31Å; R199-L203 WeakPolarHBondContact O-CG 3.38Å; R199-L203 PolarHBondContact O-N 3.39Å; E200-L203 WeakPolarHBondContact O-CB 3.34Å; E200-L203 PolarHBondContact O-N 3.39Å; E200-L203 VanDerWaalsContact O-N 3.14Å; E201-L203 VanDerWaalsContact C-N 3.32Å; E201-L203 PolarHBondContact O-N 3.25Å; L203-R206 PolarHBondContact O-N 3.2Å; L203-K207 WeakPolarHBondContact O-CB 3.33Å; L203-K207 PolarHBondContact O-N 2.67Å
204R91.6Very high87.1Confident111 Ų111103.6 Ų103.642%0.41951%0.507SS..Hα-helixtrans-61.8-50.1175.4-156.5-173.972.567.816.8111.4E200 E201 K207 E208E200-R204 WeakPolarHBondContact O-CB 3.33Å; E200-R204 PolarHBondContact O-N 2.89Å; E201-R204 WeakPolarHBondContact O-CB 3.39Å; E201-R204 PolarHBondContact O-N 2.82Å; E201-R204 VanDerWaalsContact O-N 3.16Å; E201-R204 IonicContact OE1-CZ 3.81Å; E201-R204 IonicContact OE1-NE 3.84Å; E201-R204 PolarHBondContact OE1-NE 3.11Å; E201-R204 IonicContact OE1-NH2 2.93Å; E201-R204 PolarHBondContact OE1-NH2 3.27Å; E201-R204 WeakPolarHBondContact OE2-CD 3.24Å; E201-R204 IonicContact OE2-CZ 3.32Å; E201-R204 IonicContact OE2-NE 2.59Å; E201-R204 PolarHBondContact OE2-NE 3.34Å; E201-R204 IonicContact OE2-NH2 2.69Å; R204-K207 WeakPolarHBondContact O-CB 3.47Å; R204-K207 PolarHBondContact O-N 3.08Å; R204-E208 IonicContact CZ-OE1 3.67Å; R204-E208 IonicContact NH1-OE1 3.55Å; R204-E208 PolarHBondContact NH1-OE1 2.8Å; R204-E208 IonicContact NH2-OE1 3.92Å; R204-E208 PolarHBondContact O-N 3.18Å
205V87Confident86.6Confident67 Ų67107.4 Ų107.441%0.40652%0.515SS..Hα-helixtrans-64.1-40177171.80000111.6E201 K207 E208 A209E201-V205 HydrophobicContact CG-CG2 4.41Å; E201-V205 WeakPolarHBondContact O-CB 3.38Å; E201-V205 WeakPolarHBondContact O-CG2 3.36Å; E201-V205 PolarHBondContact O-N 3.47Å; V205-K207 VanDerWaalsContact C-N 3.32Å; V205-K207 PolarHBondContact O-N 3.38Å; V205-E208 PolarHBondContact O-N 3.25Å; V205-A209 VanDerWaalsContact O-CB 3.27Å; V205-A209 WeakPolarHBondContact O-CB 3.22Å; V205-A209 PolarHBondContact O-N 3.16Å
206R88.9Confident85.8Confident160 Ų160106.9 Ų106.960%0.60452%0.521SS*.Hα-helixtrans-61.2-39.5173.2-77.4169.1175.7-174.1-2.2112L202 L203 A210L202-R206 VanDerWaalsContact O-CB 3.29Å; L202-R206 WeakPolarHBondContact O-CB 3.43Å; L202-R206 WeakPolarHBondContact O-CD 3.39Å; L202-R206 WeakPolarHBondContact O-CG 3.48Å; L202-R206 PolarHBondContact O-N 2.96Å; L203-R206 PolarHBondContact O-N 3.2Å; R206-A210 WeakPolarHBondContact O-CB 3.2Å; R206-A210 PolarHBondContact O-N 2.97Å
207K89.3Confident84.7Confident151 Ų151105.9 Ų105.966%0.65752%0.524SS*.Hα-helixtrans-67.6-44.3175.8-169.4177.2-178179.40112L203 R204 V205 A210 I211L203-K207 WeakPolarHBondContact O-CB 3.33Å; L203-K207 PolarHBondContact O-N 2.67Å; R204-K207 WeakPolarHBondContact O-CB 3.47Å; R204-K207 PolarHBondContact O-N 3.08Å; V205-K207 VanDerWaalsContact C-N 3.32Å; V205-K207 PolarHBondContact O-N 3.38Å; K207-A210 PolarHBondContact O-N 3.32Å; K207-I211 HydrophobicContact CG-CD1 4.43Å; K207-I211 WeakPolarHBondContact O-CG1 3.39Å; K207-I211 PolarHBondContact O-N 2.99Å; K207-I211 VanDerWaalsContact O-N 3.08Å
208E88.2Confident83.7Confident93 Ų93105.2 Ų105.244%0.43553%0.527SS..Hα-helixtrans-61-44.4172.9-73.8-171.517000112R204 V205 A210 I211 A212R204-E208 IonicContact CZ-OE1 3.67Å; R204-E208 IonicContact NH1-OE1 3.55Å; R204-E208 PolarHBondContact NH1-OE1 2.8Å; R204-E208 IonicContact NH2-OE1 3.92Å; R204-E208 PolarHBondContact O-N 3.18Å; V205-E208 PolarHBondContact O-N 3.25Å; E208-A210 VanDerWaalsContact C-N 3.34Å; E208-A210 PolarHBondContact O-N 3.29Å; E208-I211 PolarHBondContact O-N 2.97Å; E208-A212 WeakPolarHBondContact O-CB 3.39Å; E208-A212 PolarHBondContact O-N 3.39Å
209A81.5Confident82.1Confident36 Ų36103 Ų10330%0.29853%0.525SS..Hα-helixtrans-64-36.7177.900000112.4V205 A212 R213V205-A209 VanDerWaalsContact O-CB 3.27Å; V205-A209 WeakPolarHBondContact O-CB 3.22Å; V205-A209 PolarHBondContact O-N 3.16Å; A209-A212 PolarHBondContact O-N 2.95Å; A209-R213 WeakPolarHBondContact O-CB 3.37Å; A209-R213 VanDerWaalsContact O-CG 3.27Å; A209-R213 WeakPolarHBondContact O-CG 3.45Å; A209-R213 PolarHBondContact O-N 3.02Å
210A83.4Confident80.2Confident57 Ų57100.7 Ų100.747%0.47153%0.528SS..Hα-helixtrans-64.5-43172.900000111.9R206 K207 E208 R213 S214R206-A210 WeakPolarHBondContact O-CB 3.2Å; R206-A210 PolarHBondContact O-N 2.97Å; K207-A210 PolarHBondContact O-N 3.32Å; E208-A210 VanDerWaalsContact C-N 3.34Å; E208-A210 PolarHBondContact O-N 3.29Å; A210-R213 PolarHBondContact O-N 3.35Å; A210-S214 WeakPolarHBondContact O-CB 3.37Å; A210-S214 PolarHBondContact O-N 3.04Å
211I86.1Confident78.3Confident81 Ų8199.6 Ų99.642%0.41553%0.531SS..Hα-helixtrans-63.1-42174.4-66.2162.8000110.7K207 E208 S214 R215K207-I211 HydrophobicContact CG-CD1 4.43Å; K207-I211 WeakPolarHBondContact O-CG1 3.39Å; K207-I211 PolarHBondContact O-N 2.99Å; K207-I211 VanDerWaalsContact O-N 3.08Å; E208-I211 PolarHBondContact O-N 2.97Å; I211-S214 PolarHBondContact O-N 3.29Å; I211-R215 WeakPolarHBondContact O-CG 3.05Å; I211-R215 PolarHBondContact O-N 2.89Å
212A81.7Confident75.9Confident55 Ų55104 Ų10446%0.45555%0.552SS.*Hα-helixtrans-64.5-42.9177.500000112.3E208 A209 R215 L216E208-A212 WeakPolarHBondContact O-CB 3.39Å; E208-A212 PolarHBondContact O-N 3.39Å; A209-A212 PolarHBondContact O-N 2.95Å; A212-R215 PolarHBondContact O-N 3.22Å; A212-L216 WeakPolarHBondContact O-CB 3.41Å; A212-L216 PolarHBondContact O-N 3.09Å
213R78.9Confident73.2Confident187 Ų187111.1 Ų111.171%0.70657%0.573SS**Hα-helixtrans-63.1-41.3173.8-71.1174.5-159.9-166.25.3112A209 A210 L216 A217A209-R213 WeakPolarHBondContact O-CB 3.37Å; A209-R213 VanDerWaalsContact O-CG 3.27Å; A209-R213 WeakPolarHBondContact O-CG 3.45Å; A209-R213 PolarHBondContact O-N 3.02Å; A210-R213 PolarHBondContact O-N 3.35Å; R213-L216 PolarHBondContact O-N 3.19Å; R213-A217 WeakPolarHBondContact O-CB 3.38Å; R213-A217 PolarHBondContact O-N 2.86Å
214S78.2Confident70.9Confident82 Ų82111.8 Ų111.857%0.57358%0.584SS**Hα-helixtrans-60.6-46.4175.3-177.90000111.7A210 I211 A217 S218A210-S214 WeakPolarHBondContact O-CB 3.37Å; A210-S214 PolarHBondContact O-N 3.04Å; I211-S214 PolarHBondContact O-N 3.29Å; S214-A217 PolarHBondContact O-N 3.12Å; S214-S218 PolarHBondContact O-N 3.44Å; S214-S218 PolarHBondContact O-OG 3.1Å
215R80.3Confident68.2Low179 Ų179112.8 Ų112.868%0.67560%0.602SS**Hα-helixtrans-60.3-45.6173.3-72.6174.8178.1174.9-0.4112.2I211 A212 S218 A219I211-R215 WeakPolarHBondContact O-CG 3.05Å; I211-R215 PolarHBondContact O-N 2.89Å; A212-R215 PolarHBondContact O-N 3.22Å; R215-S218 WeakPolarHBondContact CA-OG 3.49Å; R215-S218 PolarHBondContact O-N 3.32Å; R215-S218 PolarHBondContact O-OG 3.49Å; R215-A219 PolarHBondContact O-N 3.39Å
216L71.7Confident65.4Low121 Ų121116.7 Ų116.763%0.63462%0.62SS**Hα-helixtrans-61.7-46.5178.9-163.278000111.1A212 R213 S218 A219 T220A212-L216 WeakPolarHBondContact O-CB 3.41Å; A212-L216 PolarHBondContact O-N 3.09Å; R213-L216 PolarHBondContact O-N 3.19Å; L216-S218 VanDerWaalsContact C-N 3.33Å; L216-S218 PolarHBondContact O-N 3.07Å; L216-A219 PolarHBondContact O-N 3.01Å; L216-T220 PolarHBondContact O-N 2.67Å; L216-T220 PolarHBondContact O-OG1 3.48Å
217A67.9Low62.6Low62 Ų62114.2 Ų114.251%0.51263%0.628SS.*Hα-helixtrans-57.5-43.817600000111.9R213 S214 A219 T220 T221R213-A217 WeakPolarHBondContact O-CB 3.38Å; R213-A217 PolarHBondContact O-N 2.86Å; S214-A217 PolarHBondContact O-N 3.12Å; A217-A219 VanDerWaalsContact C-N 3.27Å; A217-A219 PolarHBondContact O-N 3.14Å; A217-T220 PolarHBondContact O-N 3.39Å; A217-T221 PolarHBondContact O-OG1 2.93Å
218S68.5Low60.5Low85 Ų85112.7 Ų112.759%0.59463%0.633SS**Hα-helixtrans-65.6-26.3175.565.90000114.1S214 R215 L216S214-S218 PolarHBondContact O-N 3.44Å; S214-S218 PolarHBondContact O-OG 3.1Å; R215-S218 WeakPolarHBondContact CA-OG 3.49Å; R215-S218 PolarHBondContact O-N 3.32Å; R215-S218 PolarHBondContact O-OG 3.49Å; L216-S218 VanDerWaalsContact C-N 3.33Å; L216-S218 PolarHBondContact O-N 3.07Å
219A55.8Low57.7Low62 Ų62114.8 Ų114.851%0.51265%0.652SS.*Hα-helixtrans-84.8-34.117700000113.2R215 L216 A217 T221 Q222R215-A219 PolarHBondContact O-N 3.39Å; L216-A219 PolarHBondContact O-N 3.01Å; A217-A219 VanDerWaalsContact C-N 3.27Å; A217-A219 PolarHBondContact O-N 3.14Å; A219-T221 PolarHBondContact O-N 3.23Å; A219-Q222 PolarHBondContact O-N 3.14Å; A219-Q222 VanDerWaalsContact O-N 3.1Å
220T51.6Low55Low106 Ų106119.3 Ų119.365%0.6568%0.676SS**Hα-helixtrans-63.3-25.4-178.3-50.50000112.5L216 A217 Q222L216-T220 PolarHBondContact O-N 2.67Å; L216-T220 PolarHBondContact O-OG1 3.48Å; A217-T220 PolarHBondContact O-N 3.39Å; T220-Q222 PolarHBondContact O-N 2.93Å; T220-Q222 VanDerWaalsContact O-N 3.11Å
221T48.8Very low52.3Low120 Ų120121.7 Ų121.774%0.73669%0.69SS**THydrogen-bonded Turntrans-63.5-11.1174.5-38.10000113.9A217 A219A217-T221 PolarHBondContact O-OG1 2.93Å; A219-T221 PolarHBondContact O-N 3.23Å
222Q39.1Very low49.4Very low170 Ų170124 Ų12479%0.79471%0.707SS**THydrogen-bonded Turntrans-137.669.2-177.2-65.6-166.90.800115.1A219 T220A219-Q222 PolarHBondContact O-N 3.14Å; A219-Q222 VanDerWaalsContact O-N 3.1Å; T220-Q222 PolarHBondContact O-N 2.93Å; T220-Q222 VanDerWaalsContact O-N 3.11Å
223R31.7Very low46.8Very low236 Ų236127.3 Ų127.389%0.89172%0.724SS**  trans-163.7136.2141.8-122.3168.3175.7134.4-0.6115.1
224P39.4Very low44.2Very low126 Ų126127.7 Ų127.782%0.81873%0.734SS**  trans-83167.2169.534.6-35.3000113
225V33.2Very low41.7Very low132 Ų132128.2 Ų128.280%0.874%0.743SS**  trans-71141.7-175.7175.30000113.1
226N29.2Very low39.3Very low149 Ų149125.8 Ų125.880%0.79775%0.75SS**  trans-170.3140.4136.4-100.5-24.9000115.1
227S30.4Very low37.1Very low109 Ų109127.5 Ų127.576%0.76276%0.76SS**  trans62.1131.7156.2-56.80000121.6
228P45.5Very low35.2Very low118 Ų118133.2 Ų133.277%0.76678%0.776SS**  trans-97.3163.5174.639-34.8000113.7
229V29.4Very low33.2Very low137 Ų137138.6 Ų138.683%0.8379%0.791SS**  trans-134.5135.8163177.10000108.5
230T24.5Very low32Very low132 Ų132143.5 Ų143.581%0.8180%0.803SS**  trans-121.5123.9178.8-43.80000109.3
231S26.6Very low31.3Very low107 Ų107143.8 Ų143.875%0.74881%0.807SS**  trans-149.8102.7176.843.60000111.2
232T24.9Very low30.5Very low128 Ų128146.8 Ų146.879%0.78581%0.81SS**PPolyproline II helixtrans-86.3122.5176.545.30000110.9
233P27.6Very low30.3Very low125 Ų125143.9 Ų143.981%0.81280%0.8SS**PPolyproline II helixtrans-78.6151.7177.532.2-34.5000112.4
234H24.2Very low30.6Very low195 Ų195140.3 Ų140.390%0.90379%0.793SS**PPolyproline II helixtrans-79148.5173.9-70.6-47.7000112.5
235A25Very low30.7Very low94 Ų94137.8 Ų137.878%0.77778%0.783SS**PPolyproline II helixtrans-96.7139173.700000111.4
236P30.6Very low30.9Very low127 Ų127137 Ų13783%0.82577%0.774SS**PPolyproline II helixtrans-86.1162.6177.634.6-34.9000113.4
237N25.8Very low31.7Very low157 Ų157136.4 Ų136.484%0.8477%0.765SS**PPolyproline II helixtrans-74.6161.5-168.6-82.9-27.2000116.5
238H26.5Very low32.3Very low183 Ų183137.5 Ų137.585%0.84776%0.76SS**PPolyproline II helixtrans-64151.6-179.6-57.3-88.7000115.3
239H28.1Very low32.3Very low197 Ų197134.4 Ų134.491%0.91274%0.744SS**  trans-128.2147.5156.3-93.2-48.5000110.7
240H29.9Very low33.2Very low166 Ų166131.8 Ų131.877%0.76973%0.728SS**  trans-89.9141.6-174.5-123.5-83.3000111.8F242H240-F242 PolarHBondContact O-N 2.96Å
241P36.6Very low34.2Very low112 Ų112129.5 Ų129.573%0.72771%0.714SS**THydrogen-bonded Turntrans-93.960.4-167.537.9-38.4000114.3
242F31.7Very low34.9Very low182 Ų182129.1 Ų129.180%0.79870%0.702SS**THydrogen-bonded Turntrans-118.2-13.6174.1-93.3-80.1000115.5H240 E244H240-F242 PolarHBondContact O-N 2.96Å; F242-E244 VanDerWaalsContact C-N 3.34Å; F242-E244 PolarHBondContact O-N 3.31Å
243D35.1Very low35.9Very low109 Ų109129.5 Ų129.558%0.58370%0.697SS**THydrogen-bonded Turntrans-78.3-6.3-178.5-86.81000115.2A245 D246 K247D243-A245 VanDerWaalsContact C-N 3.33Å; D243-A245 PolarHBondContact O-N 2.98Å; D243-D246 PolarHBondContact O-N 2.69Å; D243-K247 WeakPolarHBondContact O-CB 3.5Å; D243-K247 PolarHBondContact O-N 2.97Å
244E38.3Very low36.9Very low161 Ų161128.4 Ų128.475%0.75269%0.687SS**Hα-helixtrans-70-29.1-165.7-161.9162-125.500113.4F242 M248F242-E244 VanDerWaalsContact C-N 3.34Å; F242-E244 PolarHBondContact O-N 3.31Å; E244-M248 PolarHBondContact O-N 3.32Å; E244-M248 VanDerWaalsContact O-N 3.15Å
245A41.6Very low37.6Very low73 Ų73122.2 Ų122.260%0.60366%0.659SS**Hα-helixtrans-68.8-47.3173.100000112.1D243 M248 A249D243-A245 VanDerWaalsContact C-N 3.33Å; D243-A245 PolarHBondContact O-N 2.98Å; A245-M248 PolarHBondContact O-N 3.01Å; A245-M248 VanDerWaalsContact O-N 3.14Å; A245-A249 PolarHBondContact O-N 3Å
246D38.4Very low38.8Very low115 Ų115122.6 Ų122.662%0.61565%0.652SS**Hα-helixtrans-72.8-29.5-179.6-78.3-6.3000111.8D243 A249 T250D243-D246 PolarHBondContact O-N 2.69Å; D246-A249 PolarHBondContact O-N 3.17Å; D246-T250 WeakPolarHBondContact O-CB 3.34Å; D246-T250 PolarHBondContact O-N 3.25Å; D246-T250 PolarHBondContact O-OG1 3.12Å
247K44.8Very low39Very low138 Ų138122.9 Ų122.960%0.665%0.647SS**Hα-helixtrans-62.2-41.5166.1-84.7-178.1176.3171.40112.1D243 T251D243-K247 WeakPolarHBondContact O-CB 3.5Å; D243-K247 PolarHBondContact O-N 2.97Å; K247-T251 WeakPolarHBondContact O-CB 3.46Å; K247-T251 PolarHBondContact O-N 3.41Å; K247-T251 PolarHBondContact O-OG1 2.98Å
248M42.9Very low39.5Very low132 Ų132123.3 Ų123.365%0.6564%0.644SS**Hα-helixtrans-68.2-40.8177.6-169.5168-71.500112E244 A245 T251 M252E244-M248 PolarHBondContact O-N 3.32Å; E244-M248 VanDerWaalsContact O-N 3.15Å; A245-M248 PolarHBondContact O-N 3.01Å; A245-M248 VanDerWaalsContact O-N 3.14Å; M248-T251 PolarHBondContact O-N 3.48Å; M248-M252 PolarHBondContact O-N 3.42Å; M248-M252 VanDerWaalsContact O-N 3.13Å
249A46.8Very low40.1Very low53 Ų53118.6 Ų118.644%0.43864%0.636SS.*Hα-helixtrans-62.2-48.3173.100000112.1A245 D246 T251 M252 M253A245-A249 PolarHBondContact O-N 3Å; D246-A249 PolarHBondContact O-N 3.17Å; A249-T251 VanDerWaalsContact C-N 3.32Å; A249-T251 PolarHBondContact O-N 2.91Å; A249-M252 PolarHBondContact O-N 2.77Å; A249-M253 PolarHBondContact O-N 3.12Å; A249-M253 VanDerWaalsContact O-N 3.07Å
250T48.2Very low40.6Very low82 Ų82117.8 Ų117.850%0.50363%0.633SS.*Hα-helixtrans-59-42.6176.7-56.80000111.5D246 M252 M253 V254D246-T250 WeakPolarHBondContact O-CB 3.34Å; D246-T250 PolarHBondContact O-N 3.25Å; D246-T250 PolarHBondContact O-OG1 3.12Å; T250-M252 VanDerWaalsContact C-N 3.32Å; T250-M252 PolarHBondContact O-N 2.92Å; T250-M253 PolarHBondContact O-N 3.32Å; T250-M253 VanDerWaalsContact O-N 3.12Å; T250-V254 WeakPolarHBondContact O-CG2 3.06Å; T250-V254 PolarHBondContact O-N 3.27Å
251T45.7Very low40.8Very low84 Ų84116.6 Ų116.652%0.51563%0.631SS.*Hα-helixtrans-61-40.7177.4-57.10000111.4K247 M248 A249 M255K247-T251 WeakPolarHBondContact O-CB 3.46Å; K247-T251 PolarHBondContact O-N 3.41Å; K247-T251 PolarHBondContact O-OG1 2.98Å; M248-T251 PolarHBondContact O-N 3.48Å; A249-T251 VanDerWaalsContact C-N 3.32Å; A249-T251 PolarHBondContact O-N 2.91Å; T251-M255 WeakPolarHBondContact O-CG 3.36Å; T251-M255 PolarHBondContact O-N 3.47Å
252M40.3Very low41Very low99 Ų99116.8 Ų116.849%0.48864%0.635SS.*Hα-helixtrans-65.6-38.2173.9-69.2-153.4-53.400112.9M248 A249 T250 M255 T256 I280M248-M252 PolarHBondContact O-N 3.42Å; M248-M252 VanDerWaalsContact O-N 3.13Å; A249-M252 PolarHBondContact O-N 2.77Å; T250-M252 VanDerWaalsContact C-N 3.32Å; T250-M252 PolarHBondContact O-N 2.92Å; M252-M255 WeakPolarHBondContact O-CB 3.29Å; M252-M255 PolarHBondContact O-N 3.4Å; M252-T256 PolarHBondContact O-N 3.38Å; M252-I280 HydrophobicContact SD-CD1 3.7Å
253M45.2Very low41.4Very low136 Ų136117.2 Ų117.267%0.6764%0.64SS**Hα-helixtrans-67.5-39.4179.9-158.917680.200111.8A249 T250 M255 T256A249-M253 PolarHBondContact O-N 3.12Å; A249-M253 VanDerWaalsContact O-N 3.07Å; T250-M253 PolarHBondContact O-N 3.32Å; T250-M253 VanDerWaalsContact O-N 3.12Å; M253-M255 PolarHBondContact O-N 2.66Å; M253-T256 PolarHBondContact O-N 2.93Å; M253-T256 VanDerWaalsContact O-N 3.13Å; M253-T256 PolarHBondContact O-OG1 3.44Å
254V48.9Very low41.4Very low101 Ų101118.4 Ų118.461%0.61265%0.646SS**Hα-helixtrans-63-30.3172.2172.50000111.9T250 T256T250-V254 WeakPolarHBondContact O-CG2 3.06Å; T250-V254 PolarHBondContact O-N 3.27Å; V254-T256 VanDerWaalsContact C-N 3.28Å; V254-T256 PolarHBondContact O-N 3.14Å
255M40.3Very low41.5Very low65 Ų65119.9 Ų119.932%0.3265%0.652SS.*THydrogen-bonded Turntrans-73-13175.4-73.3-17970.500114.4T251 M252 M253 H258 I273T251-M255 WeakPolarHBondContact O-CG 3.36Å; T251-M255 PolarHBondContact O-N 3.47Å; M252-M255 WeakPolarHBondContact O-CB 3.29Å; M252-M255 PolarHBondContact O-N 3.4Å; M253-M255 PolarHBondContact O-N 2.66Å; M255-H258 PolarHBondContact O-CE1 2.79Å; M255-H258 PolarHBondContact O-ND1 3.44Å; M255-H258 PolarHBondContact O-NE2 3.15Å; M255-I273 HydrophobicContact CE-CB 4.47Å; M255-I273 HydrophobicContact CE-CD1 3.88Å; M255-I273 HydrophobicContact CE-CG1 3.9Å; M255-I273 HydrophobicContact CE-CG2 3.87Å
256T48.2Very low41.6Very low102 Ų102123.8 Ų123.863%0.62666%0.663SS**THydrogen-bonded Turntrans-86.1-22.917920.20000114.9M252 M253 V254 H258M252-T256 PolarHBondContact O-N 3.38Å; M253-T256 PolarHBondContact O-N 2.93Å; M253-T256 VanDerWaalsContact O-N 3.13Å; M253-T256 PolarHBondContact O-OG1 3.44Å; V254-T256 VanDerWaalsContact C-N 3.28Å; V254-T256 PolarHBondContact O-N 3.14Å; T256-H258 VanDerWaalsContact C-N 3.25Å; T256-H258 PolarHBondContact O-N 3.13Å
257D36.6Very low41.7Very low133 Ų133124.3 Ų124.371%0.71167%0.665SS**  trans-81.866.9178.7-77.2-33.1000112A259D257-A259 PolarHBondContact O-N 2.89Å
258H34.9Very low42Very low167 Ų167121.1 Ų121.177%0.77366%0.658SS**THydrogen-bonded Turntrans-70.428.6-179.5-74.9-36.3000115.2M255 T256M255-H258 PolarHBondContact O-CE1 2.79Å; M255-H258 PolarHBondContact O-ND1 3.44Å; M255-H258 PolarHBondContact O-NE2 3.15Å; T256-H258 VanDerWaalsContact C-N 3.25Å; T256-H258 PolarHBondContact O-N 3.13Å
259A40.2Very low42.3Very low84 Ų84119 Ų11969%0.69466%0.655SS**THydrogen-bonded Turntrans-102.4-43.3-171.500000115.5D257D257-A259 PolarHBondContact O-N 2.89Å
260E39Very low43Very low180 Ų180124 Ų12484%0.84167%0.669SS**SBendtrans-123.2-3-159.6-61.5-160.1141.900117.2
261L33.7Very low43.6Very low141 Ų141125.6 Ų125.674%0.73867%0.674SS**  trans-11048.6-170.6-86.1155.8000115.3Q263L261-Q263 PolarHBondContact O-N 2.67Å
262S40Very low44.3Very low116 Ų116123.2 Ų123.281%0.81166%0.663SS**THydrogen-bonded Turntrans-73.823.1-179-54.70000116.1
263Q40.9Very low45.3Very low191 Ų191121 Ų12189%0.89365%0.653SS**THydrogen-bonded Turntrans-137.417.3-174.2-67.2-164.26.100116.1L261L261-Q263 PolarHBondContact O-N 2.67Å
264L34.8Very low46.4Very low134 Ų134119.2 Ų119.270%0.70265%0.645SS**  trans-113.9115.9169.8-137.275.3000111.3D266L264-D266 PolarHBondContact O-N 3.12Å
265H40.1Very low47.3Very low191 Ų191120.2 Ų120.288%0.88464%0.643SS**THydrogen-bonded Turntrans-88.81.6-161-138.9-57000115.2
266D43.2Very low48.4Very low156 Ų156121.9 Ų121.983%0.83465%0.652SS**THydrogen-bonded Turntrans-104.718.7-175-75.5-53.1000114.1L264L264-D266 PolarHBondContact O-N 3.12Å
267L41.5Very low49.6Very low125 Ų125125.2 Ų125.265%0.65465%0.653SS**PPolyproline II helixtrans-67.2126.5172.4-83.7163000110.6
268P49.9Very low51.3Low72 Ų72123 Ų12347%0.46865%0.645SS.*PPolyproline II helixtrans-66148.6-178.527.1-34.5000111.5A272P268-A272 HydrophobicContact CB-CB 4.48Å
269P50.9Low52.9Low88 Ų88120.4 Ų120.457%0.57163%0.633SS**PPolyproline II helixtrans-60.1149.5-171.923.8-34.5000112.6D271 A272P269-D271 PolarHBondContact O-N 3.07Å; P269-A272 VanDerWaalsContact O-CB 3.3Å; P269-A272 WeakPolarHBondContact O-CB 3.47Å; P269-A272 PolarHBondContact O-N 3.41Å
270Q60.4Low54.5Low157 Ų157119.4 Ų119.473%0.73462%0.615SS**Hα-helixtrans-55.2-31.9-168.4-153.5167.71700114A272 I273 I274Q270-A272 VanDerWaalsContact C-N 3.31Å; Q270-A272 PolarHBondContact O-N 3.18Å; Q270-I273 WeakPolarHBondContact O-CB 3.42Å; Q270-I273 PolarHBondContact O-N 3.41Å; Q270-I274 WeakPolarHBondContact O-CG1 3.22Å; Q270-I274 PolarHBondContact O-N 3.18Å
271D61.2Low56.4Low115 Ų115114.2 Ų114.262%0.61559%0.591SS**Hα-helixtrans-59.4-36.3172.9-70-37.1000113.6P269 I273 I274 Q275P269-D271 PolarHBondContact O-N 3.07Å; D271-I273 VanDerWaalsContact C-N 3.34Å; D271-I274 PolarHBondContact O-N 2.73Å; D271-Q275 WeakPolarHBondContact O-CG 3.48Å; D271-Q275 PolarHBondContact O-N 3.13Å
272A60.2Low58.4Low34 Ų34114.8 Ų114.828%0.28158%0.584SS.*Hα-helixtrans-67.8-36.7177.500000111.3P268 P269 Q270 Q275 L276P268-A272 HydrophobicContact CB-CB 4.48Å; P269-A272 VanDerWaalsContact O-CB 3.3Å; P269-A272 WeakPolarHBondContact O-CB 3.47Å; P269-A272 PolarHBondContact O-N 3.41Å; Q270-A272 VanDerWaalsContact C-N 3.31Å; Q270-A272 PolarHBondContact O-N 3.18Å; A272-Q275 PolarHBondContact O-N 3.46Å; A272-L276 WeakPolarHBondContact O-CB 3.45Å; A272-L276 WeakPolarHBondContact O-CG 3.47Å; A272-L276 PolarHBondContact O-N 3.36Å
273I61.3Low59.9Low54 Ų54117.5 Ų117.528%0.27758%0.577SS.*Hα-helixtrans-65-43.2174.5-51.9179.3000110M255 Q270 D271 L276 R277M255-I273 HydrophobicContact CE-CB 4.47Å; M255-I273 HydrophobicContact CE-CD1 3.88Å; M255-I273 HydrophobicContact CE-CG1 3.9Å; M255-I273 HydrophobicContact CE-CG2 3.87Å; Q270-I273 WeakPolarHBondContact O-CB 3.42Å; Q270-I273 PolarHBondContact O-N 3.41Å; D271-I273 VanDerWaalsContact C-N 3.34Å; I273-L276 PolarHBondContact O-N 3Å; I273-R277 WeakPolarHBondContact O-CB 3.42Å; I273-R277 PolarHBondContact O-N 2.87Å
274I69.1Low61.7Low98 Ų98112.3 Ų112.350%0.50355%0.554SS.*Hα-helixtrans-63.5-43.1175.7-65.6165.9000111.1Q270 D271 T278Q270-I274 WeakPolarHBondContact O-CG1 3.22Å; Q270-I274 PolarHBondContact O-N 3.18Å; D271-I274 PolarHBondContact O-N 2.73Å; I274-T278 WeakPolarHBondContact O-CB 3.26Å; I274-T278 PolarHBondContact O-N 3.17Å; I274-T278 PolarHBondContact O-OG1 3.18Å
275Q67.7Low63.5Low121 Ų121113.3 Ų113.357%0.56555%0.549SS*.Hα-helixtrans-64.4-45176.8-74.6-175.934.500112.4D271 A272 T278 Q279D271-Q275 WeakPolarHBondContact O-CG 3.48Å; D271-Q275 PolarHBondContact O-N 3.13Å; A272-Q275 PolarHBondContact O-N 3.46Å; Q275-T278 PolarHBondContact O-N 3.4Å; Q275-Q279 PolarHBondContact O-N 3.23Å
276L61.8Low65Low100 Ų100108.7 Ų108.752%0.52453%0.53SS..Hα-helixtrans-59.3-49175.9-80.2165.4000111.4A272 I273 T278 Q279 I280A272-L276 WeakPolarHBondContact O-CB 3.45Å; A272-L276 WeakPolarHBondContact O-CG 3.47Å; A272-L276 PolarHBondContact O-N 3.36Å; I273-L276 PolarHBondContact O-N 3Å; L276-T278 VanDerWaalsContact C-N 3.28Å; L276-T278 PolarHBondContact O-N 3.18Å; L276-Q279 PolarHBondContact O-N 3.15Å; L276-I280 VanDerWaalsContact O-CG1 3.31Å; L276-I280 WeakPolarHBondContact O-CG1 3.38Å; L276-I280 PolarHBondContact O-N 2.63Å
277R73.7Confident66.3Low172 Ų172104.6 Ų104.665%0.64951%0.514SS*.Hα-helixtrans-55.3-44174.5-176.1177.6179.9154.46.4111.9I273 I280 E281I273-R277 WeakPolarHBondContact O-CB 3.42Å; I273-R277 PolarHBondContact O-N 2.87Å; R277-I280 PolarHBondContact O-N 3.07Å; R277-E281 IonicContact NE-OE1 2.82Å; R277-E281 PolarHBondContact O-N 3.4Å
278T72.2Confident68.1Low86 Ų86104.2 Ų104.253%0.52851%0.509SS..Hα-helixtrans-65.4-39.7179.4-53.60000112.3I274 Q275 L276 Y282I274-T278 WeakPolarHBondContact O-CB 3.26Å; I274-T278 PolarHBondContact O-N 3.17Å; I274-T278 PolarHBondContact O-OG1 3.18Å; Q275-T278 PolarHBondContact O-N 3.4Å; L276-T278 VanDerWaalsContact C-N 3.28Å; L276-T278 PolarHBondContact O-N 3.18Å; T278-Y282 WeakPolarHBondContact O-CB 3.35Å; T278-Y282 PolarHBondContact O-N 3.24Å
279Q69.1Low69.5Low114 Ų114104 Ų10453%0.53351%0.509SS..Hα-helixtrans-68.8-38.4175.2-71.1-165.520.700112.5Q275 L276 Y282 R283Q275-Q279 PolarHBondContact O-N 3.23Å; L276-Q279 PolarHBondContact O-N 3.15Å; Q279-Y282 PolarHBondContact O-N 3.34Å; Q279-R283 PolarHBondContact O-N 3.37Å
280I73.6Confident70.4Confident62 Ų62104.9 Ų104.932%0.31851%0.509SS..Hα-helixtrans-65.3-47.5177.1-69.8167000110M252 L276 R277 Y282 R283 I284M252-I280 HydrophobicContact SD-CD1 3.7Å; L276-I280 VanDerWaalsContact O-CG1 3.31Å; L276-I280 WeakPolarHBondContact O-CG1 3.38Å; L276-I280 PolarHBondContact O-N 2.63Å; R277-I280 PolarHBondContact O-N 3.07Å; I280-Y282 VanDerWaalsContact C-N 3.29Å; I280-Y282 PolarHBondContact O-N 3.06Å; I280-R283 PolarHBondContact O-N 3.2Å; I280-I284 HydrophobicContact CG2-CD1 3.77Å; I280-I284 HydrophobicContact CG2-CG1 4.42Å; I280-I284 WeakPolarHBondContact O-CG1 3.46Å; I280-I284 PolarHBondContact O-N 3.12Å
281E78.6Confident71.4Confident71 Ų71105.3 Ų105.333%0.33251%0.508SS..Hα-helixtrans-57.4-40.7173.2-77.9-172.1-145.900112.5R277 I284 R285R277-E281 IonicContact NE-OE1 2.82Å; R277-E281 PolarHBondContact O-N 3.4Å; E281-I284 PolarHBondContact O-N 2.89Å; E281-R285 VanDerWaalsContact O-CG 3.26Å; E281-R285 WeakPolarHBondContact O-CG 3.47Å; E281-R285 PolarHBondContact O-N 2.66Å; E281-R285 IonicContact OE2-CZ 3.66Å; E281-R285 IonicContact OE2-NH2 3.42Å; E281-R285 PolarHBondContact OE2-NH2 2.71Å
282Y76.8Confident72.4Confident153 Ų153103.4 Ų103.460%0.650%0.503SS*.Hα-helixtrans-63-44.5176177.4-101000112.2T278 Q279 I280 R285 L286T278-Y282 WeakPolarHBondContact O-CB 3.35Å; T278-Y282 PolarHBondContact O-N 3.24Å; Q279-Y282 PolarHBondContact O-N 3.34Å; I280-Y282 VanDerWaalsContact C-N 3.29Å; I280-Y282 PolarHBondContact O-N 3.06Å; Y282-R285 PolarHBondContact O-N 2.92Å; Y282-L286 WeakPolarHBondContact O-CB 3.43Å; Y282-L286 PolarHBondContact O-N 2.8Å
283R70.2Confident73.1Confident173 Ų173107.8 Ų107.865%0.65352%0.518SS*.Hα-helixtrans-67.9-35.1177.5-71.6-173.3-175.8-86.94.2112.9Q279 I280 L286 S287Q279-R283 PolarHBondContact O-N 3.37Å; I280-R283 PolarHBondContact O-N 3.2Å; R283-L286 PolarHBondContact O-N 3.46Å; R283-S287 PolarHBondContact O-N 3.32Å
284I79Confident73.8Confident82 Ų82109.2 Ų109.242%0.42153%0.529SS..Hα-helixtrans-62.1-54.5173.8-70167.3000109.7I280 E281 L286 S287 E288I280-I284 HydrophobicContact CG2-CD1 3.77Å; I280-I284 HydrophobicContact CG2-CG1 4.42Å; I280-I284 WeakPolarHBondContact O-CG1 3.46Å; I280-I284 PolarHBondContact O-N 3.12Å; E281-I284 PolarHBondContact O-N 2.89Å; I284-L286 VanDerWaalsContact C-N 3.26Å; I284-L286 PolarHBondContact O-N 3.34Å; I284-S287 PolarHBondContact O-N 3.4Å; I284-S287 PolarHBondContact O-OG 3.07Å; I284-E288 HydrophobicContact CG2-CG 4.45Å; I284-E288 WeakPolarHBondContact O-CG 3.39Å; I284-E288 PolarHBondContact O-N 3.19Å
285R74.1Confident74.3Confident155 Ų155112.3 Ų112.359%0.58554%0.539SS*.Hα-helixtrans-58.6-36.4178.7-65.5175.2-149.7-169.47.4112.4E281 Y282 S289E281-R285 VanDerWaalsContact O-CG 3.26Å; E281-R285 WeakPolarHBondContact O-CG 3.47Å; E281-R285 PolarHBondContact O-N 2.66Å; E281-R285 IonicContact OE2-CZ 3.66Å; E281-R285 IonicContact OE2-NH2 3.42Å; E281-R285 PolarHBondContact OE2-NH2 2.71Å; Y282-R285 PolarHBondContact O-N 2.92Å; R285-S289 WeakPolarHBondContact O-CB 3.39Å; R285-S289 PolarHBondContact O-N 3.02Å
286L70Confident75.1Confident94 Ų94110.1 Ų110.149%0.49254%0.537SS..Hα-helixtrans-65-42.4174.6-16776.7000111.8Y282 R283 I284 S289 L290Y282-L286 WeakPolarHBondContact O-CB 3.43Å; Y282-L286 PolarHBondContact O-N 2.8Å; R283-L286 PolarHBondContact O-N 3.46Å; I284-L286 VanDerWaalsContact C-N 3.26Å; I284-L286 PolarHBondContact O-N 3.34Å; L286-S289 PolarHBondContact O-N 2.91Å; L286-L290 WeakPolarHBondContact O-CB 3.48Å; L286-L290 PolarHBondContact O-N 3.31Å
287S71.1Confident75.3Confident70 Ų70110.4 Ų110.449%0.4954%0.538SS..Hα-helixtrans-68.6-36.9177.877.90000112.5R283 I284 K291R283-S287 PolarHBondContact O-N 3.32Å; I284-S287 PolarHBondContact O-N 3.4Å; I284-S287 PolarHBondContact O-OG 3.07Å; S287-K291 WeakPolarHBondContact O-CB 3.39Å; S287-K291 PolarHBondContact O-N 3.21Å
288E78.8Confident75.5Confident117 Ų117111.4 Ų111.455%0.54754%0.542SS..Hα-helixtrans-65.1-44.7172.5-68.2-179.4139.100111.9I284 L290 K291 S292I284-E288 HydrophobicContact CG2-CG 4.45Å; I284-E288 WeakPolarHBondContact O-CG 3.39Å; I284-E288 PolarHBondContact O-N 3.19Å; E288-L290 PolarHBondContact O-N 3.25Å; E288-K291 PolarHBondContact O-N 2.68Å; E288-S292 PolarHBondContact O-N 3.2Å
289S80.8Confident75.9Confident68 Ų68112.1 Ų112.148%0.47654%0.54SS..Hα-helixtrans-57.1-51.1174.7-170.70000110.9R285 L286 K291 S292 E293R285-S289 WeakPolarHBondContact O-CB 3.39Å; R285-S289 PolarHBondContact O-N 3.02Å; L286-S289 PolarHBondContact O-N 2.91Å; S289-K291 VanDerWaalsContact C-N 3.33Å; S289-K291 PolarHBondContact O-N 3.3Å; S289-S292 WeakPolarHBondContact O-CB 3.46Å; S289-S292 PolarHBondContact O-N 3.5Å; S289-S292 VanDerWaalsContact O-N 3.12Å; S289-S292 PolarHBondContact O-OG 3.28Å; S289-E293 PolarHBondContact O-N 2.94Å
290L68.7Low76.2Confident107 Ų107110.4 Ų110.456%0.5654%0.537SS*.Hα-helixtrans-61.7-40.4179.1-163.676.3000111.8L286 E288 S292 E293 V294L286-L290 WeakPolarHBondContact O-CB 3.48Å; L286-L290 PolarHBondContact O-N 3.31Å; E288-L290 PolarHBondContact O-N 3.25Å; L290-S292 VanDerWaalsContact C-N 3.31Å; L290-S292 PolarHBondContact O-N 3.36Å; L290-E293 PolarHBondContact O-N 2.79Å; L290-V294 WeakPolarHBondContact O-CB 3.48Å; L290-V294 WeakPolarHBondContact O-CG2 3.36Å; L290-V294 PolarHBondContact O-N 2.91Å
291K82.1Confident75.8Confident166 Ų166112.2 Ų112.272%0.72255%0.546SS*.Hα-helixtrans-64.3-34.2175.8-169.6175.2-174.8177.10112.2S287 E288 S289 K295S287-K291 WeakPolarHBondContact O-CB 3.39Å; S287-K291 PolarHBondContact O-N 3.21Å; E288-K291 PolarHBondContact O-N 2.68Å; S289-K291 VanDerWaalsContact C-N 3.33Å; S289-K291 PolarHBondContact O-N 3.3Å; K291-K295 WeakPolarHBondContact O-CB 3.13Å; K291-K295 PolarHBondContact O-N 3.32Å
292S82.5Confident75.8Confident74 Ų74114.4 Ų114.452%0.51755%0.552SS.*Hα-helixtrans-71.4-39.717481.60000112.4E288 S289 L290 K295 S296E288-S292 PolarHBondContact O-N 3.2Å; S289-S292 WeakPolarHBondContact O-CB 3.46Å; S289-S292 PolarHBondContact O-N 3.5Å; S289-S292 VanDerWaalsContact O-N 3.12Å; S289-S292 PolarHBondContact O-OG 3.28Å; L290-S292 VanDerWaalsContact C-N 3.31Å; L290-S292 PolarHBondContact O-N 3.36Å; S292-K295 WeakPolarHBondContact O-CB 3.47Å; S292-K295 PolarHBondContact O-N 3.35Å; S292-S296 PolarHBondContact O-N 3.3Å
293E74.9Confident75.9Confident127 Ų127108.3 Ų108.359%0.59354%0.535SS*.Hα-helixtrans-68.1-44.5178.5-172.8169.3-157.700111.5S289 L290 K295 S296 L297S289-E293 PolarHBondContact O-N 2.94Å; L290-E293 PolarHBondContact O-N 2.79Å; E293-K295 VanDerWaalsContact C-N 3.27Å; E293-K295 PolarHBondContact O-N 3.27Å; E293-S296 WeakPolarHBondContact O-CB 3.37Å; E293-S296 PolarHBondContact O-N 2.86Å; E293-S296 VanDerWaalsContact O-N 3.15Å; E293-L297 WeakPolarHBondContact O-CB 3.41Å; E293-L297 PolarHBondContact O-N 2.83Å
294V74.2Confident75.8Confident83 Ų83106 Ų10650%0.50353%0.533SS..Hα-helixtrans-60.5-35.8172.6170.40000111.8L290 R298L290-V294 WeakPolarHBondContact O-CB 3.48Å; L290-V294 WeakPolarHBondContact O-CG2 3.36Å; L290-V294 PolarHBondContact O-N 2.91Å; V294-R298 WeakPolarHBondContact O-CB 3.34Å; V294-R298 PolarHBondContact O-N 3.34Å
295K81.6Confident75.3Confident163 Ų163106.9 Ų106.971%0.70954%0.538SS*.Hα-helixtrans-67.3-43.5174.1-170.6179.6179.7-176.10111.6K291 S292 E293 R298 E299K291-K295 WeakPolarHBondContact O-CB 3.13Å; K291-K295 PolarHBondContact O-N 3.32Å; S292-K295 WeakPolarHBondContact O-CB 3.47Å; S292-K295 PolarHBondContact O-N 3.35Å; E293-K295 VanDerWaalsContact C-N 3.27Å; E293-K295 PolarHBondContact O-N 3.27Å; K295-R298 PolarHBondContact O-N 3.12Å; K295-E299 WeakPolarHBondContact O-CB 3.35Å; K295-E299 PolarHBondContact O-N 2.92Å
296S82.7Confident75.5Confident76 Ų76104.4 Ų104.453%0.53153%0.533SS..Hα-helixtrans-61.7-42.6175.4-171.60000112.3S292 E293 E299 T300S292-S296 PolarHBondContact O-N 3.3Å; E293-S296 WeakPolarHBondContact O-CB 3.37Å; E293-S296 PolarHBondContact O-N 2.86Å; E293-S296 VanDerWaalsContact O-N 3.15Å; S296-E299 PolarHBondContact O-N 3.32Å; S296-T300 WeakPolarHBondContact O-CB 3.37Å; S296-T300 PolarHBondContact O-N 3Å; S296-T300 PolarHBondContact O-OG1 3.4Å
297L67.4Low75.8Confident105 Ų105106.6 Ų106.655%0.5554%0.539SS..Hα-helixtrans-65.8-44.7176.8-177.361.9000111.8E293 E299 T300 I301E293-L297 WeakPolarHBondContact O-CB 3.41Å; E293-L297 PolarHBondContact O-N 2.83Å; L297-E299 VanDerWaalsContact C-N 3.31Å; L297-E299 PolarHBondContact O-N 3.12Å; L297-T300 WeakPolarHBondContact O-CB 3.38Å; L297-T300 PolarHBondContact O-N 2.88Å; L297-I301 HydrophobicContact CD1-CD1 4.33Å; L297-I301 HydrophobicContact CG-CD1 4.08Å; L297-I301 WeakPolarHBondContact O-CG1 3.12Å; L297-I301 PolarHBondContact O-N 3.42Å
298R77.6Confident75.6Confident194 Ų194109 Ų10973%0.73254%0.542SS*.Hα-helixtrans-60.3-40.6176-175.1-179.3-74.4-153.9-2.4111.7V294 K295 I301 R302V294-R298 WeakPolarHBondContact O-CB 3.34Å; V294-R298 PolarHBondContact O-N 3.34Å; K295-R298 PolarHBondContact O-N 3.12Å; R298-I301 PolarHBondContact O-N 3.02Å; R298-R302 PolarHBondContact O-N 2.88Å
299E79.7Confident75.3Confident101 Ų101107.8 Ų107.847%0.47254%0.543SS..Hα-helixtrans-67.9-38.2176-174.670163.600112.3K295 S296 L297 R302 G303K295-E299 WeakPolarHBondContact O-CB 3.35Å; K295-E299 PolarHBondContact O-N 2.92Å; S296-E299 PolarHBondContact O-N 3.32Å; L297-E299 VanDerWaalsContact C-N 3.31Å; L297-E299 PolarHBondContact O-N 3.12Å; E299-R302 VanDerWaalsContact CD-NH2 3.27Å; E299-R302 WeakPolarHBondContact O-CB 3.48Å; E299-R302 PolarHBondContact O-N 2.97Å; E299-R302 IonicContact OE1-CZ 2.66Å; E299-R302 IonicContact OE1-NE 2.69Å; E299-R302 IonicContact OE1-NH2 3.99Å; E299-R302 PolarHBondContact OE1-NH2 2.99Å; E299-R302 IonicContact OE2-CZ 3.65Å; E299-R302 IonicContact OE2-NE 3.61Å; E299-R302 PolarHBondContact OE2-NE 3.16Å; E299-R302 IonicContact OE2-NH2 2.94Å; E299-R302 PolarHBondContact OE2-NH2 3.43Å; E299-G303 PolarHBondContact O-N 3.34Å
300T76Confident74.9Confident77 Ų77107 Ų10747%0.47254%0.541SS..Hα-helixtrans-63.1-43.3174.6-57.50000111.5S296 L297 G303 M304S296-T300 WeakPolarHBondContact O-CB 3.37Å; S296-T300 PolarHBondContact O-N 3Å; S296-T300 PolarHBondContact O-OG1 3.4Å; L297-T300 WeakPolarHBondContact O-CB 3.38Å; L297-T300 PolarHBondContact O-N 2.88Å; T300-G303 PolarHBondContact O-N 3.35Å; T300-M304 WeakPolarHBondContact O-CG 3.3Å; T300-M304 PolarHBondContact O-N 3.05Å
301I65.4Low74.7Confident100 Ų100107.9 Ų107.951%0.51354%0.542SS..Hα-helixtrans-63.3-43.1175.7-68.3165.2000110.6L297 R298 M304 L305L297-I301 HydrophobicContact CD1-CD1 4.33Å; L297-I301 HydrophobicContact CG-CD1 4.08Å; L297-I301 WeakPolarHBondContact O-CG1 3.12Å; L297-I301 PolarHBondContact O-N 3.42Å; R298-I301 PolarHBondContact O-N 3.02Å; I301-M304 PolarHBondContact O-N 2.82Å; I301-L305 PolarHBondContact O-N 3.5Å
302R79.2Confident73.9Confident118 Ų118102.7 Ų102.745%0.44553%0.526SS..Hα-helixtrans-57-50.8174.6-176177.674.387.8-6.9111.6R298 E299 M304 L305 E306R298-R302 PolarHBondContact O-N 2.88Å; E299-R302 VanDerWaalsContact CD-NH2 3.27Å; E299-R302 WeakPolarHBondContact O-CB 3.48Å; E299-R302 PolarHBondContact O-N 2.97Å; E299-R302 IonicContact OE1-CZ 2.66Å; E299-R302 IonicContact OE1-NE 2.69Å; E299-R302 IonicContact OE1-NH2 3.99Å; E299-R302 PolarHBondContact OE1-NH2 2.99Å; E299-R302 IonicContact OE2-CZ 3.65Å; E299-R302 IonicContact OE2-NE 3.61Å; E299-R302 PolarHBondContact OE2-NE 3.16Å; E299-R302 IonicContact OE2-NH2 2.94Å; E299-R302 PolarHBondContact OE2-NH2 3.43Å; R302-M304 PolarHBondContact O-N 2.92Å; R302-L305 PolarHBondContact O-N 3.44Å; R302-E306 VanDerWaalsContact CG-OE1 3.24Å; R302-E306 WeakPolarHBondContact CG-OE1 3.39Å; R302-E306 IonicContact CZ-OE1 2.73Å; R302-E306 IonicContact NE-OE1 3.66Å; R302-E306 IonicContact NH1-OE1 3.47Å; R302-E306 PolarHBondContact NH1-OE1 2.94Å; R302-E306 IonicContact NH1-OE2 3.96Å; R302-E306 PolarHBondContact NH1-OE2 3.28Å; R302-E306 WeakPolarHBondContact O-CG 3.43Å; R302-E306 PolarHBondContact O-N 3.2Å
303G78.1Confident73.4Confident24 Ų24105.9 Ų105.925%0.24753%0.533CS..Hα-helixtrans-70.4-9.3178.300000115.6E299 T300 K307E299-G303 PolarHBondContact O-N 3.34Å; T300-G303 PolarHBondContact O-N 3.35Å; G303-K307 VanDerWaalsContact O-CD 3.29Å; G303-K307 WeakPolarHBondContact O-CD 3.4Å; G303-K307 WeakPolarHBondContact O-CE 3.42Å; G303-K307 WeakPolarHBondContact O-CG 3.42Å
304M67.6Low73.1Confident124 Ų124103.4 Ų103.461%0.61152%0.523SS*.Hα-helixtrans-85.8-48.6165.5-75.9177.959.300111T300 I301 R302 E306 K307 E308T300-M304 WeakPolarHBondContact O-CG 3.3Å; T300-M304 PolarHBondContact O-N 3.05Å; I301-M304 PolarHBondContact O-N 2.82Å; R302-M304 PolarHBondContact O-N 2.92Å; M304-E306 VanDerWaalsContact C-N 3.32Å; M304-E306 PolarHBondContact O-N 2.88Å; M304-K307 WeakPolarHBondContact O-CB 3.08Å; M304-K307 PolarHBondContact O-N 2.94Å; M304-E308 PolarHBondContact O-N 3.41Å
305L69.9Low72.7Confident101 Ų101104.1 Ų104.153%0.52952%0.522SS..Hα-helixtrans-60.4-40.3-179.5-168.270.9000112I301 R302 K307 E308 V309I301-L305 PolarHBondContact O-N 3.5Å; R302-L305 PolarHBondContact O-N 3.44Å; L305-K307 VanDerWaalsContact C-N 3.26Å; L305-K307 PolarHBondContact O-N 3.38Å; L305-E308 PolarHBondContact O-N 3.13Å; L305-V309 WeakPolarHBondContact O-CG2 3.43Å; L305-V309 PolarHBondContact O-N 3.45Å
306E77.8Confident72.1Confident103 Ų103100.1 Ų100.148%0.48151%0.509SS..Hα-helixtrans-60.4-34175.1-74.3168.1-174.100112.6R302 M304 A310R302-E306 VanDerWaalsContact CG-OE1 3.24Å; R302-E306 WeakPolarHBondContact CG-OE1 3.39Å; R302-E306 IonicContact CZ-OE1 2.73Å; R302-E306 IonicContact NE-OE1 3.66Å; R302-E306 IonicContact NH1-OE1 3.47Å; R302-E306 PolarHBondContact NH1-OE1 2.94Å; R302-E306 IonicContact NH1-OE2 3.96Å; R302-E306 PolarHBondContact NH1-OE2 3.28Å; R302-E306 WeakPolarHBondContact O-CG 3.43Å; R302-E306 PolarHBondContact O-N 3.2Å; M304-E306 VanDerWaalsContact C-N 3.32Å; M304-E306 PolarHBondContact O-N 2.88Å; E306-A310 WeakPolarHBondContact O-CB 3.22Å; E306-A310 PolarHBondContact O-N 3.44Å; E306-A310 VanDerWaalsContact O-N 3.12Å
307K76.4Confident71.6Confident141 Ų14198.2 Ų98.261%0.61350%0.496SS*.Hα-helixtrans-76.1-37.3175.7-67.8171.3-174.2163.90112.2G303 M304 L305 A310 Q311G303-K307 VanDerWaalsContact O-CD 3.29Å; G303-K307 WeakPolarHBondContact O-CD 3.4Å; G303-K307 WeakPolarHBondContact O-CE 3.42Å; G303-K307 WeakPolarHBondContact O-CG 3.42Å; M304-K307 WeakPolarHBondContact O-CB 3.08Å; M304-K307 PolarHBondContact O-N 2.94Å; L305-K307 VanDerWaalsContact C-N 3.26Å; L305-K307 PolarHBondContact O-N 3.38Å; K307-A310 PolarHBondContact O-N 3.1Å; K307-Q311 WeakPolarHBondContact O-CB 3.45Å; K307-Q311 VanDerWaalsContact O-CG 3.31Å; K307-Q311 WeakPolarHBondContact O-CG 3.35Å; K307-Q311 PolarHBondContact O-N 2.99Å
308E66.7Low71.5Confident119 Ų11994.9 Ų94.956%0.55648%0.478SS*.Hα-helixtrans-66.2-40.9176.6-173.6171.3-164.100111.6M304 L305 Q311 S312M304-E308 PolarHBondContact O-N 3.41Å; L305-E308 PolarHBondContact O-N 3.13Å; E308-Q311 PolarHBondContact O-N 2.93Å; E308-S312 WeakPolarHBondContact O-CB 3.41Å; E308-S312 PolarHBondContact O-N 2.85Å; E308-S312 PolarHBondContact O-OG 2.65Å
309V72.8Confident71.1Confident93 Ų9393.4 Ų93.456%0.56447%0.472SS*.Hα-helixtrans-63.7-45.2172.3171.90000111.2L305 Q311 S312 H313L305-V309 WeakPolarHBondContact O-CG2 3.43Å; L305-V309 PolarHBondContact O-N 3.45Å; V309-Q311 PolarHBondContact O-N 3.15Å; V309-S312 PolarHBondContact O-N 3.19Å; V309-H313 PolarHBondContact O-N 2.84Å
310A71.4Confident70.7Confident52 Ų5292.5 Ų92.543%0.4347%0.474SS..Hα-helixtrans-61.9-42.1176.500000112.5E306 K307 H313 I314E306-A310 WeakPolarHBondContact O-CB 3.22Å; E306-A310 PolarHBondContact O-N 3.44Å; E306-A310 VanDerWaalsContact O-N 3.12Å; K307-A310 PolarHBondContact O-N 3.1Å; A310-H313 PolarHBondContact O-N 2.85Å; A310-I314 WeakPolarHBondContact O-CG1 3.37Å; A310-I314 PolarHBondContact O-N 2.92Å; A310-I314 VanDerWaalsContact O-N 3.12Å
311Q64.6Low70Confident125 Ų12591.1 Ų91.158%0.58446%0.462SS*.Hα-helixtrans-64.5-41.1174.8-75.4177.3-3.400112.1K307 E308 V309 H313 I314 I315K307-Q311 WeakPolarHBondContact O-CB 3.45Å; K307-Q311 VanDerWaalsContact O-CG 3.31Å; K307-Q311 WeakPolarHBondContact O-CG 3.35Å; K307-Q311 PolarHBondContact O-N 2.99Å; E308-Q311 PolarHBondContact O-N 2.93Å; V309-Q311 PolarHBondContact O-N 3.15Å; Q311-H313 PolarHBondContact O-N 3.12Å; Q311-I314 PolarHBondContact O-N 3.45Å; Q311-I315 WeakPolarHBondContact O-CG1 3.43Å; Q311-I315 PolarHBondContact O-N 3.26Å
312S65.6Low69.9Low56 Ų5691.3 Ų91.339%0.39246%0.459SS..Hα-helixtrans-60.8-44.1176.3-590000111.6E308 V309 I314 I315 D316E308-S312 WeakPolarHBondContact O-CB 3.41Å; E308-S312 PolarHBondContact O-N 2.85Å; E308-S312 PolarHBondContact O-OG 2.65Å; V309-S312 PolarHBondContact O-N 3.19Å; S312-I314 VanDerWaalsContact C-N 3.34Å; S312-I314 PolarHBondContact O-N 2.91Å; S312-I315 PolarHBondContact O-N 2.65Å; S312-I315 VanDerWaalsContact O-N 3.17Å; S312-D316 PolarHBondContact O-N 2.89Å
313H71.7Confident69.2Low142 Ų14292.5 Ų92.566%0.65747%0.468SS*.Hα-helixtrans-64-35.6176.8-167.2-70.6000112.8V309 A310 Q311 S317V309-H313 PolarHBondContact O-N 2.84Å; A310-H313 PolarHBondContact O-N 2.85Å; Q311-H313 PolarHBondContact O-N 3.12Å; H313-S317 WeakPolarHBondContact O-CB 3.42Å; H313-S317 PolarHBondContact O-N 3.36Å
314I68.4Low68.4Low75 Ų7595 Ų9539%0.38548%0.478SS..Hα-helixtrans-65.1-43.9172.9-67.7164.3000110.5A310 Q311 S312 S317 I318 L361A310-I314 WeakPolarHBondContact O-CG1 3.37Å; A310-I314 PolarHBondContact O-N 2.92Å; A310-I314 VanDerWaalsContact O-N 3.12Å; Q311-I314 PolarHBondContact O-N 3.45Å; S312-I314 VanDerWaalsContact C-N 3.34Å; S312-I314 PolarHBondContact O-N 2.91Å; I314-S317 PolarHBondContact O-N 3.03Å; I314-I318 HydrophobicContact CG2-CD1 3.88Å; I314-I318 WeakPolarHBondContact O-CG1 3.35Å; I314-I318 PolarHBondContact O-N 3.22Å; I314-L361 HydrophobicContact CG2-CD2 4.22Å
315I65.4Low67.9Low97 Ų9790 Ų9050%0.49745%0.454SS..Hα-helixtrans-62.1-44.8178.8-69.4164.6000111.4Q311 S312 I318 R319Q311-I315 WeakPolarHBondContact O-CG1 3.43Å; Q311-I315 PolarHBondContact O-N 3.26Å; S312-I315 PolarHBondContact O-N 2.65Å; S312-I315 VanDerWaalsContact O-N 3.17Å; I315-I318 PolarHBondContact O-N 3.36Å; I315-R319 WeakPolarHBondContact O-CB 3.44Å; I315-R319 PolarHBondContact O-N 3.46Å
316D70.4Confident67.3Low79 Ų7988.3 Ų88.342%0.42245%0.445SS..Hα-helixtrans-71.1-30.9178.1-82-42.4000113S312 R319 T320S312-D316 PolarHBondContact O-N 2.89Å; D316-R319 PolarHBondContact O-N 3.49Å; D316-R319 IonicContact OD1-CZ 2.69Å; D316-R319 IonicContact OD1-NE 3.2Å; D316-R319 IonicContact OD1-NH1 3.63Å; D316-R319 PolarHBondContact OD1-NH1 3.13Å; D316-T320 WeakPolarHBondContact O-CG2 3.31Å; D316-T320 PolarHBondContact O-N 3.21Å; D316-T320 PolarHBondContact O-OG1 2.98Å; D316-T320 VanDerWaalsContact O-OG1 3.11Å
317S71.4Confident66.1Low37 Ų3787.4 Ų87.426%0.25944%0.441SS..Hα-helixtrans-66.3-36.2170.5-167.10000112.9H313 I314 T320 E321H313-S317 WeakPolarHBondContact O-CB 3.42Å; H313-S317 PolarHBondContact O-N 3.36Å; I314-S317 PolarHBondContact O-N 3.03Å; S317-T320 PolarHBondContact O-OG1 3.02Å; S317-T320 VanDerWaalsContact O-OG1 3.09Å; S317-E321 PolarHBondContact O-N 3.42Å
318I65.4Low64.9Low35 Ų3584.1 Ų84.118%0.17943%0.434CS..Hα-helixtrans-68.7-41172.5-68.7164.1000110.3I314 I315 E321 F322 I357 L360 L361I314-I318 HydrophobicContact CG2-CD1 3.88Å; I314-I318 WeakPolarHBondContact O-CG1 3.35Å; I314-I318 PolarHBondContact O-N 3.22Å; I315-I318 PolarHBondContact O-N 3.36Å; I318-E321 PolarHBondContact O-N 3.37Å; I318-F322 WeakPolarHBondContact O-CB 3.44Å; I318-F322 PolarHBondContact O-N 2.98Å; I318-I357 HydrophobicContact CG2-CD1 4.38Å; I318-I357 HydrophobicContact CG2-CG1 4.36Å; I318-L360 HydrophobicContact CB-CD1 4.46Å; I318-L360 HydrophobicContact CG1-CB 4.11Å; I318-L360 HydrophobicContact CG1-CD1 3.8Å; I318-L361 HydrophobicContact CD1-CD2 3.6Å; I318-L361 HydrophobicContact CD1-CG 3.96Å
319R69.3Low64.2Low162 Ų16280.5 Ų80.561%0.61142%0.416SS*.Hα-helixtrans-63.7-39.2178.3179.3-177.2-78.9153.1-9.4112.5I315 D316 K323I315-R319 WeakPolarHBondContact O-CB 3.44Å; I315-R319 PolarHBondContact O-N 3.46Å; D316-R319 PolarHBondContact O-N 3.49Å; D316-R319 IonicContact OD1-CZ 2.69Å; D316-R319 IonicContact OD1-NE 3.2Å; D316-R319 IonicContact OD1-NH1 3.63Å; D316-R319 PolarHBondContact OD1-NH1 3.13Å; R319-K323 PolarHBondContact O-N 3.46Å
320T71.3Confident63.2Low82 Ų8284 Ų8450%0.50342%0.419SS..Hα-helixtrans-71-43.5177.148.90000112D316 S317 F322 K323 T324D316-T320 WeakPolarHBondContact O-CG2 3.31Å; D316-T320 PolarHBondContact O-N 3.21Å; D316-T320 PolarHBondContact O-OG1 2.98Å; D316-T320 VanDerWaalsContact O-OG1 3.11Å; S317-T320 PolarHBondContact O-OG1 3.02Å; S317-T320 VanDerWaalsContact O-OG1 3.09Å; T320-F322 PolarHBondContact O-N 3.38Å; T320-K323 WeakPolarHBondContact O-CB 3.37Å; T320-K323 PolarHBondContact O-N 2.98Å; T320-K323 VanDerWaalsContact O-N 3.12Å; T320-T324 PolarHBondContact O-N 2.83Å; T320-T324 PolarHBondContact O-OG1 3.16Å
321E61.4Low62.1Low48 Ų4889.2 Ų89.222%0.22443%0.428CS..Hα-helixtrans-63.3-38.5174.4-84.5-67.7110.800113S317 I318 K323 T324 L325 R356 L360S317-E321 PolarHBondContact O-N 3.42Å; I318-E321 PolarHBondContact O-N 3.37Å; E321-K323 PolarHBondContact O-N 2.79Å; E321-T324 WeakPolarHBondContact CA-OG1 3.39Å; E321-T324 PolarHBondContact O-N 2.99Å; E321-T324 PolarHBondContact O-OG1 3.34Å; E321-T324 PolarHBondContact OE1-OG1 3.39Å; E321-L325 WeakPolarHBondContact O-CB 3.44Å; E321-L325 WeakPolarHBondContact O-CD1 3.36Å; E321-L325 PolarHBondContact O-N 2.97Å; E321-R356 IonicContact OE1-NH1 3.9Å; E321-R356 WeakPolarHBondContact OE2-CD 3.43Å; E321-R356 IonicContact OE2-CZ 2.67Å; E321-R356 IonicContact OE2-NE 2.67Å; E321-R356 IonicContact OE2-NH1 3.63Å; E321-R356 PolarHBondContact OE2-NH1 2.94Å; E321-L360 HydrophobicContact CB-CD1 4.2Å; E321-L360 HydrophobicContact CG-CD1 4.09Å
322F63.1Low61.4Low104 Ų10487.3 Ų87.346%0.45642%0.422SS..Hα-helixtrans-63.1-33.6174.3-159.6-104000111.9I318 T320 I326 C353 I357I318-F322 WeakPolarHBondContact O-CB 3.44Å; I318-F322 PolarHBondContact O-N 2.98Å; T320-F322 PolarHBondContact O-N 3.38Å; F322-I326 HydrophobicContact CD1-CD1 3.67Å; F322-I326 HydrophobicContact CE1-CD1 3.33Å; F322-I326 HydrophobicContact CG-CD1 4.48Å; F322-I326 HydrophobicContact CZ-CD1 3.91Å; F322-I326 WeakPolarHBondContact O-CG1 3.29Å; F322-I326 PolarHBondContact O-N 2.97Å; F322-C353 VanDerWaalsContact CD2-SG 3.57Å; F322-I357 HydrophobicContact CD2-CD1 4.27Å
323K63.6Low60.6Low144 Ų14487.7 Ų87.763%0.62642%0.419SS*.Hα-helixtrans-72.4-43.6175.7-168.2-178.3177.2-171.80112.2R319 T320 E321 L325 I326 E327R319-K323 PolarHBondContact O-N 3.46Å; T320-K323 WeakPolarHBondContact O-CB 3.37Å; T320-K323 PolarHBondContact O-N 2.98Å; T320-K323 VanDerWaalsContact O-N 3.12Å; E321-K323 PolarHBondContact O-N 2.79Å; K323-L325 VanDerWaalsContact C-N 3.31Å; K323-L325 PolarHBondContact O-N 3.25Å; K323-I326 PolarHBondContact O-N 3.27Å; K323-E327 PolarHBondContact O-N 2.76Å; K323-E327 VanDerWaalsContact O-N 3.1Å
324T62.4Low59.5Low76 Ų7688.6 Ų88.647%0.46642%0.423SS..Hα-helixtrans-67.6-30.3178.155.60000112.6T320 E321 P328T320-T324 PolarHBondContact O-N 2.83Å; T320-T324 PolarHBondContact O-OG1 3.16Å; E321-T324 WeakPolarHBondContact CA-OG1 3.39Å; E321-T324 PolarHBondContact O-N 2.99Å; E321-T324 PolarHBondContact O-OG1 3.34Å; E321-T324 PolarHBondContact OE1-OG1 3.39Å; T324-P328 WeakPolarHBondContact O-CD 3.44Å
325L57.7Low58.6Low19 Ų1992.4 Ų92.410%0.09944%0.437CS..Hα-helixtrans-68.6-39.9171.4-84.7158.4000113.5E321 K323 L349 H352 C353E321-L325 WeakPolarHBondContact O-CB 3.44Å; E321-L325 WeakPolarHBondContact O-CD1 3.36Å; E321-L325 PolarHBondContact O-N 2.97Å; K323-L325 VanDerWaalsContact C-N 3.31Å; K323-L325 PolarHBondContact O-N 3.25Å; L325-L349 HydrophobicContact CD2-CD2 4.28Å; L325-L349 WeakPolarHBondContact O-CD2 3.46Å; L325-H352 HydrophobicContact CD2-CB 4.4Å; L325-C353 HydrophobicContact CD1-CB 3.88Å
326I57Low57.7Low66 Ų6695.4 Ų95.434%0.33845%0.454SS..Hα-helixtrans-79.8-29.5-176.7-73.7176000112.8F322 K323 F329 W330F322-I326 HydrophobicContact CD1-CD1 3.67Å; F322-I326 HydrophobicContact CE1-CD1 3.33Å; F322-I326 HydrophobicContact CG-CD1 4.48Å; F322-I326 HydrophobicContact CZ-CD1 3.91Å; F322-I326 WeakPolarHBondContact O-CG1 3.29Å; F322-I326 PolarHBondContact O-N 2.97Å; K323-I326 PolarHBondContact O-N 3.27Å; I326-F329 WeakPolarHBondContact O-CA 3.4Å; I326-F329 WeakPolarHBondContact O-CB 3.34Å; I326-F329 PolarHBondContact O-N 2.91Å; I326-W330 PolarHBondContact O-N 2.91Å
327E52.8Low56.3Low83 Ų8399.7 Ų99.739%0.38847%0.465SS..Hα-helixtrans-61.9-39.6-173.6-155.7174.8125.500114.5K323 F329 W330 R331K323-E327 PolarHBondContact O-N 2.76Å; K323-E327 VanDerWaalsContact O-N 3.1Å; E327-F329 VanDerWaalsContact C-N 3.33Å; E327-F329 PolarHBondContact O-N 3.05Å; E327-W330 PolarHBondContact O-N 3.24Å; E327-R331 WeakPolarHBondContact O-CG 3.5Å; E327-R331 PolarHBondContact O-N 3.47Å; E327-R331 VanDerWaalsContact O-N 3.15Å; E327-R331 IonicContact OE1-CZ 2.9Å; E327-R331 IonicContact OE1-NE 2.63Å; E327-R331 IonicContact OE1-NH2 2.69Å; E327-R331 PolarHBondContact OE1-NH2 3.05Å
328P49.8Very low55.3Low73 Ų73103 Ų10347%0.47448%0.48SS..Hα-helixtrans-59.4-39.5168.8-24.734.9000113.3T324 R331 L332T324-P328 WeakPolarHBondContact O-CD 3.44Å; P328-R331 PolarHBondContact O-N 2.97Å; P328-L332 PolarHBondContact O-N 3.05Å
329F52.2Low54.6Low42 Ų42107.6 Ų107.618%0.18450%0.504CS..Hα-helixtrans-64.2-40.8178-168.8-116.5000111.6I326 E327 R331 L332 L333 M342 L345 L349I326-F329 WeakPolarHBondContact O-CA 3.4Å; I326-F329 WeakPolarHBondContact O-CB 3.34Å; I326-F329 PolarHBondContact O-N 2.91Å; E327-F329 VanDerWaalsContact C-N 3.33Å; E327-F329 PolarHBondContact O-N 3.05Å; F329-R331 PolarHBondContact O-N 3.46Å; F329-L332 PolarHBondContact O-N 3.46Å; F329-L333 HydrophobicContact CD1-CD1 3.87Å; F329-L333 HydrophobicContact CE1-CD1 3.53Å; F329-L333 HydrophobicContact CE1-CG 4.29Å; F329-L333 HydrophobicContact CZ-CD1 4.16Å; F329-L333 HydrophobicContact CZ-CG 4.48Å; F329-L333 WeakPolarHBondContact O-CB 3.32Å; F329-L333 PolarHBondContact O-N 2.89Å; F329-M342 HydrophobicContact CE2-SD 3.92Å; F329-M342 HydrophobicContact CZ-CE 4.16Å; F329-M342 HydrophobicContact CZ-SD 3.87Å; F329-L345 HydrophobicContact CD2-CD2 3.59Å; F329-L345 HydrophobicContact CE2-CD2 3.94Å; F329-L349 HydrophobicContact CB-CD1 3.68Å; F329-L349 HydrophobicContact CD2-CD1 3.32Å; F329-L349 HydrophobicContact CE2-CD1 4.04Å; F329-L349 HydrophobicContact CG-CD1 3.59Å
330W51.6Low53.8Low167 Ų167105 Ų10563%0.63350%0.503SS*.Hα-helixtrans-63.3-40.6174.9-108.6137.4000112.5I326 E327 L332 L333 Q334I326-W330 PolarHBondContact O-N 2.91Å; E327-W330 PolarHBondContact O-N 3.24Å; W330-L332 VanDerWaalsContact C-N 3.31Å; W330-L332 PolarHBondContact O-N 2.94Å; W330-L333 HydrophobicContact CE3-CB 3.86Å; W330-L333 HydrophobicContact CE3-CD1 4.05Å; W330-L333 HydrophobicContact CZ3-CB 4.07Å; W330-L333 HydrophobicContact CZ3-CD1 3.98Å; W330-L333 PolarHBondContact O-N 3.34Å; W330-Q334 PolarHBondContact O-N 3.44Å; W330-Q334 VanDerWaalsContact O-N 3.17Å
331R49.6Very low52.8Low162 Ų162106.5 Ų106.561%0.61150%0.504SS*.Hα-helixtrans-66.9-31.3176.3-65174.1-169.3-163.94.9112.5E327 P328 F329E327-R331 WeakPolarHBondContact O-CG 3.5Å; E327-R331 PolarHBondContact O-N 3.47Å; E327-R331 VanDerWaalsContact O-N 3.15Å; E327-R331 IonicContact OE1-CZ 2.9Å; E327-R331 IonicContact OE1-NE 2.63Å; E327-R331 IonicContact OE1-NH2 2.69Å; E327-R331 PolarHBondContact OE1-NH2 3.05Å; P328-R331 PolarHBondContact O-N 2.97Å; F329-R331 PolarHBondContact O-N 3.46Å
332L48.6Very low52.1Low85 Ų85107.3 Ų107.345%0.44551%0.509SS..Hα-helixtrans-72.4-48.8172.6-91158.6000112P328 F329 W330 Q334 K335 L345P328-L332 PolarHBondContact O-N 3.05Å; F329-L332 PolarHBondContact O-N 3.46Å; W330-L332 VanDerWaalsContact C-N 3.31Å; W330-L332 PolarHBondContact O-N 2.94Å; L332-Q334 PolarHBondContact O-N 3.29Å; L332-Q334 VanDerWaalsContact O-N 3.08Å; L332-K335 CarbonylContact O-C 3.6Å; L332-K335 PolarHBondContact O-N 2.88Å; L332-K335 VanDerWaalsContact O-O 3.05Å; L332-L345 HydrophobicContact CD1-CD1 4.03Å; L332-L345 HydrophobicContact CD1-CD2 3.97Å
333L48.4Very low51.5Low63 Ų63111.3 Ų111.333%0.3352%0.521SS..Hα-helixtrans-54.1-28.9175.3-107167.5000113.3F329 W330 K335 M342F329-L333 HydrophobicContact CD1-CD1 3.87Å; F329-L333 HydrophobicContact CE1-CD1 3.53Å; F329-L333 HydrophobicContact CE1-CG 4.29Å; F329-L333 HydrophobicContact CZ-CD1 4.16Å; F329-L333 HydrophobicContact CZ-CG 4.48Å; F329-L333 WeakPolarHBondContact O-CB 3.32Å; F329-L333 PolarHBondContact O-N 2.89Å; W330-L333 HydrophobicContact CE3-CB 3.86Å; W330-L333 HydrophobicContact CE3-CD1 4.05Å; W330-L333 HydrophobicContact CZ3-CB 4.07Å; W330-L333 HydrophobicContact CZ3-CD1 3.98Å; W330-L333 PolarHBondContact O-N 3.34Å; L333-K335 VanDerWaalsContact C-N 3.26Å; L333-K335 PolarHBondContact O-N 3.37Å; L333-M342 HydrophobicContact CD2-CE 3.6Å; L333-M342 HydrophobicContact CD2-SD 4.25Å; L333-M342 HydrophobicContact CG-CE 4.04Å; L333-M342 HydrophobicContact CG-SD 4.21Å
334Q50.7Low50.9Low162 Ų162107.9 Ų107.976%0.75752%0.515SS*.THydrogen-bonded Turntrans-77.1-7.9178.8-155.3170.726.300113.8W330 L332W330-Q334 PolarHBondContact O-N 3.44Å; W330-Q334 VanDerWaalsContact O-N 3.17Å; L332-Q334 PolarHBondContact O-N 3.29Å; L332-Q334 VanDerWaalsContact O-N 3.08Å
335K48.7Very low50.3Low154 Ų154107.3 Ų107.367%0.6751%0.509SS*.SBendtrans-118.897.7170.3-70.8-173.6176.6-175.70108.9L332 L333 Y337L332-K335 CarbonylContact O-C 3.6Å; L332-K335 PolarHBondContact O-N 2.88Å; L332-K335 VanDerWaalsContact O-O 3.05Å; L333-K335 VanDerWaalsContact C-N 3.26Å; L333-K335 PolarHBondContact O-N 3.37Å; K335-Y337 VanDerWaalsContact O-CD2 3.32Å; K335-Y337 WeakPolarHBondContact O-CD2 3.49Å; K335-Y337 PolarHBondContact O-N 3.06Å
336N46.6Very low50Low161 Ų161110.2 Ų110.286%0.86152%0.524SS*.  trans-45.4105.6-175.3-60.7-15.7000113.3
337Y41.1Very low49.7Very low168 Ų168108.9 Ų108.966%0.65952%0.523SS*.  trans-124.6161.1171.3-89.7-77.8000110.7K335K335-Y337 VanDerWaalsContact O-CD2 3.32Å; K335-Y337 WeakPolarHBondContact O-CD2 3.49Å; K335-Y337 PolarHBondContact O-N 3.06Å
338D49.5Very low49.6Very low106 Ų106107.4 Ų107.457%0.56752%0.519SS*.  trans-70.9149.7-164.7-166.810.2000114.1N340 Q341 M342D338-N340 PolarHBondContact O-N 3.38Å; D338-N340 VanDerWaalsContact O-N 3.09Å; D338-Q341 PolarHBondContact O-N 3.45Å; D338-Q341 VanDerWaalsContact O-N 3.07Å; D338-M342 PolarHBondContact O-N 3.48Å
339L51.7Low49.7Very low132 Ų132105.7 Ų105.769%0.69151%0.506SS*.Hα-helixtrans-57.5-29.8-172.1-97.682.3000113.6M342 R343L339-M342 WeakPolarHBondContact O-CB 3.38Å; L339-M342 PolarHBondContact O-N 3.22Å; L339-R343 PolarHBondContact O-N 2.99Å
340N51.8Low49.9Very low108 Ų108107.7 Ų107.758%0.57852%0.519SS*.Hα-helixtrans-71.8-35.6-179.6-69.9-38.9000112.3D338 R343 S344D338-N340 PolarHBondContact O-N 3.38Å; D338-N340 VanDerWaalsContact O-N 3.09Å; N340-R343 PolarHBondContact O-N 3.25Å; N340-S344 PolarHBondContact O-N 3.44Å
341Q50.1Low50.1Low113 Ų113101.5 Ų101.553%0.52850%0.498SS..Hα-helixtrans-70.2-36.7171-68-177.4-15.400111.1D338 R343 S344 L345D338-Q341 PolarHBondContact O-N 3.45Å; D338-Q341 VanDerWaalsContact O-N 3.07Å; Q341-R343 VanDerWaalsContact C-N 3.29Å; Q341-R343 PolarHBondContact O-N 3.42Å; Q341-S344 PolarHBondContact O-N 2.92Å; Q341-S344 PolarHBondContact O-OG 3.44Å; Q341-L345 VanDerWaalsContact O-CB 3.26Å; Q341-L345 WeakPolarHBondContact O-CB 3.45Å; Q341-L345 PolarHBondContact O-N 3.35Å
342M47.2Very low50.4Low66 Ų6699.3 Ų99.333%0.32549%0.494SS..Hα-helixtrans-61-34.9172.6-78.3-91.1-76.800112.8F329 L333 D338 L339 N346F329-M342 HydrophobicContact CE2-SD 3.92Å; F329-M342 HydrophobicContact CZ-CE 4.16Å; F329-M342 HydrophobicContact CZ-SD 3.87Å; L333-M342 HydrophobicContact CD2-CE 3.6Å; L333-M342 HydrophobicContact CD2-SD 4.25Å; L333-M342 HydrophobicContact CG-CE 4.04Å; L333-M342 HydrophobicContact CG-SD 4.21Å; D338-M342 PolarHBondContact O-N 3.48Å; L339-M342 WeakPolarHBondContact O-CB 3.38Å; L339-M342 PolarHBondContact O-N 3.22Å; M342-N346 WeakPolarHBondContact O-CB 3.49Å; M342-N346 PolarHBondContact O-N 3.19Å
343R51.1Low50.7Low188 Ų18896.1 Ų96.171%0.70948%0.479SS*.Hα-helixtrans-66.1-51.2176-84.2-175.9173.5174.5-0.8112.9L339 N340 Q341 N346 A347L339-R343 PolarHBondContact O-N 2.99Å; N340-R343 PolarHBondContact O-N 3.25Å; Q341-R343 VanDerWaalsContact C-N 3.29Å; Q341-R343 PolarHBondContact O-N 3.42Å; R343-N346 PolarHBondContact O-N 3.41Å; R343-A347 PolarHBondContact O-N 2.9Å
344S50.5Low51Low72 Ų7297.7 Ų97.750%0.50349%0.486SS..Hα-helixtrans-65.2-41.4179.6530000111.6N340 Q341 N346 A347 V348N340-S344 PolarHBondContact O-N 3.44Å; Q341-S344 PolarHBondContact O-N 2.92Å; Q341-S344 PolarHBondContact O-OG 3.44Å; S344-N346 PolarHBondContact O-N 3.04Å; S344-A347 WeakPolarHBondContact O-CB 3.47Å; S344-A347 PolarHBondContact O-N 3.2Å; S344-A347 VanDerWaalsContact O-N 3.16Å; S344-V348 WeakPolarHBondContact O-CG2 3.45Å; S344-V348 PolarHBondContact O-N 3.02Å
345L49.4Very low51.4Low64 Ų6491.3 Ų91.334%0.33546%0.459SS..Hα-helixtrans-69.2-32.6179.5-155.8132.9000112.5F329 L332 Q341 L349F329-L345 HydrophobicContact CD2-CD2 3.59Å; F329-L345 HydrophobicContact CE2-CD2 3.94Å; L332-L345 HydrophobicContact CD1-CD1 4.03Å; L332-L345 HydrophobicContact CD1-CD2 3.97Å; Q341-L345 VanDerWaalsContact O-CB 3.26Å; Q341-L345 WeakPolarHBondContact O-CB 3.45Å; Q341-L345 PolarHBondContact O-N 3.35Å; L345-L349 HydrophobicContact CD2-CD1 3.83Å; L345-L349 WeakPolarHBondContact O-CB 3.37Å; L345-L349 WeakPolarHBondContact O-CG 3.48Å; L345-L349 PolarHBondContact O-N 3.18Å
346N50.8Low51.8Low80 Ų8088.3 Ų88.343%0.42844%0.443SS..Hα-helixtrans-67.1-39169.5-17841.6000112.1M342 R343 S344 L349 N350M342-N346 WeakPolarHBondContact O-CB 3.49Å; M342-N346 PolarHBondContact O-N 3.19Å; R343-N346 PolarHBondContact O-N 3.41Å; S344-N346 PolarHBondContact O-N 3.04Å; N346-L349 PolarHBondContact O-N 3.32Å; N346-N350 PolarHBondContact O-N 3.37Å; N346-N350 PolarHBondContact O-ND2 2.98Å; N346-N350 PolarHBondContact OD1-ND2 3.19Å
347A51.9Low52.2Low37 Ų3782.6 Ų82.631%0.30641%0.412SS..Hα-helixtrans-60.1-51.5173.800000110.9R343 S344 L349 N350 I351R343-A347 PolarHBondContact O-N 2.9Å; S344-A347 WeakPolarHBondContact O-CB 3.47Å; S344-A347 PolarHBondContact O-N 3.2Å; S344-A347 VanDerWaalsContact O-N 3.16Å; A347-L349 VanDerWaalsContact C-N 3.31Å; A347-L349 PolarHBondContact O-N 3Å; A347-N350 PolarHBondContact O-N 2.95Å; A347-I351 VanDerWaalsContact O-CB 3.3Å; A347-I351 WeakPolarHBondContact O-CB 3.21Å; A347-I351 WeakPolarHBondContact O-CG1 3.43Å; A347-I351 PolarHBondContact O-N 3.24Å
348V50Low53.2Low52 Ų5275.2 Ų75.232%0.31539%0.386SS..Hα-helixtrans-58.4-38.2177173.50000112.4S344 I351 H352 F376S344-V348 WeakPolarHBondContact O-CG2 3.45Å; S344-V348 PolarHBondContact O-N 3.02Å; V348-I351 WeakPolarHBondContact O-CB 3.26Å; V348-H352 PolarHBondContact O-N 3.03Å; V348-F376 HydrophobicContact CG2-CB 4.41Å
349L53Low53.9Low37 Ų3777.9 Ų77.919%0.19439%0.392CS..Hα-helixtrans-66.9-46.4176.5-89.5162.9000113.2L325 F329 L345 N346 A347 I351 H352 C353L325-L349 HydrophobicContact CD2-CD2 4.28Å; L325-L349 WeakPolarHBondContact O-CD2 3.46Å; F329-L349 HydrophobicContact CB-CD1 3.68Å; F329-L349 HydrophobicContact CD2-CD1 3.32Å; F329-L349 HydrophobicContact CE2-CD1 4.04Å; F329-L349 HydrophobicContact CG-CD1 3.59Å; L345-L349 HydrophobicContact CD2-CD1 3.83Å; L345-L349 WeakPolarHBondContact O-CB 3.37Å; L345-L349 WeakPolarHBondContact O-CG 3.48Å; L345-L349 PolarHBondContact O-N 3.18Å; N346-L349 PolarHBondContact O-N 3.32Å; A347-L349 VanDerWaalsContact C-N 3.31Å; A347-L349 PolarHBondContact O-N 3Å; L349-I351 VanDerWaalsContact C-N 3.29Å; L349-I351 PolarHBondContact O-N 3.46Å; L349-H352 PolarHBondContact O-N 3.21Å; L349-C353 WeakPolarHBondContact O-CB 3.42Å; L349-C353 PolarHBondContact O-N 3.2Å
350N56.5Low54.1Low85 Ų8574.4 Ų74.446%0.45537%0.374SS..Hα-helixtrans-61.1-43.5175.8-74.2-70.9000110.5N346 A347 C353 I354N346-N350 PolarHBondContact O-N 3.37Å; N346-N350 PolarHBondContact O-ND2 2.98Å; N346-N350 PolarHBondContact OD1-ND2 3.19Å; A347-N350 PolarHBondContact O-N 2.95Å; N350-C353 PolarHBondContact O-N 3.03Å; N350-I354 WeakPolarHBondContact O-CB 3.49Å; N350-I354 WeakPolarHBondContact O-CD1 3.43Å; N350-I354 WeakPolarHBondContact O-CG1 3.37Å; N350-I354 PolarHBondContact O-N 3.28Å
351I55.4Low54.4Low37 Ų3772.8 Ų72.819%0.1937%0.365CS..Hα-helixtrans-51.5-61.5173-87.4171.5000111.8A347 V348 L349 C353 I354 T355 L373 F376A347-I351 VanDerWaalsContact O-CB 3.3Å; A347-I351 WeakPolarHBondContact O-CB 3.21Å; A347-I351 WeakPolarHBondContact O-CG1 3.43Å; A347-I351 PolarHBondContact O-N 3.24Å; V348-I351 WeakPolarHBondContact O-CB 3.26Å; L349-I351 VanDerWaalsContact C-N 3.29Å; L349-I351 PolarHBondContact O-N 3.46Å; I351-C353 VanDerWaalsContact C-N 3.29Å; I351-C353 PolarHBondContact O-N 3.41Å; I351-I354 PolarHBondContact O-N 3.18Å; I351-T355 PolarHBondContact O-N 2.93Å; I351-T355 PolarHBondContact O-OG1 3.41Å; I351-T355 VanDerWaalsContact O-OG1 3.05Å; I351-L373 HydrophobicContact CB-CD2 3.72Å; I351-L373 HydrophobicContact CD1-CD2 4.39Å; I351-L373 HydrophobicContact CG1-CD2 3.66Å; I351-L373 HydrophobicContact CG2-CD2 3.34Å; I351-F376 HydrophobicContact CD1-CB 4.02Å; I351-F376 HydrophobicContact CD1-CD1 4.39Å; I351-F376 HydrophobicContact CD1-CD2 3.33Å; I351-F376 HydrophobicContact CD1-CE2 3.84Å; I351-F376 HydrophobicContact CD1-CG 3.65Å
352H54.4Low54.8Low116 Ų11673.6 Ų73.654%0.53738%0.378SS..Hα-helixtrans-68.8-31.4-174.1-154.859.7000112.2L325 V348 L349 R356L325-H352 HydrophobicContact CD2-CB 4.4Å; V348-H352 PolarHBondContact O-N 3.03Å; L349-H352 PolarHBondContact O-N 3.21Å; H352-R356 PolarHBondContact NE2-NH2 2.96Å; H352-R356 WeakPolarHBondContact O-CG 3.36Å; H352-R356 PolarHBondContact O-N 2.79Å
353C56.8Low55.2Low17 Ų1775 Ų7512%0.11539%0.386CS..Hα-helixtrans-63-49.3173.3-171.40000111.8F322 L325 L349 N350 I351 T355 R356 I357F322-C353 VanDerWaalsContact CD2-SG 3.57Å; L325-C353 HydrophobicContact CD1-CB 3.88Å; L349-C353 WeakPolarHBondContact O-CB 3.42Å; L349-C353 PolarHBondContact O-N 3.2Å; N350-C353 PolarHBondContact O-N 3.03Å; I351-C353 VanDerWaalsContact C-N 3.29Å; I351-C353 PolarHBondContact O-N 3.41Å; C353-T355 PolarHBondContact O-N 3.43Å; C353-R356 PolarHBondContact O-N 2.98Å; C353-I357 WeakPolarHBondContact O-CB 3.16Å; C353-I357 WeakPolarHBondContact O-CG1 3.27Å; C353-I357 PolarHBondContact O-N 3.35Å; C353-I357 VanDerWaalsContact SG-CD1 3.52Å
354I53.4Low55.1Low96 Ų9671.5 Ų71.549%0.49239%0.387SS..Hα-helixtrans-59.5-46176.5-70.5163.9000110.5N350 I351 R356 I357 A358 I365N350-I354 WeakPolarHBondContact O-CB 3.49Å; N350-I354 WeakPolarHBondContact O-CD1 3.43Å; N350-I354 WeakPolarHBondContact O-CG1 3.37Å; N350-I354 PolarHBondContact O-N 3.28Å; I351-I354 PolarHBondContact O-N 3.18Å; I354-R356 VanDerWaalsContact C-N 3.34Å; I354-R356 PolarHBondContact O-N 3.41Å; I354-I357 PolarHBondContact O-N 2.98Å; I354-A358 VanDerWaalsContact O-CB 3.3Å; I354-A358 WeakPolarHBondContact O-CB 3.49Å; I354-A358 PolarHBondContact O-N 3.43Å; I354-I365 HydrophobicContact CG2-CD1 4.48Å
355T59.6Low55Low28 Ų2869.9 Ų69.917%0.17237%0.373CS..Hα-helixtrans-62.7-37.2179.7-440000113I351 C353 K359 I365I351-T355 PolarHBondContact O-N 2.93Å; I351-T355 PolarHBondContact O-OG1 3.41Å; I351-T355 VanDerWaalsContact O-OG1 3.05Å; C353-T355 PolarHBondContact O-N 3.43Å; T355-K359 WeakPolarHBondContact O-CG 3.32Å; T355-K359 PolarHBondContact O-N 2.71Å; T355-I365 HydrophobicContact CG2-CD1 4.28Å
356R57.4Low55Low91 Ų9170.1 Ų70.134%0.34338%0.378SS..Hα-helixtrans-76.3-42.9177.4-70.2-165.3-175.6-157.8-2.9113E321 H352 C353 I354 A358 K359 L360E321-R356 IonicContact OE1-NH1 3.9Å; E321-R356 WeakPolarHBondContact OE2-CD 3.43Å; E321-R356 IonicContact OE2-CZ 2.67Å; E321-R356 IonicContact OE2-NE 2.67Å; E321-R356 IonicContact OE2-NH1 3.63Å; E321-R356 PolarHBondContact OE2-NH1 2.94Å; H352-R356 PolarHBondContact NE2-NH2 2.96Å; H352-R356 WeakPolarHBondContact O-CG 3.36Å; H352-R356 PolarHBondContact O-N 2.79Å; C353-R356 PolarHBondContact O-N 2.98Å; I354-R356 VanDerWaalsContact C-N 3.34Å; I354-R356 PolarHBondContact O-N 3.41Å; R356-A358 VanDerWaalsContact C-N 3.35Å; R356-A358 PolarHBondContact O-N 3.43Å; R356-K359 PolarHBondContact O-N 3.04Å; R356-L360 PolarHBondContact O-N 3.41Å
357I55.6Low54.9Low42 Ų4272.7 Ų72.722%0.21539%0.392CS..Hα-helixtrans-63.8-40.7178.1-70.4176.6000110.9I318 F322 C353 I354 K359 L360 L361I318-I357 HydrophobicContact CG2-CD1 4.38Å; I318-I357 HydrophobicContact CG2-CG1 4.36Å; F322-I357 HydrophobicContact CD2-CD1 4.27Å; C353-I357 WeakPolarHBondContact O-CB 3.16Å; C353-I357 WeakPolarHBondContact O-CG1 3.27Å; C353-I357 PolarHBondContact O-N 3.35Å; C353-I357 VanDerWaalsContact SG-CD1 3.52Å; I354-I357 PolarHBondContact O-N 2.98Å; I357-K359 VanDerWaalsContact C-N 3.32Å; I357-K359 PolarHBondContact O-N 3.34Å; I357-L360 PolarHBondContact O-N 2.85Å; I357-L361 HydrophobicContact CG2-CD1 3.71Å; I357-L361 HydrophobicContact CG2-CG 4.33Å; I357-L361 WeakPolarHBondContact O-CB 3.44Å; I357-L361 WeakPolarHBondContact O-CG 3.44Å; I357-L361 PolarHBondContact O-N 2.9Å
358A61.5Low55Low12 Ų1276.6 Ų76.610%0.09940%0.403CS..Hα-helixtrans-60.6-40.7175.200000112.2I354 R356 L361 T362 I363 I365I354-A358 VanDerWaalsContact O-CB 3.3Å; I354-A358 WeakPolarHBondContact O-CB 3.49Å; I354-A358 PolarHBondContact O-N 3.43Å; R356-A358 VanDerWaalsContact C-N 3.35Å; R356-A358 PolarHBondContact O-N 3.43Å; A358-L361 CarbonylContact O-C 3.59Å; A358-L361 PolarHBondContact O-N 3.02Å; A358-T362 PolarHBondContact O-N 3Å; A358-I363 HydrophobicContact CB-CB 4.47Å; A358-I363 PolarHBondContact O-N 2.96Å; A358-I365 HydrophobicContact CB-CD1 3.6Å; A358-I365 HydrophobicContact CB-CG1 3.64Å
359K64Low54.8Low163 Ų16376.1 Ų76.171%0.70940%0.4SS*.Hα-helixtrans-64-43.8174.1-74.7178.6178.8-1790112.4T355 R356 I357 L361 T362T355-K359 WeakPolarHBondContact O-CG 3.32Å; T355-K359 PolarHBondContact O-N 2.71Å; R356-K359 PolarHBondContact O-N 3.04Å; I357-K359 VanDerWaalsContact C-N 3.32Å; I357-K359 PolarHBondContact O-N 3.34Å; K359-L361 VanDerWaalsContact C-N 3.31Å; K359-L361 PolarHBondContact O-N 3.31Å; K359-T362 PolarHBondContact O-N 3.5Å
360L55.9Low54.6Low59 Ų5977.2 Ų77.231%0.30941%0.409SS..Hα-helixtrans-62.4-35.9174.9-79.2174.1000113I318 E321 R356 I357 T362I318-L360 HydrophobicContact CB-CD1 4.46Å; I318-L360 HydrophobicContact CG1-CB 4.11Å; I318-L360 HydrophobicContact CG1-CD1 3.8Å; E321-L360 HydrophobicContact CB-CD1 4.2Å; E321-L360 HydrophobicContact CG-CD1 4.09Å; R356-L360 PolarHBondContact O-N 3.41Å; I357-L360 PolarHBondContact O-N 2.85Å; L360-T362 VanDerWaalsContact C-N 3.33Å
361L58.5Low54.3Low74 Ų7478.9 Ų78.939%0.38742%0.415SS..THydrogen-bonded Turntrans-86-0.5177.5-67.8173.6000113.6I314 I318 I357 A358 K359 I363I314-L361 HydrophobicContact CG2-CD2 4.22Å; I318-L361 HydrophobicContact CD1-CD2 3.6Å; I318-L361 HydrophobicContact CD1-CG 3.96Å; I357-L361 HydrophobicContact CG2-CD1 3.71Å; I357-L361 HydrophobicContact CG2-CG 4.33Å; I357-L361 WeakPolarHBondContact O-CB 3.44Å; I357-L361 WeakPolarHBondContact O-CG 3.44Å; I357-L361 PolarHBondContact O-N 2.9Å; A358-L361 CarbonylContact O-C 3.59Å; A358-L361 PolarHBondContact O-N 3.02Å; K359-L361 VanDerWaalsContact C-N 3.31Å; K359-L361 PolarHBondContact O-N 3.31Å; L361-I363 HydrophobicContact CB-CD1 3.69Å; L361-I363 HydrophobicContact CB-CG1 3.79Å; L361-I363 HydrophobicContact CD1-CD1 3.85Å; L361-I363 HydrophobicContact CG-CD1 4.42Å; L361-I363 PolarHBondContact O-N 3.32Å
362T58.6Low54Low129 Ų12982.8 Ų82.879%0.79143%0.433SS*.THydrogen-bonded Turntrans53.528.4-172.158.90000114.6A358 K359 L360A358-T362 PolarHBondContact O-N 3Å; K359-T362 PolarHBondContact O-N 3.5Å; L360-T362 VanDerWaalsContact C-N 3.33Å
363I54.5Low53.5Low96 Ų9678.1 Ų78.149%0.49241%0.411SS..PPolyproline II helixtrans-85.1124.1177.7-62.4171.7000108.7A358 L361 I365A358-I363 HydrophobicContact CB-CB 4.47Å; A358-I363 PolarHBondContact O-N 2.96Å; L361-I363 HydrophobicContact CB-CD1 3.69Å; L361-I363 HydrophobicContact CB-CG1 3.79Å; L361-I363 HydrophobicContact CD1-CD1 3.85Å; L361-I363 HydrophobicContact CG-CD1 4.42Å; L361-I363 PolarHBondContact O-N 3.32Å; I363-I365 PolarHBondContact O-N 3.41Å
364P49.6Very low53.1Low115 Ų11580.2 Ų80.275%0.74743%0.426SS*.PPolyproline II helixtrans-68.4128.2172.428.6-33.1000110.2
365I48.3Very low53Low38 Ų3882 Ų8220%0.19543%0.433CS..PPolyproline II helixtrans-82.5131.4170.1-70179.5000108.1I354 T355 A358 I363 V369 L373I354-I365 HydrophobicContact CG2-CD1 4.48Å; T355-I365 HydrophobicContact CG2-CD1 4.28Å; A358-I365 HydrophobicContact CB-CD1 3.6Å; A358-I365 HydrophobicContact CB-CG1 3.64Å; I363-I365 PolarHBondContact O-N 3.41Å; I365-V369 HydrophobicContact CG2-CB 3.69Å; I365-V369 HydrophobicContact CG2-CG1 3.94Å; I365-L373 HydrophobicContact CG2-CD1 4.4Å
366P48.7Very low52.2Low68 Ų6885.1 Ų85.144%0.44244%0.444SS..PPolyproline II helixtrans-63.9142.2176.2-22.534.1000112.7H368 V369 T370P366-H368 VanDerWaalsContact C-N 3.25Å; P366-H368 VanDerWaalsContact CB-CE1 3.43Å; P366-H368 WeakPolarHBondContact CB-CE1 3.48Å; P366-H368 PolarHBondContact O-N 2.9Å; P366-H368 VanDerWaalsContact O-N 3.1Å; P366-V369 HydrophobicContact CB-CG2 4.43Å; P366-V369 WeakPolarHBondContact O-CA 3.27Å; P366-V369 WeakPolarHBondContact O-CB 3.42Å; P366-V369 PolarHBondContact O-N 2.86Å; P366-T370 PolarHBondContact O-N 2.88Å; P366-T370 PolarHBondContact O-OG1 3.04Å
367D50.1Low51.4Low135 Ų13585.6 Ų85.672%0.72246%0.457SS*.Hα-helixtrans-60.4-27.8-170.4-63.7-68.1000115.2V369 T370 M371D367-V369 VanDerWaalsContact C-N 3.33Å; D367-V369 PolarHBondContact O-N 3.37Å; D367-T370 WeakPolarHBondContact CA-OG1 3.21Å; D367-T370 PolarHBondContact O-N 2.64Å; D367-M371 WeakPolarHBondContact O-CB 3.4Å; D367-M371 PolarHBondContact O-N 3.11Å
368H53.9Low50.2Low118 Ų11890.9 Ų90.955%0.54649%0.486SS..Hα-helixtrans-64.3-36.8172.663-96.6000112.4P366 M371 E372P366-H368 VanDerWaalsContact C-N 3.25Å; P366-H368 VanDerWaalsContact CB-CE1 3.43Å; P366-H368 WeakPolarHBondContact CB-CE1 3.48Å; P366-H368 PolarHBondContact O-N 2.9Å; P366-H368 VanDerWaalsContact O-N 3.1Å; H368-M371 PolarHBondContact O-N 2.72Å; H368-E372 PolarHBondContact O-N 2.98Å
369V44.9Very low48.6Very low42 Ų4294.8 Ų94.826%0.25551%0.512SS..Hα-helixtrans-70.2-40.8175-172.50000109.4I365 P366 D367 M371 E372 L373I365-V369 HydrophobicContact CG2-CB 3.69Å; I365-V369 HydrophobicContact CG2-CG1 3.94Å; P366-V369 HydrophobicContact CB-CG2 4.43Å; P366-V369 WeakPolarHBondContact O-CA 3.27Å; P366-V369 WeakPolarHBondContact O-CB 3.42Å; P366-V369 PolarHBondContact O-N 2.86Å; D367-V369 VanDerWaalsContact C-N 3.33Å; D367-V369 PolarHBondContact O-N 3.37Å; V369-M371 VanDerWaalsContact C-N 3.25Å; V369-M371 PolarHBondContact O-N 2.99Å; V369-E372 PolarHBondContact O-N 3.08Å; V369-L373 HydrophobicContact CG1-CD1 3.98Å; V369-L373 HydrophobicContact CG1-CG 4.26Å; V369-L373 VanDerWaalsContact O-CB 3.31Å; V369-L373 WeakPolarHBondContact O-CB 3.29Å; V369-L373 WeakPolarHBondContact O-CD1 3.47Å; V369-L373 WeakPolarHBondContact O-CG 3.45Å; V369-L373 PolarHBondContact O-N 1.91Å
370T49.9Very low46.8Very low60 Ų6094 Ų9437%0.36852%0.515SS..Hα-helixtrans-64.4-29.1175-5.90000113.2P366 D367 L373 S374P366-T370 PolarHBondContact O-N 2.88Å; P366-T370 PolarHBondContact O-OG1 3.04Å; D367-T370 WeakPolarHBondContact CA-OG1 3.21Å; D367-T370 PolarHBondContact O-N 2.64Å; T370-L373 HydrophobicContact CG2-CD1 4.35Å; T370-S374 PolarHBondContact O-N 3.02Å; T370-S374 PolarHBondContact O-OG 3.45Å
371M50.1Low45.5Very low121 Ų12196.6 Ų96.660%0.59654%0.536SS*.Hα-helixtrans-78.2-30.3174-176.3174.563.800113.6D367 H368 V369 S374 Q375D367-M371 WeakPolarHBondContact O-CB 3.4Å; D367-M371 PolarHBondContact O-N 3.11Å; H368-M371 PolarHBondContact O-N 2.72Å; V369-M371 VanDerWaalsContact C-N 3.25Å; V369-M371 PolarHBondContact O-N 2.99Å; M371-S374 PolarHBondContact O-OG 2.78Å; M371-S374 VanDerWaalsContact O-OG 3.05Å; M371-Q375 PolarHBondContact O-NE2 3.04Å
372E48Very low44.2Very low118 Ų11899.2 Ų99.255%0.55155%0.554SS**Hα-helixtrans-71.6-42.8165.8-74-174.2163.300110.8H368 V369 S374 Q375 F376H368-E372 PolarHBondContact O-N 2.98Å; V369-E372 PolarHBondContact O-N 3.08Å; E372-S374 VanDerWaalsContact C-N 3.25Å; E372-S374 PolarHBondContact O-N 3.12Å; E372-Q375 WeakPolarHBondContact O-CB 3.45Å; E372-Q375 PolarHBondContact O-N 3.18Å; E372-F376 VanDerWaalsContact O-CD2 3.23Å; E372-F376 WeakPolarHBondContact O-CD2 3.43Å
373L43.3Very low42.7Very low18 Ų1899 Ų999%0.09455%0.552CS.*Hα-helixtrans-55.9-36.3179-74.5165.1000112.6I351 I365 V369 T370 Q375 F376I351-L373 HydrophobicContact CB-CD2 3.72Å; I351-L373 HydrophobicContact CD1-CD2 4.39Å; I351-L373 HydrophobicContact CG1-CD2 3.66Å; I351-L373 HydrophobicContact CG2-CD2 3.34Å; I365-L373 HydrophobicContact CG2-CD1 4.4Å; V369-L373 HydrophobicContact CG1-CD1 3.98Å; V369-L373 HydrophobicContact CG1-CG 4.26Å; V369-L373 VanDerWaalsContact O-CB 3.31Å; V369-L373 WeakPolarHBondContact O-CB 3.29Å; V369-L373 WeakPolarHBondContact O-CD1 3.47Å; V369-L373 WeakPolarHBondContact O-CG 3.45Å; V369-L373 PolarHBondContact O-N 1.91Å; T370-L373 HydrophobicContact CG2-CD1 4.35Å; L373-Q375 VanDerWaalsContact C-N 3.35Å; L373-F376 PolarHBondContact O-N 3.41Å
374S49.2Very low41.4Very low61 Ų6199.6 Ų99.643%0.42757%0.565SS.*G310 helixtrans-72.8-20.9177550000114.4T370 M371 E372 F376 T377T370-S374 PolarHBondContact O-N 3.02Å; T370-S374 PolarHBondContact O-OG 3.45Å; M371-S374 PolarHBondContact O-OG 2.78Å; M371-S374 VanDerWaalsContact O-OG 3.05Å; E372-S374 VanDerWaalsContact C-N 3.25Å; E372-S374 PolarHBondContact O-N 3.12Å; S374-F376 PolarHBondContact O-N 2.87Å; S374-T377 PolarHBondContact O-N 3.03Å; S374-T377 PolarHBondContact O-OG1 3.44Å
375Q50.5Low40.4Very low135 Ų135101.4 Ų101.463%0.63157%0.568SS**G310 helixtrans-69.8-17.1175-63.2170.641.600112.4M371 E372 L373M371-Q375 PolarHBondContact O-NE2 3.04Å; E372-Q375 WeakPolarHBondContact O-CB 3.45Å; E372-Q375 PolarHBondContact O-N 3.18Å; L373-Q375 VanDerWaalsContact C-N 3.35Å
376F43.7Very low39.4Very low93 Ų93106.9 Ų106.941%0.40860%0.598SS.*G310 helixtrans-101.8-1.1179.2-61.8-79.9000113.9V348 I351 E372 L373 S374V348-F376 HydrophobicContact CG2-CB 4.41Å; I351-F376 HydrophobicContact CD1-CB 4.02Å; I351-F376 HydrophobicContact CD1-CD1 4.39Å; I351-F376 HydrophobicContact CD1-CD2 3.33Å; I351-F376 HydrophobicContact CD1-CE2 3.84Å; I351-F376 HydrophobicContact CD1-CG 3.65Å; E372-F376 VanDerWaalsContact O-CD2 3.23Å; E372-F376 WeakPolarHBondContact O-CD2 3.43Å; L373-F376 PolarHBondContact O-N 3.41Å; S374-F376 PolarHBondContact O-N 2.87Å
377T41.3Very low38.3Very low101 Ų101113.1 Ų113.162%0.6262%0.618SS**SBendtrans-83.5-17.6178.342.10000114.6S374 C379S374-T377 PolarHBondContact O-N 3.03Å; S374-T377 PolarHBondContact O-OG1 3.44Å; T377-C379 PolarHBondContact O-N 3.15Å
378D28.7Very low37.2Very low152 Ų152111.8 Ų111.881%0.81362%0.62SS**  trans-80.245.4175.6-71-4.8000112.2D380D378-D380 PolarHBondContact O-N 3.34Å
379C28.2Very low36Very low95 Ų95115 Ų11564%0.64264%0.635SS**  trans-85.791.3159.2-70.30000107.8T377T377-C379 PolarHBondContact O-N 3.15Å
380D26Very low35Very low147 Ų147122 Ų12279%0.78666%0.662SS**  trans-44.3132.1173.9-108.5-39.7000110.4D378 V382D378-D380 PolarHBondContact O-N 3.34Å; D380-V382 PolarHBondContact O-N 3.07Å
381P29.8Very low33.9Very low113 Ų113127.5 Ų127.573%0.73469%0.688SS**  trans-67.297.1-174.226.9-34000109.7V383P381-V383 PolarHBondContact O-N 3.34Å
382V30.2Very low32.9Very low128 Ų128128.3 Ų128.378%0.77670%0.695SS**  trans-44.8112.7-175.11770000109.8D380 S384D380-V382 PolarHBondContact O-N 3.07Å; V382-S384 PolarHBondContact O-N 3.18Å; V382-S384 PolarHBondContact O-OG 3.11Å
383V27.3Very low31.8Very low125 Ų125132.6 Ų132.676%0.75871%0.712SS**  trans-57.3104.7-174.7177.30000108.2P381 D385P381-V383 PolarHBondContact O-N 3.34Å; V383-D385 VanDerWaalsContact C-N 3.34Å; V383-D385 PolarHBondContact O-N 3.25Å
384S28.8Very low31.1Very low109 Ų109141.7 Ų141.776%0.76275%0.751SS**  trans-79.291.4-177.6-18.40000107V382 N386V382-S384 PolarHBondContact O-N 3.18Å; V382-S384 PolarHBondContact O-OG 3.11Å; S384-N386 PolarHBondContact O-N 2.92Å
385D28.5Very low29.8Very low152 Ų152143.3 Ų143.381%0.81377%0.767SS**  trans-61.784.4169.9-100-38000109.8V383V383-D385 VanDerWaalsContact C-N 3.34Å; V383-D385 PolarHBondContact O-N 3.25Å
386N27.1Very low28.6Very low154 Ų154142.2 Ų142.282%0.82478%0.775SS**  trans-155.1137.3152.6-101.5-61.3000111.1S384S384-N386 PolarHBondContact O-N 2.92Å
387K25.7Very low27.6Very low198 Ų198146.8 Ų146.886%0.86180%0.795SS**  trans-75162.1-172.1-64158.1-177.3167.80111.1
388S25.6Very low26.7Very low107 Ų107146.8 Ų146.875%0.74880%0.798SS**  trans74.8140.6-179.680.10000114.6
389Q28.4Very low26.4Very low187 Ų187145.3 Ų145.387%0.87480%0.795SS**  cis-142.6154.45.2-132.6161.528.900110.5
390K24.4Very low26.2Very low187 Ų187147.1 Ų147.181%0.81380%0.798SS**  trans-64.3135.8178-69.7-179.2175.6-176.30111.3
391L27.4Very low26Very low176 Ų176145.9 Ų145.992%0.92180%0.801SS**  trans-143.6130.4144.6-102169.4000108.3
392D29.5Very low25.7Very low139 Ų139145.6 Ų145.674%0.74380%0.801SS**  trans-85.4152.5-158.4-74.9-72000115.4K394D392-K394 PolarHBondContact O-N 3.08Å
393K24.2Very low25.4Very low207 Ų207146.5 Ų146.590%0.981%0.808SS**  trans-57.8123.2172.5-65.1175178.4177.20111.1
394K27.9Very low25.3Very low210 Ų210147.3 Ų147.391%0.91381%0.813SS**  trans-140.289.1151-101-176.8-178.6176.60111.4D392D392-K394 PolarHBondContact O-N 3.08Å
395A23.9Very low25.1Very low94 Ų94146.4 Ų146.478%0.77781%0.812SS**  trans-79.5132.7160.400000109.4
396S24.5Very low24.8Very low112 Ų112148.8 Ų148.878%0.78382%0.815SS**  trans-171.4131.5151.7-86.60000111.9
397K23.1Very low24.7Very low190 Ų190146.7 Ų146.783%0.82681%0.812SS**  trans27.5107.3136.7-64.3177.7-179.8-179.50116.5
398S21.7Very low25Very low100 Ų100143.2 Ų143.270%0.69981%0.81SS**  70.4151.570.376.50000114.7
399V22.9Very low24.9Very low121 Ų121147 Ų14773%0.73381%0.813SS**  trans101.6102.6173.5-176.40000115.6
400N23.5Very low24.7Very low133 Ų133147.4 Ų147.471%0.71181%0.812SS**  trans55.7100.1140.6-555.2000120.4S402N400-S402 PolarHBondContact O-N 3.15Å
401S21.4Very low24.7Very low122 Ų122145.4 Ų145.485%0.85381%0.81SS**  2.9112.3123.856.40000117.4
402S23.9Very low24.7Very low106 Ų106146.8 Ų146.874%0.74181%0.809SS**  trans-135.5133.7152.861.30000110.2N400 V404N400-S402 PolarHBondContact O-N 3.15Å; S402-V404 PolarHBondContact O-N 3.12Å
403T23.9Very low24.7Very low148 Ų148147.9 Ų147.991%0.90882%0.815SS**  trans-44.5123.9179.946.80000114.4
404V25.2Very low24.7Very low142 Ų142147.5 Ų147.586%0.86181%0.813SS**  trans-116.9136.3166.4178.20000109.5S402S402-V404 PolarHBondContact O-N 3.12Å
405A24.7Very low24.6Very low90 Ų90142.5 Ų142.574%0.74481%0.805SS**  trans-80.2163.6-172.900000113.7
406K22.6Very low24.5Very low201 Ų201145.3 Ų145.387%0.87481%0.807SS**  trans-57.2134.4179.7-63.6172.6178.6176.20112
407S24.8Very low24.6Very low110 Ų110148.6 Ų148.677%0.76981%0.81SS**  trans-128.9155.516052.70000109.1
408P32.4Very low24.8Very low126 Ų126146.7 Ų146.782%0.81881%0.808SS**  trans-85.6157.9-149.231.3-36.2000116
409K23.1Very low25Very low185 Ų185149.9 Ų149.980%0.80482%0.816SS**  trans-53148.1173.1-64.7-179.1175.4-175.90111.8
410K24.8Very low25.1Very low197 Ų197152.3 Ų152.386%0.85782%0.819SS**  trans-140.9128.9163.5-158.8174.1-171.9178.80109
411D24.1Very low25.2Very low145 Ų145153 Ų15378%0.77582%0.822SS**  trans-77.3147.5-160.5-48.9-84.2000113.9
412F27.5Very low25.4Very low205 Ų205154.7 Ų154.790%0.89982%0.82SS**  trans-125.8132.2167-98.1-90000110.2
413N28.6Very low25.3Very low162 Ų162156.7 Ų156.787%0.86682%0.822SS**  trans-75.5146.6-171.9-86.7-45.9000113.1
414K23.7Very low25.4Very low198 Ų198154.8 Ų154.886%0.86182%0.815SS**  trans-69.2128.9170.9-67.3178.7176.5179.70110.9
415S26.7Very low25.4Very low105 Ų105159.2 Ų159.273%0.73482%0.816SS**  trans-111.4119.3159.651.10000109.1E417S415-E417 PolarHBondContact O-N 3.29Å
416N22.3Very low25.5Very low154 Ų154159.3 Ų159.382%0.82482%0.817SS**  trans-80.6110.1174.4-73.9-11.7000109.6
417E26.3Very low25.6Very low181 Ų181159.3 Ų159.385%0.84682%0.817SS**  trans-104.8120.2163.6-67.9-161.6137.100109.9S415S415-E417 PolarHBondContact O-N 3.29Å
418N26.9Very low25.6Very low149 Ų149159.8 Ų159.880%0.79782%0.817SS**  trans-74.4128.1179.8-78.1-40.8000110.4H420N418-H420 PolarHBondContact O-N 3.47Å
419I26.2Very low25.2Very low168 Ų168158.8 Ų158.886%0.86281%0.813SS**  trans-68103.1178.6-60.5171.1000109.2L421I419-L421 PolarHBondContact O-N 3.01Å
420H25.5Very low25.2Very low171 Ų171157.6 Ų157.679%0.79281%0.814SS**  trans-70.3125.1176.6-113.8-90.6000111.1N418 I422N418-H420 PolarHBondContact O-N 3.47Å; H420-I422 PolarHBondContact O-N 3.33Å
421L24.2Very low25.2Very low149 Ų149155.3 Ų155.378%0.7881%0.811SS**  trans-75111.8-178.8-158.478.3000110.6I419 N423I419-L421 PolarHBondContact O-N 3.01Å; L421-N423 PolarHBondContact O-N 3.42Å; L421-N423 VanDerWaalsContact O-N 3.08Å
422I25.3Very low25.3Very low157 Ų157157.2 Ų157.281%0.80582%0.815SS**  trans-79.993.3-176.7-57178.6000110.4H420H420-I422 PolarHBondContact O-N 3.33Å
423N23.2Very low25.2Very low148 Ų148156.9 Ų156.979%0.79181%0.813SS**  trans-77123.5165.5-87.4-24.1000110.7L421L421-N423 PolarHBondContact O-N 3.42Å; L421-N423 VanDerWaalsContact O-N 3.08Å
424S25.2Very low25Very low108 Ų108153.3 Ų153.376%0.75581%0.807SS**  trans-138.5153162.767.30000108.2
425R25.2Very low25Very low235 Ų235154 Ų15489%0.88781%0.81SS**  cis-151141.226.9-178.9177.8179.4176.10.3112.2
426A27.3Very low24.8Very low91 Ų91157.2 Ų157.275%0.75281%0.814SS**  trans41.7110.2157.800000120.4
427K24.2Very low25Very low201 Ų201159.1 Ų159.187%0.87482%0.82SS**PPolyproline II helixtrans-81152.7134.1-80.3-174.8174.9-177.50108.8
428P24.8Very low24.9Very low120 Ų120155.6 Ų155.678%0.77981%0.807SS**PPolyproline II helixtrans-68.7149.1177.729.4-35.3000112
429S23.4Very low24.7Very low106 Ų106156.1 Ų156.174%0.74180%0.802SS**PPolyproline II helixtrans-76.1128.7177.9480000111.9
430I25Very low24.6Very low159 Ų159154.1 Ų154.182%0.81580%0.803SS**  trans-121.2104.2162.5-62.4177.8000106.7Q432I430-Q432 PolarHBondContact O-N 3.04Å
431D23.4Very low24.5Very low149 Ų149150.9 Ų150.980%0.79780%0.8SS**  trans-78.6108176.3-77.5-57.9000110.8
432Q26Very low24.7Very low185 Ų185151.2 Ų151.286%0.86480%0.802SS**  trans-150.489.3156.7-122.2156.87600113.2I430I430-Q432 PolarHBondContact O-N 3.04Å
433K25.9Very low24.6Very low198 Ų198152.5 Ų152.586%0.86180%0.802SS**  trans17.6120.5155.5-66.1-179.1178178.60118.8
434A23.5Very low24.6Very low88 Ų88151.5 Ų151.573%0.72780%0.801SS**  trans-38.2138.6163.200000115.6
435F25.6Very low24.8Very low212 Ų212151.9 Ų151.993%0.9380%0.804SS**  trans-98.6104.8140.8-90.8-93.9000107.9
436E22.3Very low24.6Very low173 Ų173147.3 Ų147.381%0.80880%0.803SS**  trans-73.4125.5162-70.1-178.9111.400108.4
437M25.8Very low24.6Very low193 Ų193149.3 Ų149.395%0.95181%0.805SS**  trans-121.7104.8163.8-167171.3-174.400107.7
438D24.6Very low24.6Very low108 Ų108148.5 Ų148.558%0.57880%0.801SS**  trans-89.4155.2-155.4-154.220.2000114.5
439K22.7Very low24.6Very low160 Ų160154.3 Ų154.370%0.69681%0.808SS**  trans-2.9137.1165.4-61.3155.8-161.480.80117.4
440S24.3Very low24.7Very low125 Ų125155.8 Ų155.887%0.87481%0.808SS**  -178.4166.598.147.50000113.9
441S23.9Very low24.7Very low104 Ų104157.7 Ų157.773%0.72781%0.81SS**  trans-109.4145.8-175.753.60000112.5
442N26.6Very low24.7Very low156 Ų156156.5 Ų156.583%0.83481%0.81SS**  trans-152.4117.6149.4-89.1-49.2000108.2
443K24.1Very low24.5Very low183 Ų183152.9 Ų152.980%0.79681%0.805SS**  72.1108.770.3-104.1-175.4177.11780115.5
444T22.4Very low24.5Very low127 Ų127151 Ų15178%0.77980%0.803SS**  trans54.6114.2144.450.40000120.4
445S29.1Very low24.5Very low116 Ų116153.4 Ų153.481%0.81180%0.804SS**  trans-138.9113.2142.855.80000110.7
446T22.7Very low24.5Very low140 Ų140148 Ų14886%0.85979%0.793SS**  trans-89.7115.8-180-12.60000109.6
447V27.1Very low24.7Very low132 Ų132148.1 Ų148.180%0.880%0.798SS**  trans-108.1109.9174.3-178.90000109.5
448K22.7Very low24.5Very low184 Ų184146.2 Ų146.280%0.879%0.785SS**  trans-70.9146.3165.9-64.6-178.7180-179.10109.3
449R25.7Very low24.6Very low242 Ų242147.7 Ų147.791%0.91380%0.797SS**  trans-147.5126.1156.9-138.9172.4-168.6159.64.4109
450D26.4Very low24.7Very low138 Ų138145.5 Ų145.574%0.73879%0.793SS**PPolyproline II helixtrans-82.3152.6-160.2-55.2-81000113.1
451K23.6Very low24.8Very low199 Ų199146.9 Ų146.987%0.86579%0.79SS**PPolyproline II helixtrans-78125174.6-70.7-179.2175.7-178.40109.6S453K451-S453 PolarHBondContact O-N 2.98Å
452P24.6Very low24.9Very low123 Ų123149.1 Ų149.180%0.79979%0.794SS**PPolyproline II helixtrans-70.7118.1162.529.3-31.2000109
453S22Very low24.8Very low110 Ų110150.3 Ų150.377%0.76980%0.795SS**PPolyproline II helixtrans-83.8131.4170.551.40000110.4K451K451-S453 PolarHBondContact O-N 2.98Å
454I24.5Very low24.9Very low158 Ų158151.9 Ų151.981%0.8180%0.802SS**  trans-127.5134.2163-62.1-178.6000107.3
455N24.9Very low25.1Very low139 Ų139148.8 Ų148.874%0.74380%0.795SS**  trans-55.8139.1-179.6-64.72.1000110.3
456S24.1Very low24.9Very low99 Ų99152.6 Ų152.669%0.69280%0.8SS**  cis69.389.445.387.70000113.5
457D27.2Very low25Very low174 Ų174153.4 Ų153.493%0.9380%0.799SS**  trans-124.7141.9153.5-98.2-46.7000108.9
458K21.9Very low24.9Very low153 Ų153156.1 Ų156.167%0.66580%0.803SS**  trans-89.7145-179.9-85.1167.7146.6-92.10110.5D460K458-D460 IonicContact NZ-OD1 2.8Å; K458-D460 PolarHBondContact NZ-OD1 3.19Å; K458-D460 IonicContact NZ-OD2 3.87Å; K458-D460 PolarHBondContact NZ-OD2 3.04Å
459V26.2Very low25.1Very low139 Ų139154.7 Ų154.784%0.84280%0.803SS**  trans-129.4109.6141.9-178.80000106.1
460D24.2Very low25.2Very low114 Ų114149.8 Ų149.861%0.6179%0.793SS**  trans-77.5134174.4-64.9-56.6000109.2K458K458-D460 IonicContact NZ-OD1 2.8Å; K458-D460 PolarHBondContact NZ-OD1 3.19Å; K458-D460 IonicContact NZ-OD2 3.87Å; K458-D460 PolarHBondContact NZ-OD2 3.04Å
461L27.4Very low25.2Very low154 Ų154151.9 Ų151.981%0.80680%0.796SS**  trans-145.889.1167.2-99.7175.7000109.7
462D25.1Very low25.3Very low151 Ų151149.3 Ų149.381%0.80779%0.791SS**  trans31.7139.8157.2-56.9-33000123.2
463E25.4Very low25.3Very low182 Ų182150.3 Ų150.385%0.8579%0.79SS**  trans-90.1111.2-171.7176-180-14800113.1
464F26.4Very low25.5Very low216 Ų216150.1 Ų150.195%0.94779%0.786SS**  trans-153.5132.1158.5-85-81.8000109.2
465G25.3Very low25.6Very low62 Ų62148.4 Ų148.464%0.63979%0.785SS**  cis175.9109.2-9.100000112
466Q25.7Very low25.6Very low195 Ų195147.7 Ų147.791%0.91179%0.79SS**  trans61.2119.1173.8-63.6-176.4-1100117.9
467D25.1Very low25.6Very low157 Ų157151.1 Ų151.184%0.8480%0.795SS**  trans-60.1130.8169.7-51.9-97.7000112I469D467-I469 PolarHBondContact O-N 3.01Å
468E25.1Very low25.5Very low190 Ų190150.4 Ų150.489%0.88879%0.789SS**  trans-64.2111.1159.7-80.8-158.4120.700108.7I470E468-I470 PolarHBondContact O-N 3.46Å
469I27.4Very low25.7Very low154 Ų154150.2 Ų150.279%0.7980%0.796SS**  trans-59.1108.4-178.7-62.8172.9000108.9D467 K471D467-I469 PolarHBondContact O-N 3.01Å; I469-K471 PolarHBondContact O-N 3.38Å
470I25.9Very low25.7Very low138 Ų138152.1 Ų152.171%0.70879%0.792SS**  trans-54.8106.5175.4-61.9173.7000108.3E468 N472E468-I470 PolarHBondContact O-N 3.46Å; I470-N472 PolarHBondContact O-N 3.25Å; I470-N472 PolarHBondContact O-ND2 3.43Å
471K26.4Very low25.7Very low183 Ų183152.9 Ų152.980%0.79680%0.801SS**  trans-66.798.7171.4-73.4178.7-179.8171.30107.8I469 D473I469-K471 PolarHBondContact O-N 3.38Å; K471-D473 VanDerWaalsContact C-N 3.28Å; K471-D473 PolarHBondContact O-N 2.9Å
472N26.2Very low25.6Very low144 Ų144153 Ų15377%0.7780%0.797SS**  trans-7090.8167.3-66.6-75.4000107.5I470I470-N472 PolarHBondContact O-N 3.25Å; I470-N472 PolarHBondContact O-ND2 3.43Å
473D24.7Very low25.6Very low144 Ų144153.1 Ų153.177%0.7780%0.797SS**PPolyproline II helixtrans-55.7127.4172.5-75.4-38000109.1K471K471-D473 VanDerWaalsContact C-N 3.28Å; K471-D473 PolarHBondContact O-N 2.9Å
474P27.1Very low25.4Very low106 Ų106153.1 Ų153.169%0.68880%0.8SS**PPolyproline II helixtrans-68.2146.6-17327.3-34.3000110.9C476P474-C476 PolarHBondContact O-N 3.24Å
475P26.8Very low25.4Very low123 Ų123146.7 Ų146.780%0.79978%0.781SS**PPolyproline II helixtrans-61.7129.4-179.726.7-34.4000110.2E477P475-E477 PolarHBondContact O-N 2.92Å
476C23.1Very low25.4Very low123 Ų123149.8 Ų149.883%0.83178%0.783SS**PPolyproline II helixtrans-50.8127.6-176.3-55.10000111.6P474 I478P474-C476 PolarHBondContact O-N 3.24Å; C476-I478 PolarHBondContact O-N 3.11Å
477E24.4Very low25.3Very low172 Ų172150.8 Ų150.880%0.80478%0.78SS**PPolyproline II helixtrans-60.1128173-77.4-166.89600109.9P475 D479P475-E477 PolarHBondContact O-N 2.92Å; E477-D479 PolarHBondContact O-N 3.11Å
478I26.1Very low25.2Very low159 Ų159149.1 Ų149.182%0.81578%0.781SS**  trans-74107.2169.8-61.2171.8000106.1C476 K480C476-I478 PolarHBondContact O-N 3.11Å; I478-K480 PolarHBondContact O-N 2.95Å
479D26.3Very low25.2Very low149 Ų149145 Ų14580%0.79777%0.773SS**  trans-47113.8178.9-96.7-40.7000110.7E477 V481E477-D479 PolarHBondContact O-N 3.11Å; D479-V481 VanDerWaalsContact C-N 3.34Å; D479-V481 PolarHBondContact O-N 3.4Å
480K25.2Very low25.1Very low178 Ų178143.3 Ų143.377%0.77478%0.775SS**  trans-73.491.9176.4-69.9168.2-172.6144.10107.8I478 E482I478-K480 PolarHBondContact O-N 2.95Å; K480-E482 PolarHBondContact O-N 3.03Å
481V25.5Very low25Very low130 Ų130146.4 Ų146.479%0.78879%0.786SS**  trans-61.292.2165.9-178.50000107.6D479 L483D479-V481 VanDerWaalsContact C-N 3.34Å; D479-V481 PolarHBondContact O-N 3.4Å; V481-L483 PolarHBondContact O-N 2.87Å; V481-L483 VanDerWaalsContact O-N 3.14Å
482E24.6Very low24.9Very low156 Ų156142.9 Ų142.973%0.72979%0.785SS**  trans-69.4110.2-177.8-167.1175.9-17000108.5K480 M484K480-E482 PolarHBondContact O-N 3.03Å; E482-M484 PolarHBondContact O-N 2.96Å
483L24.4Very low24.8Very low155 Ų155141.5 Ų141.581%0.81279%0.787SS**  trans-71.791.4-171.6-149.693.8000109.9V481 S485V481-L483 PolarHBondContact O-N 2.87Å; V481-L483 VanDerWaalsContact O-N 3.14Å; L483-S485 PolarHBondContact O-N 2.82Å
484M22.8Very low24.7Very low182 Ų182146.8 Ų146.890%0.89780%0.796SS**  trans-68.296.7173.9-74.6-166.266.300110.2E482E482-M484 PolarHBondContact O-N 2.96Å
485S24.5Very low24.6Very low81 Ų81147.8 Ų147.857%0.56680%0.804SS**  trans-77.8157.8172.170.60000111.9L483L483-S485 PolarHBondContact O-N 2.82Å
486D25.3Very low24.5Very low126 Ų126145.5 Ų145.567%0.67480%0.802SS**  trans63.193.4156-43.2-47.5000118.7
487Y25.4Very low24.6Very low216 Ų216145.2 Ų145.285%0.84780%0.802SS**  trans-154.172.4136.1-95.2-62.5000111.4S489Y487-S489 VanDerWaalsContact C-N 3.3Å; Y487-S489 PolarHBondContact O-N 2.95Å
488S23Very low24.5Very low123 Ų123144.3 Ų144.386%0.8680%0.802SS**  trans-80.270.3173.2-590000112.2
489S24.6Very low24.3Very low103 Ų103146.4 Ų146.472%0.7281%0.805SS**  trans-78.2120.317152.30000111.3Y487 E491Y487-S489 VanDerWaalsContact C-N 3.3Å; Y487-S489 PolarHBondContact O-N 2.95Å; S489-E491 PolarHBondContact O-N 3.35Å
490S24.8Very low24.2Very low119 Ų119147.9 Ų147.983%0.83281%0.805SS**  trans-83.6104.7-169.3-43.50000114
491E22.9Very low24.2Very low202 Ų202144.5 Ų144.594%0.94480%0.801SS**  trans-99.291162-76.2-158.8123.700111S489S489-E491 PolarHBondContact O-N 3.35Å
492S24.8Very low24.2Very low110 Ų110145.9 Ų145.977%0.76980%0.804SS**  trans-122.987.9178.5164.20000110.9
493S25.3Very low24.1Very low115 Ų115146.3 Ų146.380%0.80481%0.809SS**  trans175.487.3148.755.50000113.7
494R22.7Very low24.1Very low254 Ų254143.9 Ų143.996%0.95881%0.806SS**  trans-159.468.7158-129.9175.4-172.5-174.72116.6
495C23.1Very low24.3Very low128 Ų128141.2 Ų141.287%0.86581%0.805SS**  trans-147.7122.1149.8-144.30000108.7
496G25Very low24.4Very low74 Ų74143.1 Ų143.176%0.76382%0.818SS**  trans-80.7124.1-168.800000112.8L498G496-L498 PolarHBondContact O-N 3.48Å; G496-L498 VanDerWaalsContact O-N 3.13Å
497S25Very low24.5Very low117 Ų117142.1 Ų142.182%0.81882%0.821SS**  trans-66.1107.3169.4-53.70000110.1K499S497-K499 PolarHBondContact O-N 3.12Å
498L23.1Very low24.6Very low154 Ų154136.1 Ų136.181%0.80681%0.81SS**  trans-66.1102.8168.1-75.8166.6000108.6G496 F500G496-L498 PolarHBondContact O-N 3.48Å; G496-L498 VanDerWaalsContact O-N 3.13Å; L498-F500 PolarHBondContact O-N 2.72Å
499K23Very low25Very low202 Ų202137 Ų13788%0.87881%0.806SS**PPolyproline II helixtrans-63.6120.7170.7-76.9-169.9172.1-169.70109.2S497S497-K499 PolarHBondContact O-N 3.12Å
500F23.6Very low25.2Very low180 Ų180140.7 Ų140.779%0.78981%0.811SS**PPolyproline II helixtrans-81139.2157.7-72.1-95.9000107.9L498L498-F500 PolarHBondContact O-N 2.72Å
501P25.3Very low25.4Very low108 Ų108142 Ų14270%0.70181%0.809SS**PPolyproline II helixtrans-80.2122.417530.8-31.5000110.1
502D24.5Very low25.9Very low159 Ų159140 Ų14085%0.8580%0.804SS**PPolyproline II helixtrans-68.7136.2168.2-73-60.8000110.5
503I23.7Very low26Very low164 Ų164142.6 Ų142.684%0.84181%0.81SS**  trans-121.180180-53.1177.3000108.3
504S24.7Very low26.2Very low105 Ų105140.9 Ų140.973%0.73481%0.81SS**  trans-106.4119.4167.657.70000109.8
505S26.5Very low26.3Very low125 Ų125137.3 Ų137.387%0.87481%0.81SS**  trans-52.3132.3-178.850.50000114.2
506S25.8Very low26.4Very low122 Ų122133.7 Ų133.785%0.85380%0.795SS**  trans-134.9157.1158.450.80000109.1
507S27.2Very low26.4Very low105 Ų105136 Ų13673%0.73479%0.794SS**  trans-111.5156.8-166.655.30000113.3
508S28.4Very low26.3Very low89 Ų89139.2 Ų139.262%0.62279%0.794SS**  trans57.9110.2156.156.40000118.7
509D30.5Very low26.3Very low142 Ų142138.2 Ų138.276%0.75979%0.789SS**  59.5101.7125.7-40.3-28.7000119.1
510H29.5Very low26.3Very low180 Ų180134.5 Ų134.583%0.83378%0.779SS**  -172.1149.599.2-107.4-70.5000113.2
511D29.6Very low26.3Very low147 Ų147132.6 Ų132.679%0.78678%0.777SS**  trans-73.5135.2161.3-38.3-99.2000110.6
512D31.9Very low26.5Very low159 Ų159133.8 Ų133.885%0.8578%0.778SS**  -171.1160.4116.1-132.2-32.7000111.6
513D28.4Very low26.6Very low166 Ų166134.4 Ų134.489%0.88877%0.773SS**  trans-79.9134.7178.3-82.1-53.1000112.4
514G28.4Very low26.8Very low79 Ų79133.8 Ų133.881%0.81477%0.771SS**  trans-162113.1179.400000115.7
515D24.7Very low27Very low178 Ų178138.5 Ų138.595%0.95278%0.778SS**  trans-82.6157.5173.2-172.517.6000112
516G25.8Very low27Very low52 Ų52137 Ų13754%0.53677%0.768SS.*  trans110.984.8162.500000118.8
517T25.2Very low27.1Very low124 Ų124136.2 Ų136.276%0.76176%0.762SS**  trans38.9120.9134.755.50000122.5
518F22.3Very low27.2Very low183 Ų183137.9 Ų137.980%0.80376%0.763SS**  trans49.6108.2140.7-75.6-91.7000120.3
519N23.7Very low27.1Very low133 Ų133138.3 Ų138.371%0.71176%0.762SS**  176.9146.499.6-98.4-42.9000116.4
520N22.7Very low26.9Very low124 Ų124137.8 Ų137.866%0.66376%0.76SS**  trans58.4127.4141.2-62.1-25000123.7
521N23.6Very low27.1Very low140 Ų140135.2 Ų135.275%0.74975%0.752SS**  trans63.2113.1132.9-59.5-12000121.9
522D29.8Very low27Very low134 Ų134134.7 Ų134.772%0.71775%0.749SS**  -166.1167122.4-99.7-24000107.6
523K27.1Very low26.9Very low171 Ų171134.5 Ų134.574%0.74375%0.748SS**  cis165.5112.7-31.5-106.4-156.6-151.689.20105.6
524N26.4Very low26.9Very low152 Ų152133.5 Ų133.581%0.81374%0.743SS**  trans32.4117.3144.7-60.72.2000121.5
525K30Very low26.9Very low203 Ų203136.5 Ų136.588%0.88374%0.74SS**  trans-158.4115.7133.9-103.2169.2-177.6175.60107.9
526S25.5Very low26.9Very low94 Ų94135.1 Ų135.166%0.65773%0.733SS**  cis100.5132.815.584.40000115.5
527S28.1Very low27.2Very low105 Ų105140.7 Ų140.773%0.73475%0.75SS**  trans74.8150.7168.988.90000116.4
528N28.8Very low27.2Very low140 Ų140142.1 Ų142.175%0.74975%0.753SS**  cis-169-175.2-6.5-115.633000108.1
529T26.6Very low27.2Very low99 Ų99136.6 Ų136.661%0.60775%0.748SS**  cis172.6152.8-35.644.70000106.4
530N27.5Very low27.2Very low131 Ų131138 Ų13870%0.70176%0.756SS**  cis-166.7-178.4-3-130.365000110.3
531N32.1Very low27.3Very low125 Ų125142 Ų14267%0.66876%0.763SS**  trans73.2136.3156.8-62.3-3.4000117.7
532N27.5Very low27.4Very low137 Ų137141.6 Ų141.673%0.73376%0.761SS**  cis94.7120.935.9-75.514.3000113.5
533D31.7Very low27.3Very low154 Ų154143 Ų14382%0.82477%0.768SS**  -177.5171.4105.4-92.4-24.2000113.1
534N27.5Very low27.2Very low146 Ų146141.9 Ų141.978%0.78177%0.77SS**  trans-74.6167.9175.6-62.8-38.2000110.8
535D28.3Very low27.2Very low141 Ų141144.4 Ų144.475%0.75477%0.774SS**  -172.6-177.853.5-136.4-48.1000113.8
536N25.6Very low27Very low150 Ų150138.9 Ų138.980%0.80277%0.766SS**  trans-72.2139.2179.1-62.5-90.2000112.9
537N31.5Very low27Very low169 Ų169139.8 Ų139.890%0.90477%0.773SS**  trans-150.2162.3145.3-144.7-17.9000112.5
538N24.2Very low27Very low153 Ų153140.6 Ų140.682%0.81878%0.776SS**  trans-117.5126.1-159.7-177.328.5000113.2
539G22.3Very low26.9Very low68 Ų68143.3 Ų143.370%0.70178%0.784SS**  trans73.9128.8160.400000118
540N24.7Very low26.7Very low162 Ų162143.9 Ų143.987%0.86679%0.791SS**  -161.716896.6-154.7-0.4000111
541Y24.3Very low26.7Very low208 Ų208142.5 Ų142.582%0.81679%0.792SS**  trans-86.4173.6177.5-94.2-105.4000113.3
542N25Very low26.4Very low131 Ų131144.5 Ų144.570%0.70180%0.798SS**  trans76.1105.9164.5-55.3-18.1000118
543N28.6Very low26.1Very low163 Ų163145.6 Ų145.687%0.87280%0.803SS**  -168.6130.595.8-95.7-52.6000112.3
544D25.5Very low25.9Very low149 Ų149144.4 Ų144.480%0.79780%0.796SS**  trans-75.1141.2164.9-66.1-79000111.7
545K26.2Very low25.9Very low204 Ų204147.1 Ų147.189%0.88780%0.801SS**  trans168.6150.2146.1-93.9150-171.8173.10110.7
546A24.6Very low25.7Very low87 Ų87148.6 Ų148.672%0.71980%0.803SS**  cis-173119.2-27.800000108.3
547S25.2Very low25.6Very low114 Ų114146.7 Ų146.780%0.79779%0.793SS**  trans-169.977.716457.70000112
548P29.5Very low25.3Very low122 Ų122147.5 Ų147.579%0.79279%0.792SS**  trans-75.6127.9169.631.2-31.6000110.3S550P548-S550 PolarHBondContact O-N 3.05Å
549E25.4Very low25.2Very low197 Ų197146.6 Ų146.692%0.92179%0.787SS**  trans-73.8113.6170-67.9-174.9130.400109.4S551E549-S551 PolarHBondContact O-N 2.74Å
550S24.1Very low25.3Very low110 Ų110148.4 Ų148.477%0.76978%0.784SS**  trans-79.4103.4-175.8550000112.1P548P548-S550 PolarHBondContact O-N 3.05Å
551S26.2Very low25.2Very low103 Ų103147.2 Ų147.272%0.7278%0.776SS**  trans-75.7115.8158.954.90000109.4E549 D553E549-S551 PolarHBondContact O-N 2.74Å; S551-D553 PolarHBondContact O-N 2.9Å
552E25.3Very low25.2Very low167 Ų167144.2 Ų144.278%0.7877%0.773SS**  trans-69.4114.1-177-65.5176.211400112.4I554E552-I554 HydrophobicContact CB-CG1 4.42Å; E552-I554 PolarHBondContact O-N 3.26Å
553D22.7Very low25Very low159 Ų159146.2 Ų146.285%0.8578%0.778SS**  trans-72.785.9171.7-84.4-48.6000111.3S551S551-D553 PolarHBondContact O-N 2.9Å
554I26Very low24.8Very low130 Ų130143.2 Ų143.267%0.66777%0.769SS**  trans-97.588.3168.5-54.8178.8000109.2E552E552-I554 HydrophobicContact CB-CG1 4.42Å; E552-I554 PolarHBondContact O-N 3.26Å
555F28.5Very low24.7Very low203 Ų203141.8 Ų141.889%0.8977%0.768SS**  trans173.375.1136-93.2-60.8000110.2
556Q23.8Very low24.5Very low171 Ų171139.5 Ų139.580%0.79977%0.765SS**  trans-80.6148.2175.7-145.6170.55.300111.4
557D24.5Very low24.5Very low111 Ų111144.6 Ų144.659%0.59477%0.774SS**  trans42.4109.1164.7-71-52.8000120.9N559D557-N559 PolarHBondContact OD1-ND2 2.97Å
558Q25Very low24.4Very low186 Ų186146.4 Ų146.487%0.86977%0.769SS**  trans-138.471.8133.1-121.4176.238.700111.3V560Q558-V560 VanDerWaalsContact C-N 3.26Å; Q558-V560 PolarHBondContact O-N 3.34Å
559N21.7Very low24Very low134 Ų134145.8 Ų145.872%0.71777%0.768SS**  trans-67.776.9170.7-86.1-54.4000111.3D557 I561D557-N559 PolarHBondContact OD1-ND2 2.97Å; N559-I561 PolarHBondContact O-N 3.27Å
560V25.1Very low23.9Very low106 Ų106142 Ų14264%0.64275%0.754SS**  trans-84.190.7171.9-174.90000109.2Q558 I562Q558-V560 VanDerWaalsContact C-N 3.26Å; Q558-V560 PolarHBondContact O-N 3.34Å; V560-I562 HydrophobicContact CG1-CG1 4.17Å; V560-I562 PolarHBondContact O-N 3.29Å
561I21.8Very low23.8Very low137 Ų137144.2 Ų144.270%0.70376%0.756SS**  trans-66.1102.6175.4-61172.3000109.2N559 Q563N559-I561 PolarHBondContact O-N 3.27Å; I561-Q563 HydrophobicContact CG2-CG 3.79Å
562I23.6Very low23.7Very low145 Ų145144.4 Ų144.474%0.74475%0.753SS**  trans-100.690.4164-56.9-176.2000107.7V560 S564V560-I562 HydrophobicContact CG1-CG1 4.17Å; V560-I562 PolarHBondContact O-N 3.29Å; I562-S564 PolarHBondContact O-N 2.88Å; I562-S564 VanDerWaalsContact O-N 3.08Å
563Q21.8Very low23.6Very low173 Ų173142.7 Ų142.781%0.80875%0.754SS**  trans-71.193.5167.5-80.5171.1-1800109.7I561I561-Q563 HydrophobicContact CG2-CG 3.79Å
564S23.2Very low23.6Very low99 Ų99142.4 Ų142.469%0.69275%0.752SS**PPolyproline II helixtrans-76.4123.8154.135.80000108.3I562I562-S564 PolarHBondContact O-N 2.88Å; I562-S564 VanDerWaalsContact O-N 3.08Å
565P24.6Very low23.5Very low119 Ų119144.9 Ų144.977%0.77376%0.761SS**PPolyproline II helixtrans-71.7142.9-168.827.5-34.9000112.4H567P565-H567 PolarHBondContact O-N 3.07Å
566L22.5Very low23.2Very low157 Ų157139.7 Ų139.782%0.82275%0.75SS**PPolyproline II helixtrans-64.2126.3168.5-8280.6000109.6Q568L566-Q568 PolarHBondContact O-N 3.23Å
567H23.2Very low23.2Very low194 Ų194139.1 Ų139.190%0.89875%0.752SS**  trans-70.985.4158.7-101.1-75.6000108.8P565 S569P565-H567 PolarHBondContact O-N 3.07Å; H567-S569 PolarHBondContact O-N 3.15Å
568Q23Very low23.2Very low151 Ų151137.3 Ų137.371%0.70676%0.76SS**  trans-74.291.3178.5-156.3173.88.200109.1L566 N570L566-Q568 PolarHBondContact O-N 3.23Å; Q568-N570 VanDerWaalsContact C-N 3.27Å; Q568-N570 WeakPolarHBondContact CG-OD1 3.43Å; Q568-N570 PolarHBondContact O-N 2.73Å
569S22.8Very low23.2Very low109 Ų109137.2 Ų137.276%0.76276%0.764SS**  trans-72.482.1177.357.40000110.2H567 I571H567-S569 PolarHBondContact O-N 3.15Å; S569-I571 PolarHBondContact O-N 2.95Å
570N22Very low23.2Very low117 Ų117141 Ų14163%0.62677%0.774SS**  trans-64.691-179.2-70.5-17.5000111.6Q568 T572Q568-N570 VanDerWaalsContact C-N 3.27Å; Q568-N570 WeakPolarHBondContact CG-OD1 3.43Å; Q568-N570 PolarHBondContact O-N 2.73Å; N570-T572 PolarHBondContact O-N 2.67Å
571I22.7Very low23.1Very low157 Ų157139 Ų13981%0.80578%0.775SS**  trans-8390.4157-59.4-179.5000106.2S569 T573S569-I571 PolarHBondContact O-N 2.95Å; I571-T573 PolarHBondContact O-N 2.83Å; I571-T573 VanDerWaalsContact O-N 3.12Å
572T23.4Very low23.2Very low108 Ų108140 Ų14066%0.66378%0.782SS**  trans-66.1107.6177.445.60000110.1N570 N574N570-T572 PolarHBondContact O-N 2.67Å; T572-N574 PolarHBondContact O-N 3.44Å; T572-N574 VanDerWaalsContact O-N 3.1Å
573T23.5Very low23.2Very low130 Ų130138.8 Ų138.880%0.79879%0.786SS**  trans-64.1105.2162.345.30000108.4I571 E575I571-T573 PolarHBondContact O-N 2.83Å; I571-T573 VanDerWaalsContact O-N 3.12Å; T573-E575 PolarHBondContact O-N 2.94Å
574N23.9Very low23.2Very low154 Ų154137.8 Ų137.882%0.82479%0.785SS**  trans-59.8127.1175.2-81.3-13.2000110.1T572T572-N574 PolarHBondContact O-N 3.44Å; T572-N574 VanDerWaalsContact O-N 3.1Å
575E22.7Very low23.2Very low182 Ų182139.2 Ų139.285%0.8579%0.785SS**  trans-68.9152.4171.9-57.9178.312200111T573T573-E575 PolarHBondContact O-N 2.94Å
576S22.5Very low23.2Very low94 Ų94140.2 Ų140.266%0.65778%0.782SS**  137146.3118.667.70000114.6
577N24.1Very low23.1Very low159 Ų159137.4 Ų137.485%0.8578%0.776SS**  trans68.5125.5165.4-45-50.2000116.5
578G24.1Very low23.2Very low72 Ų72132.8 Ų132.874%0.74277%0.765SS**  cis14090.7-3.800000112
579L24.8Very low23.2Very low185 Ų185134.3 Ų134.397%0.96978%0.777SS**  trans-117.6126.2169.3-72.8171.9000109.1
580K22.2Very low23.2Very low213 Ų213134 Ų13493%0.92678%0.775SS**  trans-149.1126.9-169.3-172.7-179.5-175.8179.80109.1
581G23.2Very low23.1Very low64 Ų64133.8 Ų133.866%0.6678%0.782SS**  trans109.8146.8-174.500000112
582N23.9Very low23.2Very low157 Ų157134.3 Ų134.384%0.8479%0.786SS**  cis-130126.62.2-75.1-32.9000111.9I584N582-I584 PolarHBondContact O-N 3.29Å
583S22.5Very low23.1Very low121 Ų121138.1 Ų138.185%0.84680%0.796SS**  trans-77.4103.9169.553.20000110.3N585S583-N585 PolarHBondContact O-N 3.03Å
584I22.5Very low23Very low151 Ų151138.4 Ų138.477%0.77480%0.798SS**  trans-78.4119.7171.9-63.2178.4000108.3N582 I586N582-I584 PolarHBondContact O-N 3.29Å; I584-I586 HydrophobicContact CG2-CD1 4.35Å; I584-I586 HydrophobicContact CG2-CG1 4.17Å
585N23.1Very low23Very low129 Ų129135.5 Ų135.569%0.6979%0.79SS**  trans-102.9111.2-173.9-175.27.7000110.3S583 S587S583-N585 PolarHBondContact O-N 3.03Å; N585-S587 PolarHBondContact OD1-N 2.96Å; N585-S587 PolarHBondContact OD1-OG 3.18Å
586I24.4Very low22.9Very low141 Ų141133.5 Ų133.572%0.72379%0.785SS**  trans-124.167.2173.5-50.3-176.9000109.3I584 S588I584-I586 HydrophobicContact CG2-CD1 4.35Å; I584-I586 HydrophobicContact CG2-CG1 4.17Å; I586-S588 PolarHBondContact O-N 2.84Å
587S21.3Very low23Very low98 Ų98135.9 Ų135.969%0.68579%0.79SS**  trans-83.473.3171.356.90000111.4N585N585-S587 PolarHBondContact OD1-N 2.96Å; N585-S587 PolarHBondContact OD1-OG 3.18Å
588S24.7Very low23Very low96 Ų96132.2 Ų132.267%0.67178%0.777SS**  trans-170.191.116941.90000114.8I586I586-S588 PolarHBondContact O-N 2.84Å
589L23.4Very low23Very low183 Ų183136 Ų13696%0.95877%0.773SS**  trans-160.1104.2146.6-111.3157.3000109.2
590S21.5Very low23.1Very low102 Ų102136.2 Ų136.271%0.71377%0.769SS**  trans-88.1146.9-172.853.60000112.8
591C20.6Very low23.2Very low114 Ų114131.2 Ų131.277%0.7776%0.761SS**  trans38113144.9-56.50000118.7
592N23.9Very low23.4Very low167 Ų167133.8 Ų133.889%0.89377%0.766SS**  -145.6117.9124.4-100.4-33.3000109.5
593E21.6Very low23.5Very low189 Ų189132.9 Ų132.988%0.88377%0.765SS**  trans-78.3129167-63.6176.5112.400108.7
594T23Very low23.5Very low136 Ų136132.7 Ų132.783%0.83476%0.759SS**  trans-152.6139.8149.8-20.30000110.9
595S22Very low23.6Very low92 Ų92132.5 Ų132.564%0.64376%0.759SS**  trans-68.8151.5-173.255.50000114.5
596N22.3Very low23.6Very low141 Ų141132.9 Ų132.975%0.75476%0.761SS**  trans53.796.6146.1-56.3-10.4000117.5
597N23.6Very low23.6Very low143 Ų143133.4 Ų133.477%0.76577%0.765SS**  -173.7175.397.2-93.8-14.4000112.4
598S25.4Very low23.7Very low82 Ų82135.3 Ų135.357%0.57377%0.773SS**  trans-52.7146.2171.952.40000113.6
599F23.6Very low23.6Very low152 Ų152138.3 Ų138.367%0.66778%0.776SS**  -159.7149.5124.2-106-67.7000111.8T909F599-T909 HydrophobicContact CE1-CG2 3.85Å; F599-T909 HydrophobicContact CZ-CG2 4.03Å
600H25.9Very low23.7Very low190 Ų190134.7 Ų134.788%0.8876%0.764SS**  trans-71.5139161.6-76.6-97.7000109.4
601S25.2Very low23.8Very low108 Ų108137.4 Ų137.476%0.75577%0.77SS**  trans-147.8133.3157.2-164.60000108.9
602P27.6Very low24Very low117 Ų117139.9 Ų139.976%0.7677%0.77SS**  trans-74.1130.8-176.129.7-33.7000110.9V604P602-V604 PolarHBondContact O-N 3Å; P602-V604 VanDerWaalsContact O-N 3.17Å
603V24.4Very low24Very low138 Ų138139.2 Ų139.284%0.83677%0.767SS**  trans-71.2110.3171.7177.50000108.3L605V603-L605 PolarHBondContact O-N 3.39Å
604V22.7Very low24.2Very low118 Ų118135.2 Ų135.272%0.71576%0.755SS**  trans-62.2124.6166.4175.90000107.8P602 N606P602-V604 PolarHBondContact O-N 3Å; P602-V604 VanDerWaalsContact O-N 3.17Å; V604-N606 PolarHBondContact O-N 3.38Å; V604-N606 VanDerWaalsContact O-N 3.08Å
605L25.7Very low24.2Very low146 Ų146135.4 Ų135.476%0.76476%0.756SS**  trans-72.5100.4179.8-16382.4000108.7V603 D607V603-L605 PolarHBondContact O-N 3.39Å; L605-D607 PolarHBondContact O-N 2.94Å
606N23.3Very low24.3Very low138 Ų138136.4 Ų136.474%0.73876%0.763SS**  trans-73120.5170-80.4-11.9000109V604 V608V604-N606 PolarHBondContact O-N 3.38Å; V604-N606 VanDerWaalsContact O-N 3.08Å; N606-V608 PolarHBondContact O-N 2.96Å
607D24.6Very low24.4Very low151 Ų151132.8 Ų132.881%0.80776%0.759SS**  trans-60.5102.7-179.9-68.1-63.3000112.1L605 Q609L605-D607 PolarHBondContact O-N 2.94Å; D607-Q609 VanDerWaalsContact C-N 3.3Å; D607-Q609 PolarHBondContact O-N 3.23Å
608V23.5Very low24.4Very low139 Ų139134.3 Ų134.384%0.84277%0.766SS**  trans-83.885.2159.6-177.90000106.9N606N606-V608 PolarHBondContact O-N 2.96Å
609Q21.4Very low24.4Very low158 Ų158139.3 Ų139.374%0.73878%0.78SS**PPolyproline II helixtrans-53.7121.2176.8-175.2176.8-4.300109.8D607D607-Q609 VanDerWaalsContact C-N 3.3Å; D607-Q609 PolarHBondContact O-N 3.23Å
610P26.1Very low24.4Very low108 Ų108137.1 Ų137.170%0.70178%0.784SS**PPolyproline II helixtrans-74.2129.6-177.728.9-33.6000110.7E612P610-E612 PolarHBondContact O-N 3.13Å
611D23.5Very low24.3Very low158 Ų158138.8 Ų138.885%0.84578%0.783SS**PPolyproline II helixtrans-57126.6-180-83.6-52.2000112.1N613D611-N613 PolarHBondContact O-N 2.89Å
612E24.5Very low24.2Very low166 Ų166142 Ų14278%0.77679%0.785SS**  trans-7382.3-174.8-65.5-171.812300112P610 T614P610-E612 PolarHBondContact O-N 3.13Å; E612-T614 PolarHBondContact O-N 3.41Å; E612-T614 PolarHBondContact O-OG1 3.11Å
613N24.8Very low24.1Very low153 Ų153142 Ų14282%0.81878%0.783SS**  trans-72.653.4166.3-89-45.2000112.6D611 V615D611-N613 PolarHBondContact O-N 2.89Å; N613-V615 PolarHBondContact O-N 3.22Å
614T24.5Very low24.1Very low106 Ų106144 Ų14465%0.6578%0.78SS**  trans7.174.1143.3-51.40000116.4E612 S616E612-T614 PolarHBondContact O-N 3.41Å; E612-T614 PolarHBondContact O-OG1 3.11Å; T614-S616 VanDerWaalsContact CG2-OG 3.31Å; T614-S616 WeakPolarHBondContact CG2-OG 3.38Å
615V24.3Very low24.2Very low139 Ų139143.2 Ų143.284%0.84278%0.78SS**  trans-98.969.5159.8-173.90000108.7N613 G617N613-V615 PolarHBondContact O-N 3.22Å; V615-G617 VanDerWaalsContact C-N 3.26Å; V615-G617 PolarHBondContact O-N 2.87Å
616S24.1Very low24.1Very low114 Ų114142.9 Ų142.980%0.79778%0.779SS**  trans-70.675.8178.4-54.10000111.5T614T614-S616 VanDerWaalsContact CG2-OG 3.31Å; T614-S616 WeakPolarHBondContact CG2-OG 3.38Å
617G24.4Very low24Very low64 Ų64142 Ų14266%0.6678%0.784SS**  trans-116.3-22.7-16600000117.9V615V615-G617 VanDerWaalsContact C-N 3.26Å; V615-G617 PolarHBondContact O-N 2.87Å
618L23.7Very low24Very low175 Ų175144.2 Ų144.292%0.91679%0.786SS**  trans-132.691.7-176.6-85.8168.3000111.8S620L618-S620 PolarHBondContact O-N 3.43Å
619Q25.2Very low24Very low187 Ų187142.7 Ų142.787%0.87478%0.782SS**  trans-62.4116.1169.3-72.5-178.1-14.700110.3R621Q619-R621 PolarHBondContact O-N 3.1Å
620S24Very low24.2Very low107 Ų107142 Ų14275%0.74878%0.782SS**  trans-63.597.9165.5470000109.4L618 H622L618-S620 PolarHBondContact O-N 3.43Å; S620-H622 PolarHBondContact O-N 3.02Å
621R23.3Very low24.1Very low225 Ų225144.7 Ų144.785%0.84978%0.783SS**  trans-60.5107.5170.3-87.4-173.6171.3176.6-1.4108.6Q619 V623Q619-R621 PolarHBondContact O-N 3.1Å; R621-V623 PolarHBondContact O-N 3.05Å
622H22.9Very low24.1Very low176 Ų176145 Ų14582%0.81578%0.779SS**  trans-63.277.9171-102.3-65.9000110.7S620 K624S620-H622 PolarHBondContact O-N 3.02Å; H622-K624 PolarHBondContact O-N 3.35Å; H622-K624 VanDerWaalsContact O-N 3.09Å
623V25.4Very low24Very low116 Ų116142.6 Ų142.670%0.70377%0.772SS**  trans-74.296163.2-179.20000106.6R621 S625R621-V623 PolarHBondContact O-N 3.05Å; V623-S625 PolarHBondContact O-N 3.38Å
624K24.4Very low23.9Very low179 Ų179142.4 Ų142.478%0.77877%0.77SS**  trans-66.884.6163.1-75.7-173.5174.5-1760108.6H622 D626H622-K624 PolarHBondContact O-N 3.35Å; H622-K624 VanDerWaalsContact O-N 3.09Å; K624-D626 VanDerWaalsContact C-N 3.33Å; K624-D626 PolarHBondContact O-N 3.26Å; K624-D626 VanDerWaalsContact O-N 3.14Å
625S24.5Very low23.9Very low103 Ų103144 Ų14472%0.7277%0.773SS**  trans-77.687.6165.855.10000108.3V623 S627V623-S625 PolarHBondContact O-N 3.38Å; S625-S627 PolarHBondContact O-N 2.73Å
626D24Very low23.9Very low138 Ų138144.1 Ų144.174%0.73877%0.768SS**  trans-54.6137.8-179.3-73.2-39.5000111.7K624 K628K624-D626 VanDerWaalsContact C-N 3.33Å; K624-D626 PolarHBondContact O-N 3.26Å; K624-D626 VanDerWaalsContact O-N 3.14Å; D626-K628 PolarHBondContact O-N 3.15Å
627S21.1Very low23.8Very low121 Ų121143 Ų14385%0.84676%0.759SS**  trans-69.389-174.557.40000112.3S625S625-S627 PolarHBondContact O-N 2.73Å
628K25.5Very low23.7Very low197 Ų197148.6 Ų148.686%0.85777%0.769SS**  trans-100.388.3159.1-78.2-174.1175.8176.80109.6D626 L630D626-K628 PolarHBondContact O-N 3.15Å; K628-L630 VanDerWaalsContact C-N 3.26Å; K628-L630 PolarHBondContact O-N 2.93Å
629S23Very low23.7Very low107 Ų107146.5 Ų146.575%0.74876%0.763SS**  trans-64.183.7171.256.70000110.4K631S629-K631 PolarHBondContact O-N 2.9Å
630L24.5Very low23.7Very low142 Ų142142.9 Ų142.974%0.74376%0.758SS**  trans-76.183.1175.5-147.3167.1000108K628 Q632K628-L630 VanDerWaalsContact C-N 3.26Å; K628-L630 PolarHBondContact O-N 2.93Å; L630-Q632 VanDerWaalsContact C-N 3.32Å; L630-Q632 HydrophobicContact CD2-CG 3.83Å; L630-Q632 PolarHBondContact O-N 3.31Å
631K24.6Very low23.7Very low165 Ų165142.7 Ų142.772%0.71776%0.757SS**  trans-61.893.7171.5-74.2-168.6174.8-166.80109.4S629S629-K631 PolarHBondContact O-N 2.9Å
632Q23.1Very low23.7Very low165 Ų165135.1 Ų135.177%0.77175%0.748SS**  trans-97.691150.5-76.1177.9-71.500105.8L630 L634L630-Q632 VanDerWaalsContact C-N 3.32Å; L630-Q632 HydrophobicContact CD2-CG 3.83Å; L630-Q632 PolarHBondContact O-N 3.31Å; Q632-L634 PolarHBondContact O-N 3.01Å
633D24.1Very low23.8Very low115 Ų115130 Ų13062%0.61574%0.743SS**  trans-59.3103.8175.6-61.2-54.6000107.6I635D633-I635 HydrophobicContact CB-CG1 4.37Å; D633-I635 PolarHBondContact O-N 3.37Å
634L22.7Very low23.7Very low150 Ų150132 Ų13279%0.78575%0.75SS**  trans-81.779.9-176.8-152.7146.2000107.2Q632 I636Q632-L634 PolarHBondContact O-N 3.01Å; L634-I636 HydrophobicContact CD2-CD1 4.14Å; L634-I636 HydrophobicContact CD2-CG1 3.75Å; L634-I636 PolarHBondContact O-N 3.45Å
635I23Very low23.8Very low138 Ų138129.6 Ų129.671%0.70875%0.75SS**  trans-66.583.8-176.9-57.4171.1000108.9D633 S637D633-I635 HydrophobicContact CB-CG1 4.37Å; D633-I635 PolarHBondContact O-N 3.37Å; I635-S637 VanDerWaalsContact C-N 3.27Å; I635-S637 PolarHBondContact O-N 3.08Å; I635-S637 VanDerWaalsContact O-N 3.08Å
636I23.8Very low23.9Very low143 Ų143130.5 Ų130.573%0.73375%0.752SS**  trans-73.291159.4-57.4-178.8000105.4L634 E638L634-I636 HydrophobicContact CD2-CD1 4.14Å; L634-I636 HydrophobicContact CD2-CG1 3.75Å; L634-I636 PolarHBondContact O-N 3.45Å; I636-E638 PolarHBondContact O-N 3.34Å; I636-E638 VanDerWaalsContact O-N 3.12Å
637S23.1Very low23.9Very low89 Ų89132.8 Ų132.862%0.62276%0.758SS**  trans-54117-178.1-58.70000111.1I635 V639I635-S637 VanDerWaalsContact C-N 3.27Å; I635-S637 PolarHBondContact O-N 3.08Å; I635-S637 VanDerWaalsContact O-N 3.08Å; S637-V639 PolarHBondContact O-N 3.4Å
638E22.6Very low24.2Very low183 Ų183136.3 Ų136.386%0.85576%0.758SS**  trans-60.2110173.7-65.6-177.4121.500109.7I636 S640I636-E638 PolarHBondContact O-N 3.34Å; I636-E638 VanDerWaalsContact O-N 3.12Å; E638-S640 PolarHBondContact O-N 3.28Å
639V24Very low24.1Very low130 Ų130135 Ų13579%0.78876%0.76SS**  trans-76.574.4172.8-175.20000108.5S637 S641S637-V639 PolarHBondContact O-N 3.4Å; V639-S641 PolarHBondContact O-N 3.22Å
640S23.6Very low24.3Very low111 Ų111140 Ų14078%0.77677%0.768SS**  trans-73.968.4177.2173.50000111.3E638 G642E638-S640 PolarHBondContact O-N 3.28Å; S640-G642 PolarHBondContact O-N 2.99Å
641S24.3Very low24.4Very low104 Ų104136.7 Ų136.773%0.72777%0.768SS**  trans-78.766175.847.10000112.3V639 G643V639-S641 PolarHBondContact O-N 3.22Å; S641-G643 VanDerWaalsContact C-N 3.27Å; S641-G643 PolarHBondContact O-N 3.05Å
642G23.2Very low24.3Very low65 Ų65137.1 Ų137.167%0.6777%0.773SS**  trans-67.771.8177.800000114.4S640 N644S640-G642 PolarHBondContact O-N 2.99Å; G642-N644 PolarHBondContact O-N 3.49Å; G642-N644 VanDerWaalsContact O-N 3.08Å
643G24.7Very low24.4Very low68 Ų68136 Ų13670%0.70177%0.772SS**  trans-78.178.6178.700000113.8S641 V645S641-G643 VanDerWaalsContact C-N 3.27Å; S641-G643 PolarHBondContact O-N 3.05Å; G643-V645 PolarHBondContact O-N 3.22Å
644N24.8Very low24.4Very low160 Ų160139.9 Ų139.986%0.85679%0.787SS**  trans-68.888.5173.8-80.1-41.1000112G642G642-N644 PolarHBondContact O-N 3.49Å; G642-N644 VanDerWaalsContact O-N 3.08Å
645V26.7Very low24.4Very low128 Ų128141.4 Ų141.478%0.77679%0.792SS**  trans-94.5105.4168.2-178.40000109.2G643 E647G643-V645 PolarHBondContact O-N 3.22Å; V645-E647 PolarHBondContact O-N 2.82Å
646T25.1Very low24.5Very low122 Ų122141.1 Ų141.175%0.74880%0.797SS**  trans-75.8100.4172.649.80000110.3K648T646-K648 PolarHBondContact O-N 2.94Å
647E25.1Very low24.4Very low185 Ų185141.9 Ų141.986%0.86480%0.802SS**PPolyproline II helixtrans-59.5125.4169.1-67.7-173.8124.300110.3V645V645-E647 PolarHBondContact O-N 2.82Å
648K26.3Very low24.4Very low196 Ų196143.7 Ų143.785%0.85281%0.814SS**PPolyproline II helixtrans-94119.2171.7-79.2-177.4175.5177.20109.1T646 K650T646-K648 PolarHBondContact O-N 2.94Å; K648-K650 PolarHBondContact O-N 3.45Å
649N24Very low24.5Very low168 Ų168140.7 Ų140.790%0.89881%0.813SS**PPolyproline II helixtrans-57.7119.2165.9-70.6-20.1000110.3
650K27.1Very low24.5Very low213 Ų213142.5 Ų142.593%0.92682%0.818SS**  trans-141.2143.9153.9-104.3-165.8170.3-165.30108.4K648K648-K650 PolarHBondContact O-N 3.45Å
651G26.1Very low24.5Very low72 Ų72142 Ų14274%0.74282%0.821SS**  trans-84.9151.3-161.600000115.8
652E23.8Very low24.6Very low175 Ų175147.1 Ų147.182%0.81883%0.83SS**  trans40.9122.8136.1-61.9-164.4158.700121.7
653N25.1Very low24.6Very low141 Ų141150.2 Ų150.275%0.75484%0.836SS**  trans66.684134.3-55.8-22000119.4
654E24.5Very low24.6Very low197 Ų197155 Ų15592%0.92184%0.844SS**  trans-97.1127.4141.3-71.6-16814200109.6
655M22.2Very low24.5Very low182 Ų182153.6 Ų153.690%0.89784%0.837SS**  trans-119.2103.7-179-168.2171.4-17400109.1
656T25.3Very low24.4Very low131 Ų131152.9 Ų152.980%0.80484%0.838SS**PPolyproline II helixtrans-84.3123.3-171.224.90000112.9
657N21.3Very low24.3Very low160 Ų160152.4 Ų152.486%0.85684%0.839SS**PPolyproline II helixtrans-70.9131.1177.4-73.2-39.7000112.1
658C22.7Very low24.2Very low127 Ų127149 Ų14986%0.85884%0.836SS**PPolyproline II helixtrans-88.1121.4173.6-670000111.2
659S24.1Very low24.1Very low120 Ų120148 Ų14884%0.83984%0.838SS**PPolyproline II helixtrans-72.3146.6-176.9-600000114.1A661S659-A661 PolarHBondContact O-N 3.43Å
660N24.2Very low24.1Very low168 Ų168145.2 Ų145.290%0.89883%0.832SS**PPolyproline II helixtrans-59.3127.3-176.5-66-48.5000114
661A24.9Very low23.9Very low100 Ų100145.3 Ų145.383%0.82683%0.832SS**PPolyproline II helixtrans-79.3140170.500000111.3S659S659-A661 PolarHBondContact O-N 3.43Å
662K24.9Very low23.8Very low211 Ų211147.7 Ų147.792%0.91784%0.837SS**PPolyproline II helixtrans-79.3132.9-179.5-82.4-173.7172-176.60112.6
663T24Very low23.9Very low130 Ų130144.6 Ų144.680%0.79884%0.835SS**PPolyproline II helixtrans-61.8143.4169.1-230000111.5
664L24.5Very low23.7Very low168 Ų168147.5 Ų147.588%0.8884%0.844SS**  trans-139.4131.4166.3-138165000108.9
665N23.7Very low23.8Very low131 Ų131146.8 Ų146.870%0.70184%0.838SS**  trans-89.3142.3-165.7-61.9-33.6000113.1
666S23.6Very low23.8Very low114 Ų114143.9 Ų143.980%0.79784%0.836SS**  trans-145.599.4154.748.80000112.3
667S23.4Very low23.9Very low111 Ų111146.7 Ų146.778%0.77684%0.84SS**  trans17.2112.6154.456.80000119.4
668S22.6Very low24.1Very low114 Ų114148.2 Ų148.280%0.79784%0.839SS**  trans-47.3143.3156.553.30000114.7
669I24.1Very low24Very low174 Ų174150.4 Ų150.489%0.89284%0.838SS**  trans-112.7141.5147.4-66.2-179.2000107.9
670S23.9Very low24Very low111 Ų111151 Ų15178%0.77684%0.837SS**PPolyproline II helixtrans-87.3151.2-156.5410000115.2S672S670-S672 PolarHBondContact O-N 2.88Å
671K22.6Very low24Very low215 Ų215148.4 Ų148.494%0.93583%0.827SS**PPolyproline II helixtrans-62.6119174.8-61.8168.8-179172.80110.3
672S25.4Very low23.9Very low121 Ų121155.1 Ų155.185%0.84683%0.831SS**PPolyproline II helixtrans-85.5146.5160.752.70000110S670S670-S672 PolarHBondContact O-N 2.88Å
673S24.9Very low23.9Very low110 Ų110150.2 Ų150.277%0.76982%0.823SS**PPolyproline II helixtrans-88.6154.4-16447.60000114.7K675S673-K675 PolarHBondContact O-N 2.99Å
674E21.6Very low24Very low202 Ų202155.7 Ų155.794%0.94483%0.829SS**PPolyproline II helixtrans-57.6118.8175.6-64.2171.1108.300111.2
675K25.1Very low24.2Very low182 Ų182155.5 Ų155.579%0.79183%0.828SS**  trans-107.9125.7162.5-85.5-177.7174.7174.60109.5S673 H677S673-K675 PolarHBondContact O-N 2.99Å; K675-H677 PolarHBondContact O-N 3.39Å; K675-H677 VanDerWaalsContact O-N 3.12Å
676S23.4Very low24.1Very low122 Ų122158.1 Ų158.185%0.85383%0.833SS**  trans-58.5111.9179.946.50000111.5K678S676-K678 PolarHBondContact O-N 3.21Å
677H26.9Very low24.3Very low190 Ų190159.3 Ų159.388%0.8884%0.836SS**  trans-68.4105.5176.6-83.8-85.6000110.6K675 M679K675-H677 PolarHBondContact O-N 3.39Å; K675-H677 VanDerWaalsContact O-N 3.12Å; H677-M679 PolarHBondContact O-N 2.81Å
678K24.8Very low24.4Very low192 Ų192160.1 Ų160.184%0.83583%0.832SS**  trans-57.4135.7168.2-86.1-175.8173.5179.10110.1S676 V680S676-K678 PolarHBondContact O-N 3.21Å; K678-V680 PolarHBondContact O-N 2.91Å; K678-V680 VanDerWaalsContact O-N 3.09Å
679M21.3Very low24.3Very low173 Ų173160.6 Ų160.685%0.85284%0.835SS**  trans-60.4107.3179.2-174.5176.2-178.800110.9H677 T681H677-M679 PolarHBondContact O-N 2.81Å; M679-T681 PolarHBondContact O-N 2.95Å
680V24.7Very low24.4Very low133 Ų133161.2 Ų161.281%0.80683%0.834SS**  trans-76.191.5-178.1-178.10000110.2K678 R682K678-V680 PolarHBondContact O-N 2.91Å; K678-V680 VanDerWaalsContact O-N 3.09Å; V680-R682 PolarHBondContact O-N 2.85Å
681T23.6Very low24.3Very low112 Ų112162.1 Ų162.169%0.68783%0.834SS**  trans-67.4100.3170.545.80000110.3M679 S683M679-T681 PolarHBondContact O-N 2.95Å; T681-S683 PolarHBondContact O-N 2.91Å
682R22.5Very low24.4Very low241 Ų241159 Ų15991%0.90983%0.826SS**  trans-6493.5167.5-98.6-176.3166.5177.2-4.1109.9V680 R684V680-R682 PolarHBondContact O-N 2.85Å; R682-R684 PolarHBondContact O-N 3.15Å
683S25.3Very low24.2Very low109 Ų109160.5 Ų160.576%0.76283%0.825SS**  trans-63.3102.2168.138.40000109.7T681 L685T681-S683 PolarHBondContact O-N 2.91Å; S683-L685 PolarHBondContact O-N 2.97Å
684R26Very low24.2Very low244 Ų244160.5 Ų160.592%0.92183%0.825SS**  trans-64.8116.9163.6-90.1-173.7165.7-173.7-5.4107.8R682 K686R682-R684 PolarHBondContact O-N 3.15Å; R684-K686 PolarHBondContact O-N 3.28Å
685L27.7Very low24.2Very low164 Ų164156.4 Ų156.486%0.85982%0.819SS**  trans-52.5133.2178.3-81.4152.1000110.8S683 T687S683-L685 PolarHBondContact O-N 2.97Å; L685-T687 PolarHBondContact O-N 3.29Å; L685-T687 VanDerWaalsContact O-N 3.1Å
686K23.5Very low24.2Very low187 Ų187155 Ų15581%0.81382%0.819SS**  trans-68.2100.9166.4-85.7-178170.6-178.90108.5R684 N688R684-K686 PolarHBondContact O-N 3.28Å; K686-N688 VanDerWaalsContact C-N 3.3Å; K686-N688 PolarHBondContact O-N 3.4Å; K686-N688 VanDerWaalsContact O-N 3.1Å
687T26.2Very low24.2Very low138 Ų138155.8 Ų155.885%0.84781%0.814SS**  trans-73.491.5154.839.60000107.7L685L685-T687 PolarHBondContact O-N 3.29Å; L685-T687 VanDerWaalsContact O-N 3.1Å
688N25.3Very low24Very low129 Ų129153.7 Ų153.769%0.6982%0.815SS**  trans-59.9142.3171.2-77.3-10.5000109.4K686 Q690K686-N688 VanDerWaalsContact C-N 3.3Å; K686-N688 PolarHBondContact O-N 3.4Å; K686-N688 VanDerWaalsContact O-N 3.1Å; N688-Q690 PolarHBondContact O-N 2.93Å
689S21Very low24Very low124 Ų124149 Ų14987%0.86781%0.806SS**  trans-69.3117.5169.750.50000110.3
690Q25.9Very low24.1Very low187 Ų187145.8 Ų145.887%0.87480%0.8SS**  trans-142.2128.1160.2-141.8164.3300108.8N688N688-Q690 PolarHBondContact O-N 2.93Å
691V22Very low24.1Very low129 Ų129148.7 Ų148.778%0.78280%0.803SS**  trans-81.3122.3-176.5176.10000108.8
692I25.6Very low24.2Very low149 Ų149151.8 Ų151.876%0.76481%0.809SS**  trans-138.6121157.8-59.6-177.3000106.5S694I692-S694 PolarHBondContact O-N 3.44Å
693D21.6Very low24.2Very low154 Ų154145.9 Ų145.982%0.82480%0.804SS**  trans-73.4119.9171.8-69.8-68.1000110.4
694S24.2Very low24Very low109 Ų109147 Ų14776%0.76280%0.802SS**  trans-149.190.7164.553.80000110.9I692 L696I692-S694 PolarHBondContact O-N 3.44Å; S694-L696 PolarHBondContact O-N 3.49Å
695S22.1Very low24.1Very low116 Ų116142.6 Ų142.681%0.81180%0.796SS**  trans-69.3122171.454.70000111
696L24Very low23.9Very low153 Ų153141.4 Ų141.480%0.80179%0.791SS**  trans-158.1128.5143.9-136.669.8000113.6S694S694-L696 PolarHBondContact O-N 3.49Å
697N24.4Very low23.9Very low139 Ų139141.4 Ų141.474%0.74379%0.791SS**  trans46.291.1152.4-60.5-4.2000119.2S699N697-S699 PolarHBondContact O-N 3Å
698T22.8Very low23.9Very low146 Ų146140.1 Ų140.190%0.89679%0.785SS**  trans-61.6106.115047.70000110.8
699S23.5Very low23.9Very low94 Ų94141.1 Ų141.166%0.65779%0.789SS**  trans-86.6117.1166.947.10000110.6N697 F701N697-S699 PolarHBondContact O-N 3Å; S699-F701 PolarHBondContact O-N 2.71Å; S699-F701 VanDerWaalsContact O-N 3.13Å
700S23.6Very low24.1Very low105 Ų105142.7 Ų142.773%0.73479%0.788SS**  trans-80.589.6-176.555.20000112.2H702S700-H702 PolarHBondContact O-N 3.12Å
701F24.6Very low24.1Very low194 Ų194141.4 Ų141.485%0.85179%0.786SS**  trans-82.687.1165.3-82.4-82.1000110.5S699 S703S699-F701 PolarHBondContact O-N 2.71Å; S699-F701 VanDerWaalsContact O-N 3.13Å; F701-S703 PolarHBondContact O-N 3.43Å
702H26.5Very low24.1Very low176 Ų176140.9 Ų140.982%0.81579%0.787SS**  trans-68.1109162.8-87.1-85.3000109.1S700 N704S700-H702 PolarHBondContact O-N 3.12Å; H702-N704 PolarHBondContact O-N 2.9Å
703S22.8Very low24Very low117 Ų117142.7 Ų142.782%0.81879%0.792SS**  trans-73.5109.617250.60000110.2F701F701-S703 PolarHBondContact O-N 3.43Å
704N21.2Very low24.1Very low133 Ų133145 Ų14571%0.71180%0.795SS**  trans-15032.2174.9-147.229.7000114H702 N706H702-N704 PolarHBondContact O-N 2.9Å; N704-N706 PolarHBondContact O-N 2.94Å; N704-N706 VanDerWaalsContact O-N 3.17Å
705D26.8Very low24.2Very low151 Ų151145.5 Ų145.581%0.80780%0.798SS**  trans-80.990.8174-71.8-50.3000110.8F707D705-F707 PolarHBondContact O-N 2.92Å
706N23.8Very low24.4Very low140 Ų140145 Ų14575%0.74980%0.795SS**  trans-63.7116.6166.5-72.1-59.9000109.5N704 P708N704-N706 PolarHBondContact O-N 2.94Å; N704-N706 VanDerWaalsContact O-N 3.17Å; N706-P708 WeakPolarHBondContact O-CD 3.5Å
707F24.7Very low24.4Very low186 Ų186144.8 Ų144.882%0.81680%0.795SS**  trans-87106.9169.4-93-95000110.3D705 I709D705-F707 PolarHBondContact O-N 2.92Å; F707-I709 PolarHBondContact O-N 3Å
708P25.6Very low24.5Very low111 Ų111143.4 Ų143.472%0.72180%0.796SS**  trans-74.7107.517430.7-33.8000109.8N706 N710N706-P708 WeakPolarHBondContact O-CD 3.5Å; P708-N710 PolarHBondContact O-N 2.99Å
709I26.2Very low24.6Very low150 Ų150146.7 Ų146.777%0.76980%0.798SS**  trans-76104.3171.2-62.7178.4000108.1F707 L711F707-I709 PolarHBondContact O-N 3Å; I709-L711 PolarHBondContact O-N 3.25Å
710N23.2Very low24.8Very low157 Ų157147.1 Ų147.184%0.8481%0.807SS**  trans-61.496.1175.3-82.6-36.2000111.3P708P708-N710 PolarHBondContact O-N 2.99Å
711L26.4Very low24.9Very low161 Ų161151.7 Ų151.784%0.84381%0.814SS**  trans-87.3110162.3-89.7161.8000108.7I709 E713I709-L711 PolarHBondContact O-N 3.25Å; L711-E713 PolarHBondContact O-N 2.99Å
712C23Very low24.8Very low117 Ų117150.4 Ų150.479%0.79182%0.815SS**  trans-68.2124.1-169.2-171.70000112.5K714C712-K714 PolarHBondContact O-N 3.45Å
713E23.1Very low24.7Very low188 Ų188148.1 Ų148.188%0.87981%0.813SS**  trans-68116179.5-65-178.8115.400112.3L711L711-E713 PolarHBondContact O-N 2.99Å
714K24Very low24.9Very low201 Ų201150.3 Ų150.387%0.87482%0.815SS**  trans-146.574.1162.1-76.6-160.9175.8-177.70112.4C712C712-K714 PolarHBondContact O-N 3.45Å
715S27Very low25Very low120 Ų120152.5 Ų152.584%0.83982%0.821SS**  trans-150.3118.1163.356.70000110.3
716S24.8Very low24.8Very low107 Ų107154.2 Ų154.275%0.74883%0.825SS**  trans-87.2124.9-173.249.90000113.7
717D25.3Very low24.9Very low148 Ų148153.7 Ų153.779%0.79183%0.826SS**  trans74.6145142.9-66.1-58.7000123.7
718S26Very low24.8Very low110 Ų110150.3 Ų150.377%0.76983%0.826SS**  trans57.689170.853.60000117
719K24Very low24.8Very low214 Ų214155.8 Ų155.893%0.9383%0.834SS**  62.59571.9-70.2-170.2170.3179.30116.5
720A28.2Very low24.8Very low104 Ų104156.4 Ų156.486%0.8684%0.838SS**  trans-155.250.2147.800000111.2L722A720-L722 PolarHBondContact O-N 3.03Å
721K25.1Very low24.8Very low201 Ų201157.9 Ų157.987%0.87484%0.84SS**  trans-84.4107.8179.5-171.2176.3-178.6-178.10110.2T723K721-T723 PolarHBondContact O-N 3.49Å
722L23.7Very low24.8Very low166 Ų166156.1 Ų156.187%0.86984%0.836SS**  trans-58.4130.4170.8-82.7155000110.6A720 L724A720-L722 PolarHBondContact O-N 3.03Å; L722-L724 PolarHBondContact O-N 2.89Å
723T23.3Very low24.8Very low128 Ų128155.5 Ų155.579%0.78583%0.833SS**  trans-83.1106.717143.40000109.4K721K721-T723 PolarHBondContact O-N 3.49Å
724L26.5Very low24.8Very low164 Ų164153 Ų15386%0.85983%0.83SS**  trans-81.9121.7163.1-17368.8000107.6L722 E726L722-L724 PolarHBondContact O-N 2.89Å; L724-E726 PolarHBondContact O-N 3.17Å
725E23.5Very low25Very low179 Ų179152.3 Ų152.384%0.83683%0.828SS**  trans-76.1107.6178.9-68.9-174.9119.800110.4T727E725-T727 PolarHBondContact O-N 3.45Å; E725-T727 VanDerWaalsContact O-N 3.16Å
726E24Very low25.1Very low187 Ų187152.4 Ų152.487%0.87483%0.825SS**  trans-70.8104.4167.2-69.5-175.2121.400109.3L724 S728L724-E726 PolarHBondContact O-N 3.17Å; E726-S728 PolarHBondContact O-N 2.97Å; E726-S728 VanDerWaalsContact O-N 3.14Å
727T24.3Very low25.1Very low128 Ų128154.6 Ų154.679%0.78583%0.828SS**  trans-59.9115.4173.751.10000110E725E725-T727 PolarHBondContact O-N 3.45Å; E725-T727 VanDerWaalsContact O-N 3.16Å
728S24.6Very low25.1Very low116 Ų116154 Ų15481%0.81183%0.829SS**  trans-67.5138.5-170.8460000113.3E726E726-S728 PolarHBondContact O-N 2.97Å; E726-S728 VanDerWaalsContact O-N 3.14Å
729Y25Very low25.1Very low225 Ų225156.6 Ų156.688%0.88283%0.829SS**  trans-68.7130.3177.6-77.8-98.4000111.1E731Y729-E731 PolarHBondContact O-N 3.33Å
730L25.1Very low25.1Very low163 Ų163155.1 Ų155.185%0.85383%0.826SS**  trans-76.7109.2-177.1-165.977000111.3T732L730-T732 PolarHBondContact O-N 3.34Å
731E23.7Very low25Very low188 Ų188158 Ų15888%0.87983%0.825SS**  trans-66.4100.1177.6-72.9-167.4109.600112.7Y729 S733Y729-E731 PolarHBondContact O-N 3.33Å; E731-S733 PolarHBondContact O-N 3.33Å
732T25.6Very low25Very low124 Ų124158 Ų15876%0.76183%0.825SS**  trans-74.790.6168.7530000110.8L730 T734L730-T732 PolarHBondContact O-N 3.34Å; T732-T734 PolarHBondContact O-N 2.92Å; T732-T734 VanDerWaalsContact O-N 3.14Å
733S24.3Very low25.1Very low105 Ų105159.9 Ų159.973%0.73483%0.826SS**  trans-60.6109.6-176.6-167.30000113.6E731E731-S733 PolarHBondContact O-N 3.33Å
734T23.3Very low25.2Very low134 Ų134161.2 Ų161.282%0.82283%0.827SS**  trans-91.7102.2173.352.50000111.6T732T732-T734 PolarHBondContact O-N 2.92Å; T732-T734 VanDerWaalsContact O-N 3.14Å
735K27.1Very low25.1Very low188 Ų188162.1 Ų162.182%0.81783%0.827SS**  trans-96.5136.3164.2-74.5-178.1177.5175.60110.5L737K735-L737 PolarHBondContact O-N 2.92Å
736P29.6Very low25.1Very low122 Ų122161.4 Ų161.479%0.79283%0.829SS**  trans-81.3120.1-169.530.8-34.6000112.6
737L25.6Very low25.3Very low153 Ų153161.9 Ų161.980%0.80183%0.828SS**  trans-93.3107.7170.9-163.281.2000110.6K735 Q739K735-L737 PolarHBondContact O-N 2.92Å; L737-Q739 PolarHBondContact O-N 3.33Å
738V24.7Very low25.2Very low134 Ų134167.6 Ų167.681%0.81284%0.835SS**  trans-85.2101177179.20000110
739Q25.7Very low25.3Very low166 Ų166167.3 Ų167.378%0.77683%0.834SS**  trans-135.498.1167-90.5-172.6-4.400113.7L737L737-Q739 PolarHBondContact O-N 3.33Å
740Q24.7Very low25.2Very low183 Ų183165.7 Ų165.786%0.85583%0.831SS**  trans18100.5147-63.6178.7-6.800119K742Q740-K742 PolarHBondContact O-N 2.98Å
741I24.6Very low25.2Very low165 Ų165163.9 Ų163.985%0.84683%0.827SS**  trans1.5104.1141.1-49.4172.7000115.2
742K25.3Very low25.2Very low200 Ų200161.5 Ų161.587%0.8782%0.82SS**  trans-109.8155.1147.7-85.4-178174.7176.40109.5Q740Q740-K742 PolarHBondContact O-N 2.98Å
743K26.2Very low25.1Very low205 Ų205161.1 Ų161.189%0.89182%0.818SS**  trans-62.6149.9-158.8-70.6179.1176.2177.50113.9
744L25.9Very low25Very low156 Ų156162.1 Ų162.182%0.81782%0.819SS**  trans-58.3132.6174.8-82.761.4000111.8
745E23.6Very low25.1Very low184 Ų184162.1 Ų162.186%0.8681%0.814SS**  trans-112.8145.6146.2-77.3-164.3133.500109.7K747E745-K747 PolarHBondContact O-N 3.46Å
746N25.4Very low25Very low163 Ų163159.4 Ų159.487%0.87281%0.808SS**  trans-78.277.1-167.3-75.1-43.9000113.5
747K26.4Very low24.9Very low197 Ų197159.4 Ų159.486%0.85780%0.801SS**  trans-89.2121.5161.9-75.3-176.5177.6174.90110.3E745 S749E745-K747 PolarHBondContact O-N 3.46Å; K747-S749 PolarHBondContact O-N 3.4Å
748R23.2Very low25Very low248 Ų248158.3 Ų158.394%0.93680%0.796SS**  trans-41.5121.7178-83.5174.4163.9153.8-6.7110.9K750R748-K750 PolarHBondContact O-N 2.99Å
749S26.5Very low25.2Very low111 Ų111158.3 Ų158.378%0.77680%0.796SS**  trans-58.4124.3168.335.40000109.4K747 T751K747-S749 PolarHBondContact O-N 3.4Å; S749-T751 PolarHBondContact O-N 3.08Å
750K23.7Very low25.1Very low191 Ų191155.6 Ų155.683%0.8380%0.796SS**  trans-61.7104.6171.6-77.7-177.3175.5-179.80108.4R748 N752R748-K750 PolarHBondContact O-N 2.99Å; K750-N752 PolarHBondContact O-N 2.87Å; K750-N752 VanDerWaalsContact O-N 3.11Å
751T25Very low25.2Very low125 Ų125151.8 Ų151.877%0.76779%0.789SS**  trans-67.5105.8159.9-9.60000106.6S749 V753S749-T751 PolarHBondContact O-N 3.08Å; T751-V753 VanDerWaalsContact C-N 3.26Å; T751-V753 PolarHBondContact O-N 2.91Å
752N22.8Very low25.3Very low138 Ų138154.6 Ų154.674%0.73879%0.789SS**  trans-67.890.9170.4-76.7-6.7000107.9K750 T754K750-N752 PolarHBondContact O-N 2.87Å; K750-N752 VanDerWaalsContact O-N 3.11Å; N752-T754 PolarHBondContact O-N 2.88Å
753V23.4Very low25.2Very low116 Ų116151 Ų15170%0.70378%0.784SS**  trans-74.581.9170.4-1760000107.3T751 L755T751-V753 VanDerWaalsContact C-N 3.26Å; T751-V753 PolarHBondContact O-N 2.91Å; V753-L755 PolarHBondContact O-N 3.05Å
754T22.8Very low25.1Very low125 Ų125149.2 Ų149.277%0.76778%0.783SS**  trans-54.6125.7159.745.70000107.9N752N752-T754 PolarHBondContact O-N 2.88Å
755L24.9Very low25.1Very low134 Ų134148.2 Ų148.270%0.70278%0.783SS**  trans-69.5135.7-175.3-71.887.2000110.6V753 D757V753-L755 PolarHBondContact O-N 3.05Å; L755-D757 VanDerWaalsContact C-N 3.33Å; L755-D757 VanDerWaalsContact CB-OD2 3.31Å; L755-D757 WeakPolarHBondContact CB-OD2 3.46Å; L755-D757 WeakPolarHBondContact CD2-OD2 3.41Å; L755-D757 PolarHBondContact O-N 3.07Å
756D25.8Very low25Very low132 Ų132145.1 Ų145.171%0.70678%0.781SS**  trans-9466.4174.3-161.5-11.9000108.9N758D756-N758 PolarHBondContact O-N 3.5Å; D756-N758 PolarHBondContact OD1-ND2 3.27Å
757D27Very low25.1Very low121 Ų121142.3 Ų142.365%0.64777%0.771SS**  trans-7949.5-172.4-93.3-51.4000113.2L755 V759L755-D757 VanDerWaalsContact C-N 3.33Å; L755-D757 VanDerWaalsContact CB-OD2 3.31Å; L755-D757 WeakPolarHBondContact CB-OD2 3.46Å; L755-D757 WeakPolarHBondContact CD2-OD2 3.41Å; L755-D757 PolarHBondContact O-N 3.07Å; D757-V759 PolarHBondContact O-N 3.36Å; D757-V759 VanDerWaalsContact O-N 3.17Å
758N28.3Very low25.1Very low130 Ų130137.8 Ų137.870%0.69577%0.765SS**  trans-88.669.3-179.7-83.9-67.3000113.2D756 S760D756-N758 PolarHBondContact O-N 3.5Å; D756-N758 PolarHBondContact OD1-ND2 3.27Å; N758-S760 PolarHBondContact O-N 2.83Å
759V27.7Very low25.4Very low134 Ų134132.1 Ų132.181%0.81276%0.758SS**  trans-85.296.3167.4-179.30000109.4D757 S761D757-V759 PolarHBondContact O-N 3.36Å; D757-V759 VanDerWaalsContact O-N 3.17Å; V759-S761 PolarHBondContact O-N 3.44Å; V759-S761 VanDerWaalsContact O-N 3.09Å
760S24.3Very low25.4Very low109 Ų109134.9 Ų134.976%0.76276%0.763SS**  trans-52.8113.6-172.2-41.10000113.9N758N758-S760 PolarHBondContact O-N 2.83Å
761S26.2Very low25.4Very low103 Ų103130.1 Ų130.172%0.7275%0.754SS**  trans-58.2147.2157.850.30000109.5V759V759-S761 PolarHBondContact O-N 3.44Å; V759-S761 VanDerWaalsContact O-N 3.09Å
762R26.3Very low25.4Very low224 Ų224135.5 Ų135.585%0.84576%0.76SS**  trans-100.496.6-172.7-68.7-175.3-177.7-177.41.7111.3
763V23.9Very low25.4Very low124 Ų124134.2 Ų134.275%0.75276%0.762SS**  trans-65.4141.6162.2-177.10000109.6T765V763-T765 PolarHBondContact O-N 2.62Å; V763-T765 VanDerWaalsContact O-N 3.15Å
764L24.8Very low25.5Very low169 Ų169133.5 Ų133.589%0.88576%0.762SS**  trans-78.293.5-174.6-74.6164.5000112.2C766L764-C766 PolarHBondContact O-N 2.96Å
765T24.6Very low25.6Very low134 Ų134134.6 Ų134.682%0.82276%0.763SS**  trans-77.1104.9172.457.90000111.5V763V763-T765 PolarHBondContact O-N 2.62Å; V763-T765 VanDerWaalsContact O-N 3.15Å
766C23Very low25.5Very low119 Ų119133.7 Ų133.780%0.80477%0.767SS**  trans-66.8150166.9-910000111.8L764L764-C766 PolarHBondContact O-N 2.96Å
767P26.6Very low25.5Very low104 Ų104132.8 Ų132.868%0.67577%0.768SS**  trans-67.8142.2-178.4-20.233.7000113.6T769P767-T769 PolarHBondContact O-N 3.24Å
768S27.4Very low25.4Very low102 Ų102130.8 Ų130.871%0.71377%0.768SS**THydrogen-bonded Turntrans-7726.5-173.966.10000115.5S771S768-S771 PolarHBondContact O-OG 3.17Å
769T29Very low25.3Very low130 Ų130131.8 Ų131.880%0.79877%0.773SS**THydrogen-bonded Turntrans-87.5-15.1-18042.50000113.5P767P767-T769 PolarHBondContact O-N 3.24Å
770L25.8Very low25.1Very low169 Ų169130.8 Ų130.889%0.88577%0.772SS**SBendtrans-101.6-2177.2-79.4159.3000113.9R772L770-R772 PolarHBondContact O-N 2.93Å
771S24Very low25.2Very low90 Ų90133.3 Ų133.363%0.62978%0.776SS**  trans-91.764.2-177.162.90000113.1S768S768-S771 PolarHBondContact O-OG 3.17Å
772R24.2Very low25Very low239 Ų239133.7 Ų133.790%0.90278%0.778SS**  trans-138.5107.7160.9-81.3-162.4169-157.5-4.9110.9L770 S774L770-R772 PolarHBondContact O-N 2.93Å; R772-S774 PolarHBondContact O-N 3.4Å
773S23.9Very low25Very low110 Ų110127.4 Ų127.477%0.76977%0.774SS**  trans-70.9118.6178.738.90000112.3
774S24.9Very low25.1Very low102 Ų102126.7 Ų126.771%0.71378%0.775SS**  trans-100.1109149.755.90000107.6R772 C776R772-S774 PolarHBondContact O-N 3.4Å; S774-C776 PolarHBondContact O-N 3Å
775N24.9Very low25.2Very low148 Ų148126 Ų12679%0.79177%0.771SS**  trans-67.4100.1-176.3-67-1.9000110.7P777N775-P777 WeakPolarHBondContact O-CD 3.47Å
776C22.7Very low25.4Very low115 Ų115129.4 Ų129.478%0.77778%0.775SS**PPolyproline II helixtrans-75.1117.9163.4-67.70000108.4S774S774-C776 PolarHBondContact O-N 3Å
777P26.4Very low25.8Very low113 Ų113126.5 Ų126.573%0.73476%0.756SS**PPolyproline II helixtrans-69.5147.4177.529.4-34.2000110.8N775 L779N775-P777 WeakPolarHBondContact O-CD 3.47Å; P777-L779 PolarHBondContact O-N 2.95Å
778A25.5Very low26.1Very low78 Ų78127.4 Ų127.465%0.64576%0.755SS**PPolyproline II helixtrans-62.1126.2-176.700000111.9S780A778-S780 PolarHBondContact O-N 2.93Å
779L25.4Very low26.6Very low151 Ų151128.6 Ų128.679%0.79176%0.757SS**  trans-83.897.7176.6-74.8165.7000109.9P777 L781P777-L779 PolarHBondContact O-N 2.95Å; L779-L781 HydrophobicContact CB-CD1 4.48Å; L779-L781 HydrophobicContact CB-CG 4.38Å; L779-L781 PolarHBondContact O-N 2.78Å
780S23.8Very low27.1Very low114 Ų114129 Ų12980%0.79775%0.751SS**  trans-70.976.3171.838.30000111.4A778 S782A778-S780 PolarHBondContact O-N 2.93Å; S780-S782 PolarHBondContact O-N 2.92Å
781L26.2Very low27.6Very low161 Ų161126.1 Ų126.184%0.84374%0.735SS**  trans-6989-179.1-79.2158.2000111.8L779L779-L781 HydrophobicContact CB-CD1 4.48Å; L779-L781 HydrophobicContact CB-CG 4.38Å; L779-L781 PolarHBondContact O-N 2.78Å
782S22.2Very low28.3Very low111 Ų111129.2 Ų129.278%0.77674%0.738SS**  trans-109.8152.917157.90000111.2S780S780-S782 PolarHBondContact O-N 2.92Å
783A26Very low29.3Very low92 Ų92120.1 Ų120.176%0.7671%0.711SS**SBendtrans82.383.8177.200000118.9
784S26.8Very low30.2Very low109 Ų109119.7 Ų119.776%0.76270%0.699SS**  trans57.583139.264.60000120.1
785L27.1Very low30.9Very low155 Ų155117.7 Ų117.781%0.81268%0.68SS**  trans-90.2100.8157.3-102160.7000110.6S787L785-S787 PolarHBondContact O-N 2.81Å
786K28.3Very low32.1Very low206 Ų206113.8 Ų113.890%0.89667%0.665SS**  trans-82.586170.8-83.3-174.8173.7176.70110.8
787S31.2Very low33.4Very low57 Ų57114.7 Ų114.740%0.39966%0.662SS.*  trans-146.8-4173.549.80000116.9L785 V789 Q790L785-S787 PolarHBondContact O-N 2.81Å; S787-V789 PolarHBondContact O-N 3.3Å; S787-Q790 PolarHBondContact O-N 3.43Å; S787-Q790 VanDerWaalsContact O-N 3.08Å
788D32.2Very low34.2Very low124 Ų124117.1 Ų117.166%0.66366%0.661SS**THydrogen-bonded Turntrans-58.5-14.9-175.1-68-21.6000116.1Q790 L791D788-Q790 PolarHBondContact O-N 2.85Å; D788-L791 PolarHBondContact O-N 3.19Å
789V38.5Very low35Very low126 Ų126119 Ų11976%0.76465%0.652SS**Hα-helixtrans-57.9-37.7173.5-178.20000111.2S787 L791 F792 S793S787-V789 PolarHBondContact O-N 3.3Å; V789-L791 PolarHBondContact O-N 2.91Å; V789-F792 PolarHBondContact O-N 3.11Å; V789-S793 PolarHBondContact O-N 3.4Å; V789-S793 VanDerWaalsContact O-N 3.13Å; V789-S793 PolarHBondContact O-OG 3.43Å
790Q38.6Very low36.3Very low140 Ų140114.7 Ų114.765%0.65463%0.634SS**Hα-helixtrans-67.1-34.7-177.1-76.4-173.1-26.300113.3S787 D788 S793 L794S787-Q790 PolarHBondContact O-N 3.43Å; S787-Q790 VanDerWaalsContact O-N 3.08Å; D788-Q790 PolarHBondContact O-N 2.85Å; Q790-S793 WeakPolarHBondContact CA-OG 3.41Å; Q790-S793 PolarHBondContact O-OG 2.76Å; Q790-L794 WeakPolarHBondContact O-CB 3.38Å; Q790-L794 WeakPolarHBondContact O-CG 3.5Å; Q790-L794 PolarHBondContact O-N 3.22Å
791L36.1Very low37.4Very low108 Ų108113.3 Ų113.357%0.56563%0.625SS**Hα-helixtrans-70.4-39.3179.3-173.265.4000111.3D788 V789 L794 L795D788-L791 PolarHBondContact O-N 3.19Å; V789-L791 PolarHBondContact O-N 2.91Å; L791-L794 PolarHBondContact O-N 3.46Å; L791-L795 HydrophobicContact CG-CD1 4.26Å; L791-L795 WeakPolarHBondContact O-CB 3.45Å; L791-L795 WeakPolarHBondContact O-CG 3.44Å; L791-L795 PolarHBondContact O-N 2.97Å
792F38.9Very low38.6Very low154 Ų154110.7 Ų110.768%0.67561%0.612SS**Hα-helixtrans-68.2-36.9176.2-92.6-79.7000112.8V789 L795 S796V789-F792 PolarHBondContact O-N 3.11Å; F792-L795 PolarHBondContact O-N 3.2Å; F792-S796 PolarHBondContact O-N 2.9Å; F792-S796 PolarHBondContact O-OG 3.43Å
793S45.1Very low39.8Very low48 Ų48109.2 Ų109.234%0.33659%0.594SS.*Hα-helixtrans-65.9-43.3170.949.70000112.3V789 Q790 L795 S796 D797V789-S793 PolarHBondContact O-N 3.4Å; V789-S793 VanDerWaalsContact O-N 3.13Å; V789-S793 PolarHBondContact O-OG 3.43Å; Q790-S793 WeakPolarHBondContact CA-OG 3.41Å; Q790-S793 PolarHBondContact O-OG 2.76Å; S793-L795 PolarHBondContact O-N 2.97Å; S793-S796 WeakPolarHBondContact CA-OG 3.49Å; S793-S796 PolarHBondContact O-N 3.27Å; S793-S796 PolarHBondContact O-OG 3.34Å; S793-D797 WeakPolarHBondContact O-CB 3.42Å; S793-D797 PolarHBondContact O-N 2.97Å
794L44.2Very low40.8Very low102 Ų102107 Ų10753%0.53457%0.569SS.*Hα-helixtrans-60.8-28.1175.7-83.6164.1000113.5Q790 L791Q790-L794 WeakPolarHBondContact O-CB 3.38Å; Q790-L794 WeakPolarHBondContact O-CG 3.5Å; Q790-L794 PolarHBondContact O-N 3.22Å; L791-L794 PolarHBondContact O-N 3.46Å
795L39Very low41.8Very low60 Ų60110 Ų11031%0.31456%0.564SS.*Hα-helixtrans-81.1-41.2174.2-73.6169.5000112.2L791 F792 S793 D797 K798 Y799 L804L791-L795 HydrophobicContact CG-CD1 4.26Å; L791-L795 WeakPolarHBondContact O-CB 3.45Å; L791-L795 WeakPolarHBondContact O-CG 3.44Å; L791-L795 PolarHBondContact O-N 2.97Å; F792-L795 PolarHBondContact O-N 3.2Å; S793-L795 PolarHBondContact O-N 2.97Å; L795-D797 VanDerWaalsContact C-N 3.32Å; L795-D797 PolarHBondContact O-N 2.94Å; L795-K798 PolarHBondContact O-N 2.73Å; L795-Y799 HydrophobicContact CD2-CD2 4.05Å; L795-Y799 HydrophobicContact CD2-CE2 4.07Å; L795-Y799 PolarHBondContact O-N 3.06Å; L795-L804 HydrophobicContact CB-CD2 4.19Å
796S49.5Very low42.8Very low66 Ų66110.2 Ų110.246%0.46255%0.554SS.*Hα-helixtrans-68.7-29.2176.260.50000113.7F792 S793 K798F792-S796 PolarHBondContact O-N 2.9Å; F792-S796 PolarHBondContact O-OG 3.43Å; S793-S796 WeakPolarHBondContact CA-OG 3.49Å; S793-S796 PolarHBondContact O-N 3.27Å; S793-S796 PolarHBondContact O-OG 3.34Å; S796-K798 VanDerWaalsContact C-N 3.29Å
797D50.1Low43.4Very low133 Ų133103.2 Ų103.271%0.71153%0.531SS*.THydrogen-bonded Turntrans-75.8-19178.5-68.3-5.4000112.5S793 L795S793-D797 WeakPolarHBondContact O-CB 3.42Å; S793-D797 PolarHBondContact O-N 2.97Å; L795-D797 VanDerWaalsContact C-N 3.32Å; L795-D797 PolarHBondContact O-N 2.94Å
798K44Very low44.2Very low164 Ų164106 Ų10671%0.71354%0.541SS*.THydrogen-bonded Turntrans-110.6-21.9-179.2-72.7-164.5173.1-171.70115.3L795 S796L795-K798 PolarHBondContact O-N 2.73Å; S796-K798 VanDerWaalsContact C-N 3.29Å
799Y41.7Very low44.8Very low118 Ų118108.1 Ų108.146%0.46354%0.54SS..SBendtrans-131.1133.9-177.5-58.5-75.2000110L795 I803L795-Y799 HydrophobicContact CD2-CD2 4.05Å; L795-Y799 HydrophobicContact CD2-CE2 4.07Å; L795-Y799 PolarHBondContact O-N 3.06Å; Y799-I803 HydrophobicContact CD1-CD1 4.47Å; Y799-I803 HydrophobicContact CD1-CG2 4.13Å; Y799-I803 HydrophobicContact CG-CG2 4.4Å
800S53Low44.9Very low60 Ų60106 Ų10642%0.4252%0.524SS..  trans-59.7154.3177.569.70000111D802 I803 L804S800-D802 PolarHBondContact O-N 3.37Å; S800-I803 PolarHBondContact O-N 3.36Å; S800-I803 WeakPolarHBondContact OG-CG1 3.43Å; S800-I803 PolarHBondContact OG-N 3.49Å; S800-L804 PolarHBondContact O-N 3.32Å; S800-L804 VanDerWaalsContact O-N 3.12Å
801S47.2Very low44.9Very low86 Ų86103.9 Ų103.960%0.60152%0.524SS*.Hα-helixtrans-51.1-31.2174.747.70000112.7R805S801-R805 WeakPolarHBondContact O-CB 3.46Å; S801-R805 PolarHBondContact O-N 2.97Å
802D51Low44.6Very low106 Ų106100.7 Ų100.757%0.56751%0.511SS*.Hα-helixtrans-77.1-34.1-179.3-54.2-49.5000112.7S800 W806S800-D802 PolarHBondContact O-N 3.37Å; D802-W806 VanDerWaalsContact O-CB 3.22Å; D802-W806 WeakPolarHBondContact O-CB 3.35Å; D802-W806 PolarHBondContact O-N 3.08Å
803I46.4Very low44.5Very low79 Ų7999.2 Ų99.241%0.40552%0.52SS..Hα-helixtrans-65.8-46.3171.4-67.2169000109.8Y799 S800 R805 W806 C807Y799-I803 HydrophobicContact CD1-CD1 4.47Å; Y799-I803 HydrophobicContact CD1-CG2 4.13Å; Y799-I803 HydrophobicContact CG-CG2 4.4Å; S800-I803 PolarHBondContact O-N 3.36Å; S800-I803 WeakPolarHBondContact OG-CG1 3.43Å; S800-I803 PolarHBondContact OG-N 3.49Å; I803-R805 VanDerWaalsContact C-N 3.34Å; I803-R805 PolarHBondContact O-N 2.81Å; I803-W806 WeakPolarHBondContact O-CB 3.34Å; I803-W806 PolarHBondContact O-N 3.4Å; I803-W806 VanDerWaalsContact O-N 3.15Å; I803-C807 PolarHBondContact O-N 3.13Å; I803-C807 PolarHBondContact O-SG 3.29Å; I803-C807 VanDerWaalsContact O-SG 3.38Å
804L48.3Very low44.3Very low46 Ų4699.9 Ų99.924%0.24152%0.524CS..Hα-helixtrans-62-42.7177.4-63.4176.1000111.3L795 S800 W806 C807 D808L795-L804 HydrophobicContact CB-CD2 4.19Å; S800-L804 PolarHBondContact O-N 3.32Å; S800-L804 VanDerWaalsContact O-N 3.12Å; L804-W806 VanDerWaalsContact C-N 3.28Å; L804-W806 PolarHBondContact O-N 3.21Å; L804-C807 PolarHBondContact O-N 3.28Å; L804-D808 PolarHBondContact O-N 2.92Å
805R47.4Very low43.8Very low171 Ų17199.4 Ų99.465%0.64552%0.518SS*.Hα-helixtrans-67.4-25.7175.6-164.3178.7-156.5168.95.7113.5S801 I803 R809S801-R805 WeakPolarHBondContact O-CB 3.46Å; S801-R805 PolarHBondContact O-N 2.97Å; I803-R805 VanDerWaalsContact C-N 3.34Å; I803-R805 PolarHBondContact O-N 2.81Å; R805-R809 WeakPolarHBondContact O-CG 3.38Å; R805-R809 PolarHBondContact O-N 2.92Å; R805-R809 VanDerWaalsContact O-N 3.12Å
806W47.1Very low43.6Very low160 Ų160103.5 Ų103.561%0.60654%0.54SS*.Hα-helixtrans-76.1-39.5172.4-178.684.9000111.5D802 I803 L804 R809 L810D802-W806 VanDerWaalsContact O-CB 3.22Å; D802-W806 WeakPolarHBondContact O-CB 3.35Å; D802-W806 PolarHBondContact O-N 3.08Å; I803-W806 WeakPolarHBondContact O-CB 3.34Å; I803-W806 PolarHBondContact O-N 3.4Å; I803-W806 VanDerWaalsContact O-N 3.15Å; L804-W806 VanDerWaalsContact C-N 3.28Å; L804-W806 PolarHBondContact O-N 3.21Å; W806-R809 WeakPolarHBondContact O-CB 3.5Å; W806-R809 PolarHBondContact O-N 3.03Å; W806-L810 HydrophobicContact CD2-CD1 4.08Å; W806-L810 HydrophobicContact CE3-CD1 3.87Å; W806-L810 HydrophobicContact CH2-CD1 3.46Å; W806-L810 VanDerWaalsContact CH2-CD1 3.46Å; W806-L810 HydrophobicContact CZ2-CD1 3.68Å; W806-L810 HydrophobicContact CZ3-CD1 3.56Å; W806-L810 PolarHBondContact O-N 2.91Å
807C42.5Very low43.1Very low60 Ų60107.3 Ų107.341%0.40556%0.555SS.*Hα-helixtrans-63.9-40.8170.6-660000112.6I803 L804 R809 L810 S811I803-C807 PolarHBondContact O-N 3.13Å; I803-C807 PolarHBondContact O-SG 3.29Å; I803-C807 VanDerWaalsContact O-SG 3.38Å; L804-C807 PolarHBondContact O-N 3.28Å; C807-R809 VanDerWaalsContact C-N 3.3Å; C807-R809 PolarHBondContact O-N 3.48Å; C807-L810 PolarHBondContact O-N 3.08Å; C807-S811 PolarHBondContact O-N 2.98Å; C807-S811 PolarHBondContact O-OG 3.41Å
808D48Very low42.2Very low115 Ų115108.3 Ų108.362%0.61556%0.555SS**Hα-helixtrans-61-38.2171.4-83.1-10.9000111.6L804 S811 S812L804-D808 PolarHBondContact O-N 2.92Å; D808-S811 WeakPolarHBondContact CA-OG 3.39Å; D808-S811 PolarHBondContact O-N 3.09Å; D808-S811 PolarHBondContact O-OG 2.93Å; D808-S812 PolarHBondContact O-N 3Å
809R44Very low41.6Very low169 Ų169105.9 Ų105.964%0.63855%0.549SS*.Hα-helixtrans-67.2-43175-85.8177.3159.5179.6-8.7112.9R805 W806 C807 S811 S812R805-R809 WeakPolarHBondContact O-CG 3.38Å; R805-R809 PolarHBondContact O-N 2.92Å; R805-R809 VanDerWaalsContact O-N 3.12Å; W806-R809 WeakPolarHBondContact O-CB 3.5Å; W806-R809 PolarHBondContact O-N 3.03Å; C807-R809 VanDerWaalsContact C-N 3.3Å; C807-R809 PolarHBondContact O-N 3.48Å; R809-S811 VanDerWaalsContact C-N 3.27Å; R809-S811 PolarHBondContact O-N 2.99Å; R809-S812 WeakPolarHBondContact O-CB 3.23Å; R809-S812 PolarHBondContact O-N 2.97Å; R809-S812 VanDerWaalsContact O-N 3.1Å; R809-S812 PolarHBondContact O-OG 2.37Å
810L40.3Very low41Very low82 Ų82104.8 Ų104.843%0.42956%0.556SS.*Hα-helixtrans-63.4-32175.7-89.4169.7000113.2W806 C807 F815W806-L810 HydrophobicContact CD2-CD1 4.08Å; W806-L810 HydrophobicContact CE3-CD1 3.87Å; W806-L810 HydrophobicContact CH2-CD1 3.46Å; W806-L810 VanDerWaalsContact CH2-CD1 3.46Å; W806-L810 HydrophobicContact CZ2-CD1 3.68Å; W806-L810 HydrophobicContact CZ3-CD1 3.56Å; W806-L810 PolarHBondContact O-N 2.91Å; C807-L810 PolarHBondContact O-N 3.08Å; L810-F815 HydrophobicContact CD2-CE1 4.23Å; L810-F815 HydrophobicContact CD2-CE2 4.27Å; L810-F815 HydrophobicContact CD2-CZ 4.1Å
811S39.1Very low39.9Very low95 Ų95111.9 Ų111.966%0.66458%0.579SS**Hα-helixtrans-86.5-5.4174.754.40000113.8C807 D808 R809C807-S811 PolarHBondContact O-N 2.98Å; C807-S811 PolarHBondContact O-OG 3.41Å; D808-S811 WeakPolarHBondContact CA-OG 3.39Å; D808-S811 PolarHBondContact O-N 3.09Å; D808-S811 PolarHBondContact O-OG 2.93Å; R809-S811 VanDerWaalsContact C-N 3.27Å; R809-S811 PolarHBondContact O-N 2.99Å
812S29.8Very low38.9Very low40 Ų40114.3 Ų114.328%0.2858%0.584SS.*SBendtrans-78.8128.3172.280.10000111.2D808 R809 S814 F815D808-S812 PolarHBondContact O-N 3Å; R809-S812 WeakPolarHBondContact O-CB 3.23Å; R809-S812 PolarHBondContact O-N 2.97Å; R809-S812 VanDerWaalsContact O-N 3.1Å; R809-S812 PolarHBondContact O-OG 2.37Å; S812-S814 WeakPolarHBondContact CB-OG 3.42Å; S812-S814 PolarHBondContact O-N 3.01Å; S812-S814 PolarHBondContact OG-OG 3.39Å; S812-F815 PolarHBondContact O-N 2.9Å; S812-F815 VanDerWaalsContact O-N 3.12Å
813S37.2Very low37.6Very low124 Ų124115.3 Ų115.387%0.86760%0.598SS**THydrogen-bonded Turntrans-64.5-8.6-179.350.20000114.4F815S813-F815 VanDerWaalsContact C-N 3.34Å
814S40.6Very low36.7Very low62 Ų62116.9 Ų116.943%0.43462%0.616SS.*THydrogen-bonded Turntrans-70.2-20.9171.727.50000114.7S812 L816 N817S812-S814 WeakPolarHBondContact CB-OG 3.42Å; S812-S814 PolarHBondContact O-N 3.01Å; S812-S814 PolarHBondContact OG-OG 3.39Å; S814-L816 VanDerWaalsContact C-N 3.28Å; S814-L816 PolarHBondContact O-N 3.36Å; S814-L816 VanDerWaalsContact O-N 3.15Å; S814-N817 PolarHBondContact O-N 3.03Å
815F34.7Very low35.6Very low92 Ų92120.1 Ų120.140%0.40464%0.642SS.*G310 helixtrans-55.4-38-170.9-177.6-104.7000114.1L810 S812 S813 N817 E818 I819L810-F815 HydrophobicContact CD2-CE1 4.23Å; L810-F815 HydrophobicContact CD2-CE2 4.27Å; L810-F815 HydrophobicContact CD2-CZ 4.1Å; S812-F815 PolarHBondContact O-N 2.9Å; S812-F815 VanDerWaalsContact O-N 3.12Å; S813-F815 VanDerWaalsContact C-N 3.34Å; F815-N817 PolarHBondContact O-N 3.27Å; F815-E818 PolarHBondContact O-N 3.01Å; F815-I819 HydrophobicContact CE1-CD1 4.13Å; F815-I819 HydrophobicContact CZ-CD1 4.23Å
816L34.6Very low34.5Very low146 Ų146115.3 Ų115.376%0.76465%0.647SS**G310 helixtrans-70.1-12.7-179.5-67.4175.4000114.5S814S814-L816 VanDerWaalsContact C-N 3.28Å; S814-L816 PolarHBondContact O-N 3.36Å; S814-L816 VanDerWaalsContact O-N 3.15Å
817N39.1Very low33.5Very low146 Ų146117 Ų11778%0.78166%0.661SS**G310 helixtrans-96.8-12.8179.7-72.6-11.8000113.8S814 F815S814-N817 PolarHBondContact O-N 3.03Å; F815-N817 PolarHBondContact O-N 3.27Å
818E31.2Very low32.6Very low153 Ų153121.6 Ų121.672%0.71568%0.68SS**SBendtrans-102.62.5-175.7-70.7-164.3151.300114.6F815 P820F815-E818 PolarHBondContact O-N 3.01Å; E818-P820 WeakPolarHBondContact O-CD 3.08Å
819I30.1Very low31.3Very low114 Ų114121.7 Ų121.759%0.58569%0.69SS**SBendtrans-84.7107.2168.9-58.5180000108.4F815F815-I819 HydrophobicContact CE1-CD1 4.13Å; F815-I819 HydrophobicContact CZ-CD1 4.23Å
820P30.5Very low30.2Very low94 Ų94119 Ų11961%0.6170%0.697SS**  trans-78.4139.6-169.6-1331.1000111.7E818 I822E818-P820 WeakPolarHBondContact O-CD 3.08Å; P820-I822 HydrophobicContact CB-CD1 4.34Å; P820-I822 HydrophobicContact CB-CG1 4.26Å; P820-I822 PolarHBondContact O-N 2.88Å
821K29.6Very low29.3Very low209 Ų209122 Ų12291%0.90972%0.718SS**  trans-70.288.2173.7-66.5-178.4179.8-179.40110.7
822I25.7Very low28.6Very low138 Ų138123 Ų12371%0.70873%0.726SS**  trans-101153.7173.8-62.2172000108.3P820P820-I822 HydrophobicContact CB-CD1 4.34Å; P820-I822 HydrophobicContact CB-CG1 4.26Å; P820-I822 PolarHBondContact O-N 2.88Å
823C23.5Very low28.2Very low126 Ų126126.8 Ų126.885%0.85175%0.748SS**  trans70.937.9-178.2-63.10000117.2S825C823-S825 PolarHBondContact O-N 3.12Å
824S27.9Very low27.5Very low112 Ų112128.2 Ų128.278%0.78375%0.745SS**  trans-70.2116.2144.3-60.50000108.8
825S24.1Very low26.8Very low114 Ų114130.8 Ų130.880%0.79776%0.763SS**  trans-61.1140.1169.553.80000109.4C823C823-S825 PolarHBondContact O-N 3.12Å
826G26Very low26.1Very low71 Ų71136.4 Ų136.473%0.73279%0.787SS**  cis9815.648.900000111.9
827Q25.8Very low25.7Very low195 Ų195136 Ų13691%0.91179%0.791SS**  trans-75.5148.7166.5-78.6-168.2-21.100111.9
828I22.7Very low24.8Very low156 Ų156136.3 Ų136.380%0.879%0.788SS**  trans-104.3150.9-164.8-61.8165.1000109.9
829S21Very low24.4Very low118 Ų118137.6 Ų137.683%0.82580%0.799SS**  trans83.8142.1-177.8-35.70000113.6
830S21.7Very low24Very low112 Ų112139.3 Ų139.378%0.78380%0.804SS**  cis-139.9165.27.756.30000112.3S832S830-S832 PolarHBondContact O-N 3.46Å
831T21Very low23.7Very low144 Ų144141.5 Ų141.588%0.88382%0.815SS**  trans-72.4117.8-179.647.10000112.4
832S22.9Very low23.5Very low118 Ų118136.5 Ų136.583%0.82580%0.804SS**  trans-130.8126.5156.362.30000110.3S830S830-S832 PolarHBondContact O-N 3.46Å
833T21.6Very low23.3Very low119 Ų119136.1 Ų136.173%0.7381%0.808SS**  trans-93.8156.6178.648.10000111.4
834N23.4Very low23.3Very low154 Ų154136.1 Ų136.182%0.82480%0.804SS**  trans77.190.6164.9-52.4-31.4000117.8
835S25.2Very low23.1Very low115 Ų115136.1 Ų136.180%0.80480%0.799SS**  -148.4122.211756.90000111
836K20.9Very low23.1Very low210 Ų210137.3 Ų137.391%0.91380%0.802SS**  trans-90.3124.1164.4-77.2-179176.6178.70107.8
837T24.8Very low22.9Very low137 Ų137142.6 Ų142.684%0.8481%0.807SS**  trans-123.8113.5156.931.10000108.8
838H21.3Very low22.8Very low154 Ų154137.7 Ų137.771%0.71380%0.8SS**  trans-89.5117-174.6-156.8-115.3000108.3Q840H838-Q840 PolarHBondContact CE1-OE1 2.9Å; H838-Q840 PolarHBondContact ND1-OE1 3.06Å
839L23.2Very low22.9Very low180 Ų180136 Ų13694%0.94280%0.799SS**  trans-112.1114.7166.1-86.3172.2000108.7
840Q20.2Very low22.9Very low149 Ų149138.8 Ų138.870%0.69680%0.799SS**  trans-128.9116.1-166.3-175.5179.411.500107.9H838H838-Q840 PolarHBondContact CE1-OE1 2.9Å; H838-Q840 PolarHBondContact ND1-OE1 3.06Å
841V24.9Very low23.1Very low140 Ų140139.8 Ų139.885%0.84880%0.801SS**  trans-127.3130.9172.9-178.90000106.7
842P25.5Very low23.4Very low105 Ų105141 Ų14168%0.68280%0.796SS**  trans-91.2158.7-152.734.7-37.6000114.9
843V21.9Very low23.4Very low129 Ų129141.2 Ų141.278%0.78280%0.798SS**  trans-65.6131.1160.1175.80000109.2T845V843-T845 HydrophobicContact CG1-CG2 4.09Å
844V23.7Very low23.6Very low126 Ų126140.4 Ų140.476%0.76480%0.797SS**  trans-126.4108.1160.1179.20000107.7
845T22.3Very low23.7Very low112 Ų112139.1 Ų139.169%0.68780%0.796SS**  trans-75.6136.2173.841.60000110.9V843V843-T845 HydrophobicContact CG1-CG2 4.09Å
846V25.3Very low23.7Very low140 Ų140141 Ų14185%0.84880%0.796SS**  trans-118.3115.7156.5179.10000106.5
847E21.3Very low23.9Very low182 Ų182140 Ų14085%0.8579%0.792SS**  trans-75.8141.5-175.3-60175.4122.400111
848A24.8Very low24Very low91 Ų91140.7 Ų140.775%0.75279%0.79SS**  trans-118.9135.9164.300000108.4
849P23.9Very low24.3Very low122 Ų122143 Ų14379%0.79280%0.798SS**  trans-75.8151.4-155.3-20.134.7000115T851P849-T851 PolarHBondContact O-N 3.33Å
850Q21.3Very low24.4Very low176 Ų176142.9 Ų142.982%0.82279%0.793SS**  trans-57.4127.7169-62.6174-2.100110.4
851T26.7Very low24.7Very low133 Ų133144 Ų14482%0.81680%0.802SS**  trans-119.4129.7161.4420000108.2P849 S853P849-T851 PolarHBondContact O-N 3.33Å; T851-S853 PolarHBondContact O-N 3.29Å
852H27.1Very low24.8Very low170 Ų170143.1 Ų143.179%0.78780%0.801SS**  trans-70118.8-160.7-65.6-81.9000112.7S854H852-S854 PolarHBondContact O-N 3.38Å
853S22.2Very low24.8Very low122 Ų122147 Ų14785%0.85381%0.807SS**  trans-67.2122.7169420000110.4T851T851-S853 PolarHBondContact O-N 3.29Å
854S25.8Very low25Very low102 Ų102148.1 Ų148.171%0.71381%0.808SS**  trans-127.4142.8165.9-75.30000108.1H852H852-S854 PolarHBondContact O-N 3.38Å
855P26.6Very low25.2Very low126 Ų126149 Ų14982%0.81881%0.808SS**  trans-68.8136.8-149.822.4-33.7000114.2K857P855-K857 PolarHBondContact O-N 3.07Å; P855-K857 VanDerWaalsContact O-N 3.12Å
856I24.7Very low25.5Very low155 Ų155149.3 Ų149.380%0.79581%0.806SS**  trans-63.8110.5177.1-62.8169.5000108.8N858I856-N858 PolarHBondContact O-N 3.38Å
857K25.3Very low25.6Very low190 Ų190149.5 Ų149.583%0.82680%0.803SS**  trans-67.3120.5162.9-72.7-177.5177.3178.30108.1P855 K859P855-K857 PolarHBondContact O-N 3.07Å; P855-K857 VanDerWaalsContact O-N 3.12Å; K857-K859 PolarHBondContact O-N 2.93Å
858N25.3Very low25.9Very low151 Ų151149.3 Ų149.381%0.80780%0.801SS**  trans-49.4111.5176-73.1-21.5000110.2I856 Q860I856-N858 PolarHBondContact O-N 3.38Å; N858-Q860 PolarHBondContact O-N 3.07Å
859K27.7Very low26Very low203 Ų203152 Ų15288%0.88380%0.797SS**PPolyproline II helixtrans-64.7123.8174.2-80-175.3175178.80108.1K857 L861K857-K859 PolarHBondContact O-N 2.93Å; K859-L861 PolarHBondContact O-N 3.31Å
860Q26.8Very low26.1Very low176 Ų176153 Ų15382%0.82279%0.793SS**PPolyproline II helixtrans-57.7134.9177.6-69.1170.7-29.300109.6N858 C862N858-Q860 PolarHBondContact O-N 3.07Å; Q860-C862 PolarHBondContact O-N 3.43Å
861L26.5Very low26.2Very low172 Ų172150.8 Ų150.890%0.90179%0.787SS**PPolyproline II helixtrans-56.5126.4171-152.974.6000108.1K859 K863K859-L861 PolarHBondContact O-N 3.31Å; L861-K863 PolarHBondContact O-N 3.49Å
862C25.5Very low26.2Very low122 Ų122155.4 Ų155.482%0.82479%0.79SS**PPolyproline II helixtrans-59.9133.6-168.2-67.80000111.9Q860Q860-C862 PolarHBondContact O-N 3.43Å
863K26.1Very low26.1Very low186 Ų186156.2 Ų156.281%0.80979%0.791SS**PPolyproline II helixtrans-62.6135167.2-64177-179.9178.10108.8L861L861-K863 PolarHBondContact O-N 3.49Å
864L26.8Very low26.2Very low154 Ų154161.4 Ų161.481%0.80679%0.792SS**PPolyproline II helixtrans-71.5137.1161.4-73.7154.2000108
865N27.9Very low26.2Very low143 Ų143166 Ų16677%0.76580%0.799SS**  trans-88.7105.3171.2-74.1-4.3000108.3D867N865-D867 PolarHBondContact O-N 3.38Å
866D27.4Very low26.3Very low120 Ų120165.8 Ų165.864%0.64280%0.795SS**  trans-76.843.4-176.8-69.5-44.7000113.8K869D866-K869 PolarHBondContact O-NZ 3.45Å
867D28.8Very low26.5Very low144 Ų144163.8 Ų163.877%0.7779%0.791SS**  trans-105.534.6-175.1-73.2-40.6000113.9N865N865-D867 PolarHBondContact O-N 3.38Å
868E25.8Very low26.7Very low177 Ų177160.3 Ų160.383%0.82779%0.79SS**  trans-132.562.2158.8-149.5170.1-124.100111.1I870E868-I870 VanDerWaalsContact C-N 3.31Å; E868-I870 PolarHBondContact O-N 2.92Å
869K28.2Very low26.8Very low149 Ų149162 Ų16265%0.64879%0.793SS**  trans-70.782178.7-73.3-175.9-179.373.70111.8D866 N871D866-K869 PolarHBondContact O-NZ 3.45Å; K869-N871 PolarHBondContact O-N 2.91Å; K869-N871 PolarHBondContact O-ND2 3.24Å
870I25.6Very low26.8Very low142 Ų142156.6 Ų156.673%0.72878%0.781SS**  trans-53110.8163.3-64.8177.2000108.2E868 R872E868-I870 VanDerWaalsContact C-N 3.31Å; E868-I870 PolarHBondContact O-N 2.92Å; I870-R872 PolarHBondContact O-N 2.94Å
871N24.5Very low27.2Very low130 Ų130154.4 Ų154.470%0.69578%0.782SS**  trans-75.955.9-165.9-99.5-71.9000113.8K869 K873K869-N871 PolarHBondContact O-N 2.91Å; K869-N871 PolarHBondContact O-ND2 3.24Å; N871-K873 VanDerWaalsContact C-N 3.25Å; N871-K873 PolarHBondContact O-N 2.78Å
872R25.7Very low27.5Very low230 Ų230148.1 Ų148.187%0.86876%0.759SS**  trans-68.885.8164.4-80.2-173.2171.8175.9-0.3109.3I870 R874I870-R872 PolarHBondContact O-N 2.94Å; R872-R874 PolarHBondContact O-N 3.11Å
873K25.4Very low27.8Very low187 Ų187144.1 Ų144.181%0.81374%0.738SS**  trans-64.260.7174.4-68.5177.2178.4171.10112.7N871 K875N871-K873 VanDerWaalsContact C-N 3.25Å; N871-K873 PolarHBondContact O-N 2.78Å; K873-K875 PolarHBondContact O-N 3.13Å
874R24.7Very low28.2Very low230 Ų230143.4 Ų143.487%0.86874%0.735SS**  trans-66.6116.7152.6-93.2-172.5172.1171.7-1.5106.5R872 V876R872-R874 PolarHBondContact O-N 3.11Å; R874-V876 PolarHBondContact O-N 3.45Å
875K25.9Very low28.8Very low198 Ų198142.9 Ų142.986%0.86173%0.726SS**  trans-73.872.8-176.3-171.1-178.2180-177.10109.8K873 T877K873-K875 PolarHBondContact O-N 3.13Å; K875-T877 PolarHBondContact O-N 3.22Å
876V26.8Very low29.3Very low123 Ų123142 Ų14275%0.74572%0.719SS**  trans-64.1105.6171.5179.90000107.4R874 S878R874-V876 PolarHBondContact O-N 3.45Å; V876-S878 PolarHBondContact O-N 2.92Å
877T29.5Very low29.9Very low113 Ų113138.8 Ų138.869%0.69370%0.703SS**  trans-61.9124.8165.937.60000108.3K875 E879K875-T877 PolarHBondContact O-N 3.22Å; T877-E879 PolarHBondContact O-N 3.1Å; T877-E879 VanDerWaalsContact O-N 3.1Å
878S29.4Very low30.7Very low116 Ų116135.2 Ų135.281%0.81168%0.684SS**  trans-61.5110.4-175.252.60000111.7V876V876-S878 PolarHBondContact O-N 2.92Å
879E27.4Very low31.7Very low186 Ų186130.1 Ų130.187%0.86966%0.663SS**  trans-64.8132.3170-63.2-177.9145.100109.9T877T877-E879 PolarHBondContact O-N 3.1Å; T877-E879 VanDerWaalsContact O-N 3.1Å
880S27.5Very low32.4Very low90 Ų90125.1 Ų125.163%0.62965%0.646SS**  trans-82148.6171.583.20000110.2G882 G883S880-G882 PolarHBondContact O-N 3.22Å; S880-G883 PolarHBondContact O-N 3.42Å; S880-G883 VanDerWaalsContact O-N 3.11Å
881P35.5Very low33.3Very low130 Ų130118.6 Ų118.684%0.84461%0.612SS**THydrogen-bonded Turntrans-64-8.5-177.224.9-34.3000114.7G883P881-G883 PolarHBondContact O-N 3.43Å
882G32.9Very low34.3Very low41 Ų41114.1 Ų114.142%0.42359%0.591SS.*Hα-helixtrans-63-26.417100000113.8S880 K884 K885 M886S880-G882 PolarHBondContact O-N 3.22Å; G882-K884 VanDerWaalsContact C-N 3.35Å; G882-K884 PolarHBondContact O-N 2.95Å; G882-K885 PolarHBondContact O-N 3.4Å; G882-M886 PolarHBondContact O-N 3.41Å
883G31.9Very low35.4Very low37 Ų37106.6 Ų106.638%0.38157%0.571SS.*Hα-helixtrans-57.5-39.9-173.700000114.4S880 P881 M886 V887S880-G883 PolarHBondContact O-N 3.42Å; S880-G883 VanDerWaalsContact O-N 3.11Å; P881-G883 PolarHBondContact O-N 3.43Å; G883-M886 PolarHBondContact O-N 2.79Å; G883-V887 WeakPolarHBondContact O-CG2 3.31Å; G883-V887 PolarHBondContact O-N 2.87Å
884K35Very low36.4Very low172 Ų172101.7 Ų101.775%0.74855%0.554SS**Hα-helixtrans-66.1-41-179.4-76.1-167.9174.4-170.80113.3G882 M886 V887 L888G882-K884 VanDerWaalsContact C-N 3.35Å; G882-K884 PolarHBondContact O-N 2.95Å; K884-M886 VanDerWaalsContact C-N 3.35Å; K884-V887 PolarHBondContact O-N 2.87Å; K884-L888 PolarHBondContact O-N 3.39Å
885K38.4Very low37.5Very low142 Ų14292 Ų9262%0.61752%0.52SS*.Hα-helixtrans-68-42.1175-159.9-163.8170.5-166.20109.9G882 V887 L888 D889G882-K885 PolarHBondContact O-N 3.4Å; K885-V887 PolarHBondContact O-N 3.3Å; K885-L888 PolarHBondContact O-N 3.02Å; K885-D889 WeakPolarHBondContact CE-OD2 3.3Å; K885-D889 IonicContact NZ-OD2 2.69Å; K885-D889 WeakPolarHBondContact O-CB 3.48Å; K885-D889 VanDerWaalsContact O-CG 3.28Å; K885-D889 PolarHBondContact O-N 3.28Å
886M39.3Very low38.3Very low125 Ų12585.8 Ų85.862%0.61650%0.502SS*.Hα-helixtrans-59.1-32.7176.2-149.3-179.5104.500112.8G882 G883 K884 C890G882-M886 PolarHBondContact O-N 3.41Å; G883-M886 PolarHBondContact O-N 2.79Å; K884-M886 VanDerWaalsContact C-N 3.35Å; M886-C890 WeakPolarHBondContact O-CB 3.43Å; M886-C890 PolarHBondContact O-N 3.13Å; M886-C890 PolarHBondContact O-SG 2.86Å
887V40.1Very low38.6Very low52 Ų5286 Ų8632%0.31550%0.498SS..Hα-helixtrans-70.3-39.3173.5169.10000112.4G883 K884 K885 L891 N969G883-V887 WeakPolarHBondContact O-CG2 3.31Å; G883-V887 PolarHBondContact O-N 2.87Å; K884-V887 PolarHBondContact O-N 2.87Å; K885-V887 PolarHBondContact O-N 3.3Å; V887-L891 HydrophobicContact CG1-CD1 4.27Å; V887-L891 WeakPolarHBondContact O-CB 3.46Å; V887-L891 PolarHBondContact O-N 2.91Å; V887-N969 HydrophobicContact CG1-CB 4.4Å
888L44.3Very low38.8Very low69 Ų6985.1 Ų85.136%0.36149%0.494SS..Hα-helixtrans-68.2-46.2175.4-153.488000110.7K884 K885 C890 L891 S892 L973K884-L888 PolarHBondContact O-N 3.39Å; K885-L888 PolarHBondContact O-N 3.02Å; L888-C890 VanDerWaalsContact C-N 3.34Å; L888-C890 PolarHBondContact O-N 3.47Å; L888-L891 PolarHBondContact O-N 2.91Å; L888-S892 PolarHBondContact O-N 2.88Å; L888-S892 PolarHBondContact O-OG 2.72Å; L888-L973 HydrophobicContact CD1-CD1 4.05Å
889D47.5Very low39Very low71 Ų7187 Ų8738%0.3849%0.487SS..Hα-helixtrans-59.7-42.9175.1-64.1-28.1000110.2K885 S892 T893K885-D889 WeakPolarHBondContact CE-OD2 3.3Å; K885-D889 IonicContact NZ-OD2 2.69Å; K885-D889 WeakPolarHBondContact O-CB 3.48Å; K885-D889 VanDerWaalsContact O-CG 3.28Å; K885-D889 PolarHBondContact O-N 3.28Å; D889-S892 PolarHBondContact O-N 3.37Å; D889-T893 WeakPolarHBondContact O-CG2 3.5Å; D889-T893 PolarHBondContact O-N 3.21Å; D889-T893 PolarHBondContact O-OG1 2.88Å
890C44.1Very low39Very low44 Ų4483.8 Ų83.830%0.29748%0.48SS..Hα-helixtrans-65.4-37.7174.9-78.30000113.7M886 L888 T893 D894M886-C890 WeakPolarHBondContact O-CB 3.43Å; M886-C890 PolarHBondContact O-N 3.13Å; M886-C890 PolarHBondContact O-SG 2.86Å; L888-C890 VanDerWaalsContact C-N 3.34Å; L888-C890 PolarHBondContact O-N 3.47Å; C890-T893 WeakPolarHBondContact CA-OG1 3.41Å; C890-T893 PolarHBondContact O-N 3.25Å; C890-T893 PolarHBondContact O-OG1 3.27Å; C890-T893 VanDerWaalsContact O-OG1 3.13Å; C890-D894 WeakPolarHBondContact O-CB 3.42Å; C890-D894 PolarHBondContact O-N 3.27Å
891L43.8Very low39.2Very low4 Ų483.9 Ų83.92%0.02149%0.487CS..Hα-helixtrans-63.5-46.2173.3-88.8161.6000110.5V887 L888 V895 N966 C970V887-L891 HydrophobicContact CG1-CD1 4.27Å; V887-L891 WeakPolarHBondContact O-CB 3.46Å; V887-L891 PolarHBondContact O-N 2.91Å; L888-L891 PolarHBondContact O-N 2.91Å; L891-V895 VanDerWaalsContact O-CB 3.26Å; L891-V895 WeakPolarHBondContact O-CB 3.39Å; L891-V895 WeakPolarHBondContact O-CG2 3.48Å; L891-V895 PolarHBondContact O-N 2.88Å; L891-N966 HydrophobicContact CD2-CB 3.6Å; L891-N966 HydrophobicContact CG-CB 3.99Å; L891-C970 VanDerWaalsContact CD1-SG 3.55Å
892S46.2Very low38.8Very low36 Ų3685.3 Ų85.325%0.25249%0.488SS..Hα-helixtrans-62.6-40.3174.1-62.60000112L888 D889 S896 N924L888-S892 PolarHBondContact O-N 2.88Å; L888-S892 PolarHBondContact O-OG 2.72Å; D889-S892 PolarHBondContact O-N 3.37Å; S892-S896 WeakPolarHBondContact O-CB 3.33Å; S892-S896 PolarHBondContact O-N 2.96Å; S892-S896 PolarHBondContact O-OG 3.1Å; S892-N924 PolarHBondContact OG-OD1 3.22Å
893T47.4Very low38.6Very low73 Ų7391.4 Ų91.445%0.44851%0.505SS..Hα-helixtrans-69.5-45.2178.955.20000112.8D889 C890 V895 S896 L897D889-T893 WeakPolarHBondContact O-CG2 3.5Å; D889-T893 PolarHBondContact O-N 3.21Å; D889-T893 PolarHBondContact O-OG1 2.88Å; C890-T893 WeakPolarHBondContact CA-OG1 3.41Å; C890-T893 PolarHBondContact O-N 3.25Å; C890-T893 PolarHBondContact O-OG1 3.27Å; C890-T893 VanDerWaalsContact O-OG1 3.13Å; T893-V895 VanDerWaalsContact C-N 3.29Å; T893-V895 PolarHBondContact O-N 2.97Å; T893-S896 WeakPolarHBondContact CA-OG 3.31Å; T893-S896 CarbonylContact O-C 3.48Å; T893-S896 WeakPolarHBondContact O-CA 3.47Å; T893-S896 PolarHBondContact O-N 3.35Å; T893-S896 PolarHBondContact O-OG 3.28Å; T893-L897 PolarHBondContact O-N 3.37Å
894D46.5Very low38.3Very low84 Ų8497.8 Ų97.845%0.44953%0.527SS..Hα-helixtrans-68.4-30.5-178.7-72.30.2000111.8C890 L897 N966C890-D894 WeakPolarHBondContact O-CB 3.42Å; C890-D894 PolarHBondContact O-N 3.27Å; D894-L897 WeakPolarHBondContact O-CB 3.41Å; D894-N966 PolarHBondContact OD2-ND2 3.47Å
895V47.5Very low38Very low27 Ų2797.9 Ų97.916%0.16453%0.533CS..Hα-helixtrans-81.8-19.3172.2176.80000112.4L891 T893 Q920 I923L891-V895 VanDerWaalsContact O-CB 3.26Å; L891-V895 WeakPolarHBondContact O-CB 3.39Å; L891-V895 WeakPolarHBondContact O-CG2 3.48Å; L891-V895 PolarHBondContact O-N 2.88Å; T893-V895 VanDerWaalsContact C-N 3.29Å; T893-V895 PolarHBondContact O-N 2.97Å; V895-Q920 PolarHBondContact O-NE2 3.5Å; V895-I923 HydrophobicContact CG1-CD1 3.73Å; V895-I923 HydrophobicContact CG1-CG2 4.33Å
896S42.6Very low37.6Very low67 Ų6795.9 Ų95.947%0.46953%0.533SS..Hα-helixtrans-85.6-8.6169.978.10000114S892 T893 P898S892-S896 WeakPolarHBondContact O-CB 3.33Å; S892-S896 PolarHBondContact O-N 2.96Å; S892-S896 PolarHBondContact O-OG 3.1Å; T893-S896 WeakPolarHBondContact CA-OG 3.31Å; T893-S896 CarbonylContact O-C 3.48Å; T893-S896 WeakPolarHBondContact O-CA 3.47Å; T893-S896 PolarHBondContact O-N 3.35Å; T893-S896 PolarHBondContact O-OG 3.28Å; S896-P898 WeakPolarHBondContact O-CD 3.26Å; S896-P898 VanDerWaalsContact O-N 3.12Å
897L33.8Very low37.1Very low128 Ų12894.3 Ų94.367%0.6753%0.527SS*.SBendtrans-62.3115.6179.2-145.580.8000108.3T893 D894T893-L897 PolarHBondContact O-N 3.37Å; D894-L897 WeakPolarHBondContact O-CB 3.41Å
898P34.5Very low36.7Very low93 Ų9399.3 Ų99.360%0.60455%0.552SS**  trans-66.9157.6-167.125.7-34.7000111.8S896 T900S896-P898 WeakPolarHBondContact O-CD 3.26Å; S896-P898 VanDerWaalsContact O-N 3.12Å; P898-T900 PolarHBondContact O-N 3.06Å; P898-T900 PolarHBondContact O-OG1 3.19Å
899K32.7Very low36.3Very low156 Ų156100.9 Ų100.968%0.67857%0.565SS**  trans-69.433.6-174.3-61.6161.3-172.9147.80114.5D916K899-D916 IonicContact NZ-OD1 3.57Å; K899-D916 PolarHBondContact NZ-OD1 3.39Å
900T28.2Very low35.7Very low118 Ų118106.2 Ų106.272%0.72459%0.585SS**THydrogen-bonded Turntrans-69.5130.6163.747.20000109.5P898P898-T900 PolarHBondContact O-N 3.06Å; P898-T900 PolarHBondContact O-OG1 3.19Å
901A31.5Very low35.7Very low92 Ų92108.1 Ų108.176%0.7660%0.596SS**THydrogen-bonded Turncis-146.658.614.200000113
902N26.8Very low36.3Very low161 Ų161114 Ų11486%0.86163%0.628SS**  trans-112.4-3.6179.8-89.2-1.6000115.8M904N902-M904 PolarHBondContact O-N 2.93Å
903H28.1Very low37.1Very low169 Ų169119 Ų11978%0.78265%0.647SS**  trans-82.3100.7165.4-99.1-81.3000109.8
904M26.4Very low38.2Very low171 Ų171120.1 Ų120.184%0.84265%0.647SS**  trans-65.6150.1157.2-68.4-164.474.300109.4N902 T906N902-M904 PolarHBondContact O-N 2.93Å; M904-T906 PolarHBondContact O-N 3.21Å
905I28.5Very low39.6Very low173 Ų173119.8 Ų119.889%0.88764%0.64SS**  trans-59.3115.4-166.9-59.3162.2000111.4
906T28.9Very low40.7Very low100 Ų100121.3 Ų121.361%0.61365%0.647SS**  trans-138.9132.1165.454.20000109.2M904M904-T906 PolarHBondContact O-N 3.21Å
907D28.8Very low42.3Very low93 Ų93123.4 Ų123.450%0.49765%0.65SS.*  trans-43.8120.5-158.6-64.1-74.3000120.2T909D907-T909 VanDerWaalsContact C-N 3.29Å; D907-T909 PolarHBondContact O-N 2.7Å
908N32.1Very low44.4Very low156 Ų156117.4 Ų117.483%0.83462%0.618SS**  53.44.4126.9-70.8-32.8000122.3K910N908-K910 PolarHBondContact O-N 2.72Å
909T36.1Very low46.4Very low103 Ų103114.1 Ų114.163%0.63260%0.595SS**PPolyproline II helixtrans-69.1116.915648.20000108.6F599 D907F599-T909 HydrophobicContact CE1-CG2 3.85Å; F599-T909 HydrophobicContact CZ-CG2 4.03Å; D907-T909 VanDerWaalsContact C-N 3.29Å; D907-T909 PolarHBondContact O-N 2.7Å
910K35.5Very low48.5Very low183 Ų183109.1 Ų109.180%0.79657%0.574SS**PPolyproline II helixtrans-56.2137.2171.3-68.4179179.9176.30108.7N908 D912N908-K910 PolarHBondContact O-N 2.72Å; K910-D912 PolarHBondContact O-N 2.91Å
911P44.4Very low50.8Low83 Ų83106.5 Ų106.554%0.53955%0.552SS.*PPolyproline II helixtrans-62.3134.7171.927.4-33.6000109.3H913P911-H913 VanDerWaalsContact C-N 3.31Å; P911-H913 PolarHBondContact O-N 2.97Å
912D55.8Low53.1Low127 Ų127102.1 Ų102.168%0.67952%0.516SS*.  trans-68.189.4176.3-78.7-46.2000109.9K910 Q914 Y915 D916K910-D912 PolarHBondContact O-N 2.91Å; D912-Q914 PolarHBondContact O-N 3.06Å; D912-Q914 VanDerWaalsContact O-N 3.08Å; D912-Y915 WeakPolarHBondContact O-CA 3.4Å; D912-Y915 WeakPolarHBondContact O-CB 3.46Å; D912-Y915 PolarHBondContact O-N 3.39Å; D912-D916 PolarHBondContact O-N 2.88Å
913H64.2Low55.5Low141 Ų14194.5 Ų94.565%0.65348%0.476SS*.Hα-helixtrans-54.1-30.5178.2-67.3-60.3000112.4P911 E917P911-H913 VanDerWaalsContact C-N 3.31Å; P911-H913 PolarHBondContact O-N 2.97Å; H913-E917 VanDerWaalsContact O-CB 3.32Å; H913-E917 WeakPolarHBondContact O-CB 3.26Å; H913-E917 PolarHBondContact O-N 2.83Å
914Q70.5Confident57.7Low98 Ų9890 Ų9046%0.45846%0.457SS..Hα-helixtrans-65.7-34.4173.9-172.5172.84.700112.8D912 I918D912-Q914 PolarHBondContact O-N 3.06Å; D912-Q914 VanDerWaalsContact O-N 3.08Å; Q914-I918 HydrophobicContact CG-CD1 3.85Å; Q914-I918 HydrophobicContact CG-CG1 4.5Å; Q914-I918 WeakPolarHBondContact O-CB 3.42Å; Q914-I918 VanDerWaalsContact O-CG1 3.23Å; Q914-I918 WeakPolarHBondContact O-CG1 3.44Å; Q914-I918 PolarHBondContact O-N 3.34Å
915Y74Confident60.1Low77 Ų7783 Ų8330%0.30242%0.422SS..Hα-helixtrans-66.3-52.2174.8-176-76.3000110.7D912 E917 I918 Q919 I953 S956D912-Y915 WeakPolarHBondContact O-CA 3.4Å; D912-Y915 WeakPolarHBondContact O-CB 3.46Å; D912-Y915 PolarHBondContact O-N 3.39Å; Y915-E917 VanDerWaalsContact C-N 3.31Å; Y915-E917 PolarHBondContact O-N 3.04Å; Y915-I918 PolarHBondContact O-N 2.84Å; Y915-Q919 WeakPolarHBondContact O-CB 3.28Å; Y915-Q919 PolarHBondContact O-N 3.01Å; Y915-I953 HydrophobicContact CD2-CD1 4.14Å; Y915-I953 HydrophobicContact CD2-CG1 3.94Å; Y915-I953 HydrophobicContact CE2-CD1 4.11Å; Y915-I953 HydrophobicContact CE2-CG1 3.42Å; Y915-I953 VanDerWaalsContact CE2-CG1 3.42Å; Y915-S956 PolarHBondContact OH-OG 3.21Å
916D72.6Confident62.4Low59 Ų5974.7 Ų74.732%0.31638%0.38SS..Hα-helixtrans-63.7-36.2179.8-78.1-37.1000110.8K899 D912 Q919 Q920K899-D916 IonicContact NZ-OD1 3.57Å; K899-D916 PolarHBondContact NZ-OD1 3.39Å; D912-D916 PolarHBondContact O-N 2.88Å; D916-Q919 PolarHBondContact O-N 3.15Å; D916-Q920 VanDerWaalsContact O-CG 3.3Å; D916-Q920 WeakPolarHBondContact O-CG 3.39Å; D916-Q920 PolarHBondContact O-N 3.19Å
917E75.9Confident64.5Low110 Ų11070.6 Ų70.651%0.51435%0.354SS..Hα-helixtrans-64.6-49.3175.5-169.7-172.3144.100112.4H913 Y915 Q919 Q920 K921H913-E917 VanDerWaalsContact O-CB 3.32Å; H913-E917 WeakPolarHBondContact O-CB 3.26Å; H913-E917 PolarHBondContact O-N 2.83Å; Y915-E917 VanDerWaalsContact C-N 3.31Å; Y915-E917 PolarHBondContact O-N 3.04Å; E917-Q919 VanDerWaalsContact C-N 3.32Å; E917-Q919 PolarHBondContact O-N 3.2Å; E917-Q920 PolarHBondContact O-N 3.14Å; E917-K921 WeakPolarHBondContact O-CG 3.17Å; E917-K921 PolarHBondContact O-N 3.48Å; E917-K921 WeakPolarHBondContact OE1-CE 3.28Å; E917-K921 IonicContact OE1-NZ 2.67Å; E917-K921 PolarHBondContact OE1-NZ 3.21Å
918I76.8Confident66.5Low3 Ų366.5 Ų66.52%0.01533%0.332CS..Hα-helixtrans-65.4-37.6178.1-63.8169.4000110.1Q914 Y915 Q920 K921 C922 E943 L944 T947 I953Q914-I918 HydrophobicContact CG-CD1 3.85Å; Q914-I918 HydrophobicContact CG-CG1 4.5Å; Q914-I918 WeakPolarHBondContact O-CB 3.42Å; Q914-I918 VanDerWaalsContact O-CG1 3.23Å; Q914-I918 WeakPolarHBondContact O-CG1 3.44Å; Q914-I918 PolarHBondContact O-N 3.34Å; Y915-I918 PolarHBondContact O-N 2.84Å; I918-Q920 PolarHBondContact O-N 3.15Å; I918-K921 PolarHBondContact O-N 3.08Å; I918-C922 WeakPolarHBondContact O-CB 3.49Å; I918-C922 PolarHBondContact O-N 2.76Å; I918-C922 PolarHBondContact O-SG 2.87Å; I918-E943 HydrophobicContact CD1-CB 4.38Å; I918-E943 HydrophobicContact CG1-CB 4.41Å; I918-L944 HydrophobicContact CG2-CD2 3.73Å; I918-L944 HydrophobicContact CG2-CG 4.16Å; I918-T947 HydrophobicContact CD1-CG2 3.57Å; I918-I953 HydrophobicContact CG2-CD1 4.5Å; I918-I953 HydrophobicContact CG2-CG2 4.1Å
919Q77.1Confident67.8Low23 Ų2363.9 Ų63.911%0.10732%0.318CS..Hα-helixtrans-59.1-45.8173.6-164.1-171.4-6.200111.2Y915 D916 E917 K921 C922 I923 I953 S956 S957Y915-Q919 WeakPolarHBondContact O-CB 3.28Å; Y915-Q919 PolarHBondContact O-N 3.01Å; D916-Q919 PolarHBondContact O-N 3.15Å; E917-Q919 VanDerWaalsContact C-N 3.32Å; E917-Q919 PolarHBondContact O-N 3.2Å; Q919-K921 PolarHBondContact O-N 3.02Å; Q919-C922 WeakPolarHBondContact O-CB 3.29Å; Q919-C922 PolarHBondContact O-N 2.78Å; Q919-I923 HydrophobicContact CG-CD1 4.14Å; Q919-I923 VanDerWaalsContact O-CG1 3.27Å; Q919-I923 WeakPolarHBondContact O-CG1 3.34Å; Q919-I923 PolarHBondContact O-N 3.3Å; Q919-I953 HydrophobicContact CB-CG2 4.27Å; Q919-S956 VanDerWaalsContact NE2-C 3.34Å; Q919-S956 PolarHBondContact NE2-O 3.16Å; Q919-S956 VanDerWaalsContact NE2-O 3.14Å; Q919-S956 PolarHBondContact NE2-OG 2.78Å; Q919-S957 WeakPolarHBondContact CG-OG 3.49Å; Q919-S957 PolarHBondContact O-OG 3.16Å
920Q75.9Confident68.8Low51 Ų5164.9 Ų64.924%0.23831%0.314CS..Hα-helixtrans-65-37.1176.6-67.7-68.1-5.600112.5V895 D916 E917 I918 I923 N924V895-Q920 PolarHBondContact O-NE2 3.5Å; D916-Q920 VanDerWaalsContact O-CG 3.3Å; D916-Q920 WeakPolarHBondContact O-CG 3.39Å; D916-Q920 PolarHBondContact O-N 3.19Å; E917-Q920 PolarHBondContact O-N 3.14Å; I918-Q920 PolarHBondContact O-N 3.15Å; Q920-I923 PolarHBondContact O-N 3.33Å; Q920-N924 WeakPolarHBondContact O-CB 3.35Å; Q920-N924 VanDerWaalsContact O-CG 3.27Å; Q920-N924 PolarHBondContact O-N 2.74Å; Q920-N924 PolarHBondContact O-ND2 2.78Å; Q920-N924 VanDerWaalsContact O-ND2 3.08Å
921K77.6Confident69.5Low63 Ų6363.7 Ų63.727%0.27432%0.316SS..Hα-helixtrans-64.1-42173.4-70.1172.3-176.1169.30112.1E917 I918 Q919 N924 F925 L940 E943E917-K921 WeakPolarHBondContact O-CG 3.17Å; E917-K921 PolarHBondContact O-N 3.48Å; E917-K921 WeakPolarHBondContact OE1-CE 3.28Å; E917-K921 IonicContact OE1-NZ 2.67Å; E917-K921 PolarHBondContact OE1-NZ 3.21Å; I918-K921 PolarHBondContact O-N 3.08Å; Q919-K921 PolarHBondContact O-N 3.02Å; K921-N924 PolarHBondContact O-N 2.93Å; K921-F925 WeakPolarHBondContact O-CB 3.24Å; K921-F925 PolarHBondContact O-N 3.1Å; K921-L940 HydrophobicContact CB-CD1 3.75Å; K921-E943 WeakPolarHBondContact CD-OE2 3.47Å; K921-E943 WeakPolarHBondContact CE-OE2 3.38Å; K921-E943 IonicContact NZ-OE1 2.68Å; K921-E943 PolarHBondContact NZ-OE1 2.84Å; K921-E943 IonicContact NZ-OE2 3.93Å; K921-E943 PolarHBondContact NZ-OE2 3.33Å
922C78.8Confident69.6Low0 Ų063.4 Ų63.40%032%0.316CS..Hα-helixtrans-61-43.2172.7-750000112.2I918 Q919 F925 L926 S957I918-C922 WeakPolarHBondContact O-CB 3.49Å; I918-C922 PolarHBondContact O-N 2.76Å; I918-C922 PolarHBondContact O-SG 2.87Å; Q919-C922 WeakPolarHBondContact O-CB 3.29Å; Q919-C922 PolarHBondContact O-N 2.78Å; C922-F925 PolarHBondContact O-N 3.12Å; C922-L926 WeakPolarHBondContact O-CB 3.49Å; C922-L926 VanDerWaalsContact O-CG 3.3Å; C922-L926 WeakPolarHBondContact O-CG 3.47Å; C922-L926 PolarHBondContact O-N 3.17Å; C922-S957 VanDerWaalsContact CB-OG 3.22Å; C922-S957 WeakPolarHBondContact CB-OG 3.29Å
923I77Confident69.1Low2 Ų260.1 Ų60.11%0.0130%0.298CS..Hα-helixtrans-62.3-47.3176.5-69.1166.5000111V895 Q919 Q920 F925 L926 L927 A960 I961V895-I923 HydrophobicContact CG1-CD1 3.73Å; V895-I923 HydrophobicContact CG1-CG2 4.33Å; Q919-I923 HydrophobicContact CG-CD1 4.14Å; Q919-I923 VanDerWaalsContact O-CG1 3.27Å; Q919-I923 WeakPolarHBondContact O-CG1 3.34Å; Q919-I923 PolarHBondContact O-N 3.3Å; Q920-I923 PolarHBondContact O-N 3.33Å; I923-F925 VanDerWaalsContact C-N 3.33Å; I923-F925 PolarHBondContact O-N 3.15Å; I923-L926 PolarHBondContact O-N 3.39Å; I923-L927 HydrophobicContact CG2-CD1 3.9Å; I923-L927 WeakPolarHBondContact O-CB 3.44Å; I923-L927 WeakPolarHBondContact O-CG 3.27Å; I923-L927 PolarHBondContact O-N 2.86Å; I923-A960 HydrophobicContact CD1-CB 3.8Å; I923-I961 HydrophobicContact CG1-CD1 4.43Å; I923-I961 HydrophobicContact CG1-CG1 4.3Å; I923-I961 HydrophobicContact CG2-CD1 4.29Å; I923-I961 HydrophobicContact CG2-CG1 3.96Å
924N75.7Confident68.3Low73 Ų7363.3 Ų63.339%0.3931%0.31SS..Hα-helixtrans-63.6-36.4177.1-71-35.7000112.3S892 Q920 K921 S928S892-N924 PolarHBondContact OG-OD1 3.22Å; Q920-N924 WeakPolarHBondContact O-CB 3.35Å; Q920-N924 VanDerWaalsContact O-CG 3.27Å; Q920-N924 PolarHBondContact O-N 2.74Å; Q920-N924 PolarHBondContact O-ND2 2.78Å; Q920-N924 VanDerWaalsContact O-ND2 3.08Å; K921-N924 PolarHBondContact O-N 2.93Å; N924-S928 VanDerWaalsContact O-CB 3.32Å; N924-S928 WeakPolarHBondContact O-CB 3.13Å; N924-S928 PolarHBondContact O-N 2.8Å
925F76.9Confident67.1Low24 Ų2462.7 Ų62.711%0.10531%0.313CS..Hα-helixtrans-63.4-50.1173-178.7-99.1000111.4K921 C922 I923 L927 S928 I933 P937 L940 K980 L984K921-F925 WeakPolarHBondContact O-CB 3.24Å; K921-F925 PolarHBondContact O-N 3.1Å; C922-F925 PolarHBondContact O-N 3.12Å; I923-F925 VanDerWaalsContact C-N 3.33Å; I923-F925 PolarHBondContact O-N 3.15Å; F925-L927 VanDerWaalsContact C-N 3.34Å; F925-L927 PolarHBondContact O-N 2.82Å; F925-S928 PolarHBondContact O-N 3.47Å; F925-S928 PolarHBondContact O-OG 3.31Å; F925-I933 HydrophobicContact CD2-CD1 3.69Å; F925-I933 HydrophobicContact CE2-CD1 4.35Å; F925-I933 HydrophobicContact CG-CD1 4.48Å; F925-P937 HydrophobicContact CE2-CB 4.34Å; F925-P937 HydrophobicContact CZ-CB 4.05Å; F925-L940 HydrophobicContact CB-CD2 3.73Å; F925-L940 HydrophobicContact CD1-CD2 4.22Å; F925-L940 HydrophobicContact CD2-CD2 4.39Å; F925-L940 HydrophobicContact CG-CD2 3.87Å; F925-K980 HydrophobicContact CD1-CB 4.33Å; F925-K980 HydrophobicContact CE1-CB 3.82Å; F925-K980 HydrophobicContact CE1-CG 4.22Å; F925-K980 HydrophobicContact CZ-CB 4.5Å; F925-K980 HydrophobicContact CZ-CG 4.44Å; F925-K980 WeakPolarHBondContact O-CD 3.42Å; F925-L984 HydrophobicContact CD1-CD2 4.29Å; F925-L984 HydrophobicContact CE1-CB 4.42Å
926L75.3Confident65.9Low0 Ų063.3 Ų63.30%033%0.325CS..Hα-helixtrans-62.2-36.4179.8-72.2171.9000113.3C922 I923 I961 M977 K980 F981C922-L926 WeakPolarHBondContact O-CB 3.49Å; C922-L926 VanDerWaalsContact O-CG 3.3Å; C922-L926 WeakPolarHBondContact O-CG 3.47Å; C922-L926 PolarHBondContact O-N 3.17Å; I923-L926 PolarHBondContact O-N 3.39Å; L926-I961 HydrophobicContact CB-CD1 3.71Å; L926-I961 HydrophobicContact CD1-CD1 3.8Å; L926-I961 HydrophobicContact CG-CD1 4.42Å; L926-M977 HydrophobicContact CB-CG 4.11Å; L926-M977 HydrophobicContact CD2-CG 4.12Å; L926-K980 HydrophobicContact CD2-CB 4.32Å; L926-F981 HydrophobicContact CD2-CB 3.87Å
927L74.3Confident65Low13 Ų1362.2 Ų62.27%0.06832%0.321CS..Hα-helixtrans-90.6-5.5-179.6-67.4-179.3000114.9I923 F925 I961 L973I923-L927 HydrophobicContact CG2-CD1 3.9Å; I923-L927 WeakPolarHBondContact O-CB 3.44Å; I923-L927 WeakPolarHBondContact O-CG 3.27Å; I923-L927 PolarHBondContact O-N 2.86Å; F925-L927 VanDerWaalsContact C-N 3.34Å; F925-L927 PolarHBondContact O-N 2.82Å; L927-I961 HydrophobicContact CD1-CG1 4.21Å; L927-I961 HydrophobicContact CD2-CD1 4.24Å; L927-I961 HydrophobicContact CD2-CG1 4.36Å; L927-I961 HydrophobicContact CD2-CG2 3.95Å; L927-I961 HydrophobicContact CG-CD1 4.01Å; L927-I961 HydrophobicContact CG-CG1 4.19Å; L927-L973 WeakPolarHBondContact O-CD1 3.2Å; L927-L973 WeakPolarHBondContact O-CD2 3.35Å
928S69.6Low64Low7 Ų760.1 Ų60.15%0.04932%0.316CS..  trans-65.3155-179.260.60000113.2N924 F925 I933 K980N924-S928 VanDerWaalsContact O-CB 3.32Å; N924-S928 WeakPolarHBondContact O-CB 3.13Å; N924-S928 PolarHBondContact O-N 2.8Å; F925-S928 PolarHBondContact O-N 3.47Å; F925-S928 PolarHBondContact O-OG 3.31Å; S928-I933 VanDerWaalsContact CB-CD1 3.48Å; S928-I933 WeakPolarHBondContact OG-CD1 2.78Å; S928-K980 PolarHBondContact O-NZ 3.25Å; S928-K980 PolarHBondContact OG-NZ 2.86Å
929D59.8Low63.3Low101 Ų10163.9 Ų63.954%0.5434%0.336SS..  trans-86.8153.4171.9-132.5-32.9000111D931 S932 L973D929-D931 PolarHBondContact O-N 3.3Å; D929-D931 VanDerWaalsContact O-N 3.14Å; D929-S932 PolarHBondContact N-OG 2.65Å; D929-S932 PolarHBondContact O-N 2.87Å; D929-S932 PolarHBondContact O-OG 2.88Å; D929-L973 HydrophobicContact CB-CD2 4.37Å
930K56.9Low62.7Low125 Ų12563.6 Ų63.654%0.54334%0.335SS..THydrogen-bonded Turntrans-59.9-29.2-170.6-79.5-164.8175.1-171.40114.5E979K930-E979 WeakPolarHBondContact CE-OE2 3.46Å; K930-E979 IonicContact NZ-OE1 2.68Å; K930-E979 IonicContact NZ-OE2 2.74Å; K930-E979 PolarHBondContact NZ-OE2 2.95Å
931D49.7Very low62.2Low157 Ų15761.2 Ų61.284%0.8432%0.324SS*.THydrogen-bonded Turntrans-84.8-9-179.6-57.7-42.9000113.9D929D929-D931 PolarHBondContact O-N 3.3Å; D929-D931 VanDerWaalsContact O-N 3.14Å
932S48Very low61.7Low77 Ų7761.7 Ų61.754%0.53833%0.33SS..THydrogen-bonded Turntrans-92.9-26.2-166.966.90000115.1D929D929-S932 PolarHBondContact N-OG 2.65Å; D929-S932 PolarHBondContact O-N 2.87Å; D929-S932 PolarHBondContact O-OG 2.88Å
933I45Very low61.2Low58 Ų5864.4 Ų64.430%0.29734%0.343SS..  trans-103.4110.8-179.7-66.9-166.5000109.9F925 S928 T935F925-I933 HydrophobicContact CD2-CD1 3.69Å; F925-I933 HydrophobicContact CE2-CD1 4.35Å; F925-I933 HydrophobicContact CG-CD1 4.48Å; S928-I933 VanDerWaalsContact CB-CD1 3.48Å; S928-I933 WeakPolarHBondContact OG-CD1 2.78Å; I933-T935 WeakPolarHBondContact CG2-O 3.36Å
934K46.5Very low60.8Low208 Ų20864.3 Ų64.390%0.90434%0.342SS*.  trans-92.7-16.8169.3-73.2-174.7176.2-179.70113.6
935T45.2Very low60.3Low85 Ų8564.9 Ų64.952%0.52134%0.341SS..SBendtrans-76.4128.8176.439.90000109.9I933 D939I933-T935 WeakPolarHBondContact CG2-O 3.36Å; T935-D939 WeakPolarHBondContact CB-OD2 3.33Å; T935-D939 WeakPolarHBondContact CG2-OD2 3.3Å
936T48.5Very low59.8Low90 Ų9070 Ų7055%0.55237%0.365SS*.  trans-66.3149.6175.129.80000110.1T938 D939T936-T938 WeakPolarHBondContact CB-OG1 3.36Å; T936-T938 PolarHBondContact O-N 3.31Å; T936-T938 PolarHBondContact O-OG1 3.46Å; T936-T938 PolarHBondContact OG1-OG1 2.91Å; T936-D939 PolarHBondContact O-N 3.35Å; T936-D939 VanDerWaalsContact O-N 3.17Å
937P53.6Low59.3Low37 Ų3771.1 Ų71.124%0.2437%0.372CS..THydrogen-bonded Turntrans-60.8-11.8-177.323.8-33.8000113.7F925 D939 L940 S941F925-P937 HydrophobicContact CE2-CB 4.34Å; F925-P937 HydrophobicContact CZ-CB 4.05Å; P937-D939 PolarHBondContact O-N 2.83Å; P937-L940 PolarHBondContact O-N 3.49Å; P937-S941 WeakPolarHBondContact O-CB 3.33Å; P937-S941 PolarHBondContact O-N 3.25Å
938T55.4Low59.1Low65 Ų6578.2 Ų78.240%0.39941%0.41SS..Hα-helixtrans-50.9-36.6170.141.90000113.8T936 S941 N942T936-T938 WeakPolarHBondContact CB-OG1 3.36Å; T936-T938 PolarHBondContact O-N 3.31Å; T936-T938 PolarHBondContact O-OG1 3.46Å; T936-T938 PolarHBondContact OG1-OG1 2.91Å; T938-S941 PolarHBondContact O-N 3.18Å; T938-N942 VanDerWaalsContact O-CB 3.24Å; T938-N942 WeakPolarHBondContact O-CB 3.28Å; T938-N942 PolarHBondContact O-N 2.93Å; T938-N942 PolarHBondContact O-ND2 2.88Å
939D61.7Low59.3Low83 Ų8381.9 Ų81.944%0.44443%0.427SS..Hα-helixtrans-67.5-47.5-178.4-63.5-19000110.6T935 T936 P937 N942 E943T935-D939 WeakPolarHBondContact CB-OD2 3.33Å; T935-D939 WeakPolarHBondContact CG2-OD2 3.3Å; T936-D939 PolarHBondContact O-N 3.35Å; T936-D939 VanDerWaalsContact O-N 3.17Å; P937-D939 PolarHBondContact O-N 2.83Å; D939-N942 PolarHBondContact O-N 3.47Å; D939-E943 PolarHBondContact O-N 3.42Å; D939-E943 VanDerWaalsContact O-N 3.11Å
940L66.3Low60.1Low17 Ų1777.3 Ų77.39%0.08940%0.403CS..Hα-helixtrans-68-37175.9-174.262.7000112.1K921 F925 P937 N942 E943 L944 L984K921-L940 HydrophobicContact CB-CD1 3.75Å; F925-L940 HydrophobicContact CB-CD2 3.73Å; F925-L940 HydrophobicContact CD1-CD2 4.22Å; F925-L940 HydrophobicContact CD2-CD2 4.39Å; F925-L940 HydrophobicContact CG-CD2 3.87Å; P937-L940 PolarHBondContact O-N 3.49Å; L940-N942 VanDerWaalsContact C-N 3.32Å; L940-N942 PolarHBondContact O-N 2.81Å; L940-E943 PolarHBondContact O-N 3.42Å; L940-L944 HydrophobicContact CG-CD1 4.26Å; L940-L944 WeakPolarHBondContact O-CB 3.1Å; L940-L944 WeakPolarHBondContact O-CG 3Å; L940-L944 PolarHBondContact O-N 3.05Å; L940-L984 HydrophobicContact CD2-CD1 3.82Å; L940-L984 HydrophobicContact CD2-CD2 4.14Å; L940-L984 HydrophobicContact CG-CD1 4.2Å
941S64.6Low61Low0 Ų071.5 Ų71.50%038%0.378CS..Hα-helixtrans-65-36.2174.9-1500000111.5P937 T938 L944 K945 S987 D991P937-S941 WeakPolarHBondContact O-CB 3.33Å; P937-S941 PolarHBondContact O-N 3.25Å; T938-S941 PolarHBondContact O-N 3.18Å; S941-L944 PolarHBondContact O-N 3.47Å; S941-K945 WeakPolarHBondContact O-CG 3.22Å; S941-K945 PolarHBondContact O-N 2.91Å; S941-S987 WeakPolarHBondContact OG-CB 3.44Å; S941-S987 PolarHBondContact OG-OG 3.27Å; S941-D991 WeakPolarHBondContact CB-OD2 3.33Å; S941-D991 PolarHBondContact OG-OD2 2.94Å
942N67.9Low62.4Low73 Ų7368.7 Ų68.739%0.3936%0.36SS..Hα-helixtrans-71.8-27.7174.9-73.8-29.2000113.6T938 D939 L940 K945T938-N942 VanDerWaalsContact O-CB 3.24Å; T938-N942 WeakPolarHBondContact O-CB 3.28Å; T938-N942 PolarHBondContact O-N 2.93Å; T938-N942 PolarHBondContact O-ND2 2.88Å; D939-N942 PolarHBondContact O-N 3.47Å; L940-N942 VanDerWaalsContact C-N 3.32Å; L940-N942 PolarHBondContact O-N 2.81Å; N942-K945 PolarHBondContact OD1-NZ 3.31Å
943E68Low63.8Low58 Ų5865.1 Ų65.127%0.27134%0.335SS..Hα-helixtrans-73.2-42.2167-69.1-169.2-174.400111.4I918 K921 D939 L940 K945 Q946I918-E943 HydrophobicContact CD1-CB 4.38Å; I918-E943 HydrophobicContact CG1-CB 4.41Å; K921-E943 WeakPolarHBondContact CD-OE2 3.47Å; K921-E943 WeakPolarHBondContact CE-OE2 3.38Å; K921-E943 IonicContact NZ-OE1 2.68Å; K921-E943 PolarHBondContact NZ-OE1 2.84Å; K921-E943 IonicContact NZ-OE2 3.93Å; K921-E943 PolarHBondContact NZ-OE2 3.33Å; D939-E943 PolarHBondContact O-N 3.42Å; D939-E943 VanDerWaalsContact O-N 3.11Å; L940-E943 PolarHBondContact O-N 3.42Å; E943-K945 VanDerWaalsContact C-N 3.26Å; E943-K945 PolarHBondContact O-N 3.04Å; E943-Q946 WeakPolarHBondContact O-CB 3.49Å; E943-Q946 PolarHBondContact O-N 2.98Å
944L67.5Low65.5Low0 Ų062.4 Ų62.40%032%0.321CS..Hα-helixtrans-60.5-33176-75.4164000112.6I918 L940 S941 Q946 T947 P950 I953 I954 L984 V988I918-L944 HydrophobicContact CG2-CD2 3.73Å; I918-L944 HydrophobicContact CG2-CG 4.16Å; L940-L944 HydrophobicContact CG-CD1 4.26Å; L940-L944 WeakPolarHBondContact O-CB 3.1Å; L940-L944 WeakPolarHBondContact O-CG 3Å; L940-L944 PolarHBondContact O-N 3.05Å; S941-L944 PolarHBondContact O-N 3.47Å; L944-Q946 PolarHBondContact O-N 3.13Å; L944-Q946 VanDerWaalsContact O-N 3.13Å; L944-T947 WeakPolarHBondContact O-CB 3.15Å; L944-T947 PolarHBondContact O-N 3.15Å; L944-T947 PolarHBondContact O-OG1 3.39Å; L944-P950 HydrophobicContact CB-CB 3.99Å; L944-P950 HydrophobicContact CD2-CB 4.07Å; L944-I953 HydrophobicContact CD2-CB 4.13Å; L944-I953 HydrophobicContact CD2-CD1 4.18Å; L944-I953 HydrophobicContact CD2-CG2 4.17Å; L944-I954 HydrophobicContact CD1-CD1 4.24Å; L944-I954 HydrophobicContact CD1-CG1 4.3Å; L944-L984 HydrophobicContact CD1-CD1 3.94Å; L944-L984 HydrophobicContact CD1-CG 4.39Å; L944-V988 HydrophobicContact CB-CG2 4.37Å; L944-V988 HydrophobicContact CD1-CG2 3.91Å
945K65.2Low67.1Low84 Ų8452.8 Ų52.837%0.36528%0.279SS..THydrogen-bonded Turntrans-55.7-21.3170.1-78.6175.6-168.4162.80114.9S941 N942 E943 D991 H992S941-K945 WeakPolarHBondContact O-CG 3.22Å; S941-K945 PolarHBondContact O-N 2.91Å; N942-K945 PolarHBondContact OD1-NZ 3.31Å; E943-K945 VanDerWaalsContact C-N 3.26Å; E943-K945 PolarHBondContact O-N 3.04Å; K945-D991 WeakPolarHBondContact CE-OD1 3.45Å; K945-D991 VanDerWaalsContact NZ-CG 3.29Å; K945-D991 IonicContact NZ-OD1 3.55Å; K945-D991 PolarHBondContact NZ-OD1 2.67Å; K945-D991 IonicContact NZ-OD2 3.62Å; K945-H992 WeakPolarHBondContact CA-NE2 3.45Å
946Q66.5Low68.8Low132 Ų13249.9 Ų49.962%0.61726%0.263SS*.THydrogen-bonded Turntrans-85.91.8177.5-54.8-177.217.700112.4E943 L944E943-Q946 WeakPolarHBondContact O-CB 3.49Å; E943-Q946 PolarHBondContact O-N 2.98Å; L944-Q946 PolarHBondContact O-N 3.13Å; L944-Q946 VanDerWaalsContact O-N 3.13Å
947T66.5Low70.3Confident23 Ų2345.6 Ų45.614%0.14124%0.236CC..SBendtrans-118.1137.9-175.675.20000110.8I918 L944 M949 I953I918-T947 HydrophobicContact CD1-CG2 3.57Å; L944-T947 WeakPolarHBondContact O-CB 3.15Å; L944-T947 PolarHBondContact O-N 3.15Å; L944-T947 PolarHBondContact O-OG1 3.39Å; T947-M949 PolarHBondContact O-N 3.12Å; T947-I953 HydrophobicContact CG2-CD1 3.68Å; T947-I953 WeakPolarHBondContact OG1-CD1 3.29Å
948N69.7Low71.6Confident162 Ų16243.9 Ų43.987%0.86623%0.225SC*.SBendtrans-70.5-14.7-179.5-68.3-8.1000113.7
949M73.6Confident72.8Confident84 Ų8442.3 Ų42.341%0.41421%0.214SC..  trans-136.857.6-171.1-62-64.2-73.100112.2T947 I951 Q952 I953T947-M949 PolarHBondContact O-N 3.12Å; M949-I951 PolarHBondContact O-N 2.98Å; M949-Q952 HydrophobicContact CB-CB 3.91Å; M949-Q952 HydrophobicContact CE-CB 4.41Å; M949-Q952 VanDerWaalsContact CE-OE1 3.3Å; M949-Q952 WeakPolarHBondContact O-CB 3.43Å; M949-Q952 PolarHBondContact O-N 3.38Å; M949-Q952 VanDerWaalsContact O-N 3.11Å; M949-I953 PolarHBondContact O-N 2.94Å
950P76.1Confident73.6Confident5 Ų539.2 Ų39.23%0.03220%0.2CC..Hα-helixtrans-62.5-41.2-170.527.1-37.2000112.7L944 Q952 I953 I954 V988L944-P950 HydrophobicContact CB-CB 3.99Å; L944-P950 HydrophobicContact CD2-CB 4.07Å; P950-Q952 VanDerWaalsContact C-N 3.29Å; P950-Q952 PolarHBondContact O-N 3.39Å; P950-I953 WeakPolarHBondContact O-CB 3.25Å; P950-I953 PolarHBondContact O-N 3.42Å; P950-I953 VanDerWaalsContact O-N 3.16Å; P950-I954 WeakPolarHBondContact O-CG1 3.21Å; P950-I954 PolarHBondContact O-N 3.2Å; P950-I954 VanDerWaalsContact O-N 3.09Å; P950-V988 HydrophobicContact CB-CG1 3.9Å; P950-V988 HydrophobicContact CB-CG2 4.26Å; P950-V988 HydrophobicContact CG-CG1 3.68Å
951I76.6Confident74.1Confident3 Ų338.8 Ų38.82%0.01520%0.198CC..Hα-helixtrans-62.4-38.2177.5-60.1158000110.5M949 I953 I954 L955 V988 I994 C999 Q1002M949-I951 PolarHBondContact O-N 2.98Å; I951-I953 VanDerWaalsContact C-N 3.32Å; I951-I953 PolarHBondContact O-N 2.97Å; I951-I954 PolarHBondContact O-N 2.91Å; I951-L955 HydrophobicContact CG2-CD1 3.68Å; I951-L955 HydrophobicContact CG2-CG 4.33Å; I951-L955 WeakPolarHBondContact O-CB 3.45Å; I951-L955 VanDerWaalsContact O-CG 3.26Å; I951-L955 WeakPolarHBondContact O-CG 3.47Å; I951-L955 PolarHBondContact O-N 3.35Å; I951-V988 HydrophobicContact CG1-CG1 3.98Å; I951-I994 HydrophobicContact CD1-CD1 4.29Å; I951-I994 HydrophobicContact CD1-CG2 4.18Å; I951-C999 HydrophobicContact CD1-CB 4.44Å; I951-C999 VanDerWaalsContact CD1-SG 3.58Å; I951-Q1002 HydrophobicContact CG2-CB 3.97Å
952Q78.3Confident74.5Confident99 Ų9938.9 Ų38.946%0.46320%0.198SC..Hα-helixtrans-66.7-32.3177.3-162.4-178.99.800112.3M949 P950 S956M949-Q952 HydrophobicContact CB-CB 3.91Å; M949-Q952 HydrophobicContact CE-CB 4.41Å; M949-Q952 VanDerWaalsContact CE-OE1 3.3Å; M949-Q952 WeakPolarHBondContact O-CB 3.43Å; M949-Q952 PolarHBondContact O-N 3.38Å; M949-Q952 VanDerWaalsContact O-N 3.11Å; P950-Q952 VanDerWaalsContact C-N 3.29Å; P950-Q952 PolarHBondContact O-N 3.39Å; Q952-S956 VanDerWaalsContact O-CB 3.28Å; Q952-S956 WeakPolarHBondContact O-CB 3.32Å; Q952-S956 PolarHBondContact O-N 2.92Å; Q952-S956 PolarHBondContact O-OG 3.01Å
953I78Confident74.7Confident2 Ų238.4 Ų38.41%0.0120%0.198CC..Hα-helixtrans-69.5-41.7173.2-62.6167.2000110.8Y915 I918 Q919 L944 T947 M949 P950 I951 L955 S956 S957Y915-I953 HydrophobicContact CD2-CD1 4.14Å; Y915-I953 HydrophobicContact CD2-CG1 3.94Å; Y915-I953 HydrophobicContact CE2-CD1 4.11Å; Y915-I953 HydrophobicContact CE2-CG1 3.42Å; Y915-I953 VanDerWaalsContact CE2-CG1 3.42Å; I918-I953 HydrophobicContact CG2-CD1 4.5Å; I918-I953 HydrophobicContact CG2-CG2 4.1Å; Q919-I953 HydrophobicContact CB-CG2 4.27Å; L944-I953 HydrophobicContact CD2-CB 4.13Å; L944-I953 HydrophobicContact CD2-CD1 4.18Å; L944-I953 HydrophobicContact CD2-CG2 4.17Å; T947-I953 HydrophobicContact CG2-CD1 3.68Å; T947-I953 WeakPolarHBondContact OG1-CD1 3.29Å; M949-I953 PolarHBondContact O-N 2.94Å; P950-I953 WeakPolarHBondContact O-CB 3.25Å; P950-I953 PolarHBondContact O-N 3.42Å; P950-I953 VanDerWaalsContact O-N 3.16Å; I951-I953 VanDerWaalsContact C-N 3.32Å; I951-I953 PolarHBondContact O-N 2.97Å; I953-L955 VanDerWaalsContact C-N 3.34Å; I953-L955 PolarHBondContact O-N 3.44Å; I953-S956 PolarHBondContact O-N 3.45Å; I953-S956 PolarHBondContact O-OG 3.01Å; I953-S957 VanDerWaalsContact O-CB 3.3Å; I953-S957 WeakPolarHBondContact O-CB 3.27Å; I953-S957 PolarHBondContact O-N 2.88Å; I953-S957 PolarHBondContact O-OG 3.31Å
954I79.5Confident74.9Confident0 Ų036.4 Ų36.40%019%0.191CC..Hα-helixtrans-62.5-43.6176.2-63165000110.4L944 P950 I951 S957 L958 F981 L984 V988L944-I954 HydrophobicContact CD1-CD1 4.24Å; L944-I954 HydrophobicContact CD1-CG1 4.3Å; P950-I954 WeakPolarHBondContact O-CG1 3.21Å; P950-I954 PolarHBondContact O-N 3.2Å; P950-I954 VanDerWaalsContact O-N 3.09Å; I951-I954 PolarHBondContact O-N 2.91Å; I954-S957 WeakPolarHBondContact O-CB 3.4Å; I954-S957 PolarHBondContact O-N 2.89Å; I954-L958 PolarHBondContact O-N 3.05Å; I954-F981 HydrophobicContact CG2-CD2 3.78Å; I954-F981 HydrophobicContact CG2-CE2 3.63Å; I954-L984 HydrophobicContact CD1-CD2 4.11Å; I954-L984 HydrophobicContact CD1-CG 3.77Å; I954-L984 HydrophobicContact CG1-CD2 3.82Å; I954-L984 HydrophobicContact CG1-CG 4.07Å; I954-L984 HydrophobicContact CG2-CD2 4.24Å; I954-V988 HydrophobicContact CD1-CG2 3.86Å
955L81.7Confident74.5Confident7 Ų745.7 Ų45.74%0.03723%0.231CC..Hα-helixtrans-73.6-32.3179.6-66.8168.5000112.9I951 I953 N959 F981 Q1002 W1006I951-L955 HydrophobicContact CG2-CD1 3.68Å; I951-L955 HydrophobicContact CG2-CG 4.33Å; I951-L955 WeakPolarHBondContact O-CB 3.45Å; I951-L955 VanDerWaalsContact O-CG 3.26Å; I951-L955 WeakPolarHBondContact O-CG 3.47Å; I951-L955 PolarHBondContact O-N 3.35Å; I953-L955 VanDerWaalsContact C-N 3.34Å; I953-L955 PolarHBondContact O-N 3.44Å; L955-N959 WeakPolarHBondContact O-CB 3.32Å; L955-N959 PolarHBondContact O-N 2.96Å; L955-F981 HydrophobicContact CD2-CE2 4.06Å; L955-F981 HydrophobicContact CD2-CZ 3.89Å; L955-Q1002 HydrophobicContact CD1-CB 4.41Å; L955-W1006 HydrophobicContact CB-CB 4.43Å; L955-W1006 HydrophobicContact CB-CD2 4.28Å; L955-W1006 HydrophobicContact CB-CG 3.87Å; L955-W1006 HydrophobicContact CD1-CB 3.83Å; L955-W1006 HydrophobicContact CD1-CG 4.17Å; L955-W1006 HydrophobicContact CD2-CB 4.19Å; L955-W1006 HydrophobicContact CD2-CD2 3.81Å; L955-W1006 HydrophobicContact CD2-CE3 3.95Å; L955-W1006 HydrophobicContact CD2-CG 3.91Å; L955-W1006 HydrophobicContact CG-CB 4.38Å; L955-W1006 HydrophobicContact CG-CG 4.2Å; L955-W1006 PolarHBondContact O-NE1 3.11Å; L955-W1006 VanDerWaalsContact O-NE1 3.08Å
956S80.2Confident74.1Confident24 Ų2443.5 Ų43.517%0.16822%0.224CC..Hα-helixtrans-70.3-34.9171.574.50000111.9Y915 Q919 Q952 I953 N959 A960Y915-S956 PolarHBondContact OH-OG 3.21Å; Q919-S956 VanDerWaalsContact NE2-C 3.34Å; Q919-S956 PolarHBondContact NE2-O 3.16Å; Q919-S956 VanDerWaalsContact NE2-O 3.14Å; Q919-S956 PolarHBondContact NE2-OG 2.78Å; Q952-S956 VanDerWaalsContact O-CB 3.28Å; Q952-S956 WeakPolarHBondContact O-CB 3.32Å; Q952-S956 PolarHBondContact O-N 2.92Å; Q952-S956 PolarHBondContact O-OG 3.01Å; I953-S956 PolarHBondContact O-N 3.45Å; I953-S956 PolarHBondContact O-OG 3.01Å; S956-N959 PolarHBondContact O-N 2.93Å; S956-A960 WeakPolarHBondContact O-CB 3.34Å; S956-A960 PolarHBondContact O-N 3.18Å
957S79.6Confident74Confident0 Ų038 Ų380%020%0.198CC..Hα-helixtrans-61.7-48.8170.6-58.90000111.8Q919 C922 I953 I954 N959 A960 I961Q919-S957 WeakPolarHBondContact CG-OG 3.49Å; Q919-S957 PolarHBondContact O-OG 3.16Å; C922-S957 VanDerWaalsContact CB-OG 3.22Å; C922-S957 WeakPolarHBondContact CB-OG 3.29Å; I953-S957 VanDerWaalsContact O-CB 3.3Å; I953-S957 WeakPolarHBondContact O-CB 3.27Å; I953-S957 PolarHBondContact O-N 2.88Å; I953-S957 PolarHBondContact O-OG 3.31Å; I954-S957 WeakPolarHBondContact O-CB 3.4Å; I954-S957 PolarHBondContact O-N 2.89Å; S957-N959 PolarHBondContact O-N 2.93Å; S957-A960 PolarHBondContact O-N 3Å; S957-I961 WeakPolarHBondContact O-CG1 3.27Å; S957-I961 PolarHBondContact O-N 3.35Å
958L80.8Confident73.5Confident0 Ų041.4 Ų41.40%021%0.214CC..Hα-helixtrans-60.9-42.6176-176.663.9000111.7I954 A960 I961 L962 M977 F981 W1006 V1026I954-L958 PolarHBondContact O-N 3.05Å; L958-A960 PolarHBondContact O-N 2.95Å; L958-I961 PolarHBondContact O-N 3.3Å; L958-L962 HydrophobicContact CD1-CD1 4.14Å; L958-L962 HydrophobicContact CD1-CG 4.4Å; L958-L962 HydrophobicContact CG-CD1 3.93Å; L958-L962 WeakPolarHBondContact O-CB 3.49Å; L958-L962 VanDerWaalsContact O-CG 3.29Å; L958-L962 WeakPolarHBondContact O-CG 3.45Å; L958-L962 PolarHBondContact O-N 2.86Å; L958-M977 HydrophobicContact CD1-CE 3.7Å; L958-M977 HydrophobicContact CD1-SD 4.1Å; L958-F981 HydrophobicContact CB-CE2 4.49Å; L958-F981 HydrophobicContact CD2-CD2 4.11Å; L958-F981 HydrophobicContact CD2-CE2 3.69Å; L958-F981 HydrophobicContact CD2-CZ 4.22Å; L958-W1006 HydrophobicContact CB-CH2 4.5Å; L958-W1006 HydrophobicContact CB-CZ2 4.32Å; L958-W1006 HydrophobicContact CD2-CH2 3.46Å; L958-W1006 VanDerWaalsContact CD2-CH2 3.46Å; L958-W1006 HydrophobicContact CD2-CZ2 4.06Å; L958-W1006 HydrophobicContact CD2-CZ3 3.78Å; L958-W1006 HydrophobicContact CG-CH2 3.81Å; L958-W1006 HydrophobicContact CG-CZ2 4.1Å; L958-V1026 HydrophobicContact CD2-CG1 3.96Å
959N81.6Confident72.8Confident32 Ų3238.7 Ų38.717%0.17120%0.2CC..Hα-helixtrans-60.4-43.3173.3171.793.2000112.1L955 S956 S957 L962 T963 W1006 T1010L955-N959 WeakPolarHBondContact O-CB 3.32Å; L955-N959 PolarHBondContact O-N 2.96Å; S956-N959 PolarHBondContact O-N 2.93Å; S957-N959 PolarHBondContact O-N 2.93Å; N959-L962 PolarHBondContact O-N 3.13Å; N959-T963 WeakPolarHBondContact O-CB 3.33Å; N959-T963 WeakPolarHBondContact O-CG2 3.43Å; N959-T963 PolarHBondContact O-N 3.3Å; N959-T963 PolarHBondContact O-OG1 2.82Å; N959-W1006 HydrophobicContact CB-CZ2 4.06Å; N959-T1010 HydrophobicContact CB-CG2 4.43Å; N959-T1010 VanDerWaalsContact OD1-CG2 3.24Å; N959-T1010 WeakPolarHBondContact OD1-CG2 3.26Å
960A77.9Confident71.9Confident19 Ų1935.4 Ų35.416%0.15719%0.185CC..Hα-helixtrans-62.9-42.8178.900000111.7I923 S956 S957 L958 S964I923-A960 HydrophobicContact CD1-CB 3.8Å; S956-A960 WeakPolarHBondContact O-CB 3.34Å; S956-A960 PolarHBondContact O-N 3.18Å; S957-A960 PolarHBondContact O-N 3Å; L958-A960 PolarHBondContact O-N 2.95Å; A960-S964 WeakPolarHBondContact O-CB 3.48Å; A960-S964 PolarHBondContact O-N 3.09Å
961I76Confident70.8Confident7 Ų739.5 Ų39.54%0.03621%0.211CC..Hα-helixtrans-59.4-52.7174-67.4165.4000110.7I923 L926 L927 S957 L958 T963 S964 M977I923-I961 HydrophobicContact CG1-CD1 4.43Å; I923-I961 HydrophobicContact CG1-CG1 4.3Å; I923-I961 HydrophobicContact CG2-CD1 4.29Å; I923-I961 HydrophobicContact CG2-CG1 3.96Å; L926-I961 HydrophobicContact CB-CD1 3.71Å; L926-I961 HydrophobicContact CD1-CD1 3.8Å; L926-I961 HydrophobicContact CG-CD1 4.42Å; L927-I961 HydrophobicContact CD1-CG1 4.21Å; L927-I961 HydrophobicContact CD2-CD1 4.24Å; L927-I961 HydrophobicContact CD2-CG1 4.36Å; L927-I961 HydrophobicContact CD2-CG2 3.95Å; L927-I961 HydrophobicContact CG-CD1 4.01Å; L927-I961 HydrophobicContact CG-CG1 4.19Å; S957-I961 WeakPolarHBondContact O-CG1 3.27Å; S957-I961 PolarHBondContact O-N 3.35Å; L958-I961 PolarHBondContact O-N 3.3Å; I961-T963 VanDerWaalsContact C-N 3.31Å; I961-T963 PolarHBondContact O-N 2.77Å; I961-S964 PolarHBondContact O-N 3.36Å; I961-S964 PolarHBondContact O-OG 3Å; I961-M977 HydrophobicContact CD1-SD 4.36Å; I961-M977 HydrophobicContact CG2-SD 4.18Å
962L74.1Confident69.5Low2 Ų246.1 Ų46.11%0.0125%0.246CC..Hα-helixtrans-67.1-28.3-175.4-69.3169.3000113.7L958 N959 W1006 F1014 Q1019 I1022 A1023L958-L962 HydrophobicContact CD1-CD1 4.14Å; L958-L962 HydrophobicContact CD1-CG 4.4Å; L958-L962 HydrophobicContact CG-CD1 3.93Å; L958-L962 WeakPolarHBondContact O-CB 3.49Å; L958-L962 VanDerWaalsContact O-CG 3.29Å; L958-L962 WeakPolarHBondContact O-CG 3.45Å; L958-L962 PolarHBondContact O-N 2.86Å; N959-L962 PolarHBondContact O-N 3.13Å; L962-W1006 HydrophobicContact CD1-CH2 3.92Å; L962-W1006 HydrophobicContact CD1-CZ2 4.45Å; L962-F1014 HydrophobicContact CB-CE1 3.9Å; L962-F1014 HydrophobicContact CD1-CE1 3.9Å; L962-F1014 HydrophobicContact CD1-CZ 3.79Å; L962-Q1019 WeakPolarHBondContact O-CG 3.39Å; L962-Q1019 PolarHBondContact O-NE2 2.88Å; L962-I1022 HydrophobicContact CD2-CB 3.9Å; L962-I1022 HydrophobicContact CD2-CD1 4.14Å; L962-I1022 HydrophobicContact CD2-CG2 3.81Å; L962-A1023 HydrophobicContact CD1-CB 3.9Å
963T72.1Confident68.3Low63 Ų6342.2 Ų42.239%0.38723%0.228SC..Hα-helixtrans-95.3-5.6178.8560000113.9N959 I961N959-T963 WeakPolarHBondContact O-CB 3.33Å; N959-T963 WeakPolarHBondContact O-CG2 3.43Å; N959-T963 PolarHBondContact O-N 3.3Å; N959-T963 PolarHBondContact O-OG1 2.82Å; I961-T963 VanDerWaalsContact C-N 3.31Å; I961-T963 PolarHBondContact O-N 2.77Å
964S71.8Confident67.5Low16 Ų1644 Ų4411%0.11224%0.238CC..SBendtrans-64.8146.3172.273.90000111.5A960 I961 N966 Y967A960-S964 WeakPolarHBondContact O-CB 3.48Å; A960-S964 PolarHBondContact O-N 3.09Å; I961-S964 PolarHBondContact O-N 3.36Å; I961-S964 PolarHBondContact O-OG 3Å; S964-N966 VanDerWaalsContact C-N 3.29Å; S964-N966 PolarHBondContact O-N 2.84Å; S964-Y967 VanDerWaalsContact O-CD1 3.23Å; S964-Y967 WeakPolarHBondContact O-CD1 3.33Å
965F58.9Low66.8Low196 Ų19651.9 Ų51.986%0.8627%0.272SS*.THydrogen-bonded Turntrans-71.6-22.2-176.1-130.2-87.9000113.6
966N57.7Low66.1Low38 Ų3852 Ų5220%0.20327%0.273CS..THydrogen-bonded Turntrans-92.9-5-171.3-73.6-26.1000115L891 D894 S964 L968 N969L891-N966 HydrophobicContact CD2-CB 3.6Å; L891-N966 HydrophobicContact CG-CB 3.99Å; D894-N966 PolarHBondContact OD2-ND2 3.47Å; S964-N966 VanDerWaalsContact C-N 3.29Å; S964-N966 PolarHBondContact O-N 2.84Å; N966-L968 PolarHBondContact O-N 3.26Å; N966-L968 VanDerWaalsContact O-N 3.08Å; N966-N969 WeakPolarHBondContact O-CB 3.5Å; N966-N969 PolarHBondContact O-N 3.36Å; N966-N969 PolarHBondContact O-ND2 3.44Å
967Y63.2Low65.7Low17 Ų1751 Ų517%0.06727%0.266CS..G310 helixtrans-55.7-30.8-172.381.8-71.6000114.4S964 N969 C970 E1016 T1018 Q1019 I1022S964-Y967 VanDerWaalsContact O-CD1 3.23Å; S964-Y967 WeakPolarHBondContact O-CD1 3.33Å; Y967-N969 PolarHBondContact O-N 2.97Å; Y967-N969 VanDerWaalsContact O-N 3.11Å; Y967-C970 PolarHBondContact O-N 2.96Å; Y967-E1016 WeakPolarHBondContact OH-CB 3.48Å; Y967-E1016 PolarHBondContact OH-OE1 2.99Å; Y967-E1016 PolarHBondContact OH-OE2 2.72Å; Y967-T1018 PolarHBondContact OH-OG1 3.4Å; Y967-Q1019 HydrophobicContact CD2-CG 4.42Å; Y967-Q1019 HydrophobicContact CE1-CG 4.27Å; Y967-Q1019 HydrophobicContact CE2-CG 3.66Å; Y967-I1022 HydrophobicContact CD2-CD1 4.32Å; Y967-I1022 HydrophobicContact CE2-CD1 4.45Å
968L56.4Low65.5Low93 Ų9353 Ų5349%0.48728%0.277SS..G310 helixtrans-55.8-25.7176.9-77.3166.2000113.7N966 C970N966-L968 PolarHBondContact O-N 3.26Å; N966-L968 VanDerWaalsContact O-N 3.08Å; L968-C970 VanDerWaalsContact C-N 3.31Å; L968-C970 PolarHBondContact O-N 3.36Å
969N55.1Low65.1Low105 Ų10557.8 Ų57.856%0.56130%0.299SS*.G310 helixtrans-79.8-6.9-175.7-64.7-41.8000114.2V887 N966 Y967 P971V887-N969 HydrophobicContact CG1-CB 4.4Å; N966-N969 WeakPolarHBondContact O-CB 3.5Å; N966-N969 PolarHBondContact O-N 3.36Å; N966-N969 PolarHBondContact O-ND2 3.44Å; Y967-N969 PolarHBondContact O-N 2.97Å; Y967-N969 VanDerWaalsContact O-N 3.11Å; N969-P971 WeakPolarHBondContact O-CD 3.41Å
970C54.9Low64.8Low16 Ų1657.4 Ų57.411%0.10830%0.296CS..  trans-121.543.6-166.8-71.30000116.8L891 Y967 L968 L972 L973L891-C970 VanDerWaalsContact CD1-SG 3.55Å; Y967-C970 PolarHBondContact O-N 2.96Å; L968-C970 VanDerWaalsContact C-N 3.31Å; L968-C970 PolarHBondContact O-N 3.36Å; C970-L972 PolarHBondContact O-N 3.42Å; C970-L973 HydrophobicContact CB-CB 4.37Å; C970-L973 HydrophobicContact CB-CD1 4.07Å; C970-L973 PolarHBondContact O-N 3.47Å
971P52.7Low64.9Low90 Ų9056.5 Ų56.558%0.58429%0.289SS*.THydrogen-bonded Turntrans-62.8-15.1-174.227.4-36.5000115.9N969N969-P971 WeakPolarHBondContact O-CD 3.41Å
972L50.2Low64.9Low143 Ų14357 Ų5775%0.74929%0.292SS*.THydrogen-bonded Turntrans-81-39.4173.4-72.8171.2000112.8C970 L974 K975C970-L972 PolarHBondContact O-N 3.42Å; L972-L974 VanDerWaalsContact C-N 3.33Å; L972-L974 PolarHBondContact O-N 3.44Å; L972-K975 PolarHBondContact O-N 3.37Å
973L53Low65Low17 Ų1759.4 Ų59.49%0.08931%0.309CS..Hα-helixtrans-66.5-37-178.2-69.6174.1000111.5L888 L927 D929 C970 K975 S976 M977L888-L973 HydrophobicContact CD1-CD1 4.05Å; L927-L973 WeakPolarHBondContact O-CD1 3.2Å; L927-L973 WeakPolarHBondContact O-CD2 3.35Å; D929-L973 HydrophobicContact CB-CD2 4.37Å; C970-L973 HydrophobicContact CB-CB 4.37Å; C970-L973 HydrophobicContact CB-CD1 4.07Å; C970-L973 PolarHBondContact O-N 3.47Å; L973-K975 VanDerWaalsContact C-N 3.27Å; L973-K975 PolarHBondContact O-N 2.73Å; L973-S976 WeakPolarHBondContact O-CA 3.38Å; L973-S976 PolarHBondContact O-N 2.84Å; L973-S976 PolarHBondContact O-OG 2.83Å; L973-M977 PolarHBondContact O-N 3.21Å
974L61.2Low65.1Low40 Ų4056.4 Ų56.421%0.20929%0.29CS..Hα-helixtrans-45-46.8175-93.649.9000113.1L972 S976 M977 D978 I1022L972-L974 VanDerWaalsContact C-N 3.33Å; L972-L974 PolarHBondContact O-N 3.44Å; L974-S976 VanDerWaalsContact C-N 3.26Å; L974-S976 PolarHBondContact O-N 3.4Å; L974-M977 VanDerWaalsContact O-CB 3.31Å; L974-M977 WeakPolarHBondContact O-CB 3.49Å; L974-M977 PolarHBondContact O-N 3.08Å; L974-M977 VanDerWaalsContact O-N 3.11Å; L974-D978 PolarHBondContact O-N 3Å; L974-I1022 HydrophobicContact CD1-CD1 4.49Å; L974-I1022 HydrophobicContact CD2-CD1 3.46Å; L974-I1022 VanDerWaalsContact CD2-CD1 3.46Å; L974-I1022 HydrophobicContact CD2-CG1 3.67Å; L974-I1022 HydrophobicContact CG-CD1 3.95Å; L974-I1022 HydrophobicContact CG-CG1 4.05Å; L974-I1022 HydrophobicContact CG-CG2 4.39Å
975K63.1Low65.4Low164 Ų16455.7 Ų55.771%0.71329%0.285SS*.Hα-helixtrans-66.2-26179.6-74.7-169.8174.4-1740114L972 L973L972-K975 PolarHBondContact O-N 3.37Å; L973-K975 VanDerWaalsContact C-N 3.27Å; L973-K975 PolarHBondContact O-N 2.73Å
976S66.7Low66.2Low10 Ų1048.7 Ų48.77%0.0726%0.255CS..Hα-helixtrans-85.4-24.9173.878.20000112.3L973 L974 E979 K980L973-S976 WeakPolarHBondContact O-CA 3.38Å; L973-S976 PolarHBondContact O-N 2.84Å; L973-S976 PolarHBondContact O-OG 2.83Å; L974-S976 VanDerWaalsContact C-N 3.26Å; L974-S976 PolarHBondContact O-N 3.4Å; S976-E979 PolarHBondContact O-N 2.68Å; S976-K980 WeakPolarHBondContact O-CB 3.3Å; S976-K980 VanDerWaalsContact O-CG 3.26Å; S976-K980 WeakPolarHBondContact O-CG 3.36Å; S976-K980 PolarHBondContact O-N 2.79Å; S976-K980 VanDerWaalsContact O-N 3.1Å
977M73.2Confident66.8Low2 Ų247.9 Ų47.91%0.0125%0.253CS..Hα-helixtrans-64.9-40.2178.6-164.9-174.971.900111.5L926 L958 I961 L973 L974 E979 K980 F981 I1022 V1026L926-M977 HydrophobicContact CB-CG 4.11Å; L926-M977 HydrophobicContact CD2-CG 4.12Å; L958-M977 HydrophobicContact CD1-CE 3.7Å; L958-M977 HydrophobicContact CD1-SD 4.1Å; I961-M977 HydrophobicContact CD1-SD 4.36Å; I961-M977 HydrophobicContact CG2-SD 4.18Å; L973-M977 PolarHBondContact O-N 3.21Å; L974-M977 VanDerWaalsContact O-CB 3.31Å; L974-M977 WeakPolarHBondContact O-CB 3.49Å; L974-M977 PolarHBondContact O-N 3.08Å; L974-M977 VanDerWaalsContact O-N 3.11Å; M977-E979 PolarHBondContact O-N 2.72Å; M977-K980 PolarHBondContact O-N 3.15Å; M977-F981 WeakPolarHBondContact O-CB 3.22Å; M977-F981 PolarHBondContact O-N 3.21Å; M977-I1022 HydrophobicContact CE-CG2 3.42Å; M977-I1022 VanDerWaalsContact CE-CG2 3.42Å; M977-V1026 HydrophobicContact CE-CG2 3.65Å
978D74.2Confident67.3Low42 Ų4247.1 Ų47.123%0.22525%0.249CC..Hα-helixtrans-54.7-51.1175.6-64.7-15.2000111.6L974 K980 V982 V1026 K1029L974-D978 PolarHBondContact O-N 3Å; D978-K980 PolarHBondContact O-N 3.04Å; D978-V982 WeakPolarHBondContact O-CB 3.48Å; D978-V982 VanDerWaalsContact O-CG2 3.3Å; D978-V982 WeakPolarHBondContact O-CG2 3.39Å; D978-V982 PolarHBondContact O-N 3.36Å; D978-V1026 WeakPolarHBondContact OD1-CG2 3.42Å; D978-K1029 HydrophobicContact CB-CG 4.31Å
979E73.4Confident68Low101 Ų10143.2 Ų43.247%0.47223%0.23SC..Hα-helixtrans-65-38.1179-64.8177.1163.200112.2K930 S976 M977 S983K930-E979 WeakPolarHBondContact CE-OE2 3.46Å; K930-E979 IonicContact NZ-OE1 2.68Å; K930-E979 IonicContact NZ-OE2 2.74Å; K930-E979 PolarHBondContact NZ-OE2 2.95Å; S976-E979 PolarHBondContact O-N 2.68Å; M977-E979 PolarHBondContact O-N 2.72Å; E979-S983 WeakPolarHBondContact O-CB 3.42Å; E979-S983 PolarHBondContact O-N 3.32Å
980K75Confident68.7Low25 Ų2543.6 Ų43.611%0.10924%0.236CC..Hα-helixtrans-74.4-42.2-177.6-73.1175.3-175.6-174.40112.9F925 L926 S928 S976 M977 D978 V982 S983 L984F925-K980 HydrophobicContact CD1-CB 4.33Å; F925-K980 HydrophobicContact CE1-CB 3.82Å; F925-K980 HydrophobicContact CE1-CG 4.22Å; F925-K980 HydrophobicContact CZ-CB 4.5Å; F925-K980 HydrophobicContact CZ-CG 4.44Å; F925-K980 WeakPolarHBondContact O-CD 3.42Å; L926-K980 HydrophobicContact CD2-CB 4.32Å; S928-K980 PolarHBondContact O-NZ 3.25Å; S928-K980 PolarHBondContact OG-NZ 2.86Å; S976-K980 WeakPolarHBondContact O-CB 3.3Å; S976-K980 VanDerWaalsContact O-CG 3.26Å; S976-K980 WeakPolarHBondContact O-CG 3.36Å; S976-K980 PolarHBondContact O-N 2.79Å; S976-K980 VanDerWaalsContact O-N 3.1Å; M977-K980 PolarHBondContact O-N 3.15Å; D978-K980 PolarHBondContact O-N 3.04Å; K980-V982 VanDerWaalsContact C-N 3.31Å; K980-V982 PolarHBondContact O-N 3.13Å; K980-S983 PolarHBondContact O-N 2.88Å; K980-L984 WeakPolarHBondContact O-CB 3.42Å; K980-L984 PolarHBondContact O-N 2.93Å
981F80Confident69.1Low0 Ų045.5 Ų45.50%025%0.245CC..Hα-helixtrans-58.7-46.4172.3177.1-90.7000110.5L926 I954 L955 L958 M977 S983 L984 C985 V1026 I1027 L1030L926-F981 HydrophobicContact CD2-CB 3.87Å; I954-F981 HydrophobicContact CG2-CD2 3.78Å; I954-F981 HydrophobicContact CG2-CE2 3.63Å; L955-F981 HydrophobicContact CD2-CE2 4.06Å; L955-F981 HydrophobicContact CD2-CZ 3.89Å; L958-F981 HydrophobicContact CB-CE2 4.49Å; L958-F981 HydrophobicContact CD2-CD2 4.11Å; L958-F981 HydrophobicContact CD2-CE2 3.69Å; L958-F981 HydrophobicContact CD2-CZ 4.22Å; M977-F981 WeakPolarHBondContact O-CB 3.22Å; M977-F981 PolarHBondContact O-N 3.21Å; F981-S983 PolarHBondContact O-N 2.75Å; F981-L984 PolarHBondContact O-N 3.13Å; F981-C985 PolarHBondContact O-N 3.2Å; F981-C985 PolarHBondContact O-SG 3.15Å; F981-C985 VanDerWaalsContact O-SG 3.39Å; F981-V1026 HydrophobicContact CB-CG1 3.95Å; F981-V1026 HydrophobicContact CD1-CG1 3.19Å; F981-V1026 HydrophobicContact CD2-CG1 3.89Å; F981-V1026 HydrophobicContact CE1-CG1 3.48Å; F981-V1026 VanDerWaalsContact CE1-CG1 3.48Å; F981-V1026 HydrophobicContact CE2-CG1 4.15Å; F981-V1026 HydrophobicContact CG-CG1 3.4Å; F981-V1026 VanDerWaalsContact CG-CG1 3.4Å; F981-V1026 HydrophobicContact CZ-CG1 3.96Å; F981-I1027 HydrophobicContact CZ-CD1 4.49Å; F981-L1030 HydrophobicContact CE1-CB 4.2Å; F981-L1030 HydrophobicContact CE1-CD2 3.87Å
982V75.5Confident69.4Low18 Ų1843.7 Ų43.711%0.10923%0.229CC..Hα-helixtrans-58.9-48.1174.7164.10000112.1D978 K980 L984 C985 H986 K1029 L1030 T1033D978-V982 WeakPolarHBondContact O-CB 3.48Å; D978-V982 VanDerWaalsContact O-CG2 3.3Å; D978-V982 WeakPolarHBondContact O-CG2 3.39Å; D978-V982 PolarHBondContact O-N 3.36Å; K980-V982 VanDerWaalsContact C-N 3.31Å; K980-V982 PolarHBondContact O-N 3.13Å; V982-L984 PolarHBondContact O-N 2.88Å; V982-C985 PolarHBondContact O-N 3.31Å; V982-H986 WeakPolarHBondContact O-CB 3.47Å; V982-H986 PolarHBondContact O-CD2 3.49Å; V982-H986 PolarHBondContact O-N 3.19Å; V982-K1029 HydrophobicContact CG2-CB 4.4Å; V982-K1029 HydrophobicContact CG2-CG 4.02Å; V982-L1030 HydrophobicContact CG2-CB 4.12Å; V982-L1030 HydrophobicContact CG2-CD1 4.44Å; V982-T1033 HydrophobicContact CG1-CG2 3.4Å; V982-T1033 HydrophobicContact CG2-CG2 4.29Å
983S75.9Confident69.9Low51 Ų5145.8 Ų45.836%0.35724%0.235SC..Hα-helixtrans-60.9-33177.9-173.80000113E979 K980 F981 S987E979-S983 WeakPolarHBondContact O-CB 3.42Å; E979-S983 PolarHBondContact O-N 3.32Å; K980-S983 PolarHBondContact O-N 2.88Å; F981-S983 PolarHBondContact O-N 2.75Å; S983-S987 WeakPolarHBondContact O-CB 3.24Å; S983-S987 PolarHBondContact O-N 3.09Å
984L75.7Confident70.2Confident0 Ų046.9 Ų46.90%024%0.24CC..Hα-helixtrans-79.6-38.1-178.5-168.161.1000111.9F925 L940 L944 I954 K980 F981 V982 S987 V988F925-L984 HydrophobicContact CD1-CD2 4.29Å; F925-L984 HydrophobicContact CE1-CB 4.42Å; L940-L984 HydrophobicContact CD2-CD1 3.82Å; L940-L984 HydrophobicContact CD2-CD2 4.14Å; L940-L984 HydrophobicContact CG-CD1 4.2Å; L944-L984 HydrophobicContact CD1-CD1 3.94Å; L944-L984 HydrophobicContact CD1-CG 4.39Å; I954-L984 HydrophobicContact CD1-CD2 4.11Å; I954-L984 HydrophobicContact CD1-CG 3.77Å; I954-L984 HydrophobicContact CG1-CD2 3.82Å; I954-L984 HydrophobicContact CG1-CG 4.07Å; I954-L984 HydrophobicContact CG2-CD2 4.24Å; K980-L984 WeakPolarHBondContact O-CB 3.42Å; K980-L984 PolarHBondContact O-N 2.93Å; F981-L984 PolarHBondContact O-N 3.13Å; V982-L984 PolarHBondContact O-N 2.88Å; L984-S987 PolarHBondContact O-N 2.68Å; L984-S987 PolarHBondContact O-OG 3.05Å; L984-S987 VanDerWaalsContact O-OG 3.08Å; L984-V988 WeakPolarHBondContact O-CB 3.36Å; L984-V988 WeakPolarHBondContact O-CG2 3.32Å; L984-V988 PolarHBondContact O-N 2.87Å
985C78.3Confident70.5Confident1 Ų151 Ų511%0.00726%0.262CS..Hα-helixtrans-66.6-39.7171.8-68.90000112.1F981 V982 S989 L1030F981-C985 PolarHBondContact O-N 3.2Å; F981-C985 PolarHBondContact O-SG 3.15Å; F981-C985 VanDerWaalsContact O-SG 3.39Å; V982-C985 PolarHBondContact O-N 3.31Å; C985-S989 WeakPolarHBondContact O-CB 3.4Å; C985-S989 PolarHBondContact O-N 3.31Å; C985-L1030 HydrophobicContact CB-CD1 3.75Å; C985-L1030 HydrophobicContact CB-CD2 4.43Å
986H74.6Confident70.8Confident50 Ų5044.4 Ų44.423%0.23124%0.235CC..Hα-helixtrans-66.1-42.6173.3-90.4-92.6000112.2V982 S989 V990 M996 T1033V982-H986 WeakPolarHBondContact O-CB 3.47Å; V982-H986 PolarHBondContact O-CD2 3.49Å; V982-H986 PolarHBondContact O-N 3.19Å; H986-S989 PolarHBondContact O-N 3.27Å; H986-V990 WeakPolarHBondContact O-CG2 3.24Å; H986-V990 PolarHBondContact O-N 2.99Å; H986-V990 VanDerWaalsContact O-N 3.11Å; H986-M996 WeakPolarHBondContact NE2-CE 3.45Å; H986-T1033 WeakPolarHBondContact NE2-CB 3.29Å; H986-T1033 PolarHBondContact NE2-OG1 2.97Å
987S71.2Confident70.8Confident21 Ų2148 Ų4815%0.14725%0.252CS..Hα-helixtrans-61.6-48.6176.874.90000110.7S941 S983 L984 S989 V990 D991S941-S987 WeakPolarHBondContact OG-CB 3.44Å; S941-S987 PolarHBondContact OG-OG 3.27Å; S983-S987 WeakPolarHBondContact O-CB 3.24Å; S983-S987 PolarHBondContact O-N 3.09Å; L984-S987 PolarHBondContact O-N 2.68Å; L984-S987 PolarHBondContact O-OG 3.05Å; L984-S987 VanDerWaalsContact O-OG 3.08Å; S987-S989 PolarHBondContact O-N 3.26Å; S987-V990 PolarHBondContact O-N 2.87Å; S987-D991 WeakPolarHBondContact O-CB 3.5Å; S987-D991 PolarHBondContact O-N 3.08Å
988V72.8Confident70.8Confident0 Ų051.2 Ų51.20%027%0.267CS..Hα-helixtrans-59-43.8177.9166.20000112.6L944 P950 I951 I954 L984 D991 H992L944-V988 HydrophobicContact CB-CG2 4.37Å; L944-V988 HydrophobicContact CD1-CG2 3.91Å; P950-V988 HydrophobicContact CB-CG1 3.9Å; P950-V988 HydrophobicContact CB-CG2 4.26Å; P950-V988 HydrophobicContact CG-CG1 3.68Å; I951-V988 HydrophobicContact CG1-CG1 3.98Å; I954-V988 HydrophobicContact CD1-CG2 3.86Å; L984-V988 WeakPolarHBondContact O-CB 3.36Å; L984-V988 WeakPolarHBondContact O-CG2 3.32Å; L984-V988 PolarHBondContact O-N 2.87Å; V988-D991 PolarHBondContact O-N 3.11Å; V988-H992 WeakPolarHBondContact O-CB 3.46Å; V988-H992 PolarHBondContact O-N 3.36Å; V988-H992 PolarHBondContact O-ND1 3.34Å
989S71.7Confident70.8Confident11 Ų1149.3 Ų49.38%0.07726%0.257CS..Hα-helixtrans-58.5-52.4177.31730000112C985 H986 S987 D991 Q993 I994 M996C985-S989 WeakPolarHBondContact O-CB 3.4Å; C985-S989 PolarHBondContact O-N 3.31Å; H986-S989 PolarHBondContact O-N 3.27Å; S987-S989 PolarHBondContact O-N 3.26Å; S989-D991 VanDerWaalsContact C-N 3.35Å; S989-D991 PolarHBondContact O-N 2.87Å; S989-Q993 PolarHBondContact O-N 3.35Å; S989-I994 WeakPolarHBondContact CA-O 3.48Å; S989-I994 WeakPolarHBondContact CB-O 3.23Å; S989-I994 PolarHBondContact O-N 2.98Å; S989-I994 VanDerWaalsContact O-N 3.15Å; S989-I994 PolarHBondContact OG-O 2.64Å; S989-M996 VanDerWaalsContact CB-SD 3.51Å; S989-M996 WeakPolarHBondContact OG-CG 3.37Å
990V69.2Low70.8Confident114 Ų11444.7 Ų44.769%0.69124%0.235SC*.Hα-helixtrans-63.1-41.5179173.60000111.5H986 S987H986-V990 WeakPolarHBondContact O-CG2 3.24Å; H986-V990 PolarHBondContact O-N 2.99Å; H986-V990 VanDerWaalsContact O-N 3.11Å; S987-V990 PolarHBondContact O-N 2.87Å
991D62.7Low70.7Confident56 Ų5647.8 Ų47.830%0.29925%0.25SS..Hα-helixtrans-74.3-27.3-174.6-90.3-42.6000114.7S941 K945 S987 V988 S989S941-D991 WeakPolarHBondContact CB-OD2 3.33Å; S941-D991 PolarHBondContact OG-OD2 2.94Å; K945-D991 WeakPolarHBondContact CE-OD1 3.45Å; K945-D991 VanDerWaalsContact NZ-CG 3.29Å; K945-D991 IonicContact NZ-OD1 3.55Å; K945-D991 PolarHBondContact NZ-OD1 2.67Å; K945-D991 IonicContact NZ-OD2 3.62Å; S987-D991 WeakPolarHBondContact O-CB 3.5Å; S987-D991 PolarHBondContact O-N 3.08Å; V988-D991 PolarHBondContact O-N 3.11Å; S989-D991 VanDerWaalsContact C-N 3.35Å; S989-D991 PolarHBondContact O-N 2.87Å
992H59.7Low70.6Confident52 Ų5249.8 Ų49.824%0.24126%0.26CS..Hα-helixtrans-106.4-0.3-177.6-63.769.5000113.2K945 V988 I994K945-H992 WeakPolarHBondContact CA-NE2 3.45Å; V988-H992 WeakPolarHBondContact O-CB 3.46Å; V988-H992 PolarHBondContact O-N 3.36Å; V988-H992 PolarHBondContact O-ND1 3.34Å; H992-I994 HydrophobicContact CB-CB 4.39Å; H992-I994 HydrophobicContact CB-CD1 3.56Å; H992-I994 HydrophobicContact CB-CG1 3.65Å; H992-I994 PolarHBondContact O-N 3.25Å
993Q61.1Low70.8Confident187 Ų18749 Ų4987%0.87426%0.255SS*.THydrogen-bonded Turntrans55.827.9-168.8-55-179.6-7.400112.9S989S989-Q993 PolarHBondContact O-N 3.35Å
994I58.6Low70.8Confident39 Ų3947 Ų4720%0.224%0.241CC..  trans-83.7121.3175.9-67.7169.8000107.8I951 S989 H992 M996 H998I951-I994 HydrophobicContact CD1-CD1 4.29Å; I951-I994 HydrophobicContact CD1-CG2 4.18Å; S989-I994 WeakPolarHBondContact CA-O 3.48Å; S989-I994 WeakPolarHBondContact CB-O 3.23Å; S989-I994 PolarHBondContact O-N 2.98Å; S989-I994 VanDerWaalsContact O-N 3.15Å; S989-I994 PolarHBondContact OG-O 2.64Å; H992-I994 HydrophobicContact CB-CB 4.39Å; H992-I994 HydrophobicContact CB-CD1 3.56Å; H992-I994 HydrophobicContact CB-CG1 3.65Å; H992-I994 PolarHBondContact O-N 3.25Å; I994-M996 PolarHBondContact O-N 2.97Å; I994-H998 HydrophobicContact CG2-CB 3.88Å; I994-H998 WeakPolarHBondContact CG2-ND1 3.13Å
995D67.7Low71Confident126 Ų12652.7 Ų52.767%0.67427%0.267SS*.  trans-50.3131.9172.7-80.5-35.7000111.3L997 H998 C999D995-L997 HydrophobicContact CB-CB 4.4Å; D995-L997 PolarHBondContact O-N 3.16Å; D995-H998 WeakPolarHBondContact O-CB 3.45Å; D995-H998 PolarHBondContact O-N 2.88Å; D995-C999 PolarHBondContact O-N 2.8Å
996M68.9Low71.2Confident27 Ų2754 Ų5413%0.13327%0.272CS..Hα-helixtrans-53.4-27.4174.4-83.1-66.6-65.700112.5H986 S989 I994 H998 C999 Y1000 L1030H986-M996 WeakPolarHBondContact NE2-CE 3.45Å; S989-M996 VanDerWaalsContact CB-SD 3.51Å; S989-M996 WeakPolarHBondContact OG-CG 3.37Å; I994-M996 PolarHBondContact O-N 2.97Å; M996-H998 VanDerWaalsContact C-N 3.32Å; M996-H998 PolarHBondContact O-N 2.83Å; M996-C999 WeakPolarHBondContact O-CB 3.35Å; M996-C999 PolarHBondContact O-N 3.3Å; M996-Y1000 HydrophobicContact CB-CE2 4.41Å; M996-Y1000 HydrophobicContact CE-CD1 4.33Å; M996-Y1000 HydrophobicContact CE-CE1 3.47Å; M996-Y1000 VanDerWaalsContact CE-CE1 3.47Å; M996-Y1000 WeakPolarHBondContact O-CD2 3.27Å; M996-Y1000 PolarHBondContact O-N 3.15Å; M996-L1030 HydrophobicContact CE-CD1 4Å
997L68.3Low71.4Confident84 Ų8451.6 Ų51.644%0.4426%0.261SS..Hα-helixtrans-58.8-39.3172.9-176.262.7000112.9D995 Y1000 Q1001D995-L997 HydrophobicContact CB-CB 4.4Å; D995-L997 PolarHBondContact O-N 3.16Å; L997-Y1000 WeakPolarHBondContact O-CB 3.5Å; L997-Y1000 PolarHBondContact O-N 3.16Å; L997-Q1001 WeakPolarHBondContact O-CB 3.16Å; L997-Q1001 VanDerWaalsContact O-CG 3.26Å; L997-Q1001 WeakPolarHBondContact O-CG 3.43Å; L997-Q1001 PolarHBondContact O-N 2.76Å
998H72.5Confident71.6Confident71 Ų7152 Ų5233%0.32926%0.261SS..Hα-helixtrans-71.7-38.7176.1178.1-108000111.4I994 D995 M996 Y1000 Q1001 Q1002I994-H998 HydrophobicContact CG2-CB 3.88Å; I994-H998 WeakPolarHBondContact CG2-ND1 3.13Å; D995-H998 WeakPolarHBondContact O-CB 3.45Å; D995-H998 PolarHBondContact O-N 2.88Å; M996-H998 VanDerWaalsContact C-N 3.32Å; M996-H998 PolarHBondContact O-N 2.83Å; H998-Y1000 VanDerWaalsContact C-N 3.29Å; H998-Y1000 PolarHBondContact O-N 3.04Å; H998-Q1001 PolarHBondContact O-N 3.01Å; H998-Q1002 PolarHBondContact CE1-NE2 2.88Å; H998-Q1002 PolarHBondContact NE2-NE2 3.19Å; H998-Q1002 PolarHBondContact O-N 2.93Å
999C73.2Confident71.7Confident1 Ų156.2 Ų56.21%0.00728%0.284CS..Hα-helixtrans-57.9-42.6170-64.10000111.6I951 D995 M996 S1003I951-C999 HydrophobicContact CD1-CB 4.44Å; I951-C999 VanDerWaalsContact CD1-SG 3.58Å; D995-C999 PolarHBondContact O-N 2.8Å; M996-C999 WeakPolarHBondContact O-CB 3.35Å; M996-C999 PolarHBondContact O-N 3.3Å; C999-S1003 WeakPolarHBondContact O-CB 3.49Å; C999-S1003 PolarHBondContact O-N 2.98Å; C999-S1003 VanDerWaalsContact O-N 3.12Å; C999-S1003 PolarHBondContact O-OG 2.85Å
1000Y73.5Confident71.9Confident5 Ų556 Ų562%0.0228%0.282CS..Hα-helixtrans-64.1-50.5174.9-60.6-28.2000112M996 L997 H998 Q1002 S1003 T1004 L1030 L1031 Q1039M996-Y1000 HydrophobicContact CB-CE2 4.41Å; M996-Y1000 HydrophobicContact CE-CD1 4.33Å; M996-Y1000 HydrophobicContact CE-CE1 3.47Å; M996-Y1000 VanDerWaalsContact CE-CE1 3.47Å; M996-Y1000 WeakPolarHBondContact O-CD2 3.27Å; M996-Y1000 PolarHBondContact O-N 3.15Å; L997-Y1000 WeakPolarHBondContact O-CB 3.5Å; L997-Y1000 PolarHBondContact O-N 3.16Å; H998-Y1000 VanDerWaalsContact C-N 3.29Å; H998-Y1000 PolarHBondContact O-N 3.04Å; Y1000-Q1002 PolarHBondContact O-N 3.44Å; Y1000-S1003 PolarHBondContact O-N 3.4Å; Y1000-T1004 WeakPolarHBondContact O-CG2 3.36Å; Y1000-T1004 PolarHBondContact O-N 3.2Å; Y1000-T1004 PolarHBondContact O-OG1 3.15Å; Y1000-L1030 HydrophobicContact CD1-CD2 4.12Å; Y1000-L1030 HydrophobicContact CD1-CG 3.92Å; Y1000-L1030 HydrophobicContact CE1-CD1 4.18Å; Y1000-L1030 HydrophobicContact CE1-CG 3.86Å; Y1000-L1031 HydrophobicContact CD1-CD2 3.52Å; Y1000-L1031 HydrophobicContact CD2-CD2 3.97Å; Y1000-L1031 HydrophobicContact CE1-CD2 3.98Å; Y1000-L1031 HydrophobicContact CE2-CD2 4.4Å; Y1000-L1031 HydrophobicContact CG-CD2 3.49Å; Y1000-L1031 VanDerWaalsContact CG-CD2 3.49Å; Y1000-Q1039 HydrophobicContact CE2-CG 4.3Å; Y1000-Q1039 VanDerWaalsContact CZ-OE1 3.25Å; Y1000-Q1039 PolarHBondContact OH-OE1 3.46Å
1001Q73.9Confident72Confident89 Ų8950.9 Ų50.942%0.41625%0.251SS..Hα-helixtrans-55.5-52.7179.4-75.7168.9-4.100112.2L997 H998 S1003 T1004 E1005 W1042L997-Q1001 WeakPolarHBondContact O-CB 3.16Å; L997-Q1001 VanDerWaalsContact O-CG 3.26Å; L997-Q1001 WeakPolarHBondContact O-CG 3.43Å; L997-Q1001 PolarHBondContact O-N 2.76Å; H998-Q1001 PolarHBondContact O-N 3.01Å; Q1001-S1003 VanDerWaalsContact C-N 3.3Å; Q1001-S1003 PolarHBondContact O-N 3.45Å; Q1001-T1004 PolarHBondContact O-N 2.89Å; Q1001-T1004 PolarHBondContact O-OG1 3.37Å; Q1001-E1005 WeakPolarHBondContact O-CB 3.36Å; Q1001-E1005 PolarHBondContact O-N 3.38Å; Q1001-W1042 HydrophobicContact CG-CZ2 4.04Å
1002Q78.1Confident72.3Confident43 Ų4352.5 Ų52.520%0.20126%0.26CS..Hα-helixtrans-63.2-36.8178.6-69.8-160.9-8.900112.3I951 L955 H998 Y1000 W1006I951-Q1002 HydrophobicContact CG2-CB 3.97Å; L955-Q1002 HydrophobicContact CD1-CB 4.41Å; H998-Q1002 PolarHBondContact CE1-NE2 2.88Å; H998-Q1002 PolarHBondContact NE2-NE2 3.19Å; H998-Q1002 PolarHBondContact O-N 2.93Å; Y1000-Q1002 PolarHBondContact O-N 3.44Å; Q1002-W1006 VanDerWaalsContact O-CB 3.22Å; Q1002-W1006 WeakPolarHBondContact O-CB 3.48Å; Q1002-W1006 PolarHBondContact O-N 2.86Å
1003S78.6Confident72.8Confident1 Ų156.1 Ų56.11%0.00728%0.275CS..Hα-helixtrans-69.9-36.5178.7-59.40000112.5C999 Y1000 Q1001 L1007 I1027C999-S1003 WeakPolarHBondContact O-CB 3.49Å; C999-S1003 PolarHBondContact O-N 2.98Å; C999-S1003 VanDerWaalsContact O-N 3.12Å; C999-S1003 PolarHBondContact O-OG 2.85Å; Y1000-S1003 PolarHBondContact O-N 3.4Å; Q1001-S1003 VanDerWaalsContact C-N 3.3Å; Q1001-S1003 PolarHBondContact O-N 3.45Å; S1003-L1007 PolarHBondContact O-N 3.3Å; S1003-L1007 VanDerWaalsContact O-N 3.07Å; S1003-I1027 WeakPolarHBondContact O-CD1 3.26Å
1004T76.6Confident73.3Confident10 Ų1047.7 Ų47.76%0.06124%0.235CC..Hα-helixtrans-76.5-38.8176.753.40000112.7Y1000 Q1001 W1006 L1007 L1008 I1027 L1031 W1042 F1046Y1000-T1004 WeakPolarHBondContact O-CG2 3.36Å; Y1000-T1004 PolarHBondContact O-N 3.2Å; Y1000-T1004 PolarHBondContact O-OG1 3.15Å; Q1001-T1004 PolarHBondContact O-N 2.89Å; Q1001-T1004 PolarHBondContact O-OG1 3.37Å; T1004-W1006 VanDerWaalsContact C-N 3.34Å; T1004-L1007 PolarHBondContact O-N 2.67Å; T1004-L1008 WeakPolarHBondContact O-CG 3.36Å; T1004-L1008 PolarHBondContact O-N 3.1Å; T1004-I1027 HydrophobicContact CG2-CG2 4.17Å; T1004-L1031 HydrophobicContact CG2-CD1 4.42Å; T1004-W1042 HydrophobicContact CG2-CH2 3.49Å; T1004-W1042 VanDerWaalsContact CG2-CH2 3.49Å; T1004-W1042 HydrophobicContact CG2-CZ3 3.73Å; T1004-W1042 WeakPolarHBondContact OG1-CH2 3.39Å; T1004-F1046 HydrophobicContact CG2-CD1 3.66Å; T1004-F1046 HydrophobicContact CG2-CD2 3.63Å; T1004-F1046 HydrophobicContact CG2-CE1 3.58Å; T1004-F1046 HydrophobicContact CG2-CE2 3.58Å; T1004-F1046 HydrophobicContact CG2-CG 3.67Å; T1004-F1046 HydrophobicContact CG2-CZ 3.54Å
1005E78.7Confident73.6Confident118 Ų11850.2 Ų50.255%0.55125%0.252SS*.Hα-helixtrans-61.1-43.1170.2-176.9178.7-17800111.1Q1001 L1007 L1008 N1009Q1001-E1005 WeakPolarHBondContact O-CB 3.36Å; Q1001-E1005 PolarHBondContact O-N 3.38Å; E1005-L1007 VanDerWaalsContact C-N 3.31Å; E1005-L1007 PolarHBondContact O-N 3.07Å; E1005-L1008 PolarHBondContact O-N 3.15Å; E1005-N1009 WeakPolarHBondContact CG-ND2 3.46Å; E1005-N1009 WeakPolarHBondContact O-CB 3.27Å; E1005-N1009 PolarHBondContact O-N 3.1Å; E1005-N1009 PolarHBondContact O-ND2 3.48Å
1006W82.9Confident73.6Confident28 Ų2847.6 Ų47.611%0.10624%0.236CC..Hα-helixtrans-58.8-41172.6169.890.9000112.2L955 L958 N959 L962 Q1002 T1004 N1009 T1010 F1014 A1023 I1027L955-W1006 HydrophobicContact CB-CB 4.43Å; L955-W1006 HydrophobicContact CB-CD2 4.28Å; L955-W1006 HydrophobicContact CB-CG 3.87Å; L955-W1006 HydrophobicContact CD1-CB 3.83Å; L955-W1006 HydrophobicContact CD1-CG 4.17Å; L955-W1006 HydrophobicContact CD2-CB 4.19Å; L955-W1006 HydrophobicContact CD2-CD2 3.81Å; L955-W1006 HydrophobicContact CD2-CE3 3.95Å; L955-W1006 HydrophobicContact CD2-CG 3.91Å; L955-W1006 HydrophobicContact CG-CB 4.38Å; L955-W1006 HydrophobicContact CG-CG 4.2Å; L955-W1006 PolarHBondContact O-NE1 3.11Å; L955-W1006 VanDerWaalsContact O-NE1 3.08Å; L958-W1006 HydrophobicContact CB-CH2 4.5Å; L958-W1006 HydrophobicContact CB-CZ2 4.32Å; L958-W1006 HydrophobicContact CD2-CH2 3.46Å; L958-W1006 VanDerWaalsContact CD2-CH2 3.46Å; L958-W1006 HydrophobicContact CD2-CZ2 4.06Å; L958-W1006 HydrophobicContact CD2-CZ3 3.78Å; L958-W1006 HydrophobicContact CG-CH2 3.81Å; L958-W1006 HydrophobicContact CG-CZ2 4.1Å; N959-W1006 HydrophobicContact CB-CZ2 4.06Å; L962-W1006 HydrophobicContact CD1-CH2 3.92Å; L962-W1006 HydrophobicContact CD1-CZ2 4.45Å; Q1002-W1006 VanDerWaalsContact O-CB 3.22Å; Q1002-W1006 WeakPolarHBondContact O-CB 3.48Å; Q1002-W1006 PolarHBondContact O-N 2.86Å; T1004-W1006 VanDerWaalsContact C-N 3.34Å; W1006-N1009 PolarHBondContact O-N 2.86Å; W1006-T1010 HydrophobicContact CZ2-CG2 3.91Å; W1006-T1010 PolarHBondContact NE1-OG1 2.81Å; W1006-T1010 WeakPolarHBondContact O-CA 3.28Å; W1006-T1010 WeakPolarHBondContact O-CB 3.06Å; W1006-T1010 PolarHBondContact O-N 2.85Å; W1006-T1010 PolarHBondContact O-OG1 3.16Å; W1006-F1014 HydrophobicContact CH2-CZ 4.18Å; W1006-A1023 HydrophobicContact CH2-CB 4.36Å; W1006-A1023 HydrophobicContact CZ3-CB 4.44Å; W1006-I1027 HydrophobicContact CE3-CD1 4.25Å; W1006-I1027 HydrophobicContact CZ3-CD1 4.33Å; W1006-I1027 HydrophobicContact CZ3-CG1 4.39Å
1007L80Confident73.4Confident0 Ų048.5 Ų48.50%024%0.241CC..Hα-helixtrans-65.1-47.8177.8-170.867.8000110.7S1003 T1004 E1005 N1009 T1010 C1011 F1014 A1023 I1027 F1046 Y1050S1003-L1007 PolarHBondContact O-N 3.3Å; S1003-L1007 VanDerWaalsContact O-N 3.07Å; T1004-L1007 PolarHBondContact O-N 2.67Å; E1005-L1007 VanDerWaalsContact C-N 3.31Å; E1005-L1007 PolarHBondContact O-N 3.07Å; L1007-N1009 VanDerWaalsContact C-N 3.31Å; L1007-N1009 PolarHBondContact O-N 3.4Å; L1007-T1010 PolarHBondContact O-N 2.68Å; L1007-C1011 VanDerWaalsContact O-CB 3.29Å; L1007-C1011 WeakPolarHBondContact O-CB 3.42Å; L1007-C1011 PolarHBondContact O-N 3.09Å; L1007-C1011 PolarHBondContact O-SG 3.1Å; L1007-F1014 HydrophobicContact CD1-CE2 4.33Å; L1007-A1023 HydrophobicContact CD1-CB 3.56Å; L1007-I1027 HydrophobicContact CB-CG1 4.42Å; L1007-I1027 HydrophobicContact CD1-CG1 4.46Å; L1007-I1027 HydrophobicContact CD2-CB 4.38Å; L1007-I1027 HydrophobicContact CD2-CG1 4.25Å; L1007-I1027 HydrophobicContact CD2-CG2 4.39Å; L1007-F1046 HydrophobicContact CD2-CE1 4.5Å; L1007-F1046 HydrophobicContact CD2-CZ 4.02Å; L1007-Y1050 HydrophobicContact CD2-CD2 4.11Å; L1007-Y1050 HydrophobicContact CD2-CE1 4.29Å; L1007-Y1050 HydrophobicContact CD2-CE2 3.7Å; L1007-Y1050 HydrophobicContact CG-CD2 4.43Å; L1007-Y1050 HydrophobicContact CG-CE2 3.85Å
1008L74.9Confident73.3Confident31 Ų3147.2 Ų47.216%0.16224%0.237CC..Hα-helixtrans-55.9-43.4176.7-69.8163.8000112.1T1004 E1005 F1046 Y1050 H1053T1004-L1008 WeakPolarHBondContact O-CG 3.36Å; T1004-L1008 PolarHBondContact O-N 3.1Å; E1005-L1008 PolarHBondContact O-N 3.15Å; L1008-F1046 HydrophobicContact CD1-CE2 4.3Å; L1008-F1046 HydrophobicContact CG-CE2 4.25Å; L1008-Y1050 HydrophobicContact CD2-CD2 4.03Å; L1008-H1053 WeakPolarHBondContact CA-NE2 3.34Å; L1008-H1053 HydrophobicContact CD2-CB 3.7Å; L1008-H1053 VanDerWaalsContact CD2-CD2 3.43Å; L1008-H1053 WeakPolarHBondContact CD2-CD2 3.38Å; L1008-H1053 PolarHBondContact O-NE2 2.82Å
1009N75.3Confident73.2Confident88 Ų8844.3 Ų44.347%0.47122%0.223SC..Hα-helixtrans-76.9-36.4-179.7-73.9-31000113E1005 W1006 L1007E1005-N1009 WeakPolarHBondContact CG-ND2 3.46Å; E1005-N1009 WeakPolarHBondContact O-CB 3.27Å; E1005-N1009 PolarHBondContact O-N 3.1Å; E1005-N1009 PolarHBondContact O-ND2 3.48Å; W1006-N1009 PolarHBondContact O-N 2.86Å; L1007-N1009 VanDerWaalsContact C-N 3.31Å; L1007-N1009 PolarHBondContact O-N 3.4Å
1010T74.6Confident73.2Confident7 Ų744.9 Ų44.94%0.04323%0.225CC..Hα-helixtrans-86-25-173.5-55.40000113.1N959 W1006 L1007 N1012 K1013 F1014N959-T1010 HydrophobicContact CB-CG2 4.43Å; N959-T1010 VanDerWaalsContact OD1-CG2 3.24Å; N959-T1010 WeakPolarHBondContact OD1-CG2 3.26Å; W1006-T1010 HydrophobicContact CZ2-CG2 3.91Å; W1006-T1010 PolarHBondContact NE1-OG1 2.81Å; W1006-T1010 WeakPolarHBondContact O-CA 3.28Å; W1006-T1010 WeakPolarHBondContact O-CB 3.06Å; W1006-T1010 PolarHBondContact O-N 2.85Å; W1006-T1010 PolarHBondContact O-OG1 3.16Å; L1007-T1010 PolarHBondContact O-N 2.68Å; T1010-N1012 PolarHBondContact O-N 2.79Å; T1010-K1013 HydrophobicContact CG2-CD 4.41Å; T1010-K1013 WeakPolarHBondContact O-CB 3.44Å; T1010-K1013 PolarHBondContact O-N 2.84Å; T1010-F1014 HydrophobicContact CG2-CE1 3.81Å; T1010-F1014 HydrophobicContact CG2-CE2 4.45Å; T1010-F1014 HydrophobicContact CG2-CZ 3.66Å
1011C72.2Confident73Confident5 Ų546.1 Ų46.13%0.03424%0.235CC..G310 helixtrans-52.9-31178-89.80000114.1L1007 K1013 F1014 Y1020 Y1050L1007-C1011 VanDerWaalsContact O-CB 3.29Å; L1007-C1011 WeakPolarHBondContact O-CB 3.42Å; L1007-C1011 PolarHBondContact O-N 3.09Å; L1007-C1011 PolarHBondContact O-SG 3.1Å; C1011-K1013 PolarHBondContact O-N 3.46Å; C1011-K1013 VanDerWaalsContact O-N 3.11Å; C1011-F1014 HydrophobicContact CB-CD2 4.49Å; C1011-F1014 PolarHBondContact O-N 3.31Å; C1011-Y1020 HydrophobicContact CB-CD1 4.44Å; C1011-Y1020 HydrophobicContact CB-CE1 3.77Å; C1011-Y1020 VanDerWaalsContact O-CZ 3.31Å; C1011-Y1020 PolarHBondContact O-OH 3.19Å; C1011-Y1050 PolarHBondContact SG-OH 3.22Å; C1011-Y1050 VanDerWaalsContact SG-OH 3.34Å
1012N68.5Low72.8Confident91 Ų9142.8 Ų42.849%0.48722%0.22SC..G310 helixtrans-65.1-11.4175.5-68.9-72.5000115T1010 Q1057T1010-N1012 PolarHBondContact O-N 2.79Å; N1012-Q1057 PolarHBondContact ND2-OE1 3.21Å; N1012-Q1057 PolarHBondContact OD1-OE1 2.95Å; N1012-Q1057 VanDerWaalsContact OD1-OE1 3.12Å
1013K70.2Confident72.6Confident127 Ų12740.8 Ų40.855%0.55221%0.21SC*.G310 helixtrans-99.3-15.4179.9-56.3177.9-172.6167.90113.3T1010 C1011T1010-K1013 HydrophobicContact CG2-CD 4.41Å; T1010-K1013 WeakPolarHBondContact O-CB 3.44Å; T1010-K1013 PolarHBondContact O-N 2.84Å; C1011-K1013 PolarHBondContact O-N 3.46Å; C1011-K1013 VanDerWaalsContact O-N 3.11Å
1014F70.9Confident72.4Confident10 Ų1040.7 Ų40.74%0.04421%0.21CC..  trans-78.9126.9-178.8-59.7-34.5000110.5L962 W1006 L1007 T1010 C1011 Q1019 Y1020 A1023L962-F1014 HydrophobicContact CB-CE1 3.9Å; L962-F1014 HydrophobicContact CD1-CE1 3.9Å; L962-F1014 HydrophobicContact CD1-CZ 3.79Å; W1006-F1014 HydrophobicContact CH2-CZ 4.18Å; L1007-F1014 HydrophobicContact CD1-CE2 4.33Å; T1010-F1014 HydrophobicContact CG2-CE1 3.81Å; T1010-F1014 HydrophobicContact CG2-CE2 4.45Å; T1010-F1014 HydrophobicContact CG2-CZ 3.66Å; C1011-F1014 HydrophobicContact CB-CD2 4.49Å; C1011-F1014 PolarHBondContact O-N 3.31Å; F1014-Q1019 HydrophobicContact CB-CB 4Å; F1014-Q1019 HydrophobicContact CD1-CB 3.9Å; F1014-Q1019 HydrophobicContact CG-CB 3.93Å; F1014-Y1020 HydrophobicContact CB-CD2 3.57Å; F1014-Y1020 HydrophobicContact CB-CE1 4.43Å; F1014-Y1020 HydrophobicContact CB-CE2 3.37Å; F1014-Y1020 HydrophobicContact CB-CG 4.18Å; F1014-Y1020 AromaticContact CD2-CD1 3.93Å; F1014-Y1020 HydrophobicContact CD2-CD1 3.93Å; F1014-Y1020 HydrophobicContact CD2-CD2 4.25Å; F1014-Y1020 HydrophobicContact CD2-CE1 4.17Å; F1014-Y1020 HydrophobicContact CD2-CE2 4.46Å; F1014-Y1020 AromaticContact CD2-CG 4Å; F1014-Y1020 HydrophobicContact CD2-CG 4Å; F1014-Y1020 HydrophobicContact CG-CD2 4.38Å; F1014-Y1020 HydrophobicContact CG-CE2 4.44Å; F1014-Y1020 WeakPolarHBondContact O-CE2 3.43Å; F1014-A1023 HydrophobicContact CE2-CB 3.59Å; F1014-A1023 HydrophobicContact CZ-CB 3.8Å
1015T66.4Low72.3Confident92 Ų9241 Ų4156%0.56422%0.215SC*.  trans-97.6-18.7179.650.30000113.1Q1019T1015-Q1019 PolarHBondContact OG1-OE1 2.83Å
1016E66.6Low72.1Confident72 Ų7235.3 Ų35.334%0.33619%0.188SC..SBendtrans-125.6144.5-175.1-73-167.4-113.700114.2Y967 T1018 Q1019 Y1020Y967-E1016 WeakPolarHBondContact OH-CB 3.48Å; Y967-E1016 PolarHBondContact OH-OE1 2.99Å; Y967-E1016 PolarHBondContact OH-OE2 2.72Å; E1016-T1018 WeakPolarHBondContact CB-OG1 3.42Å; E1016-T1018 PolarHBondContact O-N 3.03Å; E1016-T1018 VanDerWaalsContact O-N 3.16Å; E1016-Q1019 HydrophobicContact CB-CG 4.37Å; E1016-Q1019 WeakPolarHBondContact O-CB 3.47Å; E1016-Q1019 PolarHBondContact O-N 3.47Å; E1016-Y1020 WeakPolarHBondContact O-CD2 3.46Å; E1016-Y1020 PolarHBondContact O-N 3.05Å
1017I65.3Low71.8Confident46 Ų4634 Ų3424%0.23618%0.183CC..Hα-helixtrans-54.4-33.9177.2-63.7138.7000112.2S1021 F1064 Y1067 L1068I1017-S1021 WeakPolarHBondContact O-CB 3.22Å; I1017-S1021 PolarHBondContact O-N 3.17Å; I1017-F1064 HydrophobicContact CG1-CE2 3.83Å; I1017-F1064 HydrophobicContact CG1-CZ 3.94Å; I1017-Y1067 HydrophobicContact CD1-CD1 3.7Å; I1017-Y1067 HydrophobicContact CD1-CE1 3.47Å; I1017-Y1067 VanDerWaalsContact CD1-CE1 3.47Å; I1017-Y1067 HydrophobicContact CG1-CD1 4.07Å; I1017-Y1067 HydrophobicContact CG1-CE1 4.22Å; I1017-L1068 HydrophobicContact CG2-CD1 4.03Å
1018T66.5Low71.6Confident57 Ų5734.1 Ų34.135%0.3518%0.184SC..Hα-helixtrans-60.8-51.217541.90000111.5Y967 E1016 Y1020 S1021 I1022Y967-T1018 PolarHBondContact OH-OG1 3.4Å; E1016-T1018 WeakPolarHBondContact CB-OG1 3.42Å; E1016-T1018 PolarHBondContact O-N 3.03Å; E1016-T1018 VanDerWaalsContact O-N 3.16Å; T1018-Y1020 PolarHBondContact O-N 3.15Å; T1018-S1021 PolarHBondContact O-N 3.1Å; T1018-S1021 VanDerWaalsContact O-N 3.16Å; T1018-I1022 VanDerWaalsContact O-CD1 3.24Å; T1018-I1022 WeakPolarHBondContact O-CD1 3.49Å; T1018-I1022 WeakPolarHBondContact O-CG1 3.4Å; T1018-I1022 PolarHBondContact O-N 3.48Å
1019Q70.6Confident71.7Confident9 Ų936.9 Ų36.94%0.04220%0.195CC..Hα-helixtrans-56-49.3177.8-63.5166.6-35.200111.3L962 Y967 F1014 T1015 E1016 I1022 A1023L962-Q1019 WeakPolarHBondContact O-CG 3.39Å; L962-Q1019 PolarHBondContact O-NE2 2.88Å; Y967-Q1019 HydrophobicContact CD2-CG 4.42Å; Y967-Q1019 HydrophobicContact CE1-CG 4.27Å; Y967-Q1019 HydrophobicContact CE2-CG 3.66Å; F1014-Q1019 HydrophobicContact CB-CB 4Å; F1014-Q1019 HydrophobicContact CD1-CB 3.9Å; F1014-Q1019 HydrophobicContact CG-CB 3.93Å; T1015-Q1019 PolarHBondContact OG1-OE1 2.83Å; E1016-Q1019 HydrophobicContact CB-CG 4.37Å; E1016-Q1019 WeakPolarHBondContact O-CB 3.47Å; E1016-Q1019 PolarHBondContact O-N 3.47Å; Q1019-I1022 PolarHBondContact O-N 2.85Å; Q1019-A1023 WeakPolarHBondContact O-CB 3.48Å; Q1019-A1023 PolarHBondContact O-N 3.27Å
1020Y72.9Confident71.7Confident13 Ų1332.8 Ų32.85%0.05117%0.172CC..Hα-helixtrans-61-44.9175.4-77.7-91.4000112.6C1011 F1014 E1016 T1018 I1022 A1023 C1024 L1054 F1064 L1068C1011-Y1020 HydrophobicContact CB-CD1 4.44Å; C1011-Y1020 HydrophobicContact CB-CE1 3.77Å; C1011-Y1020 VanDerWaalsContact O-CZ 3.31Å; C1011-Y1020 PolarHBondContact O-OH 3.19Å; F1014-Y1020 HydrophobicContact CB-CD2 3.57Å; F1014-Y1020 HydrophobicContact CB-CE1 4.43Å; F1014-Y1020 HydrophobicContact CB-CE2 3.37Å; F1014-Y1020 HydrophobicContact CB-CG 4.18Å; F1014-Y1020 AromaticContact CD2-CD1 3.93Å; F1014-Y1020 HydrophobicContact CD2-CD1 3.93Å; F1014-Y1020 HydrophobicContact CD2-CD2 4.25Å; F1014-Y1020 HydrophobicContact CD2-CE1 4.17Å; F1014-Y1020 HydrophobicContact CD2-CE2 4.46Å; F1014-Y1020 AromaticContact CD2-CG 4Å; F1014-Y1020 HydrophobicContact CD2-CG 4Å; F1014-Y1020 HydrophobicContact CG-CD2 4.38Å; F1014-Y1020 HydrophobicContact CG-CE2 4.44Å; F1014-Y1020 WeakPolarHBondContact O-CE2 3.43Å; E1016-Y1020 WeakPolarHBondContact O-CD2 3.46Å; E1016-Y1020 PolarHBondContact O-N 3.05Å; T1018-Y1020 PolarHBondContact O-N 3.15Å; Y1020-I1022 VanDerWaalsContact C-N 3.28Å; Y1020-I1022 PolarHBondContact O-N 3.32Å; Y1020-A1023 PolarHBondContact O-N 3.19Å; Y1020-C1024 VanDerWaalsContact O-CB 3.26Å; Y1020-C1024 WeakPolarHBondContact O-CB 3.11Å; Y1020-C1024 PolarHBondContact O-N 3.07Å; Y1020-C1024 PolarHBondContact O-SG 3.47Å; Y1020-L1054 HydrophobicContact CD1-CD1 4.35Å; Y1020-L1054 HydrophobicContact CE1-CD1 3.71Å; Y1020-F1064 AromaticContact CD2-CE1 3.66Å; Y1020-F1064 HydrophobicContact CD2-CE1 3.66Å; Y1020-F1064 AromaticContact CD2-CZ 3.64Å; Y1020-F1064 HydrophobicContact CD2-CZ 3.64Å; Y1020-F1064 HydrophobicContact CE2-CD1 4.43Å; Y1020-F1064 AromaticContact CE2-CE1 3.28Å; Y1020-F1064 HydrophobicContact CE2-CE1 3.28Å; Y1020-F1064 AromaticContact CE2-CZ 3.44Å; Y1020-F1064 HydrophobicContact CE2-CZ 3.44Å; Y1020-F1064 VanDerWaalsContact CE2-CZ 3.44Å; Y1020-F1064 HydrophobicContact CG-CE1 4.43Å; Y1020-F1064 AromaticContact CZ-CE1 3.76Å; Y1020-L1068 HydrophobicContact CD1-CD2 3.46Å; Y1020-L1068 VanDerWaalsContact CD1-CD2 3.46Å; Y1020-L1068 HydrophobicContact CD2-CD2 4.1Å; Y1020-L1068 HydrophobicContact CE1-CD2 4.06Å; Y1020-L1068 HydrophobicContact CG-CD1 4.45Å; Y1020-L1068 HydrophobicContact CG-CD2 3.47Å; Y1020-L1068 VanDerWaalsContact CG-CD2 3.47Å
1021S68.5Low71.6Confident32 Ų3232.7 Ų32.722%0.22417%0.172CC..Hα-helixtrans-62.1-38-179.4-176.80000111.8I1017 T1018 G1025 N1075I1017-S1021 WeakPolarHBondContact O-CB 3.22Å; I1017-S1021 PolarHBondContact O-N 3.17Å; T1018-S1021 PolarHBondContact O-N 3.1Å; T1018-S1021 VanDerWaalsContact O-N 3.16Å; S1021-G1025 PolarHBondContact O-N 3.3Å; S1021-N1075 PolarHBondContact O-ND2 2.9Å; S1021-N1075 PolarHBondContact OG-ND2 3Å
1022I69.8Low71.7Confident19 Ų1933.1 Ų33.110%0.09718%0.175CC..Hα-helixtrans-69.9-51.7176.3-58.6153.4000109.9L962 Y967 L974 M977 T1018 Q1019 Y1020 C1024 G1025 V1026L962-I1022 HydrophobicContact CD2-CB 3.9Å; L962-I1022 HydrophobicContact CD2-CD1 4.14Å; L962-I1022 HydrophobicContact CD2-CG2 3.81Å; Y967-I1022 HydrophobicContact CD2-CD1 4.32Å; Y967-I1022 HydrophobicContact CE2-CD1 4.45Å; L974-I1022 HydrophobicContact CD1-CD1 4.49Å; L974-I1022 HydrophobicContact CD2-CD1 3.46Å; L974-I1022 VanDerWaalsContact CD2-CD1 3.46Å; L974-I1022 HydrophobicContact CD2-CG1 3.67Å; L974-I1022 HydrophobicContact CG-CD1 3.95Å; L974-I1022 HydrophobicContact CG-CG1 4.05Å; L974-I1022 HydrophobicContact CG-CG2 4.39Å; M977-I1022 HydrophobicContact CE-CG2 3.42Å; M977-I1022 VanDerWaalsContact CE-CG2 3.42Å; T1018-I1022 VanDerWaalsContact O-CD1 3.24Å; T1018-I1022 WeakPolarHBondContact O-CD1 3.49Å; T1018-I1022 WeakPolarHBondContact O-CG1 3.4Å; T1018-I1022 PolarHBondContact O-N 3.48Å; Q1019-I1022 PolarHBondContact O-N 2.85Å; Y1020-I1022 VanDerWaalsContact C-N 3.28Å; Y1020-I1022 PolarHBondContact O-N 3.32Å; I1022-C1024 VanDerWaalsContact C-N 3.33Å; I1022-C1024 PolarHBondContact O-N 3.34Å; I1022-G1025 WeakPolarHBondContact O-CA 3.28Å; I1022-G1025 PolarHBondContact O-N 2.89Å; I1022-V1026 HydrophobicContact CG2-CG2 4.17Å; I1022-V1026 VanDerWaalsContact O-CG2 3.3Å; I1022-V1026 WeakPolarHBondContact O-CG2 3.46Å; I1022-V1026 PolarHBondContact O-N 2.82Å
1023A74.5Confident71.8Confident0 Ų030.8 Ų30.80%016%0.164CC..Hα-helixtrans-57.9-44.5-179.500000111.9L962 W1006 L1007 F1014 Q1019 Y1020 I1027L962-A1023 HydrophobicContact CD1-CB 3.9Å; W1006-A1023 HydrophobicContact CH2-CB 4.36Å; W1006-A1023 HydrophobicContact CZ3-CB 4.44Å; L1007-A1023 HydrophobicContact CD1-CB 3.56Å; F1014-A1023 HydrophobicContact CE2-CB 3.59Å; F1014-A1023 HydrophobicContact CZ-CB 3.8Å; Q1019-A1023 WeakPolarHBondContact O-CB 3.48Å; Q1019-A1023 PolarHBondContact O-N 3.27Å; Y1020-A1023 PolarHBondContact O-N 3.19Å; A1023-I1027 WeakPolarHBondContact O-CB 3.49Å; A1023-I1027 WeakPolarHBondContact O-CG1 3.37Å; A1023-I1027 PolarHBondContact O-N 3.46Å; A1023-I1027 VanDerWaalsContact O-N 3.16Å
1024C74.8Confident71.5Confident0 Ų028 Ų280%016%0.155CC..Hα-helixtrans-59.8-48.6170.4-69.70000111.9Y1020 I1022 V1026 I1027 F1028 Y1050Y1020-C1024 VanDerWaalsContact O-CB 3.26Å; Y1020-C1024 WeakPolarHBondContact O-CB 3.11Å; Y1020-C1024 PolarHBondContact O-N 3.07Å; Y1020-C1024 PolarHBondContact O-SG 3.47Å; I1022-C1024 VanDerWaalsContact C-N 3.33Å; I1022-C1024 PolarHBondContact O-N 3.34Å; C1024-V1026 PolarHBondContact O-N 3.47Å; C1024-I1027 PolarHBondContact O-N 2.8Å; C1024-F1028 HydrophobicContact CB-CD2 4.11Å; C1024-F1028 HydrophobicContact CB-CE2 4.04Å; C1024-F1028 WeakPolarHBondContact O-CB 3.46Å; C1024-F1028 WeakPolarHBondContact O-CD2 3.46Å; C1024-F1028 PolarHBondContact O-N 2.8Å; C1024-Y1050 PolarHBondContact SG-OH 2.83Å
1025G73.1Confident71.1Confident15 Ų1533.6 Ų33.616%0.15519%0.185CC..Hα-helixtrans-56.5-50-178.800000112.5S1021 I1022 I1027 K1029S1021-G1025 PolarHBondContact O-N 3.3Å; I1022-G1025 WeakPolarHBondContact O-CA 3.28Å; I1022-G1025 PolarHBondContact O-N 2.89Å; G1025-I1027 PolarHBondContact O-N 2.83Å; G1025-K1029 WeakPolarHBondContact O-CB 3.48Å; G1025-K1029 PolarHBondContact O-N 3.24Å
1026V75.6Confident71.1Confident0 Ų033.6 Ų33.60%018%0.181CC..Hα-helixtrans-57.1-48.4176.4173.80000111.6L958 M977 D978 F981 I1022 C1024 K1029 L1030L958-V1026 HydrophobicContact CD2-CG1 3.96Å; M977-V1026 HydrophobicContact CE-CG2 3.65Å; D978-V1026 WeakPolarHBondContact OD1-CG2 3.42Å; F981-V1026 HydrophobicContact CB-CG1 3.95Å; F981-V1026 HydrophobicContact CD1-CG1 3.19Å; F981-V1026 HydrophobicContact CD2-CG1 3.89Å; F981-V1026 HydrophobicContact CE1-CG1 3.48Å; F981-V1026 VanDerWaalsContact CE1-CG1 3.48Å; F981-V1026 HydrophobicContact CE2-CG1 4.15Å; F981-V1026 HydrophobicContact CG-CG1 3.4Å; F981-V1026 VanDerWaalsContact CG-CG1 3.4Å; F981-V1026 HydrophobicContact CZ-CG1 3.96Å; I1022-V1026 HydrophobicContact CG2-CG2 4.17Å; I1022-V1026 VanDerWaalsContact O-CG2 3.3Å; I1022-V1026 WeakPolarHBondContact O-CG2 3.46Å; I1022-V1026 PolarHBondContact O-N 2.82Å; C1024-V1026 PolarHBondContact O-N 3.47Å; V1026-K1029 PolarHBondContact O-N 2.9Å; V1026-L1030 PolarHBondContact O-N 3.1Å
1027I77.6Confident70.7Confident1 Ų137.5 Ų37.51%0.00520%0.203CC..Hα-helixtrans-69.3-46.7-177.5-63.9-70.7000111.4F981 S1003 T1004 W1006 L1007 A1023 C1024 G1025 K1029 L1030 L1031 F1046F981-I1027 HydrophobicContact CZ-CD1 4.49Å; S1003-I1027 WeakPolarHBondContact O-CD1 3.26Å; T1004-I1027 HydrophobicContact CG2-CG2 4.17Å; W1006-I1027 HydrophobicContact CE3-CD1 4.25Å; W1006-I1027 HydrophobicContact CZ3-CD1 4.33Å; W1006-I1027 HydrophobicContact CZ3-CG1 4.39Å; L1007-I1027 HydrophobicContact CB-CG1 4.42Å; L1007-I1027 HydrophobicContact CD1-CG1 4.46Å; L1007-I1027 HydrophobicContact CD2-CB 4.38Å; L1007-I1027 HydrophobicContact CD2-CG1 4.25Å; L1007-I1027 HydrophobicContact CD2-CG2 4.39Å; A1023-I1027 WeakPolarHBondContact O-CB 3.49Å; A1023-I1027 WeakPolarHBondContact O-CG1 3.37Å; A1023-I1027 PolarHBondContact O-N 3.46Å; A1023-I1027 VanDerWaalsContact O-N 3.16Å; C1024-I1027 PolarHBondContact O-N 2.8Å; G1025-I1027 PolarHBondContact O-N 2.83Å; I1027-K1029 PolarHBondContact O-N 2.93Å; I1027-L1030 WeakPolarHBondContact O-CB 3.27Å; I1027-L1030 PolarHBondContact O-N 2.95Å; I1027-L1031 HydrophobicContact CG2-CD1 4.19Å; I1027-L1031 WeakPolarHBondContact O-CG 3.47Å; I1027-L1031 PolarHBondContact O-N 3.04Å; I1027-F1046 HydrophobicContact CG2-CE1 4.09Å
1028F75Confident70.6Confident2 Ų240.9 Ų40.91%0.00923%0.226CC..Hα-helixtrans-66.2-28.9174.8-68.6-59.6000111.9C1024 L1031 S1032 F1046 L1047 I1072 C1076 A1079 F1080C1024-F1028 HydrophobicContact CB-CD2 4.11Å; C1024-F1028 HydrophobicContact CB-CE2 4.04Å; C1024-F1028 WeakPolarHBondContact O-CB 3.46Å; C1024-F1028 WeakPolarHBondContact O-CD2 3.46Å; C1024-F1028 PolarHBondContact O-N 2.8Å; F1028-L1031 HydrophobicContact CD1-CD1 4.26Å; F1028-L1031 PolarHBondContact O-N 2.94Å; F1028-S1032 WeakPolarHBondContact O-CB 3.43Å; F1028-S1032 PolarHBondContact O-N 3.43Å; F1028-F1046 HydrophobicContact CE1-CD1 4.11Å; F1028-F1046 HydrophobicContact CE1-CE1 4.12Å; F1028-F1046 HydrophobicContact CZ-CE1 4.17Å; F1028-L1047 HydrophobicContact CE1-CB 4.47Å; F1028-L1047 HydrophobicContact CE1-CD1 4.47Å; F1028-L1047 HydrophobicContact CZ-CD1 3.86Å; F1028-I1072 HydrophobicContact CE2-CG2 4.28Å; F1028-C1076 WeakPolarHBondContact CE2-SG 3.44Å; F1028-C1076 VanDerWaalsContact CZ-SG 3.54Å; F1028-A1079 HydrophobicContact CB-CB 4.04Å; F1028-F1080 HydrophobicContact CB-CE2 4.3Å; F1028-F1080 HydrophobicContact CD1-CE2 4.19Å
1029K76.2Confident70.5Confident89 Ų8939.8 Ų39.839%0.38722%0.217SC..Hα-helixtrans-68.4-42.6173.1-17168.6-161.9144.30111.7D978 V982 G1025 V1026 I1027 S1032 T1033D978-K1029 HydrophobicContact CB-CG 4.31Å; V982-K1029 HydrophobicContact CG2-CB 4.4Å; V982-K1029 HydrophobicContact CG2-CG 4.02Å; G1025-K1029 WeakPolarHBondContact O-CB 3.48Å; G1025-K1029 PolarHBondContact O-N 3.24Å; V1026-K1029 PolarHBondContact O-N 2.9Å; I1027-K1029 PolarHBondContact O-N 2.93Å; K1029-S1032 PolarHBondContact NZ-OG 3.16Å; K1029-S1032 PolarHBondContact O-N 3.49Å; K1029-S1032 PolarHBondContact O-OG 2.81Å; K1029-T1033 WeakPolarHBondContact O-CG2 3.31Å
1030L75.2Confident70.2Confident1 Ų140.9 Ų40.91%0.00522%0.224CC..Hα-helixtrans-56.9-49.6171.7176.263.3000111.5F981 V982 C985 M996 Y1000 V1026 I1027 S1032 T1033F981-L1030 HydrophobicContact CE1-CB 4.2Å; F981-L1030 HydrophobicContact CE1-CD2 3.87Å; V982-L1030 HydrophobicContact CG2-CB 4.12Å; V982-L1030 HydrophobicContact CG2-CD1 4.44Å; C985-L1030 HydrophobicContact CB-CD1 3.75Å; C985-L1030 HydrophobicContact CB-CD2 4.43Å; M996-L1030 HydrophobicContact CE-CD1 4Å; Y1000-L1030 HydrophobicContact CD1-CD2 4.12Å; Y1000-L1030 HydrophobicContact CD1-CG 3.92Å; Y1000-L1030 HydrophobicContact CE1-CD1 4.18Å; Y1000-L1030 HydrophobicContact CE1-CG 3.86Å; V1026-L1030 PolarHBondContact O-N 3.1Å; I1027-L1030 WeakPolarHBondContact O-CB 3.27Å; I1027-L1030 PolarHBondContact O-N 2.95Å; L1030-S1032 PolarHBondContact O-N 3.42Å; L1030-T1033 WeakPolarHBondContact O-CB 3.47Å; L1030-T1033 WeakPolarHBondContact O-CG2 3.4Å; L1030-T1033 PolarHBondContact O-N 3.14Å; L1030-T1033 PolarHBondContact O-OG1 3.45Å
1031L73.2Confident69.8Low6 Ų643.5 Ų43.53%0.03124%0.237CC..Hα-helixtrans-64.2-28.4178.2-62.1171.2000112.6Y1000 T1004 I1027 F1028 T1033 W1042 F1046 F1080Y1000-L1031 HydrophobicContact CD1-CD2 3.52Å; Y1000-L1031 HydrophobicContact CD2-CD2 3.97Å; Y1000-L1031 HydrophobicContact CE1-CD2 3.98Å; Y1000-L1031 HydrophobicContact CE2-CD2 4.4Å; Y1000-L1031 HydrophobicContact CG-CD2 3.49Å; Y1000-L1031 VanDerWaalsContact CG-CD2 3.49Å; T1004-L1031 HydrophobicContact CG2-CD1 4.42Å; I1027-L1031 HydrophobicContact CG2-CD1 4.19Å; I1027-L1031 WeakPolarHBondContact O-CG 3.47Å; I1027-L1031 PolarHBondContact O-N 3.04Å; F1028-L1031 HydrophobicContact CD1-CD1 4.26Å; F1028-L1031 PolarHBondContact O-N 2.94Å; L1031-T1033 PolarHBondContact O-N 3.18Å; L1031-W1042 HydrophobicContact CD1-CZ3 4.05Å; L1031-W1042 HydrophobicContact CD2-CE3 3.94Å; L1031-W1042 HydrophobicContact CD2-CH2 4.34Å; L1031-W1042 HydrophobicContact CD2-CZ3 3.42Å; L1031-W1042 VanDerWaalsContact CD2-CZ3 3.42Å; L1031-W1042 HydrophobicContact CG-CZ3 4.4Å; L1031-F1046 HydrophobicContact CD1-CD1 4.03Å; L1031-F1046 HydrophobicContact CD1-CE1 4.48Å; L1031-F1080 HydrophobicContact CB-CE2 4.16Å; L1031-F1080 HydrophobicContact CB-CZ 3.61Å
1032S73.6Confident69.7Low14 Ų1444.9 Ų44.910%0.09824%0.237CC..THydrogen-bonded Turntrans-72.8-1.6179.276.40000115F1028 K1029 L1030F1028-S1032 WeakPolarHBondContact O-CB 3.43Å; F1028-S1032 PolarHBondContact O-N 3.43Å; K1029-S1032 PolarHBondContact NZ-OG 3.16Å; K1029-S1032 PolarHBondContact O-N 3.49Å; K1029-S1032 PolarHBondContact O-OG 2.81Å; L1030-S1032 PolarHBondContact O-N 3.42Å
1033T70.9Confident69.6Low41 Ų4144 Ų4425%0.25223%0.233SC..THydrogen-bonded Turntrans-80.3-31.3-167.855.30000114.3V982 H986 K1029 L1030 L1031V982-T1033 HydrophobicContact CG1-CG2 3.4Å; V982-T1033 HydrophobicContact CG2-CG2 4.29Å; H986-T1033 WeakPolarHBondContact NE2-CB 3.29Å; H986-T1033 PolarHBondContact NE2-OG1 2.97Å; K1029-T1033 WeakPolarHBondContact O-CG2 3.31Å; L1030-T1033 WeakPolarHBondContact O-CB 3.47Å; L1030-T1033 WeakPolarHBondContact O-CG2 3.4Å; L1030-T1033 PolarHBondContact O-N 3.14Å; L1030-T1033 PolarHBondContact O-OG1 3.45Å; L1031-T1033 PolarHBondContact O-N 3.18Å
1034N65.2Low69.2Low68 Ų6846.2 Ų46.236%0.36424%0.241SC..SBendtrans-123.8107.8174-74.9-38.4000109.1D1036 Q1039N1034-D1036 PolarHBondContact O-N 2.91Å; N1034-Q1039 VanDerWaalsContact CB-NE2 3.28Å; N1034-Q1039 VanDerWaalsContact O-CD 3.28Å; N1034-Q1039 PolarHBondContact O-OE1 3.34Å; N1034-Q1039 VanDerWaalsContact O-OE1 3.11Å
1035L62.3Low68.8Low129 Ų12950.6 Ų50.668%0.67526%0.262SS*.  trans-83.948.2-173.8-70.3168.6000113F1080L1035-F1080 HydrophobicContact CD2-CD1 4.23Å; L1035-F1080 HydrophobicContact CD2-CE1 4.37Å
1036D64.9Low68.7Low92 Ų9250.2 Ų50.249%0.49226%0.256SS..  trans-73.6145.2171.5-66.1-40.9000111N1034 V1038 Q1039 V1040N1034-D1036 PolarHBondContact O-N 2.91Å; D1036-V1038 PolarHBondContact O-N 2.84Å; D1036-Q1039 HydrophobicContact CB-CB 4.28Å; D1036-Q1039 HydrophobicContact CB-CG 4.01Å; D1036-Q1039 WeakPolarHBondContact O-CA 3.3Å; D1036-Q1039 PolarHBondContact O-N 2.94Å; D1036-Q1039 PolarHBondContact OD2-NE2 2.72Å; D1036-V1040 PolarHBondContact O-N 2.69Å
1037L59.7Low68.7Low153 Ų15350.2 Ų50.280%0.80126%0.256SS*.Hα-helixtrans-54.4-38.5177.2-17565.3000112.5V1040 E1041L1037-V1040 PolarHBondContact O-N 2.88Å; L1037-E1041 PolarHBondContact O-N 2.95Å; L1037-E1041 VanDerWaalsContact O-N 3.11Å
1038V62.8Low68.2Low118 Ų11851 Ų5172%0.71526%0.26SS*.Hα-helixtrans-64.8-39.7176.2-177.90000111.4D1036 W1042D1036-V1038 PolarHBondContact O-N 2.84Å; V1038-W1042 VanDerWaalsContact O-CB 3.26Å; V1038-W1042 WeakPolarHBondContact O-CB 3.06Å; V1038-W1042 PolarHBondContact O-N 3.42Å
1039Q64.1Low68Low34 Ų3455.3 Ų55.316%0.15928%0.28CS..Hα-helixtrans-72.8-33.6179.4-64.2-17553.200111.6Y1000 N1034 D1036 S1043Y1000-Q1039 HydrophobicContact CE2-CG 4.3Å; Y1000-Q1039 VanDerWaalsContact CZ-OE1 3.25Å; Y1000-Q1039 PolarHBondContact OH-OE1 3.46Å; N1034-Q1039 VanDerWaalsContact CB-NE2 3.28Å; N1034-Q1039 VanDerWaalsContact O-CD 3.28Å; N1034-Q1039 PolarHBondContact O-OE1 3.34Å; N1034-Q1039 VanDerWaalsContact O-OE1 3.11Å; D1036-Q1039 HydrophobicContact CB-CB 4.28Å; D1036-Q1039 HydrophobicContact CB-CG 4.01Å; D1036-Q1039 WeakPolarHBondContact O-CA 3.3Å; D1036-Q1039 PolarHBondContact O-N 2.94Å; D1036-Q1039 PolarHBondContact OD2-NE2 2.72Å; Q1039-S1043 VanDerWaalsContact O-CB 3.28Å; Q1039-S1043 WeakPolarHBondContact O-CB 3.11Å; Q1039-S1043 PolarHBondContact O-N 2.96Å; Q1039-S1043 PolarHBondContact O-OG 2.71Å
1040V64.5Low68Low31 Ų3151.1 Ų51.119%0.18826%0.262CS..Hα-helixtrans-63.7-51.4172.5177.80000110.9D1036 L1037 W1042 S1043 R1044 L1083D1036-V1040 PolarHBondContact O-N 2.69Å; L1037-V1040 PolarHBondContact O-N 2.88Å; V1040-W1042 PolarHBondContact O-N 3.35Å; V1040-S1043 PolarHBondContact O-N 3.29Å; V1040-S1043 PolarHBondContact O-OG 3.47Å; V1040-R1044 PolarHBondContact O-N 3.32Å; V1040-L1083 HydrophobicContact CG1-CD1 4.07Å
1041E63.7Low68Low69 Ų6951.2 Ų51.232%0.32226%0.262SS..Hα-helixtrans-66-36.3178.3-179.356.1-145.200112L1037 R1044 Q1045L1037-E1041 PolarHBondContact O-N 2.95Å; L1037-E1041 VanDerWaalsContact O-N 3.11Å; E1041-R1044 WeakPolarHBondContact O-CB 3.25Å; E1041-R1044 PolarHBondContact O-N 2.75Å; E1041-R1044 IonicContact OE1-NH1 3.32Å; E1041-R1044 VanDerWaalsContact OE2-CD 3.24Å; E1041-R1044 WeakPolarHBondContact OE2-CD 3.13Å; E1041-R1044 IonicContact OE2-CZ 3.2Å; E1041-R1044 IonicContact OE2-NE 2.72Å; E1041-R1044 IonicContact OE2-NH1 3.45Å; E1041-R1044 PolarHBondContact OE2-NH1 2.86Å; E1041-Q1045 WeakPolarHBondContact O-CG 3.44Å; E1041-Q1045 PolarHBondContact O-N 3.21Å; E1041-Q1045 WeakPolarHBondContact OE1-CG 3.24Å; E1041-Q1045 PolarHBondContact OE1-NE2 3.2Å
1042W66.6Low67.8Low61 Ų6151.1 Ų51.123%0.23126%0.262CS..Hα-helixtrans-62.6-42.6171.5-169.294.9000111.9Q1001 T1004 L1031 V1038 V1040 R1044 Q1045 F1046Q1001-W1042 HydrophobicContact CG-CZ2 4.04Å; T1004-W1042 HydrophobicContact CG2-CH2 3.49Å; T1004-W1042 VanDerWaalsContact CG2-CH2 3.49Å; T1004-W1042 HydrophobicContact CG2-CZ3 3.73Å; T1004-W1042 WeakPolarHBondContact OG1-CH2 3.39Å; L1031-W1042 HydrophobicContact CD1-CZ3 4.05Å; L1031-W1042 HydrophobicContact CD2-CE3 3.94Å; L1031-W1042 HydrophobicContact CD2-CH2 4.34Å; L1031-W1042 HydrophobicContact CD2-CZ3 3.42Å; L1031-W1042 VanDerWaalsContact CD2-CZ3 3.42Å; L1031-W1042 HydrophobicContact CG-CZ3 4.4Å; V1038-W1042 VanDerWaalsContact O-CB 3.26Å; V1038-W1042 WeakPolarHBondContact O-CB 3.06Å; V1038-W1042 PolarHBondContact O-N 3.42Å; V1040-W1042 PolarHBondContact O-N 3.35Å; W1042-R1044 VanDerWaalsContact C-N 3.31Å; W1042-R1044 PolarHBondContact O-N 2.86Å; W1042-Q1045 PolarHBondContact O-N 2.96Å; W1042-F1046 HydrophobicContact CE3-CB 4.23Å; W1042-F1046 HydrophobicContact CZ3-CB 4.1Å; W1042-F1046 HydrophobicContact CZ3-CG 4.41Å; W1042-F1046 WeakPolarHBondContact O-CB 3.28Å; W1042-F1046 PolarHBondContact O-N 3.3Å
1043S67.3Low67.8Low0 Ų053.2 Ų53.20%027%0.27CS..Hα-helixtrans-66.1-32.7176.9780000112.6Q1039 V1040 L1047 L1083Q1039-S1043 VanDerWaalsContact O-CB 3.28Å; Q1039-S1043 WeakPolarHBondContact O-CB 3.11Å; Q1039-S1043 PolarHBondContact O-N 2.96Å; Q1039-S1043 PolarHBondContact O-OG 2.71Å; V1040-S1043 PolarHBondContact O-N 3.29Å; V1040-S1043 PolarHBondContact O-OG 3.47Å; S1043-L1047 VanDerWaalsContact O-CB 3.29Å; S1043-L1047 WeakPolarHBondContact O-CB 3.49Å; S1043-L1047 PolarHBondContact O-N 2.91Å; S1043-L1083 VanDerWaalsContact OG-CD1 3.29Å; S1043-L1083 WeakPolarHBondContact OG-CD1 3.44Å
1044R66.8Low67.9Low46 Ų4651.4 Ų51.417%0.17426%0.259CS..Hα-helixtrans-64.6-52.2171179.3-165.9167.8-166.8-0.1110.4V1040 E1041 W1042 F1046 L1047 I1048 L1083 W1084 D1222V1040-R1044 PolarHBondContact O-N 3.32Å; E1041-R1044 WeakPolarHBondContact O-CB 3.25Å; E1041-R1044 PolarHBondContact O-N 2.75Å; E1041-R1044 IonicContact OE1-NH1 3.32Å; E1041-R1044 VanDerWaalsContact OE2-CD 3.24Å; E1041-R1044 WeakPolarHBondContact OE2-CD 3.13Å; E1041-R1044 IonicContact OE2-CZ 3.2Å; E1041-R1044 IonicContact OE2-NE 2.72Å; E1041-R1044 IonicContact OE2-NH1 3.45Å; E1041-R1044 PolarHBondContact OE2-NH1 2.86Å; W1042-R1044 VanDerWaalsContact C-N 3.31Å; W1042-R1044 PolarHBondContact O-N 2.86Å; R1044-F1046 VanDerWaalsContact C-N 3.33Å; R1044-F1046 PolarHBondContact O-N 2.94Å; R1044-L1047 PolarHBondContact O-N 3.23Å; R1044-I1048 HydrophobicContact CG-CD1 3.9Å; R1044-I1048 WeakPolarHBondContact O-CD1 3.41Å; R1044-I1048 WeakPolarHBondContact O-CG1 3.46Å; R1044-I1048 PolarHBondContact O-N 2.77Å; R1044-L1083 HydrophobicContact CB-CD1 3.95Å; R1044-W1084 HydrophobicContact CG-CE3 4.43Å; R1044-W1084 HydrophobicContact CG-CH2 3.66Å; R1044-W1084 HydrophobicContact CG-CZ2 4.19Å; R1044-W1084 HydrophobicContact CG-CZ3 3.8Å; R1044-D1222 IonicContact CZ-OD1 2.71Å; R1044-D1222 IonicContact NH2-OD1 3.52Å; R1044-D1222 PolarHBondContact NH2-OD1 3.38Å
1045Q66.1Low68.1Low92 Ų9248.2 Ų48.243%0.4324%0.242SC..Hα-helixtrans-61.5-40.8178.4-69.5179.422.900112.1E1041 W1042 I1048 Q1049E1041-Q1045 WeakPolarHBondContact O-CG 3.44Å; E1041-Q1045 PolarHBondContact O-N 3.21Å; E1041-Q1045 WeakPolarHBondContact OE1-CG 3.24Å; E1041-Q1045 PolarHBondContact OE1-NE2 3.2Å; W1042-Q1045 PolarHBondContact O-N 2.96Å; Q1045-I1048 WeakPolarHBondContact O-CB 3.17Å; Q1045-I1048 PolarHBondContact O-N 2.78Å; Q1045-Q1049 WeakPolarHBondContact O-CG 3.26Å; Q1045-Q1049 PolarHBondContact O-N 3.49Å
1046F71.5Confident68.3Low8 Ų842.9 Ų42.94%0.03521%0.214CC..Hα-helixtrans-61.3-48.3172.1171.4-114.8000112T1004 L1007 L1008 I1027 F1028 L1031 W1042 R1044 I1048 Q1049 Y1050T1004-F1046 HydrophobicContact CG2-CD1 3.66Å; T1004-F1046 HydrophobicContact CG2-CD2 3.63Å; T1004-F1046 HydrophobicContact CG2-CE1 3.58Å; T1004-F1046 HydrophobicContact CG2-CE2 3.58Å; T1004-F1046 HydrophobicContact CG2-CG 3.67Å; T1004-F1046 HydrophobicContact CG2-CZ 3.54Å; L1007-F1046 HydrophobicContact CD2-CE1 4.5Å; L1007-F1046 HydrophobicContact CD2-CZ 4.02Å; L1008-F1046 HydrophobicContact CD1-CE2 4.3Å; L1008-F1046 HydrophobicContact CG-CE2 4.25Å; I1027-F1046 HydrophobicContact CG2-CE1 4.09Å; F1028-F1046 HydrophobicContact CE1-CD1 4.11Å; F1028-F1046 HydrophobicContact CE1-CE1 4.12Å; F1028-F1046 HydrophobicContact CZ-CE1 4.17Å; L1031-F1046 HydrophobicContact CD1-CD1 4.03Å; L1031-F1046 HydrophobicContact CD1-CE1 4.48Å; W1042-F1046 HydrophobicContact CE3-CB 4.23Å; W1042-F1046 HydrophobicContact CZ3-CB 4.1Å; W1042-F1046 HydrophobicContact CZ3-CG 4.41Å; W1042-F1046 WeakPolarHBondContact O-CB 3.28Å; W1042-F1046 PolarHBondContact O-N 3.3Å; R1044-F1046 VanDerWaalsContact C-N 3.33Å; R1044-F1046 PolarHBondContact O-N 2.94Å; F1046-I1048 PolarHBondContact O-N 2.8Å; F1046-Q1049 PolarHBondContact O-N 2.93Å; F1046-Y1050 HydrophobicContact CE2-CG 4.44Å; F1046-Y1050 HydrophobicContact CZ-CD2 4.26Å; F1046-Y1050 HydrophobicContact CZ-CG 4.06Å; F1046-Y1050 WeakPolarHBondContact O-CB 3.34Å; F1046-Y1050 PolarHBondContact O-N 2.92Å
1047L74.6Confident68.4Low0 Ų041.2 Ų41.20%020%0.203CC..Hα-helixtrans-57.4-38.7177.4175.460.7000111.8F1028 S1043 R1044 L1051 I1072 I1073 C1076 L1083 W1084F1028-L1047 HydrophobicContact CE1-CB 4.47Å; F1028-L1047 HydrophobicContact CE1-CD1 4.47Å; F1028-L1047 HydrophobicContact CZ-CD1 3.86Å; S1043-L1047 VanDerWaalsContact O-CB 3.29Å; S1043-L1047 WeakPolarHBondContact O-CB 3.49Å; S1043-L1047 PolarHBondContact O-N 2.91Å; R1044-L1047 PolarHBondContact O-N 3.23Å; L1047-L1051 HydrophobicContact CD1-CD1 3.79Å; L1047-L1051 HydrophobicContact CD1-CG 3.96Å; L1047-L1051 HydrophobicContact CG-CD1 4.06Å; L1047-L1051 WeakPolarHBondContact O-CB 3.37Å; L1047-L1051 VanDerWaalsContact O-CG 3.27Å; L1047-L1051 WeakPolarHBondContact O-CG 3.3Å; L1047-L1051 PolarHBondContact O-N 3.46Å; L1047-I1072 HydrophobicContact CD1-CG2 3.86Å; L1047-I1073 HydrophobicContact CD2-CD1 4.47Å; L1047-C1076 HydrophobicContact CD2-CB 4.28Å; L1047-L1083 HydrophobicContact CD2-CD2 3.78Å; L1047-W1084 HydrophobicContact CD2-CZ2 4.24Å
1048I68.8Low68.3Low18 Ų1834.6 Ų34.69%0.09217%0.17CC..Hα-helixtrans-64.9-50.5176.8-66.7161.4000111.2R1044 Q1045 F1046 S1052 W1084 I1115 Y1225R1044-I1048 HydrophobicContact CG-CD1 3.9Å; R1044-I1048 WeakPolarHBondContact O-CD1 3.41Å; R1044-I1048 WeakPolarHBondContact O-CG1 3.46Å; R1044-I1048 PolarHBondContact O-N 2.77Å; Q1045-I1048 WeakPolarHBondContact O-CB 3.17Å; Q1045-I1048 PolarHBondContact O-N 2.78Å; F1046-I1048 PolarHBondContact O-N 2.8Å; I1048-S1052 WeakPolarHBondContact O-CB 3.45Å; I1048-S1052 PolarHBondContact O-N 2.89Å; I1048-W1084 HydrophobicContact CD1-CH2 4.41Å; I1048-I1115 HydrophobicContact CB-CD1 4.34Å; I1048-I1115 HydrophobicContact CD1-CD1 3.35Å; I1048-I1115 HydrophobicContact CD1-CG2 4.49Å; I1048-I1115 HydrophobicContact CG1-CD1 3.64Å; I1048-I1115 HydrophobicContact CG1-CG2 4.07Å; I1048-I1115 HydrophobicContact CG2-CD1 3.73Å; I1048-Y1225 HydrophobicContact CG2-CD1 4.32Å; I1048-Y1225 HydrophobicContact CG2-CD2 4.03Å; I1048-Y1225 HydrophobicContact CG2-CG 3.75Å
1049Q69.3Low67.7Low91 Ų9129.7 Ų29.743%0.42514%0.139SC..Hα-helixtrans-63.5-43.8178.4-70175.212.400111.1Q1045 F1046 S1052 H1053Q1045-Q1049 WeakPolarHBondContact O-CG 3.26Å; Q1045-Q1049 PolarHBondContact O-N 3.49Å; F1046-Q1049 PolarHBondContact O-N 2.93Å; Q1049-S1052 PolarHBondContact O-N 2.92Å; Q1049-H1053 VanDerWaalsContact O-CB 3.24Å; Q1049-H1053 WeakPolarHBondContact O-CB 3.45Å; Q1049-H1053 PolarHBondContact O-N 3.28Å
1050Y77Confident67Low1 Ų132.7 Ų32.70%0.00416%0.16CC..Hα-helixtrans-61-47.2177.4176.7-117.5000112.5L1007 L1008 C1011 C1024 F1046 H1053 L1054 I1072L1007-Y1050 HydrophobicContact CD2-CD2 4.11Å; L1007-Y1050 HydrophobicContact CD2-CE1 4.29Å; L1007-Y1050 HydrophobicContact CD2-CE2 3.7Å; L1007-Y1050 HydrophobicContact CG-CD2 4.43Å; L1007-Y1050 HydrophobicContact CG-CE2 3.85Å; L1008-Y1050 HydrophobicContact CD2-CD2 4.03Å; C1011-Y1050 PolarHBondContact SG-OH 3.22Å; C1011-Y1050 VanDerWaalsContact SG-OH 3.34Å; C1024-Y1050 PolarHBondContact SG-OH 2.83Å; F1046-Y1050 HydrophobicContact CE2-CG 4.44Å; F1046-Y1050 HydrophobicContact CZ-CD2 4.26Å; F1046-Y1050 HydrophobicContact CZ-CG 4.06Å; F1046-Y1050 WeakPolarHBondContact O-CB 3.34Å; F1046-Y1050 PolarHBondContact O-N 2.92Å; Y1050-H1053 PolarHBondContact O-N 3.33Å; Y1050-L1054 VanDerWaalsContact O-CB 3.27Å; Y1050-L1054 WeakPolarHBondContact O-CB 3.33Å; Y1050-L1054 PolarHBondContact O-N 2.88Å; Y1050-I1072 HydrophobicContact CE1-CD1 3.92Å; Y1050-I1072 HydrophobicContact CE1-CG1 4.45Å; Y1050-I1072 HydrophobicContact CE1-CG2 4.31Å
1051L75.2Confident66.4Low3 Ų336.4 Ų36.42%0.01618%0.175CC..Hα-helixtrans-64.6-43.6174.4-71.8172.7000111.1L1047 H1053 L1054 F1055 I1072 I1073 L1119 L1229L1047-L1051 HydrophobicContact CD1-CD1 3.79Å; L1047-L1051 HydrophobicContact CD1-CG 3.96Å; L1047-L1051 HydrophobicContact CG-CD1 4.06Å; L1047-L1051 WeakPolarHBondContact O-CB 3.37Å; L1047-L1051 VanDerWaalsContact O-CG 3.27Å; L1047-L1051 WeakPolarHBondContact O-CG 3.3Å; L1047-L1051 PolarHBondContact O-N 3.46Å; L1051-H1053 VanDerWaalsContact C-N 3.29Å; L1051-H1053 PolarHBondContact O-N 3.37Å; L1051-L1054 HydrophobicContact CD2-CD2 4.46Å; L1051-L1054 PolarHBondContact O-N 3.4Å; L1051-F1055 HydrophobicContact CD2-CE2 4.38Å; L1051-F1055 WeakPolarHBondContact O-CD2 3.46Å; L1051-F1055 PolarHBondContact O-N 3.43Å; L1051-I1072 HydrophobicContact CD2-CD1 4.02Å; L1051-I1072 HydrophobicContact CD2-CG2 4.19Å; L1051-I1073 HydrophobicContact CD1-CD1 4.19Å; L1051-L1119 HydrophobicContact CD1-CD2 3.69Å; L1051-L1229 HydrophobicContact CB-CD1 4.01Å
1052S69.5Low65.8Low5 Ų540.7 Ų40.74%0.03520%0.195CC..Hα-helixtrans-61.1-38176.4-173.80000112.2I1048 Q1049 H1056 R1228I1048-S1052 WeakPolarHBondContact O-CB 3.45Å; I1048-S1052 PolarHBondContact O-N 2.89Å; Q1049-S1052 PolarHBondContact O-N 2.92Å; S1052-H1056 WeakPolarHBondContact O-CB 3.18Å; S1052-H1056 PolarHBondContact O-N 3.31Å; S1052-H1056 VanDerWaalsContact O-N 3.13Å; S1052-R1228 PolarHBondContact OG-NE 3.46Å; S1052-R1228 VanDerWaalsContact OG-NE 3.12Å
1053H72.2Confident65.5Low57 Ų5739 Ų3926%0.26419%0.191SC..Hα-helixtrans-68.5-48.7177.4-175.183.1000111.8L1008 Q1049 Y1050 L1051 F1055 H1056 Q1057L1008-H1053 WeakPolarHBondContact CA-NE2 3.34Å; L1008-H1053 HydrophobicContact CD2-CB 3.7Å; L1008-H1053 VanDerWaalsContact CD2-CD2 3.43Å; L1008-H1053 WeakPolarHBondContact CD2-CD2 3.38Å; L1008-H1053 PolarHBondContact O-NE2 2.82Å; Q1049-H1053 VanDerWaalsContact O-CB 3.24Å; Q1049-H1053 WeakPolarHBondContact O-CB 3.45Å; Q1049-H1053 PolarHBondContact O-N 3.28Å; Y1050-H1053 PolarHBondContact O-N 3.33Å; L1051-H1053 VanDerWaalsContact C-N 3.29Å; L1051-H1053 PolarHBondContact O-N 3.37Å; H1053-F1055 PolarHBondContact O-N 2.84Å; H1053-H1056 WeakPolarHBondContact O-CB 3.15Å; H1053-H1056 PolarHBondContact O-N 3.03Å; H1053-Q1057 PolarHBondContact CD2-OE1 2.73Å; H1053-Q1057 PolarHBondContact CE1-NE2 3.43Å; H1053-Q1057 PolarHBondContact NE2-OE1 2.9Å; H1053-Q1057 PolarHBondContact O-N 3.07Å; H1053-Q1057 VanDerWaalsContact O-N 3.15Å
1054L72.9Confident65.2Low4 Ų440 Ų402%0.02120%0.195CC..Hα-helixtrans-55.5-50.4175.7-177.573.9000111.7Y1020 Y1050 L1051 H1056 Q1057 A1058 A1065 L1068 I1072Y1020-L1054 HydrophobicContact CD1-CD1 4.35Å; Y1020-L1054 HydrophobicContact CE1-CD1 3.71Å; Y1050-L1054 VanDerWaalsContact O-CB 3.27Å; Y1050-L1054 WeakPolarHBondContact O-CB 3.33Å; Y1050-L1054 PolarHBondContact O-N 2.88Å; L1051-L1054 HydrophobicContact CD2-CD2 4.46Å; L1051-L1054 PolarHBondContact O-N 3.4Å; L1054-H1056 PolarHBondContact O-N 3.29Å; L1054-Q1057 PolarHBondContact O-N 3.1Å; L1054-A1058 HydrophobicContact CD1-CB 4.4Å; L1054-A1058 WeakPolarHBondContact O-CB 3.28Å; L1054-A1058 PolarHBondContact O-N 3.09Å; L1054-A1065 HydrophobicContact CD2-CB 4.32Å; L1054-A1065 HydrophobicContact CG-CB 4.08Å; L1054-L1068 HydrophobicContact CD1-CD2 4.31Å; L1054-L1068 HydrophobicContact CD2-CD2 4.12Å; L1054-I1072 HydrophobicContact CD2-CD1 3.51Å
1055F69.5Low65Low1 Ų138 Ų380%0.00419%0.188CC..Hα-helixtrans-70.4-16.6177.6-76.9-69.7000113.9L1051 H1053 F1059 A1065 L1066 M1069 L1229 A1233L1051-F1055 HydrophobicContact CD2-CE2 4.38Å; L1051-F1055 WeakPolarHBondContact O-CD2 3.46Å; L1051-F1055 PolarHBondContact O-N 3.43Å; H1053-F1055 PolarHBondContact O-N 2.84Å; F1055-F1059 WeakPolarHBondContact O-CD2 3.5Å; F1055-F1059 WeakPolarHBondContact O-CE2 3.43Å; F1055-A1065 HydrophobicContact CD1-CB 3.43Å; F1055-A1065 VanDerWaalsContact CD1-CB 3.43Å; F1055-A1065 HydrophobicContact CE1-CB 3.5Å; F1055-A1065 VanDerWaalsContact CE1-CB 3.5Å; F1055-A1065 HydrophobicContact CG-CB 4.14Å; F1055-A1065 HydrophobicContact CZ-CB 4.26Å; F1055-L1066 HydrophobicContact CE1-CB 4.46Å; F1055-L1066 HydrophobicContact CE1-CD2 3.96Å; F1055-L1066 HydrophobicContact CE1-CG 3.88Å; F1055-L1066 HydrophobicContact CZ-CD2 4.24Å; F1055-M1069 HydrophobicContact CZ-CB 4.16Å; F1055-M1069 HydrophobicContact CZ-CG 4.34Å; F1055-M1069 HydrophobicContact CZ-SD 4.15Å; F1055-L1229 HydrophobicContact CD2-CD1 3.44Å; F1055-L1229 VanDerWaalsContact CD2-CD1 3.44Å; F1055-L1229 HydrophobicContact CE2-CD1 3.89Å; F1055-L1229 HydrophobicContact CG-CD1 4.37Å; F1055-A1233 HydrophobicContact CD1-CB 3.78Å; F1055-A1233 HydrophobicContact CE1-CB 3.78Å; F1055-A1233 HydrophobicContact CG-CB 4.25Å; F1055-A1233 HydrophobicContact CZ-CB 4.22Å
1056H67.9Low65.3Low17 Ų1733.7 Ų33.78%0.07917%0.168CC..Hα-helixtrans-85.4-23.9178.2-172.775.2000113.4S1052 H1053 L1054 Y1323 H1326 L1327 T1330 N1331S1052-H1056 WeakPolarHBondContact O-CB 3.18Å; S1052-H1056 PolarHBondContact O-N 3.31Å; S1052-H1056 VanDerWaalsContact O-N 3.13Å; H1053-H1056 WeakPolarHBondContact O-CB 3.15Å; H1053-H1056 PolarHBondContact O-N 3.03Å; L1054-H1056 PolarHBondContact O-N 3.29Å; H1056-Y1323 AromaticContact CE1-CE1 3.75Å; H1056-Y1323 AromaticContact CE1-CE2 3.24Å; H1056-Y1323 WeakPolarHBondContact CE1-CE2 3.42Å; H1056-Y1323 AromaticContact CE1-CZ 2.84Å; H1056-Y1323 PolarHBondContact CE1-OH 3.03Å; H1056-Y1323 AromaticContact ND1-CE2 3.69Å; H1056-Y1323 AromaticContact ND1-CZ 3.59Å; H1056-Y1323 PolarHBondContact ND1-OH 3.28Å; H1056-Y1323 VanDerWaalsContact ND1-OH 3.08Å; H1056-Y1323 AromaticContact NE2-CD2 3.88Å; H1056-Y1323 AromaticContact NE2-CE2 3.32Å; H1056-Y1323 VanDerWaalsContact NE2-CE2 3.32Å; H1056-Y1323 WeakPolarHBondContact NE2-CE2 3.48Å; H1056-Y1323 AromaticContact NE2-CZ 3.94Å; H1056-H1326 AromaticContact NE2-CD2 3.9Å; H1056-H1326 AromaticContact NE2-CE1 3.37Å; H1056-H1326 PolarHBondContact NE2-CE1 2.93Å; H1056-H1326 AromaticContact NE2-CG 3.16Å; H1056-H1326 AromaticContact NE2-ND1 2.78Å; H1056-H1326 PolarHBondContact NE2-ND1 3.32Å; H1056-L1327 WeakPolarHBondContact CE1-CD2 3.47Å; H1056-L1327 WeakPolarHBondContact ND1-CD2 3.42Å; H1056-T1330 PolarHBondContact O-OG1 2.93Å; H1056-N1331 PolarHBondContact O-ND2 2.91Å; H1056-N1331 PolarHBondContact O-OD1 2.98Å
1057Q66.1Low65.1Low56 Ų5636 Ų3626%0.26218%0.177SC..Hα-helixtrans-111-29.9-175.3-64.3-176.6-3200114.9N1012 H1053 L1054 F1059 N1331N1012-Q1057 PolarHBondContact ND2-OE1 3.21Å; N1012-Q1057 PolarHBondContact OD1-OE1 2.95Å; N1012-Q1057 VanDerWaalsContact OD1-OE1 3.12Å; H1053-Q1057 PolarHBondContact CD2-OE1 2.73Å; H1053-Q1057 PolarHBondContact CE1-NE2 3.43Å; H1053-Q1057 PolarHBondContact NE2-OE1 2.9Å; H1053-Q1057 PolarHBondContact O-N 3.07Å; H1053-Q1057 VanDerWaalsContact O-N 3.15Å; L1054-Q1057 PolarHBondContact O-N 3.1Å; Q1057-F1059 PolarHBondContact O-N 3.17Å; Q1057-N1331 PolarHBondContact O-OD1 3.46Å; Q1057-N1331 VanDerWaalsContact O-OD1 3.12Å
1058A57.2Low64.9Low14 Ų1436 Ų3612%0.11618%0.177CC..  trans-96.823.8-163.700000116.5L1054 A1065L1054-A1058 HydrophobicContact CD1-CB 4.4Å; L1054-A1058 WeakPolarHBondContact O-CB 3.28Å; L1054-A1058 PolarHBondContact O-N 3.09Å; A1058-A1065 HydrophobicContact CB-CB 4.3Å
1059F51Low65.4Low16 Ų1635.2 Ų35.27%0.0717%0.173CC..THydrogen-bonded Turntrans-81.7-9.8-178.2-97.3-84.4000115.9F1055 Q1057 Q1061 Q1062 S1232 F1236 N1331F1055-F1059 WeakPolarHBondContact O-CD2 3.5Å; F1055-F1059 WeakPolarHBondContact O-CE2 3.43Å; Q1057-F1059 PolarHBondContact O-N 3.17Å; F1059-Q1061 PolarHBondContact O-N 3.45Å; F1059-Q1062 PolarHBondContact O-N 2.74Å; F1059-S1232 WeakPolarHBondContact CE2-O 3.18Å; F1059-S1232 WeakPolarHBondContact CZ-O 3.38Å; F1059-F1236 HydrophobicContact CB-CD2 4.24Å; F1059-F1236 HydrophobicContact CD1-CB 4.19Å; F1059-F1236 AromaticContact CD1-CD2 3.74Å; F1059-F1236 HydrophobicContact CD1-CD2 3.74Å; F1059-F1236 HydrophobicContact CD1-CG 4.45Å; F1059-F1236 HydrophobicContact CD2-CD2 4.15Å; F1059-F1236 HydrophobicContact CD2-CE2 4.5Å; F1059-F1236 HydrophobicContact CE1-CB 4.15Å; F1059-F1236 HydrophobicContact CE1-CD2 4.07Å; F1059-F1236 HydrophobicContact CE2-CD2 4.45Å; F1059-F1236 AromaticContact CG-CD2 3.78Å; F1059-F1236 HydrophobicContact CG-CD2 3.78Å; F1059-F1236 HydrophobicContact CG-CE2 4.37Å; F1059-F1236 HydrophobicContact CZ-CD2 4.41Å; F1059-N1331 HydrophobicContact CB-CB 3.57Å; F1059-N1331 WeakPolarHBondContact CB-OD1 3.44Å; F1059-N1331 PolarHBondContact N-OD1 3.23Å; F1059-N1331 VanDerWaalsContact N-OD1 3.15Å
1060T49.5Very low65.7Low97 Ų9730.9 Ų30.960%0.59515%0.153SC*.THydrogen-bonded Turntrans-56.4-34.8-179.753.20000112.5Q1062 N1331T1060-Q1062 PolarHBondContact O-N 2.75Å; T1060-N1331 WeakPolarHBondContact CG2-O 3.41Å
1061Q51.9Low65.6Low108 Ų10831.8 Ų31.851%0.50516%0.157SC..SBendtrans-97.264.6175.4-63.1-170.816.500112.2F1059 N1063 F1064F1059-Q1061 PolarHBondContact O-N 3.45Å; Q1061-N1063 PolarHBondContact O-N 3.05Å; Q1061-F1064 HydrophobicContact CB-CB 3.93Å; Q1061-F1064 WeakPolarHBondContact O-CB 3.3Å; Q1061-F1064 PolarHBondContact O-N 3.13Å
1062Q51.5Low65.5Low159 Ų15931.7 Ų31.774%0.74316%0.156SC*.THydrogen-bonded Turntrans25.163.4167.7-72.5-168.2-42.300116.3F1059 T1060F1059-Q1062 PolarHBondContact O-N 2.74Å; T1060-Q1062 PolarHBondContact O-N 2.75Å
1063N58.8Low65.7Low25 Ų2531.5 Ų31.513%0.13416%0.155CC..THydrogen-bonded Turntrans82.321.2177.5-43.3-81.7000117.6Q1061 A1065 L1066 Y1067 R1129Q1061-N1063 PolarHBondContact O-N 3.05Å; N1063-A1065 VanDerWaalsContact C-N 3.26Å; N1063-A1065 PolarHBondContact O-N 2.87Å; N1063-L1066 HydrophobicContact CB-CB 4.25Å; N1063-L1066 HydrophobicContact CB-CD1 3.92Å; N1063-L1066 WeakPolarHBondContact O-CB 3.16Å; N1063-L1066 PolarHBondContact O-N 3.37Å; N1063-Y1067 PolarHBondContact O-N 3.49Å; N1063-Y1067 VanDerWaalsContact O-N 3.15Å; N1063-R1129 PolarHBondContact ND2-NH2 2.57Å
1064F61.5Low65.8Low23 Ų2329.2 Ų29.210%0.10115%0.145CC..Hα-helixtrans-47.9-42.8174.1-176.1-82000114I1017 Y1020 Q1061 L1066 Y1067 L1068I1017-F1064 HydrophobicContact CG1-CE2 3.83Å; I1017-F1064 HydrophobicContact CG1-CZ 3.94Å; Y1020-F1064 AromaticContact CD2-CE1 3.66Å; Y1020-F1064 HydrophobicContact CD2-CE1 3.66Å; Y1020-F1064 AromaticContact CD2-CZ 3.64Å; Y1020-F1064 HydrophobicContact CD2-CZ 3.64Å; Y1020-F1064 HydrophobicContact CE2-CD1 4.43Å; Y1020-F1064 AromaticContact CE2-CE1 3.28Å; Y1020-F1064 HydrophobicContact CE2-CE1 3.28Å; Y1020-F1064 AromaticContact CE2-CZ 3.44Å; Y1020-F1064 HydrophobicContact CE2-CZ 3.44Å; Y1020-F1064 VanDerWaalsContact CE2-CZ 3.44Å; Y1020-F1064 HydrophobicContact CG-CE1 4.43Å; Y1020-F1064 AromaticContact CZ-CE1 3.76Å; Q1061-F1064 HydrophobicContact CB-CB 3.93Å; Q1061-F1064 WeakPolarHBondContact O-CB 3.3Å; Q1061-F1064 PolarHBondContact O-N 3.13Å; F1064-L1066 PolarHBondContact O-N 2.75Å; F1064-Y1067 WeakPolarHBondContact O-CB 3.49Å; F1064-Y1067 PolarHBondContact O-N 3.26Å; F1064-Y1067 VanDerWaalsContact O-N 3.13Å; F1064-L1068 HydrophobicContact CE1-CB 4.38Å; F1064-L1068 HydrophobicContact CE1-CD2 3.98Å; F1064-L1068 WeakPolarHBondContact O-CB 3.29Å; F1064-L1068 PolarHBondContact O-N 3.27Å
1065A64.1Low65.7Low3 Ų330.6 Ų30.63%0.02515%0.152CC..Hα-helixtrans-62.7-39.4177.900000113.6L1054 F1055 A1058 N1063 Y1067 L1068 M1069L1054-A1065 HydrophobicContact CD2-CB 4.32Å; L1054-A1065 HydrophobicContact CG-CB 4.08Å; F1055-A1065 HydrophobicContact CD1-CB 3.43Å; F1055-A1065 VanDerWaalsContact CD1-CB 3.43Å; F1055-A1065 HydrophobicContact CE1-CB 3.5Å; F1055-A1065 VanDerWaalsContact CE1-CB 3.5Å; F1055-A1065 HydrophobicContact CG-CB 4.14Å; F1055-A1065 HydrophobicContact CZ-CB 4.26Å; A1058-A1065 HydrophobicContact CB-CB 4.3Å; N1063-A1065 VanDerWaalsContact C-N 3.26Å; N1063-A1065 PolarHBondContact O-N 2.87Å; A1065-Y1067 VanDerWaalsContact C-N 3.28Å; A1065-Y1067 PolarHBondContact O-N 3.07Å; A1065-L1068 PolarHBondContact O-N 2.98Å; A1065-M1069 WeakPolarHBondContact O-CB 3.22Å; A1065-M1069 PolarHBondContact O-N 3.43Å
1066L70.6Confident65.8Low1 Ų130.6 Ų30.61%0.00515%0.153CC..Hα-helixtrans-64.9-34.8174.1-78.9167.4000111.4F1055 N1063 F1064 P1070 W1125 A1233F1055-L1066 HydrophobicContact CE1-CB 4.46Å; F1055-L1066 HydrophobicContact CE1-CD2 3.96Å; F1055-L1066 HydrophobicContact CE1-CG 3.88Å; F1055-L1066 HydrophobicContact CZ-CD2 4.24Å; N1063-L1066 HydrophobicContact CB-CB 4.25Å; N1063-L1066 HydrophobicContact CB-CD1 3.92Å; N1063-L1066 WeakPolarHBondContact O-CB 3.16Å; N1063-L1066 PolarHBondContact O-N 3.37Å; F1064-L1066 PolarHBondContact O-N 2.75Å; L1066-P1070 WeakPolarHBondContact O-CD 3.2Å; L1066-W1125 HydrophobicContact CD1-CH2 4.5Å; L1066-W1125 HydrophobicContact CD1-CZ3 3.83Å; L1066-A1233 HydrophobicContact CD2-CB 4.19Å
1067Y68.7Low65.9Low57 Ų5730.3 Ų30.322%0.22415%0.152CC..Hα-helixtrans-71.7-36.4178.9-168.2-77.2000112.6I1017 N1063 F1064 A1065 P1070 N1143 Q1146I1017-Y1067 HydrophobicContact CD1-CD1 3.7Å; I1017-Y1067 HydrophobicContact CD1-CE1 3.47Å; I1017-Y1067 VanDerWaalsContact CD1-CE1 3.47Å; I1017-Y1067 HydrophobicContact CG1-CD1 4.07Å; I1017-Y1067 HydrophobicContact CG1-CE1 4.22Å; N1063-Y1067 PolarHBondContact O-N 3.49Å; N1063-Y1067 VanDerWaalsContact O-N 3.15Å; F1064-Y1067 WeakPolarHBondContact O-CB 3.49Å; F1064-Y1067 PolarHBondContact O-N 3.26Å; F1064-Y1067 VanDerWaalsContact O-N 3.13Å; A1065-Y1067 VanDerWaalsContact C-N 3.28Å; A1065-Y1067 PolarHBondContact O-N 3.07Å; Y1067-P1070 WeakPolarHBondContact O-CD 3.44Å; Y1067-N1143 WeakPolarHBondContact OH-CB 3.16Å; Y1067-N1143 PolarHBondContact OH-ND2 3.32Å; Y1067-Q1146 VanDerWaalsContact CD1-NE2 3.34Å; Y1067-Q1146 HydrophobicContact CE1-CG 4.4Å; Y1067-Q1146 VanDerWaalsContact CE1-NE2 3.26Å; Y1067-Q1146 VanDerWaalsContact CE2-OE1 3.22Å; Y1067-Q1146 VanDerWaalsContact CZ-NE2 3.29Å; Y1067-Q1146 PolarHBondContact O-NE2 3.26Å; Y1067-Q1146 VanDerWaalsContact O-NE2 3.1Å; Y1067-Q1146 PolarHBondContact OH-OE1 2.93Å
1068L70.3Confident66.1Low0 Ų032.5 Ų32.50%016%0.164CC..Hα-helixtrans-79.4-28.6178.4179.364.3000112.8I1017 Y1020 L1054 F1064 A1065 P1070 H1071 I1072I1017-L1068 HydrophobicContact CG2-CD1 4.03Å; Y1020-L1068 HydrophobicContact CD1-CD2 3.46Å; Y1020-L1068 VanDerWaalsContact CD1-CD2 3.46Å; Y1020-L1068 HydrophobicContact CD2-CD2 4.1Å; Y1020-L1068 HydrophobicContact CE1-CD2 4.06Å; Y1020-L1068 HydrophobicContact CG-CD1 4.45Å; Y1020-L1068 HydrophobicContact CG-CD2 3.47Å; Y1020-L1068 VanDerWaalsContact CG-CD2 3.47Å; L1054-L1068 HydrophobicContact CD1-CD2 4.31Å; L1054-L1068 HydrophobicContact CD2-CD2 4.12Å; F1064-L1068 HydrophobicContact CE1-CB 4.38Å; F1064-L1068 HydrophobicContact CE1-CD2 3.98Å; F1064-L1068 WeakPolarHBondContact O-CB 3.29Å; F1064-L1068 PolarHBondContact O-N 3.27Å; A1065-L1068 PolarHBondContact O-N 2.98Å; L1068-P1070 VanDerWaalsContact C-CD 3.47Å; L1068-H1071 HydrophobicContact CD1-CB 4.41Å; L1068-H1071 WeakPolarHBondContact O-CB 3.31Å; L1068-H1071 PolarHBondContact O-N 3.14Å; L1068-I1072 HydrophobicContact CD1-CG1 4.49Å; L1068-I1072 HydrophobicContact CD2-CD1 3.93Å; L1068-I1072 HydrophobicContact CD2-CG1 4.5Å; L1068-I1072 HydrophobicContact CG-CD1 3.77Å; L1068-I1072 HydrophobicContact CG-CG1 4.02Å; L1068-I1072 PolarHBondContact O-N 3.39Å; L1068-I1072 VanDerWaalsContact O-N 3.16Å
1069M78.3Confident66.7Low1 Ų132.9 Ų32.91%0.00517%0.167CC..Hα-helixtrans-48.5-45.8-177.1-178-164.7-179.300114.8F1055 A1065 H1071 I1072 I1073 L1119 L1122 L1123F1055-M1069 HydrophobicContact CZ-CB 4.16Å; F1055-M1069 HydrophobicContact CZ-CG 4.34Å; F1055-M1069 HydrophobicContact CZ-SD 4.15Å; A1065-M1069 WeakPolarHBondContact O-CB 3.22Å; A1065-M1069 PolarHBondContact O-N 3.43Å; M1069-H1071 VanDerWaalsContact C-N 3.29Å; M1069-H1071 PolarHBondContact O-N 3Å; M1069-I1072 PolarHBondContact O-N 2.98Å; M1069-I1073 HydrophobicContact CG-CG1 4.4Å; M1069-I1073 WeakPolarHBondContact O-CG1 3.37Å; M1069-I1073 PolarHBondContact O-N 3.47Å; M1069-L1119 HydrophobicContact CE-CB 4.1Å; M1069-L1119 HydrophobicContact CE-CD2 3.48Å; M1069-L1119 VanDerWaalsContact CE-CD2 3.48Å; M1069-L1119 HydrophobicContact CE-CG 4.41Å; M1069-L1122 HydrophobicContact CE-CB 3.97Å; M1069-L1122 HydrophobicContact CE-CD1 4.39Å; M1069-L1122 HydrophobicContact SD-CB 4.02Å; M1069-L1123 HydrophobicContact CE-CD1 4.45Å; M1069-L1123 HydrophobicContact CE-CD2 4.23Å; M1069-L1123 HydrophobicContact CE-CG 3.87Å; M1069-L1123 HydrophobicContact CG-CD2 4.17Å; M1069-L1123 HydrophobicContact SD-CD2 4.06Å; M1069-L1123 HydrophobicContact SD-CG 4.23Å
1070P77Confident67.5Low0 Ų032.4 Ų32.40%017%0.165CC..Hα-helixtrans-60.1-37.9177.8-21.132.4000112.7L1066 Y1067 L1068 I1073 D1074 L1123 V1149 Y1150L1066-P1070 WeakPolarHBondContact O-CD 3.2Å; Y1067-P1070 WeakPolarHBondContact O-CD 3.44Å; L1068-P1070 VanDerWaalsContact C-CD 3.47Å; P1070-I1073 PolarHBondContact O-N 2.82Å; P1070-D1074 VanDerWaalsContact O-CB 3.26Å; P1070-D1074 WeakPolarHBondContact O-CB 3.41Å; P1070-D1074 PolarHBondContact O-N 2.93Å; P1070-L1123 HydrophobicContact CB-CD2 4.1Å; P1070-L1123 HydrophobicContact CG-CD2 3.88Å; P1070-V1149 HydrophobicContact CB-CG1 3.67Å; P1070-V1149 WeakPolarHBondContact O-CG1 3.47Å; P1070-Y1150 HydrophobicContact CB-CE1 4.05Å; P1070-Y1150 HydrophobicContact CG-CE1 3.86Å; P1070-Y1150 WeakPolarHBondContact CG-OH 3.19Å
1071H73.8Confident68.2Low20 Ų2031.5 Ų31.59%0.09316%0.161CC..Hα-helixtrans-69.7-39.4179.1-65.2-77.4000112L1068 M1069 N1075 Q1146L1068-H1071 HydrophobicContact CD1-CB 4.41Å; L1068-H1071 WeakPolarHBondContact O-CB 3.31Å; L1068-H1071 PolarHBondContact O-N 3.14Å; M1069-H1071 VanDerWaalsContact C-N 3.29Å; M1069-H1071 PolarHBondContact O-N 3Å; H1071-N1075 WeakPolarHBondContact O-CB 3.34Å; H1071-N1075 PolarHBondContact O-N 3.08Å; H1071-N1075 PolarHBondContact O-ND2 2.92Å; H1071-Q1146 WeakPolarHBondContact NE2-CG 3.37Å
1072I73.2Confident68.7Low1 Ų131.9 Ų31.91%0.00517%0.166CC..Hα-helixtrans-61.1-50.5174-64.2167.1000109.8F1028 L1047 Y1050 L1051 L1054 L1068 M1069 N1075 C1076F1028-I1072 HydrophobicContact CE2-CG2 4.28Å; L1047-I1072 HydrophobicContact CD1-CG2 3.86Å; Y1050-I1072 HydrophobicContact CE1-CD1 3.92Å; Y1050-I1072 HydrophobicContact CE1-CG1 4.45Å; Y1050-I1072 HydrophobicContact CE1-CG2 4.31Å; L1051-I1072 HydrophobicContact CD2-CD1 4.02Å; L1051-I1072 HydrophobicContact CD2-CG2 4.19Å; L1054-I1072 HydrophobicContact CD2-CD1 3.51Å; L1068-I1072 HydrophobicContact CD1-CG1 4.49Å; L1068-I1072 HydrophobicContact CD2-CD1 3.93Å; L1068-I1072 HydrophobicContact CD2-CG1 4.5Å; L1068-I1072 HydrophobicContact CG-CD1 3.77Å; L1068-I1072 HydrophobicContact CG-CG1 4.02Å; L1068-I1072 PolarHBondContact O-N 3.39Å; L1068-I1072 VanDerWaalsContact O-N 3.16Å; M1069-I1072 PolarHBondContact O-N 2.98Å; I1072-N1075 PolarHBondContact O-N 3.35Å; I1072-C1076 PolarHBondContact O-N 3.07Å; I1072-C1076 PolarHBondContact O-SG 3.43Å
1073I74.7Confident69.1Low1 Ų124.8 Ų24.81%0.00513%0.133CC..Hα-helixtrans-66.2-39.4-177.3-63-62.3000112L1047 L1051 M1069 P1070 C1076 L1077 L1119 L1123 L1153 W1158L1047-I1073 HydrophobicContact CD2-CD1 4.47Å; L1051-I1073 HydrophobicContact CD1-CD1 4.19Å; M1069-I1073 HydrophobicContact CG-CG1 4.4Å; M1069-I1073 WeakPolarHBondContact O-CG1 3.37Å; M1069-I1073 PolarHBondContact O-N 3.47Å; P1070-I1073 PolarHBondContact O-N 2.82Å; I1073-C1076 PolarHBondContact O-N 3.45Å; I1073-L1077 HydrophobicContact CG2-CD1 3.78Å; I1073-L1077 HydrophobicContact CG2-CG 4.33Å; I1073-L1077 WeakPolarHBondContact O-CB 3.37Å; I1073-L1077 VanDerWaalsContact O-CG 3.29Å; I1073-L1077 WeakPolarHBondContact O-CG 3.42Å; I1073-L1077 PolarHBondContact O-N 3.36Å; I1073-L1119 HydrophobicContact CD1-CD1 4.12Å; I1073-L1119 HydrophobicContact CD1-CD2 4.33Å; I1073-L1123 HydrophobicContact CG1-CD1 4.49Å; I1073-L1123 HydrophobicContact CG2-CD1 4.25Å; I1073-L1153 HydrophobicContact CG2-CD2 4.14Å; I1073-W1158 HydrophobicContact CG2-CE3 3.91Å; I1073-W1158 HydrophobicContact CG2-CH2 4.26Å; I1073-W1158 HydrophobicContact CG2-CZ3 3.72Å
1074D73.3Confident69.2Low9 Ų925 Ų255%0.04813%0.133CC..Hα-helixtrans-61.3-46.9174.1-176.760.3000111.6P1070 C1076 L1077 I1078 V1149 R1152P1070-D1074 VanDerWaalsContact O-CB 3.26Å; P1070-D1074 WeakPolarHBondContact O-CB 3.41Å; P1070-D1074 PolarHBondContact O-N 2.93Å; D1074-C1076 VanDerWaalsContact C-N 3.34Å; D1074-C1076 PolarHBondContact O-N 3Å; D1074-L1077 PolarHBondContact O-N 2.87Å; D1074-I1078 WeakPolarHBondContact O-CD1 3.25Å; D1074-I1078 VanDerWaalsContact O-CG1 3.22Å; D1074-I1078 WeakPolarHBondContact O-CG1 3.43Å; D1074-I1078 PolarHBondContact O-N 3.34Å; D1074-V1149 HydrophobicContact CB-CG1 3.88Å; D1074-V1149 HydrophobicContact CB-CG2 4.26Å; D1074-R1152 VanDerWaalsContact CG-NH1 3.32Å; D1074-R1152 IonicContact OD1-CZ 2.8Å; D1074-R1152 IonicContact OD1-NE 3.83Å; D1074-R1152 IonicContact OD1-NH1 3.65Å; D1074-R1152 PolarHBondContact OD1-NH1 3.12Å; D1074-R1152 IonicContact OD1-NH2 3.73Å; D1074-R1152 IonicContact OD2-CZ 3.88Å; D1074-R1152 IonicContact OD2-NH1 3.82Å; D1074-R1152 PolarHBondContact OD2-NH1 3.43Å; D1074-R1152 IonicContact OD2-NH2 2.68Å; D1074-R1152 PolarHBondContact OD2-NH2 3.38Å
1075N69.9Low68.5Low33 Ų3327.3 Ų27.318%0.17615%0.15CC..Hα-helixtrans-62.2-40.1175.3-68.4-14.2000111.9S1021 H1071 I1072 I1078 A1079S1021-N1075 PolarHBondContact O-ND2 2.9Å; S1021-N1075 PolarHBondContact OG-ND2 3Å; H1071-N1075 WeakPolarHBondContact O-CB 3.34Å; H1071-N1075 PolarHBondContact O-N 3.08Å; H1071-N1075 PolarHBondContact O-ND2 2.92Å; I1072-N1075 PolarHBondContact O-N 3.35Å; N1075-I1078 PolarHBondContact O-N 3.42Å; N1075-A1079 WeakPolarHBondContact O-CB 3.43Å; N1075-A1079 PolarHBondContact O-N 3.24Å
1076C72.4Confident67.3Low2 Ų232.1 Ų32.11%0.01418%0.176CC..Hα-helixtrans-61.7-44174.6-660000112.2F1028 L1047 I1072 I1073 D1074 I1078 A1079 F1080 L1083F1028-C1076 WeakPolarHBondContact CE2-SG 3.44Å; F1028-C1076 VanDerWaalsContact CZ-SG 3.54Å; L1047-C1076 HydrophobicContact CD2-CB 4.28Å; I1072-C1076 PolarHBondContact O-N 3.07Å; I1072-C1076 PolarHBondContact O-SG 3.43Å; I1073-C1076 PolarHBondContact O-N 3.45Å; D1074-C1076 VanDerWaalsContact C-N 3.34Å; D1074-C1076 PolarHBondContact O-N 3Å; C1076-I1078 VanDerWaalsContact C-N 3.28Å; C1076-I1078 PolarHBondContact O-N 3.45Å; C1076-A1079 PolarHBondContact O-N 3.14Å; C1076-F1080 WeakPolarHBondContact O-CA 3.17Å; C1076-F1080 PolarHBondContact O-N 3.18Å; C1076-L1083 HydrophobicContact CB-CD2 4.38Å
1077L70.8Confident65.9Low11 Ų1134.1 Ų34.16%0.05819%0.188CC..Hα-helixtrans-75.1-15.1-179.4-69.8170000114I1073 D1074 L1153 W1158I1073-L1077 HydrophobicContact CG2-CD1 3.78Å; I1073-L1077 HydrophobicContact CG2-CG 4.33Å; I1073-L1077 WeakPolarHBondContact O-CB 3.37Å; I1073-L1077 VanDerWaalsContact O-CG 3.29Å; I1073-L1077 WeakPolarHBondContact O-CG 3.42Å; I1073-L1077 PolarHBondContact O-N 3.36Å; D1074-L1077 PolarHBondContact O-N 2.87Å; L1077-L1153 HydrophobicContact CD1-CD2 3.68Å; L1077-W1158 HydrophobicContact CD1-CD2 3.89Å; L1077-W1158 HydrophobicContact CD1-CE3 4.5Å; L1077-W1158 HydrophobicContact CD1-CG 4.06Å; L1077-W1158 HydrophobicContact CD1-CZ2 4.3Å; L1077-W1158 HydrophobicContact CD2-CZ2 3.9Å
1078I70.5Confident64.3Low102 Ų10238.1 Ų38.152%0.52321%0.208SC..Hα-helixtrans-83.2-44.9170.2-69.4162.7000110.4D1074 N1075 C1076D1074-I1078 WeakPolarHBondContact O-CD1 3.25Å; D1074-I1078 VanDerWaalsContact O-CG1 3.22Å; D1074-I1078 WeakPolarHBondContact O-CG1 3.43Å; D1074-I1078 PolarHBondContact O-N 3.34Å; N1075-I1078 PolarHBondContact O-N 3.42Å; C1076-I1078 VanDerWaalsContact C-N 3.28Å; C1076-I1078 PolarHBondContact O-N 3.45Å
1079A68Low62.7Low22 Ų2242.5 Ų42.518%0.18223%0.232CC..Hα-helixtrans-72.1-38178.200000112.8F1028 N1075 C1076F1028-A1079 HydrophobicContact CB-CB 4.04Å; N1075-A1079 WeakPolarHBondContact O-CB 3.43Å; N1075-A1079 PolarHBondContact O-N 3.24Å; C1076-A1079 PolarHBondContact O-N 3.14Å
1080F68.8Low60.6Low5 Ų545.8 Ų45.82%0.02225%0.248CC..  trans-133.281-176.9-58.5-88.2000111.2F1028 L1031 L1035 C1076 N1082 L1083F1028-F1080 HydrophobicContact CB-CE2 4.3Å; F1028-F1080 HydrophobicContact CD1-CE2 4.19Å; L1031-F1080 HydrophobicContact CB-CE2 4.16Å; L1031-F1080 HydrophobicContact CB-CZ 3.61Å; L1035-F1080 HydrophobicContact CD2-CD1 4.23Å; L1035-F1080 HydrophobicContact CD2-CE1 4.37Å; C1076-F1080 WeakPolarHBondContact O-CA 3.17Å; C1076-F1080 PolarHBondContact O-N 3.18Å; F1080-N1082 PolarHBondContact O-N 3.48Å; F1080-N1082 VanDerWaalsContact O-N 3.11Å; F1080-L1083 HydrophobicContact CB-CB 3.72Å; F1080-L1083 HydrophobicContact CB-CD1 4.49Å; F1080-L1083 HydrophobicContact CB-CD2 4.47Å; F1080-L1083 HydrophobicContact CB-CG 4.46Å; F1080-L1083 WeakPolarHBondContact O-CB 3.48Å; F1080-L1083 PolarHBondContact O-N 2.82Å
1081P64.3Low58.6Low78 Ų7853.4 Ų53.451%0.50628%0.282SS..THydrogen-bonded Turntrans-55.9-29.4176.1-25.835.4000113.5
1082N61.2Low57.1Low117 Ų11758.1 Ų58.163%0.62631%0.307SS*.THydrogen-bonded Turntrans-104.614.6-175.3-61.11.6000113.2F1080 W1084 C1085F1080-N1082 PolarHBondContact O-N 3.48Å; F1080-N1082 VanDerWaalsContact O-N 3.11Å; N1082-W1084 PolarHBondContact O-N 3.47Å; N1082-C1085 PolarHBondContact O-N 3.26Å; N1082-C1085 PolarHBondContact O-SG 2.96Å
1083L61.5Low55.1Low10 Ų1061.2 Ų61.25%0.05232%0.322CS..THydrogen-bonded Turntrans-56.3-26.5178.5-171.857.2000113V1040 S1043 R1044 L1047 C1076 F1080V1040-L1083 HydrophobicContact CG1-CD1 4.07Å; S1043-L1083 VanDerWaalsContact OG-CD1 3.29Å; S1043-L1083 WeakPolarHBondContact OG-CD1 3.44Å; R1044-L1083 HydrophobicContact CB-CD1 3.95Å; L1047-L1083 HydrophobicContact CD2-CD2 3.78Å; C1076-L1083 HydrophobicContact CB-CD2 4.38Å; F1080-L1083 HydrophobicContact CB-CB 3.72Å; F1080-L1083 HydrophobicContact CB-CD1 4.49Å; F1080-L1083 HydrophobicContact CB-CD2 4.47Å; F1080-L1083 HydrophobicContact CB-CG 4.46Å; F1080-L1083 WeakPolarHBondContact O-CB 3.48Å; F1080-L1083 PolarHBondContact O-N 2.82Å
1084W60.2Low53.5Low30 Ų3063.5 Ų63.511%0.11433%0.334CS..THydrogen-bonded Turntrans-133.773.1178.9-46.693.6000108.6R1044 L1047 I1048 N1082 V1087 I1115 T1116 L1119 W1158R1044-W1084 HydrophobicContact CG-CE3 4.43Å; R1044-W1084 HydrophobicContact CG-CH2 3.66Å; R1044-W1084 HydrophobicContact CG-CZ2 4.19Å; R1044-W1084 HydrophobicContact CG-CZ3 3.8Å; L1047-W1084 HydrophobicContact CD2-CZ2 4.24Å; I1048-W1084 HydrophobicContact CD1-CH2 4.41Å; N1082-W1084 PolarHBondContact O-N 3.47Å; W1084-V1087 HydrophobicContact CB-CG2 3.65Å; W1084-I1115 HydrophobicContact CH2-CB 4.45Å; W1084-I1115 HydrophobicContact CH2-CG2 3.86Å; W1084-T1116 VanDerWaalsContact CZ3-OG1 3.27Å; W1084-T1116 WeakPolarHBondContact CZ3-OG1 3.33Å; W1084-L1119 HydrophobicContact CH2-CD1 4.5Å; W1084-L1119 HydrophobicContact CZ2-CD1 4.04Å; W1084-W1158 AromaticContact CD1-CH2 3.99Å; W1084-W1158 AromaticContact CD1-CZ2 3.58Å; W1084-W1158 HydrophobicContact CG-CZ2 4.15Å; W1084-W1158 AromaticContact NE1-CH2 3.94Å
1085C46.1Very low51.8Low70 Ų7069.2 Ų69.247%0.47336%0.36SS..THydrogen-bonded Turntrans-53.7141172.7-69.70000111N1082 V1087N1082-C1085 PolarHBondContact O-N 3.26Å; N1082-C1085 PolarHBondContact O-SG 2.96Å; C1085-V1087 VanDerWaalsContact C-N 3.26Å; C1085-V1087 PolarHBondContact O-N 3.19Å; C1085-V1087 VanDerWaalsContact O-N 3.15Å
1086N40.5Very low50Low104 Ų10474.6 Ų74.656%0.55638%0.382SS*.THydrogen-bonded Turntrans59.325.9167.2-45.6-49.2000115.9E1088 F1110N1086-E1088 PolarHBondContact O-N 2.96Å; N1086-F1110 HydrophobicContact CB-CD1 4.14Å; N1086-F1110 WeakPolarHBondContact ND2-CD1 3.48Å
1087V39.9Very low48.3Very low43 Ų4380.3 Ų80.326%0.26141%0.408SS..  trans-79.690.2171-168.70000110W1084 C1085 T1116 K1120W1084-V1087 HydrophobicContact CB-CG2 3.65Å; C1085-V1087 VanDerWaalsContact C-N 3.26Å; C1085-V1087 PolarHBondContact O-N 3.19Å; C1085-V1087 VanDerWaalsContact O-N 3.15Å; V1087-T1116 HydrophobicContact CB-CG2 4.44Å; V1087-T1116 HydrophobicContact CG1-CG2 3.81Å; V1087-T1116 HydrophobicContact CG2-CG2 4.18Å; V1087-K1120 VanDerWaalsContact CG1-NZ 3.3Å; V1087-K1120 PolarHBondContact O-NZ 3.47Å
1088E34.9Very low46.9Very low141 Ų14182.4 Ų82.466%0.65942%0.424SS*.  trans-51.7156174-62.7-168106.300112N1086 E1093 K1120N1086-E1088 PolarHBondContact O-N 2.96Å; E1088-E1093 VanDerWaalsContact CB-OE2 3.28Å; E1088-E1093 WeakPolarHBondContact CB-OE2 3.33Å; E1088-K1120 PolarHBondContact O-NZ 2.79Å; E1088-K1120 VanDerWaalsContact O-NZ 3.13Å
1089L37.3Very low45.3Very low93 Ų9382.3 Ų82.349%0.48742%0.424SS..  trans-75.6143.5-173.5-73.399.2000109.3K1091 G1157L1089-K1091 PolarHBondContact O-N 3.16Å; L1089-G1157 WeakPolarHBondContact CD2-O 3.47Å
1090I35.1Very low43.4Very low69 Ų6984.9 Ų84.935%0.35444%0.438SS..  trans-70.478.9175.1-53.7176.2000109.6I1094 K1120I1090-I1094 HydrophobicContact CG2-CD1 3.8Å; I1090-I1094 HydrophobicContact CG2-CG1 3.99Å; I1090-K1120 HydrophobicContact CD1-CB 3.86Å; I1090-K1120 HydrophobicContact CD1-CD 3.84Å; I1090-K1120 HydrophobicContact CD1-CG 4.49Å; I1090-K1120 HydrophobicContact CG1-CD 4.15Å
1091K34.6Very low41.7Very low161 Ų16189.2 Ų89.270%0.747%0.466SS*.SBendtrans-11175.9162.2-75.5-175173.8-178.20106.6L1089 E1093L1089-K1091 PolarHBondContact O-N 3.16Å; K1091-E1093 PolarHBondContact O-N 3.15Å
1092D40.7Very low40.3Very low118 Ų11890 Ų9063%0.63148%0.479SS*.SBendtrans63.3-0.3168.4-45.1-45.1000116.6I1094 E1095D1092-I1094 PolarHBondContact O-N 3.01Å; D1092-E1095 WeakPolarHBondContact O-CB 3.47Å; D1092-E1095 PolarHBondContact O-N 3.36Å
1093E32.7Very low38.7Very low66 Ų6689.8 Ų89.831%0.30848%0.482SS..Hα-helixtrans-56.5-19.5174.9-80.6156.7-15400115.5E1088 K1091 E1095 F1096 H1097E1088-E1093 VanDerWaalsContact CB-OE2 3.28Å; E1088-E1093 WeakPolarHBondContact CB-OE2 3.33Å; K1091-E1093 PolarHBondContact O-N 3.15Å; E1093-E1095 PolarHBondContact O-N 3.12Å; E1093-E1095 VanDerWaalsContact O-N 3.16Å; E1093-F1096 WeakPolarHBondContact O-CB 3.48Å; E1093-F1096 PolarHBondContact O-N 2.96Å; E1093-H1097 PolarHBondContact O-N 3.44Å
1094I39.8Very low37.3Very low50 Ų5094.3 Ų94.326%0.25651%0.51SS..Hα-helixtrans-70.2-2.5170.5-17.6179.5000112.2I1090 D1092 F1112 T1117 R1190I1090-I1094 HydrophobicContact CG2-CD1 3.8Å; I1090-I1094 HydrophobicContact CG2-CG1 3.99Å; D1092-I1094 PolarHBondContact O-N 3.01Å; I1094-F1112 HydrophobicContact CG2-CZ 4.49Å; I1094-T1117 HydrophobicContact CD1-CG2 4.13Å; I1094-R1190 VanDerWaalsContact CG2-NH1 3.28Å; I1094-R1190 VanDerWaalsContact O-CZ 3.25Å; I1094-R1190 PolarHBondContact O-NH1 3.42Å; I1094-R1190 PolarHBondContact O-NH2 2.82Å
1095E39.5Very low35.9Very low129 Ų12999.9 Ų99.960%0.60354%0.542SS*.Hα-helixtrans-95.8-34.9161.3-58.9-168.2151.500111.2D1092 E1093 H1097 S1098D1092-E1095 WeakPolarHBondContact O-CB 3.47Å; D1092-E1095 PolarHBondContact O-N 3.36Å; E1093-E1095 PolarHBondContact O-N 3.12Å; E1093-E1095 VanDerWaalsContact O-N 3.16Å; E1095-H1097 PolarHBondContact O-N 2.91Å; E1095-S1098 WeakPolarHBondContact O-CB 3.27Å; E1095-S1098 PolarHBondContact O-N 3.49Å; E1095-S1098 PolarHBondContact O-OG 2.84Å
1096F30.5Very low35.3Very low145 Ų145102.7 Ų102.764%0.63655%0.552SS**Hα-helixtrans-61.2-46.2-177.8-133.5-87.8000113.3E1093 S1098 L1099E1093-F1096 WeakPolarHBondContact O-CB 3.48Å; E1093-F1096 PolarHBondContact O-N 2.96Å; F1096-S1098 PolarHBondContact O-N 2.87Å; F1096-S1098 VanDerWaalsContact O-N 3.12Å; F1096-L1099 PolarHBondContact O-N 3.18Å
1097H37.4Very low35Very low122 Ų122104.6 Ų104.657%0.56556%0.562SS**THydrogen-bonded Turntrans-67.8-8.2174.5-73.9-35000114.4E1093 E1095 F1112E1093-H1097 PolarHBondContact O-N 3.44Å; E1095-H1097 PolarHBondContact O-N 2.91Å; H1097-F1112 AromaticContact CD2-CD2 3.58Å; H1097-F1112 AromaticContact CD2-CG 3.72Å; H1097-F1112 AromaticContact NE2-CD2 3.82Å; H1097-F1112 AromaticContact NE2-CG 3.89Å
1098S42.2Very low34.6Very low55 Ų55109 Ų10939%0.38558%0.584SS.*THydrogen-bonded Turntrans-89-7.7170.968.60000114E1095 F1096E1095-S1098 WeakPolarHBondContact O-CB 3.27Å; E1095-S1098 PolarHBondContact O-N 3.49Å; E1095-S1098 PolarHBondContact O-OG 2.84Å; F1096-S1098 PolarHBondContact O-N 2.87Å; F1096-S1098 VanDerWaalsContact O-N 3.12Å
1099L36.2Very low34.6Very low101 Ų101109.5 Ų109.553%0.52959%0.586SS.*THydrogen-bonded Turntrans-91.6-20-178.4-78.9154.3000114F1096 I1203F1096-L1099 PolarHBondContact O-N 3.18Å; L1099-I1203 HydrophobicContact CD2-CD1 3.83Å; L1099-I1203 HydrophobicContact CD2-CG1 4.31Å
1100T28.7Very low34.6Very low76 Ų76111.5 Ų111.547%0.46659%0.591SS.*  trans-139.776.5-176.641.80000115A1102T1100-A1102 PolarHBondContact O-N 3.3Å
1101P33.2Very low35.3Very low95 Ų95111.6 Ų111.662%0.61760%0.598SS**THydrogen-bonded Turntrans-67.6-17.7162-16.130.9000113.4
1102A33.8Very low36.2Very low94 Ų94107.5 Ų107.578%0.77758%0.58SS**THydrogen-bonded Turntrans-96.32-164.900000115.5T1100T1100-A1102 PolarHBondContact O-N 3.3Å
1103V29.1Very low37.4Very low113 Ų113102 Ų10269%0.68555%0.551SS**  trans-127.665176.3-167.20000109.3
1104V32.1Very low39.3Very low106 Ų106102 Ų10264%0.64255%0.549SS*.  trans-119.757.9167.1-168.10000107.8
1105D30Very low40.9Very low147 Ų14799.9 Ų99.979%0.78654%0.538SS*.  trans-69.5143.6160.4-98.7-45.2000108.9N1107D1105-N1107 PolarHBondContact O-N 3.2Å; D1105-N1107 VanDerWaalsContact O-N 3.12Å
1106N34Very low42.3Very low128 Ų12893.7 Ų93.768%0.68451%0.509SS*.THydrogen-bonded Turntrans-66.3112.7-165-51.6-83.8000112.1
1107N33.1Very low44.3Very low145 Ų14587.1 Ų87.178%0.77548%0.481SS*.THydrogen-bonded Turn175.5-25.2124.3-86.4-32.2000113.9D1105 H1109D1105-N1107 PolarHBondContact O-N 3.2Å; D1105-N1107 VanDerWaalsContact O-N 3.12Å; N1107-H1109 PolarHBondContact O-N 2.69Å
1108D31.7Very low46.2Very low136 Ų13681.3 Ų81.373%0.72745%0.454SS*.  trans-78.460.1-176.9-74.4-35.7000112.9F1110D1108-F1110 HydrophobicContact CB-CD2 4.11Å; D1108-F1110 HydrophobicContact CB-CE2 4.47Å; D1108-F1110 PolarHBondContact O-N 3.02Å
1109H34.6Very low48Very low150 Ų15078.8 Ų78.869%0.69444%0.436SS*.  trans-73.551.3169.3-77.1-55000112.2N1107 S1111N1107-H1109 PolarHBondContact O-N 2.69Å; H1109-S1111 PolarHBondContact O-N 2.83Å
1110F38.2Very low49.8Very low136 Ų13674.4 Ų74.460%0.59641%0.413SS*.  trans-71.184164.1-70.8-69.3000108.1N1086 D1108 F1112N1086-F1110 HydrophobicContact CB-CD1 4.14Å; N1086-F1110 WeakPolarHBondContact ND2-CD1 3.48Å; D1108-F1110 HydrophobicContact CB-CD2 4.11Å; D1108-F1110 HydrophobicContact CB-CE2 4.47Å; D1108-F1110 PolarHBondContact O-N 3.02Å; F1110-F1112 PolarHBondContact O-N 3.09Å; F1110-F1112 VanDerWaalsContact O-N 3.16Å
1111S50.4Low52.1Low70 Ų7071.4 Ų71.449%0.4939%0.394SS..  trans-76.4105.1-149.660.70000114.2H1109 S1113H1109-S1111 PolarHBondContact O-N 2.83Å; S1111-S1113 PolarHBondContact O-N 3.39Å
1112F52.6Low54.3Low75 Ų7567 Ų6733%0.32937%0.365SS..  trans-56.5118.3161.4178.5-89.5000110.4I1094 H1097 F1110 Y1114 T1117I1094-F1112 HydrophobicContact CG2-CZ 4.49Å; H1097-F1112 AromaticContact CD2-CD2 3.58Å; H1097-F1112 AromaticContact CD2-CG 3.72Å; H1097-F1112 AromaticContact NE2-CD2 3.82Å; H1097-F1112 AromaticContact NE2-CG 3.89Å; F1110-F1112 PolarHBondContact O-N 3.09Å; F1110-F1112 VanDerWaalsContact O-N 3.16Å; F1112-Y1114 HydrophobicContact CE1-CD1 4.05Å; F1112-Y1114 HydrophobicContact CE1-CE1 4.09Å; F1112-Y1114 HydrophobicContact CE1-CG 4.28Å; F1112-T1117 WeakPolarHBondContact CE2-OG1 3.27Å; F1112-T1117 HydrophobicContact CZ-CG2 4.32Å; F1112-T1117 WeakPolarHBondContact CZ-OG1 3.43Å
1113S66.7Low56.4Low4 Ų462.5 Ų62.53%0.02833%0.328CS..  trans-102.1128.3173.8171.20000110.9S1111 I1115 T1116 T1117 D1222S1111-S1113 PolarHBondContact O-N 3.39Å; S1113-I1115 PolarHBondContact O-N 3.14Å; S1113-I1115 PolarHBondContact OG-N 2.93Å; S1113-I1115 VanDerWaalsContact OG-N 3.15Å; S1113-T1116 PolarHBondContact O-N 3.43Å; S1113-T1116 PolarHBondContact OG-N 3.03Å; S1113-T1117 PolarHBondContact O-N 3.27Å; S1113-T1117 PolarHBondContact O-OG1 3.16Å; S1113-T1117 VanDerWaalsContact O-OG1 3.1Å; S1113-D1222 PolarHBondContact OG-OD1 3.23Å; S1113-D1222 PolarHBondContact OG-OD2 3.38Å
1114Y71.9Confident58.7Low66 Ų6657.9 Ų57.926%0.25930%0.302SS..Hα-helixtrans-62.5-35.6170.8-68.8-85.9000110.5F1112 T1117 A1118 L1191 T1194 D1222 I1223 S1226F1112-Y1114 HydrophobicContact CE1-CD1 4.05Å; F1112-Y1114 HydrophobicContact CE1-CE1 4.09Å; F1112-Y1114 HydrophobicContact CE1-CG 4.28Å; Y1114-T1117 WeakPolarHBondContact O-CB 3.4Å; Y1114-T1117 PolarHBondContact O-N 3.04Å; Y1114-A1118 PolarHBondContact O-N 2.8Å; Y1114-L1191 HydrophobicContact CD1-CD2 3.75Å; Y1114-L1191 HydrophobicContact CG-CD2 4.17Å; Y1114-T1194 HydrophobicContact CE1-CG2 4.26Å; Y1114-D1222 WeakPolarHBondContact CA-OD2 3.29Å; Y1114-D1222 WeakPolarHBondContact CB-OD2 3.33Å; Y1114-D1222 PolarHBondContact N-OD2 2.95Å; Y1114-I1223 HydrophobicContact CD1-CG1 4.43Å; Y1114-I1223 HydrophobicContact CD2-CD1 4.36Å; Y1114-I1223 HydrophobicContact CD2-CG1 3.51Å; Y1114-I1223 HydrophobicContact CE2-CD1 4.05Å; Y1114-I1223 HydrophobicContact CE2-CG1 3.69Å; Y1114-I1223 HydrophobicContact CG-CG1 3.91Å; Y1114-S1226 WeakPolarHBondContact CB-OG 3.39Å; Y1114-S1226 PolarHBondContact O-OG 2.96Å
1115I73.4Confident61Low4 Ų452.8 Ų52.82%0.02127%0.271CS..Hα-helixtrans-64.3-49.3177.8-66.9179.1000110.3I1048 W1084 S1113 T1117 A1118 L1119 D1222 S1226I1048-I1115 HydrophobicContact CB-CD1 4.34Å; I1048-I1115 HydrophobicContact CD1-CD1 3.35Å; I1048-I1115 HydrophobicContact CD1-CG2 4.49Å; I1048-I1115 HydrophobicContact CG1-CD1 3.64Å; I1048-I1115 HydrophobicContact CG1-CG2 4.07Å; I1048-I1115 HydrophobicContact CG2-CD1 3.73Å; W1084-I1115 HydrophobicContact CH2-CB 4.45Å; W1084-I1115 HydrophobicContact CH2-CG2 3.86Å; S1113-I1115 PolarHBondContact O-N 3.14Å; S1113-I1115 PolarHBondContact OG-N 2.93Å; S1113-I1115 VanDerWaalsContact OG-N 3.15Å; I1115-T1117 PolarHBondContact O-N 2.93Å; I1115-A1118 CarbonylContact O-C 3.56Å; I1115-A1118 WeakPolarHBondContact O-CA 3.3Å; I1115-A1118 WeakPolarHBondContact O-CB 3.28Å; I1115-A1118 PolarHBondContact O-N 3.11Å; I1115-L1119 HydrophobicContact CG2-CD1 3.93Å; I1115-L1119 HydrophobicContact CG2-CG 4.14Å; I1115-L1119 VanDerWaalsContact O-CG 3.3Å; I1115-L1119 WeakPolarHBondContact O-CG 3.36Å; I1115-L1119 PolarHBondContact O-N 3.1Å; I1115-D1222 HydrophobicContact CD1-CB 4.37Å; I1115-D1222 WeakPolarHBondContact CD1-OD1 3.2Å; I1115-D1222 HydrophobicContact CG1-CB 4.49Å; I1115-D1222 VanDerWaalsContact CG1-O 3.23Å; I1115-D1222 WeakPolarHBondContact CG1-O 3.45Å; I1115-D1222 PolarHBondContact N-OD2 3.47Å; I1115-S1226 VanDerWaalsContact CA-OG 3.26Å; I1115-S1226 WeakPolarHBondContact CA-OG 3.47Å; I1115-S1226 WeakPolarHBondContact CG1-OG 3.43Å; I1115-S1226 PolarHBondContact N-OG 3.47Å
1116T68.3Low63.3Low0 Ų046.2 Ų46.20%024%0.236CC..Hα-helixtrans-61.3-34.9178.1-46.70000111.7W1084 V1087 S1113 L1119 K1120 W1158W1084-T1116 VanDerWaalsContact CZ3-OG1 3.27Å; W1084-T1116 WeakPolarHBondContact CZ3-OG1 3.33Å; V1087-T1116 HydrophobicContact CB-CG2 4.44Å; V1087-T1116 HydrophobicContact CG1-CG2 3.81Å; V1087-T1116 HydrophobicContact CG2-CG2 4.18Å; S1113-T1116 PolarHBondContact O-N 3.43Å; S1113-T1116 PolarHBondContact OG-N 3.03Å; T1116-L1119 PolarHBondContact O-N 3.44Å; T1116-K1120 HydrophobicContact CG2-CD 4.44Å; T1116-K1120 HydrophobicContact CG2-CG 4.39Å; T1116-K1120 WeakPolarHBondContact O-CB 3.34Å; T1116-K1120 WeakPolarHBondContact O-CG 3.46Å; T1116-K1120 PolarHBondContact O-N 2.95Å; T1116-W1158 HydrophobicContact CG2-CH2 3.79Å; T1116-W1158 HydrophobicContact CG2-CZ2 3.97Å; T1116-W1158 HydrophobicContact CG2-CZ3 4.37Å
1117T72.1Confident65.2Low6 Ų641.8 Ų41.84%0.03721%0.211CC..Hα-helixtrans-66.6-40.2174.5-59.30000111.8I1094 F1112 S1113 Y1114 I1115 T1121 L1187I1094-T1117 HydrophobicContact CD1-CG2 4.13Å; F1112-T1117 WeakPolarHBondContact CE2-OG1 3.27Å; F1112-T1117 HydrophobicContact CZ-CG2 4.32Å; F1112-T1117 WeakPolarHBondContact CZ-OG1 3.43Å; S1113-T1117 PolarHBondContact O-N 3.27Å; S1113-T1117 PolarHBondContact O-OG1 3.16Å; S1113-T1117 VanDerWaalsContact O-OG1 3.1Å; Y1114-T1117 WeakPolarHBondContact O-CB 3.4Å; Y1114-T1117 PolarHBondContact O-N 3.04Å; I1115-T1117 PolarHBondContact O-N 2.93Å; T1117-T1121 VanDerWaalsContact O-CB 3.26Å; T1117-T1121 WeakPolarHBondContact O-CB 3.29Å; T1117-T1121 PolarHBondContact O-N 3.02Å; T1117-T1121 PolarHBondContact O-OG1 3.35Å; T1117-L1187 HydrophobicContact CG2-CD1 3.95Å
1118A78.8Confident67.2Low0 Ų035.5 Ų35.50%018%0.18CC..Hα-helixtrans-63.8-45.217200000112.4Y1114 I1115 T1121 L1122 L1187 V1230Y1114-A1118 PolarHBondContact O-N 2.8Å; I1115-A1118 CarbonylContact O-C 3.56Å; I1115-A1118 WeakPolarHBondContact O-CA 3.3Å; I1115-A1118 WeakPolarHBondContact O-CB 3.28Å; I1115-A1118 PolarHBondContact O-N 3.11Å; A1118-T1121 PolarHBondContact O-N 3.39Å; A1118-L1122 WeakPolarHBondContact O-CB 3.42Å; A1118-L1122 WeakPolarHBondContact O-CG 3.42Å; A1118-L1122 PolarHBondContact O-N 3.39Å; A1118-L1187 HydrophobicContact CB-CD2 4.11Å; A1118-V1230 HydrophobicContact CB-CG2 3.82Å
1119L78.6Confident69.2Low2 Ų230.1 Ų30.11%0.0115%0.149CC..Hα-helixtrans-60.8-51.8176.8-64.4174.4000111.4L1051 M1069 I1073 W1084 I1115 T1116 T1121 L1122 L1123 W1158 L1229L1051-L1119 HydrophobicContact CD1-CD2 3.69Å; M1069-L1119 HydrophobicContact CE-CB 4.1Å; M1069-L1119 HydrophobicContact CE-CD2 3.48Å; M1069-L1119 VanDerWaalsContact CE-CD2 3.48Å; M1069-L1119 HydrophobicContact CE-CG 4.41Å; I1073-L1119 HydrophobicContact CD1-CD1 4.12Å; I1073-L1119 HydrophobicContact CD1-CD2 4.33Å; W1084-L1119 HydrophobicContact CH2-CD1 4.5Å; W1084-L1119 HydrophobicContact CZ2-CD1 4.04Å; I1115-L1119 HydrophobicContact CG2-CD1 3.93Å; I1115-L1119 HydrophobicContact CG2-CG 4.14Å; I1115-L1119 VanDerWaalsContact O-CG 3.3Å; I1115-L1119 WeakPolarHBondContact O-CG 3.36Å; I1115-L1119 PolarHBondContact O-N 3.1Å; T1116-L1119 PolarHBondContact O-N 3.44Å; L1119-T1121 VanDerWaalsContact C-N 3.29Å; L1119-T1121 PolarHBondContact O-N 2.93Å; L1119-L1122 PolarHBondContact O-N 2.84Å; L1119-L1123 WeakPolarHBondContact O-CB 3.33Å; L1119-L1123 VanDerWaalsContact O-CG 3.28Å; L1119-L1123 WeakPolarHBondContact O-CG 3.25Å; L1119-L1123 PolarHBondContact O-N 3.23Å; L1119-W1158 HydrophobicContact CB-CZ3 4.05Å; L1119-W1158 HydrophobicContact CD1-CH2 4.39Å; L1119-W1158 HydrophobicContact CD1-CZ3 4.49Å; L1119-L1229 HydrophobicContact CD2-CD2 3.75Å; L1119-L1229 HydrophobicContact CG-CD2 4.49Å
1120K74.5Confident71Confident9 Ų924.8 Ų24.84%0.03912%0.124CC..Hα-helixtrans-58.2-40.1176.2-72.9-176.4-178.1-175.20111.5V1087 E1088 I1090 T1116 A1124 W1158V1087-K1120 VanDerWaalsContact CG1-NZ 3.3Å; V1087-K1120 PolarHBondContact O-NZ 3.47Å; E1088-K1120 PolarHBondContact O-NZ 2.79Å; E1088-K1120 VanDerWaalsContact O-NZ 3.13Å; I1090-K1120 HydrophobicContact CD1-CB 3.86Å; I1090-K1120 HydrophobicContact CD1-CD 3.84Å; I1090-K1120 HydrophobicContact CD1-CG 4.49Å; I1090-K1120 HydrophobicContact CG1-CD 4.15Å; T1116-K1120 HydrophobicContact CG2-CD 4.44Å; T1116-K1120 HydrophobicContact CG2-CG 4.39Å; T1116-K1120 WeakPolarHBondContact O-CB 3.34Å; T1116-K1120 WeakPolarHBondContact O-CG 3.46Å; T1116-K1120 PolarHBondContact O-N 2.95Å; K1120-A1124 WeakPolarHBondContact O-CB 3.48Å; K1120-A1124 PolarHBondContact O-N 3.39Å; K1120-W1158 HydrophobicContact CG-CD2 4.37Å; K1120-W1158 HydrophobicContact CG-CE3 3.95Å; K1120-W1158 HydrophobicContact CG-CZ3 4.36Å
1121T76.4Confident72.5Confident14 Ų1420 Ų209%0.08611%0.11CC..Hα-helixtrans-71-41.7-179.3-55.90000112.8T1117 A1118 L1119 A1124 W1125 R1183 I1184 L1187T1117-T1121 VanDerWaalsContact O-CB 3.26Å; T1117-T1121 WeakPolarHBondContact O-CB 3.29Å; T1117-T1121 PolarHBondContact O-N 3.02Å; T1117-T1121 PolarHBondContact O-OG1 3.35Å; A1118-T1121 PolarHBondContact O-N 3.39Å; L1119-T1121 VanDerWaalsContact C-N 3.29Å; L1119-T1121 PolarHBondContact O-N 2.93Å; T1121-A1124 PolarHBondContact O-N 3.29Å; T1121-W1125 PolarHBondContact O-N 3.04Å; T1121-R1183 HydrophobicContact CG2-CB 4.34Å; T1121-I1184 HydrophobicContact CG2-CG1 3.7Å; T1121-L1187 HydrophobicContact CG2-CD2 4.26Å
1122L80.1Confident73.3Confident1 Ų117.7 Ų17.71%0.0059%0.091CC..Hα-helixtrans-65.3-42.9175.7-72.9170.2000111.4M1069 A1118 L1119 A1124 W1125 Q1126 I1184 L1229 A1233 M1234M1069-L1122 HydrophobicContact CE-CB 3.97Å; M1069-L1122 HydrophobicContact CE-CD1 4.39Å; M1069-L1122 HydrophobicContact SD-CB 4.02Å; A1118-L1122 WeakPolarHBondContact O-CB 3.42Å; A1118-L1122 WeakPolarHBondContact O-CG 3.42Å; A1118-L1122 PolarHBondContact O-N 3.39Å; L1119-L1122 PolarHBondContact O-N 2.84Å; L1122-A1124 PolarHBondContact O-N 3.32Å; L1122-W1125 PolarHBondContact O-N 3Å; L1122-Q1126 WeakPolarHBondContact O-CB 3.4Å; L1122-Q1126 PolarHBondContact O-N 3.38Å; L1122-I1184 HydrophobicContact CD2-CD1 4.37Å; L1122-L1229 HydrophobicContact CD1-CG 4.35Å; L1122-A1233 HydrophobicContact CD1-CB 4.05Å; L1122-A1233 HydrophobicContact CD2-CB 3.98Å; L1122-M1234 HydrophobicContact CD2-CG 3.85Å; L1122-M1234 HydrophobicContact CD2-SD 3.88Å
1123L79.1Confident74.1Confident0 Ų016.2 Ų16.20%09%0.086CC..Hα-helixtrans-61.5-42.7174.9-70.4167.9000112.1M1069 P1070 I1073 L1119 W1125 Q1126 E1127 L1153 W1158 L1159M1069-L1123 HydrophobicContact CE-CD1 4.45Å; M1069-L1123 HydrophobicContact CE-CD2 4.23Å; M1069-L1123 HydrophobicContact CE-CG 3.87Å; M1069-L1123 HydrophobicContact CG-CD2 4.17Å; M1069-L1123 HydrophobicContact SD-CD2 4.06Å; M1069-L1123 HydrophobicContact SD-CG 4.23Å; P1070-L1123 HydrophobicContact CB-CD2 4.1Å; P1070-L1123 HydrophobicContact CG-CD2 3.88Å; I1073-L1123 HydrophobicContact CG1-CD1 4.49Å; I1073-L1123 HydrophobicContact CG2-CD1 4.25Å; L1119-L1123 WeakPolarHBondContact O-CB 3.33Å; L1119-L1123 VanDerWaalsContact O-CG 3.28Å; L1119-L1123 WeakPolarHBondContact O-CG 3.25Å; L1119-L1123 PolarHBondContact O-N 3.23Å; L1123-W1125 PolarHBondContact O-N 2.94Å; L1123-Q1126 PolarHBondContact O-N 3.18Å; L1123-E1127 PolarHBondContact O-N 2.82Å; L1123-L1153 HydrophobicContact CD1-CD1 4.43Å; L1123-W1158 HydrophobicContact CD1-CE3 4.03Å; L1123-W1158 HydrophobicContact CD1-CZ3 4.37Å; L1123-L1159 HydrophobicContact CB-CD2 4.19Å
1124A75.5Confident74.1Confident16 Ų1618.7 Ų18.713%0.13211%0.107CC..Hα-helixtrans-65-36.6177.400000112.8K1120 T1121 L1122 A1128 L1159K1120-A1124 WeakPolarHBondContact O-CB 3.48Å; K1120-A1124 PolarHBondContact O-N 3.39Å; T1121-A1124 PolarHBondContact O-N 3.29Å; L1122-A1124 PolarHBondContact O-N 3.32Å; A1124-A1128 WeakPolarHBondContact O-CB 3.49Å; A1124-A1128 PolarHBondContact O-N 3.3Å; A1124-A1128 VanDerWaalsContact O-N 3.15Å; A1124-L1159 HydrophobicContact CB-CD2 4.08Å
1125W82.2Confident73.5Confident0 Ų017.5 Ų17.50%011%0.108CC..Hα-helixtrans-69.4-42.1173.9178.886.9000112.3L1066 T1121 L1122 L1123 A1128 R1129 F1177 Q1180 I1184 M1234 V1237 E1241L1066-W1125 HydrophobicContact CD1-CH2 4.5Å; L1066-W1125 HydrophobicContact CD1-CZ3 3.83Å; T1121-W1125 PolarHBondContact O-N 3.04Å; L1122-W1125 PolarHBondContact O-N 3Å; L1123-W1125 PolarHBondContact O-N 2.94Å; W1125-A1128 PolarHBondContact O-N 2.91Å; W1125-R1129 HydrophobicContact CH2-CG 4.5Å; W1125-R1129 WeakPolarHBondContact O-CB 3.48Å; W1125-R1129 PolarHBondContact O-N 2.59Å; W1125-F1177 HydrophobicContact CD2-CE2 4.35Å; W1125-F1177 AromaticContact CE2-CE2 3.53Å; W1125-F1177 AromaticContact CE2-CZ 3.79Å; W1125-F1177 AromaticContact CZ2-CE2 3.76Å; W1125-F1177 HydrophobicContact CZ2-CE2 3.76Å; W1125-F1177 AromaticContact CZ2-CZ 3.73Å; W1125-F1177 HydrophobicContact CZ2-CZ 3.73Å; W1125-F1177 AromaticContact NE1-CE2 3.3Å; W1125-F1177 VanDerWaalsContact NE1-CE2 3.3Å; W1125-F1177 AromaticContact NE1-CZ 3.48Å; W1125-Q1180 HydrophobicContact CB-CB 3.92Å; W1125-Q1180 HydrophobicContact CG-CB 4.34Å; W1125-I1184 HydrophobicContact CB-CD1 3.56Å; W1125-I1184 HydrophobicContact CD2-CD1 4.11Å; W1125-I1184 HydrophobicContact CG-CD1 3.5Å; W1125-M1234 HydrophobicContact CD2-CE 4.12Å; W1125-M1234 HydrophobicContact CD2-SD 4.47Å; W1125-M1234 HydrophobicContact CE3-CE 4.38Å; W1125-M1234 HydrophobicContact CE3-SD 4.24Å; W1125-M1234 HydrophobicContact CH2-CE 4.14Å; W1125-M1234 HydrophobicContact CH2-SD 4.5Å; W1125-M1234 HydrophobicContact CZ2-CE 3.85Å; W1125-M1234 HydrophobicContact CZ3-CE 4.4Å; W1125-M1234 HydrophobicContact CZ3-SD 4.26Å; W1125-V1237 HydrophobicContact CH2-CG1 3.94Å; W1125-V1237 HydrophobicContact CH2-CG2 4.02Å; W1125-V1237 HydrophobicContact CZ2-CG1 3.73Å; W1125-E1241 HydrophobicContact CZ2-CB 4.41Å
1126Q77.9Confident72.9Confident8 Ų821.1 Ų21.14%0.03713%0.127CC..Hα-helixtrans-65.2-39.3177.8177.960.62800111.7L1122 L1123 R1129 E1130 Y1150L1122-Q1126 WeakPolarHBondContact O-CB 3.4Å; L1122-Q1126 PolarHBondContact O-N 3.38Å; L1123-Q1126 PolarHBondContact O-N 3.18Å; Q1126-R1129 WeakPolarHBondContact O-CB 3.43Å; Q1126-R1129 PolarHBondContact O-N 3.18Å; Q1126-E1130 PolarHBondContact NE2-OE1 3.26Å; Q1126-E1130 PolarHBondContact O-N 3.11Å; Q1126-Y1150 WeakPolarHBondContact CG-OH 3.21Å
1127E73.5Confident72.1Confident35 Ų3530.2 Ų30.216%0.16417%0.166CC..Hα-helixtrans-62.6-44.3171.2-176.4179.4-15200111.7L1123 R1129 E1130 A1131 Y1150 R1154L1123-E1127 PolarHBondContact O-N 2.82Å; E1127-R1129 PolarHBondContact O-N 3.32Å; E1127-E1130 PolarHBondContact O-N 3.41Å; E1127-A1131 WeakPolarHBondContact O-CB 3.21Å; E1127-A1131 PolarHBondContact O-N 2.91Å; E1127-Y1150 HydrophobicContact CB-CD1 4.43Å; E1127-Y1150 HydrophobicContact CB-CE1 4.29Å; E1127-R1154 IonicContact OE1-CZ 2.69Å; E1127-R1154 VanDerWaalsContact OE1-CZ 3.24Å; E1127-R1154 IonicContact OE1-NH1 3.2Å; E1127-R1154 PolarHBondContact OE1-NH1 2.91Å; E1127-R1154 IonicContact OE1-NH2 2.88Å; E1127-R1154 PolarHBondContact OE1-NH2 3.2Å; E1127-R1154 IonicContact OE2-CZ 2.72Å; E1127-R1154 IonicContact OE2-NH1 3.2Å; E1127-R1154 IonicContact OE2-NH2 3.34Å; E1127-R1154 PolarHBondContact OE2-NH2 3.14Å
1128A74.8Confident70.9Confident14 Ų1432.2 Ų32.212%0.11618%0.18CC..Hα-helixtrans-63-33.2177.800000112.4A1124 W1125 R1132 F1177 Q1180A1124-A1128 WeakPolarHBondContact O-CB 3.49Å; A1124-A1128 PolarHBondContact O-N 3.3Å; A1124-A1128 VanDerWaalsContact O-N 3.15Å; W1125-A1128 PolarHBondContact O-N 2.91Å; A1128-R1132 WeakPolarHBondContact O-CB 3.42Å; A1128-R1132 PolarHBondContact O-N 2.84Å; A1128-R1132 VanDerWaalsContact O-N 3.07Å; A1128-F1177 HydrophobicContact CB-CB 4.38Å; A1128-F1177 HydrophobicContact CB-CD2 4.29Å; A1128-Q1180 HydrophobicContact CB-CG 3.87Å
1129R74.4Confident69.1Low22 Ų2240.6 Ų40.68%0.08323%0.225CC..Hα-helixtrans-67.5-46.4174.2-168.9-168.6-173.9-174.95.9111.9N1063 W1125 Q1126 E1127 R1132 N1133 F1177 E1241N1063-R1129 PolarHBondContact ND2-NH2 2.57Å; W1125-R1129 HydrophobicContact CH2-CG 4.5Å; W1125-R1129 WeakPolarHBondContact O-CB 3.48Å; W1125-R1129 PolarHBondContact O-N 2.59Å; Q1126-R1129 WeakPolarHBondContact O-CB 3.43Å; Q1126-R1129 PolarHBondContact O-N 3.18Å; E1127-R1129 PolarHBondContact O-N 3.32Å; R1129-R1132 WeakPolarHBondContact O-CB 3.5Å; R1129-R1132 PolarHBondContact O-N 3.48Å; R1129-N1133 WeakPolarHBondContact O-CB 3.44Å; R1129-N1133 VanDerWaalsContact O-CG 3.27Å; R1129-N1133 PolarHBondContact O-N 3.14Å; R1129-F1177 HydrophobicContact CB-CD2 4.13Å; R1129-F1177 HydrophobicContact CB-CE2 3.77Å; R1129-F1177 HydrophobicContact CG-CE2 4Å; R1129-E1241 IonicContact CZ-OE1 2.79Å; R1129-E1241 IonicContact CZ-OE2 3.44Å; R1129-E1241 IonicContact NE-OE1 3.44Å; R1129-E1241 PolarHBondContact NE-OE1 3.31Å; R1129-E1241 IonicContact NE-OE2 3.65Å; R1129-E1241 VanDerWaalsContact NH2-CD 3.28Å; R1129-E1241 IonicContact NH2-OE1 2.71Å; R1129-E1241 PolarHBondContact NH2-OE1 3.35Å; R1129-E1241 IonicContact NH2-OE2 3.59Å; R1129-E1241 PolarHBondContact NH2-OE2 2.9Å
1130E71.5Confident67.5Low39 Ų3945.1 Ų45.118%0.18225%0.253CS..Hα-helixtrans-64.3-40.8176.9-74.6176.3-135.600111.7Q1126 E1127 R1132 N1133 A1134 Y1150Q1126-E1130 PolarHBondContact NE2-OE1 3.26Å; Q1126-E1130 PolarHBondContact O-N 3.11Å; E1127-E1130 PolarHBondContact O-N 3.41Å; E1130-R1132 VanDerWaalsContact C-N 3.34Å; E1130-R1132 PolarHBondContact O-N 3.22Å; E1130-N1133 PolarHBondContact O-N 2.86Å; E1130-A1134 WeakPolarHBondContact O-CB 3.33Å; E1130-A1134 PolarHBondContact O-N 3.38Å; E1130-Y1150 PolarHBondContact OE1-OH 3.26Å; E1130-Y1150 WeakPolarHBondContact OE2-CE2 3.37Å
1131A70.2Confident65.9Low36 Ų3653.3 Ų53.330%0.29829%0.291SS..Hα-helixtrans-59.5-43.1173.300000112.1E1127 C1135E1127-A1131 WeakPolarHBondContact O-CB 3.21Å; E1127-A1131 PolarHBondContact O-N 2.91Å; A1131-C1135 WeakPolarHBondContact O-CB 3.23Å; A1131-C1135 PolarHBondContact O-N 3.4Å; A1131-C1135 VanDerWaalsContact O-N 3.13Å
1132R68Low64.6Low21 Ų2156.8 Ų56.88%0.07932%0.316CS..Hα-helixtrans-60.5-49.8173.1-174.8-177.8-172-125.8-9.4111.6A1128 R1129 E1130 A1134 C1135 L1136 N1174 E1240A1128-R1132 WeakPolarHBondContact O-CB 3.42Å; A1128-R1132 PolarHBondContact O-N 2.84Å; A1128-R1132 VanDerWaalsContact O-N 3.07Å; R1129-R1132 WeakPolarHBondContact O-CB 3.5Å; R1129-R1132 PolarHBondContact O-N 3.48Å; E1130-R1132 VanDerWaalsContact C-N 3.34Å; E1130-R1132 PolarHBondContact O-N 3.22Å; R1132-A1134 PolarHBondContact O-N 3.39Å; R1132-C1135 PolarHBondContact O-N 2.77Å; R1132-L1136 HydrophobicContact CG-CD1 3.99Å; R1132-L1136 WeakPolarHBondContact O-CG 3.29Å; R1132-L1136 PolarHBondContact O-N 2.89Å; R1132-N1174 WeakPolarHBondContact CD-OD1 3.26Å; R1132-N1174 WeakPolarHBondContact CG-OD1 3.49Å; R1132-N1174 PolarHBondContact NE-OD1 3.42Å; R1132-E1240 IonicContact CZ-OE2 3.83Å; R1132-E1240 IonicContact NH1-OE2 3Å; R1132-E1240 IonicContact NH2-OE2 2.74Å; R1132-E1240 PolarHBondContact NH2-OE2 3.13Å
1133N68.8Low63.4Low43 Ų4358.9 Ų58.923%0.2333%0.327CS..Hα-helixtrans-68-34.1-174.9-70.2-7.1000113.4R1129 E1130 S1138R1129-N1133 WeakPolarHBondContact O-CB 3.44Å; R1129-N1133 VanDerWaalsContact O-CG 3.27Å; R1129-N1133 PolarHBondContact O-N 3.14Å; E1130-N1133 PolarHBondContact O-N 2.86Å; N1133-S1138 PolarHBondContact O-OG 3.2Å
1134A65.8Low62.4Low57 Ų5763.1 Ų63.147%0.47136%0.357SS..Hα-helixtrans-68.2-41.617200000111.8E1130 R1132 L1136 K1137E1130-A1134 WeakPolarHBondContact O-CB 3.33Å; E1130-A1134 PolarHBondContact O-N 3.38Å; R1132-A1134 PolarHBondContact O-N 3.39Å; A1134-L1136 VanDerWaalsContact C-N 3.31Å; A1134-L1136 PolarHBondContact O-N 2.81Å; A1134-K1137 PolarHBondContact O-N 3.17Å
1135C59.9Low61.8Low41 Ų4167.1 Ų67.128%0.27738%0.376SS..Hα-helixtrans-65.7-34178.5-155.50000112.3A1131 R1132 K1137 I1170A1131-C1135 WeakPolarHBondContact O-CB 3.23Å; A1131-C1135 PolarHBondContact O-N 3.4Å; A1131-C1135 VanDerWaalsContact O-N 3.13Å; R1132-C1135 PolarHBondContact O-N 2.77Å; C1135-K1137 PolarHBondContact O-N 3.36Å; C1135-K1137 VanDerWaalsContact O-N 3.14Å; C1135-I1170 WeakPolarHBondContact SG-CG1 3.22Å
1136L60.1Low61.1Low80 Ų8067.3 Ų67.342%0.41938%0.377SS..THydrogen-bonded Turntrans-71.22.5177.9-73.1170.3000115.1R1132 A1134 S1138R1132-L1136 HydrophobicContact CG-CD1 3.99Å; R1132-L1136 WeakPolarHBondContact O-CG 3.29Å; R1132-L1136 PolarHBondContact O-N 2.89Å; A1134-L1136 VanDerWaalsContact C-N 3.31Å; A1134-L1136 PolarHBondContact O-N 2.81Å; L1136-S1138 PolarHBondContact O-N 3.22Å; L1136-S1138 VanDerWaalsContact O-N 3.12Å
1137K52.1Low60.7Low190 Ų19070.1 Ų70.183%0.82639%0.394SS*.THydrogen-bonded Turntrans50.432.2-174.2-62-174.1179.1179.90113.8A1134 C1135A1134-K1137 PolarHBondContact O-N 3.17Å; C1135-K1137 PolarHBondContact O-N 3.36Å; C1135-K1137 VanDerWaalsContact O-N 3.14Å
1138S46.6Very low60.5Low48 Ų4870 Ų7034%0.33640%0.4SS..  trans-62.9148.3171.867.70000109.9N1133 L1136 V1140N1133-S1138 PolarHBondContact O-OG 3.2Å; L1136-S1138 PolarHBondContact O-N 3.22Å; L1136-S1138 VanDerWaalsContact O-N 3.12Å; S1138-V1140 PolarHBondContact O-N 3.07Å
1139N41.7Very low60.3Low176 Ų17669.4 Ų69.494%0.94139%0.394SS*.SBendtrans-67.310.3175.6-83.2-12.6000113.6Q1141N1139-Q1141 VanDerWaalsContact C-N 3.32Å; N1139-Q1141 PolarHBondContact O-N 3.02Å
1140V44.6Very low60.4Low97 Ų9768.6 Ų68.659%0.58839%0.392SS*.  trans-75.387.6171.1-173.70000107.9S1138 S1142S1138-V1140 PolarHBondContact O-N 3.07Å; V1140-S1142 PolarHBondContact O-N 3.45Å; V1140-S1142 VanDerWaalsContact O-N 3.1Å
1141Q41.5Very low60.3Low182 Ų18273.8 Ų73.885%0.8541%0.409SS*.  trans-56.2115.5176.6-175.7169.7-8.600109.7N1139 N1143N1139-Q1141 VanDerWaalsContact C-N 3.32Å; N1139-Q1141 PolarHBondContact O-N 3.02Å; Q1141-N1143 PolarHBondContact O-N 2.89Å
1142S48.1Very low60.2Low86 Ų8676.5 Ų76.560%0.60141%0.412SS*.  trans-62.5120.3-174.447.90000110.7V1140 S1144V1140-S1142 PolarHBondContact O-N 3.45Å; V1140-S1142 VanDerWaalsContact O-N 3.1Å; S1142-S1144 PolarHBondContact O-N 2.72Å; S1142-S1144 VanDerWaalsContact O-N 3.14Å
1143N55.1Low60.3Low46 Ų4675.5 Ų75.525%0.24641%0.408CS..  trans-75.9109.6-173.4-170.2-25.6000109.3Y1067 Q1141 N1145 Q1146 V1147Y1067-N1143 WeakPolarHBondContact OH-CB 3.16Å; Y1067-N1143 PolarHBondContact OH-ND2 3.32Å; Q1141-N1143 PolarHBondContact O-N 2.89Å; N1143-N1145 PolarHBondContact O-N 3.32Å; N1143-N1145 WeakPolarHBondContact OD1-CB 3.41Å; N1143-N1145 PolarHBondContact OD1-N 3.45Å; N1143-N1145 PolarHBondContact OD1-ND2 3.39Å; N1143-Q1146 PolarHBondContact O-N 2.85Å; N1143-V1147 PolarHBondContact O-N 3.26Å
1144S58.2Low60.5Low88 Ų8876.1 Ų76.162%0.61541%0.407SS*.Hα-helixtrans-53.9-28.2-177.451.90000113.1S1142 A1148S1142-S1144 PolarHBondContact O-N 2.72Å; S1142-S1144 VanDerWaalsContact O-N 3.14Å; S1144-A1148 WeakPolarHBondContact O-CB 3.39Å; S1144-A1148 PolarHBondContact O-N 3.45Å
1145N63.4Low60.6Low101 Ų10180.5 Ų80.554%0.5442%0.418SS..Hα-helixtrans-66.7-40.2176.4-60.5-46.8000112.6N1143 A1148 V1149N1143-N1145 PolarHBondContact O-N 3.32Å; N1143-N1145 WeakPolarHBondContact OD1-CB 3.41Å; N1143-N1145 PolarHBondContact OD1-N 3.45Å; N1143-N1145 PolarHBondContact OD1-ND2 3.39Å; N1145-A1148 PolarHBondContact O-N 2.96Å; N1145-V1149 WeakPolarHBondContact O-CG2 3.45Å; N1145-V1149 PolarHBondContact O-N 3.2Å
1146Q67.2Low60.9Low3 Ų384 Ų841%0.01443%0.429CS..Hα-helixtrans-67.1-42.9176.1-77.7177.9-48.700111.2Y1067 H1071 N1143 A1148 V1149 Y1150Y1067-Q1146 VanDerWaalsContact CD1-NE2 3.34Å; Y1067-Q1146 HydrophobicContact CE1-CG 4.4Å; Y1067-Q1146 VanDerWaalsContact CE1-NE2 3.26Å; Y1067-Q1146 VanDerWaalsContact CE2-OE1 3.22Å; Y1067-Q1146 VanDerWaalsContact CZ-NE2 3.29Å; Y1067-Q1146 PolarHBondContact O-NE2 3.26Å; Y1067-Q1146 VanDerWaalsContact O-NE2 3.1Å; Y1067-Q1146 PolarHBondContact OH-OE1 2.93Å; H1071-Q1146 WeakPolarHBondContact NE2-CG 3.37Å; N1143-Q1146 PolarHBondContact O-N 2.85Å; Q1146-A1148 PolarHBondContact O-N 3.43Å; Q1146-V1149 CarbonylContact O-C 3.6Å; Q1146-V1149 WeakPolarHBondContact O-CA 3.42Å; Q1146-V1149 WeakPolarHBondContact O-CB 3.48Å; Q1146-V1149 PolarHBondContact O-N 2.88Å; Q1146-Y1150 HydrophobicContact CB-CD2 4.46Å; Q1146-Y1150 HydrophobicContact CB-CE2 4.02Å; Q1146-Y1150 WeakPolarHBondContact O-CD2 3.48Å; Q1146-Y1150 PolarHBondContact O-N 3.42Å
1147V68.9Low60.9Low67 Ų6781.1 Ų81.141%0.40642%0.418SS..Hα-helixtrans-60-36.5175.2-175.20000111.3N1143 R1151N1143-V1147 PolarHBondContact O-N 3.26Å; V1147-R1151 WeakPolarHBondContact O-CB 3.43Å; V1147-R1151 PolarHBondContact O-N 2.94Å; V1147-R1151 VanDerWaalsContact O-N 3.12Å
1148A69.4Low61.5Low33 Ų3373.2 Ų73.227%0.27338%0.383SS..Hα-helixtrans-71.1-29.1173.300000113.8S1144 N1145 Q1146 R1152S1144-A1148 WeakPolarHBondContact O-CB 3.39Å; S1144-A1148 PolarHBondContact O-N 3.45Å; N1145-A1148 PolarHBondContact O-N 2.96Å; Q1146-A1148 PolarHBondContact O-N 3.43Å; A1148-R1152 PolarHBondContact O-N 2.86Å; A1148-R1152 PolarHBondContact O-NE 3.43Å
1149V71.7Confident62.3Low1 Ų171.1 Ų71.11%0.00637%0.368CS..Hα-helixtrans-70.1-51.9170.4165.80000110.9P1070 D1074 N1145 Q1146 R1151 R1152 L1153P1070-V1149 HydrophobicContact CB-CG1 3.67Å; P1070-V1149 WeakPolarHBondContact O-CG1 3.47Å; D1074-V1149 HydrophobicContact CB-CG1 3.88Å; D1074-V1149 HydrophobicContact CB-CG2 4.26Å; N1145-V1149 WeakPolarHBondContact O-CG2 3.45Å; N1145-V1149 PolarHBondContact O-N 3.2Å; Q1146-V1149 CarbonylContact O-C 3.6Å; Q1146-V1149 WeakPolarHBondContact O-CA 3.42Å; Q1146-V1149 WeakPolarHBondContact O-CB 3.48Å; Q1146-V1149 PolarHBondContact O-N 2.88Å; V1149-R1151 PolarHBondContact O-N 2.88Å; V1149-R1152 CarbonylContact O-C 3.54Å; V1149-R1152 WeakPolarHBondContact O-CA 3.39Å; V1149-R1152 PolarHBondContact O-N 3.33Å; V1149-L1153 HydrophobicContact CG1-CD1 3.77Å; V1149-L1153 HydrophobicContact CG1-CG 4.12Å; V1149-L1153 WeakPolarHBondContact O-CG 3.47Å; V1149-L1153 PolarHBondContact O-N 3.37Å
1150Y75.8Confident63.1Low6 Ų666.7 Ų66.72%0.02435%0.349CS..Hα-helixtrans-59.7-32.4178.5-62.6-56.2000112.8P1070 Q1126 E1127 E1130 Q1146 L1153 R1154 L1159P1070-Y1150 HydrophobicContact CB-CE1 4.05Å; P1070-Y1150 HydrophobicContact CG-CE1 3.86Å; P1070-Y1150 WeakPolarHBondContact CG-OH 3.19Å; Q1126-Y1150 WeakPolarHBondContact CG-OH 3.21Å; E1127-Y1150 HydrophobicContact CB-CD1 4.43Å; E1127-Y1150 HydrophobicContact CB-CE1 4.29Å; E1130-Y1150 PolarHBondContact OE1-OH 3.26Å; E1130-Y1150 WeakPolarHBondContact OE2-CE2 3.37Å; Q1146-Y1150 HydrophobicContact CB-CD2 4.46Å; Q1146-Y1150 HydrophobicContact CB-CE2 4.02Å; Q1146-Y1150 WeakPolarHBondContact O-CD2 3.48Å; Q1146-Y1150 PolarHBondContact O-N 3.42Å; Y1150-L1153 HydrophobicContact CD1-CD1 4.26Å; Y1150-R1154 PolarHBondContact O-N 2.85Å; Y1150-L1159 HydrophobicContact CD1-CD1 3.71Å; Y1150-L1159 HydrophobicContact CG-CD1 4.47Å
1151R69.4Low63.4Low147 Ų14766.6 Ų66.656%0.55536%0.358SS*.Hα-helixtrans-62.8-42.8171.2-169.5-178.5-66.6117.3-2.7112.2V1147 V1149 R1154 Q1155V1147-R1151 WeakPolarHBondContact O-CB 3.43Å; V1147-R1151 PolarHBondContact O-N 2.94Å; V1147-R1151 VanDerWaalsContact O-N 3.12Å; V1149-R1151 PolarHBondContact O-N 2.88Å; R1151-R1154 PolarHBondContact O-N 2.79Å; R1151-Q1155 WeakPolarHBondContact O-CG 3.13Å; R1151-Q1155 PolarHBondContact O-N 3.48Å; R1151-Q1155 VanDerWaalsContact O-N 3.11Å
1152R68Low64Low93 Ų9363.7 Ų63.735%0.35134%0.343SS..Hα-helixtrans-70.4-39.8176.3-76.8-178.6-74.9143.45112.5D1074 A1148 V1149 R1154 Q1155 K1156D1074-R1152 VanDerWaalsContact CG-NH1 3.32Å; D1074-R1152 IonicContact OD1-CZ 2.8Å; D1074-R1152 IonicContact OD1-NE 3.83Å; D1074-R1152 IonicContact OD1-NH1 3.65Å; D1074-R1152 PolarHBondContact OD1-NH1 3.12Å; D1074-R1152 IonicContact OD1-NH2 3.73Å; D1074-R1152 IonicContact OD2-CZ 3.88Å; D1074-R1152 IonicContact OD2-NH1 3.82Å; D1074-R1152 PolarHBondContact OD2-NH1 3.43Å; D1074-R1152 IonicContact OD2-NH2 2.68Å; D1074-R1152 PolarHBondContact OD2-NH2 3.38Å; A1148-R1152 PolarHBondContact O-N 2.86Å; A1148-R1152 PolarHBondContact O-NE 3.43Å; V1149-R1152 CarbonylContact O-C 3.54Å; V1149-R1152 WeakPolarHBondContact O-CA 3.39Å; V1149-R1152 PolarHBondContact O-N 3.33Å; R1152-R1154 VanDerWaalsContact C-N 3.29Å; R1152-R1154 PolarHBondContact O-N 3.19Å; R1152-Q1155 WeakPolarHBondContact O-CB 3.43Å; R1152-Q1155 PolarHBondContact O-N 3.15Å; R1152-Q1155 VanDerWaalsContact O-N 3.11Å; R1152-K1156 WeakPolarHBondContact O-CG 3.48Å; R1152-K1156 PolarHBondContact O-N 2.89Å
1153L70.4Confident63.9Low1 Ų163.8 Ų63.81%0.00535%0.349CS..Hα-helixtrans-61.8-34.9173.8-66.2174.8000112.3I1073 L1077 L1123 V1149 Y1150 K1156 G1157 W1158 L1159I1073-L1153 HydrophobicContact CG2-CD2 4.14Å; L1077-L1153 HydrophobicContact CD1-CD2 3.68Å; L1123-L1153 HydrophobicContact CD1-CD1 4.43Å; V1149-L1153 HydrophobicContact CG1-CD1 3.77Å; V1149-L1153 HydrophobicContact CG1-CG 4.12Å; V1149-L1153 WeakPolarHBondContact O-CG 3.47Å; V1149-L1153 PolarHBondContact O-N 3.37Å; Y1150-L1153 HydrophobicContact CD1-CD1 4.26Å; L1153-K1156 CarbonylContact O-C 3.54Å; L1153-K1156 PolarHBondContact O-N 3.01Å; L1153-G1157 PolarHBondContact O-N 2.87Å; L1153-W1158 HydrophobicContact CB-CB 4.32Å; L1153-W1158 HydrophobicContact CD2-CB 4.43Å; L1153-W1158 PolarHBondContact O-N 3.14Å; L1153-L1159 HydrophobicContact CB-CD1 4.09Å; L1153-L1159 HydrophobicContact CB-CG 4.38Å; L1153-L1159 HydrophobicContact CD1-CD1 4.42Å
1154R71.9Confident63.1Low56 Ų5666.9 Ų66.921%0.21137%0.374CS..Hα-helixtrans-65.2-46.1168.5-79.7-171173.390.89.7113.1E1127 Y1150 R1151 R1152 K1156 G1157 L1159 P1160E1127-R1154 IonicContact OE1-CZ 2.69Å; E1127-R1154 VanDerWaalsContact OE1-CZ 3.24Å; E1127-R1154 IonicContact OE1-NH1 3.2Å; E1127-R1154 PolarHBondContact OE1-NH1 2.91Å; E1127-R1154 IonicContact OE1-NH2 2.88Å; E1127-R1154 PolarHBondContact OE1-NH2 3.2Å; E1127-R1154 IonicContact OE2-CZ 2.72Å; E1127-R1154 IonicContact OE2-NH1 3.2Å; E1127-R1154 IonicContact OE2-NH2 3.34Å; E1127-R1154 PolarHBondContact OE2-NH2 3.14Å; Y1150-R1154 PolarHBondContact O-N 2.85Å; R1151-R1154 PolarHBondContact O-N 2.79Å; R1152-R1154 VanDerWaalsContact C-N 3.29Å; R1152-R1154 PolarHBondContact O-N 3.19Å; R1154-K1156 PolarHBondContact O-N 3.38Å; R1154-G1157 PolarHBondContact O-N 2.86Å; R1154-L1159 HydrophobicContact CG-CB 3.89Å; R1154-P1160 PolarHBondContact NE-O 3.39Å
1155Q69.3Low62.1Low148 Ų14870 Ų7069%0.69238%0.379SS*.Hα-helixtrans-60.9-27.2176.4-71168.6-34.200112.4R1151 R1152R1151-Q1155 WeakPolarHBondContact O-CG 3.13Å; R1151-Q1155 PolarHBondContact O-N 3.48Å; R1151-Q1155 VanDerWaalsContact O-N 3.11Å; R1152-Q1155 WeakPolarHBondContact O-CB 3.43Å; R1152-Q1155 PolarHBondContact O-N 3.15Å; R1152-Q1155 VanDerWaalsContact O-N 3.11Å
1156K66.4Low60.8Low115 Ų11569 Ų6950%0.538%0.38SS..THydrogen-bonded Turntrans-88.64.5173-70.1-77.3-172.81620114.4R1152 L1153 R1154 W1158R1152-K1156 WeakPolarHBondContact O-CG 3.48Å; R1152-K1156 PolarHBondContact O-N 2.89Å; L1153-K1156 CarbonylContact O-C 3.54Å; L1153-K1156 PolarHBondContact O-N 3.01Å; R1154-K1156 PolarHBondContact O-N 3.38Å; K1156-W1158 VanDerWaalsContact C-N 3.25Å; K1156-W1158 PolarHBondContact O-N 2.78Å
1157G60.5Low59.8Low20 Ų2074.8 Ų74.821%0.20642%0.421CS..THydrogen-bonded Turntrans70.610.7178.800000115.9L1089 L1153 R1154L1089-G1157 WeakPolarHBondContact CD2-O 3.47Å; L1153-G1157 PolarHBondContact O-N 2.87Å; R1154-G1157 PolarHBondContact O-N 2.86Å
1158W64.1Low58.8Low23 Ų2374.2 Ų74.29%0.08742%0.418CS..SBendtrans-78.5-27.2179.4-89.559.1000113.5I1073 L1077 W1084 T1116 L1119 K1120 L1123 L1153 K1156I1073-W1158 HydrophobicContact CG2-CE3 3.91Å; I1073-W1158 HydrophobicContact CG2-CH2 4.26Å; I1073-W1158 HydrophobicContact CG2-CZ3 3.72Å; L1077-W1158 HydrophobicContact CD1-CD2 3.89Å; L1077-W1158 HydrophobicContact CD1-CE3 4.5Å; L1077-W1158 HydrophobicContact CD1-CG 4.06Å; L1077-W1158 HydrophobicContact CD1-CZ2 4.3Å; L1077-W1158 HydrophobicContact CD2-CZ2 3.9Å; W1084-W1158 AromaticContact CD1-CH2 3.99Å; W1084-W1158 AromaticContact CD1-CZ2 3.58Å; W1084-W1158 HydrophobicContact CG-CZ2 4.15Å; W1084-W1158 AromaticContact NE1-CH2 3.94Å; T1116-W1158 HydrophobicContact CG2-CH2 3.79Å; T1116-W1158 HydrophobicContact CG2-CZ2 3.97Å; T1116-W1158 HydrophobicContact CG2-CZ3 4.37Å; L1119-W1158 HydrophobicContact CB-CZ3 4.05Å; L1119-W1158 HydrophobicContact CD1-CH2 4.39Å; L1119-W1158 HydrophobicContact CD1-CZ3 4.49Å; K1120-W1158 HydrophobicContact CG-CD2 4.37Å; K1120-W1158 HydrophobicContact CG-CE3 3.95Å; K1120-W1158 HydrophobicContact CG-CZ3 4.36Å; L1123-W1158 HydrophobicContact CD1-CE3 4.03Å; L1123-W1158 HydrophobicContact CD1-CZ3 4.37Å; L1153-W1158 HydrophobicContact CB-CB 4.32Å; L1153-W1158 HydrophobicContact CD2-CB 4.43Å; L1153-W1158 PolarHBondContact O-N 3.14Å; K1156-W1158 VanDerWaalsContact C-N 3.25Å; K1156-W1158 PolarHBondContact O-N 2.78Å
1159L62.6Low58.1Low5 Ų576.1 Ų76.13%0.02643%0.427CS..SBendtrans-122.1145.4174.9-70.3173.6000110L1123 A1124 Y1150 L1153 R1154L1123-L1159 HydrophobicContact CB-CD2 4.19Å; A1124-L1159 HydrophobicContact CB-CD2 4.08Å; Y1150-L1159 HydrophobicContact CD1-CD1 3.71Å; Y1150-L1159 HydrophobicContact CG-CD1 4.47Å; L1153-L1159 HydrophobicContact CB-CD1 4.09Å; L1153-L1159 HydrophobicContact CB-CG 4.38Å; L1153-L1159 HydrophobicContact CD1-CD1 4.42Å; R1154-L1159 HydrophobicContact CG-CB 3.89Å
1160P58.7Low57.4Low83 Ų8379.8 Ų79.854%0.53945%0.446SS..PPolyproline II helixtrans-62147178.226.4-34.5000111.4R1154 K1162R1154-P1160 PolarHBondContact NE-O 3.39Å; P1160-K1162 PolarHBondContact O-N 2.77Å
1161A52.1Low56.4Low94 Ų9485.5 Ų85.578%0.77747%0.473SS*.PPolyproline II helixtrans-54.5136.9175.300000110.6A1163A1161-A1163 PolarHBondContact O-N 3.11Å
1162K53.8Low55.9Low121 Ų12182.5 Ų82.553%0.52647%0.467SS..PPolyproline II helixtrans-71.4128.6179.3-147.2176.5-174.6-179.50108.2P1160 E1165P1160-K1162 PolarHBondContact O-N 2.77Å; K1162-E1165 HydrophobicContact CD-CG 4.37Å; K1162-E1165 WeakPolarHBondContact CE-OE1 3.2Å; K1162-E1165 IonicContact NZ-OE1 3.76Å; K1162-E1165 PolarHBondContact NZ-OE1 2.93Å
1163A44.7Very low55.6Low88 Ų8880.3 Ų80.373%0.72746%0.46SS*.PPolyproline II helixtrans-58.5147.5161.800000108.8A1161A1161-A1163 PolarHBondContact O-N 3.11Å
1164S38.3Very low55.3Low111 Ų11181.1 Ų81.178%0.77647%0.465SS*.PPolyproline II helixtrans-57.7141.8-172.733.80000112.3S1166S1164-S1166 PolarHBondContact O-N 3.02Å
1165E37.9Very low54.8Low155 Ų15583.6 Ų83.672%0.72448%0.477SS*.  trans-77.267.4-171.9-61.9-175.5150.300112.1K1162K1162-E1165 HydrophobicContact CD-CG 4.37Å; K1162-E1165 WeakPolarHBondContact CE-OE1 3.2Å; K1162-E1165 IonicContact NZ-OE1 3.76Å; K1162-E1165 PolarHBondContact NZ-OE1 2.93Å
1166S36.5Very low54.7Low78 Ų7878 Ų7855%0.54546%0.457SS..  trans-72.7156.8157.664.80000110.1S1164 T1168S1164-S1166 PolarHBondContact O-N 3.02Å; S1166-T1168 VanDerWaalsContact C-N 3.3Å; S1166-T1168 PolarHBondContact O-N 3.07Å; S1166-T1168 PolarHBondContact O-OG1 3.48Å
1167S44.7Very low54.9Low125 Ų12572.9 Ų72.987%0.87443%0.434SS*.  trans-66.884.4180560000111.1
1168T48.9Very low55.4Low56 Ų5672.7 Ų72.734%0.34443%0.43SS..  trans-85.9128.2-172.230.10000110.7S1166 I1172S1166-T1168 VanDerWaalsContact C-N 3.3Å; S1166-T1168 PolarHBondContact O-N 3.07Å; S1166-T1168 PolarHBondContact O-OG1 3.48Å; T1168-I1172 HydrophobicContact CG2-CD1 3.93Å
1169P54Low55.9Low72 Ų7275.6 Ų75.647%0.46844%0.444SS..  trans-66.4155.1-17823.8-33.9000112.9E1171 I1172P1169-E1171 PolarHBondContact O-N 2.94Å; P1169-I1172 HydrophobicContact CG-CD1 4.06Å; P1169-I1172 HydrophobicContact CG-CG1 4.18Å; P1169-I1172 WeakPolarHBondContact O-CB 3.45Å; P1169-I1172 PolarHBondContact O-N 2.97Å
1170I58.2Low56.6Low79 Ų7976.4 Ų76.441%0.40545%0.448SS..Hα-helixtrans-47-36.4179.5-63.7158.7000112.3C1135 I1172 H1173 N1174C1135-I1170 WeakPolarHBondContact SG-CG1 3.22Å; I1170-I1172 VanDerWaalsContact C-N 3.28Å; I1170-I1172 PolarHBondContact O-N 3.11Å; I1170-H1173 PolarHBondContact O-N 3.28Å; I1170-H1173 VanDerWaalsContact O-N 3.15Å; I1170-N1174 PolarHBondContact O-N 3.21Å
1171E53.7Low57.4Low126 Ų12672.8 Ų72.859%0.58943%0.425SS*.Hα-helixtrans-56.8-37.1177.9-61.2-174.4163.900113.4P1169 N1174 F1175 F1246P1169-E1171 PolarHBondContact O-N 2.94Å; E1171-N1174 PolarHBondContact O-N 3.01Å; E1171-F1175 WeakPolarHBondContact O-CB 3.36Å; E1171-F1175 PolarHBondContact O-N 3.49Å; E1171-F1246 HydrophobicContact CB-CE1 4.37Å
1172I58.6Low58.5Low84 Ų8473 Ų7343%0.43141%0.41SS..Hα-helixtrans-70.8-39178.4-62.4179.9000110.4T1168 P1169 I1170 F1175 A1176T1168-I1172 HydrophobicContact CG2-CD1 3.93Å; P1169-I1172 HydrophobicContact CG-CD1 4.06Å; P1169-I1172 HydrophobicContact CG-CG1 4.18Å; P1169-I1172 WeakPolarHBondContact O-CB 3.45Å; P1169-I1172 PolarHBondContact O-N 2.97Å; I1170-I1172 VanDerWaalsContact C-N 3.28Å; I1170-I1172 PolarHBondContact O-N 3.11Å; I1172-F1175 PolarHBondContact O-N 2.88Å; I1172-A1176 WeakPolarHBondContact O-CB 3.26Å; I1172-A1176 PolarHBondContact O-N 2.84Å
1173H61.7Low59.4Low47 Ų4772 Ų7222%0.21840%0.403CS..Hα-helixtrans-66.2-42.2174.2-66.6-63.5000111.9I1170 A1176 F1177I1170-H1173 PolarHBondContact O-N 3.28Å; I1170-H1173 VanDerWaalsContact O-N 3.15Å; H1173-A1176 PolarHBondContact O-N 3.37Å; H1173-F1177 VanDerWaalsContact O-CB 3.27Å; H1173-F1177 WeakPolarHBondContact O-CB 3.42Å; H1173-F1177 PolarHBondContact O-N 2.92Å
1174N64.2Low61.1Low17 Ų1768 Ų689%0.09137%0.369CS..Hα-helixtrans-63.9-39.3174.3-74.4-20.5000111.9R1132 I1170 E1171 S1178R1132-N1174 WeakPolarHBondContact CD-OD1 3.26Å; R1132-N1174 WeakPolarHBondContact CG-OD1 3.49Å; R1132-N1174 PolarHBondContact NE-OD1 3.42Å; I1170-N1174 PolarHBondContact O-N 3.21Å; E1171-N1174 PolarHBondContact O-N 3.01Å; N1174-S1178 VanDerWaalsContact O-CB 3.32Å; N1174-S1178 WeakPolarHBondContact O-CB 3.39Å; N1174-S1178 PolarHBondContact O-N 3.33Å
1175F62.9Low63.2Low108 Ų10863.3 Ų63.347%0.47434%0.335SS..Hα-helixtrans-64.2-49174.1-179.1-100.5000112.2E1171 I1172 F1177 S1178 Q1179 F1246E1171-F1175 WeakPolarHBondContact O-CB 3.36Å; E1171-F1175 PolarHBondContact O-N 3.49Å; I1172-F1175 PolarHBondContact O-N 2.88Å; F1175-F1177 VanDerWaalsContact C-N 3.33Å; F1175-F1177 PolarHBondContact O-N 3.47Å; F1175-S1178 WeakPolarHBondContact O-CB 3.36Å; F1175-S1178 PolarHBondContact O-N 3.16Å; F1175-Q1179 WeakPolarHBondContact O-CB 3.28Å; F1175-Q1179 PolarHBondContact O-N 2.75Å; F1175-F1246 HydrophobicContact CB-CZ 3.91Å; F1175-F1246 AromaticContact CD2-CE2 3.7Å; F1175-F1246 HydrophobicContact CD2-CE2 3.7Å; F1175-F1246 AromaticContact CD2-CZ 3.88Å; F1175-F1246 HydrophobicContact CD2-CZ 3.88Å; F1175-F1246 HydrophobicContact CE2-CE2 4.44Å; F1175-F1246 HydrophobicContact CG-CZ 4.3Å
1176A66.4Low65.1Low32 Ų3258.3 Ų58.326%0.26432%0.316SS..Hα-helixtrans-60.8-41.6178.200000111.9I1172 H1173 Q1179 Q1180I1172-A1176 WeakPolarHBondContact O-CB 3.26Å; I1172-A1176 PolarHBondContact O-N 2.84Å; H1173-A1176 PolarHBondContact O-N 3.37Å; A1176-Q1179 WeakPolarHBondContact O-CB 3.29Å; A1176-Q1179 PolarHBondContact O-N 3.37Å; A1176-Q1180 WeakPolarHBondContact O-CG 3.39Å; A1176-Q1180 PolarHBondContact O-N 2.74Å
1177F71Confident67.3Low6 Ų655.3 Ų55.33%0.02629%0.294CS..Hα-helixtrans-62.6-47.7174.5178.7-97.5000112.1W1125 A1128 R1129 H1173 F1175 Q1179 Q1180 A1181 E1241W1125-F1177 HydrophobicContact CD2-CE2 4.35Å; W1125-F1177 AromaticContact CE2-CE2 3.53Å; W1125-F1177 AromaticContact CE2-CZ 3.79Å; W1125-F1177 AromaticContact CZ2-CE2 3.76Å; W1125-F1177 HydrophobicContact CZ2-CE2 3.76Å; W1125-F1177 AromaticContact CZ2-CZ 3.73Å; W1125-F1177 HydrophobicContact CZ2-CZ 3.73Å; W1125-F1177 AromaticContact NE1-CE2 3.3Å; W1125-F1177 VanDerWaalsContact NE1-CE2 3.3Å; W1125-F1177 AromaticContact NE1-CZ 3.48Å; A1128-F1177 HydrophobicContact CB-CB 4.38Å; A1128-F1177 HydrophobicContact CB-CD2 4.29Å; R1129-F1177 HydrophobicContact CB-CD2 4.13Å; R1129-F1177 HydrophobicContact CB-CE2 3.77Å; R1129-F1177 HydrophobicContact CG-CE2 4Å; H1173-F1177 VanDerWaalsContact O-CB 3.27Å; H1173-F1177 WeakPolarHBondContact O-CB 3.42Å; H1173-F1177 PolarHBondContact O-N 2.92Å; F1175-F1177 VanDerWaalsContact C-N 3.33Å; F1175-F1177 PolarHBondContact O-N 3.47Å; F1177-Q1179 PolarHBondContact O-N 2.84Å; F1177-Q1180 PolarHBondContact O-N 2.66Å; F1177-A1181 PolarHBondContact O-N 3.05Å; F1177-E1241 HydrophobicContact CE1-CB 4.48Å; F1177-E1241 WeakPolarHBondContact CE1-O 3.23Å; F1177-E1241 HydrophobicContact CZ-CB 3.96Å; F1177-E1241 HydrophobicContact CZ-CG 4.38Å; F1177-E1241 VanDerWaalsContact CZ-O 3.25Å; F1177-E1241 WeakPolarHBondContact CZ-O 3.26Å
1178S71.3Confident69.2Low16 Ų1649.3 Ų49.311%0.11225%0.252CS..Hα-helixtrans-57.3-35.9172168.10000112.2N1174 F1175 H1182 I1244 G1245N1174-S1178 VanDerWaalsContact O-CB 3.32Å; N1174-S1178 WeakPolarHBondContact O-CB 3.39Å; N1174-S1178 PolarHBondContact O-N 3.33Å; F1175-S1178 WeakPolarHBondContact O-CB 3.36Å; F1175-S1178 PolarHBondContact O-N 3.16Å; S1178-H1182 WeakPolarHBondContact O-CB 3.47Å; S1178-H1182 PolarHBondContact O-N 3.12Å; S1178-I1244 WeakPolarHBondContact OG-CA 3.38Å; S1178-G1245 PolarHBondContact OG-N 2.85Å
1179Q73.6Confident70.7Confident84 Ų8447.6 Ų47.639%0.39324%0.24SC..Hα-helixtrans-69-40.8177-165.7-173.425.600112.1F1175 A1176 F1177 H1182 R1183F1175-Q1179 WeakPolarHBondContact O-CB 3.28Å; F1175-Q1179 PolarHBondContact O-N 2.75Å; A1176-Q1179 WeakPolarHBondContact O-CB 3.29Å; A1176-Q1179 PolarHBondContact O-N 3.37Å; F1177-Q1179 PolarHBondContact O-N 2.84Å; Q1179-H1182 WeakPolarHBondContact O-CB 3.38Å; Q1179-H1182 PolarHBondContact O-N 2.99Å; Q1179-R1183 WeakPolarHBondContact O-CG 3.17Å; Q1179-R1183 PolarHBondContact O-N 3.09Å
1180Q76.5Confident71.8Confident22 Ų2248.1 Ų48.110%0.10323%0.233CC..Hα-helixtrans-69.6-37.4174.1-53.1-43.3-39.100111.7W1125 A1128 A1176 F1177 H1182 R1183 I1184W1125-Q1180 HydrophobicContact CB-CB 3.92Å; W1125-Q1180 HydrophobicContact CG-CB 4.34Å; A1128-Q1180 HydrophobicContact CB-CG 3.87Å; A1176-Q1180 WeakPolarHBondContact O-CG 3.39Å; A1176-Q1180 PolarHBondContact O-N 2.74Å; F1177-Q1180 PolarHBondContact O-N 2.66Å; Q1180-H1182 VanDerWaalsContact C-N 3.25Å; Q1180-H1182 PolarHBondContact O-N 2.94Å; Q1180-R1183 PolarHBondContact O-N 3.32Å; Q1180-R1183 VanDerWaalsContact O-N 3.13Å; Q1180-I1184 PolarHBondContact O-N 3.41Å
1181A76.1Confident73Confident8 Ų844.4 Ų44.47%0.06621%0.214CC..Hα-helixtrans-61-35.1172.300000112F1177 R1185 I1244F1177-A1181 PolarHBondContact O-N 3.05Å; A1181-R1185 PolarHBondContact O-N 3.05Å; A1181-R1185 VanDerWaalsContact O-N 3.15Å; A1181-I1244 HydrophobicContact CB-CG1 3.99Å
1182H75.2Confident74.5Confident98 Ų9838.4 Ų38.445%0.45419%0.186SC..Hα-helixtrans-67.2-44.1170.7-170.1-91.9000112.6S1178 Q1179 Q1180 I1184 R1185 C1186 I1244S1178-H1182 WeakPolarHBondContact O-CB 3.47Å; S1178-H1182 PolarHBondContact O-N 3.12Å; Q1179-H1182 WeakPolarHBondContact O-CB 3.38Å; Q1179-H1182 PolarHBondContact O-N 2.99Å; Q1180-H1182 VanDerWaalsContact C-N 3.25Å; Q1180-H1182 PolarHBondContact O-N 2.94Å; H1182-I1184 PolarHBondContact O-N 2.7Å; H1182-R1185 PolarHBondContact O-N 3.49Å; H1182-R1185 VanDerWaalsContact O-N 3.1Å; H1182-C1186 PolarHBondContact CE1-SG 2.74Å; H1182-C1186 PolarHBondContact O-N 2.69Å; H1182-I1244 VanDerWaalsContact CA-CD1 3.49Å; H1182-I1244 HydrophobicContact CB-CD1 3.88Å; H1182-I1244 HydrophobicContact CB-CG1 4.45Å; H1182-I1244 HydrophobicContact CB-CG2 4.29Å
1183R73.5Confident75.5Confident100 Ų10035 Ų3538%0.37717%0.169SC..Hα-helixtrans-59.5-42.3175.8-75164.3162.7-166.1-6.7112.3T1121 Q1179 Q1180 R1185 C1186 L1187T1121-R1183 HydrophobicContact CG2-CB 4.34Å; Q1179-R1183 WeakPolarHBondContact O-CG 3.17Å; Q1179-R1183 PolarHBondContact O-N 3.09Å; Q1180-R1183 PolarHBondContact O-N 3.32Å; Q1180-R1183 VanDerWaalsContact O-N 3.13Å; R1183-R1185 PolarHBondContact O-N 2.65Å; R1183-C1186 PolarHBondContact O-N 3.15Å; R1183-L1187 WeakPolarHBondContact O-CB 3.31Å; R1183-L1187 PolarHBondContact O-N 3.2Å
1184I79.8Confident76.2Confident4 Ų434.3 Ų34.32%0.02117%0.168CC..Hα-helixtrans-60.1-44.2172.1-68.9174.6000111.2T1121 L1122 W1125 Q1180 H1182 C1186 L1187 C1188 V1230 M1234 L1278T1121-I1184 HydrophobicContact CG2-CG1 3.7Å; L1122-I1184 HydrophobicContact CD2-CD1 4.37Å; W1125-I1184 HydrophobicContact CB-CD1 3.56Å; W1125-I1184 HydrophobicContact CD2-CD1 4.11Å; W1125-I1184 HydrophobicContact CG-CD1 3.5Å; Q1180-I1184 PolarHBondContact O-N 3.41Å; H1182-I1184 PolarHBondContact O-N 2.7Å; I1184-C1186 PolarHBondContact O-N 2.96Å; I1184-L1187 PolarHBondContact O-N 3.08Å; I1184-C1188 WeakPolarHBondContact O-CB 3.45Å; I1184-C1188 PolarHBondContact O-N 3.44Å; I1184-V1230 HydrophobicContact CG2-CG1 4.24Å; I1184-M1234 HydrophobicContact CD1-CE 3.78Å; I1184-M1234 HydrophobicContact CD1-CG 4.44Å; I1184-M1234 HydrophobicContact CD1-SD 3.99Å; I1184-M1234 HydrophobicContact CG2-CG 4.21Å; I1184-L1278 HydrophobicContact CG2-CD1 4.28Å; I1184-L1278 HydrophobicContact CG2-CD2 3.88Å
1185R81.6Confident76.8Confident13 Ų1333.5 Ų33.55%0.04916%0.164CC..Hα-helixtrans-64.1-36.8177-78.1-163.2174.5114.44.4112.8A1181 H1182 R1183 L1189 A1242 I1244 H1273 G1277 L1278 W1281A1181-R1185 PolarHBondContact O-N 3.05Å; A1181-R1185 VanDerWaalsContact O-N 3.15Å; H1182-R1185 PolarHBondContact O-N 3.49Å; H1182-R1185 VanDerWaalsContact O-N 3.1Å; R1183-R1185 PolarHBondContact O-N 2.65Å; R1185-L1189 WeakPolarHBondContact O-CG 3.5Å; R1185-L1189 PolarHBondContact O-N 3.47Å; R1185-A1242 PolarHBondContact NH1-O 2.95Å; R1185-A1242 PolarHBondContact NH2-O 2.97Å; R1185-I1244 HydrophobicContact CG-CD1 4.25Å; R1185-H1273 PolarHBondContact NH2-ND1 3.47Å; R1185-G1277 PolarHBondContact NH2-O 2.87Å; R1185-L1278 HydrophobicContact CG-CD1 3.63Å; R1185-W1281 HydrophobicContact CB-CH2 3.58Å; R1185-W1281 HydrophobicContact CB-CZ2 4.29Å; R1185-W1281 HydrophobicContact CB-CZ3 3.75Å; R1185-W1281 HydrophobicContact CG-CD2 4.4Å; R1185-W1281 HydrophobicContact CG-CE3 3.85Å; R1185-W1281 HydrophobicContact CG-CH2 3.82Å; R1185-W1281 HydrophobicContact CG-CZ2 4.39Å; R1185-W1281 HydrophobicContact CG-CZ3 3.54Å
1186C78.9Confident77.5Confident49 Ų4928.4 Ų28.433%0.33114%0.141SC..Hα-helixtrans-69.1-45173.9-72.20000112.4H1182 R1183 I1184 L1189 R1190H1182-C1186 PolarHBondContact CE1-SG 2.74Å; H1182-C1186 PolarHBondContact O-N 2.69Å; R1183-C1186 PolarHBondContact O-N 3.15Å; I1184-C1186 PolarHBondContact O-N 2.96Å; C1186-L1189 PolarHBondContact O-N 2.87Å; C1186-R1190 PolarHBondContact O-N 3.43Å
1187L81.6Confident77.9Confident15 Ų1527.9 Ų27.98%0.07913%0.134CC..Hα-helixtrans-61.4-47.1176178.263.3000111.2T1117 A1118 T1121 R1183 I1184 L1189 R1190 L1191 V1230T1117-L1187 HydrophobicContact CG2-CD1 3.95Å; A1118-L1187 HydrophobicContact CB-CD2 4.11Å; T1121-L1187 HydrophobicContact CG2-CD2 4.26Å; R1183-L1187 WeakPolarHBondContact O-CB 3.31Å; R1183-L1187 PolarHBondContact O-N 3.2Å; I1184-L1187 PolarHBondContact O-N 3.08Å; L1187-L1189 PolarHBondContact O-N 3.29Å; L1187-R1190 PolarHBondContact O-N 3.11Å; L1187-R1190 VanDerWaalsContact O-N 3.11Å; L1187-L1191 HydrophobicContact CD1-CD1 4.24Å; L1187-L1191 HydrophobicContact CD1-CG 4.13Å; L1187-L1191 HydrophobicContact CG-CD1 3.95Å; L1187-L1191 HydrophobicContact CG-CG 4.3Å; L1187-L1191 WeakPolarHBondContact O-CB 3.5Å; L1187-L1191 WeakPolarHBondContact O-CG 3.49Å; L1187-L1191 PolarHBondContact O-N 2.86Å; L1187-V1230 HydrophobicContact CD2-CG2 4.47Å
1188C84.7Confident77.9Confident0 Ų028 Ų280%014%0.135CC..Hα-helixtrans-61-33.3178.4-172.10000112.5I1184 V1192 V1230 L1278I1184-C1188 WeakPolarHBondContact O-CB 3.45Å; I1184-C1188 PolarHBondContact O-N 3.44Å; C1188-V1192 WeakPolarHBondContact O-CB 3.31Å; C1188-V1192 WeakPolarHBondContact O-CG2 3.43Å; C1188-V1192 PolarHBondContact O-N 2.99Å; C1188-V1230 HydrophobicContact CB-CG1 4.45Å; C1188-L1278 HydrophobicContact CB-CD1 4.34Å; C1188-L1278 HydrophobicContact CB-CD2 4.43Å
1189L82.1Confident77.5Confident19 Ų1928.8 Ų28.810%0.09914%0.14CC..Hα-helixtrans-70.6-44.4171.8-81.6171.2000112.1R1185 C1186 L1187 L1191 V1192 D1193 W1281 L1282 R1286R1185-L1189 WeakPolarHBondContact O-CG 3.5Å; R1185-L1189 PolarHBondContact O-N 3.47Å; C1186-L1189 PolarHBondContact O-N 2.87Å; L1187-L1189 PolarHBondContact O-N 3.29Å; L1189-L1191 PolarHBondContact O-N 3.39Å; L1189-V1192 WeakPolarHBondContact O-CB 3.16Å; L1189-V1192 PolarHBondContact O-N 3.11Å; L1189-V1192 VanDerWaalsContact O-N 3.14Å; L1189-D1193 PolarHBondContact O-N 3.42Å; L1189-W1281 HydrophobicContact CD1-CH2 3.64Å; L1189-W1281 HydrophobicContact CD1-CZ2 4.05Å; L1189-W1281 HydrophobicContact CD2-CH2 4.43Å; L1189-W1281 HydrophobicContact CG-CH2 3.78Å; L1189-L1282 HydrophobicContact CD2-CD1 4.26Å; L1189-R1286 HydrophobicContact CD2-CB 4.28Å; L1189-R1286 HydrophobicContact CD2-CG 4.01Å
1190R77.3Confident77Confident84 Ų8428.5 Ų28.532%0.31714%0.136SC..Hα-helixtrans-62.8-40.6177.7-74.7175.5170.2-178.1-9.9112.2I1094 C1186 L1187 V1192 D1193 T1194I1094-R1190 VanDerWaalsContact CG2-NH1 3.28Å; I1094-R1190 VanDerWaalsContact O-CZ 3.25Å; I1094-R1190 PolarHBondContact O-NH1 3.42Å; I1094-R1190 PolarHBondContact O-NH2 2.82Å; C1186-R1190 PolarHBondContact O-N 3.43Å; L1187-R1190 PolarHBondContact O-N 3.11Å; L1187-R1190 VanDerWaalsContact O-N 3.11Å; R1190-V1192 VanDerWaalsContact C-N 3.32Å; R1190-V1192 PolarHBondContact O-N 2.73Å; R1190-D1193 PolarHBondContact O-N 3.23Å; R1190-T1194 WeakPolarHBondContact O-CG2 3.43Å; R1190-T1194 PolarHBondContact O-N 3.24Å; R1190-T1194 PolarHBondContact O-OG1 2.59Å; R1190-T1194 VanDerWaalsContact O-OG1 3.08Å
1191L82.6Confident75.5Confident0 Ų029.9 Ų29.90%014%0.144CC..Hα-helixtrans-63.4-35.3172.9-69.1173.2000112.7Y1114 L1187 L1189 T1194 C1195 I1223 L1227 V1230Y1114-L1191 HydrophobicContact CD1-CD2 3.75Å; Y1114-L1191 HydrophobicContact CG-CD2 4.17Å; L1187-L1191 HydrophobicContact CD1-CD1 4.24Å; L1187-L1191 HydrophobicContact CD1-CG 4.13Å; L1187-L1191 HydrophobicContact CG-CD1 3.95Å; L1187-L1191 HydrophobicContact CG-CG 4.3Å; L1187-L1191 WeakPolarHBondContact O-CB 3.5Å; L1187-L1191 WeakPolarHBondContact O-CG 3.49Å; L1187-L1191 PolarHBondContact O-N 2.86Å; L1189-L1191 PolarHBondContact O-N 3.39Å; L1191-T1194 PolarHBondContact O-OG1 2.88Å; L1191-C1195 VanDerWaalsContact O-CB 3.26Å; L1191-C1195 WeakPolarHBondContact O-CB 3.44Å; L1191-C1195 PolarHBondContact O-N 3.08Å; L1191-C1195 PolarHBondContact O-SG 2.87Å; L1191-C1195 VanDerWaalsContact O-SG 3.35Å; L1191-I1223 HydrophobicContact CD2-CG2 4.01Å; L1191-L1227 HydrophobicContact CB-CB 4.29Å; L1191-L1227 HydrophobicContact CB-CD1 4.2Å; L1191-V1230 HydrophobicContact CD1-CG2 4.29Å
1192V84.7Confident74Confident0 Ų036.6 Ų36.60%017%0.173CC..Hα-helixtrans-68.6-44.9172153.90000111.2C1188 L1189 R1190 T1194 C1195 L1196 L1227 L1282 L1287 W1290 L1316C1188-V1192 WeakPolarHBondContact O-CB 3.31Å; C1188-V1192 WeakPolarHBondContact O-CG2 3.43Å; C1188-V1192 PolarHBondContact O-N 2.99Å; L1189-V1192 WeakPolarHBondContact O-CB 3.16Å; L1189-V1192 PolarHBondContact O-N 3.11Å; L1189-V1192 VanDerWaalsContact O-N 3.14Å; R1190-V1192 VanDerWaalsContact C-N 3.32Å; R1190-V1192 PolarHBondContact O-N 2.73Å; V1192-T1194 VanDerWaalsContact C-N 3.35Å; V1192-T1194 PolarHBondContact O-N 3.33Å; V1192-C1195 PolarHBondContact O-N 3.4Å; V1192-L1196 HydrophobicContact CG1-CD1 3.98Å; V1192-L1196 VanDerWaalsContact O-CG 3.24Å; V1192-L1196 WeakPolarHBondContact O-CG 3.43Å; V1192-L1196 PolarHBondContact O-N 3.25Å; V1192-L1227 HydrophobicContact CG2-CD1 4.17Å; V1192-L1227 HydrophobicContact CG2-CD2 4.14Å; V1192-L1282 HydrophobicContact CG2-CD1 4.28Å; V1192-L1282 HydrophobicContact CG2-CD2 4.24Å; V1192-L1287 HydrophobicContact CG1-CD2 3.68Å; V1192-W1290 HydrophobicContact CG1-CZ3 4.23Å; V1192-L1316 HydrophobicContact CG1-CD2 4.31Å; V1192-L1316 HydrophobicContact CG2-CD2 4.37Å
1193D80.7Confident72.1Confident14 Ų1437.4 Ų37.48%0.07518%0.18CC..Hα-helixtrans-65.1-39.5-179.3-66.6-29.8000110.9L1189 R1190 L1196 N1197 V1198 R1200 W1290L1189-D1193 PolarHBondContact O-N 3.42Å; R1190-D1193 PolarHBondContact O-N 3.23Å; D1193-L1196 CarbonylContact O-C 3.59Å; D1193-L1196 PolarHBondContact O-N 3.48Å; D1193-N1197 PolarHBondContact O-N 2.81Å; D1193-N1197 VanDerWaalsContact O-N 3.11Å; D1193-V1198 HydrophobicContact CB-CB 4.47Å; D1193-V1198 PolarHBondContact O-N 2.95Å; D1193-R1200 VanDerWaalsContact CG-NE 3.34Å; D1193-R1200 IonicContact OD1-CZ 3.96Å; D1193-R1200 IonicContact OD1-NE 2.7Å; D1193-R1200 PolarHBondContact OD1-NE 3.29Å; D1193-R1200 IonicContact OD1-NH2 3.62Å; D1193-R1200 PolarHBondContact OD1-NH2 3Å; D1193-R1200 IonicContact OD2-CZ 2.67Å; D1193-R1200 IonicContact OD2-NE 2.66Å; D1193-R1200 PolarHBondContact OD2-NE 3.24Å; D1193-R1200 IonicContact OD2-NH2 3.91Å; D1193-W1290 WeakPolarHBondContact OD1-CH2 3.35Å
1194T75.3Confident70Confident31 Ų3136.9 Ų36.919%0.1919%0.188CC..Hα-helixtrans-74-35.5173.358.20000113.1Y1114 R1190 L1191 V1192 L1196 N1197 I1223Y1114-T1194 HydrophobicContact CE1-CG2 4.26Å; R1190-T1194 WeakPolarHBondContact O-CG2 3.43Å; R1190-T1194 PolarHBondContact O-N 3.24Å; R1190-T1194 PolarHBondContact O-OG1 2.59Å; R1190-T1194 VanDerWaalsContact O-OG1 3.08Å; L1191-T1194 PolarHBondContact O-OG1 2.88Å; V1192-T1194 VanDerWaalsContact C-N 3.35Å; V1192-T1194 PolarHBondContact O-N 3.33Å; T1194-L1196 PolarHBondContact O-N 2.84Å; T1194-N1197 PolarHBondContact O-N 2.82Å; T1194-N1197 PolarHBondContact O-OD1 3.43Å; T1194-N1197 VanDerWaalsContact O-OD1 3.11Å; T1194-I1223 WeakPolarHBondContact OG1-CG2 3.18Å
1195C77.2Confident67.8Low1 Ų144.8 Ų44.81%0.00723%0.23CC..Hα-helixtrans-59.3-26.4167.8-85.10000113.4L1191 V1192 V1219 L1316L1191-C1195 VanDerWaalsContact O-CB 3.26Å; L1191-C1195 WeakPolarHBondContact O-CB 3.44Å; L1191-C1195 PolarHBondContact O-N 3.08Å; L1191-C1195 PolarHBondContact O-SG 2.87Å; L1191-C1195 VanDerWaalsContact O-SG 3.35Å; V1192-C1195 PolarHBondContact O-N 3.4Å; C1195-V1219 WeakPolarHBondContact O-CG2 3.37Å; C1195-L1316 HydrophobicContact CB-CD1 4.41Å; C1195-L1316 HydrophobicContact CB-CD2 3.99Å
1196L77.5Confident65.3Low0 Ų050.3 Ų50.30%026%0.261CS..THydrogen-bonded Turntrans-91.9-4.6175.5-64.3169.9000112.8V1192 D1193 T1194 V1198 W1290 R1312 L1313 L1316V1192-L1196 HydrophobicContact CG1-CD1 3.98Å; V1192-L1196 VanDerWaalsContact O-CG 3.24Å; V1192-L1196 WeakPolarHBondContact O-CG 3.43Å; V1192-L1196 PolarHBondContact O-N 3.25Å; D1193-L1196 CarbonylContact O-C 3.59Å; D1193-L1196 PolarHBondContact O-N 3.48Å; T1194-L1196 PolarHBondContact O-N 2.84Å; L1196-V1198 HydrophobicContact CB-CB 4.47Å; L1196-V1198 HydrophobicContact CB-CG2 3.76Å; L1196-W1290 HydrophobicContact CD1-CE3 4.48Å; L1196-W1290 HydrophobicContact CD1-CH2 3.59Å; L1196-W1290 HydrophobicContact CD1-CZ3 3.53Å; L1196-R1312 HydrophobicContact CD2-CB 3.85Å; L1196-R1312 PolarHBondContact O-NH1 3.48Å; L1196-L1313 HydrophobicContact CD1-CD1 3.88Å; L1196-L1313 HydrophobicContact CD2-CB 4.17Å; L1196-L1313 HydrophobicContact CD2-CD1 4.49Å; L1196-L1316 HydrophobicContact CD1-CD2 4.18Å; L1196-L1316 HydrophobicContact CD2-CB 4.17Å; L1196-L1316 HydrophobicContact CD2-CD2 3.75Å; L1196-L1316 HydrophobicContact CG-CD2 3.74Å
1197N74.5Confident63.3Low21 Ų2153.2 Ų53.211%0.11228%0.282CS..THydrogen-bonded Turntrans51.258-169.3-76.7-30.7000111.6D1193 T1194 L1214 K1216 V1218D1193-N1197 PolarHBondContact O-N 2.81Å; D1193-N1197 VanDerWaalsContact O-N 3.11Å; T1194-N1197 PolarHBondContact O-N 2.82Å; T1194-N1197 PolarHBondContact O-OD1 3.43Å; T1194-N1197 VanDerWaalsContact O-OD1 3.11Å; N1197-L1214 HydrophobicContact CB-CB 4.19Å; N1197-L1214 WeakPolarHBondContact O-CB 3.26Å; N1197-L1214 PolarHBondContact O-N 3.14Å; N1197-K1216 PolarHBondContact ND2-O 3.2Å; N1197-V1218 PolarHBondContact ND2-O 2.9Å
1198V71.7Confident61Low9 Ų955.9 Ų55.96%0.05530%0.302CS..BIsolated β-bridgetrans-123127.9-178.5170.90000110.4D1193 L1196 M1211 L1309D1193-V1198 HydrophobicContact CB-CB 4.47Å; D1193-V1198 PolarHBondContact O-N 2.95Å; L1196-V1198 HydrophobicContact CB-CB 4.47Å; L1196-V1198 HydrophobicContact CB-CG2 3.76Å; V1198-M1211 HydrophobicContact CB-CE 4.35Å; V1198-M1211 HydrophobicContact CG1-CE 3.69Å; V1198-M1211 HydrophobicContact CG1-CG 3.65Å; V1198-M1211 HydrophobicContact CG1-SD 4.12Å; V1198-M1211 HydrophobicContact CG2-CE 3.65Å; V1198-L1309 HydrophobicContact CG2-CD1 3.76Å
1199C63.3Low58.9Low33 Ų3361.6 Ų61.622%0.22334%0.337CS..  trans-93.7144.5159.5-165.40000110.2D1201 T1212C1199-D1201 PolarHBondContact SG-OD1 3.01Å; C1199-D1201 VanDerWaalsContact SG-OD1 3.4Å; C1199-T1212 PolarHBondContact N-O 3.38Å; C1199-T1212 PolarHBondContact O-N 2.98Å
1200R62.4Low57.2Low78 Ų7866.8 Ų66.829%0.29436%0.36SS..  trans-110.9108.5167.6-62.3-176.6-169.3-84.1-7.4107D1193 H1202 W1290D1193-R1200 VanDerWaalsContact CG-NE 3.34Å; D1193-R1200 IonicContact OD1-CZ 3.96Å; D1193-R1200 IonicContact OD1-NE 2.7Å; D1193-R1200 PolarHBondContact OD1-NE 3.29Å; D1193-R1200 IonicContact OD1-NH2 3.62Å; D1193-R1200 PolarHBondContact OD1-NH2 3Å; D1193-R1200 IonicContact OD2-CZ 2.67Å; D1193-R1200 IonicContact OD2-NE 2.66Å; D1193-R1200 PolarHBondContact OD2-NE 3.24Å; D1193-R1200 IonicContact OD2-NH2 3.91Å; R1200-H1202 PolarHBondContact O-CD2 3.41Å; R1200-H1202 PolarHBondContact O-N 2.86Å; R1200-H1202 VanDerWaalsContact O-N 3.11Å; R1200-W1290 VanDerWaalsContact NH2-CZ3 3.28Å
1201D45Very low56.2Low51 Ų5165.2 Ų65.227%0.27336%0.357SS..  trans-75.5109.6-174.2-57.9-49000108.9C1199 H1210 T1212C1199-D1201 PolarHBondContact SG-OD1 3.01Å; C1199-D1201 VanDerWaalsContact SG-OD1 3.4Å; D1201-H1210 PolarHBondContact N-O 3.5Å; D1201-H1210 VanDerWaalsContact N-O 3.16Å; D1201-T1212 WeakPolarHBondContact OD2-CB 3.35Å; D1201-T1212 PolarHBondContact OD2-OG1 3.18Å
1202H45.2Very low54.9Low148 Ų14868.1 Ų68.169%0.68538%0.375SS*.  trans-96.28.2-174.9-76.6-49.5000113.3R1200R1200-H1202 PolarHBondContact O-CD2 3.41Å; R1200-H1202 PolarHBondContact O-N 2.86Å; R1200-H1202 VanDerWaalsContact O-N 3.11Å
1203I33.7Very low53.7Low115 Ų11569.9 Ų69.959%0.5938%0.384SS*.SBendtrans-104-15.9-157.7-67.1167.9000113.6L1099L1099-I1203 HydrophobicContact CD2-CD1 3.83Å; L1099-I1203 HydrophobicContact CD2-CG1 4.31Å
1204T31.4Very low52.5Low89 Ų8972.9 Ų72.955%0.54640%0.4SS..  trans-113.3124.2178.151.30000111.7D1206T1204-D1206 PolarHBondContact O-N 3.02Å; T1204-D1206 VanDerWaalsContact O-N 3.17Å
1205D33.1Very low51.4Low170 Ų17076.6 Ų76.691%0.90943%0.427SS*.  trans-65.8-10.2174.8-89.4-47.5000113.7S1207D1205-S1207 PolarHBondContact O-N 3.26Å
1206D29.3Very low50.3Low129 Ų12984.3 Ų84.369%0.6946%0.46SS*.SBendtrans-68.876.9173.1-73.7-43.5000112.2T1204 S1208T1204-D1206 PolarHBondContact O-N 3.02Å; T1204-D1206 VanDerWaalsContact O-N 3.17Å; D1206-S1208 PolarHBondContact O-N 2.96Å; D1206-S1208 PolarHBondContact O-OG 3.26Å
1207S35.4Very low49.2Very low110 Ų11090.1 Ų90.177%0.76950%0.496SS*.SBendtrans17.6-30.6163.663.30000122.9D1205 T1209D1205-S1207 PolarHBondContact O-N 3.26Å; S1207-T1209 PolarHBondContact O-N 3.45Å
1208S33.9Very low48.3Very low72 Ų7294.2 Ų94.250%0.50352%0.522SS..  trans-73.1112.4166.758.40000110.2D1206 H1210D1206-S1208 PolarHBondContact O-N 2.96Å; D1206-S1208 PolarHBondContact O-OG 3.26Å; S1208-H1210 PolarHBondContact O-N 2.91Å
1209T41.4Very low47.7Very low120 Ų12094.5 Ų94.574%0.73652%0.523SS*.  trans-6887164.156.80000108.5S1207 M1211S1207-T1209 PolarHBondContact O-N 3.45Å; T1209-M1211 PolarHBondContact O-N 3.37Å
1210H46.4Very low47.8Very low128 Ų12897.6 Ų97.659%0.59354%0.537SS*.  trans-61.4136173.7-124.8-98.7000108.6D1201 S1208D1201-H1210 PolarHBondContact N-O 3.5Å; D1201-H1210 VanDerWaalsContact N-O 3.16Å; S1208-H1210 PolarHBondContact O-N 2.91Å
1211M56Low48Very low51 Ų5198.1 Ų98.125%0.25155%0.546SS..  trans-123.687.1-170-174.2-174.6130.400107.4V1198 T1209 I1213 W1290 L1309V1198-M1211 HydrophobicContact CB-CE 4.35Å; V1198-M1211 HydrophobicContact CG1-CE 3.69Å; V1198-M1211 HydrophobicContact CG1-CG 3.65Å; V1198-M1211 HydrophobicContact CG1-SD 4.12Å; V1198-M1211 HydrophobicContact CG2-CE 3.65Å; T1209-M1211 PolarHBondContact O-N 3.37Å; M1211-I1213 HydrophobicContact CE-CD1 4.34Å; M1211-I1213 HydrophobicContact CE-CG1 3.91Å; M1211-I1213 PolarHBondContact O-N 2.89Å; M1211-I1213 VanDerWaalsContact O-N 3.11Å; M1211-W1290 HydrophobicContact CE-CZ2 3.74Å; M1211-W1290 HydrophobicContact SD-CZ2 3.73Å; M1211-L1309 HydrophobicContact CE-CD1 3.56Å; M1211-L1309 HydrophobicContact CE-CD2 3.33Å; M1211-L1309 HydrophobicContact CE-CG 4.04Å; M1211-L1309 HydrophobicContact SD-CD2 4.48Å
1212T55.8Low49.1Very low60 Ų6096.8 Ų96.837%0.36854%0.539SS..  trans-71.9105.2-177-64.10000109.5C1199 D1201 L1214C1199-T1212 PolarHBondContact N-O 3.38Å; C1199-T1212 PolarHBondContact O-N 2.98Å; D1201-T1212 WeakPolarHBondContact OD2-CB 3.35Å; D1201-T1212 PolarHBondContact OD2-OG1 3.18Å; T1212-L1214 HydrophobicContact CG2-CD2 4.26Å
1213I58.8Low50.4Low37 Ų3790 Ų9019%0.1951%0.507CS..BIsolated β-bridgetrans-79.1118.1176.9-61.4170.3000107.6M1211 D1305 I1306 L1309M1211-I1213 HydrophobicContact CE-CD1 4.34Å; M1211-I1213 HydrophobicContact CE-CG1 3.91Å; M1211-I1213 PolarHBondContact O-N 2.89Å; M1211-I1213 VanDerWaalsContact O-N 3.11Å; I1213-D1305 HydrophobicContact CB-CB 4.46Å; I1213-D1305 HydrophobicContact CD1-CB 3.96Å; I1213-D1305 HydrophobicContact CG2-CB 4.33Å; I1213-I1306 HydrophobicContact CD1-CG1 4.36Å; I1213-L1309 HydrophobicContact CD1-CB 4.13Å; I1213-L1309 HydrophobicContact CD1-CD2 4.18Å
1214L55.9Low52.2Low78 Ų7884.8 Ų84.841%0.40848%0.481SS..  trans-84.8135.2177.9-57.8172.1000109.3N1197 T1212 K1216 R1312N1197-L1214 HydrophobicContact CB-CB 4.19Å; N1197-L1214 WeakPolarHBondContact O-CB 3.26Å; N1197-L1214 PolarHBondContact O-N 3.14Å; T1212-L1214 HydrophobicContact CG2-CD2 4.26Å; L1214-K1216 VanDerWaalsContact C-N 3.32Å; L1214-K1216 PolarHBondContact O-N 2.97Å; L1214-R1312 PolarHBondContact O-NH1 3.08Å
1215S52.6Low54.2Low109 Ų10982.7 Ų82.776%0.76246%0.463SS*.  trans-82-4.2-174.854.50000114.5T1217S1215-T1217 PolarHBondContact O-N 3.42Å
1216K53.9Low56.3Low162 Ų16274.6 Ų74.670%0.70442%0.42SS*.  trans-60.6130.8173.1-72-172.2175.9-176.60109.9N1197 L1214N1197-K1216 PolarHBondContact ND2-O 3.2Å; L1214-K1216 VanDerWaalsContact C-N 3.32Å; L1214-K1216 PolarHBondContact O-N 2.97Å
1217T53.8Low58.8Low122 Ų12268.5 Ų68.575%0.74839%0.387SS*.  trans-90.8-36179.447.70000112.6S1215S1215-T1217 PolarHBondContact O-N 3.42Å
1218V55.3Low61Low108 Ų10865.1 Ų65.166%0.65536%0.357SS*.  trans-73.8129.2176.1-1740000109.5N1197N1197-V1218 PolarHBondContact ND2-O 2.9Å
1219V58.4Low63.1Low14 Ų1462 Ų629%0.08534%0.335CS..  trans-105.8130.8169.5175.50000107.3C1195 L1221 I1223 I1224 Y1414C1195-V1219 WeakPolarHBondContact O-CG2 3.37Å; V1219-L1221 PolarHBondContact O-N 2.89Å; V1219-I1223 HydrophobicContact CG1-CB 4.41Å; V1219-I1223 HydrophobicContact CG1-CD1 4.31Å; V1219-I1224 HydrophobicContact CB-CD1 4.3Å; V1219-I1224 HydrophobicContact CG1-CD1 4.05Å; V1219-I1224 HydrophobicContact CG1-CG1 3.97Å; V1219-Y1414 HydrophobicContact CG2-CD1 4.38Å; V1219-Y1414 HydrophobicContact CG2-CE1 3.99Å
1220D66.6Low65.1Low98 Ų9856.4 Ų56.452%0.52430%0.301SS..  trans-62.6133.6-179.6-61-51.5000111.5D1222 I1223 I1224D1220-D1222 PolarHBondContact O-N 2.92Å; D1220-D1222 VanDerWaalsContact O-N 3.16Å; D1220-I1223 HydrophobicContact CB-CD1 3.93Å; D1220-I1223 HydrophobicContact CB-CG1 4.18Å; D1220-I1223 WeakPolarHBondContact O-CB 3.46Å; D1220-I1223 PolarHBondContact O-N 3.31Å; D1220-I1224 PolarHBondContact O-N 2.93Å
1221L66.8Low66.9Low89 Ų8950.4 Ų50.447%0.46627%0.273SS..Hα-helixtrans-61.1-26.7178.2-74.586.2000112.1V1219 I1223 I1224 Y1225V1219-L1221 PolarHBondContact O-N 2.89Å; L1221-I1223 VanDerWaalsContact C-N 3.26Å; L1221-I1223 PolarHBondContact O-N 3.43Å; L1221-I1224 PolarHBondContact O-N 2.96Å; L1221-Y1225 HydrophobicContact CB-CD2 4.06Å; L1221-Y1225 HydrophobicContact CB-CE2 3.9Å; L1221-Y1225 HydrophobicContact CD2-CE2 3.95Å; L1221-Y1225 HydrophobicContact CG-CE2 4.5Å; L1221-Y1225 WeakPolarHBondContact O-CB 3.39Å; L1221-Y1225 WeakPolarHBondContact O-CD2 3.29Å; L1221-Y1225 PolarHBondContact O-N 3.44Å
1222D66.4Low67.8Low24 Ų2448 Ų4813%0.12826%0.261CS..Hα-helixtrans-57.3-39.3173.5-159.891.1000111R1044 S1113 Y1114 I1115 D1220 S1226R1044-D1222 IonicContact CZ-OD1 2.71Å; R1044-D1222 IonicContact NH2-OD1 3.52Å; R1044-D1222 PolarHBondContact NH2-OD1 3.38Å; S1113-D1222 PolarHBondContact OG-OD1 3.23Å; S1113-D1222 PolarHBondContact OG-OD2 3.38Å; Y1114-D1222 WeakPolarHBondContact CA-OD2 3.29Å; Y1114-D1222 WeakPolarHBondContact CB-OD2 3.33Å; Y1114-D1222 PolarHBondContact N-OD2 2.95Å; I1115-D1222 HydrophobicContact CD1-CB 4.37Å; I1115-D1222 WeakPolarHBondContact CD1-OD1 3.2Å; I1115-D1222 HydrophobicContact CG1-CB 4.49Å; I1115-D1222 VanDerWaalsContact CG1-O 3.23Å; I1115-D1222 WeakPolarHBondContact CG1-O 3.45Å; I1115-D1222 PolarHBondContact N-OD2 3.47Å; D1220-D1222 PolarHBondContact O-N 2.92Å; D1220-D1222 VanDerWaalsContact O-N 3.16Å; D1222-S1226 VanDerWaalsContact O-CB 3.28Å; D1222-S1226 WeakPolarHBondContact O-CB 3.35Å; D1222-S1226 PolarHBondContact O-N 3.09Å; D1222-S1226 PolarHBondContact O-OG 3.05Å
1223I73.8Confident68.8Low4 Ų445.1 Ų45.12%0.02124%0.244CC..Hα-helixtrans-70.5-46.7176.7-55.8162.4000110.6Y1114 L1191 T1194 V1219 D1220 L1221 S1226 L1227Y1114-I1223 HydrophobicContact CD1-CG1 4.43Å; Y1114-I1223 HydrophobicContact CD2-CD1 4.36Å; Y1114-I1223 HydrophobicContact CD2-CG1 3.51Å; Y1114-I1223 HydrophobicContact CE2-CD1 4.05Å; Y1114-I1223 HydrophobicContact CE2-CG1 3.69Å; Y1114-I1223 HydrophobicContact CG-CG1 3.91Å; L1191-I1223 HydrophobicContact CD2-CG2 4.01Å; T1194-I1223 WeakPolarHBondContact OG1-CG2 3.18Å; V1219-I1223 HydrophobicContact CG1-CB 4.41Å; V1219-I1223 HydrophobicContact CG1-CD1 4.31Å; D1220-I1223 HydrophobicContact CB-CD1 3.93Å; D1220-I1223 HydrophobicContact CB-CG1 4.18Å; D1220-I1223 WeakPolarHBondContact O-CB 3.46Å; D1220-I1223 PolarHBondContact O-N 3.31Å; L1221-I1223 VanDerWaalsContact C-N 3.26Å; L1221-I1223 PolarHBondContact O-N 3.43Å; I1223-S1226 WeakPolarHBondContact O-CB 3.47Å; I1223-S1226 PolarHBondContact O-N 3.38Å; I1223-L1227 PolarHBondContact O-N 3.15Å
1224I71.4Confident69.9Low7 Ų743.8 Ų43.84%0.03624%0.237CC..Hα-helixtrans-59.8-49.2-179.5-72.1164.3000110.7V1219 D1220 L1221 L1227 R1228 Y1414 L1415 P1417V1219-I1224 HydrophobicContact CB-CD1 4.3Å; V1219-I1224 HydrophobicContact CG1-CD1 4.05Å; V1219-I1224 HydrophobicContact CG1-CG1 3.97Å; D1220-I1224 PolarHBondContact O-N 2.93Å; L1221-I1224 PolarHBondContact O-N 2.96Å; I1224-L1227 PolarHBondContact O-N 3.32Å; I1224-R1228 WeakPolarHBondContact O-CB 3.36Å; I1224-R1228 PolarHBondContact O-N 2.87Å; I1224-Y1414 WeakPolarHBondContact CD1-O 3.47Å; I1224-Y1414 WeakPolarHBondContact CG1-O 3.36Å; I1224-Y1414 WeakPolarHBondContact CG2-O 3.25Å; I1224-L1415 HydrophobicContact CG2-CD2 4.47Å; I1224-P1417 HydrophobicContact CD1-CG 4.46Å
1225Y72.2Confident70.7Confident45 Ų4540.1 Ų40.118%0.17622%0.218CC..Hα-helixtrans-67-34.6176.3-70-55.9000112.1I1048 L1221 R1228 L1229I1048-Y1225 HydrophobicContact CG2-CD1 4.32Å; I1048-Y1225 HydrophobicContact CG2-CD2 4.03Å; I1048-Y1225 HydrophobicContact CG2-CG 3.75Å; L1221-Y1225 HydrophobicContact CB-CD2 4.06Å; L1221-Y1225 HydrophobicContact CB-CE2 3.9Å; L1221-Y1225 HydrophobicContact CD2-CE2 3.95Å; L1221-Y1225 HydrophobicContact CG-CE2 4.5Å; L1221-Y1225 WeakPolarHBondContact O-CB 3.39Å; L1221-Y1225 WeakPolarHBondContact O-CD2 3.29Å; L1221-Y1225 PolarHBondContact O-N 3.44Å; Y1225-R1228 PolarHBondContact O-N 2.74Å; Y1225-L1229 WeakPolarHBondContact O-CB 3.05Å; Y1225-L1229 PolarHBondContact O-N 2.8Å
1226S77.9Confident71.7Confident0 Ų035.9 Ų35.90%019%0.185CC..Hα-helixtrans-60-48.5171.8-64.20000112.3Y1114 I1115 D1222 I1223 L1229 V1230Y1114-S1226 WeakPolarHBondContact CB-OG 3.39Å; Y1114-S1226 PolarHBondContact O-OG 2.96Å; I1115-S1226 VanDerWaalsContact CA-OG 3.26Å; I1115-S1226 WeakPolarHBondContact CA-OG 3.47Å; I1115-S1226 WeakPolarHBondContact CG1-OG 3.43Å; I1115-S1226 PolarHBondContact N-OG 3.47Å; D1222-S1226 VanDerWaalsContact O-CB 3.28Å; D1222-S1226 WeakPolarHBondContact O-CB 3.35Å; D1222-S1226 PolarHBondContact O-N 3.09Å; D1222-S1226 PolarHBondContact O-OG 3.05Å; I1223-S1226 WeakPolarHBondContact O-CB 3.47Å; I1223-S1226 PolarHBondContact O-N 3.38Å; S1226-L1229 PolarHBondContact O-N 3.48Å; S1226-V1230 WeakPolarHBondContact O-CG2 3.19Å; S1226-V1230 PolarHBondContact O-N 2.55Å
1227L82.8Confident72.4Confident0 Ų028.3 Ų28.30%015%0.153CC..Hα-helixtrans-65.3-44.1180-177.258.7000110.6L1191 V1192 I1223 I1224 L1229 V1230 L1231 L1316 L1415L1191-L1227 HydrophobicContact CB-CB 4.29Å; L1191-L1227 HydrophobicContact CB-CD1 4.2Å; V1192-L1227 HydrophobicContact CG2-CD1 4.17Å; V1192-L1227 HydrophobicContact CG2-CD2 4.14Å; I1223-L1227 PolarHBondContact O-N 3.15Å; I1224-L1227 PolarHBondContact O-N 3.32Å; L1227-L1229 PolarHBondContact O-N 3.46Å; L1227-V1230 PolarHBondContact O-N 3.11Å; L1227-L1231 HydrophobicContact CD1-CD1 3.96Å; L1227-L1231 HydrophobicContact CD1-CG 4.05Å; L1227-L1231 HydrophobicContact CG-CD1 3.91Å; L1227-L1231 HydrophobicContact CG-CG 4.39Å; L1227-L1231 VanDerWaalsContact O-CB 3.26Å; L1227-L1231 WeakPolarHBondContact O-CB 3.37Å; L1227-L1231 VanDerWaalsContact O-CG 3.24Å; L1227-L1231 WeakPolarHBondContact O-CG 3.35Å; L1227-L1231 PolarHBondContact O-N 3.29Å; L1227-L1316 HydrophobicContact CD2-CD1 4.1Å; L1227-L1415 HydrophobicContact CD2-CD2 4.39Å
1228R80.4Confident72.9Confident39 Ų3923.5 Ų23.515%0.14712%0.123CC..Hα-helixtrans-59.4-43.4174.4-174.8174.3165.7133.7-0.9112S1052 I1224 Y1225 S1232 Y1323 L1415S1052-R1228 PolarHBondContact OG-NE 3.46Å; S1052-R1228 VanDerWaalsContact OG-NE 3.12Å; I1224-R1228 WeakPolarHBondContact O-CB 3.36Å; I1224-R1228 PolarHBondContact O-N 2.87Å; Y1225-R1228 PolarHBondContact O-N 2.74Å; R1228-S1232 WeakPolarHBondContact O-CB 3.4Å; R1228-S1232 PolarHBondContact O-N 2.69Å; R1228-S1232 PolarHBondContact O-OG 2.97Å; R1228-Y1323 HydrophobicContact CG-CE1 4.03Å; R1228-Y1323 HydrophobicContact CG-CE2 4.05Å; R1228-Y1323 WeakPolarHBondContact CG-OH 3.47Å; R1228-L1415 PolarHBondContact NH1-O 3.23Å; R1228-L1415 VanDerWaalsContact NH1-O 3.1Å
1229L79.6Confident73.3Confident7 Ų719.5 Ų19.54%0.03710%0.104CC..Hα-helixtrans-64.8-49.3178.1-178.666.8000112L1051 F1055 L1119 L1122 Y1225 S1226 L1227 S1232 A1233L1051-L1229 HydrophobicContact CB-CD1 4.01Å; F1055-L1229 HydrophobicContact CD2-CD1 3.44Å; F1055-L1229 VanDerWaalsContact CD2-CD1 3.44Å; F1055-L1229 HydrophobicContact CE2-CD1 3.89Å; F1055-L1229 HydrophobicContact CG-CD1 4.37Å; L1119-L1229 HydrophobicContact CD2-CD2 3.75Å; L1119-L1229 HydrophobicContact CG-CD2 4.49Å; L1122-L1229 HydrophobicContact CD1-CG 4.35Å; Y1225-L1229 WeakPolarHBondContact O-CB 3.05Å; Y1225-L1229 PolarHBondContact O-N 2.8Å; S1226-L1229 PolarHBondContact O-N 3.48Å; L1227-L1229 PolarHBondContact O-N 3.46Å; L1229-S1232 PolarHBondContact O-N 3.28Å; L1229-A1233 WeakPolarHBondContact O-CB 3.31Å; L1229-A1233 PolarHBondContact O-N 2.92Å
1230V82.6Confident73.3Confident2 Ų223.5 Ų23.51%0.01212%0.122CC..Hα-helixtrans-64.2-43.2178.2171.90000111.1A1118 I1184 L1187 C1188 L1191 S1226 L1227 M1234 L1278A1118-V1230 HydrophobicContact CB-CG2 3.82Å; I1184-V1230 HydrophobicContact CG2-CG1 4.24Å; L1187-V1230 HydrophobicContact CD2-CG2 4.47Å; C1188-V1230 HydrophobicContact CB-CG1 4.45Å; L1191-V1230 HydrophobicContact CD1-CG2 4.29Å; S1226-V1230 WeakPolarHBondContact O-CG2 3.19Å; S1226-V1230 PolarHBondContact O-N 2.55Å; L1227-V1230 PolarHBondContact O-N 3.11Å; V1230-M1234 VanDerWaalsContact O-CB 3.27Å; V1230-M1234 WeakPolarHBondContact O-CB 3.19Å; V1230-M1234 WeakPolarHBondContact O-CG 3.27Å; V1230-M1234 PolarHBondContact O-N 3.46Å; V1230-L1278 HydrophobicContact CG1-CD2 3.91Å
1231L83.2Confident73.3Confident3 Ų320.8 Ų20.82%0.01611%0.106CC..Hα-helixtrans-64.4-40.2175.9-73.1175.6000111.7L1227 A1235 L1279 L1282 I1320 Y1323L1227-L1231 HydrophobicContact CD1-CD1 3.96Å; L1227-L1231 HydrophobicContact CD1-CG 4.05Å; L1227-L1231 HydrophobicContact CG-CD1 3.91Å; L1227-L1231 HydrophobicContact CG-CG 4.39Å; L1227-L1231 VanDerWaalsContact O-CB 3.26Å; L1227-L1231 WeakPolarHBondContact O-CB 3.37Å; L1227-L1231 VanDerWaalsContact O-CG 3.24Å; L1227-L1231 WeakPolarHBondContact O-CG 3.35Å; L1227-L1231 PolarHBondContact O-N 3.29Å; L1231-A1235 WeakPolarHBondContact O-CA 3.35Å; L1231-A1235 WeakPolarHBondContact O-CB 3.41Å; L1231-A1235 PolarHBondContact O-N 2.9Å; L1231-L1279 HydrophobicContact CD2-CD1 4.3Å; L1231-L1282 HydrophobicContact CD2-CD2 4.07Å; L1231-I1320 HydrophobicContact CD1-CD1 4.46Å; L1231-I1320 HydrophobicContact CD1-CG1 3.91Å; L1231-I1320 HydrophobicContact CD1-CG2 4.28Å; L1231-Y1323 HydrophobicContact CB-CD1 4.47Å
1232S76.2Confident73.2Confident0 Ų016.9 Ų16.90%09%0.086CC..Hα-helixtrans-59.1-61.7173.2-53.70000110.2F1059 R1228 L1229 M1234 Y1323F1059-S1232 WeakPolarHBondContact CE2-O 3.18Å; F1059-S1232 WeakPolarHBondContact CZ-O 3.38Å; R1228-S1232 WeakPolarHBondContact O-CB 3.4Å; R1228-S1232 PolarHBondContact O-N 2.69Å; R1228-S1232 PolarHBondContact O-OG 2.97Å; L1229-S1232 PolarHBondContact O-N 3.28Å; S1232-M1234 PolarHBondContact O-N 3.27Å; S1232-M1234 VanDerWaalsContact O-N 3.09Å; S1232-Y1323 WeakPolarHBondContact OG-CE1 3.41Å; S1232-Y1323 PolarHBondContact OG-OH 3.48Å
1233A77.3Confident72.7Confident0 Ų017.4 Ų17.40%09%0.088CC..Hα-helixtrans-60.1-25.1-173.900000114.4F1055 L1066 L1122 L1229F1055-A1233 HydrophobicContact CD1-CB 3.78Å; F1055-A1233 HydrophobicContact CE1-CB 3.78Å; F1055-A1233 HydrophobicContact CG-CB 4.25Å; F1055-A1233 HydrophobicContact CZ-CB 4.22Å; L1066-A1233 HydrophobicContact CD2-CB 4.19Å; L1122-A1233 HydrophobicContact CD1-CB 4.05Å; L1122-A1233 HydrophobicContact CD2-CB 3.98Å; L1229-A1233 WeakPolarHBondContact O-CB 3.31Å; L1229-A1233 PolarHBondContact O-N 2.92Å
1234M80.7Confident71.9Confident9 Ų919.4 Ų19.44%0.04410%0.099CC..Hα-helixtrans-120.7-0.8-172.7-56.9-61.1-60.800115.2L1122 W1125 I1184 V1230 S1232 F1236 V1237 L1278L1122-M1234 HydrophobicContact CD2-CG 3.85Å; L1122-M1234 HydrophobicContact CD2-SD 3.88Å; W1125-M1234 HydrophobicContact CD2-CE 4.12Å; W1125-M1234 HydrophobicContact CD2-SD 4.47Å; W1125-M1234 HydrophobicContact CE3-CE 4.38Å; W1125-M1234 HydrophobicContact CE3-SD 4.24Å; W1125-M1234 HydrophobicContact CH2-CE 4.14Å; W1125-M1234 HydrophobicContact CH2-SD 4.5Å; W1125-M1234 HydrophobicContact CZ2-CE 3.85Å; W1125-M1234 HydrophobicContact CZ3-CE 4.4Å; W1125-M1234 HydrophobicContact CZ3-SD 4.26Å; I1184-M1234 HydrophobicContact CD1-CE 3.78Å; I1184-M1234 HydrophobicContact CD1-CG 4.44Å; I1184-M1234 HydrophobicContact CD1-SD 3.99Å; I1184-M1234 HydrophobicContact CG2-CG 4.21Å; V1230-M1234 VanDerWaalsContact O-CB 3.27Å; V1230-M1234 WeakPolarHBondContact O-CB 3.19Å; V1230-M1234 WeakPolarHBondContact O-CG 3.27Å; V1230-M1234 PolarHBondContact O-N 3.46Å; S1232-M1234 PolarHBondContact O-N 3.27Å; S1232-M1234 VanDerWaalsContact O-N 3.09Å; M1234-F1236 VanDerWaalsContact C-N 3.34Å; M1234-F1236 PolarHBondContact O-N 2.83Å; M1234-V1237 HydrophobicContact CE-CB 3.95Å; M1234-V1237 HydrophobicContact CE-CG1 3.94Å; M1234-V1237 HydrophobicContact CE-CG2 3.87Å; M1234-V1237 PolarHBondContact O-N 3.38Å; M1234-V1237 HydrophobicContact SD-CG2 4.06Å; M1234-L1278 HydrophobicContact CB-CB 4.15Å; M1234-L1278 HydrophobicContact CB-CD2 3.55Å; M1234-L1278 HydrophobicContact CB-CG 4.5Å; M1234-L1278 HydrophobicContact CG-CD2 4.23Å
1235A73.7Confident70.9Confident1 Ų121.3 Ų21.31%0.00812%0.12CC..THydrogen-bonded Turntrans-58.2-44.6-178.500000112.8L1231 L1279 L1327 L1340L1231-A1235 WeakPolarHBondContact O-CA 3.35Å; L1231-A1235 WeakPolarHBondContact O-CB 3.41Å; L1231-A1235 PolarHBondContact O-N 2.9Å; A1235-L1279 HydrophobicContact CB-CB 4.46Å; A1235-L1279 HydrophobicContact CB-CD2 4.04Å; A1235-L1327 HydrophobicContact CB-CD1 3.96Å; A1235-L1340 VanDerWaalsContact O-CD2 3.22Å; A1235-L1340 WeakPolarHBondContact O-CD2 3.46Å
1236F71.8Confident69.8Low20 Ų2025.2 Ų25.29%0.08814%0.138CC..THydrogen-bonded Turntrans-97.46.5-175.7-54.1-56000114F1059 M1234 V1238 L1327 F1328 N1331 P1333 C1337F1059-F1236 HydrophobicContact CB-CD2 4.24Å; F1059-F1236 HydrophobicContact CD1-CB 4.19Å; F1059-F1236 AromaticContact CD1-CD2 3.74Å; F1059-F1236 HydrophobicContact CD1-CD2 3.74Å; F1059-F1236 HydrophobicContact CD1-CG 4.45Å; F1059-F1236 HydrophobicContact CD2-CD2 4.15Å; F1059-F1236 HydrophobicContact CD2-CE2 4.5Å; F1059-F1236 HydrophobicContact CE1-CB 4.15Å; F1059-F1236 HydrophobicContact CE1-CD2 4.07Å; F1059-F1236 HydrophobicContact CE2-CD2 4.45Å; F1059-F1236 AromaticContact CG-CD2 3.78Å; F1059-F1236 HydrophobicContact CG-CD2 3.78Å; F1059-F1236 HydrophobicContact CG-CE2 4.37Å; F1059-F1236 HydrophobicContact CZ-CD2 4.41Å; M1234-F1236 VanDerWaalsContact C-N 3.34Å; M1234-F1236 PolarHBondContact O-N 2.83Å; F1236-V1238 PolarHBondContact O-N 2.83Å; F1236-V1238 VanDerWaalsContact O-N 3.07Å; F1236-L1327 HydrophobicContact CE2-CB 3.9Å; F1236-L1327 HydrophobicContact CZ-CB 3.68Å; F1236-F1328 HydrophobicContact CD1-CE1 4.45Å; F1236-F1328 HydrophobicContact CD1-CZ 4.39Å; F1236-F1328 AromaticContact CE1-CD1 3.95Å; F1236-F1328 HydrophobicContact CE1-CD1 3.95Å; F1236-F1328 HydrophobicContact CE1-CD2 4.07Å; F1236-F1328 AromaticContact CE1-CE1 3.83Å; F1236-F1328 HydrophobicContact CE1-CE1 3.83Å; F1236-F1328 AromaticContact CE1-CE2 3.95Å; F1236-F1328 HydrophobicContact CE1-CE2 3.95Å; F1236-F1328 HydrophobicContact CE1-CG 4.06Å; F1236-F1328 AromaticContact CE1-CZ 3.82Å; F1236-F1328 HydrophobicContact CE1-CZ 3.82Å; F1236-F1328 HydrophobicContact CZ-CD1 4.48Å; F1236-F1328 HydrophobicContact CZ-CG 4.35Å; F1236-N1331 HydrophobicContact CE2-CB 4.15Å; F1236-P1333 HydrophobicContact CD1-CB 3.84Å; F1236-P1333 HydrophobicContact CD1-CG 3.89Å; F1236-P1333 HydrophobicContact CD2-CB 4.43Å; F1236-P1333 HydrophobicContact CE1-CB 4.1Å; F1236-P1333 HydrophobicContact CE1-CG 3.64Å; F1236-P1333 HydrophobicContact CG-CB 4.03Å; F1236-P1333 HydrophobicContact CG-CG 4.47Å; F1236-P1333 HydrophobicContact CZ-CB 4.47Å; F1236-P1333 HydrophobicContact CZ-CG 3.98Å; F1236-C1337 HydrophobicContact CD1-CB 4.5Å
1237V70.7Confident68Low3 Ų330 Ų302%0.01816%0.16CC..  trans-74.699.6169.1179.20000107.9W1125 M1234 E1241 G1277W1125-V1237 HydrophobicContact CH2-CG1 3.94Å; W1125-V1237 HydrophobicContact CH2-CG2 4.02Å; W1125-V1237 HydrophobicContact CZ2-CG1 3.73Å; M1234-V1237 HydrophobicContact CE-CB 3.95Å; M1234-V1237 HydrophobicContact CE-CG1 3.94Å; M1234-V1237 HydrophobicContact CE-CG2 3.87Å; M1234-V1237 PolarHBondContact O-N 3.38Å; M1234-V1237 HydrophobicContact SD-CG2 4.06Å; V1237-E1241 HydrophobicContact CG1-CB 3.82Å; V1237-G1277 WeakPolarHBondContact O-CA 3.37Å
1238V63.2Low65.9Low20 Ų2035.7 Ų35.712%0.12119%0.19CC..  trans-133.8159.4-173.5-178.80000108F1236 R1274 L1340F1236-V1238 PolarHBondContact O-N 2.83Å; F1236-V1238 VanDerWaalsContact O-N 3.07Å; V1238-R1274 WeakPolarHBondContact CG1-O 3.48Å; V1238-L1340 HydrophobicContact CG2-CD2 4.13Å
1239G64.1Low63.8Low24 Ų2438.4 Ų38.425%0.24721%0.205CC..SBendtrans90.5-153.5-173.500000112.3E1241 A1242 R1274G1239-E1241 PolarHBondContact O-N 2.98Å; G1239-A1242 PolarHBondContact O-N 3.21Å; G1239-A1242 VanDerWaalsContact O-N 3.13Å; G1239-R1274 WeakPolarHBondContact CA-O 3.31Å; G1239-R1274 PolarHBondContact N-O 2.91Å
1240E59Low61.8Low99 Ų9945.3 Ų45.346%0.46324%0.237SC..G310 helixtrans-58.1-31.7-179.9-67.5177.9-155.700113R1132 A1242 M1243R1132-E1240 IonicContact CZ-OE2 3.83Å; R1132-E1240 IonicContact NH1-OE2 3Å; R1132-E1240 IonicContact NH2-OE2 2.74Å; R1132-E1240 PolarHBondContact NH2-OE2 3.13Å; E1240-A1242 PolarHBondContact O-N 3.4Å; E1240-A1242 VanDerWaalsContact O-N 3.11Å; E1240-M1243 HydrophobicContact CB-CE 4.47Å; E1240-M1243 HydrophobicContact CG-CE 4.3Å; E1240-M1243 PolarHBondContact O-N 3.49Å; E1240-M1243 VanDerWaalsContact O-N 3.1Å
1241E65.7Low59.7Low40 Ų4050.7 Ų50.719%0.18727%0.272CS..G310 helixtrans-64.4-15.6-179.7-61.2-168.8141.500113.5W1125 R1129 F1177 V1237 G1239W1125-E1241 HydrophobicContact CZ2-CB 4.41Å; R1129-E1241 IonicContact CZ-OE1 2.79Å; R1129-E1241 IonicContact CZ-OE2 3.44Å; R1129-E1241 IonicContact NE-OE1 3.44Å; R1129-E1241 PolarHBondContact NE-OE1 3.31Å; R1129-E1241 IonicContact NE-OE2 3.65Å; R1129-E1241 VanDerWaalsContact NH2-CD 3.28Å; R1129-E1241 IonicContact NH2-OE1 2.71Å; R1129-E1241 PolarHBondContact NH2-OE1 3.35Å; R1129-E1241 IonicContact NH2-OE2 3.59Å; R1129-E1241 PolarHBondContact NH2-OE2 2.9Å; F1177-E1241 HydrophobicContact CE1-CB 4.48Å; F1177-E1241 WeakPolarHBondContact CE1-O 3.23Å; F1177-E1241 HydrophobicContact CZ-CB 3.96Å; F1177-E1241 HydrophobicContact CZ-CG 4.38Å; F1177-E1241 VanDerWaalsContact CZ-O 3.25Å; F1177-E1241 WeakPolarHBondContact CZ-O 3.26Å; V1237-E1241 HydrophobicContact CG1-CB 3.82Å; G1239-E1241 PolarHBondContact O-N 2.98Å
1242A63.8Low57.5Low7 Ų754.3 Ų54.36%0.05830%0.297CS..G310 helixtrans-100.70.5177.600000114.4R1185 G1239 E1240R1185-A1242 PolarHBondContact NH1-O 2.95Å; R1185-A1242 PolarHBondContact NH2-O 2.97Å; G1239-A1242 PolarHBondContact O-N 3.21Å; G1239-A1242 VanDerWaalsContact O-N 3.13Å; E1240-A1242 PolarHBondContact O-N 3.4Å; E1240-A1242 VanDerWaalsContact O-N 3.11Å
1243M57.6Low55.6Low35 Ų3562.3 Ų62.317%0.17234%0.34CS..  trans-81.1153.5-176.2-61.5-156-52.600112.7E1240 V1270 R1274E1240-M1243 HydrophobicContact CB-CE 4.47Å; E1240-M1243 HydrophobicContact CG-CE 4.3Å; E1240-M1243 PolarHBondContact O-N 3.49Å; E1240-M1243 VanDerWaalsContact O-N 3.1Å; M1243-V1270 HydrophobicContact SD-CG1 3.74Å; M1243-R1274 HydrophobicContact CG-CB 4.21Å; M1243-R1274 HydrophobicContact CG-CG 4.22Å; M1243-R1274 HydrophobicContact SD-CB 4.07Å; M1243-R1274 HydrophobicContact SD-CG 3.93Å
1244I55.3Low53.6Low47 Ų4768.2 Ų68.224%0.24138%0.376CS..  trans-135129.7171.2-64171.6000107S1178 A1181 H1182 R1185S1178-I1244 WeakPolarHBondContact OG-CA 3.38Å; A1181-I1244 HydrophobicContact CB-CG1 3.99Å; H1182-I1244 VanDerWaalsContact CA-CD1 3.49Å; H1182-I1244 HydrophobicContact CB-CD1 3.88Å; H1182-I1244 HydrophobicContact CB-CG1 4.45Å; H1182-I1244 HydrophobicContact CB-CG2 4.29Å; R1185-I1244 HydrophobicContact CG-CD1 4.25Å
1245G51.1Low51.5Low46 Ų4672.7 Ų72.747%0.47441%0.408SS..SBendtrans98.9161.4-167.300000112S1178S1178-G1245 PolarHBondContact OG-N 2.85Å
1246F48.4Very low49.9Very low128 Ų12877.3 Ų77.356%0.56144%0.44SS*.  trans-73.1169.8-168.8-88.3-82.5000115.1E1171 F1175E1171-F1246 HydrophobicContact CB-CE1 4.37Å; F1175-F1246 HydrophobicContact CB-CZ 3.91Å; F1175-F1246 AromaticContact CD2-CE2 3.7Å; F1175-F1246 HydrophobicContact CD2-CE2 3.7Å; F1175-F1246 AromaticContact CD2-CZ 3.88Å; F1175-F1246 HydrophobicContact CD2-CZ 3.88Å; F1175-F1246 HydrophobicContact CE2-CE2 4.44Å; F1175-F1246 HydrophobicContact CG-CZ 4.3Å
1247H41.7Very low48.5Very low101 Ų10187.4 Ų87.447%0.46848%0.478SS..SBendtrans-38.6151.2176.5-84.1-74.7000116.3E1249H1247-E1249 PolarHBondContact O-N 3.32Å
1248D37.8Very low47.3Very low119 Ų11992.6 Ų92.664%0.63651%0.514SS*.  trans8.981.9146.7-55.8-67.1000115.9Q1250D1248-Q1250 PolarHBondContact O-N 3.16Å
1249E36.3Very low46.1Very low95 Ų95102.1 Ų102.144%0.44455%0.548SS..  trans-65.473145.6-63.7-159.212800108H1247 R1263H1247-E1249 PolarHBondContact O-N 3.32Å; E1249-R1263 IonicContact OE1-CZ 3.05Å; E1249-R1263 IonicContact OE1-NE 3.5Å; E1249-R1263 PolarHBondContact OE1-NE 3.41Å; E1249-R1263 IonicContact OE1-NH2 2.74Å; E1249-R1263 PolarHBondContact OE1-NH2 3.28Å; E1249-R1263 VanDerWaalsContact OE2-CG 3.25Å; E1249-R1263 WeakPolarHBondContact OE2-CG 3.5Å; E1249-R1263 IonicContact OE2-CZ 2.74Å; E1249-R1263 IonicContact OE2-NE 2.66Å; E1249-R1263 PolarHBondContact OE2-NE 2.95Å; E1249-R1263 IonicContact OE2-NH2 3.34Å
1250Q38Very low45.8Very low153 Ų153104.4 Ų104.472%0.71556%0.555SS**  trans-47.3140.2164.4-90.3-165.3-500107.9D1248 S1252D1248-Q1250 PolarHBondContact O-N 3.16Å; Q1250-S1252 PolarHBondContact O-N 3.11Å
1251P38Very low45.5Very low115 Ų115107.4 Ų107.475%0.74757%0.569SS**  trans-71.575.7178.130.6-35.2000110.1N1253P1251-N1253 PolarHBondContact O-N 3.09Å; P1251-N1253 VanDerWaalsContact O-N 3.15Å
1252S36.5Very low44.9Very low78 Ų78112.2 Ų112.255%0.54559%0.591SS.*  trans-59.6117.6170.245.80000108.2Q1250 V1254Q1250-S1252 PolarHBondContact O-N 3.11Å; S1252-V1254 PolarHBondContact O-N 3.36Å
1253N37.6Very low44.3Very low169 Ų169117.2 Ų117.290%0.90461%0.608SS**  trans-74.349.3-167.6-93.1-30000113.3P1251P1251-N1253 PolarHBondContact O-N 3.09Å; P1251-N1253 VanDerWaalsContact O-N 3.15Å
1254V34.3Very low44.4Very low123 Ų123118.2 Ų118.275%0.74562%0.616SS**  trans-109.997-171.5-172.90000110.8S1252S1252-V1254 PolarHBondContact O-N 3.36Å
1255S36.2Very low44.6Very low103 Ų103125.4 Ų125.472%0.7264%0.64SS**  trans57.7101.7164.7-162.30000117.5R1257S1255-R1257 VanDerWaalsContact C-N 3.33Å; S1255-R1257 PolarHBondContact O-N 3.03Å; S1255-R1257 VanDerWaalsContact O-N 3.14Å
1256S41.8Very low45Very low99 Ų99131 Ų13169%0.69265%0.647SS**  trans-76.65.2-167.953.50000117.4N1260S1256-N1260 PolarHBondContact O-ND2 2.82Å
1257R41.2Very low45.7Very low231 Ų231131.2 Ų131.287%0.87265%0.645SS**SBendtrans-104.60.7-153.1-96.7-174.9173.7-172.7-1.9120.6S1255S1255-R1257 VanDerWaalsContact C-N 3.33Å; S1255-R1257 PolarHBondContact O-N 3.03Å; S1255-R1257 VanDerWaalsContact O-N 3.14Å
1258S45.6Very low46.8Very low113 Ų113134.3 Ų134.379%0.7965%0.653SS**SBendtrans-154.3-29.4173.767.20000119.6
1259R37.6Very low48.2Very low219 Ų219132.8 Ų132.883%0.82664%0.642SS**SBendtrans-91.80.9-170.3-76.5-178.3167.5168.6-4.1116.1
1260N57.8Low49.6Very low72 Ų72131 Ų13139%0.38564%0.637SS.*Hα-helixtrans-73.8-46.9-159.2-69.3-8.2000115.5S1256 Q1262 R1263 T1264S1256-N1260 PolarHBondContact O-ND2 2.82Å; N1260-Q1262 VanDerWaalsContact C-N 3.35Å; N1260-Q1262 PolarHBondContact O-N 3.44Å; N1260-Q1262 VanDerWaalsContact O-N 3.11Å; N1260-R1263 CarbonylContact O-C 3.45Å; N1260-R1263 PolarHBondContact O-N 3.29Å; N1260-T1264 WeakPolarHBondContact O-CB 3.42Å; N1260-T1264 PolarHBondContact O-N 3.13Å; N1260-T1264 PolarHBondContact O-OG1 3.12Å
1261H53.4Low51.1Low163 Ų163125.4 Ų125.476%0.75561%0.611SS**Hα-helixtrans-56.1-39.6-165.1-67.9-43000115.6R1265H1261-R1265 WeakPolarHBondContact O-CB 3.15Å; H1261-R1265 VanDerWaalsContact O-CG 3.3Å; H1261-R1265 WeakPolarHBondContact O-CG 3.47Å; H1261-R1265 PolarHBondContact O-N 2.79Å
1262Q53.4Low52.6Low140 Ų140126.2 Ų126.265%0.65460%0.599SS**Hα-helixtrans-76.1-35.8179-160.4174.714.500112N1260 R1265 R1266N1260-Q1262 VanDerWaalsContact C-N 3.35Å; N1260-Q1262 PolarHBondContact O-N 3.44Å; N1260-Q1262 VanDerWaalsContact O-N 3.11Å; Q1262-R1265 PolarHBondContact O-N 3.34Å; Q1262-R1266 WeakPolarHBondContact O-CG 3.24Å; Q1262-R1266 PolarHBondContact O-N 2.86Å
1263R51.8Low54.2Low113 Ų113123.5 Ų123.543%0.42658%0.578SS.*Hα-helixtrans-65.6-47.1173-155.5-179.7-161.9-169.66.1110.8E1249 N1260 R1265 R1266 Y1267E1249-R1263 IonicContact OE1-CZ 3.05Å; E1249-R1263 IonicContact OE1-NE 3.5Å; E1249-R1263 PolarHBondContact OE1-NE 3.41Å; E1249-R1263 IonicContact OE1-NH2 2.74Å; E1249-R1263 PolarHBondContact OE1-NH2 3.28Å; E1249-R1263 VanDerWaalsContact OE2-CG 3.25Å; E1249-R1263 WeakPolarHBondContact OE2-CG 3.5Å; E1249-R1263 IonicContact OE2-CZ 2.74Å; E1249-R1263 IonicContact OE2-NE 2.66Å; E1249-R1263 PolarHBondContact OE2-NE 2.95Å; E1249-R1263 IonicContact OE2-NH2 3.34Å; N1260-R1263 CarbonylContact O-C 3.45Å; N1260-R1263 PolarHBondContact O-N 3.29Å; R1263-R1265 VanDerWaalsContact C-N 3.34Å; R1263-R1265 PolarHBondContact O-N 2.91Å; R1263-R1266 PolarHBondContact O-N 3.36Å; R1263-R1266 VanDerWaalsContact O-N 3.16Å; R1263-Y1267 WeakPolarHBondContact O-CB 3.48Å; R1263-Y1267 PolarHBondContact O-N 3.33Å
1264T59.1Low55.6Low56 Ų56120.3 Ų120.334%0.34455%0.553SS.*Hα-helixtrans-61-37.4173.3-50.70000112.4N1260 R1268N1260-T1264 WeakPolarHBondContact O-CB 3.42Å; N1260-T1264 PolarHBondContact O-N 3.13Å; N1260-T1264 PolarHBondContact O-OG1 3.12Å; T1264-R1268 HydrophobicContact CG2-CG 4.41Å; T1264-R1268 VanDerWaalsContact O-CB 3.29Å; T1264-R1268 WeakPolarHBondContact O-CB 3.39Å; T1264-R1268 VanDerWaalsContact O-CG 3.26Å; T1264-R1268 WeakPolarHBondContact O-CG 3.32Å; T1264-R1268 PolarHBondContact O-N 3.5Å
1265R59.7Low57.4Low197 Ų197118 Ų11874%0.74353%0.534SS*.Hα-helixtrans-65.4-43.5172.6-81.7-179.5179.5-167.81.5112H1261 Q1262 R1263 Q1269H1261-R1265 WeakPolarHBondContact O-CB 3.15Å; H1261-R1265 VanDerWaalsContact O-CG 3.3Å; H1261-R1265 WeakPolarHBondContact O-CG 3.47Å; H1261-R1265 PolarHBondContact O-N 2.79Å; Q1262-R1265 PolarHBondContact O-N 3.34Å; R1263-R1265 VanDerWaalsContact C-N 3.34Å; R1263-R1265 PolarHBondContact O-N 2.91Å; R1265-Q1269 WeakPolarHBondContact O-CB 3.39Å; R1265-Q1269 PolarHBondContact O-N 2.95Å; R1265-Q1269 VanDerWaalsContact O-N 3.09Å
1266R59Low59.4Low165 Ų165113.9 Ų113.962%0.62350%0.503SS*.Hα-helixtrans-61.5-49.7173.8-74-179.3-178.6-168.51.2111.1Q1262 R1263 R1268 Q1269 V1270Q1262-R1266 WeakPolarHBondContact O-CG 3.24Å; Q1262-R1266 PolarHBondContact O-N 2.86Å; R1263-R1266 PolarHBondContact O-N 3.36Å; R1263-R1266 VanDerWaalsContact O-N 3.16Å; R1266-R1268 PolarHBondContact O-N 2.95Å; R1266-Q1269 CarbonylContact O-C 3.55Å; R1266-Q1269 WeakPolarHBondContact O-CA 3.47Å; R1266-Q1269 WeakPolarHBondContact O-CB 3.22Å; R1266-Q1269 PolarHBondContact O-N 3.44Å; R1266-V1270 WeakPolarHBondContact O-CG2 3.39Å; R1266-V1270 PolarHBondContact O-N 2.89Å
1267Y62.4Low61.3Low131 Ų131109.1 Ų109.151%0.51447%0.471SS..Hα-helixtrans-57.3-49.4176.7-175.8-92.5000112.2R1263 Q1269 V1270 E1271R1263-Y1267 WeakPolarHBondContact O-CB 3.48Å; R1263-Y1267 PolarHBondContact O-N 3.33Å; Y1267-Q1269 PolarHBondContact O-N 3.04Å; Y1267-Q1269 VanDerWaalsContact O-N 3.1Å; Y1267-V1270 PolarHBondContact O-N 3.4Å; Y1267-E1271 WeakPolarHBondContact O-CB 3.49Å; Y1267-E1271 PolarHBondContact O-N 2.82Å
1268R65.3Low63.3Low167 Ų16798.5 Ų98.563%0.6343%0.431SS*.Hα-helixtrans-64.5-11.1173.3-72179.6-177.4-172.11.7114.1T1264 R1266 R1272T1264-R1268 HydrophobicContact CG2-CG 4.41Å; T1264-R1268 VanDerWaalsContact O-CB 3.29Å; T1264-R1268 WeakPolarHBondContact O-CB 3.39Å; T1264-R1268 VanDerWaalsContact O-CG 3.26Å; T1264-R1268 WeakPolarHBondContact O-CG 3.32Å; T1264-R1268 PolarHBondContact O-N 3.5Å; R1266-R1268 PolarHBondContact O-N 2.95Å; R1268-R1272 PolarHBondContact O-NE 2.87Å; R1268-R1272 PolarHBondContact O-NH2 2.75Å
1269Q67.2Low65.2Low87 Ų8793.3 Ų93.341%0.40739%0.394SS..Hα-helixtrans-93.4-46.6171.8-176.9178.5-10.100110.6R1265 R1266 Y1267 E1271 R1272 H1273R1265-Q1269 WeakPolarHBondContact O-CB 3.39Å; R1265-Q1269 PolarHBondContact O-N 2.95Å; R1265-Q1269 VanDerWaalsContact O-N 3.09Å; R1266-Q1269 CarbonylContact O-C 3.55Å; R1266-Q1269 WeakPolarHBondContact O-CA 3.47Å; R1266-Q1269 WeakPolarHBondContact O-CB 3.22Å; R1266-Q1269 PolarHBondContact O-N 3.44Å; Y1267-Q1269 PolarHBondContact O-N 3.04Å; Y1267-Q1269 VanDerWaalsContact O-N 3.1Å; Q1269-E1271 VanDerWaalsContact C-N 3.33Å; Q1269-E1271 PolarHBondContact O-N 3.16Å; Q1269-R1272 PolarHBondContact O-N 3.28Å; Q1269-H1273 PolarHBondContact NE2-NE2 3.12Å; Q1269-H1273 PolarHBondContact O-CD2 2.92Å; Q1269-H1273 PolarHBondContact O-N 2.96Å
1270V65.9Low67.3Low56 Ų5682.9 Ų82.934%0.33936%0.355SS..Hα-helixtrans-56.6-46.6173.4173.70000110.6M1243 R1266 Y1267 R1272 H1273 R1274M1243-V1270 HydrophobicContact SD-CG1 3.74Å; R1266-V1270 WeakPolarHBondContact O-CG2 3.39Å; R1266-V1270 PolarHBondContact O-N 2.89Å; Y1267-V1270 PolarHBondContact O-N 3.4Å; V1270-R1272 VanDerWaalsContact C-N 3.32Å; V1270-R1272 PolarHBondContact O-N 3.03Å; V1270-H1273 CarbonylContact O-C 3.49Å; V1270-H1273 WeakPolarHBondContact O-CA 3.44Å; V1270-H1273 WeakPolarHBondContact O-CB 3.41Å; V1270-H1273 PolarHBondContact O-N 3.31Å; V1270-H1273 VanDerWaalsContact O-N 3.09Å; V1270-R1274 WeakPolarHBondContact O-CB 3.31Å; V1270-R1274 PolarHBondContact O-N 3.04Å
1271E69.2Low68.6Low36 Ų3680.5 Ų80.517%0.16834%0.341CS..Hα-helixtrans-65.3-33.9178.8-173.558.3-164.600112.4Y1267 Q1269 R1274 Q1275Y1267-E1271 WeakPolarHBondContact O-CB 3.49Å; Y1267-E1271 PolarHBondContact O-N 2.82Å; Q1269-E1271 VanDerWaalsContact C-N 3.33Å; Q1269-E1271 PolarHBondContact O-N 3.16Å; E1271-R1274 WeakPolarHBondContact O-CB 3.39Å; E1271-R1274 PolarHBondContact O-N 3.17Å; E1271-R1274 IonicContact OE1-CZ 2.65Å; E1271-R1274 IonicContact OE1-NE 2.75Å; E1271-R1274 PolarHBondContact OE1-NE 2.92Å; E1271-R1274 IonicContact OE1-NH2 3.48Å; E1271-R1274 PolarHBondContact OE1-NH2 3.47Å; E1271-R1274 IonicContact OE2-CZ 3.94Å; E1271-R1274 VanDerWaalsContact OE2-CZ 3.3Å; E1271-R1274 IonicContact OE2-NE 3.53Å; E1271-R1274 PolarHBondContact OE2-NE 2.96Å; E1271-R1274 IonicContact OE2-NH2 3.91Å; E1271-R1274 PolarHBondContact OE2-NH2 3.18Å; E1271-R1274 VanDerWaalsContact OE2-NH2 3.13Å; E1271-Q1275 HydrophobicContact CG-CG 4.46Å; E1271-Q1275 WeakPolarHBondContact O-CB 3.27Å; E1271-Q1275 VanDerWaalsContact O-CG 3.28Å; E1271-Q1275 WeakPolarHBondContact O-CG 3.3Å; E1271-Q1275 PolarHBondContact O-N 3.47Å; E1271-Q1275 PolarHBondContact OE1-NE2 3.33Å
1272R69.1Low70.2Confident132 Ų13272.8 Ų72.850%0.49831%0.305SS..Hα-helixtrans-70.8-34.9171.4-82.9-175.3-70.9162.30.5112.7R1268 Q1269 V1270 R1274 H1276R1268-R1272 PolarHBondContact O-NE 2.87Å; R1268-R1272 PolarHBondContact O-NH2 2.75Å; Q1269-R1272 PolarHBondContact O-N 3.28Å; V1270-R1272 VanDerWaalsContact C-N 3.32Å; V1270-R1272 PolarHBondContact O-N 3.03Å; R1272-R1274 VanDerWaalsContact C-N 3.32Å; R1272-H1276 WeakPolarHBondContact O-CB 3.36Å; R1272-H1276 PolarHBondContact O-CD2 2.86Å; R1272-H1276 VanDerWaalsContact O-CG 3.28Å; R1272-H1276 PolarHBondContact O-N 2.95Å
1273H70.4Confident71.7Confident22 Ų2266.2 Ų66.210%0.10227%0.274CS..Hα-helixtrans-62.5-42168.8-68.5-68.6000111R1185 Q1269 V1270 G1277 W1281R1185-H1273 PolarHBondContact NH2-ND1 3.47Å; Q1269-H1273 PolarHBondContact NE2-NE2 3.12Å; Q1269-H1273 PolarHBondContact O-CD2 2.92Å; Q1269-H1273 PolarHBondContact O-N 2.96Å; V1270-H1273 CarbonylContact O-C 3.49Å; V1270-H1273 WeakPolarHBondContact O-CA 3.44Å; V1270-H1273 WeakPolarHBondContact O-CB 3.41Å; V1270-H1273 PolarHBondContact O-N 3.31Å; V1270-H1273 VanDerWaalsContact O-N 3.09Å; H1273-G1277 PolarHBondContact O-N 3.37Å; H1273-W1281 AromaticContact CE1-CD1 3.16Å; H1273-W1281 AromaticContact CE1-CG 3.73Å; H1273-W1281 AromaticContact CE1-NE1 3.55Å; H1273-W1281 AromaticContact ND1-CD1 3.58Å; H1273-W1281 AromaticContact ND1-CG 3.76Å
1274R66.9Low73.1Confident102 Ų10262.5 Ų62.539%0.38526%0.264SS..Hα-helixtrans-65.2-37.7178-159.6176.272.8124.43.4112.5V1238 G1239 M1243 V1270 E1271 R1272V1238-R1274 WeakPolarHBondContact CG1-O 3.48Å; G1239-R1274 WeakPolarHBondContact CA-O 3.31Å; G1239-R1274 PolarHBondContact N-O 2.91Å; M1243-R1274 HydrophobicContact CG-CB 4.21Å; M1243-R1274 HydrophobicContact CG-CG 4.22Å; M1243-R1274 HydrophobicContact SD-CB 4.07Å; M1243-R1274 HydrophobicContact SD-CG 3.93Å; V1270-R1274 WeakPolarHBondContact O-CB 3.31Å; V1270-R1274 PolarHBondContact O-N 3.04Å; E1271-R1274 WeakPolarHBondContact O-CB 3.39Å; E1271-R1274 PolarHBondContact O-N 3.17Å; E1271-R1274 IonicContact OE1-CZ 2.65Å; E1271-R1274 IonicContact OE1-NE 2.75Å; E1271-R1274 PolarHBondContact OE1-NE 2.92Å; E1271-R1274 IonicContact OE1-NH2 3.48Å; E1271-R1274 PolarHBondContact OE1-NH2 3.47Å; E1271-R1274 IonicContact OE2-CZ 3.94Å; E1271-R1274 VanDerWaalsContact OE2-CZ 3.3Å; E1271-R1274 IonicContact OE2-NE 3.53Å; E1271-R1274 PolarHBondContact OE2-NE 2.96Å; E1271-R1274 IonicContact OE2-NH2 3.91Å; E1271-R1274 PolarHBondContact OE2-NH2 3.18Å; E1271-R1274 VanDerWaalsContact OE2-NH2 3.13Å; R1272-R1274 VanDerWaalsContact C-N 3.32Å
1275Q72.5Confident73.9Confident74 Ų7461.7 Ų61.735%0.34627%0.267SS..Hα-helixtrans-88.5-15.7-178.9-68.5-179.612.600115E1271E1271-Q1275 HydrophobicContact CG-CG 4.46Å; E1271-Q1275 WeakPolarHBondContact O-CB 3.27Å; E1271-Q1275 VanDerWaalsContact O-CG 3.28Å; E1271-Q1275 WeakPolarHBondContact O-CG 3.3Å; E1271-Q1275 PolarHBondContact O-N 3.47Å; E1271-Q1275 PolarHBondContact OE1-NE2 3.33Å
1276H77.8Confident75Confident16 Ų1657.7 Ų57.77%0.07425%0.251CS..Hα-helixtrans-1332.5-169.3-46.3-44.7000115.5R1272 G1280 L1340 L1343R1272-H1276 WeakPolarHBondContact O-CB 3.36Å; R1272-H1276 PolarHBondContact O-CD2 2.86Å; R1272-H1276 VanDerWaalsContact O-CG 3.28Å; R1272-H1276 PolarHBondContact O-N 2.95Å; H1276-G1280 WeakPolarHBondContact O-CA 3.3Å; H1276-G1280 PolarHBondContact O-N 3.25Å; H1276-L1340 HydrophobicContact CB-CD1 4.42Å; H1276-L1343 HydrophobicContact CB-CD2 3.8Å
1277G82.2Confident76.3Confident0 Ų049.9 Ų49.90%022%0.222CC..THydrogen-bonded Turntrans68.5-145.8166.800000115.6R1185 V1237 H1273R1185-G1277 PolarHBondContact NH2-O 2.87Å; V1237-G1277 WeakPolarHBondContact O-CA 3.37Å; H1273-G1277 PolarHBondContact O-N 3.37Å
1278L83.6Confident77.4Confident8 Ų843.7 Ų43.74%0.04220%0.198CC..THydrogen-bonded Turntrans-78.2-51.2168.9-177.567.2000111.1I1184 R1185 C1188 V1230 M1234 W1281 L1282I1184-L1278 HydrophobicContact CG2-CD1 4.28Å; I1184-L1278 HydrophobicContact CG2-CD2 3.88Å; R1185-L1278 HydrophobicContact CG-CD1 3.63Å; C1188-L1278 HydrophobicContact CB-CD1 4.34Å; C1188-L1278 HydrophobicContact CB-CD2 4.43Å; V1230-L1278 HydrophobicContact CG1-CD2 3.91Å; M1234-L1278 HydrophobicContact CB-CB 4.15Å; M1234-L1278 HydrophobicContact CB-CD2 3.55Å; M1234-L1278 HydrophobicContact CB-CG 4.5Å; M1234-L1278 HydrophobicContact CG-CD2 4.23Å; L1278-W1281 HydrophobicContact CD1-CE3 3.88Å; L1278-W1281 HydrophobicContact CD1-CZ3 3.92Å; L1278-W1281 PolarHBondContact O-N 2.95Å; L1278-L1282 PolarHBondContact O-N 3.38Å
1279L84.5Confident78.2Confident4 Ų438.7 Ų38.72%0.02119%0.187CC..Hα-helixtrans-59.6-51.7-171.1175.459.7000112.9L1231 A1235 W1281 L1282 L1283 I1320 L1344L1231-L1279 HydrophobicContact CD2-CD1 4.3Å; A1235-L1279 HydrophobicContact CB-CB 4.46Å; A1235-L1279 HydrophobicContact CB-CD2 4.04Å; L1279-W1281 VanDerWaalsContact C-N 3.34Å; L1279-W1281 PolarHBondContact O-N 3.17Å; L1279-L1282 PolarHBondContact O-N 3.08Å; L1279-L1283 HydrophobicContact CD1-CD1 4.08Å; L1279-L1283 HydrophobicContact CD1-CG 4.47Å; L1279-L1283 HydrophobicContact CG-CD1 4.36Å; L1279-L1283 PolarHBondContact O-N 3.03Å; L1279-I1320 HydrophobicContact CD1-CG2 3.56Å; L1279-L1344 HydrophobicContact CD2-CD1 3.84Å; L1279-L1344 HydrophobicContact CG-CD1 4.43Å
1280G82.9Confident79Confident0 Ų036.1 Ų36.10%017%0.174CC..Hα-helixtrans-72.5-26.6-178.700000113.6H1276 T1284H1276-G1280 WeakPolarHBondContact O-CA 3.3Å; H1276-G1280 PolarHBondContact O-N 3.25Å; G1280-T1284 PolarHBondContact O-N 3.49Å; G1280-T1284 PolarHBondContact O-OG1 3.2Å
1281W85.2Confident79.9Confident22 Ų2233.4 Ų33.48%0.08316%0.157CC..Hα-helixtrans-66.2-43.2167.716470.5000111.9R1185 L1189 H1273 L1278 L1279 G1285 R1286R1185-W1281 HydrophobicContact CB-CH2 3.58Å; R1185-W1281 HydrophobicContact CB-CZ2 4.29Å; R1185-W1281 HydrophobicContact CB-CZ3 3.75Å; R1185-W1281 HydrophobicContact CG-CD2 4.4Å; R1185-W1281 HydrophobicContact CG-CE3 3.85Å; R1185-W1281 HydrophobicContact CG-CH2 3.82Å; R1185-W1281 HydrophobicContact CG-CZ2 4.39Å; R1185-W1281 HydrophobicContact CG-CZ3 3.54Å; L1189-W1281 HydrophobicContact CD1-CH2 3.64Å; L1189-W1281 HydrophobicContact CD1-CZ2 4.05Å; L1189-W1281 HydrophobicContact CD2-CH2 4.43Å; L1189-W1281 HydrophobicContact CG-CH2 3.78Å; H1273-W1281 AromaticContact CE1-CD1 3.16Å; H1273-W1281 AromaticContact CE1-CG 3.73Å; H1273-W1281 AromaticContact CE1-NE1 3.55Å; H1273-W1281 AromaticContact ND1-CD1 3.58Å; H1273-W1281 AromaticContact ND1-CG 3.76Å; L1278-W1281 HydrophobicContact CD1-CE3 3.88Å; L1278-W1281 HydrophobicContact CD1-CZ3 3.92Å; L1278-W1281 PolarHBondContact O-N 2.95Å; L1279-W1281 VanDerWaalsContact C-N 3.34Å; L1279-W1281 PolarHBondContact O-N 3.17Å; W1281-G1285 CarbonylContact O-C 3.56Å; W1281-G1285 WeakPolarHBondContact O-CA 3.28Å; W1281-G1285 PolarHBondContact O-N 2.98Å; W1281-R1286 HydrophobicContact CH2-CG 4.36Å; W1281-R1286 HydrophobicContact CZ2-CG 3.83Å; W1281-R1286 PolarHBondContact O-N 2.86Å
1282L86Confident80.4Confident0 Ų033.2 Ų33.20%016%0.159CC..Hα-helixtrans-62.8-49.5179.8-173.569.4000110.5L1189 V1192 L1231 L1278 L1279 R1286 L1287 I1320L1189-L1282 HydrophobicContact CD2-CD1 4.26Å; V1192-L1282 HydrophobicContact CG2-CD1 4.28Å; V1192-L1282 HydrophobicContact CG2-CD2 4.24Å; L1231-L1282 HydrophobicContact CD2-CD2 4.07Å; L1278-L1282 PolarHBondContact O-N 3.38Å; L1279-L1282 PolarHBondContact O-N 3.08Å; L1282-R1286 WeakPolarHBondContact O-CB 3.43Å; L1282-R1286 PolarHBondContact O-N 3.05Å; L1282-L1287 HydrophobicContact CD1-CD1 4.49Å; L1282-L1287 HydrophobicContact CD1-CG 4.44Å; L1282-L1287 HydrophobicContact CD2-CD1 4.14Å; L1282-L1287 HydrophobicContact CG-CD1 3.78Å; L1282-L1287 HydrophobicContact CG-CG 4.15Å; L1282-L1287 WeakPolarHBondContact O-CG 3.43Å; L1282-L1287 PolarHBondContact O-N 3.33Å; L1282-I1320 HydrophobicContact CD2-CD1 4.08Å
1283L85.3Confident80.9Confident2 Ų233.8 Ų33.81%0.0117%0.165CC..Iπ-helixtrans-61.7-62177.5-70.7171.3000112.1L1279 L1287 I1288 I1317 I1320 I1321 L1344 A1347L1279-L1283 HydrophobicContact CD1-CD1 4.08Å; L1279-L1283 HydrophobicContact CD1-CG 4.47Å; L1279-L1283 HydrophobicContact CG-CD1 4.36Å; L1279-L1283 PolarHBondContact O-N 3.03Å; L1283-L1287 HydrophobicContact CD2-CD1 4.39Å; L1283-L1287 PolarHBondContact O-N 3.38Å; L1283-I1288 HydrophobicContact CB-CD1 4.37Å; L1283-I1288 WeakPolarHBondContact O-CB 3.31Å; L1283-I1288 WeakPolarHBondContact O-CG1 3.49Å; L1283-I1288 PolarHBondContact O-N 2.88Å; L1283-I1317 HydrophobicContact CD2-CG2 4.03Å; L1283-I1320 HydrophobicContact CD1-CG2 4.49Å; L1283-I1320 HydrophobicContact CD2-CB 4.32Å; L1283-I1320 HydrophobicContact CD2-CG2 3.82Å; L1283-I1320 HydrophobicContact CG-CG2 4.14Å; L1283-I1321 HydrophobicContact CD1-CG1 4.06Å; L1283-I1321 HydrophobicContact CD2-CD1 4.29Å; L1283-I1321 HydrophobicContact CD2-CG1 3.73Å; L1283-L1344 HydrophobicContact CD1-CD1 4.31Å; L1283-A1347 HydrophobicContact CD1-CB 4.49Å
1284T80Confident81.2Confident36 Ų3633.1 Ų33.122%0.22116%0.163CC..Iπ-helixtrans-90.6-19.9-167.368.70000114.6G1280 P1289 L1343G1280-T1284 PolarHBondContact O-N 3.49Å; G1280-T1284 PolarHBondContact O-OG1 3.2Å; T1284-P1289 WeakPolarHBondContact O-CG 3.49Å; T1284-L1343 HydrophobicContact CG2-CD1 3.95Å; T1284-L1343 HydrophobicContact CG2-CD2 3.81Å; T1284-L1343 HydrophobicContact CG2-CG 3.83Å
1285G76.9Confident81.6Confident38 Ų3829.8 Ų29.839%0.39215%0.152SC..Iπ-helixtrans-99.5-12.3-179.900000114.6W1281W1281-G1285 CarbonylContact O-C 3.56Å; W1281-G1285 WeakPolarHBondContact O-CA 3.28Å; W1281-G1285 PolarHBondContact O-N 2.98Å
1286R82.6Confident81.7Confident113 Ų11333.9 Ų33.943%0.42617%0.169SC..Iπ-helixtrans-136-66.7-177.9-65.5-70.2-170.9146.42.4112.8L1189 W1281 L1282 W1290L1189-R1286 HydrophobicContact CD2-CB 4.28Å; L1189-R1286 HydrophobicContact CD2-CG 4.01Å; W1281-R1286 HydrophobicContact CH2-CG 4.36Å; W1281-R1286 HydrophobicContact CZ2-CG 3.83Å; W1281-R1286 PolarHBondContact O-N 2.86Å; L1282-R1286 WeakPolarHBondContact O-CB 3.43Å; L1282-R1286 PolarHBondContact O-N 3.05Å; R1286-W1290 VanDerWaalsContact O-CB 3.27Å; R1286-W1290 WeakPolarHBondContact O-CB 3.43Å; R1286-W1290 PolarHBondContact O-N 2.95Å
1287L87.1Confident81.3Confident1 Ų137.5 Ų37.51%0.00519%0.187CC..Iπ-helixtrans-68.5-55.1-167-67.6175000114V1192 L1282 L1283 W1290 L1291 L1313 I1317 I1320V1192-L1287 HydrophobicContact CG1-CD2 3.68Å; L1282-L1287 HydrophobicContact CD1-CD1 4.49Å; L1282-L1287 HydrophobicContact CD1-CG 4.44Å; L1282-L1287 HydrophobicContact CD2-CD1 4.14Å; L1282-L1287 HydrophobicContact CG-CD1 3.78Å; L1282-L1287 HydrophobicContact CG-CG 4.15Å; L1282-L1287 WeakPolarHBondContact O-CG 3.43Å; L1282-L1287 PolarHBondContact O-N 3.33Å; L1283-L1287 HydrophobicContact CD2-CD1 4.39Å; L1283-L1287 PolarHBondContact O-N 3.38Å; L1287-W1290 HydrophobicContact CD2-CE3 4.33Å; L1287-W1290 WeakPolarHBondContact O-CB 3.31Å; L1287-W1290 PolarHBondContact O-N 3.38Å; L1287-W1290 VanDerWaalsContact O-N 3.08Å; L1287-L1291 PolarHBondContact O-N 2.83Å; L1287-L1313 HydrophobicContact CD2-CD1 3.84Å; L1287-I1317 HydrophobicContact CB-CD1 3.87Å; L1287-I1317 HydrophobicContact CB-CG1 3.74Å; L1287-I1317 HydrophobicContact CD1-CG1 4.07Å; L1287-I1317 HydrophobicContact CG-CG1 4.35Å; L1287-I1320 HydrophobicContact CD1-CD1 3.66Å
1288I84.3Confident80.2Confident1 Ų146.3 Ų46.31%0.00523%0.225CC..Hα-helixtrans-64-41.5-179-63.3170.5000111.3L1283 W1290 T1292 I1317 A1347 Q1350 I1354L1283-I1288 HydrophobicContact CB-CD1 4.37Å; L1283-I1288 WeakPolarHBondContact O-CB 3.31Å; L1283-I1288 WeakPolarHBondContact O-CG1 3.49Å; L1283-I1288 PolarHBondContact O-N 2.88Å; I1288-W1290 VanDerWaalsContact C-N 3.31Å; I1288-W1290 PolarHBondContact O-N 3.49Å; I1288-T1292 VanDerWaalsContact O-CB 3.31Å; I1288-T1292 WeakPolarHBondContact O-CB 3.28Å; I1288-T1292 PolarHBondContact O-N 3.07Å; I1288-T1292 PolarHBondContact O-OG1 2.97Å; I1288-I1317 HydrophobicContact CG1-CG2 4.14Å; I1288-A1347 HydrophobicContact CD1-CB 3.76Å; I1288-Q1350 HydrophobicContact CG2-CG 4.23Å; I1288-I1354 HydrophobicContact CG2-CD1 3.6Å
1289P83.4Confident79.1Confident62 Ų6251.5 Ų51.540%0.40325%0.253SS..Hα-helixtrans-58.7-36.3169.5-27.135.4000114.5T1284 K1293T1284-P1289 WeakPolarHBondContact O-CG 3.49Å; P1289-K1293 PolarHBondContact O-N 2.79Å
1290W83.3Confident78Confident33 Ų3351.6 Ų51.613%0.12525%0.253CS..Hα-helixtrans-68.4-50178.3-175.39.7000111.3V1192 D1193 L1196 R1200 M1211 R1286 L1287 I1288 T1292 K1293 C1294 L1309 L1313V1192-W1290 HydrophobicContact CG1-CZ3 4.23Å; D1193-W1290 WeakPolarHBondContact OD1-CH2 3.35Å; L1196-W1290 HydrophobicContact CD1-CE3 4.48Å; L1196-W1290 HydrophobicContact CD1-CH2 3.59Å; L1196-W1290 HydrophobicContact CD1-CZ3 3.53Å; R1200-W1290 VanDerWaalsContact NH2-CZ3 3.28Å; M1211-W1290 HydrophobicContact CE-CZ2 3.74Å; M1211-W1290 HydrophobicContact SD-CZ2 3.73Å; R1286-W1290 VanDerWaalsContact O-CB 3.27Å; R1286-W1290 WeakPolarHBondContact O-CB 3.43Å; R1286-W1290 PolarHBondContact O-N 2.95Å; L1287-W1290 HydrophobicContact CD2-CE3 4.33Å; L1287-W1290 WeakPolarHBondContact O-CB 3.31Å; L1287-W1290 PolarHBondContact O-N 3.38Å; L1287-W1290 VanDerWaalsContact O-N 3.08Å; I1288-W1290 VanDerWaalsContact C-N 3.31Å; I1288-W1290 PolarHBondContact O-N 3.49Å; W1290-T1292 VanDerWaalsContact C-N 3.26Å; W1290-T1292 PolarHBondContact O-N 3.25Å; W1290-K1293 WeakPolarHBondContact O-CA 3.45Å; W1290-K1293 WeakPolarHBondContact O-CB 3.27Å; W1290-K1293 PolarHBondContact O-N 3.11Å; W1290-C1294 PolarHBondContact O-N 3.17Å; W1290-C1294 PolarHBondContact O-SG 3.1Å; W1290-C1294 VanDerWaalsContact O-SG 3.39Å; W1290-L1309 HydrophobicContact CZ2-CD1 4.43Å; W1290-L1313 HydrophobicContact CB-CD2 4.44Å; W1290-L1313 HydrophobicContact CD2-CD2 4.11Å; W1290-L1313 HydrophobicContact CE3-CD1 4.07Å; W1290-L1313 HydrophobicContact CE3-CD2 4.42Å; W1290-L1313 HydrophobicContact CG-CD2 4.1Å; W1290-L1313 HydrophobicContact CZ3-CD1 4.4Å
1291L83.8Confident76.9Confident0 Ų056.5 Ų56.50%029%0.288CS..Hα-helixtrans-56.1-43.3173.4-178.365.6000111.2L1287 K1293 C1294 L1295 I1310 L1313 I1317 L1351 I1354L1287-L1291 PolarHBondContact O-N 2.83Å; L1291-K1293 VanDerWaalsContact C-N 3.28Å; L1291-K1293 PolarHBondContact O-N 3.11Å; L1291-C1294 PolarHBondContact O-N 3.28Å; L1291-L1295 HydrophobicContact CD1-CD1 4.02Å; L1291-L1295 HydrophobicContact CD1-CG 4.35Å; L1291-L1295 HydrophobicContact CG-CD1 3.91Å; L1291-L1295 WeakPolarHBondContact O-CB 3.41Å; L1291-L1295 WeakPolarHBondContact O-CG 3.46Å; L1291-L1295 PolarHBondContact O-N 2.86Å; L1291-I1310 HydrophobicContact CD1-CG2 4Å; L1291-L1313 HydrophobicContact CB-CD2 3.84Å; L1291-L1313 HydrophobicContact CB-CG 4.27Å; L1291-L1313 HydrophobicContact CD1-CD2 4.13Å; L1291-L1313 HydrophobicContact CD1-CG 4.33Å; L1291-I1317 HydrophobicContact CB-CD1 4.06Å; L1291-I1317 HydrophobicContact CD2-CD1 4.01Å; L1291-L1351 HydrophobicContact CD2-CD1 3.4Å; L1291-I1354 HydrophobicContact CD2-CG2 4.33Å
1292T80.9Confident75.8Confident32 Ų3260 Ų6020%0.19632%0.315CS..Hα-helixtrans-64.1-28175.7-54.60000113.1I1288 W1290 K1296 I1354I1288-T1292 VanDerWaalsContact O-CB 3.31Å; I1288-T1292 WeakPolarHBondContact O-CB 3.28Å; I1288-T1292 PolarHBondContact O-N 3.07Å; I1288-T1292 PolarHBondContact O-OG1 2.97Å; W1290-T1292 VanDerWaalsContact C-N 3.26Å; W1290-T1292 PolarHBondContact O-N 3.25Å; T1292-K1296 HydrophobicContact CG2-CD 4.35Å; T1292-K1296 VanDerWaalsContact O-CD 3.31Å; T1292-K1296 WeakPolarHBondContact O-CD 3.3Å; T1292-K1296 VanDerWaalsContact O-CG 3.23Å; T1292-K1296 WeakPolarHBondContact O-CG 3.46Å; T1292-I1354 WeakPolarHBondContact OG1-CD1 3.32Å
1293K79.8Confident75Confident143 Ų14362.7 Ų62.762%0.62233%0.33SS*.Hα-helixtrans-76.4-46.8173.9-171-174.4178.4-171.90110.6P1289 W1290 L1291 K1296 M1297P1289-K1293 PolarHBondContact O-N 2.79Å; W1290-K1293 WeakPolarHBondContact O-CA 3.45Å; W1290-K1293 WeakPolarHBondContact O-CB 3.27Å; W1290-K1293 PolarHBondContact O-N 3.11Å; L1291-K1293 VanDerWaalsContact C-N 3.28Å; L1291-K1293 PolarHBondContact O-N 3.11Å; K1293-K1296 PolarHBondContact O-N 3.49Å; K1293-K1296 VanDerWaalsContact O-N 3.1Å; K1293-M1297 PolarHBondContact O-N 2.97Å
1294C77Confident74.3Confident9 Ų967.2 Ų67.26%0.06135%0.354CS..Hα-helixtrans-58.7-50.2179.3-64.50000111.2W1290 L1291 K1296 M1297 L1300 I1310W1290-C1294 PolarHBondContact O-N 3.17Å; W1290-C1294 PolarHBondContact O-SG 3.1Å; W1290-C1294 VanDerWaalsContact O-SG 3.39Å; L1291-C1294 PolarHBondContact O-N 3.28Å; C1294-K1296 PolarHBondContact O-N 3.39Å; C1294-M1297 PolarHBondContact O-N 2.67Å; C1294-M1297 VanDerWaalsContact O-N 3.11Å; C1294-L1300 VanDerWaalsContact O-CD1 3.25Å; C1294-L1300 WeakPolarHBondContact O-CD1 3.47Å; C1294-I1310 HydrophobicContact CB-CD1 3.81Å; C1294-I1310 HydrophobicContact CB-CG1 3.68Å
1295L75Confident73.8Confident31 Ų3169.8 Ų69.816%0.16237%0.367CS..THydrogen-bonded Turntrans-65.6-0.6176.5-69.7169000115.2L1291 I1310 I1354L1291-L1295 HydrophobicContact CD1-CD1 4.02Å; L1291-L1295 HydrophobicContact CD1-CG 4.35Å; L1291-L1295 HydrophobicContact CG-CD1 3.91Å; L1291-L1295 WeakPolarHBondContact O-CB 3.41Å; L1291-L1295 WeakPolarHBondContact O-CG 3.46Å; L1291-L1295 PolarHBondContact O-N 2.86Å; L1295-I1310 HydrophobicContact CD2-CD1 4.17Å; L1295-I1310 HydrophobicContact CD2-CG2 3.98Å; L1295-I1310 HydrophobicContact CG-CD1 4.48Å; L1295-I1310 HydrophobicContact CG-CG2 4.45Å; L1295-I1354 HydrophobicContact CD1-CG2 3.41Å; L1295-I1354 VanDerWaalsContact CD1-CG2 3.41Å
1296K73.8Confident73.6Confident161 Ų16169.5 Ų69.570%0.736%0.356SS*.THydrogen-bonded Turntrans-110.7-2175.9-74.7179.6-175.8179.90114T1292 K1293 C1294T1292-K1296 HydrophobicContact CG2-CD 4.35Å; T1292-K1296 VanDerWaalsContact O-CD 3.31Å; T1292-K1296 WeakPolarHBondContact O-CD 3.3Å; T1292-K1296 VanDerWaalsContact O-CG 3.23Å; T1292-K1296 WeakPolarHBondContact O-CG 3.46Å; K1293-K1296 PolarHBondContact O-N 3.49Å; K1293-K1296 VanDerWaalsContact O-N 3.1Å; C1294-K1296 PolarHBondContact O-N 3.39Å
1297M69.9Low73.1Confident92 Ų9265 Ų6545%0.45334%0.34SS..  trans-66.3143.6171-69.2174.6148.100109.8K1293 C1294 L1300 I1306K1293-M1297 PolarHBondContact O-N 2.97Å; C1294-M1297 PolarHBondContact O-N 2.67Å; C1294-M1297 VanDerWaalsContact O-N 3.11Å; M1297-L1300 HydrophobicContact CB-CD1 3.92Å; M1297-I1306 HydrophobicContact SD-CD1 4.21Å
1298K58.4Low72.5Confident185 Ų18567.1 Ų67.180%0.80436%0.355SS*.SBendtrans-72.9-43.8-175.1-70.5178.1179.7172.90111.9L1300K1298-L1300 VanDerWaalsContact C-N 3.3Å; K1298-L1300 PolarHBondContact O-N 3.44Å
1299D61.2Low72.2Confident117 Ų11767.3 Ų67.363%0.62636%0.356SS*.  trans-100.148.3-164.2-43-64.3000110.2S1302D1299-S1302 PolarHBondContact O-OG 3.17Å; D1299-S1302 VanDerWaalsContact O-OG 3.08Å
1300L61Low71.9Confident5 Ų564.5 Ų64.53%0.02634%0.338CS..  trans-78.7-34.1-171.6-146.581.3000112.9C1294 M1297 K1298 S1302 N1303 I1306 L1307 I1310 I1363C1294-L1300 VanDerWaalsContact O-CD1 3.25Å; C1294-L1300 WeakPolarHBondContact O-CD1 3.47Å; M1297-L1300 HydrophobicContact CB-CD1 3.92Å; K1298-L1300 VanDerWaalsContact C-N 3.3Å; K1298-L1300 PolarHBondContact O-N 3.44Å; L1300-S1302 PolarHBondContact O-N 2.82Å; L1300-N1303 PolarHBondContact O-N 3.34Å; L1300-I1306 HydrophobicContact CD1-CG2 3.58Å; L1300-I1306 HydrophobicContact CG-CG2 4.39Å; L1300-L1307 HydrophobicContact CD2-CD2 3.99Å; L1300-L1307 HydrophobicContact CG-CD2 3.99Å; L1300-I1310 HydrophobicContact CD1-CD1 3.98Å; L1300-I1310 HydrophobicContact CD2-CD1 3.73Å; L1300-I1310 HydrophobicContact CG-CD1 4.23Å; L1300-I1363 HydrophobicContact CD2-CD1 3.65Å; L1300-I1363 HydrophobicContact CD2-CG1 4.35Å; L1300-I1363 HydrophobicContact CD2-CG2 4.07Å
1301S60.2Low71.5Confident104 Ų10464.3 Ų64.373%0.72734%0.341SS*.THydrogen-bonded Turntrans-71.1-12.3-178.749.90000114.2
1302S62Low71.3Confident94 Ų9465.5 Ų65.566%0.65735%0.346SS*.THydrogen-bonded Turntrans-101.3-2.9178.249.70000114D1299 L1300D1299-S1302 PolarHBondContact O-OG 3.17Å; D1299-S1302 VanDerWaalsContact O-OG 3.08Å; L1300-S1302 PolarHBondContact O-N 2.82Å
1303N69.7Low71.4Confident57 Ų5764 Ų6431%0.30534%0.336SS..  trans-125.789.7-173.4-167.5-46000112.4L1300 D1305 I1306 L1307L1300-N1303 PolarHBondContact O-N 3.34Å; N1303-D1305 PolarHBondContact O-N 2.93Å; N1303-D1305 PolarHBondContact OD1-N 3.1Å; N1303-I1306 HydrophobicContact CB-CB 4.25Å; N1303-I1306 HydrophobicContact CB-CD1 4.08Å; N1303-I1306 HydrophobicContact CB-CG1 4.31Å; N1303-I1306 PolarHBondContact O-N 3Å; N1303-I1306 WeakPolarHBondContact OD1-CG1 3.21Å; N1303-I1306 PolarHBondContact OD1-N 2.82Å; N1303-L1307 WeakPolarHBondContact O-CG 3.49Å; N1303-L1307 PolarHBondContact O-N 3.37Å
1304N70.5Confident71.5Confident97 Ų9757.2 Ų57.252%0.51931%0.307SS..Hα-helixtrans-57.8-32.5179.6-69.4-13.3000113.4L1307 S1308N1304-L1307 PolarHBondContact O-N 3.17Å; N1304-S1308 VanDerWaalsContact O-CB 3.29Å; N1304-S1308 WeakPolarHBondContact O-CB 3.23Å; N1304-S1308 PolarHBondContact O-N 2.79Å
1305D68.9Low71.7Confident91 Ų9157.3 Ų57.349%0.48731%0.308SS..Hα-helixtrans-69-38.5179.3-59.2-49.7000111.5I1213 N1303 S1308 L1309I1213-D1305 HydrophobicContact CB-CB 4.46Å; I1213-D1305 HydrophobicContact CD1-CB 3.96Å; I1213-D1305 HydrophobicContact CG2-CB 4.33Å; N1303-D1305 PolarHBondContact O-N 2.93Å; N1303-D1305 PolarHBondContact OD1-N 3.1Å; D1305-S1308 PolarHBondContact O-N 3.3Å; D1305-L1309 WeakPolarHBondContact O-CB 3.49Å; D1305-L1309 PolarHBondContact O-N 2.9Å
1306I72.6Confident72.2Confident32 Ų3255.9 Ų55.916%0.16430%0.3CS..Hα-helixtrans-69.7-37.7173.2-65.3174000111I1213 M1297 L1300 N1303 L1309 I1310I1213-I1306 HydrophobicContact CD1-CG1 4.36Å; M1297-I1306 HydrophobicContact SD-CD1 4.21Å; L1300-I1306 HydrophobicContact CD1-CG2 3.58Å; L1300-I1306 HydrophobicContact CG-CG2 4.39Å; N1303-I1306 HydrophobicContact CB-CB 4.25Å; N1303-I1306 HydrophobicContact CB-CD1 4.08Å; N1303-I1306 HydrophobicContact CB-CG1 4.31Å; N1303-I1306 PolarHBondContact O-N 3Å; N1303-I1306 WeakPolarHBondContact OD1-CG1 3.21Å; N1303-I1306 PolarHBondContact OD1-N 2.82Å; I1306-L1309 PolarHBondContact O-N 3.34Å; I1306-I1310 HydrophobicContact CG2-CD1 3.89Å; I1306-I1310 HydrophobicContact CG2-CG1 4.43Å; I1306-I1310 WeakPolarHBondContact O-CB 3.48Å; I1306-I1310 VanDerWaalsContact O-CG1 3.25Å; I1306-I1310 WeakPolarHBondContact O-CG1 3.38Å; I1306-I1310 PolarHBondContact O-N 2.9Å
1307L72.4Confident72.8Confident17 Ų1748.2 Ų48.29%0.08927%0.267CS..Hα-helixtrans-63.5-44.5173.9-62.6173.3000111.1L1300 N1303 N1304 I1310 S1311 I1363 L1368L1300-L1307 HydrophobicContact CD2-CD2 3.99Å; L1300-L1307 HydrophobicContact CG-CD2 3.99Å; N1303-L1307 WeakPolarHBondContact O-CG 3.49Å; N1303-L1307 PolarHBondContact O-N 3.37Å; N1304-L1307 PolarHBondContact O-N 3.17Å; L1307-I1310 PolarHBondContact O-N 2.87Å; L1307-S1311 PolarHBondContact O-N 3.45Å; L1307-I1363 HydrophobicContact CD2-CG2 3.91Å; L1307-L1368 HydrophobicContact CB-CD1 4.46Å; L1307-L1368 HydrophobicContact CD2-CD1 3.65Å
1308S73.4Confident73.3Confident47 Ų4743.8 Ų43.833%0.32925%0.245SC..Hα-helixtrans-59.7-45.9172.6175.20000112.1N1304 D1305 I1310 S1311 R1312N1304-S1308 VanDerWaalsContact O-CB 3.29Å; N1304-S1308 WeakPolarHBondContact O-CB 3.23Å; N1304-S1308 PolarHBondContact O-N 2.79Å; D1305-S1308 PolarHBondContact O-N 3.3Å; S1308-I1310 PolarHBondContact O-N 2.98Å; S1308-S1311 WeakPolarHBondContact O-CB 3.28Å; S1308-S1311 PolarHBondContact O-N 2.83Å; S1308-R1312 VanDerWaalsContact O-CG 3.3Å; S1308-R1312 WeakPolarHBondContact O-CG 3.27Å; S1308-R1312 PolarHBondContact O-N 3.39Å; S1308-R1312 PolarHBondContact O-NE 3.39Å; S1308-R1312 PolarHBondContact OG-NE 3.19Å; S1308-R1312 VanDerWaalsContact OG-NE 3.15Å; S1308-R1312 PolarHBondContact OG-NH2 3.48Å
1309L78Confident74.4Confident4 Ų435 Ų352%0.02121%0.207CC..Hα-helixtrans-58.3-45.6174.1170.673.9000111.8V1198 M1211 I1213 W1290 D1305 I1306 S1311 R1312 L1313V1198-L1309 HydrophobicContact CG2-CD1 3.76Å; M1211-L1309 HydrophobicContact CE-CD1 3.56Å; M1211-L1309 HydrophobicContact CE-CD2 3.33Å; M1211-L1309 HydrophobicContact CE-CG 4.04Å; M1211-L1309 HydrophobicContact SD-CD2 4.48Å; I1213-L1309 HydrophobicContact CD1-CB 4.13Å; I1213-L1309 HydrophobicContact CD1-CD2 4.18Å; W1290-L1309 HydrophobicContact CZ2-CD1 4.43Å; D1305-L1309 WeakPolarHBondContact O-CB 3.49Å; D1305-L1309 PolarHBondContact O-N 2.9Å; I1306-L1309 PolarHBondContact O-N 3.34Å; L1309-S1311 VanDerWaalsContact C-N 3.3Å; L1309-S1311 PolarHBondContact O-N 3.09Å; L1309-R1312 PolarHBondContact O-N 2.87Å; L1309-L1313 WeakPolarHBondContact O-CB 3.38Å; L1309-L1313 PolarHBondContact O-N 2.93Å
1310I78.2Confident75.6Confident3 Ų329.5 Ų29.52%0.01518%0.178CC..Hα-helixtrans-63.6-38.6179.7-73.8167.6000110.7L1291 C1294 L1295 L1300 I1306 L1307 S1308 S1314 L1368L1291-I1310 HydrophobicContact CD1-CG2 4Å; C1294-I1310 HydrophobicContact CB-CD1 3.81Å; C1294-I1310 HydrophobicContact CB-CG1 3.68Å; L1295-I1310 HydrophobicContact CD2-CD1 4.17Å; L1295-I1310 HydrophobicContact CD2-CG2 3.98Å; L1295-I1310 HydrophobicContact CG-CD1 4.48Å; L1295-I1310 HydrophobicContact CG-CG2 4.45Å; L1300-I1310 HydrophobicContact CD1-CD1 3.98Å; L1300-I1310 HydrophobicContact CD2-CD1 3.73Å; L1300-I1310 HydrophobicContact CG-CD1 4.23Å; I1306-I1310 HydrophobicContact CG2-CD1 3.89Å; I1306-I1310 HydrophobicContact CG2-CG1 4.43Å; I1306-I1310 WeakPolarHBondContact O-CB 3.48Å; I1306-I1310 VanDerWaalsContact O-CG1 3.25Å; I1306-I1310 WeakPolarHBondContact O-CG1 3.38Å; I1306-I1310 PolarHBondContact O-N 2.9Å; L1307-I1310 PolarHBondContact O-N 2.87Å; S1308-I1310 PolarHBondContact O-N 2.98Å; I1310-S1314 VanDerWaalsContact O-CB 3.29Å; I1310-S1314 WeakPolarHBondContact O-CB 3.39Å; I1310-S1314 PolarHBondContact O-N 2.99Å; I1310-S1314 PolarHBondContact O-OG 3.02Å; I1310-L1368 HydrophobicContact CB-CD2 4.38Å; I1310-L1368 HydrophobicContact CG2-CD1 4.05Å; I1310-L1368 HydrophobicContact CG2-CD2 3.87Å
1311S75.1Confident76.7Confident29 Ų2929.2 Ų29.220%0.20318%0.176CC..Hα-helixtrans-59-59.8172.2169.50000111L1307 S1308 L1309 L1313 S1314 C1315 T1371L1307-S1311 PolarHBondContact O-N 3.45Å; S1308-S1311 WeakPolarHBondContact O-CB 3.28Å; S1308-S1311 PolarHBondContact O-N 2.83Å; L1309-S1311 VanDerWaalsContact C-N 3.3Å; L1309-S1311 PolarHBondContact O-N 3.09Å; S1311-L1313 VanDerWaalsContact C-N 3.31Å; S1311-L1313 PolarHBondContact O-N 2.84Å; S1311-S1314 PolarHBondContact O-N 2.78Å; S1311-S1314 VanDerWaalsContact O-N 3.07Å; S1311-C1315 PolarHBondContact O-N 2.98Å; S1311-T1371 PolarHBondContact OG-OG1 3.02Å
1312R78.5Confident77.7Confident25 Ų2526 Ų269%0.09415%0.151CC..Hα-helixtrans-54-45.2179.3-66.4-175.9-97.5-179.9-16.4112.4L1196 L1214 S1308 L1309 C1315 L1316 Y1414L1196-R1312 HydrophobicContact CD2-CB 3.85Å; L1196-R1312 PolarHBondContact O-NH1 3.48Å; L1214-R1312 PolarHBondContact O-NH1 3.08Å; S1308-R1312 VanDerWaalsContact O-CG 3.3Å; S1308-R1312 WeakPolarHBondContact O-CG 3.27Å; S1308-R1312 PolarHBondContact O-N 3.39Å; S1308-R1312 PolarHBondContact O-NE 3.39Å; S1308-R1312 PolarHBondContact OG-NE 3.19Å; S1308-R1312 VanDerWaalsContact OG-NE 3.15Å; S1308-R1312 PolarHBondContact OG-NH2 3.48Å; L1309-R1312 PolarHBondContact O-N 2.87Å; R1312-C1315 PolarHBondContact O-N 2.92Å; R1312-L1316 WeakPolarHBondContact O-CB 3.3Å; R1312-L1316 PolarHBondContact O-N 2.73Å; R1312-Y1414 WeakPolarHBondContact CG-OH 3.5Å
1313L83.8Confident78.5Confident0 Ų021.6 Ų21.60%012%0.12CC..Hα-helixtrans-66.6-37.9179-178.460.3000112.4L1196 L1287 W1290 L1291 L1309 S1311 I1317L1196-L1313 HydrophobicContact CD1-CD1 3.88Å; L1196-L1313 HydrophobicContact CD2-CB 4.17Å; L1196-L1313 HydrophobicContact CD2-CD1 4.49Å; L1287-L1313 HydrophobicContact CD2-CD1 3.84Å; W1290-L1313 HydrophobicContact CB-CD2 4.44Å; W1290-L1313 HydrophobicContact CD2-CD2 4.11Å; W1290-L1313 HydrophobicContact CE3-CD1 4.07Å; W1290-L1313 HydrophobicContact CE3-CD2 4.42Å; W1290-L1313 HydrophobicContact CG-CD2 4.1Å; W1290-L1313 HydrophobicContact CZ3-CD1 4.4Å; L1291-L1313 HydrophobicContact CB-CD2 3.84Å; L1291-L1313 HydrophobicContact CB-CG 4.27Å; L1291-L1313 HydrophobicContact CD1-CD2 4.13Å; L1291-L1313 HydrophobicContact CD1-CG 4.33Å; L1309-L1313 WeakPolarHBondContact O-CB 3.38Å; L1309-L1313 PolarHBondContact O-N 2.93Å; S1311-L1313 VanDerWaalsContact C-N 3.31Å; S1311-L1313 PolarHBondContact O-N 2.84Å; L1313-I1317 HydrophobicContact CD1-CD1 3.86Å; L1313-I1317 HydrophobicContact CD1-CG1 4.15Å; L1313-I1317 HydrophobicContact CG-CD1 3.89Å; L1313-I1317 WeakPolarHBondContact O-CB 3.43Å; L1313-I1317 WeakPolarHBondContact O-CD1 3.37Å; L1313-I1317 WeakPolarHBondContact O-CG1 3.48Å; L1313-I1317 PolarHBondContact O-N 3.49Å
1314S82.9Confident79Confident2 Ų219 Ų191%0.01411%0.106CC..Hα-helixtrans-68.1-43176.9-590000111.6I1310 S1311 T1318I1310-S1314 VanDerWaalsContact O-CB 3.29Å; I1310-S1314 WeakPolarHBondContact O-CB 3.39Å; I1310-S1314 PolarHBondContact O-N 2.99Å; I1310-S1314 PolarHBondContact O-OG 3.02Å; S1311-S1314 PolarHBondContact O-N 2.78Å; S1311-S1314 VanDerWaalsContact O-N 3.07Å; S1314-T1318 WeakPolarHBondContact O-CB 3.17Å; S1314-T1318 PolarHBondContact O-N 2.71Å; S1314-T1318 PolarHBondContact O-OG1 3.17Å
1315C80.4Confident79.5Confident11 Ų1116.3 Ų16.37%0.07410%0.095CC..Hα-helixtrans-60.9-50172.8-720000111.5S1311 R1312 I1317 T1318 D1319 T1371 Y1414S1311-C1315 PolarHBondContact O-N 2.98Å; R1312-C1315 PolarHBondContact O-N 2.92Å; C1315-I1317 PolarHBondContact O-N 2.67Å; C1315-T1318 CarbonylContact O-C 3.57Å; C1315-T1318 WeakPolarHBondContact O-CB 3.45Å; C1315-T1318 PolarHBondContact O-N 3.09Å; C1315-T1318 VanDerWaalsContact O-N 3.14Å; C1315-D1319 PolarHBondContact O-N 3.46Å; C1315-T1371 VanDerWaalsContact SG-CG2 3.59Å; C1315-Y1414 HydrophobicContact CB-CD2 3.91Å; C1315-Y1414 HydrophobicContact CB-CE2 3.81Å
1316L84.7Confident79.7Confident0 Ų015.4 Ų15.40%09%0.087CC..Hα-helixtrans-63.7-37.6-178.6-175.262.5000112.9V1192 C1195 L1196 L1227 R1312 D1319 I1320 Y1414V1192-L1316 HydrophobicContact CG1-CD2 4.31Å; V1192-L1316 HydrophobicContact CG2-CD2 4.37Å; C1195-L1316 HydrophobicContact CB-CD1 4.41Å; C1195-L1316 HydrophobicContact CB-CD2 3.99Å; L1196-L1316 HydrophobicContact CD1-CD2 4.18Å; L1196-L1316 HydrophobicContact CD2-CB 4.17Å; L1196-L1316 HydrophobicContact CD2-CD2 3.75Å; L1196-L1316 HydrophobicContact CG-CD2 3.74Å; L1227-L1316 HydrophobicContact CD2-CD1 4.1Å; R1312-L1316 WeakPolarHBondContact O-CB 3.3Å; R1312-L1316 PolarHBondContact O-N 2.73Å; L1316-D1319 PolarHBondContact O-N 2.86Å; L1316-I1320 HydrophobicContact CD1-CD1 4.17Å; L1316-I1320 HydrophobicContact CD1-CG1 4.45Å; L1316-I1320 HydrophobicContact CG-CD1 3.97Å; L1316-I1320 WeakPolarHBondContact O-CD1 3.32Å; L1316-I1320 VanDerWaalsContact O-CG1 3.23Å; L1316-I1320 WeakPolarHBondContact O-CG1 3.33Å; L1316-I1320 PolarHBondContact O-N 3.17Å; L1316-Y1414 HydrophobicContact CB-CD2 4.45Å
1317I86.4Confident79.7Confident0 Ų013.9 Ų13.90%08%0.08CC..Hα-helixtrans-66.6-43.9173.6-64.9165.8000110.4L1283 L1287 I1288 L1291 L1313 C1315 D1319 I1320 I1321 L1351L1283-I1317 HydrophobicContact CD2-CG2 4.03Å; L1287-I1317 HydrophobicContact CB-CD1 3.87Å; L1287-I1317 HydrophobicContact CB-CG1 3.74Å; L1287-I1317 HydrophobicContact CD1-CG1 4.07Å; L1287-I1317 HydrophobicContact CG-CG1 4.35Å; I1288-I1317 HydrophobicContact CG1-CG2 4.14Å; L1291-I1317 HydrophobicContact CB-CD1 4.06Å; L1291-I1317 HydrophobicContact CD2-CD1 4.01Å; L1313-I1317 HydrophobicContact CD1-CD1 3.86Å; L1313-I1317 HydrophobicContact CD1-CG1 4.15Å; L1313-I1317 HydrophobicContact CG-CD1 3.89Å; L1313-I1317 WeakPolarHBondContact O-CB 3.43Å; L1313-I1317 WeakPolarHBondContact O-CD1 3.37Å; L1313-I1317 WeakPolarHBondContact O-CG1 3.48Å; L1313-I1317 PolarHBondContact O-N 3.49Å; C1315-I1317 PolarHBondContact O-N 2.67Å; I1317-D1319 VanDerWaalsContact C-N 3.3Å; I1317-D1319 PolarHBondContact O-N 3.25Å; I1317-I1320 PolarHBondContact O-N 2.78Å; I1317-I1321 HydrophobicContact CG2-CD1 3.73Å; I1317-I1321 HydrophobicContact CG2-CG1 4.34Å; I1317-I1321 WeakPolarHBondContact O-CB 3.34Å; I1317-I1321 VanDerWaalsContact O-CG1 3.29Å; I1317-I1321 WeakPolarHBondContact O-CG1 3.24Å; I1317-I1321 PolarHBondContact O-N 2.85Å; I1317-L1351 HydrophobicContact CB-CD2 4.25Å; I1317-L1351 HydrophobicContact CG2-CD2 3.79Å
1318T82.2Confident79.8Confident0 Ų014.1 Ų14.10%08%0.08CC..Hα-helixtrans-57.7-44.6176-60.60000110.9S1314 C1315 I1321 I1322 L1351 R1378 L1379S1314-T1318 WeakPolarHBondContact O-CB 3.17Å; S1314-T1318 PolarHBondContact O-N 2.71Å; S1314-T1318 PolarHBondContact O-OG1 3.17Å; C1315-T1318 CarbonylContact O-C 3.57Å; C1315-T1318 WeakPolarHBondContact O-CB 3.45Å; C1315-T1318 PolarHBondContact O-N 3.09Å; C1315-T1318 VanDerWaalsContact O-N 3.14Å; T1318-I1321 PolarHBondContact O-N 2.83Å; T1318-I1322 HydrophobicContact CG2-CD1 3.57Å; T1318-I1322 HydrophobicContact CG2-CG1 4.45Å; T1318-I1322 WeakPolarHBondContact O-CB 3.19Å; T1318-I1322 WeakPolarHBondContact O-CD1 3.29Å; T1318-I1322 VanDerWaalsContact O-CG1 3.25Å; T1318-I1322 WeakPolarHBondContact O-CG1 3.5Å; T1318-I1322 PolarHBondContact O-N 3.37Å; T1318-L1351 WeakPolarHBondContact OG1-CD2 3.33Å; T1318-R1378 HydrophobicContact CG2-CB 4.04Å; T1318-L1379 HydrophobicContact CG2-CD1 4.27Å; T1318-L1379 HydrophobicContact CG2-CD2 4.13Å; T1318-L1379 HydrophobicContact CG2-CG 3.93Å
1319D81.4Confident79.7Confident0 Ų020.2 Ų20.20%010%0.1CC..Hα-helixtrans-62.4-45.6175.5-74.7-40.1000113.2C1315 L1316 I1317 I1321 I1322 Y1323 R1378 S1413 Y1414 L1415C1315-D1319 PolarHBondContact O-N 3.46Å; L1316-D1319 PolarHBondContact O-N 2.86Å; I1317-D1319 VanDerWaalsContact C-N 3.3Å; I1317-D1319 PolarHBondContact O-N 3.25Å; D1319-I1321 VanDerWaalsContact C-N 3.3Å; D1319-I1321 PolarHBondContact O-N 3.33Å; D1319-I1322 PolarHBondContact O-N 2.85Å; D1319-Y1323 WeakPolarHBondContact O-CB 3.12Å; D1319-Y1323 PolarHBondContact O-N 3.34Å; D1319-R1378 IonicContact OD1-CZ 2.73Å; D1319-R1378 IonicContact OD1-NH1 3.24Å; D1319-R1378 PolarHBondContact OD1-NH1 3.41Å; D1319-R1378 IonicContact OD1-NH2 3.64Å; D1319-R1378 PolarHBondContact OD1-NH2 3.18Å; D1319-S1413 VanDerWaalsContact OD1-CB 3.3Å; D1319-S1413 WeakPolarHBondContact OD1-CB 3.47Å; D1319-S1413 PolarHBondContact OD1-OG 2.93Å; D1319-S1413 WeakPolarHBondContact OD2-CA 3.47Å; D1319-S1413 PolarHBondContact OD2-OG 2.71Å; D1319-Y1414 PolarHBondContact OD2-N 3.09Å; D1319-L1415 HydrophobicContact CB-CB 4.19Å; D1319-L1415 HydrophobicContact CB-CD1 3.93Å; D1319-L1415 HydrophobicContact CB-CG 3.88Å
1320I85.4Confident79Confident1 Ų122.5 Ų22.51%0.00512%0.115CC..Hα-helixtrans-66.5-35.1179.4-68166.9000111L1231 L1279 L1282 L1283 L1287 L1316 I1317 G1324 L1415L1231-I1320 HydrophobicContact CD1-CD1 4.46Å; L1231-I1320 HydrophobicContact CD1-CG1 3.91Å; L1231-I1320 HydrophobicContact CD1-CG2 4.28Å; L1279-I1320 HydrophobicContact CD1-CG2 3.56Å; L1282-I1320 HydrophobicContact CD2-CD1 4.08Å; L1283-I1320 HydrophobicContact CD1-CG2 4.49Å; L1283-I1320 HydrophobicContact CD2-CB 4.32Å; L1283-I1320 HydrophobicContact CD2-CG2 3.82Å; L1283-I1320 HydrophobicContact CG-CG2 4.14Å; L1287-I1320 HydrophobicContact CD1-CD1 3.66Å; L1316-I1320 HydrophobicContact CD1-CD1 4.17Å; L1316-I1320 HydrophobicContact CD1-CG1 4.45Å; L1316-I1320 HydrophobicContact CG-CD1 3.97Å; L1316-I1320 WeakPolarHBondContact O-CD1 3.32Å; L1316-I1320 VanDerWaalsContact O-CG1 3.23Å; L1316-I1320 WeakPolarHBondContact O-CG1 3.33Å; L1316-I1320 PolarHBondContact O-N 3.17Å; I1317-I1320 PolarHBondContact O-N 2.78Å; I1320-G1324 PolarHBondContact O-N 3.41Å; I1320-L1415 HydrophobicContact CG1-CD1 4.25Å
1321I84.7Confident78.4Confident0 Ų022.3 Ų22.30%011%0.114CC..Hα-helixtrans-66.7-50.8173.9-71.7172.6000110.3L1283 I1317 T1318 D1319 Y1323 G1324 S1325 L1344 A1347 L1351 L1379 F1382L1283-I1321 HydrophobicContact CD1-CG1 4.06Å; L1283-I1321 HydrophobicContact CD2-CD1 4.29Å; L1283-I1321 HydrophobicContact CD2-CG1 3.73Å; I1317-I1321 HydrophobicContact CG2-CD1 3.73Å; I1317-I1321 HydrophobicContact CG2-CG1 4.34Å; I1317-I1321 WeakPolarHBondContact O-CB 3.34Å; I1317-I1321 VanDerWaalsContact O-CG1 3.29Å; I1317-I1321 WeakPolarHBondContact O-CG1 3.24Å; I1317-I1321 PolarHBondContact O-N 2.85Å; T1318-I1321 PolarHBondContact O-N 2.83Å; D1319-I1321 VanDerWaalsContact C-N 3.3Å; D1319-I1321 PolarHBondContact O-N 3.33Å; I1321-Y1323 PolarHBondContact O-N 3.01Å; I1321-G1324 PolarHBondContact O-N 2.94Å; I1321-S1325 PolarHBondContact O-N 3.3Å; I1321-S1325 PolarHBondContact O-OG 3.23Å; I1321-L1344 HydrophobicContact CG2-CD2 4.19Å; I1321-A1347 HydrophobicContact CD1-CB 4.2Å; I1321-L1351 HydrophobicContact CD1-CD2 4.17Å; I1321-L1379 HydrophobicContact CG2-CD2 4.01Å; I1321-F1382 HydrophobicContact CG2-CE1 3.79Å; I1321-F1382 HydrophobicContact CG2-CE2 3.91Å; I1321-F1382 HydrophobicContact CG2-CZ 3.27Å
1322I80.2Confident77.8Confident36 Ų3627.3 Ų27.319%0.18514%0.138CC..Hα-helixtrans-64.3-40.5179.2-67.9164.6000111.3T1318 D1319 S1325 H1326 R1378 L1379 W1416T1318-I1322 HydrophobicContact CG2-CD1 3.57Å; T1318-I1322 HydrophobicContact CG2-CG1 4.45Å; T1318-I1322 WeakPolarHBondContact O-CB 3.19Å; T1318-I1322 WeakPolarHBondContact O-CD1 3.29Å; T1318-I1322 VanDerWaalsContact O-CG1 3.25Å; T1318-I1322 WeakPolarHBondContact O-CG1 3.5Å; T1318-I1322 PolarHBondContact O-N 3.37Å; D1319-I1322 PolarHBondContact O-N 2.85Å; I1322-S1325 WeakPolarHBondContact O-CB 3.47Å; I1322-S1325 PolarHBondContact O-N 3.39Å; I1322-H1326 WeakPolarHBondContact O-CB 3.47Å; I1322-H1326 PolarHBondContact O-N 3.26Å; I1322-R1378 HydrophobicContact CD1-CB 3.74Å; I1322-R1378 WeakPolarHBondContact CD1-O 3.47Å; I1322-L1379 HydrophobicContact CG1-CD2 4.44Å; I1322-W1416 HydrophobicContact CG2-CH2 4.11Å; I1322-W1416 HydrophobicContact CG2-CZ3 4.07Å
1323Y79Confident77.3Confident2 Ų227.5 Ų27.51%0.00814%0.143CC..Hα-helixtrans-64.8-43.2176.5-164-109.3000111.5H1056 R1228 L1231 S1232 D1319 I1321 H1326 L1327 L1415 W1416H1056-Y1323 AromaticContact CE1-CE1 3.75Å; H1056-Y1323 AromaticContact CE1-CE2 3.24Å; H1056-Y1323 WeakPolarHBondContact CE1-CE2 3.42Å; H1056-Y1323 AromaticContact CE1-CZ 2.84Å; H1056-Y1323 PolarHBondContact CE1-OH 3.03Å; H1056-Y1323 AromaticContact ND1-CE2 3.69Å; H1056-Y1323 AromaticContact ND1-CZ 3.59Å; H1056-Y1323 PolarHBondContact ND1-OH 3.28Å; H1056-Y1323 VanDerWaalsContact ND1-OH 3.08Å; H1056-Y1323 AromaticContact NE2-CD2 3.88Å; H1056-Y1323 AromaticContact NE2-CE2 3.32Å; H1056-Y1323 VanDerWaalsContact NE2-CE2 3.32Å; H1056-Y1323 WeakPolarHBondContact NE2-CE2 3.48Å; H1056-Y1323 AromaticContact NE2-CZ 3.94Å; R1228-Y1323 HydrophobicContact CG-CE1 4.03Å; R1228-Y1323 HydrophobicContact CG-CE2 4.05Å; R1228-Y1323 WeakPolarHBondContact CG-OH 3.47Å; L1231-Y1323 HydrophobicContact CB-CD1 4.47Å; S1232-Y1323 WeakPolarHBondContact OG-CE1 3.41Å; S1232-Y1323 PolarHBondContact OG-OH 3.48Å; D1319-Y1323 WeakPolarHBondContact O-CB 3.12Å; D1319-Y1323 PolarHBondContact O-N 3.34Å; I1321-Y1323 PolarHBondContact O-N 3.01Å; Y1323-H1326 PolarHBondContact O-N 3.3Å; Y1323-L1327 HydrophobicContact CD1-CD1 3.78Å; Y1323-L1327 HydrophobicContact CD1-CG 4.19Å; Y1323-L1327 HydrophobicContact CE1-CD1 3.6Å; Y1323-L1327 HydrophobicContact CE1-CD2 4.22Å; Y1323-L1327 HydrophobicContact CE1-CG 3.94Å; Y1323-L1327 WeakPolarHBondContact O-CB 3.49Å; Y1323-L1327 WeakPolarHBondContact O-CG 3.24Å; Y1323-L1327 PolarHBondContact O-N 2.84Å; Y1323-L1415 HydrophobicContact CG-CD1 4.19Å; Y1323-W1416 AromaticContact CD2-CH2 3.56Å; Y1323-W1416 HydrophobicContact CD2-CH2 3.56Å; Y1323-W1416 AromaticContact CD2-CZ2 3.92Å; Y1323-W1416 HydrophobicContact CD2-CZ2 3.92Å; Y1323-W1416 HydrophobicContact CD2-CZ3 4.03Å; Y1323-W1416 HydrophobicContact CE2-CH2 4.41Å; Y1323-W1416 HydrophobicContact CE2-CZ2 4.34Å; Y1323-W1416 HydrophobicContact CG-CH2 4.43Å
1324G81Confident76.3Confident1 Ų129.9 Ų29.91%0.0117%0.168CC..Hα-helixtrans-61.6-43172.400000112.8I1320 I1321 H1326 L1327 F1328I1320-G1324 PolarHBondContact O-N 3.41Å; I1321-G1324 PolarHBondContact O-N 2.94Å; G1324-H1326 VanDerWaalsContact C-N 3.34Å; G1324-H1326 PolarHBondContact O-N 2.64Å; G1324-L1327 PolarHBondContact O-N 3.19Å; G1324-F1328 VanDerWaalsContact O-CD2 3.28Å; G1324-F1328 WeakPolarHBondContact O-CD2 3.49Å; G1324-F1328 PolarHBondContact O-N 3.27Å
1325S79.9Confident75.5Confident42 Ų4238.6 Ų38.629%0.29421%0.205SC..Hα-helixtrans-59.4-42.5172.2-660000112.5I1321 I1322 F1328 K1329 L1344 F1382I1321-S1325 PolarHBondContact O-N 3.3Å; I1321-S1325 PolarHBondContact O-OG 3.23Å; I1322-S1325 WeakPolarHBondContact O-CB 3.47Å; I1322-S1325 PolarHBondContact O-N 3.39Å; S1325-F1328 WeakPolarHBondContact O-CB 3.35Å; S1325-F1328 PolarHBondContact O-N 3.42Å; S1325-K1329 PolarHBondContact O-N 3.36Å; S1325-L1344 WeakPolarHBondContact OG-CD2 3.42Å; S1325-F1382 WeakPolarHBondContact OG-CZ 3.27Å
1326H74.6Confident74.8Confident71 Ų7145 Ų4533%0.32923%0.234SC..Hα-helixtrans-66.2-44.5178.5-166.6-56.9000111.3H1056 I1322 Y1323 G1324 F1328 K1329 T1330H1056-H1326 AromaticContact NE2-CD2 3.9Å; H1056-H1326 AromaticContact NE2-CE1 3.37Å; H1056-H1326 PolarHBondContact NE2-CE1 2.93Å; H1056-H1326 AromaticContact NE2-CG 3.16Å; H1056-H1326 AromaticContact NE2-ND1 2.78Å; H1056-H1326 PolarHBondContact NE2-ND1 3.32Å; I1322-H1326 WeakPolarHBondContact O-CB 3.47Å; I1322-H1326 PolarHBondContact O-N 3.26Å; Y1323-H1326 PolarHBondContact O-N 3.3Å; G1324-H1326 VanDerWaalsContact C-N 3.34Å; G1324-H1326 PolarHBondContact O-N 2.64Å; H1326-F1328 VanDerWaalsContact C-N 3.29Å; H1326-F1328 PolarHBondContact O-N 3.31Å; H1326-K1329 WeakPolarHBondContact O-CB 3.38Å; H1326-K1329 PolarHBondContact O-N 2.92Å; H1326-K1329 VanDerWaalsContact O-N 3.08Å; H1326-T1330 VanDerWaalsContact CE1-CG2 3.49Å; H1326-T1330 WeakPolarHBondContact CE1-CG2 3.45Å; H1326-T1330 PolarHBondContact O-N 2.88Å; H1326-T1330 PolarHBondContact O-OG1 2.99Å
1327L72.6Confident74.3Confident1 Ų145.3 Ų45.31%0.00524%0.236CC..Hα-helixtrans-59.8-39.4173.2-72.3174000111.4H1056 A1235 F1236 Y1323 G1324 K1329 T1330 N1331H1056-L1327 WeakPolarHBondContact CE1-CD2 3.47Å; H1056-L1327 WeakPolarHBondContact ND1-CD2 3.42Å; A1235-L1327 HydrophobicContact CB-CD1 3.96Å; F1236-L1327 HydrophobicContact CE2-CB 3.9Å; F1236-L1327 HydrophobicContact CZ-CB 3.68Å; Y1323-L1327 HydrophobicContact CD1-CD1 3.78Å; Y1323-L1327 HydrophobicContact CD1-CG 4.19Å; Y1323-L1327 HydrophobicContact CE1-CD1 3.6Å; Y1323-L1327 HydrophobicContact CE1-CD2 4.22Å; Y1323-L1327 HydrophobicContact CE1-CG 3.94Å; Y1323-L1327 WeakPolarHBondContact O-CB 3.49Å; Y1323-L1327 WeakPolarHBondContact O-CG 3.24Å; Y1323-L1327 PolarHBondContact O-N 2.84Å; G1324-L1327 PolarHBondContact O-N 3.19Å; L1327-K1329 VanDerWaalsContact C-N 3.31Å; L1327-K1329 PolarHBondContact O-N 3.46Å; L1327-T1330 PolarHBondContact O-OG1 3.27Å; L1327-N1331 VanDerWaalsContact O-CB 3.27Å; L1327-N1331 WeakPolarHBondContact O-CB 3.5Å; L1327-N1331 PolarHBondContact O-N 3.25Å; L1327-N1331 VanDerWaalsContact O-N 3.08Å; L1327-N1331 PolarHBondContact O-ND2 2.99Å
1328F74.6Confident73.7Confident22 Ų2250 Ų5010%0.09626%0.261CS..Hα-helixtrans-63.2-36.1173.8-94.4-69000112.3F1236 G1324 S1325 H1326 P1333 C1337 L1340 K1341F1236-F1328 HydrophobicContact CD1-CE1 4.45Å; F1236-F1328 HydrophobicContact CD1-CZ 4.39Å; F1236-F1328 AromaticContact CE1-CD1 3.95Å; F1236-F1328 HydrophobicContact CE1-CD1 3.95Å; F1236-F1328 HydrophobicContact CE1-CD2 4.07Å; F1236-F1328 AromaticContact CE1-CE1 3.83Å; F1236-F1328 HydrophobicContact CE1-CE1 3.83Å; F1236-F1328 AromaticContact CE1-CE2 3.95Å; F1236-F1328 HydrophobicContact CE1-CE2 3.95Å; F1236-F1328 HydrophobicContact CE1-CG 4.06Å; F1236-F1328 AromaticContact CE1-CZ 3.82Å; F1236-F1328 HydrophobicContact CE1-CZ 3.82Å; F1236-F1328 HydrophobicContact CZ-CD1 4.48Å; F1236-F1328 HydrophobicContact CZ-CG 4.35Å; G1324-F1328 VanDerWaalsContact O-CD2 3.28Å; G1324-F1328 WeakPolarHBondContact O-CD2 3.49Å; G1324-F1328 PolarHBondContact O-N 3.27Å; S1325-F1328 WeakPolarHBondContact O-CB 3.35Å; S1325-F1328 PolarHBondContact O-N 3.42Å; H1326-F1328 VanDerWaalsContact C-N 3.29Å; H1326-F1328 PolarHBondContact O-N 3.31Å; F1328-P1333 HydrophobicContact CD1-CG 3.38Å; F1328-P1333 HydrophobicContact CE1-CG 3.49Å; F1328-P1333 VanDerWaalsContact CE1-CG 3.49Å; F1328-P1333 HydrophobicContact CG-CG 4.42Å; F1328-C1337 HydrophobicContact CE1-CB 3.94Å; F1328-C1337 HydrophobicContact CZ-CB 4.23Å; F1328-L1340 HydrophobicContact CE2-CD2 4.43Å; F1328-L1340 HydrophobicContact CE2-CG 4.06Å; F1328-L1340 HydrophobicContact CZ-CB 4.12Å; F1328-L1340 HydrophobicContact CZ-CD2 4.2Å; F1328-L1340 HydrophobicContact CZ-CG 3.91Å; F1328-K1341 HydrophobicContact CD1-CB 4.22Å; F1328-K1341 HydrophobicContact CD1-CD 4.4Å; F1328-K1341 HydrophobicContact CD1-CG 4.27Å; F1328-K1341 HydrophobicContact CE1-CB 3.68Å; F1328-K1341 HydrophobicContact CE1-CG 4.23Å; F1328-K1341 HydrophobicContact CE2-CB 4.23Å; F1328-K1341 HydrophobicContact CZ-CB 3.69Å; F1328-K1341 HydrophobicContact CZ-CG 4.45Å
1329K69.7Low73.5Confident174 Ų17452.5 Ų52.576%0.75728%0.279SS*.Hα-helixtrans-73.1-41.5178.5-176.4-176175.6-173.50112.6S1325 H1326 L1327S1325-K1329 PolarHBondContact O-N 3.36Å; H1326-K1329 WeakPolarHBondContact O-CB 3.38Å; H1326-K1329 PolarHBondContact O-N 2.92Å; H1326-K1329 VanDerWaalsContact O-N 3.08Å; L1327-K1329 VanDerWaalsContact C-N 3.31Å; L1327-K1329 PolarHBondContact O-N 3.46Å
1330T64.2Low73.4Confident52 Ų5252.5 Ų52.532%0.31928%0.279SS..Hα-helixtrans-76.2-38.8-178.949.70000112.8H1056 H1326 L1327H1056-T1330 PolarHBondContact O-OG1 2.93Å; H1326-T1330 VanDerWaalsContact CE1-CG2 3.49Å; H1326-T1330 WeakPolarHBondContact CE1-CG2 3.45Å; H1326-T1330 PolarHBondContact O-N 2.88Å; H1326-T1330 PolarHBondContact O-OG1 2.99Å; L1327-T1330 PolarHBondContact O-OG1 3.27Å
1331N64.8Low73.2Confident0 Ų058.6 Ų58.60%031%0.305CS..Hα-helixtrans-101.7-9.1-162.5-66-69.4000116.1H1056 Q1057 F1059 T1060 F1236 L1327H1056-N1331 PolarHBondContact O-ND2 2.91Å; H1056-N1331 PolarHBondContact O-OD1 2.98Å; Q1057-N1331 PolarHBondContact O-OD1 3.46Å; Q1057-N1331 VanDerWaalsContact O-OD1 3.12Å; F1059-N1331 HydrophobicContact CB-CB 3.57Å; F1059-N1331 WeakPolarHBondContact CB-OD1 3.44Å; F1059-N1331 PolarHBondContact N-OD1 3.23Å; F1059-N1331 VanDerWaalsContact N-OD1 3.15Å; T1060-N1331 WeakPolarHBondContact CG2-O 3.41Å; F1236-N1331 HydrophobicContact CE2-CB 4.15Å; L1327-N1331 VanDerWaalsContact O-CB 3.27Å; L1327-N1331 WeakPolarHBondContact O-CB 3.5Å; L1327-N1331 PolarHBondContact O-N 3.25Å; L1327-N1331 VanDerWaalsContact O-N 3.08Å; L1327-N1331 PolarHBondContact O-ND2 2.99Å
1332N64.1Low73.2Confident134 Ų13463.6 Ų63.672%0.71733%0.329SS*.  trans41.454.6-177.5-74.6-45.9000114.3
1333P66.7Low73.3Confident28 Ų2863.2 Ų63.218%0.18233%0.327CS..  trans-60.9141.5-175.628.5-37.8000111.8F1236 F1328 C1337F1236-P1333 HydrophobicContact CD1-CB 3.84Å; F1236-P1333 HydrophobicContact CD1-CG 3.89Å; F1236-P1333 HydrophobicContact CD2-CB 4.43Å; F1236-P1333 HydrophobicContact CE1-CB 4.1Å; F1236-P1333 HydrophobicContact CE1-CG 3.64Å; F1236-P1333 HydrophobicContact CG-CB 4.03Å; F1236-P1333 HydrophobicContact CG-CG 4.47Å; F1236-P1333 HydrophobicContact CZ-CB 4.47Å; F1236-P1333 HydrophobicContact CZ-CG 3.98Å; F1328-P1333 HydrophobicContact CD1-CG 3.38Å; F1328-P1333 HydrophobicContact CE1-CG 3.49Å; F1328-P1333 VanDerWaalsContact CE1-CG 3.49Å; F1328-P1333 HydrophobicContact CG-CG 4.42Å; P1333-C1337 HydrophobicContact CB-CB 4.03Å; P1333-C1337 HydrophobicContact CG-CB 4.21Å
1334G62.4Low73.6Confident51 Ų5163.4 Ų63.453%0.52633%0.328SS..  trans-61.1164-174.400000114.5Q1336 C1337G1334-Q1336 PolarHBondContact O-N 3.27Å; G1334-C1337 PolarHBondContact O-N 2.66Å
1335K66Low73.7Confident184 Ų18467.7 Ų67.780%0.835%0.347SS*.G310 helixtrans-47.9-24.7-170.2-63.2-177.6-179.8179.90116.1C1337 N1338K1335-C1337 PolarHBondContact O-N 2.99Å; K1335-N1338 VanDerWaalsContact O-CB 3.29Å; K1335-N1338 WeakPolarHBondContact O-CB 3.33Å; K1335-N1338 PolarHBondContact O-N 3.49Å; K1335-N1338 VanDerWaalsContact O-N 3.12Å
1336Q66.2Low73.9Confident145 Ų14569.3 Ų69.368%0.67835%0.352SS*.G310 helixtrans-56.5-31.7172.9-66.9171.3-14.700112.8G1334 N1338G1334-Q1336 PolarHBondContact O-N 3.27Å; Q1336-N1338 VanDerWaalsContact C-N 3.32Å; Q1336-N1338 PolarHBondContact O-N 2.86Å
1337C73.3Confident74.4Confident8 Ų866 Ų665%0.05434%0.337CS..G310 helixtrans-83.21.7178.7-70.20000114.2F1236 F1328 P1333 G1334 K1335 S1339 L1340 K1341F1236-C1337 HydrophobicContact CD1-CB 4.5Å; F1328-C1337 HydrophobicContact CE1-CB 3.94Å; F1328-C1337 HydrophobicContact CZ-CB 4.23Å; P1333-C1337 HydrophobicContact CB-CB 4.03Å; P1333-C1337 HydrophobicContact CG-CB 4.21Å; G1334-C1337 PolarHBondContact O-N 2.66Å; K1335-C1337 PolarHBondContact O-N 2.99Å; C1337-S1339 VanDerWaalsContact C-N 3.3Å; C1337-S1339 PolarHBondContact O-N 2.95Å; C1337-L1340 WeakPolarHBondContact O-CB 3.47Å; C1337-L1340 PolarHBondContact O-N 2.7Å; C1337-K1341 PolarHBondContact O-N 3.01Å
1338N74.8Confident74.9Confident97 Ų9765.9 Ų65.952%0.51934%0.336SS..Hα-helixtrans-58-41.5180-74.9-1.1000112.3K1335 Q1336 L1340 K1341 Q1342K1335-N1338 VanDerWaalsContact O-CB 3.29Å; K1335-N1338 WeakPolarHBondContact O-CB 3.33Å; K1335-N1338 PolarHBondContact O-N 3.49Å; K1335-N1338 VanDerWaalsContact O-N 3.12Å; Q1336-N1338 VanDerWaalsContact C-N 3.32Å; Q1336-N1338 PolarHBondContact O-N 2.86Å; N1338-L1340 VanDerWaalsContact C-N 3.28Å; N1338-L1340 PolarHBondContact O-N 3.38Å; N1338-K1341 PolarHBondContact O-N 3.34Å; N1338-Q1342 PolarHBondContact O-N 3.04Å
1339S77.3Confident75.4Confident54 Ų5466.1 Ų66.138%0.37834%0.339SS..Hα-helixtrans-64.4-32.1176.9-52.80000112.7C1337 L1343C1337-S1339 VanDerWaalsContact C-N 3.3Å; C1337-S1339 PolarHBondContact O-N 2.95Å; S1339-L1343 VanDerWaalsContact O-CB 3.3Å; S1339-L1343 WeakPolarHBondContact O-CB 3.43Å; S1339-L1343 PolarHBondContact O-N 3.4Å; S1339-L1343 VanDerWaalsContact O-N 3.09Å
1340L81.1Confident76Confident0 Ų062.2 Ų62.20%032%0.323CS..Hα-helixtrans-75.7-36.4174.1177.560.9000111.6A1235 V1238 H1276 F1328 C1337 N1338 L1343 L1344A1235-L1340 VanDerWaalsContact O-CD2 3.22Å; A1235-L1340 WeakPolarHBondContact O-CD2 3.46Å; V1238-L1340 HydrophobicContact CG2-CD2 4.13Å; H1276-L1340 HydrophobicContact CB-CD1 4.42Å; F1328-L1340 HydrophobicContact CE2-CD2 4.43Å; F1328-L1340 HydrophobicContact CE2-CG 4.06Å; F1328-L1340 HydrophobicContact CZ-CB 4.12Å; F1328-L1340 HydrophobicContact CZ-CD2 4.2Å; F1328-L1340 HydrophobicContact CZ-CG 3.91Å; C1337-L1340 WeakPolarHBondContact O-CB 3.47Å; C1337-L1340 PolarHBondContact O-N 2.7Å; N1338-L1340 VanDerWaalsContact C-N 3.28Å; N1338-L1340 PolarHBondContact O-N 3.38Å; L1340-L1343 HydrophobicContact CD1-CD2 4.4Å; L1340-L1343 PolarHBondContact O-N 3.17Å; L1340-L1344 WeakPolarHBondContact O-CB 3.48Å; L1340-L1344 PolarHBondContact O-N 2.97Å
1341K81.2Confident76.9Confident129 Ų12959.7 Ų59.756%0.56131%0.308SS*.Hα-helixtrans-61.9-46.1174.6-171.8178.2177.3178.10111.2F1328 C1337 N1338 L1344 F1345F1328-K1341 HydrophobicContact CD1-CB 4.22Å; F1328-K1341 HydrophobicContact CD1-CD 4.4Å; F1328-K1341 HydrophobicContact CD1-CG 4.27Å; F1328-K1341 HydrophobicContact CE1-CB 3.68Å; F1328-K1341 HydrophobicContact CE1-CG 4.23Å; F1328-K1341 HydrophobicContact CE2-CB 4.23Å; F1328-K1341 HydrophobicContact CZ-CB 3.69Å; F1328-K1341 HydrophobicContact CZ-CG 4.45Å; C1337-K1341 PolarHBondContact O-N 3.01Å; N1338-K1341 PolarHBondContact O-N 3.34Å; K1341-L1344 PolarHBondContact O-N 3.35Å; K1341-F1345 PolarHBondContact O-N 2.99Å; K1341-F1345 VanDerWaalsContact O-N 3.15Å
1342Q83.3Confident77.6Confident105 Ų10559.7 Ų59.749%0.49131%0.308SS..Hα-helixtrans-62.7-50175.4-173.160.54600110.9N1338 L1344 F1345 D1346N1338-Q1342 PolarHBondContact O-N 3.04Å; Q1342-L1344 PolarHBondContact O-N 3.08Å; Q1342-L1344 VanDerWaalsContact O-N 3.16Å; Q1342-F1345 PolarHBondContact O-N 3.06Å; Q1342-F1345 VanDerWaalsContact O-N 3.07Å; Q1342-D1346 PolarHBondContact NE2-OD1 3.3Å; Q1342-D1346 PolarHBondContact O-N 3.02Å
1343L83.3Confident78.4Confident28 Ų2857.6 Ų57.615%0.14730%0.296CS..Hα-helixtrans-55.5-35.8177.9-167.986.5000112.8H1276 T1284 S1339 L1340 A1347H1276-L1343 HydrophobicContact CB-CD2 3.8Å; T1284-L1343 HydrophobicContact CG2-CD1 3.95Å; T1284-L1343 HydrophobicContact CG2-CD2 3.81Å; T1284-L1343 HydrophobicContact CG2-CG 3.83Å; S1339-L1343 VanDerWaalsContact O-CB 3.3Å; S1339-L1343 WeakPolarHBondContact O-CB 3.43Å; S1339-L1343 PolarHBondContact O-N 3.4Å; S1339-L1343 VanDerWaalsContact O-N 3.09Å; L1340-L1343 HydrophobicContact CD1-CD2 4.4Å; L1340-L1343 PolarHBondContact O-N 3.17Å; L1343-A1347 WeakPolarHBondContact O-CB 3.46Å; L1343-A1347 PolarHBondContact O-N 2.76Å
1344L84.4Confident78.9Confident6 Ų657.7 Ų57.73%0.03130%0.295CS..Hα-helixtrans-75.1-34.9-179.8-169.3142.8000112.2L1279 L1283 I1321 S1325 L1340 K1341 Q1342 A1347 G1348 F1382L1279-L1344 HydrophobicContact CD2-CD1 3.84Å; L1279-L1344 HydrophobicContact CG-CD1 4.43Å; L1283-L1344 HydrophobicContact CD1-CD1 4.31Å; I1321-L1344 HydrophobicContact CG2-CD2 4.19Å; S1325-L1344 WeakPolarHBondContact OG-CD2 3.42Å; L1340-L1344 WeakPolarHBondContact O-CB 3.48Å; L1340-L1344 PolarHBondContact O-N 2.97Å; K1341-L1344 PolarHBondContact O-N 3.35Å; Q1342-L1344 PolarHBondContact O-N 3.08Å; Q1342-L1344 VanDerWaalsContact O-N 3.16Å; L1344-A1347 PolarHBondContact O-N 2.88Å; L1344-G1348 PolarHBondContact O-N 3.04Å; L1344-G1348 VanDerWaalsContact O-N 3.1Å; L1344-F1382 HydrophobicContact CD2-CE1 4.25Å; L1344-F1382 HydrophobicContact CD2-CZ 4.32Å
1345F83.2Confident79.5Confident91 Ų9155.9 Ų55.940%0.39927%0.273SS..Hα-helixtrans-66.5-43.4169-173.8-101.4000111.8K1341 Q1342 A1347 G1348 N1349 F1382K1341-F1345 PolarHBondContact O-N 2.99Å; K1341-F1345 VanDerWaalsContact O-N 3.15Å; Q1342-F1345 PolarHBondContact O-N 3.06Å; Q1342-F1345 VanDerWaalsContact O-N 3.07Å; F1345-A1347 VanDerWaalsContact C-N 3.31Å; F1345-A1347 PolarHBondContact O-N 3.46Å; F1345-G1348 PolarHBondContact O-N 3.08Å; F1345-N1349 WeakPolarHBondContact CD1-ND2 3.35Å; F1345-N1349 WeakPolarHBondContact CE1-ND2 3.48Å; F1345-N1349 WeakPolarHBondContact CZ-ND2 3.39Å; F1345-N1349 PolarHBondContact O-N 3.24Å; F1345-N1349 VanDerWaalsContact O-N 3.07Å; F1345-N1349 PolarHBondContact O-ND2 3.31Å; F1345-F1382 AromaticContact CD2-CD1 3.8Å; F1345-F1382 HydrophobicContact CD2-CD1 3.8Å; F1345-F1382 HydrophobicContact CD2-CE1 4.37Å; F1345-F1382 HydrophobicContact CE2-CB 4.5Å; F1345-F1382 HydrophobicContact CE2-CD1 4.32Å; F1345-F1382 WeakPolarHBondContact CE2-O 3.5Å; F1345-F1382 HydrophobicContact CG-CD1 4.46Å; F1345-F1382 VanDerWaalsContact CZ-O 3.3Å; F1345-F1382 WeakPolarHBondContact CZ-O 3.45Å
1346D83.9Confident79.7Confident75 Ų7549 Ų4940%0.40125%0.245SC..Hα-helixtrans-63.4-37.1175.2-62.6-19.8000111.3Q1342 N1349 Q1350Q1342-D1346 PolarHBondContact NE2-OD1 3.3Å; Q1342-D1346 PolarHBondContact O-N 3.02Å; D1346-N1349 PolarHBondContact O-N 3.32Å; D1346-Q1350 WeakPolarHBondContact O-CB 3.43Å; D1346-Q1350 PolarHBondContact O-N 3.38Å
1347A85Confident79.8Confident1 Ų147.7 Ų47.71%0.00824%0.239CC..Hα-helixtrans-66.7-41.1176.500000112.6L1283 I1288 I1321 L1343 L1344 F1345 Q1350 L1351L1283-A1347 HydrophobicContact CD1-CB 4.49Å; I1288-A1347 HydrophobicContact CD1-CB 3.76Å; I1321-A1347 HydrophobicContact CD1-CB 4.2Å; L1343-A1347 WeakPolarHBondContact O-CB 3.46Å; L1343-A1347 PolarHBondContact O-N 2.76Å; L1344-A1347 PolarHBondContact O-N 2.88Å; F1345-A1347 VanDerWaalsContact C-N 3.31Å; F1345-A1347 PolarHBondContact O-N 3.46Å; A1347-Q1350 PolarHBondContact O-N 3.1Å; A1347-L1351 WeakPolarHBondContact O-CB 3.3Å; A1347-L1351 PolarHBondContact O-N 3.12Å
1348G84.5Confident78.9Confident0 Ų052.6 Ų52.60%027%0.265CS..Hα-helixtrans-62.7-45.4173.400000111.9L1344 F1345 L1351 L1352L1344-G1348 PolarHBondContact O-N 3.04Å; L1344-G1348 VanDerWaalsContact O-N 3.1Å; F1345-G1348 PolarHBondContact O-N 3.08Å; G1348-L1351 PolarHBondContact O-N 3.39Å; G1348-L1352 WeakPolarHBondContact O-CB 3.29Å; G1348-L1352 PolarHBondContact O-N 3.47Å
1349N83.4Confident77.9Confident27 Ų2754.1 Ų54.114%0.14427%0.267CS..Hα-helixtrans-63.4-39.5173.3-78.4-64.5000112.8F1345 D1346 L1352 N1353 N1383F1345-N1349 WeakPolarHBondContact CD1-ND2 3.35Å; F1345-N1349 WeakPolarHBondContact CE1-ND2 3.48Å; F1345-N1349 WeakPolarHBondContact CZ-ND2 3.39Å; F1345-N1349 PolarHBondContact O-N 3.24Å; F1345-N1349 VanDerWaalsContact O-N 3.07Å; F1345-N1349 PolarHBondContact O-ND2 3.31Å; D1346-N1349 PolarHBondContact O-N 3.32Å; N1349-L1352 PolarHBondContact O-N 2.93Å; N1349-N1353 WeakPolarHBondContact O-CB 3.21Å; N1349-N1353 VanDerWaalsContact O-CG 3.23Å; N1349-N1353 PolarHBondContact O-N 3.46Å; N1349-N1353 PolarHBondContact O-ND2 3.27Å; N1349-N1353 VanDerWaalsContact O-ND2 3.09Å; N1349-N1383 WeakPolarHBondContact OD1-CB 3.43Å
1350Q83.8Confident76.8Confident91 Ų9152.2 Ų52.243%0.42525%0.253SS..Hα-helixtrans-66.5-43.7177.8-172.2-178.14.400111.1I1288 D1346 A1347 N1353 I1354I1288-Q1350 HydrophobicContact CG2-CG 4.23Å; D1346-Q1350 WeakPolarHBondContact O-CB 3.43Å; D1346-Q1350 PolarHBondContact O-N 3.38Å; A1347-Q1350 PolarHBondContact O-N 3.1Å; Q1350-N1353 PolarHBondContact O-N 3.46Å; Q1350-I1354 HydrophobicContact CG-CD1 3.86Å; Q1350-I1354 HydrophobicContact CG-CG1 4.47Å; Q1350-I1354 WeakPolarHBondContact O-CB 3.41Å; Q1350-I1354 WeakPolarHBondContact O-CD1 3.28Å; Q1350-I1354 WeakPolarHBondContact O-CG1 3.29Å; Q1350-I1354 PolarHBondContact O-N 3.47Å
1351L83.5Confident75.6Confident0 Ų056.4 Ų56.40%027%0.271CS..Hα-helixtrans-59.6-49.1174.5174.158.5000110.9L1291 I1317 T1318 I1321 A1347 G1348 N1353 I1354 L1355 L1379L1291-L1351 HydrophobicContact CD2-CD1 3.4Å; I1317-L1351 HydrophobicContact CB-CD2 4.25Å; I1317-L1351 HydrophobicContact CG2-CD2 3.79Å; T1318-L1351 WeakPolarHBondContact OG1-CD2 3.33Å; I1321-L1351 HydrophobicContact CD1-CD2 4.17Å; A1347-L1351 WeakPolarHBondContact O-CB 3.3Å; A1347-L1351 PolarHBondContact O-N 3.12Å; G1348-L1351 PolarHBondContact O-N 3.39Å; L1351-N1353 VanDerWaalsContact C-N 3.31Å; L1351-N1353 PolarHBondContact O-N 3.35Å; L1351-I1354 WeakPolarHBondContact O-CB 3.24Å; L1351-I1354 PolarHBondContact O-N 3.18Å; L1351-I1354 VanDerWaalsContact O-N 3.16Å; L1351-L1355 HydrophobicContact CD1-CD1 4.12Å; L1351-L1355 HydrophobicContact CD1-CG 4.14Å; L1351-L1355 HydrophobicContact CG-CD1 4.11Å; L1351-L1355 WeakPolarHBondContact O-CB 3.25Å; L1351-L1355 WeakPolarHBondContact O-CG 3.45Å; L1351-L1355 PolarHBondContact O-N 3.1Å; L1351-L1379 HydrophobicContact CD2-CD1 3.72Å; L1351-L1379 HydrophobicContact CG-CD1 4.16Å
1352L79.4Confident74.3Confident0 Ų057.5 Ų57.50%028%0.278CS..Hα-helixtrans-61.6-37.3178.6-176.166.2000112.9G1348 N1349 L1355 N1356 N1383 L1386 I1387G1348-L1352 WeakPolarHBondContact O-CB 3.29Å; G1348-L1352 PolarHBondContact O-N 3.47Å; N1349-L1352 PolarHBondContact O-N 2.93Å; L1352-L1355 PolarHBondContact O-N 2.95Å; L1352-N1356 WeakPolarHBondContact O-CB 3.31Å; L1352-N1356 PolarHBondContact O-N 3.48Å; L1352-N1383 HydrophobicContact CD2-CB 3.73Å; L1352-L1386 HydrophobicContact CD1-CD2 4Å; L1352-L1386 HydrophobicContact CD2-CB 4.28Å; L1352-L1386 HydrophobicContact CD2-CD1 4.07Å; L1352-L1386 HydrophobicContact CD2-CD2 3.91Å; L1352-L1386 HydrophobicContact CD2-CG 4.32Å; L1352-L1386 HydrophobicContact CG-CD1 4.18Å; L1352-L1386 HydrophobicContact CG-CD2 3.74Å; L1352-I1387 HydrophobicContact CD1-CD1 3.86Å; L1352-I1387 HydrophobicContact CD1-CG1 3.63Å; L1352-I1387 HydrophobicContact CD2-CD1 3.66Å; L1352-I1387 HydrophobicContact CD2-CG1 3.83Å; L1352-I1387 HydrophobicContact CG-CD1 4.41Å; L1352-I1387 HydrophobicContact CG-CG1 4.35Å
1353N80.4Confident72.8Confident90 Ų9054.5 Ų54.548%0.48127%0.265SS..Hα-helixtrans-71.2-36.7174-75.4-33.5000112.7N1349 Q1350 L1351 L1355 H1357 L1386N1349-N1353 WeakPolarHBondContact O-CB 3.21Å; N1349-N1353 VanDerWaalsContact O-CG 3.23Å; N1349-N1353 PolarHBondContact O-N 3.46Å; N1349-N1353 PolarHBondContact O-ND2 3.27Å; N1349-N1353 VanDerWaalsContact O-ND2 3.09Å; Q1350-N1353 PolarHBondContact O-N 3.46Å; L1351-N1353 VanDerWaalsContact C-N 3.31Å; L1351-N1353 PolarHBondContact O-N 3.35Å; N1353-L1355 VanDerWaalsContact C-N 3.33Å; N1353-H1357 WeakPolarHBondContact O-CB 3.45Å; N1353-H1357 PolarHBondContact O-N 3.31Å; N1353-H1357 VanDerWaalsContact O-N 3.13Å; N1353-L1386 WeakPolarHBondContact OD1-CD1 3.35Å
1354I77.1Confident71.3Confident30 Ų3054.2 Ų54.215%0.15426%0.264CS..Hα-helixtrans-63.4-42.1172.5-75.1163000110.3I1288 L1291 T1292 L1295 Q1350 L1351I1288-I1354 HydrophobicContact CG2-CD1 3.6Å; L1291-I1354 HydrophobicContact CD2-CG2 4.33Å; T1292-I1354 WeakPolarHBondContact OG1-CD1 3.32Å; L1295-I1354 HydrophobicContact CD1-CG2 3.41Å; L1295-I1354 VanDerWaalsContact CD1-CG2 3.41Å; Q1350-I1354 HydrophobicContact CG-CD1 3.86Å; Q1350-I1354 HydrophobicContact CG-CG1 4.47Å; Q1350-I1354 WeakPolarHBondContact O-CB 3.41Å; Q1350-I1354 WeakPolarHBondContact O-CD1 3.28Å; Q1350-I1354 WeakPolarHBondContact O-CG1 3.29Å; Q1350-I1354 PolarHBondContact O-N 3.47Å; L1351-I1354 WeakPolarHBondContact O-CB 3.24Å; L1351-I1354 PolarHBondContact O-N 3.18Å; L1351-I1354 VanDerWaalsContact O-N 3.16Å
1355L74Confident69.8Low13 Ų1360.8 Ų60.87%0.06830%0.299CS..Hα-helixtrans-63-57.1174.5-70.3171.7000110.3L1351 L1352 N1353 H1357 S1360 Y1372 C1375L1351-L1355 HydrophobicContact CD1-CD1 4.12Å; L1351-L1355 HydrophobicContact CD1-CG 4.14Å; L1351-L1355 HydrophobicContact CG-CD1 4.11Å; L1351-L1355 WeakPolarHBondContact O-CB 3.25Å; L1351-L1355 WeakPolarHBondContact O-CG 3.45Å; L1351-L1355 PolarHBondContact O-N 3.1Å; L1352-L1355 PolarHBondContact O-N 2.95Å; N1353-L1355 VanDerWaalsContact C-N 3.33Å; L1355-H1357 PolarHBondContact O-N 2.92Å; L1355-H1357 VanDerWaalsContact O-N 3.11Å; L1355-S1360 WeakPolarHBondContact O-CB 3.25Å; L1355-S1360 PolarHBondContact O-OG 2.98Å; L1355-Y1372 VanDerWaalsContact C-CE2 3.43Å; L1355-Y1372 HydrophobicContact CB-CD2 4.04Å; L1355-Y1372 HydrophobicContact CB-CE2 3.65Å; L1355-Y1372 HydrophobicContact CD2-CD2 4.27Å; L1355-Y1372 WeakPolarHBondContact O-CE2 3.21Å; L1355-C1375 HydrophobicContact CD1-CB 4.04Å
1356N71.1Confident68.6Low39 Ų3962.4 Ų62.421%0.20931%0.311CS..Hα-helixtrans-70.8-6.5-175.1-164.66.9000115.1L1352 N1358 K1361 Y1372 L1386L1352-N1356 WeakPolarHBondContact O-CB 3.31Å; L1352-N1356 PolarHBondContact O-N 3.48Å; N1356-N1358 PolarHBondContact O-N 3.39Å; N1356-K1361 WeakPolarHBondContact O-CE 3.5Å; N1356-K1361 PolarHBondContact O-NZ 3.31Å; N1356-K1361 WeakPolarHBondContact OD1-CE 3.23Å; N1356-K1361 PolarHBondContact OD1-NZ 3.14Å; N1356-Y1372 VanDerWaalsContact CA-OH 3.24Å; N1356-Y1372 WeakPolarHBondContact CA-OH 3.47Å; N1356-Y1372 WeakPolarHBondContact CB-OH 3.44Å; N1356-Y1372 PolarHBondContact N-OH 2.93Å; N1356-L1386 HydrophobicContact CB-CD2 4.17Å; N1356-L1386 VanDerWaalsContact ND2-CD2 3.26Å; N1356-L1386 WeakPolarHBondContact ND2-CD2 3.18Å
1357H67Low67.5Low118 Ų11864.8 Ų64.855%0.54632%0.32SS..SBendtrans-64.4120.8-179.1177.2-81.4000112.1N1353 L1355 K1359 S1360N1353-H1357 WeakPolarHBondContact O-CB 3.45Å; N1353-H1357 PolarHBondContact O-N 3.31Å; N1353-H1357 VanDerWaalsContact O-N 3.13Å; L1355-H1357 PolarHBondContact O-N 2.92Å; L1355-H1357 VanDerWaalsContact O-N 3.11Å; H1357-K1359 PolarHBondContact O-N 3.41Å; H1357-S1360 PolarHBondContact O-N 3.48Å; H1357-S1360 PolarHBondContact O-OG 2.96Å
1358N55.7Low66.6Low111 Ų11165.7 Ų65.759%0.59433%0.325SS*.THydrogen-bonded Turntrans-41.6-33.8-163.6-70.7-8.9000118.2N1356 S1360 K1361N1356-N1358 PolarHBondContact O-N 3.39Å; N1358-S1360 PolarHBondContact O-N 3.39Å; N1358-K1361 VanDerWaalsContact O-CB 3.28Å; N1358-K1361 WeakPolarHBondContact O-CB 3.41Å; N1358-K1361 PolarHBondContact O-N 2.79Å; N1358-K1361 PolarHBondContact OD1-NZ 2.83Å
1359K54.4Low65.8Low129 Ų12966.3 Ų66.356%0.56133%0.328SS*.Hα-helixtrans-56.5-31.3173.1-74.3-160.6165.4-144.30114.6H1357 K1361 E1362 I1363H1357-K1359 PolarHBondContact O-N 3.41Å; K1359-K1361 PolarHBondContact O-N 2.99Å; K1359-E1362 PolarHBondContact O-N 2.87Å; K1359-I1363 VanDerWaalsContact O-CD1 3.31Å; K1359-I1363 WeakPolarHBondContact O-CD1 3.39Å; K1359-I1363 WeakPolarHBondContact O-CG1 3.45Å
1360S54.2Low65Low14 Ų1466.3 Ų66.310%0.09833%0.327CS..Hα-helixtrans-64.2-31.1173.564.60000112.1L1355 H1357 N1358 I1363 M1364L1355-S1360 WeakPolarHBondContact O-CB 3.25Å; L1355-S1360 PolarHBondContact O-OG 2.98Å; H1357-S1360 PolarHBondContact O-N 3.48Å; H1357-S1360 PolarHBondContact O-OG 2.96Å; N1358-S1360 PolarHBondContact O-N 3.39Å; S1360-I1363 CarbonylContact O-C 3.55Å; S1360-I1363 WeakPolarHBondContact O-CA 3.41Å; S1360-I1363 WeakPolarHBondContact O-CB 3.24Å; S1360-I1363 PolarHBondContact O-N 3.07Å; S1360-M1364 WeakPolarHBondContact O-CG 3.34Å; S1360-M1364 PolarHBondContact O-N 3.34Å
1361K54.3Low64.2Low88 Ų8862.6 Ų62.638%0.38331%0.31SS..Hα-helixtrans-68.9-36.3-177.8-57.6173.4-176158.20111.2N1356 N1358 K1359 I1363 M1364N1356-K1361 WeakPolarHBondContact O-CE 3.5Å; N1356-K1361 PolarHBondContact O-NZ 3.31Å; N1356-K1361 WeakPolarHBondContact OD1-CE 3.23Å; N1356-K1361 PolarHBondContact OD1-NZ 3.14Å; N1358-K1361 VanDerWaalsContact O-CB 3.28Å; N1358-K1361 WeakPolarHBondContact O-CB 3.41Å; N1358-K1361 PolarHBondContact O-N 2.79Å; N1358-K1361 PolarHBondContact OD1-NZ 2.83Å; K1359-K1361 PolarHBondContact O-N 2.99Å; K1361-I1363 PolarHBondContact O-N 2.69Å; K1361-M1364 HydrophobicContact CB-CE 4.17Å; K1361-M1364 HydrophobicContact CG-CE 3.65Å; K1361-M1364 PolarHBondContact O-N 2.8Å
1362E53.8Low63.6Low151 Ų15163 Ų6371%0.70631%0.312SS*.Hα-helixtrans-62.6-27.9169.9-58.1175.2122.700112.2K1359K1359-E1362 PolarHBondContact O-N 2.87Å
1363I52.5Low63.1Low43 Ų4363.3 Ų63.322%0.22131%0.314CS..Hα-helixtrans-91.8-21.5-178.5-64158.4000112.1L1300 L1307 K1359 S1360 K1361 N1365 L1368L1300-I1363 HydrophobicContact CD2-CD1 3.65Å; L1300-I1363 HydrophobicContact CD2-CG1 4.35Å; L1300-I1363 HydrophobicContact CD2-CG2 4.07Å; L1307-I1363 HydrophobicContact CD2-CG2 3.91Å; K1359-I1363 VanDerWaalsContact O-CD1 3.31Å; K1359-I1363 WeakPolarHBondContact O-CD1 3.39Å; K1359-I1363 WeakPolarHBondContact O-CG1 3.45Å; S1360-I1363 CarbonylContact O-C 3.55Å; S1360-I1363 WeakPolarHBondContact O-CA 3.41Å; S1360-I1363 WeakPolarHBondContact O-CB 3.24Å; S1360-I1363 PolarHBondContact O-N 3.07Å; K1361-I1363 PolarHBondContact O-N 2.69Å; I1363-N1365 PolarHBondContact O-N 2.85Å; I1363-L1368 HydrophobicContact CG2-CD1 3.85Å
1364M51.7Low62.6Low22 Ų2259.3 Ų59.311%0.10829%0.293CS..  trans-72.827.4-176.3-84.5-165.4-68.700114.6S1360 K1361 N1366 L1369 Y1372 F1390S1360-M1364 WeakPolarHBondContact O-CG 3.34Å; S1360-M1364 PolarHBondContact O-N 3.34Å; K1361-M1364 HydrophobicContact CB-CE 4.17Å; K1361-M1364 HydrophobicContact CG-CE 3.65Å; K1361-M1364 PolarHBondContact O-N 2.8Å; M1364-N1366 PolarHBondContact O-N 3.13Å; M1364-L1369 HydrophobicContact CB-CD1 4.36Å; M1364-L1369 HydrophobicContact CG-CD1 4.37Å; M1364-L1369 HydrophobicContact SD-CD1 3.61Å; M1364-Y1372 HydrophobicContact CE-CD2 3.91Å; M1364-Y1372 HydrophobicContact CE-CE2 3.81Å; M1364-Y1372 HydrophobicContact CG-CD2 4.48Å; M1364-Y1372 HydrophobicContact SD-CD1 4.25Å; M1364-Y1372 HydrophobicContact SD-CD2 3.24Å; M1364-Y1372 WeakPolarHBondContact SD-CD2 3.5Å; M1364-Y1372 HydrophobicContact SD-CE2 3.8Å; M1364-Y1372 HydrophobicContact SD-CG 3.51Å; M1364-Y1372 VanDerWaalsContact SD-CG 3.51Å; M1364-F1390 HydrophobicContact CE-CE2 4.21Å; M1364-F1390 HydrophobicContact CE-CZ 4.44Å
1365N53.7Low62.5Low144 Ų14458 Ų5877%0.7729%0.286SS*.SBendtrans-77.545.9-176.1-134.210.8000113I1363I1363-N1365 PolarHBondContact O-N 2.85Å
1366N58.4Low62.4Low124 Ų12457.4 Ų57.466%0.66328%0.283SS*.SBendtrans115.3-69.5173.8-61.2-51.8000116.2M1364 L1368 L1369M1364-N1366 PolarHBondContact O-N 3.13Å; N1366-L1368 PolarHBondContact O-N 3.14Å; N1366-L1369 VanDerWaalsContact O-CB 3.28Å; N1366-L1369 WeakPolarHBondContact O-CB 3.48Å; N1366-L1369 PolarHBondContact O-N 3.23Å; N1366-L1369 VanDerWaalsContact O-N 3.08Å
1367Q60.1Low62.4Low126 Ų12656.4 Ų56.459%0.58928%0.277SS*.Hα-helixtrans-57.1-49.6-166.3-72.2-178.1-7.300115L1369Q1367-L1369 VanDerWaalsContact C-N 3.26Å; Q1367-L1369 PolarHBondContact O-N 3.26Å
1368L65.3Low62.7Low19 Ų1953.7 Ų53.710%0.09926%0.262CS..Hα-helixtrans-77.4-8.9-178.8-87169000113.9L1307 I1310 I1363 N1366 T1371 Y1372L1307-L1368 HydrophobicContact CB-CD1 4.46Å; L1307-L1368 HydrophobicContact CD2-CD1 3.65Å; I1310-L1368 HydrophobicContact CB-CD2 4.38Å; I1310-L1368 HydrophobicContact CG2-CD1 4.05Å; I1310-L1368 HydrophobicContact CG2-CD2 3.87Å; I1363-L1368 HydrophobicContact CG2-CD1 3.85Å; N1366-L1368 PolarHBondContact O-N 3.14Å; L1368-T1371 PolarHBondContact O-N 3.42Å; L1368-Y1372 WeakPolarHBondContact O-CB 3.47Å; L1368-Y1372 PolarHBondContact O-N 3.22Å
1369L67.4Low63.7Low14 Ų1448.4 Ų48.47%0.07323%0.234CC..Hα-helixtrans-71.7-40.3-173.2-17451.6000111.9M1364 N1366 Q1367 Y1372 I1373 L1394 I1398M1364-L1369 HydrophobicContact CB-CD1 4.36Å; M1364-L1369 HydrophobicContact CG-CD1 4.37Å; M1364-L1369 HydrophobicContact SD-CD1 3.61Å; N1366-L1369 VanDerWaalsContact O-CB 3.28Å; N1366-L1369 WeakPolarHBondContact O-CB 3.48Å; N1366-L1369 PolarHBondContact O-N 3.23Å; N1366-L1369 VanDerWaalsContact O-N 3.08Å; Q1367-L1369 VanDerWaalsContact C-N 3.26Å; Q1367-L1369 PolarHBondContact O-N 3.26Å; L1369-Y1372 WeakPolarHBondContact O-CB 3.24Å; L1369-Y1372 PolarHBondContact O-N 3.46Å; L1369-I1373 HydrophobicContact CD1-CD1 3.97Å; L1369-I1373 HydrophobicContact CD1-CG1 4.22Å; L1369-I1373 HydrophobicContact CG-CD1 3.99Å; L1369-I1373 WeakPolarHBondContact O-CD1 3.34Å; L1369-I1373 VanDerWaalsContact O-CG1 3.23Å; L1369-I1373 WeakPolarHBondContact O-CG1 3.39Å; L1369-I1373 PolarHBondContact O-N 3.29Å; L1369-L1394 HydrophobicContact CD1-CD2 4.16Å; L1369-I1398 HydrophobicContact CD2-CD1 3.82Å; L1369-I1398 HydrophobicContact CD2-CG2 3.57Å; L1369-I1398 HydrophobicContact CG-CG2 4.04Å
1370F66.5Low64.4Low27 Ų2744.2 Ų44.212%0.11822%0.217CC..Hα-helixtrans-58.7-50.1172.1-176.5-88.4000111Y1372 I1373 T1374 F1402 Q1405 F1412F1370-Y1372 VanDerWaalsContact C-N 3.33Å; F1370-Y1372 PolarHBondContact O-N 2.91Å; F1370-I1373 PolarHBondContact O-N 3.07Å; F1370-T1374 WeakPolarHBondContact O-CB 3.48Å; F1370-T1374 PolarHBondContact O-N 3.16Å; F1370-T1374 PolarHBondContact O-OG1 3.48Å; F1370-F1402 HydrophobicContact CB-CD2 4.48Å; F1370-F1402 HydrophobicContact CD1-CE2 4.45Å; F1370-F1402 AromaticContact CD2-CD2 3.29Å; F1370-F1402 HydrophobicContact CD2-CD2 3.29Å; F1370-F1402 AromaticContact CD2-CE2 3.5Å; F1370-F1402 HydrophobicContact CD2-CE2 3.5Å; F1370-F1402 HydrophobicContact CD2-CG 4.38Å; F1370-F1402 HydrophobicContact CE1-CE2 4.49Å; F1370-F1402 AromaticContact CE2-CD2 3.59Å; F1370-F1402 HydrophobicContact CE2-CD2 3.59Å; F1370-F1402 AromaticContact CE2-CE2 3.53Å; F1370-F1402 HydrophobicContact CE2-CE2 3.53Å; F1370-F1402 HydrophobicContact CE2-CG 4.49Å; F1370-F1402 HydrophobicContact CE2-CZ 4.41Å; F1370-F1402 HydrophobicContact CG-CD2 4.02Å; F1370-F1402 AromaticContact CG-CE2 3.97Å; F1370-F1402 HydrophobicContact CG-CE2 3.97Å; F1370-F1402 HydrophobicContact CZ-CE2 4.05Å; F1370-Q1405 HydrophobicContact CD2-CB 3.97Å; F1370-Q1405 HydrophobicContact CE2-CB 3.63Å; F1370-F1412 HydrophobicContact CZ-CE1 4.11Å; F1370-F1412 AromaticContact CZ-CZ 3.94Å; F1370-F1412 HydrophobicContact CZ-CZ 3.94Å
1371T68.1Low65Low13 Ų1347.8 Ų47.88%0.0825%0.247CC..Hα-helixtrans-61.7-39.9177.8-51.50000112.6S1311 C1315 L1368 C1375S1311-T1371 PolarHBondContact OG-OG1 3.02Å; C1315-T1371 VanDerWaalsContact SG-CG2 3.59Å; L1368-T1371 PolarHBondContact O-N 3.42Å; T1371-C1375 WeakPolarHBondContact O-CB 3.37Å; T1371-C1375 PolarHBondContact O-N 3.26Å; T1371-C1375 PolarHBondContact O-SG 2.86Å
1372Y71.5Confident66Low8 Ų844.5 Ų44.53%0.03123%0.233CC..Hα-helixtrans-58.3-51174.9-176.7-65.8000110.9L1355 N1356 M1364 L1368 L1369 F1370 C1375 S1376 F1390L1355-Y1372 VanDerWaalsContact C-CE2 3.43Å; L1355-Y1372 HydrophobicContact CB-CD2 4.04Å; L1355-Y1372 HydrophobicContact CB-CE2 3.65Å; L1355-Y1372 HydrophobicContact CD2-CD2 4.27Å; L1355-Y1372 WeakPolarHBondContact O-CE2 3.21Å; N1356-Y1372 VanDerWaalsContact CA-OH 3.24Å; N1356-Y1372 WeakPolarHBondContact CA-OH 3.47Å; N1356-Y1372 WeakPolarHBondContact CB-OH 3.44Å; N1356-Y1372 PolarHBondContact N-OH 2.93Å; M1364-Y1372 HydrophobicContact CE-CD2 3.91Å; M1364-Y1372 HydrophobicContact CE-CE2 3.81Å; M1364-Y1372 HydrophobicContact CG-CD2 4.48Å; M1364-Y1372 HydrophobicContact SD-CD1 4.25Å; M1364-Y1372 HydrophobicContact SD-CD2 3.24Å; M1364-Y1372 WeakPolarHBondContact SD-CD2 3.5Å; M1364-Y1372 HydrophobicContact SD-CE2 3.8Å; M1364-Y1372 HydrophobicContact SD-CG 3.51Å; M1364-Y1372 VanDerWaalsContact SD-CG 3.51Å; L1368-Y1372 WeakPolarHBondContact O-CB 3.47Å; L1368-Y1372 PolarHBondContact O-N 3.22Å; L1369-Y1372 WeakPolarHBondContact O-CB 3.24Å; L1369-Y1372 PolarHBondContact O-N 3.46Å; F1370-Y1372 VanDerWaalsContact C-N 3.33Å; F1370-Y1372 PolarHBondContact O-N 2.91Å; Y1372-C1375 PolarHBondContact O-N 3.27Å; Y1372-S1376 VanDerWaalsContact CD1-OG 3.31Å; Y1372-S1376 WeakPolarHBondContact CD1-OG 3.44Å; Y1372-S1376 WeakPolarHBondContact CE1-OG 3.41Å; Y1372-S1376 VanDerWaalsContact O-CB 3.27Å; Y1372-S1376 WeakPolarHBondContact O-CB 3.41Å; Y1372-S1376 PolarHBondContact O-N 2.94Å; Y1372-S1376 PolarHBondContact O-OG 2.93Å; Y1372-F1390 HydrophobicContact CD1-CD1 4.28Å; Y1372-F1390 AromaticContact CD1-CE1 3.49Å; Y1372-F1390 HydrophobicContact CD1-CE1 3.49Å; Y1372-F1390 VanDerWaalsContact CD1-CE1 3.49Å; Y1372-F1390 HydrophobicContact CD1-CE2 4.19Å; Y1372-F1390 AromaticContact CD1-CZ 3.44Å; Y1372-F1390 HydrophobicContact CD1-CZ 3.44Å; Y1372-F1390 VanDerWaalsContact CD1-CZ 3.44Å; Y1372-F1390 AromaticContact CE1-CD1 3.57Å; Y1372-F1390 HydrophobicContact CE1-CD1 3.57Å; Y1372-F1390 AromaticContact CE1-CD2 3.84Å; Y1372-F1390 HydrophobicContact CE1-CD2 3.84Å; Y1372-F1390 AromaticContact CE1-CE1 3.16Å; Y1372-F1390 HydrophobicContact CE1-CE1 3.16Å; Y1372-F1390 AromaticContact CE1-CE2 3.46Å; Y1372-F1390 HydrophobicContact CE1-CE2 3.46Å; Y1372-F1390 VanDerWaalsContact CE1-CE2 3.46Å; Y1372-F1390 AromaticContact CE1-CG 3.89Å; Y1372-F1390 HydrophobicContact CE1-CG 3.89Å; Y1372-F1390 AromaticContact CE1-CZ 3.11Å; Y1372-F1390 HydrophobicContact CE1-CZ 3.11Å; Y1372-F1390 HydrophobicContact CE2-CE2 4.35Å; Y1372-F1390 HydrophobicContact CE2-CZ 4.45Å; Y1372-F1390 HydrophobicContact CG-CZ 4.35Å; Y1372-F1390 AromaticContact CZ-CD2 3.87Å; Y1372-F1390 AromaticContact CZ-CE2 3.55Å; Y1372-F1390 AromaticContact CZ-CZ 3.68Å; Y1372-F1390 WeakPolarHBondContact OH-CD2 3.4Å
1373I67.9Low67Low7 Ų739.5 Ų39.54%0.03621%0.211CC..Hα-helixtrans-64.5-46.9-175.8-65.5164.6000109.3L1369 F1370 C1375 S1376 I1377 F1390 L1394 I1398 F1402L1369-I1373 HydrophobicContact CD1-CD1 3.97Å; L1369-I1373 HydrophobicContact CD1-CG1 4.22Å; L1369-I1373 HydrophobicContact CG-CD1 3.99Å; L1369-I1373 WeakPolarHBondContact O-CD1 3.34Å; L1369-I1373 VanDerWaalsContact O-CG1 3.23Å; L1369-I1373 WeakPolarHBondContact O-CG1 3.39Å; L1369-I1373 PolarHBondContact O-N 3.29Å; F1370-I1373 PolarHBondContact O-N 3.07Å; I1373-C1375 PolarHBondContact O-N 2.89Å; I1373-S1376 PolarHBondContact O-N 3.44Å; I1373-I1377 HydrophobicContact CG2-CD1 3.6Å; I1373-I1377 HydrophobicContact CG2-CG1 4.27Å; I1373-I1377 WeakPolarHBondContact O-CG1 3.31Å; I1373-I1377 PolarHBondContact O-N 3.17Å; I1373-F1390 HydrophobicContact CG1-CE1 4.31Å; I1373-L1394 HydrophobicContact CD1-CD1 3.68Å; I1373-L1394 HydrophobicContact CG1-CD1 3.85Å; I1373-I1398 HydrophobicContact CD1-CG2 4.08Å; I1373-F1402 HydrophobicContact CB-CD2 3.92Å; I1373-F1402 HydrophobicContact CB-CE2 3.73Å; I1373-F1402 HydrophobicContact CB-CG 4.42Å; I1373-F1402 HydrophobicContact CB-CZ 4.06Å; I1373-F1402 HydrophobicContact CD1-CB 4.46Å; I1373-F1402 HydrophobicContact CD1-CD2 4.16Å; I1373-F1402 HydrophobicContact CD1-CG 4.32Å; I1373-F1402 HydrophobicContact CG2-CD1 3.73Å; I1373-F1402 HydrophobicContact CG2-CD2 3.83Å; I1373-F1402 HydrophobicContact CG2-CE1 3.52Å; I1373-F1402 HydrophobicContact CG2-CE2 3.65Å; I1373-F1402 HydrophobicContact CG2-CG 3.9Å; I1373-F1402 HydrophobicContact CG2-CZ 3.5Å
1374T69.4Low67.8Low6 Ų640.4 Ų40.44%0.03722%0.22CC..Hα-helixtrans-55.8-50.5173.6-710000112.5F1370 S1376 R1378 F1402 F1412F1370-T1374 WeakPolarHBondContact O-CB 3.48Å; F1370-T1374 PolarHBondContact O-N 3.16Å; F1370-T1374 PolarHBondContact O-OG1 3.48Å; T1374-S1376 VanDerWaalsContact C-N 3.3Å; T1374-S1376 PolarHBondContact O-N 3.19Å; T1374-R1378 WeakPolarHBondContact O-CB 3.31Å; T1374-R1378 VanDerWaalsContact O-CG 3.25Å; T1374-R1378 WeakPolarHBondContact O-CG 3.44Å; T1374-R1378 PolarHBondContact O-N 2.77Å; T1374-F1402 WeakPolarHBondContact OG1-CE2 3.35Å; T1374-F1402 WeakPolarHBondContact OG1-CZ 3.37Å; T1374-F1412 HydrophobicContact CG2-CD1 3.76Å; T1374-F1412 HydrophobicContact CG2-CE1 4.29Å
1375C74.7Confident68.7Low1 Ų147.2 Ų47.21%0.00725%0.249CC..Hα-helixtrans-63.4-37.7178.3-66.40000111.8L1355 T1371 Y1372 I1373 L1379L1355-C1375 HydrophobicContact CD1-CB 4.04Å; T1371-C1375 WeakPolarHBondContact O-CB 3.37Å; T1371-C1375 PolarHBondContact O-N 3.26Å; T1371-C1375 PolarHBondContact O-SG 2.86Å; Y1372-C1375 PolarHBondContact O-N 3.27Å; I1373-C1375 PolarHBondContact O-N 2.89Å; C1375-L1379 WeakPolarHBondContact O-CB 3.3Å; C1375-L1379 WeakPolarHBondContact O-CD1 3.41Å; C1375-L1379 WeakPolarHBondContact O-CG 3.28Å; C1375-L1379 PolarHBondContact O-N 3.22Å; C1375-L1379 VanDerWaalsContact O-N 3.17Å
1376S73.3Confident69.5Low1 Ų141.3 Ų41.31%0.00722%0.217CC..Hα-helixtrans-69-48.5-179.9-61.70000112Y1372 I1373 T1374 R1378 L1379 I1380 I1387Y1372-S1376 VanDerWaalsContact CD1-OG 3.31Å; Y1372-S1376 WeakPolarHBondContact CD1-OG 3.44Å; Y1372-S1376 WeakPolarHBondContact CE1-OG 3.41Å; Y1372-S1376 VanDerWaalsContact O-CB 3.27Å; Y1372-S1376 WeakPolarHBondContact O-CB 3.41Å; Y1372-S1376 PolarHBondContact O-N 2.94Å; Y1372-S1376 PolarHBondContact O-OG 2.93Å; I1373-S1376 PolarHBondContact O-N 3.44Å; T1374-S1376 VanDerWaalsContact C-N 3.3Å; T1374-S1376 PolarHBondContact O-N 3.19Å; S1376-R1378 VanDerWaalsContact C-N 3.35Å; S1376-R1378 PolarHBondContact O-N 3.01Å; S1376-L1379 CarbonylContact O-C 3.58Å; S1376-L1379 PolarHBondContact O-N 3.03Å; S1376-L1379 VanDerWaalsContact O-N 3.09Å; S1376-I1380 PolarHBondContact O-N 3.17Å; S1376-I1387 WeakPolarHBondContact O-CD1 3.47Å
1377I69.9Low69.8Low18 Ų1835.4 Ų35.49%0.09219%0.186CC..Hα-helixtrans-58.5-48176.4-68.7168.4000110I1373 L1379 I1380 I1391 F1402 L1481I1373-I1377 HydrophobicContact CG2-CD1 3.6Å; I1373-I1377 HydrophobicContact CG2-CG1 4.27Å; I1373-I1377 WeakPolarHBondContact O-CG1 3.31Å; I1373-I1377 PolarHBondContact O-N 3.17Å; I1377-L1379 PolarHBondContact O-N 3.2Å; I1377-L1379 VanDerWaalsContact O-N 3.1Å; I1377-I1380 VanDerWaalsContact O-CB 3.28Å; I1377-I1380 WeakPolarHBondContact O-CB 3.3Å; I1377-I1380 VanDerWaalsContact O-CG2 3.29Å; I1377-I1380 WeakPolarHBondContact O-CG2 3.15Å; I1377-I1380 PolarHBondContact O-N 3.13Å; I1377-I1391 HydrophobicContact CG1-CD1 4.09Å; I1377-F1402 HydrophobicContact CD1-CE1 3.65Å; I1377-F1402 HydrophobicContact CD1-CZ 4.08Å; I1377-L1481 HydrophobicContact CD1-CD1 4.2Å; I1377-L1481 HydrophobicContact CG2-CB 4.16Å; I1377-L1481 WeakPolarHBondContact CG2-O 3.45Å
1378R73.3Confident70Confident61 Ų6133.8 Ų33.823%0.2318%0.18CC..Hα-helixtrans-65.9-14179.5-65.8-177.270.1-137.1-7.9113.7T1318 D1319 I1322 T1374 S1376 F1412T1318-R1378 HydrophobicContact CG2-CB 4.04Å; D1319-R1378 IonicContact OD1-CZ 2.73Å; D1319-R1378 IonicContact OD1-NH1 3.24Å; D1319-R1378 PolarHBondContact OD1-NH1 3.41Å; D1319-R1378 IonicContact OD1-NH2 3.64Å; D1319-R1378 PolarHBondContact OD1-NH2 3.18Å; I1322-R1378 HydrophobicContact CD1-CB 3.74Å; I1322-R1378 WeakPolarHBondContact CD1-O 3.47Å; T1374-R1378 WeakPolarHBondContact O-CB 3.31Å; T1374-R1378 VanDerWaalsContact O-CG 3.25Å; T1374-R1378 WeakPolarHBondContact O-CG 3.44Å; T1374-R1378 PolarHBondContact O-N 2.77Å; S1376-R1378 VanDerWaalsContact C-N 3.35Å; S1376-R1378 PolarHBondContact O-N 3.01Å; R1378-F1412 PolarHBondContact NH1-O 2.89Å
1379L76.5Confident70.1Confident0 Ų039 Ų390%020%0.204CC..THydrogen-bonded Turntrans-10513.4174.1-65.3170.7000113.9T1318 I1321 I1322 L1351 C1375 S1376 I1377 A1381 F1382 I1387T1318-L1379 HydrophobicContact CG2-CD1 4.27Å; T1318-L1379 HydrophobicContact CG2-CD2 4.13Å; T1318-L1379 HydrophobicContact CG2-CG 3.93Å; I1321-L1379 HydrophobicContact CG2-CD2 4.01Å; I1322-L1379 HydrophobicContact CG1-CD2 4.44Å; L1351-L1379 HydrophobicContact CD2-CD1 3.72Å; L1351-L1379 HydrophobicContact CG-CD1 4.16Å; C1375-L1379 WeakPolarHBondContact O-CB 3.3Å; C1375-L1379 WeakPolarHBondContact O-CD1 3.41Å; C1375-L1379 WeakPolarHBondContact O-CG 3.28Å; C1375-L1379 PolarHBondContact O-N 3.22Å; C1375-L1379 VanDerWaalsContact O-N 3.17Å; S1376-L1379 CarbonylContact O-C 3.58Å; S1376-L1379 PolarHBondContact O-N 3.03Å; S1376-L1379 VanDerWaalsContact O-N 3.09Å; I1377-L1379 PolarHBondContact O-N 3.2Å; I1377-L1379 VanDerWaalsContact O-N 3.1Å; L1379-A1381 PolarHBondContact O-N 3.31Å; L1379-A1381 VanDerWaalsContact O-N 3.08Å; L1379-F1382 HydrophobicContact CB-CD2 4.11Å; L1379-F1382 HydrophobicContact CD2-CD2 3.66Å; L1379-F1382 HydrophobicContact CD2-CE2 3.58Å; L1379-F1382 HydrophobicContact CD2-CZ 4.38Å; L1379-F1382 WeakPolarHBondContact O-CB 3.41Å; L1379-F1382 WeakPolarHBondContact O-CD2 3.39Å; L1379-F1382 PolarHBondContact O-N 3.35Å; L1379-I1387 HydrophobicContact CB-CD1 4.48Å; L1379-I1387 WeakPolarHBondContact O-CD1 3.4Å
1380I69.6Low70Confident42 Ų4239.2 Ų39.222%0.21520%0.204CC..THydrogen-bonded Turntrans-55.1-30.3-178.3-163.5166.5000114.2S1376 I1377 F1382 P1384 I1387 L1478S1376-I1380 PolarHBondContact O-N 3.17Å; I1377-I1380 VanDerWaalsContact O-CB 3.28Å; I1377-I1380 WeakPolarHBondContact O-CB 3.3Å; I1377-I1380 VanDerWaalsContact O-CG2 3.29Å; I1377-I1380 WeakPolarHBondContact O-CG2 3.15Å; I1377-I1380 PolarHBondContact O-N 3.13Å; I1380-F1382 PolarHBondContact O-N 2.9Å; I1380-P1384 HydrophobicContact CG1-CB 4.15Å; I1380-P1384 WeakPolarHBondContact O-CA 3.4Å; I1380-P1384 WeakPolarHBondContact O-CB 3.35Å; I1380-P1384 VanDerWaalsContact O-CD 3.27Å; I1380-P1384 WeakPolarHBondContact O-CD 3.22Å; I1380-I1387 HydrophobicContact CB-CD1 4.48Å; I1380-I1387 HydrophobicContact CD1-CG2 4.48Å; I1380-I1387 HydrophobicContact CG1-CG2 4.28Å; I1380-L1478 HydrophobicContact CD1-CD2 4.23Å
1381A67.8Low70Confident88 Ų8839.1 Ų39.173%0.72721%0.205SC*.THydrogen-bonded Turntrans-68.4-16176.500000114.8L1379L1379-A1381 PolarHBondContact O-N 3.31Å; L1379-A1381 VanDerWaalsContact O-N 3.08Å
1382F75.5Confident69.7Low20 Ų2041.3 Ų41.39%0.08823%0.23CC..THydrogen-bonded Turntrans-87.9-42.9-178.1-67.7-96.7000112.4I1321 S1325 L1344 F1345 L1379 I1380I1321-F1382 HydrophobicContact CG2-CE1 3.79Å; I1321-F1382 HydrophobicContact CG2-CE2 3.91Å; I1321-F1382 HydrophobicContact CG2-CZ 3.27Å; S1325-F1382 WeakPolarHBondContact OG-CZ 3.27Å; L1344-F1382 HydrophobicContact CD2-CE1 4.25Å; L1344-F1382 HydrophobicContact CD2-CZ 4.32Å; F1345-F1382 AromaticContact CD2-CD1 3.8Å; F1345-F1382 HydrophobicContact CD2-CD1 3.8Å; F1345-F1382 HydrophobicContact CD2-CE1 4.37Å; F1345-F1382 HydrophobicContact CE2-CB 4.5Å; F1345-F1382 HydrophobicContact CE2-CD1 4.32Å; F1345-F1382 WeakPolarHBondContact CE2-O 3.5Å; F1345-F1382 HydrophobicContact CG-CD1 4.46Å; F1345-F1382 VanDerWaalsContact CZ-O 3.3Å; F1345-F1382 WeakPolarHBondContact CZ-O 3.45Å; L1379-F1382 HydrophobicContact CB-CD2 4.11Å; L1379-F1382 HydrophobicContact CD2-CD2 3.66Å; L1379-F1382 HydrophobicContact CD2-CE2 3.58Å; L1379-F1382 HydrophobicContact CD2-CZ 4.38Å; L1379-F1382 WeakPolarHBondContact O-CB 3.41Å; L1379-F1382 WeakPolarHBondContact O-CD2 3.39Å; L1379-F1382 PolarHBondContact O-N 3.35Å; I1380-F1382 PolarHBondContact O-N 2.9Å
1383N73.9Confident69.5Low45 Ų4549 Ų4924%0.24126%0.264CS..  trans-15381175.8-171.5-17.4000111.1N1349 L1352 K1385 L1386 I1387N1349-N1383 WeakPolarHBondContact OD1-CB 3.43Å; L1352-N1383 HydrophobicContact CD2-CB 3.73Å; N1383-K1385 PolarHBondContact O-N 3Å; N1383-K1385 PolarHBondContact OD1-N 2.85Å; N1383-L1386 HydrophobicContact CB-CB 4.28Å; N1383-L1386 PolarHBondContact O-N 3.03Å; N1383-L1386 WeakPolarHBondContact OD1-CB 3.2Å; N1383-L1386 PolarHBondContact OD1-N 2.9Å; N1383-I1387 PolarHBondContact O-N 3.48Å
1384P69.4Low69.4Low62 Ų6249.9 Ų49.940%0.40327%0.268SS..Hα-helixtrans-63.7-30.3-176.624.3-32.9000111.9I1380 I1387 I1388I1380-P1384 HydrophobicContact CG1-CB 4.15Å; I1380-P1384 WeakPolarHBondContact O-CA 3.4Å; I1380-P1384 WeakPolarHBondContact O-CB 3.35Å; I1380-P1384 VanDerWaalsContact O-CD 3.27Å; I1380-P1384 WeakPolarHBondContact O-CD 3.22Å; P1384-I1387 PolarHBondContact O-N 2.97Å; P1384-I1388 HydrophobicContact CB-CD1 4.46Å; P1384-I1388 WeakPolarHBondContact O-CB 3.42Å; P1384-I1388 WeakPolarHBondContact O-CD1 3.39Å; P1384-I1388 WeakPolarHBondContact O-CG1 3.29Å; P1384-I1388 PolarHBondContact O-N 3.15Å
1385K70.4Confident69.3Low166 Ų16653.1 Ų53.172%0.72229%0.289SS*.Hα-helixtrans-61.9-48.4178.3-68.3-172.1176.7-174.50111.9N1383 I1387 Q1389N1383-K1385 PolarHBondContact O-N 3Å; N1383-K1385 PolarHBondContact OD1-N 2.85Å; K1385-I1387 VanDerWaalsContact C-N 3.35Å; K1385-Q1389 VanDerWaalsContact O-CB 3.31Å; K1385-Q1389 WeakPolarHBondContact O-CB 3.37Å; K1385-Q1389 VanDerWaalsContact O-CG 3.23Å; K1385-Q1389 WeakPolarHBondContact O-CG 3.37Å; K1385-Q1389 PolarHBondContact O-N 2.99Å
1386L70.2Confident68.6Low20 Ų2055.1 Ų55.111%0.10530%0.299CS..Hα-helixtrans-65.1-40179.1-172.1166.7000111.2L1352 N1353 N1356 N1383 Q1389 F1390L1352-L1386 HydrophobicContact CD1-CD2 4Å; L1352-L1386 HydrophobicContact CD2-CB 4.28Å; L1352-L1386 HydrophobicContact CD2-CD1 4.07Å; L1352-L1386 HydrophobicContact CD2-CD2 3.91Å; L1352-L1386 HydrophobicContact CD2-CG 4.32Å; L1352-L1386 HydrophobicContact CG-CD1 4.18Å; L1352-L1386 HydrophobicContact CG-CD2 3.74Å; N1353-L1386 WeakPolarHBondContact OD1-CD1 3.35Å; N1356-L1386 HydrophobicContact CB-CD2 4.17Å; N1356-L1386 VanDerWaalsContact ND2-CD2 3.26Å; N1356-L1386 WeakPolarHBondContact ND2-CD2 3.18Å; N1383-L1386 HydrophobicContact CB-CB 4.28Å; N1383-L1386 PolarHBondContact O-N 3.03Å; N1383-L1386 WeakPolarHBondContact OD1-CB 3.2Å; N1383-L1386 PolarHBondContact OD1-N 2.9Å; L1386-Q1389 PolarHBondContact O-N 2.85Å; L1386-F1390 WeakPolarHBondContact O-CB 3.24Å; L1386-F1390 PolarHBondContact O-N 3.09Å
1387I65.8Low68.1Low0 Ų061.5 Ų61.50%033%0.329CS..Hα-helixtrans-71.9-42-178.1-71.8156.6000111.8L1352 S1376 L1379 I1380 N1383 P1384 K1385 F1390 I1391L1352-I1387 HydrophobicContact CD1-CD1 3.86Å; L1352-I1387 HydrophobicContact CD1-CG1 3.63Å; L1352-I1387 HydrophobicContact CD2-CD1 3.66Å; L1352-I1387 HydrophobicContact CD2-CG1 3.83Å; L1352-I1387 HydrophobicContact CG-CD1 4.41Å; L1352-I1387 HydrophobicContact CG-CG1 4.35Å; S1376-I1387 WeakPolarHBondContact O-CD1 3.47Å; L1379-I1387 HydrophobicContact CB-CD1 4.48Å; L1379-I1387 WeakPolarHBondContact O-CD1 3.4Å; I1380-I1387 HydrophobicContact CB-CD1 4.48Å; I1380-I1387 HydrophobicContact CD1-CG2 4.48Å; I1380-I1387 HydrophobicContact CG1-CG2 4.28Å; N1383-I1387 PolarHBondContact O-N 3.48Å; P1384-I1387 PolarHBondContact O-N 2.97Å; K1385-I1387 VanDerWaalsContact C-N 3.35Å; I1387-F1390 PolarHBondContact O-N 3.45Å; I1387-F1390 VanDerWaalsContact O-N 3.14Å; I1387-I1391 HydrophobicContact CG2-CD1 3.74Å; I1387-I1391 HydrophobicContact CG2-CG1 4.43Å; I1387-I1391 WeakPolarHBondContact O-CG1 3.4Å; I1387-I1391 PolarHBondContact O-N 3.24Å
1388I63.8Low67.9Low91 Ų9162.9 Ų62.947%0.46734%0.336SS..Hα-helixtrans-62.7-42.8172.5-67.4164.6000110.5P1384 F1390 I1391 G1392 L1478P1384-I1388 HydrophobicContact CB-CD1 4.46Å; P1384-I1388 WeakPolarHBondContact O-CB 3.42Å; P1384-I1388 WeakPolarHBondContact O-CD1 3.39Å; P1384-I1388 WeakPolarHBondContact O-CG1 3.29Å; P1384-I1388 PolarHBondContact O-N 3.15Å; I1388-F1390 PolarHBondContact O-N 3.47Å; I1388-I1391 PolarHBondContact O-N 3.48Å; I1388-G1392 PolarHBondContact O-N 3.36Å; I1388-L1478 HydrophobicContact CG1-CD1 4.26Å
1389Q66.4Low67.4Low130 Ų13061.1 Ų61.161%0.60733%0.331SS*.Hα-helixtrans-66.3-20.5174.4-76.2179.8-4.200114.3K1385 L1386 K1393K1385-Q1389 VanDerWaalsContact O-CB 3.31Å; K1385-Q1389 WeakPolarHBondContact O-CB 3.37Å; K1385-Q1389 VanDerWaalsContact O-CG 3.23Å; K1385-Q1389 WeakPolarHBondContact O-CG 3.37Å; K1385-Q1389 PolarHBondContact O-N 2.99Å; L1386-Q1389 PolarHBondContact O-N 2.85Å; Q1389-K1393 VanDerWaalsContact O-CD 3.28Å; Q1389-K1393 WeakPolarHBondContact O-CD 3.3Å; Q1389-K1393 VanDerWaalsContact O-CG 3.27Å; Q1389-K1393 WeakPolarHBondContact O-CG 3.39Å
1390F66.9Low66.7Low17 Ų1762.5 Ų62.58%0.07534%0.339CS..Hα-helixtrans-84.7-49.8173.6172.9-93.9000111.3M1364 Y1372 I1373 L1386 I1387 I1388 G1392 K1393 L1394M1364-F1390 HydrophobicContact CE-CE2 4.21Å; M1364-F1390 HydrophobicContact CE-CZ 4.44Å; Y1372-F1390 HydrophobicContact CD1-CD1 4.28Å; Y1372-F1390 AromaticContact CD1-CE1 3.49Å; Y1372-F1390 HydrophobicContact CD1-CE1 3.49Å; Y1372-F1390 VanDerWaalsContact CD1-CE1 3.49Å; Y1372-F1390 HydrophobicContact CD1-CE2 4.19Å; Y1372-F1390 AromaticContact CD1-CZ 3.44Å; Y1372-F1390 HydrophobicContact CD1-CZ 3.44Å; Y1372-F1390 VanDerWaalsContact CD1-CZ 3.44Å; Y1372-F1390 AromaticContact CE1-CD1 3.57Å; Y1372-F1390 HydrophobicContact CE1-CD1 3.57Å; Y1372-F1390 AromaticContact CE1-CD2 3.84Å; Y1372-F1390 HydrophobicContact CE1-CD2 3.84Å; Y1372-F1390 AromaticContact CE1-CE1 3.16Å; Y1372-F1390 HydrophobicContact CE1-CE1 3.16Å; Y1372-F1390 AromaticContact CE1-CE2 3.46Å; Y1372-F1390 HydrophobicContact CE1-CE2 3.46Å; Y1372-F1390 VanDerWaalsContact CE1-CE2 3.46Å; Y1372-F1390 AromaticContact CE1-CG 3.89Å; Y1372-F1390 HydrophobicContact CE1-CG 3.89Å; Y1372-F1390 AromaticContact CE1-CZ 3.11Å; Y1372-F1390 HydrophobicContact CE1-CZ 3.11Å; Y1372-F1390 HydrophobicContact CE2-CE2 4.35Å; Y1372-F1390 HydrophobicContact CE2-CZ 4.45Å; Y1372-F1390 HydrophobicContact CG-CZ 4.35Å; Y1372-F1390 AromaticContact CZ-CD2 3.87Å; Y1372-F1390 AromaticContact CZ-CE2 3.55Å; Y1372-F1390 AromaticContact CZ-CZ 3.68Å; Y1372-F1390 WeakPolarHBondContact OH-CD2 3.4Å; I1373-F1390 HydrophobicContact CG1-CE1 4.31Å; L1386-F1390 WeakPolarHBondContact O-CB 3.24Å; L1386-F1390 PolarHBondContact O-N 3.09Å; I1387-F1390 PolarHBondContact O-N 3.45Å; I1387-F1390 VanDerWaalsContact O-N 3.14Å; I1388-F1390 PolarHBondContact O-N 3.47Å; F1390-G1392 VanDerWaalsContact C-N 3.32Å; F1390-G1392 PolarHBondContact O-N 2.91Å; F1390-K1393 WeakPolarHBondContact O-CA 3.49Å; F1390-K1393 WeakPolarHBondContact O-CB 3.48Å; F1390-K1393 PolarHBondContact O-N 3.16Å; F1390-L1394 HydrophobicContact CD1-CD1 4.43Å; F1390-L1394 HydrophobicContact CE1-CD1 3.7Å; F1390-L1394 HydrophobicContact CE1-CD2 4.18Å; F1390-L1394 HydrophobicContact CE1-CG 3.97Å; F1390-L1394 HydrophobicContact CZ-CD1 4.19Å; F1390-L1394 HydrophobicContact CZ-CD2 3.81Å; F1390-L1394 HydrophobicContact CZ-CG 4.1Å; F1390-L1394 PolarHBondContact O-N 3.45Å
1391I66.2Low66.4Low25 Ų2566 Ų6613%0.12835%0.353CS..Hα-helixtrans-62.7-41.5-179.4-66.7171.4000110.2I1377 I1387 I1388 K1393 L1394 I1399 L1478I1377-I1391 HydrophobicContact CG1-CD1 4.09Å; I1387-I1391 HydrophobicContact CG2-CD1 3.74Å; I1387-I1391 HydrophobicContact CG2-CG1 4.43Å; I1387-I1391 WeakPolarHBondContact O-CG1 3.4Å; I1387-I1391 PolarHBondContact O-N 3.24Å; I1388-I1391 PolarHBondContact O-N 3.48Å; I1391-K1393 PolarHBondContact O-N 3.05Å; I1391-L1394 PolarHBondContact O-N 2.98Å; I1391-L1394 VanDerWaalsContact O-N 3.09Å; I1391-I1399 HydrophobicContact CG2-CD1 4.17Å; I1391-L1478 HydrophobicContact CD1-CD2 3.72Å
1392G61.8Low66.2Low59 Ų5962.2 Ų62.261%0.60832%0.32SS*.THydrogen-bonded Turntrans-68.33.4172.300000115.6I1388 F1390I1388-G1392 PolarHBondContact O-N 3.36Å; F1390-G1392 VanDerWaalsContact C-N 3.32Å; F1390-G1392 PolarHBondContact O-N 2.91Å
1393K66.3Low65.5Low171 Ų17162 Ų6274%0.74332%0.32SS*.THydrogen-bonded Turntrans-115.80.4171.7-70.9-179.3-175.9-175.10113.3Q1389 F1390 I1391Q1389-K1393 VanDerWaalsContact O-CD 3.28Å; Q1389-K1393 WeakPolarHBondContact O-CD 3.3Å; Q1389-K1393 VanDerWaalsContact O-CG 3.27Å; Q1389-K1393 WeakPolarHBondContact O-CG 3.39Å; F1390-K1393 WeakPolarHBondContact O-CA 3.49Å; F1390-K1393 WeakPolarHBondContact O-CB 3.48Å; F1390-K1393 PolarHBondContact O-N 3.16Å; I1391-K1393 PolarHBondContact O-N 3.05Å
1394L67.1Low64.7Low25 Ų2565.2 Ų65.213%0.13133%0.334CS..SBendtrans-82.4137.7170.5-70.8176.1000109.9L1369 I1373 F1390 I1391 I1399L1369-L1394 HydrophobicContact CD1-CD2 4.16Å; I1373-L1394 HydrophobicContact CD1-CD1 3.68Å; I1373-L1394 HydrophobicContact CG1-CD1 3.85Å; F1390-L1394 HydrophobicContact CD1-CD1 4.43Å; F1390-L1394 HydrophobicContact CE1-CD1 3.7Å; F1390-L1394 HydrophobicContact CE1-CD2 4.18Å; F1390-L1394 HydrophobicContact CE1-CG 3.97Å; F1390-L1394 HydrophobicContact CZ-CD1 4.19Å; F1390-L1394 HydrophobicContact CZ-CD2 3.81Å; F1390-L1394 HydrophobicContact CZ-CG 4.1Å; F1390-L1394 PolarHBondContact O-N 3.45Å; I1391-L1394 PolarHBondContact O-N 2.98Å; I1391-L1394 VanDerWaalsContact O-N 3.09Å; L1394-I1399 HydrophobicContact CB-CD1 4.18Å; L1394-I1399 HydrophobicContact CB-CG1 4.04Å; L1394-I1399 HydrophobicContact CD1-CG1 4.36Å
1395P65.8Low64.2Low73 Ų7367 Ų6747%0.47434%0.337SS..  trans-55.4138.5165.7-23.232.7000111.2E1397 I1398 I1399P1395-E1397 PolarHBondContact O-N 2.94Å; P1395-I1398 HydrophobicContact CB-CD1 4.48Å; P1395-I1398 HydrophobicContact CB-CG1 4.29Å; P1395-I1398 HydrophobicContact CG-CD1 4.12Å; P1395-I1398 HydrophobicContact CG-CG1 4.46Å; P1395-I1398 WeakPolarHBondContact O-CB 3.45Å; P1395-I1398 PolarHBondContact O-N 3.48Å; P1395-I1399 PolarHBondContact O-N 3.26Å
1396L60.3Low63.4Low43 Ų4361.2 Ų61.223%0.22531%0.313CS..Hα-helixtrans-55.6-37.9-176.4-168.670.7000112.1I1398 I1399 V1400 I1449 V1452 Y1470L1396-I1398 PolarHBondContact O-N 2.89Å; L1396-I1399 WeakPolarHBondContact O-CB 3.36Å; L1396-I1399 PolarHBondContact O-N 3.32Å; L1396-V1400 HydrophobicContact CG-CG2 4.49Å; L1396-V1400 WeakPolarHBondContact O-CG2 3.3Å; L1396-V1400 PolarHBondContact O-N 3.08Å; L1396-I1449 HydrophobicContact CD2-CG1 3.91Å; L1396-V1452 HydrophobicContact CD2-CB 4.41Å; L1396-V1452 HydrophobicContact CD2-CG2 4.26Å; L1396-Y1470 HydrophobicContact CD1-CE2 4.45Å
1397E63.7Low62.2Low136 Ų13666 Ų6664%0.63634%0.339SS*.Hα-helixtrans-53.4-35.7175.1-60.5176.6-162.800113.9P1395 K1401P1395-E1397 PolarHBondContact O-N 2.94Å; E1397-K1401 WeakPolarHBondContact O-CB 3.21Å; E1397-K1401 VanDerWaalsContact O-CG 3.3Å; E1397-K1401 WeakPolarHBondContact O-CG 3.4Å; E1397-K1401 PolarHBondContact O-N 3.31Å
1398I66.1Low61Low46 Ų4672.8 Ų72.824%0.23637%0.37CS..Hα-helixtrans-74.6-37.7179.4-59.5-170.4000109.8L1369 I1373 P1395 L1396 F1402L1369-I1398 HydrophobicContact CD2-CD1 3.82Å; L1369-I1398 HydrophobicContact CD2-CG2 3.57Å; L1369-I1398 HydrophobicContact CG-CG2 4.04Å; I1373-I1398 HydrophobicContact CD1-CG2 4.08Å; P1395-I1398 HydrophobicContact CB-CD1 4.48Å; P1395-I1398 HydrophobicContact CB-CG1 4.29Å; P1395-I1398 HydrophobicContact CG-CD1 4.12Å; P1395-I1398 HydrophobicContact CG-CG1 4.46Å; P1395-I1398 WeakPolarHBondContact O-CB 3.45Å; P1395-I1398 PolarHBondContact O-N 3.48Å; L1396-I1398 PolarHBondContact O-N 2.89Å; I1398-F1402 WeakPolarHBondContact O-CB 3.4Å; I1398-F1402 PolarHBondContact O-N 3.45Å
1399I61.8Low59.8Low25 Ų2575.9 Ų75.913%0.12839%0.388CS..Hα-helixtrans-67.1-40.7175.7-57.2175.2000110.1I1391 L1394 P1395 L1396 F1402 I1403I1391-I1399 HydrophobicContact CG2-CD1 4.17Å; L1394-I1399 HydrophobicContact CB-CD1 4.18Å; L1394-I1399 HydrophobicContact CB-CG1 4.04Å; L1394-I1399 HydrophobicContact CD1-CG1 4.36Å; P1395-I1399 PolarHBondContact O-N 3.26Å; L1396-I1399 WeakPolarHBondContact O-CB 3.36Å; L1396-I1399 PolarHBondContact O-N 3.32Å; I1399-F1402 PolarHBondContact O-N 3.15Å; I1399-I1403 HydrophobicContact CG2-CD1 3.98Å; I1399-I1403 VanDerWaalsContact O-CG1 3.3Å; I1399-I1403 WeakPolarHBondContact O-CG1 3.29Å; I1399-I1403 PolarHBondContact O-N 3.28Å
1400V61.3Low58.8Low28 Ų2875.4 Ų75.417%0.1739%0.385CS..Hα-helixtrans-63.6-52.2174.9175.60000110.9L1396 F1402 I1403 E1404 I1445 I1449L1396-V1400 HydrophobicContact CG-CG2 4.49Å; L1396-V1400 WeakPolarHBondContact O-CG2 3.3Å; L1396-V1400 PolarHBondContact O-N 3.08Å; V1400-F1402 VanDerWaalsContact C-N 3.25Å; V1400-F1402 PolarHBondContact O-N 3.45Å; V1400-I1403 PolarHBondContact O-N 3.38Å; V1400-E1404 HydrophobicContact CG1-CG 4.43Å; V1400-E1404 WeakPolarHBondContact O-CG 3.4Å; V1400-E1404 PolarHBondContact O-N 3.28Å; V1400-I1445 HydrophobicContact CG2-CG2 3.95Å; V1400-I1449 HydrophobicContact CG2-CD1 4.34Å
1401K64Low57.9Low116 Ų11679.2 Ų79.250%0.50441%0.406SS..Hα-helixtrans-57.4-37.9176.2-75.9168.2-179.4162.80112.6E1397 E1404 Q1405E1397-K1401 WeakPolarHBondContact O-CB 3.21Å; E1397-K1401 VanDerWaalsContact O-CG 3.3Å; E1397-K1401 WeakPolarHBondContact O-CG 3.4Å; E1397-K1401 PolarHBondContact O-N 3.31Å; K1401-E1404 PolarHBondContact O-N 2.82Å; K1401-Q1405 WeakPolarHBondContact O-CB 3.49Å; K1401-Q1405 VanDerWaalsContact O-CG 3.29Å; K1401-Q1405 WeakPolarHBondContact O-CG 3.44Å; K1401-Q1405 PolarHBondContact O-N 3.42Å
1402F64.1Low57.3Low9 Ų981.2 Ų81.24%0.03941%0.414CS..Hα-helixtrans-62.5-46.5173.8179.2-100.4000111.5F1370 I1373 T1374 I1377 I1398 I1399 V1400 Q1405 I1406F1370-F1402 HydrophobicContact CB-CD2 4.48Å; F1370-F1402 HydrophobicContact CD1-CE2 4.45Å; F1370-F1402 AromaticContact CD2-CD2 3.29Å; F1370-F1402 HydrophobicContact CD2-CD2 3.29Å; F1370-F1402 AromaticContact CD2-CE2 3.5Å; F1370-F1402 HydrophobicContact CD2-CE2 3.5Å; F1370-F1402 HydrophobicContact CD2-CG 4.38Å; F1370-F1402 HydrophobicContact CE1-CE2 4.49Å; F1370-F1402 AromaticContact CE2-CD2 3.59Å; F1370-F1402 HydrophobicContact CE2-CD2 3.59Å; F1370-F1402 AromaticContact CE2-CE2 3.53Å; F1370-F1402 HydrophobicContact CE2-CE2 3.53Å; F1370-F1402 HydrophobicContact CE2-CG 4.49Å; F1370-F1402 HydrophobicContact CE2-CZ 4.41Å; F1370-F1402 HydrophobicContact CG-CD2 4.02Å; F1370-F1402 AromaticContact CG-CE2 3.97Å; F1370-F1402 HydrophobicContact CG-CE2 3.97Å; F1370-F1402 HydrophobicContact CZ-CE2 4.05Å; I1373-F1402 HydrophobicContact CB-CD2 3.92Å; I1373-F1402 HydrophobicContact CB-CE2 3.73Å; I1373-F1402 HydrophobicContact CB-CG 4.42Å; I1373-F1402 HydrophobicContact CB-CZ 4.06Å; I1373-F1402 HydrophobicContact CD1-CB 4.46Å; I1373-F1402 HydrophobicContact CD1-CD2 4.16Å; I1373-F1402 HydrophobicContact CD1-CG 4.32Å; I1373-F1402 HydrophobicContact CG2-CD1 3.73Å; I1373-F1402 HydrophobicContact CG2-CD2 3.83Å; I1373-F1402 HydrophobicContact CG2-CE1 3.52Å; I1373-F1402 HydrophobicContact CG2-CE2 3.65Å; I1373-F1402 HydrophobicContact CG2-CG 3.9Å; I1373-F1402 HydrophobicContact CG2-CZ 3.5Å; T1374-F1402 WeakPolarHBondContact OG1-CE2 3.35Å; T1374-F1402 WeakPolarHBondContact OG1-CZ 3.37Å; I1377-F1402 HydrophobicContact CD1-CE1 3.65Å; I1377-F1402 HydrophobicContact CD1-CZ 4.08Å; I1398-F1402 WeakPolarHBondContact O-CB 3.4Å; I1398-F1402 PolarHBondContact O-N 3.45Å; I1399-F1402 PolarHBondContact O-N 3.15Å; V1400-F1402 VanDerWaalsContact C-N 3.25Å; V1400-F1402 PolarHBondContact O-N 3.45Å; F1402-Q1405 PolarHBondContact O-N 3.33Å; F1402-I1406 HydrophobicContact CD1-CD1 3.61Å; F1402-I1406 HydrophobicContact CD1-CG1 4.24Å; F1402-I1406 HydrophobicContact CE1-CD1 3.33Å; F1402-I1406 HydrophobicContact CE1-CG1 3.91Å; F1402-I1406 HydrophobicContact CZ-CD1 4.05Å; F1402-I1406 HydrophobicContact CZ-CG1 4.16Å; F1402-I1406 VanDerWaalsContact O-CG1 3.29Å; F1402-I1406 WeakPolarHBondContact O-CG1 3.35Å; F1402-I1406 PolarHBondContact O-N 3.01Å
1403I59.5Low57Low14 Ų1478.7 Ų78.77%0.07239%0.387CS..Hα-helixtrans-66.8-35.7177.9-67.6167.6000112.4I1399 V1400 I1406 N1407 L1441 I1445 I1477I1399-I1403 HydrophobicContact CG2-CD1 3.98Å; I1399-I1403 VanDerWaalsContact O-CG1 3.3Å; I1399-I1403 WeakPolarHBondContact O-CG1 3.29Å; I1399-I1403 PolarHBondContact O-N 3.28Å; V1400-I1403 PolarHBondContact O-N 3.38Å; I1403-I1406 HydrophobicContact CB-CD1 4.48Å; I1403-I1406 HydrophobicContact CG1-CD1 4.13Å; I1403-I1406 PolarHBondContact O-N 3.31Å; I1403-N1407 PolarHBondContact O-ND2 3.24Å; I1403-L1441 HydrophobicContact CG2-CD2 3.93Å; I1403-I1445 HydrophobicContact CD1-CD1 3.93Å; I1403-I1445 HydrophobicContact CG2-CD1 3.94Å; I1403-I1477 HydrophobicContact CD1-CG2 4.24Å
1404E58.3Low56.6Low114 Ų11472 Ų7253%0.53336%0.357SS..Hα-helixtrans-63.7-44.8171.8-69.8175.3152.200111.1V1400 K1401 I1406 N1407 H1408V1400-E1404 HydrophobicContact CG1-CG 4.43Å; V1400-E1404 WeakPolarHBondContact O-CG 3.4Å; V1400-E1404 PolarHBondContact O-N 3.28Å; K1401-E1404 PolarHBondContact O-N 2.82Å; E1404-I1406 VanDerWaalsContact C-N 3.34Å; E1404-I1406 PolarHBondContact O-N 2.94Å; E1404-N1407 PolarHBondContact O-N 3.49Å; E1404-H1408 PolarHBondContact O-CD2 3.1Å
1405Q57.4Low56Low100 Ų10071 Ų7147%0.46735%0.351SS..Hα-helixtrans-66.5-29.6175.9-74.1177.1-25.200113.6F1370 K1401 F1402 N1407 H1408F1370-Q1405 HydrophobicContact CD2-CB 3.97Å; F1370-Q1405 HydrophobicContact CE2-CB 3.63Å; K1401-Q1405 WeakPolarHBondContact O-CB 3.49Å; K1401-Q1405 VanDerWaalsContact O-CG 3.29Å; K1401-Q1405 WeakPolarHBondContact O-CG 3.44Å; K1401-Q1405 PolarHBondContact O-N 3.42Å; F1402-Q1405 PolarHBondContact O-N 3.33Å; Q1405-N1407 PolarHBondContact O-N 2.96Å; Q1405-H1408 PolarHBondContact O-N 2.93Å
1406I54.6Low55.6Low43 Ų4371.1 Ų71.122%0.22134%0.343CS..Hα-helixtrans-56.1-36.1175.7-73.7160.1000112F1402 I1403 E1404 H1408 F1412 L1481F1402-I1406 HydrophobicContact CD1-CD1 3.61Å; F1402-I1406 HydrophobicContact CD1-CG1 4.24Å; F1402-I1406 HydrophobicContact CE1-CD1 3.33Å; F1402-I1406 HydrophobicContact CE1-CG1 3.91Å; F1402-I1406 HydrophobicContact CZ-CD1 4.05Å; F1402-I1406 HydrophobicContact CZ-CG1 4.16Å; F1402-I1406 VanDerWaalsContact O-CG1 3.29Å; F1402-I1406 WeakPolarHBondContact O-CG1 3.35Å; F1402-I1406 PolarHBondContact O-N 3.01Å; I1403-I1406 HydrophobicContact CB-CD1 4.48Å; I1403-I1406 HydrophobicContact CG1-CD1 4.13Å; I1403-I1406 PolarHBondContact O-N 3.31Å; E1404-I1406 VanDerWaalsContact C-N 3.34Å; E1404-I1406 PolarHBondContact O-N 2.94Å; I1406-H1408 PolarHBondContact O-N 3.37Å; I1406-F1412 HydrophobicContact CB-CZ 3.98Å; I1406-F1412 HydrophobicContact CG1-CE1 4.11Å; I1406-F1412 HydrophobicContact CG1-CZ 3.67Å; I1406-F1412 HydrophobicContact CG2-CE2 4.26Å; I1406-F1412 HydrophobicContact CG2-CZ 3.87Å; I1406-L1481 HydrophobicContact CD1-CD2 3.75Å
1407N44.9Very low55Low121 Ų12171 Ų7165%0.64735%0.345SS*.THydrogen-bonded Turntrans-71-8.7-179.6-63.7-46.7000113.8I1403 E1404 Q1405I1403-N1407 PolarHBondContact O-ND2 3.24Å; E1404-N1407 PolarHBondContact O-N 3.49Å; Q1405-N1407 PolarHBondContact O-N 2.96Å
1408H40.9Very low53.6Low143 Ų14368 Ų6866%0.66234%0.338SS*.THydrogen-bonded Turntrans-101.536.5-172.8-70.3-58.9000114.5E1404 Q1405 I1406 E1410E1404-H1408 PolarHBondContact O-CD2 3.1Å; Q1405-H1408 PolarHBondContact O-N 2.93Å; I1406-H1408 PolarHBondContact O-N 3.37Å; H1408-E1410 PolarHBondContact O-N 3.43Å
1409N38.9Very low51.8Low156 Ų15670.5 Ų70.583%0.83436%0.36SS*.  trans57.87.7166.7-78.6-14.6000117.8L1411N1409-L1411 PolarHBondContact O-N 3.44Å
1410E43.9Very low50.1Low119 Ų11974 Ų7456%0.55639%0.387SS*.  trans-63.6132.1177.4-67.8-155.9157.300111.1H1408 F1412H1408-E1410 PolarHBondContact O-N 3.43Å; E1410-F1412 WeakPolarHBondContact O-CD2 3.47Å; E1410-F1412 WeakPolarHBondContact O-CE2 3.25Å; E1410-F1412 PolarHBondContact O-N 3.45Å
1411L48.4Very low48.4Very low97 Ų9779.9 Ų79.951%0.50842%0.417SS..  trans-64.596.2-165.5-76.8160.4000112.8N1409 S1413 P1417N1409-L1411 PolarHBondContact O-N 3.44Å; L1411-S1413 PolarHBondContact O-N 3.49Å; L1411-S1413 VanDerWaalsContact O-N 3.07Å; L1411-P1417 HydrophobicContact CD2-CB 3.72Å
1412F53.9Low46.6Very low68 Ų6878 Ų7830%0.29842%0.418SS..SBendtrans-56.7-21.6174.2-74.6-81000114.3F1370 T1374 R1378 I1406 E1410F1370-F1412 HydrophobicContact CZ-CE1 4.11Å; F1370-F1412 AromaticContact CZ-CZ 3.94Å; F1370-F1412 HydrophobicContact CZ-CZ 3.94Å; T1374-F1412 HydrophobicContact CG2-CD1 3.76Å; T1374-F1412 HydrophobicContact CG2-CE1 4.29Å; R1378-F1412 PolarHBondContact NH1-O 2.89Å; I1406-F1412 HydrophobicContact CB-CZ 3.98Å; I1406-F1412 HydrophobicContact CG1-CE1 4.11Å; I1406-F1412 HydrophobicContact CG1-CZ 3.67Å; I1406-F1412 HydrophobicContact CG2-CE2 4.26Å; I1406-F1412 HydrophobicContact CG2-CZ 3.87Å; E1410-F1412 WeakPolarHBondContact O-CD2 3.47Å; E1410-F1412 WeakPolarHBondContact O-CE2 3.25Å; E1410-F1412 PolarHBondContact O-N 3.45Å
1413S56.7Low45Very low5 Ų582.1 Ų82.14%0.03545%0.448CS..  trans-150.3136.4-179.3-176.90000112.2D1319 L1411 L1415 W1416D1319-S1413 VanDerWaalsContact OD1-CB 3.3Å; D1319-S1413 WeakPolarHBondContact OD1-CB 3.47Å; D1319-S1413 PolarHBondContact OD1-OG 2.93Å; D1319-S1413 WeakPolarHBondContact OD2-CA 3.47Å; D1319-S1413 PolarHBondContact OD2-OG 2.71Å; L1411-S1413 PolarHBondContact O-N 3.49Å; L1411-S1413 VanDerWaalsContact O-N 3.07Å; S1413-L1415 PolarHBondContact OG-N 3.32Å; S1413-L1415 VanDerWaalsContact OG-N 3.13Å; S1413-W1416 PolarHBondContact OG-N 2.89Å
1414Y56.3Low43.5Very low32 Ų3285.9 Ų85.913%0.12548%0.475CS..SBendtrans-75.6-30.1165.6-76.5-78.1000112.8V1219 I1224 R1312 C1315 L1316 D1319V1219-Y1414 HydrophobicContact CG2-CD1 4.38Å; V1219-Y1414 HydrophobicContact CG2-CE1 3.99Å; I1224-Y1414 WeakPolarHBondContact CD1-O 3.47Å; I1224-Y1414 WeakPolarHBondContact CG1-O 3.36Å; I1224-Y1414 WeakPolarHBondContact CG2-O 3.25Å; R1312-Y1414 WeakPolarHBondContact CG-OH 3.5Å; C1315-Y1414 HydrophobicContact CB-CD2 3.91Å; C1315-Y1414 HydrophobicContact CB-CE2 3.81Å; L1316-Y1414 HydrophobicContact CB-CD2 4.45Å; D1319-Y1414 PolarHBondContact OD2-N 3.09Å
1415L55Low42Very low2 Ų282.4 Ų82.41%0.0146%0.464CS..SBendtrans-92.9-8.5-178.5-64-174.9000114.1I1224 L1227 R1228 D1319 I1320 Y1323 S1413I1224-L1415 HydrophobicContact CG2-CD2 4.47Å; L1227-L1415 HydrophobicContact CD2-CD2 4.39Å; R1228-L1415 PolarHBondContact NH1-O 3.23Å; R1228-L1415 VanDerWaalsContact NH1-O 3.1Å; D1319-L1415 HydrophobicContact CB-CB 4.19Å; D1319-L1415 HydrophobicContact CB-CD1 3.93Å; D1319-L1415 HydrophobicContact CB-CG 3.88Å; I1320-L1415 HydrophobicContact CG1-CD1 4.25Å; Y1323-L1415 HydrophobicContact CG-CD1 4.19Å; S1413-L1415 PolarHBondContact OG-N 3.32Å; S1413-L1415 VanDerWaalsContact OG-N 3.13Å
1416W58.1Low40.6Very low76 Ų7680.8 Ų80.829%0.28846%0.463SS..  trans-137.268.6170.3-72.3-93.3000110.6I1322 Y1323 S1413 S1418I1322-W1416 HydrophobicContact CG2-CH2 4.11Å; I1322-W1416 HydrophobicContact CG2-CZ3 4.07Å; Y1323-W1416 AromaticContact CD2-CH2 3.56Å; Y1323-W1416 HydrophobicContact CD2-CH2 3.56Å; Y1323-W1416 AromaticContact CD2-CZ2 3.92Å; Y1323-W1416 HydrophobicContact CD2-CZ2 3.92Å; Y1323-W1416 HydrophobicContact CD2-CZ3 4.03Å; Y1323-W1416 HydrophobicContact CE2-CH2 4.41Å; Y1323-W1416 HydrophobicContact CE2-CZ2 4.34Å; Y1323-W1416 HydrophobicContact CG-CH2 4.43Å; S1413-W1416 PolarHBondContact OG-N 2.89Å; W1416-S1418 PolarHBondContact O-N 3.45Å
1417P46.4Very low39.2Very low41 Ų4182.5 Ų82.527%0.26648%0.48SS..SBendtrans-69.1-17.4176.330.4-36.6000113I1224 L1411I1224-P1417 HydrophobicContact CD1-CG 4.46Å; L1411-P1417 HydrophobicContact CD2-CB 3.72Å
1418S34.5Very low38.5Very low72 Ų7280.3 Ų80.350%0.50347%0.473SS..  trans-124.566.5-171.959.50000111.8W1416W1416-S1418 PolarHBondContact O-N 3.45Å
1419S28Very low37.9Very low99 Ų9977.4 Ų77.469%0.69246%0.463SS*.  trans-92.255.5155.358.30000110L1421S1419-L1421 PolarHBondContact O-N 2.84Å
1420S27Very low37.3Very low100 Ų10073 Ų7370%0.69944%0.444SS*.  trans-57.3126.7155.542.60000106.9S1422S1420-S1422 PolarHBondContact O-N 3.25Å
1421L26.5Very low36.5Very low151 Ų15172 Ų7279%0.79145%0.446SS*.  trans-68.390.7-161.5-15675.5000110.7S1419 S1423S1419-L1421 PolarHBondContact O-N 2.84Å; L1421-S1423 PolarHBondContact O-N 3.5Å
1422S25.6Very low35.7Very low76 Ų7672.1 Ų72.153%0.53145%0.446SS..  trans-66.8127.3-170.754.30000110.2S1420 S1424 S1425S1420-S1422 PolarHBondContact O-N 3.25Å; S1422-S1424 PolarHBondContact O-N 2.79Å; S1422-S1425 PolarHBondContact O-N 2.91Å; S1422-S1425 PolarHBondContact O-OG 3.44Å
1423S30.3Very low34.5Very low96 Ų9670.3 Ų70.367%0.67144%0.442SS*.G310 helixtrans-61-14.9-167.150.70000114.4L1421 S1425 S1426L1421-S1423 PolarHBondContact O-N 3.5Å; S1423-S1425 PolarHBondContact O-N 2.87Å; S1423-S1426 VanDerWaalsContact O-CB 3.28Å; S1423-S1426 WeakPolarHBondContact O-CB 3.35Å; S1423-S1426 PolarHBondContact O-N 2.77Å; S1423-S1426 PolarHBondContact O-OG 3.26Å
1424S26.9Very low33.2Very low92 Ų9274.2 Ų74.264%0.64347%0.469SS*.G310 helixtrans-60.4-21.9170.148.80000114.3S1422 S1427S1422-S1424 PolarHBondContact O-N 2.79Å; S1424-S1427 PolarHBondContact O-OG 2.89Å
1425S27.6Very low32.1Very low41 Ų4179.2 Ų79.229%0.28750%0.497SS..G310 helixtrans-82.4-15.117160.60000114S1422 S1423 S1427 S1428 L1429S1422-S1425 PolarHBondContact O-N 2.91Å; S1422-S1425 PolarHBondContact O-OG 3.44Å; S1423-S1425 PolarHBondContact O-N 2.87Å; S1425-S1427 VanDerWaalsContact C-N 3.3Å; S1425-S1427 PolarHBondContact O-N 3.37Å; S1425-S1428 PolarHBondContact O-OG 2.99Å; S1425-L1429 WeakPolarHBondContact O-CG 3.37Å; S1425-L1429 PolarHBondContact O-N 2.91Å
1426S28.4Very low31.1Very low66 Ų6682.2 Ų82.246%0.46252%0.515SS..Hα-helixtrans-69.6-24.7-177.272.20000113.7S1423 L1429 S1430S1423-S1426 VanDerWaalsContact O-CB 3.28Å; S1423-S1426 WeakPolarHBondContact O-CB 3.35Å; S1423-S1426 PolarHBondContact O-N 2.77Å; S1423-S1426 PolarHBondContact O-OG 3.26Å; S1426-L1429 PolarHBondContact O-N 3.45Å; S1426-S1430 WeakPolarHBondContact O-CB 3.33Å; S1426-S1430 PolarHBondContact O-N 3.19Å; S1426-S1430 PolarHBondContact O-OG 3.35Å
1427S26Very low29.8Very low80 Ų8085.8 Ų85.856%0.55954%0.535SS*.Hα-helixtrans-79.5-27.6-177.157.20000114.1S1424 S1425 S1430S1424-S1427 PolarHBondContact O-OG 2.89Å; S1425-S1427 VanDerWaalsContact C-N 3.3Å; S1425-S1427 PolarHBondContact O-N 3.37Å; S1427-S1430 PolarHBondContact O-OG 3.04Å; S1427-S1430 VanDerWaalsContact O-OG 3.07Å
1428S29.3Very low29.4Very low74 Ų7488 Ų8852%0.51755%0.551SS.*Hα-helixtrans-81.6-32.4166.452.90000111.4S1425S1425-S1428 PolarHBondContact O-OG 2.99Å
1429L27.5Very low29.4Very low83 Ų8390.1 Ų90.144%0.43555%0.549SS..Hα-helixtrans-66.7-36.5173.5-77.9167.9000113.1S1425 S1426 T1431 I1432 S1433S1425-L1429 WeakPolarHBondContact O-CG 3.37Å; S1425-L1429 PolarHBondContact O-N 2.91Å; S1426-L1429 PolarHBondContact O-N 3.45Å; L1429-T1431 PolarHBondContact O-N 3.14Å; L1429-I1432 CarbonylContact O-C 3.58Å; L1429-I1432 PolarHBondContact O-N 3.11Å; L1429-S1433 WeakPolarHBondContact O-CB 3.27Å; L1429-S1433 PolarHBondContact O-N 2.97Å
1430S27Very low30.3Very low63 Ų6388.1 Ų88.144%0.44154%0.535SS..Hα-helixtrans-62.3-31.4-179.961.20000113.4S1426 S1427 I1432 S1433 S1434S1426-S1430 WeakPolarHBondContact O-CB 3.33Å; S1426-S1430 PolarHBondContact O-N 3.19Å; S1426-S1430 PolarHBondContact O-OG 3.35Å; S1427-S1430 PolarHBondContact O-OG 3.04Å; S1427-S1430 VanDerWaalsContact O-OG 3.07Å; S1430-I1432 VanDerWaalsContact C-N 3.3Å; S1430-I1432 PolarHBondContact O-N 2.97Å; S1430-S1433 WeakPolarHBondContact CA-OG 3.26Å; S1430-S1433 PolarHBondContact O-OG 3.33Å; S1430-S1434 PolarHBondContact O-N 2.86Å; S1430-S1434 VanDerWaalsContact O-N 3.15Å
1431T27.5Very low31.1Very low97 Ų9786.3 Ų86.360%0.59552%0.517SS*.Hα-helixtrans-74.7-21.2176.7-45.20000112.3L1429 S1434L1429-T1431 PolarHBondContact O-N 3.14Å; T1431-S1434 PolarHBondContact O-OG 2.99Å; T1431-S1434 VanDerWaalsContact O-OG 3.05Å
1432I30.3Very low31.9Very low100 Ų10085.4 Ų85.451%0.51351%0.507SS..Hα-helixtrans-96.1-31175.3-62.5176.4000110.7L1429 S1430 I1435 T1436L1429-I1432 CarbonylContact O-C 3.58Å; L1429-I1432 PolarHBondContact O-N 3.11Å; S1430-I1432 VanDerWaalsContact C-N 3.3Å; S1430-I1432 PolarHBondContact O-N 2.97Å; I1432-I1435 PolarHBondContact O-N 3.42Å; I1432-I1435 VanDerWaalsContact O-N 3.16Å; I1432-T1436 PolarHBondContact O-N 3.27Å; I1432-T1436 VanDerWaalsContact O-N 3.16Å; I1432-T1436 PolarHBondContact O-OG1 3.01Å
1433S29.2Very low33Very low30 Ų3084.9 Ų84.921%0.2150%0.498CS..Hα-helixtrans-71-30.8177.6830000111.6L1429 S1430 I1435 T1436 H1437L1429-S1433 WeakPolarHBondContact O-CB 3.27Å; L1429-S1433 PolarHBondContact O-N 2.97Å; S1430-S1433 WeakPolarHBondContact CA-OG 3.26Å; S1430-S1433 PolarHBondContact O-OG 3.33Å; S1433-I1435 PolarHBondContact O-N 3.48Å; S1433-I1435 VanDerWaalsContact O-N 3.15Å; S1433-T1436 CarbonylContact O-C 3.57Å; S1433-T1436 PolarHBondContact O-N 3.21Å; S1433-H1437 VanDerWaalsContact C-CD2 3.4Å; S1433-H1437 VanDerWaalsContact CB-CD2 3.47Å; S1433-H1437 WeakPolarHBondContact CB-CD2 3.35Å; S1433-H1437 VanDerWaalsContact CB-NE2 3.29Å; S1433-H1437 WeakPolarHBondContact CB-NE2 3.38Å; S1433-H1437 WeakPolarHBondContact O-CB 3.4Å; S1433-H1437 PolarHBondContact O-CD2 3.49Å; S1433-H1437 VanDerWaalsContact O-CG 3.26Å; S1433-H1437 PolarHBondContact O-N 2.95Å; S1433-H1437 PolarHBondContact OG-CD2 2.87Å; S1433-H1437 PolarHBondContact OG-NE2 3.39Å
1434S28.9Very low33.7Very low88 Ų8881.2 Ų81.262%0.61547%0.471SS*.Hα-helixtrans-56.1-28.4168.963.60000113.6S1430 T1431S1430-S1434 PolarHBondContact O-N 2.86Å; S1430-S1434 VanDerWaalsContact O-N 3.15Å; T1431-S1434 PolarHBondContact O-OG 2.99Å; T1431-S1434 VanDerWaalsContact O-OG 3.05Å
1435I33.8Very low34.5Very low137 Ų13777.8 Ų77.870%0.70345%0.445SS*.Hα-helixtrans-93-16.7177.1-61.2177000112.1I1432 S1433I1432-I1435 PolarHBondContact O-N 3.42Å; I1432-I1435 VanDerWaalsContact O-N 3.16Å; S1433-I1435 PolarHBondContact O-N 3.48Å; S1433-I1435 VanDerWaalsContact O-N 3.15Å
1436T33.9Very low35.5Very low64 Ų6480.3 Ų80.339%0.39345%0.452SS..Hα-helixtrans-127.53.7-170.8550000116.2I1432 S1433 S1438I1432-T1436 PolarHBondContact O-N 3.27Å; I1432-T1436 VanDerWaalsContact O-N 3.16Å; I1432-T1436 PolarHBondContact O-OG1 3.01Å; S1433-T1436 CarbonylContact O-C 3.57Å; S1433-T1436 PolarHBondContact O-N 3.21Å; T1436-S1438 PolarHBondContact O-N 2.89Å; T1436-S1438 VanDerWaalsContact O-N 3.13Å
1437H31.8Very low36.5Very low152 Ų15281.4 Ų81.470%0.70445%0.45SS*.THydrogen-bonded Turntrans-67.4-6.4178.9-95.8-52.2000115.1S1433S1433-H1437 VanDerWaalsContact C-CD2 3.4Å; S1433-H1437 VanDerWaalsContact CB-CD2 3.47Å; S1433-H1437 WeakPolarHBondContact CB-CD2 3.35Å; S1433-H1437 VanDerWaalsContact CB-NE2 3.29Å; S1433-H1437 WeakPolarHBondContact CB-NE2 3.38Å; S1433-H1437 WeakPolarHBondContact O-CB 3.4Å; S1433-H1437 PolarHBondContact O-CD2 3.49Å; S1433-H1437 VanDerWaalsContact O-CG 3.26Å; S1433-H1437 PolarHBondContact O-N 2.95Å; S1433-H1437 PolarHBondContact OG-CD2 2.87Å; S1433-H1437 PolarHBondContact OG-NE2 3.39Å
1438S38Very low37.4Very low87 Ų8777.8 Ų77.861%0.60843%0.425SS*.THydrogen-bonded Turntrans-76.4-15.8178.148.70000114.8T1436T1436-S1438 PolarHBondContact O-N 2.89Å; T1436-S1438 VanDerWaalsContact O-N 3.13Å
1439Y34.9Very low38.1Very low116 Ų11677 Ų7746%0.45541%0.414SS..  trans-139.7119.5-179.6-61.6-73.9000112D1443Y1439-D1443 HydrophobicContact CD1-CB 4.23Å
1440S45.2Very low39.3Very low57 Ų5775.9 Ų75.940%0.39941%0.413SS..  trans-66.8163.6166.178.80000110.3K1442 D1443 L1444S1440-K1442 PolarHBondContact O-N 2.95Å; S1440-K1442 PolarHBondContact OG-N 2.91Å; S1440-D1443 WeakPolarHBondContact CA-OD2 3.48Å; S1440-D1443 WeakPolarHBondContact CB-OD2 3.11Å; S1440-D1443 PolarHBondContact N-OD2 3.5Å; S1440-D1443 PolarHBondContact O-N 2.86Å; S1440-D1443 PolarHBondContact OG-N 3.49Å; S1440-D1443 PolarHBondContact OG-OD2 2.94Å; S1440-L1444 PolarHBondContact O-N 3.1Å
1441L43.9Very low40.3Very low62 Ų6274.4 Ų74.433%0.32540%0.4SS..Hα-helixtrans-59.9-31.8174.3-170.769.7000111.4I1403 I1445 I1477 K1480I1403-L1441 HydrophobicContact CG2-CD2 3.93Å; L1441-I1445 HydrophobicContact CG-CD1 4.08Å; L1441-I1445 WeakPolarHBondContact O-CD1 3.41Å; L1441-I1445 VanDerWaalsContact O-CG1 3.26Å; L1441-I1445 WeakPolarHBondContact O-CG1 3.35Å; L1441-I1445 PolarHBondContact O-N 3.12Å; L1441-I1445 VanDerWaalsContact O-N 3.11Å; L1441-I1477 HydrophobicContact CD1-CG1 4.44Å; L1441-K1480 HydrophobicContact CD1-CD 3.93Å
1442K43.9Very low41.1Very low132 Ų13271.8 Ų71.857%0.57438%0.384SS*.Hα-helixtrans-67.5-43.5177.4-173.5170.8-178.9-750111.9S1440 L1444 I1445 E1446S1440-K1442 PolarHBondContact O-N 2.95Å; S1440-K1442 PolarHBondContact OG-N 2.91Å; K1442-L1444 VanDerWaalsContact C-N 3.3Å; K1442-L1444 PolarHBondContact O-N 3.03Å; K1442-I1445 CarbonylContact O-C 3.59Å; K1442-I1445 PolarHBondContact O-N 3.44Å; K1442-I1445 VanDerWaalsContact O-N 3.14Å; K1442-E1446 WeakPolarHBondContact CE-OE1 3.4Å; K1442-E1446 IonicContact NZ-OE1 3.01Å; K1442-E1446 PolarHBondContact NZ-OE1 3.01Å; K1442-E1446 PolarHBondContact O-N 3.46Å
1443D48Very low42Very low66 Ų6671.1 Ų71.135%0.35338%0.382SS..Hα-helixtrans-64.6-37.3178.3-47.9-49.9000111.4Y1439 S1440 I1445 E1446 Q1447Y1439-D1443 HydrophobicContact CD1-CB 4.23Å; S1440-D1443 WeakPolarHBondContact CA-OD2 3.48Å; S1440-D1443 WeakPolarHBondContact CB-OD2 3.11Å; S1440-D1443 PolarHBondContact N-OD2 3.5Å; S1440-D1443 PolarHBondContact O-N 2.86Å; S1440-D1443 PolarHBondContact OG-N 3.49Å; S1440-D1443 PolarHBondContact OG-OD2 2.94Å; D1443-I1445 VanDerWaalsContact C-N 3.31Å; D1443-I1445 PolarHBondContact O-N 3.4Å; D1443-E1446 PolarHBondContact O-N 3.29Å; D1443-Q1447 WeakPolarHBondContact O-CB 3.26Å; D1443-Q1447 WeakPolarHBondContact O-CG 3.16Å; D1443-Q1447 PolarHBondContact O-N 3.33Å
1444L46Very low42.9Very low18 Ų1873.9 Ų73.99%0.09439%0.394CS..Hα-helixtrans-66-34.1175.5-147.788.5000112.2S1440 K1442 S1448 T1473 I1476 I1477S1440-L1444 PolarHBondContact O-N 3.1Å; K1442-L1444 VanDerWaalsContact C-N 3.3Å; K1442-L1444 PolarHBondContact O-N 3.03Å; L1444-S1448 PolarHBondContact O-N 3.44Å; L1444-S1448 PolarHBondContact O-OG 2.96Å; L1444-T1473 HydrophobicContact CD2-CG2 3.97Å; L1444-T1473 HydrophobicContact CG-CG2 4.05Å; L1444-I1476 HydrophobicContact CD2-CB 4.06Å; L1444-I1476 HydrophobicContact CD2-CG2 3.58Å; L1444-I1477 HydrophobicContact CD2-CG1 4.12Å
1445I43.1Very low43.5Very low21 Ų2171.7 Ų71.711%0.10838%0.378CS..Hα-helixtrans-74.2-42.6174.4-70.9165.8000110.6V1400 I1403 L1441 K1442 D1443 Q1447 S1448 I1449 I1477V1400-I1445 HydrophobicContact CG2-CG2 3.95Å; I1403-I1445 HydrophobicContact CD1-CD1 3.93Å; I1403-I1445 HydrophobicContact CG2-CD1 3.94Å; L1441-I1445 HydrophobicContact CG-CD1 4.08Å; L1441-I1445 WeakPolarHBondContact O-CD1 3.41Å; L1441-I1445 VanDerWaalsContact O-CG1 3.26Å; L1441-I1445 WeakPolarHBondContact O-CG1 3.35Å; L1441-I1445 PolarHBondContact O-N 3.12Å; L1441-I1445 VanDerWaalsContact O-N 3.11Å; K1442-I1445 CarbonylContact O-C 3.59Å; K1442-I1445 PolarHBondContact O-N 3.44Å; K1442-I1445 VanDerWaalsContact O-N 3.14Å; D1443-I1445 VanDerWaalsContact C-N 3.31Å; D1443-I1445 PolarHBondContact O-N 3.4Å; I1445-Q1447 PolarHBondContact O-N 3.36Å; I1445-S1448 WeakPolarHBondContact CA-OG 3.39Å; I1445-S1448 PolarHBondContact O-N 3.05Å; I1445-S1448 PolarHBondContact O-OG 3.08Å; I1445-I1449 HydrophobicContact CG2-CD1 3.73Å; I1445-I1449 HydrophobicContact CG2-CG1 4.37Å; I1445-I1449 WeakPolarHBondContact O-CB 3.29Å; I1445-I1449 VanDerWaalsContact O-CG1 3.27Å; I1445-I1449 WeakPolarHBondContact O-CG1 3.36Å; I1445-I1449 PolarHBondContact O-N 3.39Å; I1445-I1477 HydrophobicContact CG1-CD1 4.46Å
1446E49.9Very low44Very low94 Ų9471.2 Ų71.244%0.43938%0.377SS..Hα-helixtrans-65.8-36.1175.9-75.2-178.7-162.700112.3K1442 D1443 S1450K1442-E1446 WeakPolarHBondContact CE-OE1 3.4Å; K1442-E1446 IonicContact NZ-OE1 3.01Å; K1442-E1446 PolarHBondContact NZ-OE1 3.01Å; K1442-E1446 PolarHBondContact O-N 3.46Å; D1443-E1446 PolarHBondContact O-N 3.29Å; E1446-S1450 VanDerWaalsContact O-CB 3.28Å; E1446-S1450 WeakPolarHBondContact O-CB 3.32Å; E1446-S1450 PolarHBondContact O-N 2.95Å
1447Q49.2Very low44.7Very low88 Ų8874.3 Ų74.341%0.41139%0.391SS..Hα-helixtrans-63-43169.7-79.7-173.8-11.400112.3D1443 I1445 S1450 L1451D1443-Q1447 WeakPolarHBondContact O-CB 3.26Å; D1443-Q1447 WeakPolarHBondContact O-CG 3.16Å; D1443-Q1447 PolarHBondContact O-N 3.33Å; I1445-Q1447 PolarHBondContact O-N 3.36Å; Q1447-S1450 WeakPolarHBondContact O-CB 3.48Å; Q1447-S1450 PolarHBondContact O-N 2.9Å; Q1447-L1451 VanDerWaalsContact O-CD1 3.31Å; Q1447-L1451 WeakPolarHBondContact O-CD1 3.47Å; Q1447-L1451 PolarHBondContact O-N 2.92Å
1448S44Very low45Very low5 Ų572.1 Ų72.14%0.03539%0.385CS..Hα-helixtrans-72.9-32.5178.640.60000113.1L1444 I1445 L1451 V1452L1444-S1448 PolarHBondContact O-N 3.44Å; L1444-S1448 PolarHBondContact O-OG 2.96Å; I1445-S1448 WeakPolarHBondContact CA-OG 3.39Å; I1445-S1448 PolarHBondContact O-N 3.05Å; I1445-S1448 PolarHBondContact O-OG 3.08Å; S1448-L1451 PolarHBondContact O-N 2.93Å; S1448-V1452 WeakPolarHBondContact O-CG2 3.09Å; S1448-V1452 PolarHBondContact O-N 2.95Å
1449I45.2Very low45.2Very low56 Ų5676.8 Ų76.829%0.28740%0.403SS..Hα-helixtrans-63-42.2167-69.3166.2000110.3L1396 V1400 I1445 V1452 N1453L1396-I1449 HydrophobicContact CD2-CG1 3.91Å; V1400-I1449 HydrophobicContact CG2-CD1 4.34Å; I1445-I1449 HydrophobicContact CG2-CD1 3.73Å; I1445-I1449 HydrophobicContact CG2-CG1 4.37Å; I1445-I1449 WeakPolarHBondContact O-CB 3.29Å; I1445-I1449 VanDerWaalsContact O-CG1 3.27Å; I1445-I1449 WeakPolarHBondContact O-CG1 3.36Å; I1445-I1449 PolarHBondContact O-N 3.39Å; I1449-V1452 PolarHBondContact O-N 2.95Å; I1449-N1453 WeakPolarHBondContact CG2-ND2 3.37Å; I1449-N1453 VanDerWaalsContact O-CB 3.3Å; I1449-N1453 WeakPolarHBondContact O-CB 3.36Å; I1449-N1453 VanDerWaalsContact O-CG 3.23Å; I1449-N1453 PolarHBondContact O-N 3.1Å; I1449-N1453 PolarHBondContact O-ND2 3.1Å
1450S51.2Low45.6Very low60 Ų6075.5 Ų75.542%0.4241%0.411SS..Hα-helixtrans-63.1-44.4176-175.20000112.1E1446 Q1447 N1454E1446-S1450 VanDerWaalsContact O-CB 3.28Å; E1446-S1450 WeakPolarHBondContact O-CB 3.32Å; E1446-S1450 PolarHBondContact O-N 2.95Å; Q1447-S1450 WeakPolarHBondContact O-CB 3.48Å; Q1447-S1450 PolarHBondContact O-N 2.9Å; S1450-N1454 WeakPolarHBondContact O-CB 3.38Å; S1450-N1454 PolarHBondContact O-N 3.45Å; S1450-N1454 PolarHBondContact O-ND2 3.06Å
1451L48.3Very low45.6Very low32 Ų3281.8 Ų81.817%0.16843%0.434CS..Hα-helixtrans-56.4-51.4172.4-100.677000111.6Q1447 S1448 N1454 C1455 L1466 Q1469Q1447-L1451 VanDerWaalsContact O-CD1 3.31Å; Q1447-L1451 WeakPolarHBondContact O-CD1 3.47Å; Q1447-L1451 PolarHBondContact O-N 2.92Å; S1448-L1451 PolarHBondContact O-N 2.93Å; L1451-N1454 PolarHBondContact O-N 3.08Å; L1451-C1455 PolarHBondContact O-N 2.87Å; L1451-C1455 PolarHBondContact O-SG 3.3Å; L1451-C1455 VanDerWaalsContact O-SG 3.33Å; L1451-L1466 HydrophobicContact CB-CD2 4.37Å; L1451-L1466 HydrophobicContact CD2-CD2 4.27Å; L1451-L1466 HydrophobicContact CD2-CG 4Å; L1451-L1466 HydrophobicContact CG-CD2 4.04Å; L1451-L1466 HydrophobicContact CG-CG 4.15Å; L1451-Q1469 HydrophobicContact CD2-CB 3.79Å
1452V44.5Very low45.6Very low42 Ų4284.2 Ų84.226%0.25545%0.447SS..Hα-helixtrans-67.6-37.9-176.3171.20000112.1L1396 S1448 I1449 N1454 C1455 N1456 Y1470L1396-V1452 HydrophobicContact CD2-CB 4.41Å; L1396-V1452 HydrophobicContact CD2-CG2 4.26Å; S1448-V1452 WeakPolarHBondContact O-CG2 3.09Å; S1448-V1452 PolarHBondContact O-N 2.95Å; I1449-V1452 PolarHBondContact O-N 2.95Å; V1452-N1454 VanDerWaalsContact C-N 3.31Å; V1452-N1454 PolarHBondContact O-N 3.2Å; V1452-C1455 WeakPolarHBondContact O-CB 3.45Å; V1452-C1455 PolarHBondContact O-N 3.03Å; V1452-N1456 PolarHBondContact O-N 3.27Å; V1452-Y1470 HydrophobicContact CG2-CD2 4.32Å; V1452-Y1470 HydrophobicContact CG2-CE2 4.22Å
1453N48.3Very low45.8Very low86 Ų8680.6 Ų80.646%0.4644%0.438SS..Hα-helixtrans-67.5-31.4173.7-72-15000112.3I1449 N1457I1449-N1453 WeakPolarHBondContact CG2-ND2 3.37Å; I1449-N1453 VanDerWaalsContact O-CB 3.3Å; I1449-N1453 WeakPolarHBondContact O-CB 3.36Å; I1449-N1453 VanDerWaalsContact O-CG 3.23Å; I1449-N1453 PolarHBondContact O-N 3.1Å; I1449-N1453 PolarHBondContact O-ND2 3.1Å; N1453-N1457 PolarHBondContact O-ND2 3.31Å; N1453-N1457 VanDerWaalsContact O-ND2 3.17Å
1454N48.8Very low45.9Very low89 Ų8981.2 Ų81.248%0.47645%0.452SS..Hα-helixtrans-73-31.3172.8-71.2-23.6000112.4S1450 L1451 V1452S1450-N1454 WeakPolarHBondContact O-CB 3.38Å; S1450-N1454 PolarHBondContact O-N 3.45Å; S1450-N1454 PolarHBondContact O-ND2 3.06Å; L1451-N1454 PolarHBondContact O-N 3.08Å; V1452-N1454 VanDerWaalsContact C-N 3.31Å; V1452-N1454 PolarHBondContact O-N 3.2Å
1455C42.2Very low45.8Very low41 Ų4187 Ų8728%0.27748%0.479SS..Hα-helixtrans-61.1-46.2170-660000111.7L1451 V1452 N1457 N1458 L1462 L1466L1451-C1455 PolarHBondContact O-N 2.87Å; L1451-C1455 PolarHBondContact O-SG 3.3Å; L1451-C1455 VanDerWaalsContact O-SG 3.33Å; V1452-C1455 WeakPolarHBondContact O-CB 3.45Å; V1452-C1455 PolarHBondContact O-N 3.03Å; C1455-N1457 PolarHBondContact O-N 3.23Å; C1455-N1457 VanDerWaalsContact O-N 3.09Å; C1455-N1458 PolarHBondContact O-N 3.24Å; C1455-L1462 HydrophobicContact CB-CD1 4.46Å; C1455-L1466 WeakPolarHBondContact SG-CD2 3.21Å
1456N44.2Very low45.8Very low127 Ų12788.5 Ų88.568%0.67949%0.487SS*.THydrogen-bonded Turntrans-66.2-11.3-175.5-75.7-7.3000114.9V1452V1452-N1456 PolarHBondContact O-N 3.27Å
1457N47.6Very low45.5Very low129 Ų12988.4 Ų88.469%0.6949%0.489SS*.THydrogen-bonded Turntrans-101.6-8.6179.8-73-41.8000114N1453 C1455N1453-N1457 PolarHBondContact O-ND2 3.31Å; N1453-N1457 VanDerWaalsContact O-ND2 3.17Å; C1455-N1457 PolarHBondContact O-N 3.23Å; C1455-N1457 VanDerWaalsContact O-N 3.09Å
1458N39.7Very low45.6Very low107 Ų10790.4 Ų90.457%0.57250%0.498SS*.  trans-129.497.4-174.8-70.7-37.9000110.9C1455 S1460C1455-N1458 PolarHBondContact O-N 3.24Å; N1458-S1460 PolarHBondContact O-N 3.17Å
1459D41.7Very low45.7Very low185 Ų18594.3 Ų94.399%0.98952%0.516SS*.  trans-66.717.6175.2-73.2-50000114.6
1460S42.6Very low45.7Very low88 Ų8894.7 Ų94.762%0.61551%0.514SS*.SBendtrans-108.4114-177.460.60000111.5N1458N1458-S1460 PolarHBondContact O-N 3.17Å
1461E46Very low45.5Very low190 Ų19095.1 Ų95.189%0.88851%0.514SS*.  trans22.595167.9-65.6-17012600116.3S1463E1461-S1463 PolarHBondContact O-N 3.28Å
1462L42.9Very low45.6Very low113 Ų11398.7 Ų98.759%0.59253%0.53SS*.  trans-46.6102.1175.6-168.994.4000111.2C1455 A1464 L1467C1455-L1462 HydrophobicContact CB-CD1 4.46Å; L1462-A1464 PolarHBondContact O-N 3.27Å; L1462-L1467 HydrophobicContact CD2-CB 4.22Å; L1462-L1467 HydrophobicContact CD2-CD1 4.3Å
1463S49.5Very low45.6Very low55 Ų5597.7 Ų97.739%0.38552%0.524SS..  trans-62.2135.5-171.472.30000110.7E1461 E1465 L1466 L1467E1461-S1463 PolarHBondContact O-N 3.28Å; S1463-E1465 PolarHBondContact O-N 3.02Å; S1463-L1466 PolarHBondContact O-N 3.5Å; S1463-L1466 PolarHBondContact OG-N 2.97Å; S1463-L1467 PolarHBondContact O-N 3.48Å
1464A48.9Very low45.4Very low80 Ų8095.3 Ų95.366%0.66151%0.514SS*.Hα-helixtrans-56.7-29.3-178.200000112L1462 L1467 Q1468L1462-A1464 PolarHBondContact O-N 3.27Å; A1464-L1467 PolarHBondContact O-N 2.91Å; A1464-Q1468 VanDerWaalsContact O-CB 3.29Å; A1464-Q1468 WeakPolarHBondContact O-CB 3.5Å; A1464-Q1468 PolarHBondContact O-N 3.47Å
1465E44.5Very low45.4Very low139 Ų13996.9 Ų96.965%0.6552%0.518SS*.Hα-helixtrans-66.3-41.9175.5-164.4165.2-142.600112.8S1463 Q1468 Q1469S1463-E1465 PolarHBondContact O-N 3.02Å; E1465-Q1468 PolarHBondContact O-N 3.44Å; E1465-Q1469 WeakPolarHBondContact O-CG 3.23Å; E1465-Q1469 PolarHBondContact O-N 2.87Å
1466L42Very low45.6Very low53 Ų5398 Ų9828%0.27752%0.521SS..Hα-helixtrans-66.3-41.5172.8-108.891.8000111.8L1451 C1455 S1463 Q1468 Q1469 Y1470L1451-L1466 HydrophobicContact CB-CD2 4.37Å; L1451-L1466 HydrophobicContact CD2-CD2 4.27Å; L1451-L1466 HydrophobicContact CD2-CG 4Å; L1451-L1466 HydrophobicContact CG-CD2 4.04Å; L1451-L1466 HydrophobicContact CG-CG 4.15Å; C1455-L1466 WeakPolarHBondContact SG-CD2 3.21Å; S1463-L1466 PolarHBondContact O-N 3.5Å; S1463-L1466 PolarHBondContact OG-N 2.97Å; L1466-Q1468 VanDerWaalsContact C-N 3.29Å; L1466-Q1468 PolarHBondContact O-N 2.85Å; L1466-Q1469 PolarHBondContact O-N 3.39Å; L1466-Y1470 WeakPolarHBondContact O-CB 3.48Å; L1466-Y1470 PolarHBondContact O-N 3.36Å
1467L45.2Very low45.7Very low92 Ų9293 Ų9348%0.48249%0.494SS..Hα-helixtrans-63.8-37.6176.9-176.762.7000111.4L1462 S1463 A1464 T1471L1462-L1467 HydrophobicContact CD2-CB 4.22Å; L1462-L1467 HydrophobicContact CD2-CD1 4.3Å; S1463-L1467 PolarHBondContact O-N 3.48Å; A1464-L1467 PolarHBondContact O-N 2.91Å; L1467-T1471 WeakPolarHBondContact O-CB 3.29Å; L1467-T1471 PolarHBondContact O-N 3.48Å; L1467-T1471 PolarHBondContact O-OG1 3.21Å
1468Q51.1Low45.6Very low130 Ų13088 Ų8861%0.60747%0.467SS*.Hα-helixtrans-65.7-46.6173.9-177172.2-14.600111.5A1464 E1465 L1466 T1471 Q1472A1464-Q1468 VanDerWaalsContact O-CB 3.29Å; A1464-Q1468 WeakPolarHBondContact O-CB 3.5Å; A1464-Q1468 PolarHBondContact O-N 3.47Å; E1465-Q1468 PolarHBondContact O-N 3.44Å; L1466-Q1468 VanDerWaalsContact C-N 3.29Å; L1466-Q1468 PolarHBondContact O-N 2.85Å; Q1468-T1471 PolarHBondContact O-N 3.35Å; Q1468-Q1472 WeakPolarHBondContact O-CB 3.42Å; Q1468-Q1472 PolarHBondContact O-N 2.96Å
1469Q44.7Very low45.8Very low86 Ų8686.5 Ų86.540%0.40246%0.462SS..Hα-helixtrans-61.4-42.9176.1-74.5178.611.600112.6L1451 E1465 L1466 Q1472 T1473L1451-Q1469 HydrophobicContact CD2-CB 3.79Å; E1465-Q1469 WeakPolarHBondContact O-CG 3.23Å; E1465-Q1469 PolarHBondContact O-N 2.87Å; L1466-Q1469 PolarHBondContact O-N 3.39Å; Q1469-Q1472 PolarHBondContact O-N 3.26Å; Q1469-T1473 WeakPolarHBondContact O-CB 3.43Å; Q1469-T1473 PolarHBondContact O-N 2.96Å; Q1469-T1473 PolarHBondContact O-OG1 3.13Å
1470Y45.8Very low45.9Very low65 Ų6581.9 Ų81.926%0.25543%0.433SS..Hα-helixtrans-61.6-47.1173.6-178.5-100000111.2L1396 V1452 L1466 Q1472 T1473 C1474L1396-Y1470 HydrophobicContact CD1-CE2 4.45Å; V1452-Y1470 HydrophobicContact CG2-CD2 4.32Å; V1452-Y1470 HydrophobicContact CG2-CE2 4.22Å; L1466-Y1470 WeakPolarHBondContact O-CB 3.48Å; L1466-Y1470 PolarHBondContact O-N 3.36Å; Y1470-Q1472 VanDerWaalsContact C-N 3.33Å; Y1470-Q1472 PolarHBondContact O-N 3.42Å; Y1470-T1473 PolarHBondContact O-N 2.91Å; Y1470-C1474 VanDerWaalsContact CE1-SG 3.59Å; Y1470-C1474 VanDerWaalsContact CZ-SG 3.6Å; Y1470-C1474 PolarHBondContact O-N 2.7Å; Y1470-C1474 PolarHBondContact O-SG 3.5Å
1471T46.9Very low45.9Very low68 Ų6880 Ų8042%0.41742%0.416SS..Hα-helixtrans-60.3-42178.2-58.20000111.9L1467 Q1468 C1474 Q1475L1467-T1471 WeakPolarHBondContact O-CB 3.29Å; L1467-T1471 PolarHBondContact O-N 3.48Å; L1467-T1471 PolarHBondContact O-OG1 3.21Å; Q1468-T1471 PolarHBondContact O-N 3.35Å; T1471-C1474 PolarHBondContact O-N 3.35Å; T1471-Q1475 WeakPolarHBondContact O-CG 3.44Å; T1471-Q1475 PolarHBondContact O-N 3.2Å
1472Q49.5Very low45.5Very low108 Ų10874.5 Ų74.551%0.50540%0.398SS..Hα-helixtrans-67.8-38.7177.3-167.5171.910.200111.6Q1468 Q1469 Y1470 Q1475 I1476Q1468-Q1472 WeakPolarHBondContact O-CB 3.42Å; Q1468-Q1472 PolarHBondContact O-N 2.96Å; Q1469-Q1472 PolarHBondContact O-N 3.26Å; Y1470-Q1472 VanDerWaalsContact C-N 3.33Å; Y1470-Q1472 PolarHBondContact O-N 3.42Å; Q1472-Q1475 WeakPolarHBondContact O-CB 3.46Å; Q1472-Q1475 PolarHBondContact O-N 3Å; Q1472-I1476 HydrophobicContact CG-CD1 4.44Å; Q1472-I1476 WeakPolarHBondContact O-CG1 3.26Å; Q1472-I1476 PolarHBondContact O-N 3.14Å
1473T44.6Very low45Very low20 Ų2077.8 Ų77.812%0.12342%0.415CS..Hα-helixtrans-64.3-45.1174-56.90000111.4L1444 Q1469 Y1470 Q1475 I1476 I1477L1444-T1473 HydrophobicContact CD2-CG2 3.97Å; L1444-T1473 HydrophobicContact CG-CG2 4.05Å; Q1469-T1473 WeakPolarHBondContact O-CB 3.43Å; Q1469-T1473 PolarHBondContact O-N 2.96Å; Q1469-T1473 PolarHBondContact O-OG1 3.13Å; Y1470-T1473 PolarHBondContact O-N 2.91Å; T1473-Q1475 VanDerWaalsContact C-N 3.32Å; T1473-Q1475 PolarHBondContact O-N 3.39Å; T1473-I1476 PolarHBondContact O-N 3.23Å; T1473-I1477 HydrophobicContact CG2-CD1 3.99Å; T1473-I1477 WeakPolarHBondContact O-CG1 3.44Å; T1473-I1477 PolarHBondContact O-N 3Å
1474C45.3Very low44.7Very low37 Ų3779 Ų7925%0.2542%0.417CS..Hα-helixtrans-60.3-38.8171.6-69.90000112.3Y1470 T1471 I1477 L1478Y1470-C1474 VanDerWaalsContact CE1-SG 3.59Å; Y1470-C1474 VanDerWaalsContact CZ-SG 3.6Å; Y1470-C1474 PolarHBondContact O-N 2.7Å; Y1470-C1474 PolarHBondContact O-SG 3.5Å; T1471-C1474 PolarHBondContact O-N 3.35Å; C1474-I1477 PolarHBondContact O-N 3.39Å; C1474-L1478 VanDerWaalsContact O-CB 3.25Å; C1474-L1478 WeakPolarHBondContact O-CB 3.4Å; C1474-L1478 WeakPolarHBondContact O-CD1 3.32Å; C1474-L1478 WeakPolarHBondContact O-CG 3.29Å; C1474-L1478 PolarHBondContact O-N 3.16Å
1475Q48Very low44.5Very low121 Ų12178.9 Ų78.957%0.56540%0.404SS*.Hα-helixtrans-64.1-41.5173.6-80.2-176.2-19.300112.5T1471 Q1472 T1473 L1478 T1479T1471-Q1475 WeakPolarHBondContact O-CG 3.44Å; T1471-Q1475 PolarHBondContact O-N 3.2Å; Q1472-Q1475 WeakPolarHBondContact O-CB 3.46Å; Q1472-Q1475 PolarHBondContact O-N 3Å; T1473-Q1475 VanDerWaalsContact C-N 3.32Å; T1473-Q1475 PolarHBondContact O-N 3.39Å; Q1475-L1478 PolarHBondContact O-N 3.34Å; Q1475-T1479 VanDerWaalsContact O-CB 3.31Å; Q1475-T1479 WeakPolarHBondContact O-CB 3.3Å; Q1475-T1479 PolarHBondContact O-N 3.44Å; Q1475-T1479 PolarHBondContact O-OG1 3.46Å
1476I46.7Very low44.5Very low66 Ų6675.6 Ų75.634%0.33839%0.391SS..Hα-helixtrans-64.9-43.8176.9-67.6161.7000110.6L1444 Q1472 T1473 T1479 K1480L1444-I1476 HydrophobicContact CD2-CB 4.06Å; L1444-I1476 HydrophobicContact CD2-CG2 3.58Å; Q1472-I1476 HydrophobicContact CG-CD1 4.44Å; Q1472-I1476 WeakPolarHBondContact O-CG1 3.26Å; Q1472-I1476 PolarHBondContact O-N 3.14Å; T1473-I1476 PolarHBondContact O-N 3.23Å; I1476-T1479 PolarHBondContact O-N 2.96Å; I1476-K1480 HydrophobicContact CG2-CD 4.49Å; I1476-K1480 WeakPolarHBondContact O-CB 3.34Å; I1476-K1480 PolarHBondContact O-N 3.27Å
1477I46.8Very low44.7Very low21 Ų2176.9 Ų76.911%0.10840%0.397CS..Hα-helixtrans-62.8-48.3175.6-68.3168.3000110.6I1403 L1441 L1444 I1445 T1473 C1474 T1479 K1480 L1481I1403-I1477 HydrophobicContact CD1-CG2 4.24Å; L1441-I1477 HydrophobicContact CD1-CG1 4.44Å; L1444-I1477 HydrophobicContact CD2-CG1 4.12Å; I1445-I1477 HydrophobicContact CG1-CD1 4.46Å; T1473-I1477 HydrophobicContact CG2-CD1 3.99Å; T1473-I1477 WeakPolarHBondContact O-CG1 3.44Å; T1473-I1477 PolarHBondContact O-N 3Å; C1474-I1477 PolarHBondContact O-N 3.39Å; I1477-T1479 VanDerWaalsContact C-N 3.3Å; I1477-T1479 PolarHBondContact O-N 3.23Å; I1477-K1480 CarbonylContact O-C 3.58Å; I1477-K1480 PolarHBondContact O-N 3.17Å; I1477-L1481 HydrophobicContact CG2-CD1 3.66Å; I1477-L1481 HydrophobicContact CG2-CG 4.44Å; I1477-L1481 WeakPolarHBondContact O-CB 3.17Å; I1477-L1481 VanDerWaalsContact O-CG 3.27Å; I1477-L1481 WeakPolarHBondContact O-CG 3.26Å; I1477-L1481 PolarHBondContact O-N 3.48Å
1478L45.1Very low44.6Very low25 Ų2575.9 Ų75.913%0.13139%0.392CS..Hα-helixtrans-60.3-38.1175.6-75.8167.3000112.3I1380 I1388 I1391 C1474 Q1475 L1481 S1482I1380-L1478 HydrophobicContact CD1-CD2 4.23Å; I1388-L1478 HydrophobicContact CG1-CD1 4.26Å; I1391-L1478 HydrophobicContact CD1-CD2 3.72Å; C1474-L1478 VanDerWaalsContact O-CB 3.25Å; C1474-L1478 WeakPolarHBondContact O-CB 3.4Å; C1474-L1478 WeakPolarHBondContact O-CD1 3.32Å; C1474-L1478 WeakPolarHBondContact O-CG 3.29Å; C1474-L1478 PolarHBondContact O-N 3.16Å; Q1475-L1478 PolarHBondContact O-N 3.34Å; L1478-L1481 CarbonylContact O-C 3.53Å; L1478-L1481 PolarHBondContact O-N 3.31Å; L1478-S1482 VanDerWaalsContact O-CB 3.3Å; L1478-S1482 WeakPolarHBondContact O-CB 3.25Å; L1478-S1482 PolarHBondContact O-N 3.37Å; L1478-S1482 PolarHBondContact O-OG 3.43Å
1479T44.4Very low44.2Very low74 Ų7472.3 Ų72.345%0.45438%0.378SS..Hα-helixtrans-66.1-48.2177.1-55.30000110.2Q1475 I1476 I1477 L1481 S1482 L1483Q1475-T1479 VanDerWaalsContact O-CB 3.31Å; Q1475-T1479 WeakPolarHBondContact O-CB 3.3Å; Q1475-T1479 PolarHBondContact O-N 3.44Å; Q1475-T1479 PolarHBondContact O-OG1 3.46Å; I1476-T1479 PolarHBondContact O-N 2.96Å; I1477-T1479 VanDerWaalsContact C-N 3.3Å; I1477-T1479 PolarHBondContact O-N 3.23Å; T1479-L1481 PolarHBondContact O-N 3.04Å; T1479-S1482 WeakPolarHBondContact CA-OG 3.39Å; T1479-S1482 PolarHBondContact O-N 3.07Å; T1479-S1482 PolarHBondContact O-OG 3.13Å; T1479-L1483 HydrophobicContact CG2-CD1 4.04Å; T1479-L1483 PolarHBondContact O-N 3.2Å; T1479-L1483 VanDerWaalsContact O-N 3.11Å
1480K43.2Very low44.2Very low88 Ų8871.4 Ų71.438%0.38338%0.376SS..Hα-helixtrans-64.6-18.1174.6-75.2-174175.3-177.20114.4L1441 I1476 I1477L1441-K1480 HydrophobicContact CD1-CD 3.93Å; I1476-K1480 HydrophobicContact CG2-CD 4.49Å; I1476-K1480 WeakPolarHBondContact O-CB 3.34Å; I1476-K1480 PolarHBondContact O-N 3.27Å; I1477-K1480 CarbonylContact O-C 3.58Å; I1477-K1480 PolarHBondContact O-N 3.17Å
1481L42.9Very low44.1Very low50 Ų5071.8 Ų71.826%0.26239%0.385SS..THydrogen-bonded Turntrans-96.8-5.1173.4-70.5168.4000113.5I1377 I1406 I1477 L1478 T1479I1377-L1481 HydrophobicContact CD1-CD1 4.2Å; I1377-L1481 HydrophobicContact CG2-CB 4.16Å; I1377-L1481 WeakPolarHBondContact CG2-O 3.45Å; I1406-L1481 HydrophobicContact CD1-CD2 3.75Å; I1477-L1481 HydrophobicContact CG2-CD1 3.66Å; I1477-L1481 HydrophobicContact CG2-CG 4.44Å; I1477-L1481 WeakPolarHBondContact O-CB 3.17Å; I1477-L1481 VanDerWaalsContact O-CG 3.27Å; I1477-L1481 WeakPolarHBondContact O-CG 3.26Å; I1477-L1481 PolarHBondContact O-N 3.48Å; L1478-L1481 CarbonylContact O-C 3.53Å; L1478-L1481 PolarHBondContact O-N 3.31Å; T1479-L1481 PolarHBondContact O-N 3.04Å
1482S36.9Very low43.8Very low74 Ų7472.2 Ų72.252%0.51738%0.382SS..THydrogen-bonded Turntrans-108-14.1178.272.30000113.9L1478 T1479L1478-S1482 VanDerWaalsContact O-CB 3.3Å; L1478-S1482 WeakPolarHBondContact O-CB 3.25Å; L1478-S1482 PolarHBondContact O-N 3.37Å; L1478-S1482 PolarHBondContact O-OG 3.43Å; T1479-S1482 WeakPolarHBondContact CA-OG 3.39Å; T1479-S1482 PolarHBondContact O-N 3.07Å; T1479-S1482 PolarHBondContact O-OG 3.13Å
1483L32.3Very low43.3Very low182 Ų18268.9 Ų68.995%0.95337%0.371SS*.  trans-86.40170.4-75.6165.2000110.2T1479T1479-L1483 HydrophobicContact CG2-CD1 4.04Å; T1479-L1483 PolarHBondContact O-N 3.2Å; T1479-L1483 VanDerWaalsContact O-N 3.11Å

Retrieved 1,483 of 1,483 residues in 1939.2 ms (Link to these results)