A0A087XLC6_POEFO Loading...

Frizzled-4

AlphaFold DB , UniProt , Accession A0A087XLC6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 531 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M36.2Very low42.2Very low218 Ų218128.5 Ų128.5100%1.07469%0.686SS**  084.20-68.7179.5173.100109.6
2P35.3Very low42.3Very low126 Ų126128 Ų12882%0.81868%0.682SS**  trans-106.923.9-179.229.9-11.2000112.9
3G40.2Very low42.5Very low51 Ų51123.1 Ų123.153%0.52667%0.67SS.*SBendtrans-99.2-22.1-178.300000115
4T44.3Very low42.6Very low108 Ų108122.5 Ų122.566%0.66367%0.665SS**Hα-helixtrans-87.8-24.2-169.844.80000114.2M8T4-M8 PolarHBondContact O-N 2.97Å
5M41.6Very low42.8Very low138 Ų138123.1 Ų123.168%0.6867%0.667SS**Hα-helixtrans-88.7-26.8-177.3-154.5157.274.500113.6M9M5-M9 PolarHBondContact O-N 3.27Å
6R44.2Very low43.2Very low207 Ų207124.6 Ų124.678%0.78167%0.673SS**Hα-helixtrans-70.8-34167.7-85.2-176.6170.8-175.9-3.3111.5V10R6-V10 WeakPolarHBondContact O-CB 3.48Å; R6-V10 VanDerWaalsContact O-CG2 3.3Å; R6-V10 WeakPolarHBondContact O-CG2 3.28Å; R6-V10 PolarHBondContact O-N 3.25Å
7M43.3Very low43.4Very low136 Ų136123.9 Ų123.967%0.6767%0.674SS**Hα-helixtrans-71.2-39.8176.7-155.4148.4119.800111.6M9 S11M7-M9 PolarHBondContact O-N 3.01Å; M7-S11 WeakPolarHBondContact O-CB 3.44Å; M7-S11 PolarHBondContact O-N 3.49Å; M7-S11 PolarHBondContact O-OG 3.39Å
8M44.4Very low43.1Very low144 Ų144121.6 Ų121.671%0.70967%0.668SS**Hα-helixtrans-64.7-38.2175.4-101.4178.476.300114.4T4 L12T4-M8 PolarHBondContact O-N 2.97Å; M8-L12 WeakPolarHBondContact O-CB 3.45Å; M8-L12 PolarHBondContact O-N 2.71Å
9M43.9Very low43Very low142 Ų142121.2 Ų121.270%0.767%0.671SS**Hα-helixtrans-76.3-33.4179.3-70.6-156-163.400113.1M5 M7 A13M5-M9 PolarHBondContact O-N 3.27Å; M7-M9 PolarHBondContact O-N 3.01Å; M9-A13 PolarHBondContact O-N 3.48Å
10V46.6Very low43Very low87 Ų87122.2 Ų122.253%0.52768%0.675SS.*Hα-helixtrans-73.4-36.8173.4175.30000110.6R6 A13 L14R6-V10 WeakPolarHBondContact O-CB 3.48Å; R6-V10 VanDerWaalsContact O-CG2 3.3Å; R6-V10 WeakPolarHBondContact O-CG2 3.28Å; R6-V10 PolarHBondContact O-N 3.25Å; V10-A13 PolarHBondContact O-N 3.14Å; V10-L14 HydrophobicContact CG1-CD1 3.62Å; V10-L14 WeakPolarHBondContact O-CB 3.47Å; V10-L14 WeakPolarHBondContact O-CD1 3.34Å; V10-L14 PolarHBondContact O-N 3.49Å
11S43.6Very low42.9Very low57 Ų57124.9 Ų124.940%0.39968%0.68SS.*Hα-helixtrans-68.6-33.1175.1-64.90000113.4M7 L15M7-S11 WeakPolarHBondContact O-CB 3.44Å; M7-S11 PolarHBondContact O-N 3.49Å; M7-S11 PolarHBondContact O-OG 3.39Å; S11-L15 VanDerWaalsContact O-CB 3.32Å; S11-L15 WeakPolarHBondContact O-CB 3.25Å; S11-L15 WeakPolarHBondContact O-CD1 3.45Å; S11-L15 VanDerWaalsContact O-CG 3.28Å; S11-L15 WeakPolarHBondContact O-CG 3.39Å; S11-L15 PolarHBondContact O-N 3.28Å
12L43.7Very low42.9Very low122 Ų122122 Ų12264%0.63967%0.668SS**Hα-helixtrans-73.4-31.2175.2-145.880.6000112.4M8M8-L12 WeakPolarHBondContact O-CB 3.45Å; M8-L12 PolarHBondContact O-N 2.71Å
13A44.8Very low42.9Very low64 Ų64120.9 Ų120.953%0.52967%0.669SS.*Hα-helixtrans-75.3-33.3174.200000112.6M9 V10M9-A13 PolarHBondContact O-N 3.48Å; V10-A13 PolarHBondContact O-N 3.14Å
14L43.6Very low42.8Very low115 Ų115125.4 Ų125.460%0.60268%0.68SS**Hα-helixtrans-76.3-25.8172.8-96.5120.8000113.4V10 L16 V17 C18V10-L14 HydrophobicContact CG1-CD1 3.62Å; V10-L14 WeakPolarHBondContact O-CB 3.47Å; V10-L14 WeakPolarHBondContact O-CD1 3.34Å; V10-L14 PolarHBondContact O-N 3.49Å; L14-L16 VanDerWaalsContact C-N 3.27Å; L14-L16 PolarHBondContact O-N 2.93Å; L14-V17 PolarHBondContact O-N 3.45Å; L14-C18 WeakPolarHBondContact O-CB 3.34Å
15L46.8Very low42.2Very low131 Ų131127.5 Ų127.569%0.68669%0.687SS**THydrogen-bonded Turntrans-74.5-11.6176.1-84.6161.6000114.3S11S11-L15 VanDerWaalsContact O-CB 3.32Å; S11-L15 WeakPolarHBondContact O-CB 3.25Å; S11-L15 WeakPolarHBondContact O-CD1 3.45Å; S11-L15 VanDerWaalsContact O-CG 3.28Å; S11-L15 WeakPolarHBondContact O-CG 3.39Å; S11-L15 PolarHBondContact O-N 3.28Å
16L48.7Very low41.8Very low147 Ų147124.9 Ų124.977%0.7769%0.687SS**THydrogen-bonded Turntrans-98.7-4.4175.9-79.4164000114L14L14-L16 VanDerWaalsContact C-N 3.27Å; L14-L16 PolarHBondContact O-N 2.93Å
17V46Very low41.3Very low113 Ų113125 Ų12569%0.68569%0.694SS**THydrogen-bonded Turntrans-113.8-3.5-179.5-175.80000112.1L14L14-V17 PolarHBondContact O-N 3.45Å
18C38.9Very low40.8Very low83 Ų83122.1 Ų122.156%0.56170%0.699SS**THydrogen-bonded Turntrans-100.810.7-168.4-137.70000119.2L14L14-C18 WeakPolarHBondContact O-CB 3.34Å
19P40.3Very low40.3Very low113 Ų113122.8 Ų122.873%0.73471%0.705SS**THydrogen-bonded Turntrans-93.211.6167.936.2-30.2000113.2
20L43.1Very low40.1Very low142 Ų142123.6 Ų123.674%0.74371%0.712SS**SBendtrans-104.21.5-178.5-129.991.4000115.8
21F40.6Very low40Very low179 Ų179128.6 Ų128.679%0.78573%0.73SS**SBendtrans-140.919.9-173-82.2-70.5000117.4
22L36.5Very low40.5Very low157 Ų157134.5 Ų134.582%0.82275%0.751SS**  trans-139.384.1170.5-73.2174.8000111.9
23A36.4Very low40.9Very low102 Ų102137.2 Ų137.284%0.84376%0.76SS**  trans-156.961.2154.600000109.6
24I37.7Very low41.5Very low146 Ų146139.2 Ų139.275%0.74976%0.76SS**  trans-145.4107.4162.3-54.4178.3000101.3
25D31.3Very low42.9Very low152 Ų152138.5 Ų138.581%0.81376%0.761SS**  -153.6152.252.2-84.2-52.8000110.3
26A34.2Very low44.9Very low83 Ų83133.7 Ų133.769%0.68674%0.738SS**  159.591.6127.900000110.8
27F32.3Very low46.9Very low211 Ų211130.3 Ų130.393%0.92572%0.721SS**  trans-137.1113.8144.3-80.8-75.3000106.6
28G33.8Very low49.2Very low74 Ų74128.5 Ų128.576%0.76371%0.711SS**  trans-69.4130.2167.900000108.2D30G28-D30 PolarHBondContact O-N 3.47Å; G28-D30 VanDerWaalsContact O-N 3.14Å
29D33.7Very low51.9Low159 Ų159125 Ų12585%0.8569%0.687SS**  trans-70.399.5166.7-77.3-33000107.9
30D40.6Very low54.4Low158 Ų158128.4 Ų128.485%0.84569%0.685SS**  trans-76.7109.8148.6-76.6-42.6000105.6G28 E32G28-D30 PolarHBondContact O-N 3.47Å; G28-D30 VanDerWaalsContact O-N 3.14Å; D30-E32 PolarHBondContact O-N 3.38Å
31E44.7Very low56.9Low193 Ų193121.7 Ų121.790%0.90265%0.65SS**  trans-6384.6170.6-98.7-177.7137.600108.9E33E31-E33 PolarHBondContact O-N 3.33Å
32E52.8Low59.3Low181 Ų181117.1 Ų117.185%0.84664%0.64SS**  trans-71.9120.7167.1-123.3176.7-173.500108.3D30 M34D30-E32 PolarHBondContact O-N 3.38Å; E32-M34 PolarHBondContact O-N 3.44Å; E32-M34 VanDerWaalsContact O-N 3.11Å
33E52.5Low61.9Low178 Ų178111.3 Ų111.383%0.83261%0.609SS**  trans-52.4114.3-175.9-148.9170-16600110.6E31 T35E31-E33 PolarHBondContact O-N 3.33Å; E33-T35 PolarHBondContact O-N 2.88Å
34M56.5Low64.6Low107 Ų107106.4 Ų106.453%0.52757%0.569SS.*  trans-66.8105.3-172.9-63.8-168-13400111.2E32 K53 P102E32-M34 PolarHBondContact O-N 3.44Å; E32-M34 VanDerWaalsContact O-N 3.11Å; M34-K53 VanDerWaalsContact CG-NZ 3.32Å; M34-K53 PolarHBondContact SD-NZ 3.15Å; M34-P102 HydrophobicContact CE-CB 3.72Å; M34-P102 HydrophobicContact SD-CB 3.88Å
35T74.1Confident67.2Low99 Ų99104.5 Ų104.561%0.60756%0.556SS**  trans-118.3130.3176440000110.7E33E33-T35 PolarHBondContact O-N 2.88Å
36C88.7Confident69.7Low31 Ų31100.5 Ų100.521%0.20955%0.551CS.*PPolyproline II helixtrans-78.2134.8175.2-57.30000110.5V51 C97C36-V51 HydrophobicContact CB-CB 3.98Å; C36-V51 HydrophobicContact CB-CG2 4.1Å; C36-C97 VanDerWaalsContact CA-SG 3.58Å; C36-C97 HydrophobicContact CB-CB 3.7Å; C36-C97 WeakPolarHBondContact CB-SG 3.45Å; C36-C97 WeakPolarHBondContact SG-CB 3.49Å; C36-C97 CovalentContact SG-SG 2.03Å; C36-C97 PolarHBondContact SG-SG 2.89Å
37D90.8Very high72Confident76 Ų7698.1 Ų98.141%0.40653%0.527SS..EExtended strand (participates in β ladder)trans-102146.5179.3-82.3-37.6000112.3V51 T52D37-V51 CarbonylContact O-C 3.49Å; D37-V51 VanDerWaalsContact O-CA 3.23Å; D37-V51 WeakPolarHBondContact O-CA 3.33Å; D37-T52 PolarHBondContact N-O 3.36Å; D37-T52 PolarHBondContact O-N 2.95Å
38P93.4Very high74.5Confident74 Ų7491.9 Ų91.948%0.48152%0.522SS..EExtended strand (participates in β ladder)trans-65.7142.8175.227.5-33.9000112R40 N50 Q63P38-R40 PolarHBondContact O-N 3.34Å; P38-N50 WeakPolarHBondContact CA-O 3.05Å; P38-Q63 PolarHBondContact O-NE2 3.05Å
39I95.7Very high77.2Confident11 Ų1189 Ų896%0.05649%0.488CS..PPolyproline II helixtrans-73117.7177.3-61.4169.3000109.9I41 C44 Q45 Y49 N50 T52 V94I39-I41 HydrophobicContact CG2-CB 4.39Å; I39-C44 HydrophobicContact CG2-CB 4.11Å; I39-Q45 PolarHBondContact O-NE2 3.32Å; I39-Y49 HydrophobicContact CD1-CD2 3.66Å; I39-Y49 HydrophobicContact CD1-CE2 3.48Å; I39-Y49 VanDerWaalsContact CD1-CE2 3.48Å; I39-N50 PolarHBondContact N-O 3.02Å; I39-T52 HydrophobicContact CG1-CG2 3.83Å; I39-V94 HydrophobicContact CG2-CG2 4.41Å
40R93.8Very high80Confident184 Ų18486.6 Ų86.669%0.69448%0.475SS*.  trans-96-16.3-179.6-59.4-177.1-173.6176.33.6113.2P38 S42P38-R40 PolarHBondContact O-N 3.34Å; R40-S42 PolarHBondContact O-N 3.48Å
41I94.7Very high82.5Confident1 Ų181.8 Ų81.81%0.00545%0.451CS..  trans-72.6113.8-177.7-53.3-174.1000110.1I39 M43 C44 Q45 Q63 A66 E67 L70 V94I39-I41 HydrophobicContact CG2-CB 4.39Å; I41-M43 VanDerWaalsContact C-N 3.33Å; I41-M43 HydrophobicContact CG2-CG 3.77Å; I41-M43 PolarHBondContact O-N 3.42Å; I41-C44 HydrophobicContact CB-CB 4.31Å; I41-C44 HydrophobicContact CG2-CB 4.38Å; I41-C44 PolarHBondContact O-N 2.96Å; I41-Q45 PolarHBondContact O-N 2.87Å; I41-Q63 HydrophobicContact CD1-CB 4.47Å; I41-Q63 WeakPolarHBondContact CD1-O 3.37Å; I41-Q63 HydrophobicContact CG1-CB 4.33Å; I41-A66 HydrophobicContact CD1-CB 4.05Å; I41-E67 HydrophobicContact CD1-CB 4.01Å; I41-E67 HydrophobicContact CG1-CB 4.05Å; I41-E67 HydrophobicContact CG2-CB 4.17Å; I41-E67 HydrophobicContact CG2-CG 3.98Å; I41-L70 HydrophobicContact CD1-CD1 3.91Å; I41-L70 HydrophobicContact CG2-CD1 4.15Å; I41-V94 HydrophobicContact CD1-CG1 3.48Å; I41-V94 VanDerWaalsContact CD1-CG1 3.48Å; I41-V94 HydrophobicContact CG1-CG1 4.26Å
42S91.4Very high84.8Confident82 Ų8272.6 Ų72.657%0.57341%0.408SS*.G310 helixtrans-54.7-42.9-17359.20000113.8R40 C44 Q45R40-S42 PolarHBondContact O-N 3.48Å; S42-C44 PolarHBondContact O-N 3.35Å; S42-Q45 PolarHBondContact O-N 3.02Å
43M91.1Very high86.6Confident35 Ų3566.1 Ų66.117%0.17238%0.378CS..G310 helixtrans-70.8-17.5179.965.3179-68.900113.8I41 L70 I77 K86I41-M43 VanDerWaalsContact C-N 3.33Å; I41-M43 HydrophobicContact CG2-CG 3.77Å; I41-M43 PolarHBondContact O-N 3.42Å; M43-L70 HydrophobicContact SD-CB 3.82Å; M43-I77 HydrophobicContact CE-CD1 3.3Å; M43-K86 WeakPolarHBondContact O-CE 3.22Å; M43-K86 PolarHBondContact O-NZ 3.49Å
44C93.9Very high88.4Confident0 Ų059.3 Ų59.30%035%0.346CS..G310 helixtrans-104.88.1-178.3-610000113.8I39 I41 S42 L47 C90 V94I39-C44 HydrophobicContact CG2-CB 4.11Å; I41-C44 HydrophobicContact CB-CB 4.31Å; I41-C44 HydrophobicContact CG2-CB 4.38Å; I41-C44 PolarHBondContact O-N 2.96Å; S42-C44 PolarHBondContact O-N 3.35Å; C44-L47 HydrophobicContact CB-CD1 4.03Å; C44-L47 WeakPolarHBondContact O-CD1 3.34Å; C44-L47 WeakPolarHBondContact O-CG 3.29Å; C44-C90 WeakPolarHBondContact CA-SG 3.22Å; C44-C90 HydrophobicContact CB-CB 3.68Å; C44-C90 WeakPolarHBondContact CB-SG 3.32Å; C44-C90 WeakPolarHBondContact SG-CB 3.35Å; C44-C90 CovalentContact SG-SG 2.04Å; C44-C90 PolarHBondContact SG-SG 2.9Å; C44-V94 HydrophobicContact CB-CG2 3.54Å
45Q92.2Very high90.1Very high105 Ų10558 Ų5849%0.49135%0.345SS..THydrogen-bonded Turntrans-80148.3172.7-70.6173.9-13.800111.3I39 I41 S42I39-Q45 PolarHBondContact O-NE2 3.32Å; I41-Q45 PolarHBondContact O-N 2.87Å; S42-Q45 PolarHBondContact O-N 3.02Å
46G83.9Confident90.9Very high68 Ų6853.6 Ų53.670%0.70132%0.318SS*.THydrogen-bonded Turntrans74.821.7175.700000115G48G46-G48 VanDerWaalsContact C-N 3.31Å; G46-G48 PolarHBondContact O-N 3.24Å
47L81Confident91Very high33 Ų3355.7 Ų55.717%0.17333%0.327CS..SBendtrans-86.37-179.8-64.4179.6000114.3C44 Y49 F87 C90C44-L47 HydrophobicContact CB-CD1 4.03Å; C44-L47 WeakPolarHBondContact O-CD1 3.34Å; C44-L47 WeakPolarHBondContact O-CG 3.29Å; L47-Y49 HydrophobicContact CB-CE1 4.27Å; L47-F87 HydrophobicContact CB-CD2 4.02Å; L47-F87 HydrophobicContact CB-CE2 4.18Å; L47-F87 HydrophobicContact CD1-CD2 4.45Å; L47-F87 HydrophobicContact CD2-CD2 4.21Å; L47-F87 HydrophobicContact CG-CD2 4.46Å; L47-F87 WeakPolarHBondContact O-CE2 3.34Å; L47-C90 HydrophobicContact CD1-CB 3.19Å; L47-C90 VanDerWaalsContact CD1-SG 3.58Å
48G84.9Confident91Very high80 Ų8053.8 Ų53.883%0.82532%0.318SS*.SBendtrans97.9-7-175.100000114.4G46G46-G48 VanDerWaalsContact C-N 3.31Å; G46-G48 PolarHBondContact O-N 3.24Å
49Y90.9Very high90.8Very high14 Ų1452.7 Ų52.76%0.05532%0.32CS..  trans-141.6153.4167.366.6-82.1000109.8I39 L47 F87 C90 V94 M96 M150I39-Y49 HydrophobicContact CD1-CD2 3.66Å; I39-Y49 HydrophobicContact CD1-CE2 3.48Å; I39-Y49 VanDerWaalsContact CD1-CE2 3.48Å; L47-Y49 HydrophobicContact CB-CE1 4.27Å; Y49-F87 HydrophobicContact CE1-CE2 4.24Å; Y49-C90 PolarHBondContact OH-O 2.91Å; Y49-V94 WeakPolarHBondContact CE2-O 3.28Å; Y49-V94 PolarHBondContact OH-O 2.88Å; Y49-M96 HydrophobicContact CD1-CB 4.32Å; Y49-M96 HydrophobicContact CD2-CB 3.75Å; Y49-M96 HydrophobicContact CD2-CG 4.06Å; Y49-M96 HydrophobicContact CE2-CB 4Å; Y49-M96 HydrophobicContact CG-CB 3.92Å; Y49-M96 HydrophobicContact CG-CG 4Å; Y49-M96 HydrophobicContact CG-SD 4.45Å; Y49-M150 HydrophobicContact CD1-SD 4.15Å; Y49-M150 HydrophobicContact CE1-CE 4.44Å; Y49-M150 HydrophobicContact CE1-SD 3.81Å
50N92.1Very high90.7Very high109 Ų10953 Ų5358%0.58332%0.322SS*.  trans-126.2-0.8-172.2-69.3-26000114P38 I39P38-N50 WeakPolarHBondContact CA-O 3.05Å; I39-N50 PolarHBondContact N-O 3.02Å
51V92.9Very high90.5Very high56 Ų5649 Ų4934%0.33932%0.318SS..EExtended strand (participates in β ladder)trans-127.5142-178.4-62.80000110.9C36 D37 C97C36-V51 HydrophobicContact CB-CB 3.98Å; C36-V51 HydrophobicContact CB-CG2 4.1Å; D37-V51 CarbonylContact O-C 3.49Å; D37-V51 VanDerWaalsContact O-CA 3.23Å; D37-V51 WeakPolarHBondContact O-CA 3.33Å; V51-C97 PolarHBondContact O-N 3.39Å
52T93.8Very high90.4Very high0 Ų053.6 Ų53.60%034%0.342CS..EExtended strand (participates in β ladder)trans-133.2165.3-177.9-176.40000109.8D37 I39 Q63 V94 P95D37-T52 PolarHBondContact N-O 3.36Å; D37-T52 PolarHBondContact O-N 2.95Å; I39-T52 HydrophobicContact CG1-CG2 3.83Å; T52-Q63 HydrophobicContact CG2-CG 4.38Å; T52-Q63 VanDerWaalsContact CG2-NE2 3.32Å; T52-V94 HydrophobicContact CG2-CB 4.42Å; T52-V94 HydrophobicContact CG2-CG1 4.4Å; T52-V94 WeakPolarHBondContact OG1-CA 3.49Å; T52-P95 VanDerWaalsContact CA-O 3.27Å; T52-P95 WeakPolarHBondContact CA-O 3.05Å; T52-P95 VanDerWaalsContact CB-O 3.31Å; T52-P95 WeakPolarHBondContact CB-O 3.49Å; T52-P95 PolarHBondContact OG1-O 2.9Å
53K89.9Confident90.6Very high46 Ų4650.8 Ų50.820%0.232%0.32CS..  trans-121.6142.9169.8-175173.2175.9-175.20109.3M34 C97 P102M34-K53 VanDerWaalsContact CG-NZ 3.32Å; M34-K53 PolarHBondContact SD-NZ 3.15Å; K53-C97 HydrophobicContact CB-CB 3.97Å; K53-P102 PolarHBondContact NZ-O 3.3Å
54M90.1Very high90.7Very high34 Ų3452.4 Ų52.417%0.16733%0.334CS..SBendtrans-107.9148170.8-55.9-54.6-7700109.3N56 N60 V61 Q63M54-N56 HydrophobicContact CE-CB 4.12Å; M54-N56 HydrophobicContact SD-CB 4.21Å; M54-N60 HydrophobicContact CE-CB 4.05Å; M54-N60 WeakPolarHBondContact CE-O 3.49Å; M54-V61 VanDerWaalsContact CB-O 3.22Å; M54-V61 WeakPolarHBondContact CB-O 3.44Å; M54-V61 WeakPolarHBondContact CG-O 3.41Å; M54-Q63 HydrophobicContact CE-CG 4.5Å; M54-Q63 HydrophobicContact CG-CG 4.26Å; M54-Q63 HydrophobicContact SD-CG 4Å
55P91.8Very high90.7Very high79 Ų7955.9 Ų55.951%0.51335%0.353SS..SBendcis-68.4148.2-1.629.4-34.8000113.1N60P55-N60 CarbonylContact C-O 3.59Å; P55-N60 WeakPolarHBondContact CA-O 3.49Å; P55-N60 WeakPolarHBondContact CB-O 3.28Å
56N91.9Very high90.8Very high8 Ų850.9 Ų50.94%0.04333%0.33CS..  trans-75.1-179.3176.469.115.8000111.7M54 V58 G59 N60 Y93 P95M54-N56 HydrophobicContact CE-CB 4.12Å; M54-N56 HydrophobicContact SD-CB 4.21Å; N56-V58 PolarHBondContact O-N 2.8Å; N56-V58 VanDerWaalsContact O-N 3.09Å; N56-V58 WeakPolarHBondContact OD1-CA 3.32Å; N56-V58 PolarHBondContact OD1-N 3.41Å; N56-G59 PolarHBondContact O-N 3.42Å; N56-G59 PolarHBondContact OD1-N 3.41Å; N56-N60 PolarHBondContact N-O 3.1Å; N56-N60 WeakPolarHBondContact ND2-CB 3.36Å; N56-N60 PolarHBondContact ND2-OD1 3.46Å; N56-N60 PolarHBondContact OD1-N 2.93Å; N56-N60 PolarHBondContact OD1-OD1 3.02Å; N56-Y93 WeakPolarHBondContact CB-O 3.32Å; N56-Y93 PolarHBondContact ND2-O 3.35Å; N56-P95 HydrophobicContact CB-CG 4.45Å
57L90.5Very high91.3Very high74 Ų7450.9 Ų50.939%0.38731%0.312SS..THydrogen-bonded Turntrans-67-11.8-177.9-57.3-178.3000114.2V92 P95 P104 F139L57-V92 HydrophobicContact CB-CG1 4.42Å; L57-V92 PolarHBondContact N-O 3.28Å; L57-P95 HydrophobicContact CD1-CB 4.42Å; L57-P95 HydrophobicContact CG-CB 4.31Å; L57-P95 HydrophobicContact CG-CG 4.23Å; L57-P104 HydrophobicContact CD2-CG 4.1Å; L57-F139 HydrophobicContact CD1-CE1 4.32Å
58V91.4Very high91.9Very high36 Ų3655 Ų5522%0.21833%0.333CS..THydrogen-bonded Turntrans-101.6-3.8178.3-170.40000111.3N56 V92 Y93 V133N56-V58 PolarHBondContact O-N 2.8Å; N56-V58 VanDerWaalsContact O-N 3.09Å; N56-V58 WeakPolarHBondContact OD1-CA 3.32Å; N56-V58 PolarHBondContact OD1-N 3.41Å; V58-V92 HydrophobicContact CG2-CG1 3.47Å; V58-V92 VanDerWaalsContact CG2-CG1 3.47Å; V58-Y93 HydrophobicContact CB-CD1 4.47Å; V58-Y93 HydrophobicContact CB-CE1 4.13Å; V58-Y93 HydrophobicContact CG1-CE1 4.11Å; V58-Y93 HydrophobicContact CG2-CD1 4.12Å; V58-Y93 HydrophobicContact CG2-CE1 3.84Å; V58-V133 HydrophobicContact CG1-CB 3.84Å; V58-V133 HydrophobicContact CG1-CG1 3.81Å; V58-V133 HydrophobicContact CG1-CG2 4.18Å; V58-V133 HydrophobicContact CG2-CB 4.41Å
59G89Confident92.3Very high51 Ų5155 Ų5553%0.52631%0.311SS..  trans86.411.1178.600000115N56N56-G59 PolarHBondContact O-N 3.42Å; N56-G59 PolarHBondContact OD1-N 3.41Å
60N92.4Very high92.4Very high18 Ų1854.3 Ų54.310%0.09631%0.309CS..  trans-70.1135.8170.6-50.7118.5000109.3M54 P55 N56 D65 A66 Q69M54-N60 HydrophobicContact CE-CB 4.05Å; M54-N60 WeakPolarHBondContact CE-O 3.49Å; P55-N60 CarbonylContact C-O 3.59Å; P55-N60 WeakPolarHBondContact CA-O 3.49Å; P55-N60 WeakPolarHBondContact CB-O 3.28Å; N56-N60 PolarHBondContact N-O 3.1Å; N56-N60 WeakPolarHBondContact ND2-CB 3.36Å; N56-N60 PolarHBondContact ND2-OD1 3.46Å; N56-N60 PolarHBondContact OD1-N 2.93Å; N56-N60 PolarHBondContact OD1-OD1 3.02Å; N60-D65 HydrophobicContact CB-CB 4.42Å; N60-A66 HydrophobicContact CB-CB 4.32Å; N60-Q69 PolarHBondContact ND2-OE1 3.16Å
61V90.8Very high92.4Very high101 Ų10152.2 Ų52.261%0.61230%0.3SS*.SBendtrans-93.5-27.5178.2-174.40000111.4M54M54-V61 VanDerWaalsContact CB-O 3.22Å; M54-V61 WeakPolarHBondContact CB-O 3.44Å; M54-V61 WeakPolarHBondContact CG-O 3.41Å
62L92.4Very high92.3Very high97 Ų9754.2 Ų54.251%0.50831%0.312SS..SBendtrans-111.5138.2179.3-58.9174.7000111.2S64 D65 A66L62-S64 PolarHBondContact O-N 3.48Å; L62-D65 PolarHBondContact O-N 3.15Å; L62-D65 VanDerWaalsContact O-N 3.16Å; L62-A66 PolarHBondContact O-N 3.09Å
63Q94.6Very high92.3Very high22 Ų2255.3 Ų55.310%0.10332%0.317CS..Hα-helixtrans-63-28.2175.3-71-170.439.400112.5P38 I41 T52 M54 D65 A66 E67P38-Q63 PolarHBondContact O-NE2 3.05Å; I41-Q63 HydrophobicContact CD1-CB 4.47Å; I41-Q63 WeakPolarHBondContact CD1-O 3.37Å; I41-Q63 HydrophobicContact CG1-CB 4.33Å; T52-Q63 HydrophobicContact CG2-CG 4.38Å; T52-Q63 VanDerWaalsContact CG2-NE2 3.32Å; M54-Q63 HydrophobicContact CE-CG 4.5Å; M54-Q63 HydrophobicContact CG-CG 4.26Å; M54-Q63 HydrophobicContact SD-CG 4Å; Q63-D65 VanDerWaalsContact C-N 3.3Å; Q63-D65 PolarHBondContact O-N 3.43Å; Q63-A66 PolarHBondContact O-N 3.07Å; Q63-E67 WeakPolarHBondContact O-CB 3.2Å; Q63-E67 PolarHBondContact O-N 2.98Å
64S94.2Very high92.2Very high69 Ų6955.4 Ų55.448%0.48332%0.322SS..Hα-helixtrans-63-35.4174.851.90000112.8L62 E67 L68L62-S64 PolarHBondContact O-N 3.48Å; S64-E67 PolarHBondContact O-N 3.5Å; S64-L68 PolarHBondContact O-N 3.47Å; S64-L68 VanDerWaalsContact O-N 3.08Å
65D93.3Very high92.1Very high74 Ų7458 Ų5840%0.39634%0.342SS..Hα-helixtrans-74.5-39.1179.8-59.2-14.8000110.4N60 L62 Q63 E67 L68 Q69N60-D65 HydrophobicContact CB-CB 4.42Å; L62-D65 PolarHBondContact O-N 3.15Å; L62-D65 VanDerWaalsContact O-N 3.16Å; Q63-D65 VanDerWaalsContact C-N 3.3Å; Q63-D65 PolarHBondContact O-N 3.43Å; D65-E67 VanDerWaalsContact C-N 3.33Å; D65-L68 PolarHBondContact O-N 3.41Å; D65-Q69 PolarHBondContact O-N 3.34Å; D65-Q69 VanDerWaalsContact O-N 3.15Å
66A94.4Very high91.9Very high0 Ų055.1 Ų55.10%032%0.321CS..Hα-helixtrans-62.3-40.4171.800000111.4I41 N60 L62 Q63 Q69 L70 Y93I41-A66 HydrophobicContact CD1-CB 4.05Å; N60-A66 HydrophobicContact CB-CB 4.32Å; L62-A66 PolarHBondContact O-N 3.09Å; Q63-A66 PolarHBondContact O-N 3.07Å; A66-Q69 PolarHBondContact O-N 3.08Å; A66-L70 WeakPolarHBondContact O-CB 3.45Å; A66-L70 VanDerWaalsContact O-CG 3.29Å; A66-L70 WeakPolarHBondContact O-CG 3.31Å; A66-L70 PolarHBondContact O-N 3.11Å; A66-Y93 HydrophobicContact CB-CD1 4.34Å
67E95.3Very high91.7Very high68 Ų6856.8 Ų56.832%0.31833%0.33SS..Hα-helixtrans-61.1-46175.4-175.2163-14200111.5I41 Q63 S64 D65 Q69 L70 T71I41-E67 HydrophobicContact CD1-CB 4.01Å; I41-E67 HydrophobicContact CG1-CB 4.05Å; I41-E67 HydrophobicContact CG2-CB 4.17Å; I41-E67 HydrophobicContact CG2-CG 3.98Å; Q63-E67 WeakPolarHBondContact O-CB 3.2Å; Q63-E67 PolarHBondContact O-N 2.98Å; S64-E67 PolarHBondContact O-N 3.5Å; D65-E67 VanDerWaalsContact C-N 3.33Å; E67-Q69 VanDerWaalsContact C-N 3.31Å; E67-Q69 PolarHBondContact O-N 2.99Å; E67-L70 PolarHBondContact O-N 3.07Å; E67-T71 VanDerWaalsContact O-CG2 3.31Å; E67-T71 WeakPolarHBondContact O-CG2 3.42Å; E67-T71 PolarHBondContact O-N 2.99Å
68L93.4Very high91.5Very high120 Ų12060.6 Ų60.663%0.62835%0.346SS*.Hα-helixtrans-58.2-44176.9-176.764.4000111.5S64 D65 T71S64-L68 PolarHBondContact O-N 3.47Å; S64-L68 VanDerWaalsContact O-N 3.08Å; D65-L68 PolarHBondContact O-N 3.41Å; L68-T71 PolarHBondContact O-N 3.49Å; L68-T71 PolarHBondContact O-OG1 3.5Å
69Q92.7Very high91.3Very high78 Ų7865.1 Ų65.136%0.36436%0.36SS..Hα-helixtrans-67.8-41.1177.3-68.7-171.4-12.300112.2N60 D65 A66 E67 T71 T72 Y93N60-Q69 PolarHBondContact ND2-OE1 3.16Å; D65-Q69 PolarHBondContact O-N 3.34Å; D65-Q69 VanDerWaalsContact O-N 3.15Å; A66-Q69 PolarHBondContact O-N 3.08Å; E67-Q69 VanDerWaalsContact C-N 3.31Å; E67-Q69 PolarHBondContact O-N 2.99Å; Q69-T71 VanDerWaalsContact C-N 3.31Å; Q69-T71 PolarHBondContact O-N 3.38Å; Q69-T72 WeakPolarHBondContact O-CB 3.48Å; Q69-T72 PolarHBondContact O-N 3.38Å; Q69-T72 PolarHBondContact O-OG1 3.27Å; Q69-Y93 HydrophobicContact CB-CE1 3.87Å; Q69-Y93 VanDerWaalsContact OE1-CE1 3.27Å
70L93.7Very high91.2Very high0 Ų065.1 Ų65.10%036%0.36CS..Hα-helixtrans-61-37.8175.7-79.1169.9000112.6I41 M43 A66 E67 T72 F73 L89 Y93I41-L70 HydrophobicContact CD1-CD1 3.91Å; I41-L70 HydrophobicContact CG2-CD1 4.15Å; M43-L70 HydrophobicContact SD-CB 3.82Å; A66-L70 WeakPolarHBondContact O-CB 3.45Å; A66-L70 VanDerWaalsContact O-CG 3.29Å; A66-L70 WeakPolarHBondContact O-CG 3.31Å; A66-L70 PolarHBondContact O-N 3.11Å; E67-L70 PolarHBondContact O-N 3.07Å; L70-T72 PolarHBondContact O-N 3.29Å; L70-F73 WeakPolarHBondContact O-CB 3.4Å; L70-F73 PolarHBondContact O-N 3.47Å; L70-L89 HydrophobicContact CD2-CB 3.67Å; L70-Y93 HydrophobicContact CD1-CG 4.34Å; L70-Y93 HydrophobicContact CD2-CD2 3.46Å; L70-Y93 VanDerWaalsContact CD2-CD2 3.46Å; L70-Y93 HydrophobicContact CD2-CE2 4.19Å; L70-Y93 HydrophobicContact CD2-CG 3.82Å; L70-Y93 HydrophobicContact CG-CD1 4.46Å; L70-Y93 HydrophobicContact CG-CD2 3.98Å; L70-Y93 HydrophobicContact CG-CG 3.83Å
71T92.3Very high91Very high65 Ų6565.3 Ų65.340%0.39936%0.362SS..Hα-helixtrans-61.8-26.317960.80000113E67 L68 Q69 F73 T74E67-T71 VanDerWaalsContact O-CG2 3.31Å; E67-T71 WeakPolarHBondContact O-CG2 3.42Å; E67-T71 PolarHBondContact O-N 2.99Å; L68-T71 PolarHBondContact O-N 3.49Å; L68-T71 PolarHBondContact O-OG1 3.5Å; Q69-T71 VanDerWaalsContact C-N 3.31Å; Q69-T71 PolarHBondContact O-N 3.38Å; T71-F73 PolarHBondContact O-N 3.33Å; T71-T74 WeakPolarHBondContact CA-OG1 3.39Å; T71-T74 VanDerWaalsContact O-CB 3.24Å; T71-T74 WeakPolarHBondContact O-CB 3.44Å; T71-T74 PolarHBondContact O-N 2.88Å; T71-T74 PolarHBondContact O-OG1 3.49Å
72T91.1Very high91Very high98 Ų9861 Ų6160%0.60134%0.337SS*.THydrogen-bonded Turntrans-64.5-23.7175.271.80000113.1Q69 L70 P75Q69-T72 WeakPolarHBondContact O-CB 3.48Å; Q69-T72 PolarHBondContact O-N 3.38Å; Q69-T72 PolarHBondContact O-OG1 3.27Å; L70-T72 PolarHBondContact O-N 3.29Å; T72-P75 WeakPolarHBondContact O-CD 3.35Å
73F92.2Very high90.9Very high23 Ų2360.7 Ų60.710%0.10134%0.343CS..THydrogen-bonded Turntrans-87.9-3.7176.1-65-76.8000113.5L70 T71 P75 L76 I77 L89 Y93 P131 L134L70-F73 WeakPolarHBondContact O-CB 3.4Å; L70-F73 PolarHBondContact O-N 3.47Å; T71-F73 PolarHBondContact O-N 3.33Å; F73-P75 VanDerWaalsContact C-CD 3.45Å; F73-L76 HydrophobicContact CD1-CD2 4.48Å; F73-L76 WeakPolarHBondContact O-CB 3.42Å; F73-L76 PolarHBondContact O-N 2.93Å; F73-I77 HydrophobicContact CB-CD1 4.33Å; F73-I77 WeakPolarHBondContact O-CG1 3.24Å; F73-I77 PolarHBondContact O-N 3.47Å; F73-L89 HydrophobicContact CB-CD1 3.55Å; F73-L89 HydrophobicContact CD1-CD1 4.34Å; F73-L89 HydrophobicContact CD1-CD2 4.31Å; F73-L89 HydrophobicContact CD2-CD1 4.27Å; F73-L89 HydrophobicContact CD2-CD2 4.05Å; F73-L89 HydrophobicContact CE1-CD2 4.43Å; F73-L89 HydrophobicContact CE2-CD2 4.18Å; F73-L89 HydrophobicContact CG-CD1 3.82Å; F73-L89 HydrophobicContact CG-CD2 4.11Å; F73-L89 HydrophobicContact CZ-CD2 4.37Å; F73-Y93 HydrophobicContact CE2-CE2 4.12Å; F73-P131 HydrophobicContact CE1-CG 4.26Å; F73-P131 HydrophobicContact CZ-CG 4.17Å; F73-L134 HydrophobicContact CE1-CD1 4.16Å; F73-L134 HydrophobicContact CZ-CD1 3.92Å
74T89.4Confident90.7Very high48 Ų4860.2 Ų60.229%0.29434%0.341SS..Hα-helixtrans-51.9-45-179.7-54.20000113.2T71 L76 I77 Q78T71-T74 WeakPolarHBondContact CA-OG1 3.39Å; T71-T74 VanDerWaalsContact O-CB 3.24Å; T71-T74 WeakPolarHBondContact O-CB 3.44Å; T71-T74 PolarHBondContact O-N 2.88Å; T71-T74 PolarHBondContact O-OG1 3.49Å; T74-L76 VanDerWaalsContact C-N 3.3Å; T74-L76 PolarHBondContact O-N 2.85Å; T74-I77 PolarHBondContact O-N 2.88Å; T74-Q78 HydrophobicContact CG2-CG 4.29Å; T74-Q78 WeakPolarHBondContact O-CB 3.36Å; T74-Q78 WeakPolarHBondContact O-CG 3.46Å; T74-Q78 PolarHBondContact O-N 2.93Å
75P87.7Confident90.6Very high90 Ų9057.1 Ų57.158%0.58432%0.319SS*.Hα-helixtrans-60.2-39.3177.5-23.135.1000112.7T72 F73 Q78 Y79T72-P75 WeakPolarHBondContact O-CD 3.35Å; F73-P75 VanDerWaalsContact C-CD 3.45Å; P75-Q78 PolarHBondContact O-N 2.74Å; P75-Y79 WeakPolarHBondContact O-CB 3.35Å; P75-Y79 PolarHBondContact O-N 3.25Å
76L87.5Confident90.6Very high17 Ų1757.6 Ų57.69%0.08932%0.317CS..Hα-helixtrans-72.3-35.6179.7-168.769.3000112F73 T74 Y79 G80 L85 C119 V122 L123F73-L76 HydrophobicContact CD1-CD2 4.48Å; F73-L76 WeakPolarHBondContact O-CB 3.42Å; F73-L76 PolarHBondContact O-N 2.93Å; T74-L76 VanDerWaalsContact C-N 3.3Å; T74-L76 PolarHBondContact O-N 2.85Å; L76-Y79 WeakPolarHBondContact O-CB 3.45Å; L76-Y79 PolarHBondContact O-N 3.32Å; L76-G80 PolarHBondContact O-N 2.95Å; L76-L85 HydrophobicContact CB-CD2 4.24Å; L76-L85 HydrophobicContact CD2-CD2 3.91Å; L76-L85 HydrophobicContact CG-CD2 3.72Å; L76-C119 HydrophobicContact CD2-CB 4.43Å; L76-V122 HydrophobicContact CD1-CB 4.19Å; L76-V122 HydrophobicContact CD1-CG1 3.85Å; L76-L123 HydrophobicContact CD1-CD2 4.34Å; L76-L123 HydrophobicContact CD1-CG 4.27Å; L76-L123 HydrophobicContact CD2-CD1 4.15Å; L76-L123 HydrophobicContact CD2-CD2 4.01Å; L76-L123 HydrophobicContact CD2-CG 4.02Å
77I88.3Confident90.6Very high44 Ų4458.7 Ų58.723%0.22632%0.322CS..Hα-helixtrans-64.9-44.2173.3-65.7168.3000110.3M43 F73 T74 Y79 G80 L85 K86 L89M43-I77 HydrophobicContact CE-CD1 3.3Å; F73-I77 HydrophobicContact CB-CD1 4.33Å; F73-I77 WeakPolarHBondContact O-CG1 3.24Å; F73-I77 PolarHBondContact O-N 3.47Å; T74-I77 PolarHBondContact O-N 2.88Å; I77-Y79 VanDerWaalsContact C-N 3.33Å; I77-G80 PolarHBondContact O-N 2.9Å; I77-L85 HydrophobicContact CG1-CD2 3.99Å; I77-L85 HydrophobicContact CG1-CG 4.21Å; I77-K86 HydrophobicContact CG2-CB 4.46Å; I77-L89 HydrophobicContact CD1-CD1 3.86Å; I77-L89 HydrophobicContact CG1-CD1 4.04Å
78Q85.9Confident90.6Very high154 Ų15455.5 Ų55.572%0.7231%0.307SS*.Hα-helixtrans-68.2-32.9177.1-72.5177.8-8.500112.5T74 P75 G80T74-Q78 HydrophobicContact CG2-CG 4.29Å; T74-Q78 WeakPolarHBondContact O-CB 3.36Å; T74-Q78 WeakPolarHBondContact O-CG 3.46Å; T74-Q78 PolarHBondContact O-N 2.93Å; P75-Q78 PolarHBondContact O-N 2.74Å; Q78-G80 PolarHBondContact O-N 2.88Å
79Y87.3Confident90.8Very high130 Ų13049.8 Ų49.851%0.5128%0.277SS..Hα-helixtrans-60.5-31.7172.3-173.2-86.8000111.9P75 L76 I77 C81 V122P75-Y79 WeakPolarHBondContact O-CB 3.35Å; P75-Y79 PolarHBondContact O-N 3.25Å; L76-Y79 WeakPolarHBondContact O-CB 3.45Å; L76-Y79 PolarHBondContact O-N 3.32Å; I77-Y79 VanDerWaalsContact C-N 3.33Å; Y79-C81 HydrophobicContact CD1-CB 4.03Å; Y79-C81 HydrophobicContact CE1-CB 4.4Å; Y79-V122 HydrophobicContact CD1-CB 4.47Å; Y79-V122 HydrophobicContact CD1-CG1 3.74Å; Y79-V122 HydrophobicContact CD1-CG2 3.99Å; Y79-V122 HydrophobicContact CD2-CG1 4.23Å; Y79-V122 HydrophobicContact CE1-CB 4.2Å; Y79-V122 HydrophobicContact CE1-CG1 3.67Å; Y79-V122 HydrophobicContact CE1-CG2 3.41Å; Y79-V122 VanDerWaalsContact CE1-CG2 3.41Å; Y79-V122 HydrophobicContact CE2-CG1 4.16Å; Y79-V122 HydrophobicContact CG-CG1 4.03Å
80G86.4Confident90.9Very high51 Ų5146.1 Ų46.153%0.52626%0.26SS..THydrogen-bonded Turntrans74.432.5171.300000114.4L76 I77 Q78 S82L76-G80 PolarHBondContact O-N 2.95Å; I77-G80 PolarHBondContact O-N 2.9Å; Q78-G80 PolarHBondContact O-N 2.88Å; G80-S82 PolarHBondContact O-N 3.4Å
81C88.9Confident91Very high22 Ų2246.1 Ų46.115%0.14926%0.26CS..SBendtrans-59.7-31.2178.451.90000113.4Y79 K118 C119 V122Y79-C81 HydrophobicContact CD1-CB 4.03Å; Y79-C81 HydrophobicContact CE1-CB 4.4Å; C81-K118 WeakPolarHBondContact O-CB 3.13Å; C81-C119 HydrophobicContact CB-CB 3.94Å; C81-C119 WeakPolarHBondContact CB-SG 3.5Å; C81-C119 VanDerWaalsContact SG-CA 3.56Å; C81-C119 WeakPolarHBondContact SG-CB 3.34Å; C81-C119 CovalentContact SG-SG 2.04Å; C81-C119 PolarHBondContact SG-SG 2.98Å; C81-V122 HydrophobicContact CB-CG2 4.01Å
82S90.4Very high91.1Very high10 Ų1043 Ų437%0.0724%0.241CC..  trans-144.7134.6173.2176.50000110.1G80 Q84 L85G80-S82 PolarHBondContact O-N 3.4Å; S82-Q84 PolarHBondContact O-N 3.41Å; S82-Q84 PolarHBondContact OG-N 3.39Å; S82-L85 WeakPolarHBondContact O-CB 3.32Å; S82-L85 PolarHBondContact O-N 2.91Å
83S89.3Confident91.3Very high92 Ų9238.7 Ų38.764%0.64321%0.214SC*.THydrogen-bonded Turntrans-59.3-28.1171.845.80000112.1D155S83-D155 PolarHBondContact OG-OD1 3.38Å; S83-D155 VanDerWaalsContact OG-OD1 3.05Å
84Q90.9Very high91.5Very high11 Ų1137.6 Ų37.65%0.05121%0.209CC..THydrogen-bonded Turntrans-86.8-8.2-179.7-65.3-176.676.900114S82 K86 F87 F88 V115 P153 D155S82-Q84 PolarHBondContact O-N 3.41Å; S82-Q84 PolarHBondContact OG-N 3.39Å; Q84-K86 VanDerWaalsContact C-N 3.33Å; Q84-K86 PolarHBondContact O-N 3.48Å; Q84-F87 PolarHBondContact O-N 3.42Å; Q84-F88 WeakPolarHBondContact O-CB 3.35Å; Q84-F88 PolarHBondContact O-N 3.34Å; Q84-V115 HydrophobicContact CB-CG2 3.82Å; Q84-P153 VanDerWaalsContact CD-O 3.29Å; Q84-P153 VanDerWaalsContact CG-O 3.29Å; Q84-P153 WeakPolarHBondContact CG-O 3.16Å; Q84-P153 PolarHBondContact OE1-O 3.41Å; Q84-D155 WeakPolarHBondContact CG-OD1 3.3Å; Q84-D155 PolarHBondContact NE2-OD1 3.29Å; Q84-D155 PolarHBondContact NE2-OD2 2.93Å
85L93.1Very high91.7Very high4 Ų435.3 Ų35.32%0.02120%0.195CC..Hα-helixtrans-57.6-44.6-174.5175.362.7000112.3L76 I77 S82 F88 L89 V115L76-L85 HydrophobicContact CB-CD2 4.24Å; L76-L85 HydrophobicContact CD2-CD2 3.91Å; L76-L85 HydrophobicContact CG-CD2 3.72Å; I77-L85 HydrophobicContact CG1-CD2 3.99Å; I77-L85 HydrophobicContact CG1-CG 4.21Å; S82-L85 WeakPolarHBondContact O-CB 3.32Å; S82-L85 PolarHBondContact O-N 2.91Å; L85-F88 PolarHBondContact O-N 3.15Å; L85-L89 HydrophobicContact CD1-CD1 3.83Å; L85-L89 HydrophobicContact CD1-CG 3.99Å; L85-L89 HydrophobicContact CG-CD1 3.98Å; L85-L89 HydrophobicContact CG-CG 4.49Å; L85-L89 WeakPolarHBondContact O-CG 3.43Å; L85-L89 PolarHBondContact O-N 2.89Å; L85-V115 HydrophobicContact CB-CG1 4.15Å; L85-V115 HydrophobicContact CD1-CG1 3.5Å; L85-V115 HydrophobicContact CG-CG1 4.43Å
86K93.1Very high92Very high85 Ų8534.1 Ų34.137%0.3718%0.182SC..Hα-helixtrans-61.5-48179.3-177.8-176.8175.6-172.70111.4M43 I77 Q84 F88 L89 C90M43-K86 WeakPolarHBondContact O-CE 3.22Å; M43-K86 PolarHBondContact O-NZ 3.49Å; I77-K86 HydrophobicContact CG2-CB 4.46Å; Q84-K86 VanDerWaalsContact C-N 3.33Å; Q84-K86 PolarHBondContact O-N 3.48Å; K86-F88 VanDerWaalsContact C-N 3.34Å; K86-F88 PolarHBondContact O-N 2.71Å; K86-L89 PolarHBondContact O-N 2.92Å; K86-C90 WeakPolarHBondContact O-CB 3.45Å; K86-C90 PolarHBondContact O-N 2.98Å; K86-C90 VanDerWaalsContact O-N 3.11Å; K86-C90 PolarHBondContact O-SG 3.18Å; K86-C90 VanDerWaalsContact O-SG 3.35Å
87F94.3Very high92.1Very high23 Ų2333.8 Ų33.810%0.10118%0.182CC..Hα-helixtrans-63.7-40.8178.4-176.9-98.2000111.1L47 Y49 Q84 C90 S91 M111 M150 G152L47-F87 HydrophobicContact CB-CD2 4.02Å; L47-F87 HydrophobicContact CB-CE2 4.18Å; L47-F87 HydrophobicContact CD1-CD2 4.45Å; L47-F87 HydrophobicContact CD2-CD2 4.21Å; L47-F87 HydrophobicContact CG-CD2 4.46Å; L47-F87 WeakPolarHBondContact O-CE2 3.34Å; Y49-F87 HydrophobicContact CE1-CE2 4.24Å; Q84-F87 PolarHBondContact O-N 3.42Å; F87-C90 PolarHBondContact O-N 2.88Å; F87-S91 WeakPolarHBondContact O-CB 3.3Å; F87-S91 PolarHBondContact O-N 2.83Å; F87-S91 PolarHBondContact O-OG 3.23Å; F87-M111 HydrophobicContact CD1-CE 3.32Å; F87-M111 HydrophobicContact CD1-SD 3.71Å; F87-M111 HydrophobicContact CE1-CE 3.86Å; F87-M111 HydrophobicContact CE1-SD 3.81Å; F87-M111 HydrophobicContact CG-CE 4.35Å; F87-M150 HydrophobicContact CE1-CB 4.08Å; F87-M150 HydrophobicContact CZ-CB 4.13Å; F87-M150 HydrophobicContact CZ-CG 4.49Å; F87-M150 HydrophobicContact CZ-SD 3.87Å; F87-G152 VanDerWaalsContact CE1-CA 3.43Å
88F95.6Very high92Very high0 Ų033.8 Ų33.80%018%0.184CC..Hα-helixtrans-58.8-53.3174.9174.6-113.4000113Q84 L85 K86 C90 S91 V92 P107 M111 C112 V115 W130 L134 F139Q84-F88 WeakPolarHBondContact O-CB 3.35Å; Q84-F88 PolarHBondContact O-N 3.34Å; L85-F88 PolarHBondContact O-N 3.15Å; K86-F88 VanDerWaalsContact C-N 3.34Å; K86-F88 PolarHBondContact O-N 2.71Å; F88-C90 VanDerWaalsContact C-N 3.32Å; F88-C90 PolarHBondContact O-N 2.98Å; F88-S91 WeakPolarHBondContact CA-OG 3.03Å; F88-S91 PolarHBondContact O-N 3.07Å; F88-S91 PolarHBondContact O-OG 2.95Å; F88-V92 HydrophobicContact CD2-CG2 4.37Å; F88-V92 HydrophobicContact CE2-CG2 3.96Å; F88-V92 HydrophobicContact CZ-CG2 4.22Å; F88-V92 WeakPolarHBondContact O-CG2 3.37Å; F88-V92 PolarHBondContact O-N 2.84Å; F88-P107 HydrophobicContact CD2-CB 3.89Å; F88-P107 HydrophobicContact CD2-CG 3.84Å; F88-P107 HydrophobicContact CE2-CB 4.18Å; F88-P107 HydrophobicContact CE2-CG 3.73Å; F88-M111 HydrophobicContact CB-CE 3.33Å; F88-M111 HydrophobicContact CD2-CE 3.96Å; F88-M111 HydrophobicContact CG-CE 4.14Å; F88-M111 VanDerWaalsContact N-CE 3.27Å; F88-C112 HydrophobicContact CD2-CB 4.38Å; F88-C112 HydrophobicContact CE2-CB 3.61Å; F88-C112 HydrophobicContact CZ-CB 4.07Å; F88-C112 VanDerWaalsContact CZ-SG 3.6Å; F88-V115 HydrophobicContact CB-CG2 3.99Å; F88-V115 HydrophobicContact CD1-CB 4.37Å; F88-V115 HydrophobicContact CD1-CG1 3.95Å; F88-V115 HydrophobicContact CG-CB 4.46Å; F88-V115 HydrophobicContact CG-CG1 4.42Å; F88-V115 HydrophobicContact CG-CG2 4.33Å; F88-W130 HydrophobicContact CE1-CH2 4.25Å; F88-W130 AromaticContact CE1-CZ2 3.88Å; F88-W130 HydrophobicContact CE1-CZ2 3.88Å; F88-W130 HydrophobicContact CZ-CZ2 4.3Å; F88-L134 HydrophobicContact CE1-CB 4.35Å; F88-L134 HydrophobicContact CE1-CD1 4.25Å; F88-L134 HydrophobicContact CE1-CD2 4.12Å; F88-L134 HydrophobicContact CE1-CG 4.48Å; F88-L134 HydrophobicContact CZ-CB 4.32Å; F88-L134 HydrophobicContact CZ-CD2 4.25Å; F88-F139 HydrophobicContact CE2-CD2 4.4Å; F88-F139 AromaticContact CE2-CE2 3.86Å; F88-F139 HydrophobicContact CE2-CE2 3.86Å; F88-F139 HydrophobicContact CE2-CZ 4.39Å; F88-F139 AromaticContact CZ-CE2 3.96Å; F88-F139 HydrophobicContact CZ-CE2 3.96Å; F88-F139 HydrophobicContact CZ-CZ 4.48Å
89L95.8Very high91.9Very high1 Ų133.2 Ų33.21%0.00519%0.186CC..Hα-helixtrans-60.1-45.3-179.5-68.7170.4000111L70 F73 I77 L85 K86 S91 V92 Y93 L134L70-L89 HydrophobicContact CD2-CB 3.67Å; F73-L89 HydrophobicContact CB-CD1 3.55Å; F73-L89 HydrophobicContact CD1-CD1 4.34Å; F73-L89 HydrophobicContact CD1-CD2 4.31Å; F73-L89 HydrophobicContact CD2-CD1 4.27Å; F73-L89 HydrophobicContact CD2-CD2 4.05Å; F73-L89 HydrophobicContact CE1-CD2 4.43Å; F73-L89 HydrophobicContact CE2-CD2 4.18Å; F73-L89 HydrophobicContact CG-CD1 3.82Å; F73-L89 HydrophobicContact CG-CD2 4.11Å; F73-L89 HydrophobicContact CZ-CD2 4.37Å; I77-L89 HydrophobicContact CD1-CD1 3.86Å; I77-L89 HydrophobicContact CG1-CD1 4.04Å; L85-L89 HydrophobicContact CD1-CD1 3.83Å; L85-L89 HydrophobicContact CD1-CG 3.99Å; L85-L89 HydrophobicContact CG-CD1 3.98Å; L85-L89 HydrophobicContact CG-CG 4.49Å; L85-L89 WeakPolarHBondContact O-CG 3.43Å; L85-L89 PolarHBondContact O-N 2.89Å; K86-L89 PolarHBondContact O-N 2.92Å; L89-S91 PolarHBondContact O-N 3.39Å; L89-V92 PolarHBondContact O-N 3.34Å; L89-V92 VanDerWaalsContact O-N 3.15Å; L89-Y93 HydrophobicContact CD2-CE2 4.38Å; L89-Y93 VanDerWaalsContact O-CD2 3.3Å; L89-Y93 WeakPolarHBondContact O-CD2 3.31Å; L89-Y93 PolarHBondContact O-N 2.91Å; L89-L134 HydrophobicContact CD2-CD1 3.86Å; L89-L134 HydrophobicContact CD2-CD2 4.42Å
90C95.9Very high91.5Very high0 Ų036.2 Ų36.20%020%0.201CC..Hα-helixtrans-64.1-37.6177.4-67.90000113C44 L47 Y49 K86 F87 F88 V92 Y93 V94C44-C90 WeakPolarHBondContact CA-SG 3.22Å; C44-C90 HydrophobicContact CB-CB 3.68Å; C44-C90 WeakPolarHBondContact CB-SG 3.32Å; C44-C90 WeakPolarHBondContact SG-CB 3.35Å; C44-C90 CovalentContact SG-SG 2.04Å; C44-C90 PolarHBondContact SG-SG 2.9Å; L47-C90 HydrophobicContact CD1-CB 3.19Å; L47-C90 VanDerWaalsContact CD1-SG 3.58Å; Y49-C90 PolarHBondContact OH-O 2.91Å; K86-C90 WeakPolarHBondContact O-CB 3.45Å; K86-C90 PolarHBondContact O-N 2.98Å; K86-C90 VanDerWaalsContact O-N 3.11Å; K86-C90 PolarHBondContact O-SG 3.18Å; K86-C90 VanDerWaalsContact O-SG 3.35Å; F87-C90 PolarHBondContact O-N 2.88Å; F88-C90 VanDerWaalsContact C-N 3.32Å; F88-C90 PolarHBondContact O-N 2.98Å; C90-V92 PolarHBondContact O-N 3.49Å; C90-Y93 PolarHBondContact O-N 2.77Å; C90-V94 HydrophobicContact CB-CG2 4.13Å; C90-V94 CarbonylContact O-C 3.46Å; C90-V94 WeakPolarHBondContact O-CA 3.32Å; C90-V94 WeakPolarHBondContact O-CG2 3.49Å; C90-V94 PolarHBondContact O-N 3.37Å; C90-V94 VanDerWaalsContact O-O 3.04Å
91S94.9Very high91.2Very high0 Ų035.2 Ų35.20%019%0.185CC..Hα-helixtrans-65.4-19.7176.167.10000114.4F87 F88 L89 P95 P107 M150F87-S91 WeakPolarHBondContact O-CB 3.3Å; F87-S91 PolarHBondContact O-N 2.83Å; F87-S91 PolarHBondContact O-OG 3.23Å; F88-S91 WeakPolarHBondContact CA-OG 3.03Å; F88-S91 PolarHBondContact O-N 3.07Å; F88-S91 PolarHBondContact O-OG 2.95Å; L89-S91 PolarHBondContact O-N 3.39Å; S91-P95 WeakPolarHBondContact O-CA 3.25Å; S91-P95 WeakPolarHBondContact O-CB 3.44Å; S91-P107 VanDerWaalsContact OG-CB 3.32Å; S91-P107 WeakPolarHBondContact OG-CB 3.29Å; S91-P107 WeakPolarHBondContact OG-CD 3.37Å; S91-P107 WeakPolarHBondContact OG-CG 3.31Å; S91-M150 VanDerWaalsContact CB-CE 3.5Å
92V95.4Very high90.6Very high0 Ų038 Ų380%020%0.202CC..Hα-helixtrans-91.7-45.9176.7175.50000111.1L57 V58 F88 L89 C90 P107 L134 F139L57-V92 HydrophobicContact CB-CG1 4.42Å; L57-V92 PolarHBondContact N-O 3.28Å; V58-V92 HydrophobicContact CG2-CG1 3.47Å; V58-V92 VanDerWaalsContact CG2-CG1 3.47Å; F88-V92 HydrophobicContact CD2-CG2 4.37Å; F88-V92 HydrophobicContact CE2-CG2 3.96Å; F88-V92 HydrophobicContact CZ-CG2 4.22Å; F88-V92 WeakPolarHBondContact O-CG2 3.37Å; F88-V92 PolarHBondContact O-N 2.84Å; L89-V92 PolarHBondContact O-N 3.34Å; L89-V92 VanDerWaalsContact O-N 3.15Å; C90-V92 PolarHBondContact O-N 3.49Å; V92-P107 HydrophobicContact CG2-CG 3.65Å; V92-L134 HydrophobicContact CB-CD2 4.36Å; V92-L134 HydrophobicContact CG1-CD2 3.93Å; V92-L134 HydrophobicContact CG2-CD2 4.31Å; V92-F139 HydrophobicContact CG1-CZ 4.43Å; V92-F139 HydrophobicContact CG2-CE1 4Å; V92-F139 HydrophobicContact CG2-CE2 4.47Å; V92-F139 HydrophobicContact CG2-CZ 3.65Å
93Y95.4Very high90.2Very high7 Ų743.2 Ų43.23%0.02723%0.228CC..Hα-helixtrans-87-25.3-173.2-78.3-79.4000114.2N56 V58 A66 Q69 L70 F73 L89 C90 L134N56-Y93 WeakPolarHBondContact CB-O 3.32Å; N56-Y93 PolarHBondContact ND2-O 3.35Å; V58-Y93 HydrophobicContact CB-CD1 4.47Å; V58-Y93 HydrophobicContact CB-CE1 4.13Å; V58-Y93 HydrophobicContact CG1-CE1 4.11Å; V58-Y93 HydrophobicContact CG2-CD1 4.12Å; V58-Y93 HydrophobicContact CG2-CE1 3.84Å; A66-Y93 HydrophobicContact CB-CD1 4.34Å; Q69-Y93 HydrophobicContact CB-CE1 3.87Å; Q69-Y93 VanDerWaalsContact OE1-CE1 3.27Å; L70-Y93 HydrophobicContact CD1-CG 4.34Å; L70-Y93 HydrophobicContact CD2-CD2 3.46Å; L70-Y93 VanDerWaalsContact CD2-CD2 3.46Å; L70-Y93 HydrophobicContact CD2-CE2 4.19Å; L70-Y93 HydrophobicContact CD2-CG 3.82Å; L70-Y93 HydrophobicContact CG-CD1 4.46Å; L70-Y93 HydrophobicContact CG-CD2 3.98Å; L70-Y93 HydrophobicContact CG-CG 3.83Å; F73-Y93 HydrophobicContact CE2-CE2 4.12Å; L89-Y93 HydrophobicContact CD2-CE2 4.38Å; L89-Y93 VanDerWaalsContact O-CD2 3.3Å; L89-Y93 WeakPolarHBondContact O-CD2 3.31Å; L89-Y93 PolarHBondContact O-N 2.91Å; C90-Y93 PolarHBondContact O-N 2.77Å; Y93-L134 HydrophobicContact CE2-CD2 4.28Å
94V95.5Very high90.1Very high0 Ų040 Ų400%021%0.206CC..SBendtrans-138.969.4172.9-75.80000109I39 I41 C44 Y49 T52 C90I39-V94 HydrophobicContact CG2-CG2 4.41Å; I41-V94 HydrophobicContact CD1-CG1 3.48Å; I41-V94 VanDerWaalsContact CD1-CG1 3.48Å; I41-V94 HydrophobicContact CG1-CG1 4.26Å; C44-V94 HydrophobicContact CB-CG2 3.54Å; Y49-V94 WeakPolarHBondContact CE2-O 3.28Å; Y49-V94 PolarHBondContact OH-O 2.88Å; T52-V94 HydrophobicContact CG2-CB 4.42Å; T52-V94 HydrophobicContact CG2-CG1 4.4Å; T52-V94 WeakPolarHBondContact OG1-CA 3.49Å; C90-V94 HydrophobicContact CB-CG2 4.13Å; C90-V94 CarbonylContact O-C 3.46Å; C90-V94 WeakPolarHBondContact O-CA 3.32Å; C90-V94 WeakPolarHBondContact O-CG2 3.49Å; C90-V94 PolarHBondContact O-N 3.37Å; C90-V94 VanDerWaalsContact O-O 3.04Å
95P94.8Very high90.2Very high0 Ų040.5 Ų40.50%021%0.208CC..  trans-64157.9-175.329.3-37.6000112.3T52 N56 L57 S91 P104 I105T52-P95 VanDerWaalsContact CA-O 3.27Å; T52-P95 WeakPolarHBondContact CA-O 3.05Å; T52-P95 VanDerWaalsContact CB-O 3.31Å; T52-P95 WeakPolarHBondContact CB-O 3.49Å; T52-P95 PolarHBondContact OG1-O 2.9Å; N56-P95 HydrophobicContact CB-CG 4.45Å; L57-P95 HydrophobicContact CD1-CB 4.42Å; L57-P95 HydrophobicContact CG-CB 4.31Å; L57-P95 HydrophobicContact CG-CG 4.23Å; S91-P95 WeakPolarHBondContact O-CA 3.25Å; S91-P95 WeakPolarHBondContact O-CB 3.44Å; P95-P104 HydrophobicContact CB-CB 3.79Å; P95-P104 HydrophobicContact CG-CB 3.44Å; P95-P104 VanDerWaalsContact CG-CB 3.44Å; P95-P104 HydrophobicContact CG-CG 4.23Å; P95-I105 VanDerWaalsContact CB-O 3.26Å; P95-I105 WeakPolarHBondContact CB-O 3.18Å
96M92.7Very high90.2Very high65 Ų6540.7 Ų40.732%0.3221%0.211SC..EExtended strand (participates in β ladder)trans-69.4137.8-179.8179.3-179.3178.900111.1Y49 I105 M150Y49-M96 HydrophobicContact CD1-CB 4.32Å; Y49-M96 HydrophobicContact CD2-CB 3.75Å; Y49-M96 HydrophobicContact CD2-CG 4.06Å; Y49-M96 HydrophobicContact CE2-CB 4Å; Y49-M96 HydrophobicContact CG-CB 3.92Å; Y49-M96 HydrophobicContact CG-CG 4Å; Y49-M96 HydrophobicContact CG-SD 4.45Å; M96-I105 HydrophobicContact CB-CB 4.33Å; M96-I105 PolarHBondContact N-O 3.44Å; M96-I105 PolarHBondContact O-N 3.32Å; M96-M150 HydrophobicContact CB-CE 4.26Å; M96-M150 HydrophobicContact CB-SD 4.17Å
97C90.9Very high90.3Very high11 Ų1136.6 Ų36.67%0.07419%0.193CC..EExtended strand (participates in β ladder)trans-114.1146.8174.1-179.30000111.5C36 V51 K53C36-C97 VanDerWaalsContact CA-SG 3.58Å; C36-C97 HydrophobicContact CB-CB 3.7Å; C36-C97 WeakPolarHBondContact CB-SG 3.45Å; C36-C97 WeakPolarHBondContact SG-CB 3.49Å; C36-C97 CovalentContact SG-SG 2.03Å; C36-C97 PolarHBondContact SG-SG 2.89Å; V51-C97 PolarHBondContact O-N 3.39Å; K53-C97 HydrophobicContact CB-CB 3.97Å
98T86.6Confident90.2Very high44 Ų4435.6 Ų35.627%0.2719%0.189SC..EExtended strand (participates in β ladder)trans-151.3143.3172.7-178.60000110.1K100 V101 I105T98-K100 HydrophobicContact CG2-CB 4.43Å; T98-K100 PolarHBondContact O-N 3.35Å; T98-V101 HydrophobicContact CG2-CB 3.78Å; T98-V101 HydrophobicContact CG2-CG2 3.59Å; T98-V101 PolarHBondContact O-N 2.9Å; T98-V101 VanDerWaalsContact O-N 3.12Å; T98-I105 HydrophobicContact CG2-CD1 4.12Å
99D82.2Confident90.1Very high142 Ų14239 Ų3976%0.75920%0.204SC*.THydrogen-bonded Turntrans-66.5-11.7-178.5-49.9-38.1000113
100K79.4Confident89.7Confident192 Ų19242 Ų4284%0.83523%0.225SC*.THydrogen-bonded Turntrans-82.4-13.2178.2-61.2-174.5-179-179.70113.4T98T98-K100 HydrophobicContact CG2-CB 4.43Å; T98-K100 PolarHBondContact O-N 3.35Å
101V80.1Confident89.5Confident30 Ų3042.2 Ų42.218%0.18223%0.226CC..EExtended strand (participates in β ladder)trans-137.3124-171-173.20000109.4T98 I103 I105 M148T98-V101 HydrophobicContact CG2-CB 3.78Å; T98-V101 HydrophobicContact CG2-CG2 3.59Å; T98-V101 PolarHBondContact O-N 2.9Å; T98-V101 VanDerWaalsContact O-N 3.12Å; V101-I103 PolarHBondContact O-N 3.4Å; V101-I105 HydrophobicContact CG2-CD1 4.49Å; V101-M148 HydrophobicContact CB-CE 4.07Å; V101-M148 HydrophobicContact CG1-CE 3.58Å; V101-M148 HydrophobicContact CG2-CE 3.24Å; V101-M148 HydrophobicContact CG2-SD 3.81Å
102P76.5Confident89.5Confident80 Ų8042.2 Ų42.252%0.51923%0.226SC..EExtended strand (participates in β ladder)trans-71.9-18.2-173.126.6-33.3000114M34 K53M34-P102 HydrophobicContact CE-CB 3.72Å; M34-P102 HydrophobicContact SD-CB 3.88Å; K53-P102 PolarHBondContact NZ-O 3.3Å
103I81.3Confident89.2Confident120 Ų12045.8 Ų45.862%0.61525%0.245SC*.EExtended strand (participates in β ladder)trans-111.5138.1-173.1-56.4168.9000109.6V101V101-I103 PolarHBondContact O-N 3.4Å
104P88.4Confident88.9Confident26 Ų2646.2 Ų46.217%0.16925%0.249CC..EExtended strand (participates in β ladder)trans-59.5136.617322.7-32.5000112.4L57 P95L57-P104 HydrophobicContact CD2-CG 4.1Å; P95-P104 HydrophobicContact CB-CB 3.79Å; P95-P104 HydrophobicContact CG-CB 3.44Å; P95-P104 VanDerWaalsContact CG-CB 3.44Å; P95-P104 HydrophobicContact CG-CG 4.23Å
105I91.9Very high88.8Confident20 Ų2046.2 Ų46.210%0.10325%0.249CC..EExtended strand (participates in β ladder)trans-89.8120.7-178.2-57.9172.4000108.6P95 M96 T98 V101 M148 M150P95-I105 VanDerWaalsContact CB-O 3.26Å; P95-I105 WeakPolarHBondContact CB-O 3.18Å; M96-I105 HydrophobicContact CB-CB 4.33Å; M96-I105 PolarHBondContact N-O 3.44Å; M96-I105 PolarHBondContact O-N 3.32Å; T98-I105 HydrophobicContact CG2-CD1 4.12Å; V101-I105 HydrophobicContact CG2-CD1 4.49Å; I105-M148 HydrophobicContact CD1-CB 4.11Å; I105-M148 HydrophobicContact CD1-SD 4.26Å; I105-M148 HydrophobicContact CG1-CB 4.23Å; I105-M148 HydrophobicContact CG2-CB 4.2Å; I105-M150 HydrophobicContact CG2-CG 4.34Å; I105-M150 WeakPolarHBondContact O-CE 3.4Å
106G93.4Very high88.7Confident8 Ų849 Ų498%0.08226%0.261CS..  trans-104.2-168.8-179.800000114.3C149 M150G106-C149 CarbonylContact O-C 3.56Å; G106-C149 WeakPolarHBondContact O-CA 3.38Å; G106-M150 PolarHBondContact O-N 2.96Å
107P95Very high88.6Confident0 Ų053.8 Ų53.80%028%0.276CS..BIsolated β-bridgetrans-72.2155.417629.4-32.6000112.1F88 S91 V92 M111 F139F88-P107 HydrophobicContact CD2-CB 3.89Å; F88-P107 HydrophobicContact CD2-CG 3.84Å; F88-P107 HydrophobicContact CE2-CB 4.18Å; F88-P107 HydrophobicContact CE2-CG 3.73Å; S91-P107 VanDerWaalsContact OG-CB 3.32Å; S91-P107 WeakPolarHBondContact OG-CB 3.29Å; S91-P107 WeakPolarHBondContact OG-CD 3.37Å; S91-P107 WeakPolarHBondContact OG-CG 3.31Å; V92-P107 HydrophobicContact CG2-CG 3.65Å; P107-M111 HydrophobicContact CB-CE 4.15Å; P107-M111 HydrophobicContact CB-SD 4.29Å; P107-F139 HydrophobicContact CG-CD1 3.97Å; P107-F139 HydrophobicContact CG-CD2 4.28Å; P107-F139 HydrophobicContact CG-CE1 4.02Å; P107-F139 HydrophobicContact CG-CE2 4.34Å; P107-F139 HydrophobicContact CG-CG 4.12Å; P107-F139 HydrophobicContact CG-CZ 4.22Å; P107-F139 WeakPolarHBondContact O-CB 3.47Å
108C93.3Very high88.4Confident1 Ų156.9 Ų56.91%0.00729%0.288CS..  trans-75.6153.9166.7-60.50000111.4S110 M111 C112 C149 M150C108-S110 VanDerWaalsContact C-N 3.26Å; C108-S110 PolarHBondContact O-N 3.3Å; C108-M111 PolarHBondContact O-N 3.4Å; C108-C112 PolarHBondContact O-N 2.88Å; C108-C112 VanDerWaalsContact O-N 3.13Å; C108-C149 WeakPolarHBondContact CA-SG 3.34Å; C108-C149 HydrophobicContact CB-CB 3.94Å; C108-C149 WeakPolarHBondContact CB-SG 3.43Å; C108-C149 WeakPolarHBondContact SG-CB 3.35Å; C108-C149 PolarHBondContact SG-O 3.36Å; C108-C149 CovalentContact SG-SG 2.03Å; C108-C149 PolarHBondContact SG-SG 3.46Å; C108-M150 PolarHBondContact N-O 2.78Å; C108-M150 VanDerWaalsContact SG-C 3.51Å
109K92.4Very high88.6Confident72 Ų7254.8 Ų54.831%0.31328%0.275SS..Hα-helixtrans-57.8-37.3176.1-175.6167.7-175177.30112.7M111 C112 L113 C136 P140K109-M111 PolarHBondContact O-N 2.96Å; K109-C112 PolarHBondContact O-N 3.37Å; K109-L113 HydrophobicContact CG-CD1 3.92Å; K109-L113 HydrophobicContact CG-CG 4.22Å; K109-L113 WeakPolarHBondContact O-CB 3.23Å; K109-L113 VanDerWaalsContact O-CG 3.25Å; K109-L113 WeakPolarHBondContact O-CG 3.4Å; K109-L113 PolarHBondContact O-N 3.48Å; K109-C136 HydrophobicContact CG-CB 4.41Å; K109-C136 WeakPolarHBondContact CG-O 3.3Å; K109-P140 WeakPolarHBondContact CB-O 3.32Å; K109-P140 PolarHBondContact N-O 2.94Å
110S88.7Confident88.9Confident65 Ų6549.9 Ų49.946%0.45525%0.248SC..Hα-helixtrans-57.5-47.5177.551.20000111.9C108 L113 S114C108-S110 VanDerWaalsContact C-N 3.26Å; C108-S110 PolarHBondContact O-N 3.3Å; S110-L113 PolarHBondContact O-N 3.29Å; S110-S114 PolarHBondContact O-N 2.9Å
111M91.1Very high89.2Confident3 Ų344.5 Ų44.52%0.01523%0.233CC..Hα-helixtrans-64.2-46.1177.1-171.1-176.7131.200111.4F87 F88 P107 C108 K109 L113 S114 V115 G152F87-M111 HydrophobicContact CD1-CE 3.32Å; F87-M111 HydrophobicContact CD1-SD 3.71Å; F87-M111 HydrophobicContact CE1-CE 3.86Å; F87-M111 HydrophobicContact CE1-SD 3.81Å; F87-M111 HydrophobicContact CG-CE 4.35Å; F88-M111 HydrophobicContact CB-CE 3.33Å; F88-M111 HydrophobicContact CD2-CE 3.96Å; F88-M111 HydrophobicContact CG-CE 4.14Å; F88-M111 VanDerWaalsContact N-CE 3.27Å; P107-M111 HydrophobicContact CB-CE 4.15Å; P107-M111 HydrophobicContact CB-SD 4.29Å; C108-M111 PolarHBondContact O-N 3.4Å; K109-M111 PolarHBondContact O-N 2.96Å; M111-L113 PolarHBondContact O-N 3.44Å; M111-S114 WeakPolarHBondContact O-CB 3.32Å; M111-S114 PolarHBondContact O-N 3.2Å; M111-V115 WeakPolarHBondContact O-CG2 3.37Å; M111-V115 PolarHBondContact O-N 3.44Å; M111-G152 VanDerWaalsContact SD-CA 3.59Å
112C94.2Very high89.4Confident0 Ų043.7 Ų43.70%023%0.228CC..Hα-helixtrans-57.3-47.5174.6-178.90000111.9F88 C108 K109 S114 V115 K116 L134 C136 F139F88-C112 HydrophobicContact CD2-CB 4.38Å; F88-C112 HydrophobicContact CE2-CB 3.61Å; F88-C112 HydrophobicContact CZ-CB 4.07Å; F88-C112 VanDerWaalsContact CZ-SG 3.6Å; C108-C112 PolarHBondContact O-N 2.88Å; C108-C112 VanDerWaalsContact O-N 3.13Å; K109-C112 PolarHBondContact O-N 3.37Å; C112-S114 VanDerWaalsContact C-N 3.3Å; C112-S114 PolarHBondContact O-N 3.28Å; C112-V115 PolarHBondContact O-N 3.12Å; C112-K116 WeakPolarHBondContact O-CB 3.27Å; C112-K116 PolarHBondContact O-N 2.86Å; C112-L134 PolarHBondContact SG-O 3.4Å; C112-C136 HydrophobicContact CB-CB 3.74Å; C112-C136 WeakPolarHBondContact CB-SG 3.38Å; C112-C136 PolarHBondContact O-SG 3.46Å; C112-C136 WeakPolarHBondContact SG-CA 3.15Å; C112-C136 WeakPolarHBondContact SG-CB 3.39Å; C112-C136 CovalentContact SG-SG 2.04Å; C112-C136 PolarHBondContact SG-SG 3.39Å; C112-F139 HydrophobicContact CB-CD2 3.78Å; C112-F139 HydrophobicContact CB-CE2 4.2Å
113L90.1Very high89.7Confident75 Ų7540.9 Ų40.939%0.39321%0.209SC..Hα-helixtrans-63.5-36.8178.7-72.2172.8000111.6K109 S110 M111 R117 C136K109-L113 HydrophobicContact CG-CD1 3.92Å; K109-L113 HydrophobicContact CG-CG 4.22Å; K109-L113 WeakPolarHBondContact O-CB 3.23Å; K109-L113 VanDerWaalsContact O-CG 3.25Å; K109-L113 WeakPolarHBondContact O-CG 3.4Å; K109-L113 PolarHBondContact O-N 3.48Å; S110-L113 PolarHBondContact O-N 3.29Å; M111-L113 PolarHBondContact O-N 3.44Å; L113-R117 VanDerWaalsContact O-CB 3.28Å; L113-R117 WeakPolarHBondContact O-CB 3.12Å; L113-R117 PolarHBondContact O-N 2.97Å; L113-C136 HydrophobicContact CD2-CB 3.88Å; L113-C136 HydrophobicContact CG-CB 4.08Å
114S89Confident89.9Confident17 Ų1739.5 Ų39.512%0.11920%0.199CC..Hα-helixtrans-62.7-52.2175.2-168.50000111.9S110 M111 C112 R117 K118S110-S114 PolarHBondContact O-N 2.9Å; M111-S114 WeakPolarHBondContact O-CB 3.32Å; M111-S114 PolarHBondContact O-N 3.2Å; C112-S114 VanDerWaalsContact C-N 3.3Å; C112-S114 PolarHBondContact O-N 3.28Å; S114-R117 PolarHBondContact O-N 3.12Å; S114-K118 PolarHBondContact O-N 3.2Å
115V92.8Very high89.3Confident0 Ų045 Ų450%022%0.223CC..Hα-helixtrans-62.6-45.3178.4175.40000110.9Q84 L85 F88 M111 C112 R117 K118 C119 W130Q84-V115 HydrophobicContact CB-CG2 3.82Å; L85-V115 HydrophobicContact CB-CG1 4.15Å; L85-V115 HydrophobicContact CD1-CG1 3.5Å; L85-V115 HydrophobicContact CG-CG1 4.43Å; F88-V115 HydrophobicContact CB-CG2 3.99Å; F88-V115 HydrophobicContact CD1-CB 4.37Å; F88-V115 HydrophobicContact CD1-CG1 3.95Å; F88-V115 HydrophobicContact CG-CB 4.46Å; F88-V115 HydrophobicContact CG-CG1 4.42Å; F88-V115 HydrophobicContact CG-CG2 4.33Å; M111-V115 WeakPolarHBondContact O-CG2 3.37Å; M111-V115 PolarHBondContact O-N 3.44Å; C112-V115 PolarHBondContact O-N 3.12Å; V115-R117 VanDerWaalsContact C-N 3.35Å; V115-R117 PolarHBondContact O-N 3.44Å; V115-K118 PolarHBondContact O-N 3.38Å; V115-C119 VanDerWaalsContact O-CB 3.29Å; V115-C119 WeakPolarHBondContact O-CB 3.35Å; V115-C119 PolarHBondContact O-N 2.76Å; V115-W130 HydrophobicContact CG1-CH2 4.21Å
116K92.6Very high88.7Confident58 Ų5850.1 Ų50.125%0.25225%0.245SC..Hα-helixtrans-58.3-46.1176.9-176.5173.9-178.4178.50111.2C112 K118 C119 L120 W130C112-K116 WeakPolarHBondContact O-CB 3.27Å; C112-K116 PolarHBondContact O-N 2.86Å; K116-K118 VanDerWaalsContact C-N 3.29Å; K116-K118 PolarHBondContact O-N 3.05Å; K116-C119 PolarHBondContact O-N 3.27Å; K116-L120 HydrophobicContact CG-CB 4.24Å; K116-L120 HydrophobicContact CG-CD2 4.22Å; K116-L120 WeakPolarHBondContact O-CA 3.5Å; K116-L120 WeakPolarHBondContact O-CB 3.03Å; K116-L120 PolarHBondContact O-N 2.88Å; K116-W130 HydrophobicContact CB-CD2 4.34Å; K116-W130 HydrophobicContact CB-CE3 4.43Å; K116-W130 HydrophobicContact CB-CH2 3.97Å; K116-W130 HydrophobicContact CB-CZ2 3.84Å; K116-W130 HydrophobicContact CB-CZ3 4.26Å; K116-W130 HydrophobicContact CD-CD2 4.03Å; K116-W130 HydrophobicContact CD-CG 4.05Å; K116-W130 HydrophobicContact CG-CD2 3.78Å; K116-W130 HydrophobicContact CG-CE3 3.99Å; K116-W130 HydrophobicContact CG-CG 4.26Å; K116-W130 HydrophobicContact CG-CH2 4.41Å; K116-W130 HydrophobicContact CG-CZ2 4.2Å; K116-W130 HydrophobicContact CG-CZ3 4.31Å
117R90.3Very high88Confident166 Ų16653 Ų5363%0.62627%0.274SS*.Hα-helixtrans-58.5-40.5179.7-169-171.2-54.4108.10.6112.5L113 S114 V115 P121L113-R117 VanDerWaalsContact O-CB 3.28Å; L113-R117 WeakPolarHBondContact O-CB 3.12Å; L113-R117 PolarHBondContact O-N 2.97Å; S114-R117 PolarHBondContact O-N 3.12Å; V115-R117 VanDerWaalsContact C-N 3.35Å; V115-R117 PolarHBondContact O-N 3.44Å; R117-P121 WeakPolarHBondContact O-CD 3.48Å
118K87.8Confident87.4Confident75 Ų7559.2 Ų59.233%0.32630%0.302SS..Hα-helixtrans-82.6-35.4-177.4-67.4-179.3173.2174.70113.3C81 S114 V115 K116 D155C81-K118 WeakPolarHBondContact O-CB 3.13Å; S114-K118 PolarHBondContact O-N 3.2Å; V115-K118 PolarHBondContact O-N 3.38Å; K116-K118 VanDerWaalsContact C-N 3.29Å; K116-K118 PolarHBondContact O-N 3.05Å; K118-D155 VanDerWaalsContact NZ-CG 3.31Å; K118-D155 IonicContact NZ-OD1 2.71Å; K118-D155 IonicContact NZ-OD2 2.68Å; K118-D155 PolarHBondContact NZ-OD2 3.17Å
119C89.9Confident87.2Confident0 Ų065 Ų650%033%0.331CS..Hα-helixtrans-100.8-20.9-171.9-640000114.7L76 C81 V115 K116 V122 L123 W130L76-C119 HydrophobicContact CD2-CB 4.43Å; C81-C119 HydrophobicContact CB-CB 3.94Å; C81-C119 WeakPolarHBondContact CB-SG 3.5Å; C81-C119 VanDerWaalsContact SG-CA 3.56Å; C81-C119 WeakPolarHBondContact SG-CB 3.34Å; C81-C119 CovalentContact SG-SG 2.04Å; C81-C119 PolarHBondContact SG-SG 2.98Å; V115-C119 VanDerWaalsContact O-CB 3.29Å; V115-C119 WeakPolarHBondContact O-CB 3.35Å; V115-C119 PolarHBondContact O-N 2.76Å; K116-C119 PolarHBondContact O-N 3.27Å; C119-V122 PolarHBondContact O-N 3.4Å; C119-L123 PolarHBondContact O-N 3.31Å; C119-L123 VanDerWaalsContact O-N 3.09Å; C119-W130 HydrophobicContact CB-CZ3 4.39Å
120L88.4Confident87.1Confident39 Ų3962.9 Ų62.920%0.20432%0.321CS..Hα-helixtrans-60.9-42.4176.6-176.462000113.5K116 V122 L123 H124 W130K116-L120 HydrophobicContact CG-CB 4.24Å; K116-L120 HydrophobicContact CG-CD2 4.22Å; K116-L120 WeakPolarHBondContact O-CA 3.5Å; K116-L120 WeakPolarHBondContact O-CB 3.03Å; K116-L120 PolarHBondContact O-N 2.88Å; L120-V122 VanDerWaalsContact C-N 3.25Å; L120-V122 PolarHBondContact O-N 3.33Å; L120-L123 PolarHBondContact O-N 3.49Å; L120-H124 VanDerWaalsContact CD1-CD2 3.44Å; L120-H124 WeakPolarHBondContact CD1-CD2 3.3Å; L120-H124 WeakPolarHBondContact CD1-NE2 3.29Å; L120-H124 WeakPolarHBondContact O-CB 3.38Å; L120-H124 PolarHBondContact O-CD2 2.84Å; L120-H124 VanDerWaalsContact O-CD2 3.31Å; L120-H124 PolarHBondContact O-N 3.38Å; L120-W130 HydrophobicContact CB-CE3 4.39Å; L120-W130 HydrophobicContact CD1-CB 3.7Å; L120-W130 HydrophobicContact CD1-CE3 4.09Å; L120-W130 HydrophobicContact CD1-CG 4.45Å
121P85.3Confident87.2Confident79 Ų7961.4 Ų61.451%0.51331%0.31SS..Hα-helixtrans-59.8-37.3177.4-24.235.5000112.7R117 H124 E125R117-P121 WeakPolarHBondContact O-CD 3.48Å; P121-H124 PolarHBondContact O-N 3.09Å; P121-E125 PolarHBondContact O-N 3.43Å
122V85.8Confident87.2Confident13 Ų1369.3 Ų69.38%0.07935%0.347CS..Hα-helixtrans-67.8-45.7177.8-176.70000110.6L76 Y79 C81 C119 L120 H124 E125 F126L76-V122 HydrophobicContact CD1-CB 4.19Å; L76-V122 HydrophobicContact CD1-CG1 3.85Å; Y79-V122 HydrophobicContact CD1-CB 4.47Å; Y79-V122 HydrophobicContact CD1-CG1 3.74Å; Y79-V122 HydrophobicContact CD1-CG2 3.99Å; Y79-V122 HydrophobicContact CD2-CG1 4.23Å; Y79-V122 HydrophobicContact CE1-CB 4.2Å; Y79-V122 HydrophobicContact CE1-CG1 3.67Å; Y79-V122 HydrophobicContact CE1-CG2 3.41Å; Y79-V122 VanDerWaalsContact CE1-CG2 3.41Å; Y79-V122 HydrophobicContact CE2-CG1 4.16Å; Y79-V122 HydrophobicContact CG-CG1 4.03Å; C81-V122 HydrophobicContact CB-CG2 4.01Å; C119-V122 PolarHBondContact O-N 3.4Å; L120-V122 VanDerWaalsContact C-N 3.25Å; L120-V122 PolarHBondContact O-N 3.33Å; V122-H124 VanDerWaalsContact C-N 3.27Å; V122-H124 PolarHBondContact O-N 2.96Å; V122-E125 WeakPolarHBondContact O-CB 3.41Å; V122-E125 PolarHBondContact O-N 2.95Å; V122-F126 HydrophobicContact CG1-CD2 4.29Å; V122-F126 HydrophobicContact CG1-CE2 4.09Å; V122-F126 VanDerWaalsContact O-CD2 3.23Å; V122-F126 WeakPolarHBondContact O-CD2 3.37Å; V122-F126 PolarHBondContact O-N 3.13Å
123L83.3Confident87Confident22 Ų2272.3 Ų72.312%0.11537%0.365CS..Hα-helixtrans-58.2-42.9174.6-77.1170.2000111.7L76 C119 L120 E125 F126 G127 F128 W130L76-L123 HydrophobicContact CD1-CD2 4.34Å; L76-L123 HydrophobicContact CD1-CG 4.27Å; L76-L123 HydrophobicContact CD2-CD1 4.15Å; L76-L123 HydrophobicContact CD2-CD2 4.01Å; L76-L123 HydrophobicContact CD2-CG 4.02Å; C119-L123 PolarHBondContact O-N 3.31Å; C119-L123 VanDerWaalsContact O-N 3.09Å; L120-L123 PolarHBondContact O-N 3.49Å; L123-E125 VanDerWaalsContact C-N 3.34Å; L123-E125 PolarHBondContact O-N 3.2Å; L123-F126 CarbonylContact O-C 3.55Å; L123-F126 PolarHBondContact O-N 3.45Å; L123-G127 PolarHBondContact O-N 3.28Å; L123-F128 CarbonylContact C-O 3.15Å; L123-F128 HydrophobicContact CB-CB 4.23Å; L123-F128 HydrophobicContact CD2-CB 3.95Å; L123-F128 PolarHBondContact O-N 2.92Å; L123-W130 HydrophobicContact CD1-CE3 3.77Å; L123-W130 HydrophobicContact CD1-CZ3 3.99Å
124H84.1Confident87.2Confident90 Ų9068.9 Ų68.942%0.41735%0.347SS..Hα-helixtrans-64.1-36.3178.2-79.5-149.7000112.7L120 P121 V122 F126 G127 F128L120-H124 VanDerWaalsContact CD1-CD2 3.44Å; L120-H124 WeakPolarHBondContact CD1-CD2 3.3Å; L120-H124 WeakPolarHBondContact CD1-NE2 3.29Å; L120-H124 WeakPolarHBondContact O-CB 3.38Å; L120-H124 PolarHBondContact O-CD2 2.84Å; L120-H124 VanDerWaalsContact O-CD2 3.31Å; L120-H124 PolarHBondContact O-N 3.38Å; P121-H124 PolarHBondContact O-N 3.09Å; V122-H124 VanDerWaalsContact C-N 3.27Å; V122-H124 PolarHBondContact O-N 2.96Å; H124-F126 PolarHBondContact O-N 3.24Å; H124-G127 PolarHBondContact O-N 2.88Å; H124-F128 PolarHBondContact CD2-O 3.38Å; H124-F128 VanDerWaalsContact CD2-O 3.28Å; H124-F128 PolarHBondContact N-O 2.79Å
125E76.1Confident87.3Confident142 Ų14271.2 Ų71.266%0.66436%0.358SS*.Hα-helixtrans-59.1-34.2175.3-173174.4-179.900112.1P121 V122 L123P121-E125 PolarHBondContact O-N 3.43Å; V122-E125 WeakPolarHBondContact O-CB 3.41Å; V122-E125 PolarHBondContact O-N 2.95Å; L123-E125 VanDerWaalsContact C-N 3.34Å; L123-E125 PolarHBondContact O-N 3.2Å
126F78.9Confident87.3Confident128 Ų12871.4 Ų71.456%0.56136%0.36SS*.THydrogen-bonded Turntrans-94.310.2177-64.9-73.5000113.9V122 L123 H124 F128V122-F126 HydrophobicContact CG1-CD2 4.29Å; V122-F126 HydrophobicContact CG1-CE2 4.09Å; V122-F126 VanDerWaalsContact O-CD2 3.23Å; V122-F126 WeakPolarHBondContact O-CD2 3.37Å; V122-F126 PolarHBondContact O-N 3.13Å; L123-F126 CarbonylContact O-C 3.55Å; L123-F126 PolarHBondContact O-N 3.45Å; H124-F126 PolarHBondContact O-N 3.24Å; F126-F128 HydrophobicContact CB-CD2 3.75Å; F126-F128 HydrophobicContact CB-CE2 3.95Å; F126-F128 VanDerWaalsContact O-CD2 3.3Å; F126-F128 WeakPolarHBondContact O-CD2 3.43Å; F126-F128 WeakPolarHBondContact O-CE2 3.28Å
127G78.7Confident87.3Confident68 Ų6872.9 Ų72.970%0.70138%0.377SS*.THydrogen-bonded Turntrans77.817.9176.700000115.1L123 H124L123-G127 PolarHBondContact O-N 3.28Å; H124-G127 PolarHBondContact O-N 2.88Å
128F83.6Confident87.2Confident131 Ų13170.5 Ų70.558%0.57538%0.376SS*.PPolyproline II helixtrans-103.6140.1177.4-62.4-78.4000111.4L123 H124 F126L123-F128 CarbonylContact C-O 3.15Å; L123-F128 HydrophobicContact CB-CB 4.23Å; L123-F128 HydrophobicContact CD2-CB 3.95Å; L123-F128 PolarHBondContact O-N 2.92Å; H124-F128 PolarHBondContact CD2-O 3.38Å; H124-F128 VanDerWaalsContact CD2-O 3.28Å; H124-F128 PolarHBondContact N-O 2.79Å; F126-F128 HydrophobicContact CB-CD2 3.75Å; F126-F128 HydrophobicContact CB-CE2 3.95Å; F126-F128 VanDerWaalsContact O-CD2 3.3Å; F126-F128 WeakPolarHBondContact O-CD2 3.43Å; F126-F128 WeakPolarHBondContact O-CE2 3.28Å
129I87.5Confident87.4Confident123 Ų12367.7 Ų67.763%0.63136%0.364SS*.PPolyproline II helixtrans-90.3163.317361172000111P131I129-P131 WeakPolarHBondContact O-CD 3.47Å
130W91.1Very high87.3Confident26 Ų2669.4 Ų69.410%0.09838%0.375CS..PPolyproline II helixtrans-63123.1170.4-163.6-102.7000110.4F88 V115 K116 C119 L120 L123 L134F88-W130 HydrophobicContact CE1-CH2 4.25Å; F88-W130 AromaticContact CE1-CZ2 3.88Å; F88-W130 HydrophobicContact CE1-CZ2 3.88Å; F88-W130 HydrophobicContact CZ-CZ2 4.3Å; V115-W130 HydrophobicContact CG1-CH2 4.21Å; K116-W130 HydrophobicContact CB-CD2 4.34Å; K116-W130 HydrophobicContact CB-CE3 4.43Å; K116-W130 HydrophobicContact CB-CH2 3.97Å; K116-W130 HydrophobicContact CB-CZ2 3.84Å; K116-W130 HydrophobicContact CB-CZ3 4.26Å; K116-W130 HydrophobicContact CD-CD2 4.03Å; K116-W130 HydrophobicContact CD-CG 4.05Å; K116-W130 HydrophobicContact CG-CD2 3.78Å; K116-W130 HydrophobicContact CG-CE3 3.99Å; K116-W130 HydrophobicContact CG-CG 4.26Å; K116-W130 HydrophobicContact CG-CH2 4.41Å; K116-W130 HydrophobicContact CG-CZ2 4.2Å; K116-W130 HydrophobicContact CG-CZ3 4.31Å; C119-W130 HydrophobicContact CB-CZ3 4.39Å; L120-W130 HydrophobicContact CB-CE3 4.39Å; L120-W130 HydrophobicContact CD1-CB 3.7Å; L120-W130 HydrophobicContact CD1-CE3 4.09Å; L120-W130 HydrophobicContact CD1-CG 4.45Å; L123-W130 HydrophobicContact CD1-CE3 3.77Å; L123-W130 HydrophobicContact CD1-CZ3 3.99Å; W130-L134 HydrophobicContact CZ2-CB 4.03Å; W130-L134 HydrophobicContact CZ2-CD1 4.45Å; W130-L134 PolarHBondContact NE1-O 3.1Å
131P91.4Very high86.9Confident34 Ų3471.7 Ų71.722%0.22139%0.393CS..PPolyproline II helixtrans-60.3138.1-178.7-24.534.3000112.6F73 I129 V133 L134F73-P131 HydrophobicContact CE1-CG 4.26Å; F73-P131 HydrophobicContact CZ-CG 4.17Å; I129-P131 WeakPolarHBondContact O-CD 3.47Å; P131-V133 VanDerWaalsContact C-N 3.25Å; P131-V133 HydrophobicContact CB-CG2 4.08Å; P131-V133 PolarHBondContact O-N 2.88Å; P131-L134 HydrophobicContact CB-CB 4.48Å; P131-L134 HydrophobicContact CB-CD1 4.32Å; P131-L134 HydrophobicContact CB-CG 4.23Å; P131-L134 HydrophobicContact CG-CD1 4.08Å; P131-L134 PolarHBondContact O-N 2.87Å
132E91.3Very high86.5Confident169 Ų16973.2 Ų73.279%0.7940%0.395SS*.G310 helixtrans-60.4-35.6-179.5-66.4-171.116400112.5L134 N135E132-L134 PolarHBondContact O-N 3.13Å; E132-N135 WeakPolarHBondContact O-CB 3.25Å; E132-N135 PolarHBondContact O-N 2.83Å
133V88.8Confident86.3Confident64 Ų6476.2 Ų76.239%0.38841%0.411SS..G310 helixtrans-65.2-16.4176.2-59.80000113.4V58 P131V58-V133 HydrophobicContact CG1-CB 3.84Å; V58-V133 HydrophobicContact CG1-CG1 3.81Å; V58-V133 HydrophobicContact CG1-CG2 4.18Å; V58-V133 HydrophobicContact CG2-CB 4.41Å; P131-V133 VanDerWaalsContact C-N 3.25Å; P131-V133 HydrophobicContact CB-CG2 4.08Å; P131-V133 PolarHBondContact O-N 2.88Å
134L94.1Very high86.1Confident2 Ų278.5 Ų78.51%0.0142%0.423CS..G310 helixtrans-10412.5175.6-58.7-178.4000112.2F73 F88 L89 V92 Y93 C112 W130 P131 E132 C136F73-L134 HydrophobicContact CE1-CD1 4.16Å; F73-L134 HydrophobicContact CZ-CD1 3.92Å; F88-L134 HydrophobicContact CE1-CB 4.35Å; F88-L134 HydrophobicContact CE1-CD1 4.25Å; F88-L134 HydrophobicContact CE1-CD2 4.12Å; F88-L134 HydrophobicContact CE1-CG 4.48Å; F88-L134 HydrophobicContact CZ-CB 4.32Å; F88-L134 HydrophobicContact CZ-CD2 4.25Å; L89-L134 HydrophobicContact CD2-CD1 3.86Å; L89-L134 HydrophobicContact CD2-CD2 4.42Å; V92-L134 HydrophobicContact CB-CD2 4.36Å; V92-L134 HydrophobicContact CG1-CD2 3.93Å; V92-L134 HydrophobicContact CG2-CD2 4.31Å; Y93-L134 HydrophobicContact CE2-CD2 4.28Å; C112-L134 PolarHBondContact SG-O 3.4Å; W130-L134 HydrophobicContact CZ2-CB 4.03Å; W130-L134 HydrophobicContact CZ2-CD1 4.45Å; W130-L134 PolarHBondContact NE1-O 3.1Å; P131-L134 HydrophobicContact CB-CB 4.48Å; P131-L134 HydrophobicContact CB-CD1 4.32Å; P131-L134 HydrophobicContact CB-CG 4.23Å; P131-L134 HydrophobicContact CG-CD1 4.08Å; P131-L134 PolarHBondContact O-N 2.87Å; E132-L134 PolarHBondContact O-N 3.13Å; L134-C136 PolarHBondContact O-N 3.41Å
135N92.6Very high85.6Confident66 Ų6683.4 Ų83.435%0.35345%0.446SS..  trans-61.5120.1-177.8-175.1-12.3000111.3E132 S137 L138E132-N135 WeakPolarHBondContact O-CB 3.25Å; E132-N135 PolarHBondContact O-N 2.83Å; N135-S137 PolarHBondContact O-N 3.11Å; N135-S137 PolarHBondContact OD1-N 3.4Å; N135-S137 VanDerWaalsContact OD1-N 3.15Å; N135-L138 HydrophobicContact CB-CD1 4.1Å; N135-L138 HydrophobicContact CB-CG 4.19Å; N135-L138 VanDerWaalsContact O-CB 3.27Å; N135-L138 WeakPolarHBondContact O-CB 3.45Å; N135-L138 WeakPolarHBondContact O-CG 3.22Å; N135-L138 PolarHBondContact O-N 3.15Å
136C91.7Very high85.3Confident4 Ų483.3 Ų83.33%0.02745%0.45CS..G310 helixtrans-62.9-15-175.1-54.90000114.9K109 C112 L113 L134 L138 F139K109-C136 HydrophobicContact CG-CB 4.41Å; K109-C136 WeakPolarHBondContact CG-O 3.3Å; C112-C136 HydrophobicContact CB-CB 3.74Å; C112-C136 WeakPolarHBondContact CB-SG 3.38Å; C112-C136 PolarHBondContact O-SG 3.46Å; C112-C136 WeakPolarHBondContact SG-CA 3.15Å; C112-C136 WeakPolarHBondContact SG-CB 3.39Å; C112-C136 CovalentContact SG-SG 2.04Å; C112-C136 PolarHBondContact SG-SG 3.39Å; L113-C136 HydrophobicContact CD2-CB 3.88Å; L113-C136 HydrophobicContact CG-CB 4.08Å; L134-C136 PolarHBondContact O-N 3.41Å; C136-L138 PolarHBondContact O-N 2.79Å; C136-F139 PolarHBondContact O-N 3.38Å
137S92.4Very high85.3Confident89 Ų8981.8 Ų81.862%0.62245%0.445SS*.G310 helixtrans-71.2-15.8172.4-62.90000113.5N135 F139N135-S137 PolarHBondContact O-N 3.11Å; N135-S137 PolarHBondContact OD1-N 3.4Å; N135-S137 VanDerWaalsContact OD1-N 3.15Å; S137-F139 VanDerWaalsContact C-N 3.3Å
138L89Confident85.7Confident116 Ų11682.3 Ų82.361%0.60743%0.43SS*.G310 helixtrans-78.1-14.4176.9-59.4173.9000112.9N135 C136N135-L138 HydrophobicContact CB-CD1 4.1Å; N135-L138 HydrophobicContact CB-CG 4.19Å; N135-L138 VanDerWaalsContact O-CB 3.27Å; N135-L138 WeakPolarHBondContact O-CB 3.45Å; N135-L138 WeakPolarHBondContact O-CG 3.22Å; N135-L138 PolarHBondContact O-N 3.15Å; C136-L138 PolarHBondContact O-N 2.79Å
139F90.9Very high86Confident16 Ų1676.4 Ų76.47%0.0740%0.404CS..SBendtrans-105.4147.1-172.2-55.8-53.1000112.7L57 F88 V92 P107 C112 C136 S137L57-F139 HydrophobicContact CD1-CE1 4.32Å; F88-F139 HydrophobicContact CE2-CD2 4.4Å; F88-F139 AromaticContact CE2-CE2 3.86Å; F88-F139 HydrophobicContact CE2-CE2 3.86Å; F88-F139 HydrophobicContact CE2-CZ 4.39Å; F88-F139 AromaticContact CZ-CE2 3.96Å; F88-F139 HydrophobicContact CZ-CE2 3.96Å; F88-F139 HydrophobicContact CZ-CZ 4.48Å; V92-F139 HydrophobicContact CG1-CZ 4.43Å; V92-F139 HydrophobicContact CG2-CE1 4Å; V92-F139 HydrophobicContact CG2-CE2 4.47Å; V92-F139 HydrophobicContact CG2-CZ 3.65Å; P107-F139 HydrophobicContact CG-CD1 3.97Å; P107-F139 HydrophobicContact CG-CD2 4.28Å; P107-F139 HydrophobicContact CG-CE1 4.02Å; P107-F139 HydrophobicContact CG-CE2 4.34Å; P107-F139 HydrophobicContact CG-CG 4.12Å; P107-F139 HydrophobicContact CG-CZ 4.22Å; P107-F139 WeakPolarHBondContact O-CB 3.47Å; C112-F139 HydrophobicContact CB-CD2 3.78Å; C112-F139 HydrophobicContact CB-CE2 4.2Å; C136-F139 PolarHBondContact O-N 3.38Å; S137-F139 VanDerWaalsContact C-N 3.3Å
140P88.4Confident86.2Confident36 Ų3671.6 Ų71.623%0.23438%0.38CS..  trans-59.6140.9179.4-24.834.6000113.3K109 H147 C149K109-P140 WeakPolarHBondContact CB-O 3.32Å; K109-P140 PolarHBondContact N-O 2.94Å; P140-H147 HydrophobicContact CB-CB 4.04Å; P140-C149 HydrophobicContact CB-CB 4.17Å; P140-C149 HydrophobicContact CG-CB 4.22Å
141P80.1Confident85.9Confident88 Ų8876 Ų7657%0.57140%0.401SS*.SBendtrans-72.6-37-175.327.7-33.7000114.1
142I76.8Confident85.4Confident111 Ų11175.7 Ų75.757%0.56940%0.404SS*.SBendtrans-141.3144.7-174.8-60.5174.2000107.5D144I142-D144 PolarHBondContact O-N 3.42Å
143N81.1Confident84.7Confident76 Ų7671.3 Ų71.341%0.40639%0.39SS..  trans-76.1107169.2-17319.1000109.1H147 M148 C149N143-H147 WeakPolarHBondContact CA-O 3.21Å; N143-M148 WeakPolarHBondContact OD1-CA 3.28Å; N143-C149 PolarHBondContact OD1-N 2.96Å
144D79.9Confident83.5Confident69 Ų6971.3 Ų71.337%0.36940%0.403SS..  trans-132179.2-179.97233.7000111.8I142 N146 H147I142-D144 PolarHBondContact O-N 3.42Å; D144-N146 PolarHBondContact O-N 3.08Å; D144-N146 VanDerWaalsContact OD1-CA 3.31Å; D144-N146 WeakPolarHBondContact OD1-CA 3.43Å; D144-N146 WeakPolarHBondContact OD1-CB 3.42Å; D144-N146 PolarHBondContact OD1-N 3.1Å; D144-H147 PolarHBondContact N-O 3.05Å; D144-H147 CarbonylContact O-C 3.56Å; D144-H147 PolarHBondContact O-N 2.88Å; D144-H147 IonicContact OD1-CG 2.81Å; D144-H147 PolarHBondContact OD1-N 3.31Å; D144-H147 IonicContact OD1-ND1 3.85Å; D144-H147 PolarHBondContact OD1-ND1 3.05Å; D144-H147 IonicContact OD2-ND1 2.71Å
145H72.4Confident82Confident193 Ų19373.3 Ų73.389%0.89441%0.414SS*.SBendtrans-64.7-19.1-179.1-64.5-57.7000114.2
146N71.1Confident80.1Confident140 Ų14079.3 Ų79.375%0.74944%0.44SS*.SBendtrans-102.5-23.1-179.5-67.5-12.6000112.5D144D144-N146 PolarHBondContact O-N 3.08Å; D144-N146 VanDerWaalsContact OD1-CA 3.31Å; D144-N146 WeakPolarHBondContact OD1-CA 3.43Å; D144-N146 WeakPolarHBondContact OD1-CB 3.42Å; D144-N146 PolarHBondContact OD1-N 3.1Å
147H78.1Confident77.9Confident97 Ų9785.3 Ų85.345%0.44947%0.472SS..  trans-137101.2-177.1-52.893.7000110.1P140 N143 D144P140-H147 HydrophobicContact CB-CB 4.04Å; N143-H147 WeakPolarHBondContact CA-O 3.21Å; D144-H147 PolarHBondContact N-O 3.05Å; D144-H147 CarbonylContact O-C 3.56Å; D144-H147 PolarHBondContact O-N 2.88Å; D144-H147 IonicContact OD1-CG 2.81Å; D144-H147 PolarHBondContact OD1-N 3.31Å; D144-H147 IonicContact OD1-ND1 3.85Å; D144-H147 PolarHBondContact OD1-ND1 3.05Å; D144-H147 IonicContact OD2-ND1 2.71Å
148M86.4Confident75.6Confident79 Ų7986.1 Ų86.139%0.38948%0.475SS..  trans-85132.9174-75.5167.3-74.700110.8V101 I105 N143V101-M148 HydrophobicContact CB-CE 4.07Å; V101-M148 HydrophobicContact CG1-CE 3.58Å; V101-M148 HydrophobicContact CG2-CE 3.24Å; V101-M148 HydrophobicContact CG2-SD 3.81Å; I105-M148 HydrophobicContact CD1-CB 4.11Å; I105-M148 HydrophobicContact CD1-SD 4.26Å; I105-M148 HydrophobicContact CG1-CB 4.23Å; I105-M148 HydrophobicContact CG2-CB 4.2Å; N143-M148 WeakPolarHBondContact OD1-CA 3.28Å
149C91.5Very high73.4Confident6 Ų686.6 Ų86.64%0.04149%0.485CS..  trans-149.4159.2173.465.10000111.1G106 C108 P140 N143G106-C149 CarbonylContact O-C 3.56Å; G106-C149 WeakPolarHBondContact O-CA 3.38Å; C108-C149 WeakPolarHBondContact CA-SG 3.34Å; C108-C149 HydrophobicContact CB-CB 3.94Å; C108-C149 WeakPolarHBondContact CB-SG 3.43Å; C108-C149 WeakPolarHBondContact SG-CB 3.35Å; C108-C149 PolarHBondContact SG-O 3.36Å; C108-C149 CovalentContact SG-SG 2.03Å; C108-C149 PolarHBondContact SG-SG 3.46Å; P140-C149 HydrophobicContact CB-CB 4.17Å; P140-C149 HydrophobicContact CG-CB 4.22Å; N143-C149 PolarHBondContact OD1-N 2.96Å
150M91.1Very high70.9Confident23 Ų2394.2 Ų94.211%0.11351%0.514CS..BIsolated β-bridgetrans-93.1123.4178.8-68.3175.6-77.400111.2Y49 F87 S91 M96 I105 G106 C108Y49-M150 HydrophobicContact CD1-SD 4.15Å; Y49-M150 HydrophobicContact CE1-CE 4.44Å; Y49-M150 HydrophobicContact CE1-SD 3.81Å; F87-M150 HydrophobicContact CE1-CB 4.08Å; F87-M150 HydrophobicContact CZ-CB 4.13Å; F87-M150 HydrophobicContact CZ-CG 4.49Å; F87-M150 HydrophobicContact CZ-SD 3.87Å; S91-M150 VanDerWaalsContact CB-CE 3.5Å; M96-M150 HydrophobicContact CB-CE 4.26Å; M96-M150 HydrophobicContact CB-SD 4.17Å; I105-M150 HydrophobicContact CG2-CG 4.34Å; I105-M150 WeakPolarHBondContact O-CE 3.4Å; G106-M150 PolarHBondContact O-N 2.96Å; C108-M150 PolarHBondContact N-O 2.78Å; C108-M150 VanDerWaalsContact SG-C 3.51Å
151E84.4Confident68.6Low119 Ų119100.7 Ų100.756%0.55654%0.542SS*.  trans-79.3-21.2179.8-66.2-179.3171.300113.4
152G81.6Confident66.8Low27 Ų27100.9 Ų100.928%0.27854%0.543SS..  trans86.5165.6179.600000114.5F87 M111 G154F87-G152 VanDerWaalsContact CE1-CA 3.43Å; M111-G152 VanDerWaalsContact SD-CA 3.59Å; G152-G154 PolarHBondContact O-N 3.43Å
153P76.8Confident65.4Low76 Ų76101 Ų10149%0.49455%0.548SS..SBendtrans-66.6118.1170.127.8-30.3000107.9Q84Q84-P153 VanDerWaalsContact CD-O 3.29Å; Q84-P153 VanDerWaalsContact CG-O 3.29Å; Q84-P153 WeakPolarHBondContact CG-O 3.16Å; Q84-P153 PolarHBondContact OE1-O 3.41Å
154G63.9Low63.3Low65 Ų65108.7 Ų108.767%0.6757%0.572SS**  trans-51.8150.5-178.400000112.8G152 E156G152-G154 PolarHBondContact O-N 3.43Å; G154-E156 PolarHBondContact O-N 2.85Å
155D61.7Low61.5Low43 Ų43110.9 Ų110.923%0.2358%0.58CS.*  trans-71.5115176-74-26.7000109.5S83 Q84 K118 D157S83-D155 PolarHBondContact OG-OD1 3.38Å; S83-D155 VanDerWaalsContact OG-OD1 3.05Å; Q84-D155 WeakPolarHBondContact CG-OD1 3.3Å; Q84-D155 PolarHBondContact NE2-OD1 3.29Å; Q84-D155 PolarHBondContact NE2-OD2 2.93Å; K118-D155 VanDerWaalsContact NZ-CG 3.31Å; K118-D155 IonicContact NZ-OD1 2.71Å; K118-D155 IonicContact NZ-OD2 2.68Å; K118-D155 PolarHBondContact NZ-OD2 3.17Å; D155-D157 PolarHBondContact O-N 2.9Å
156E53.1Low60.4Low192 Ų192105.9 Ų105.990%0.89756%0.564SS**  trans-77.2100.3158.5-69.7-162.8145.900107.6G154 P158G154-E156 PolarHBondContact O-N 2.85Å; E156-P158 WeakPolarHBondContact O-CD 3.49Å
157D44.6Very low59.2Low130 Ų130104 Ų10470%0.69556%0.56SS**PPolyproline II helixtrans-69.9123.9-179.4-73.8-42.7000111.5D155D155-D157 PolarHBondContact O-N 2.9Å
158P45.2Very low58Low106 Ų106103 Ų10369%0.68856%0.555SS**PPolyproline II helixtrans-65.8148.6149.6-7.624.5000108.6E156 Y160E156-P158 WeakPolarHBondContact O-CD 3.49Å; P158-Y160 PolarHBondContact O-N 3.45Å
159P41.3Very low56.3Low126 Ų126103.9 Ų103.982%0.81856%0.558SS**PPolyproline II helixtrans-56.3120.5-178.121.4-30.9000110.6Q161P159-Q161 PolarHBondContact O-N 3.24Å
160Y40.2Very low54.6Low176 Ų176109.8 Ų109.869%0.6959%0.585SS**  trans-46103.1174.1-179.7-101.2000110.5P158 P162P158-Y160 PolarHBondContact O-N 3.45Å; Y160-P162 HydrophobicContact CD1-CB 4.28Å; Y160-P162 VanDerWaalsContact CE1-CA 3.45Å; Y160-P162 HydrophobicContact CE1-CB 3.6Å; Y160-P162 HydrophobicContact CE1-CG 4.41Å
161Q40.3Very low53Low173 Ų173113.2 Ų113.281%0.80860%0.601SS**  trans-75.1120.3149.7-74.2-160.1-9.800105.9P159 V163P159-Q161 PolarHBondContact O-N 3.24Å; Q161-V163 PolarHBondContact O-N 2.99Å
162P40.8Very low52.1Low92 Ų92107.7 Ų107.760%0.59758%0.575SS**  trans-56.3115.7173.320.3-28.3000107.7Y160 R164Y160-P162 HydrophobicContact CD1-CB 4.28Å; Y160-P162 VanDerWaalsContact CE1-CA 3.45Å; Y160-P162 HydrophobicContact CE1-CB 3.6Å; Y160-P162 HydrophobicContact CE1-CG 4.41Å; P162-R164 PolarHBondContact O-N 3.47Å
163V47.4Very low51.1Low112 Ų112111.7 Ų111.768%0.67959%0.587SS**  trans-53.1112.5161.2175.40000104.7Q161 H165Q161-V163 PolarHBondContact O-N 2.99Å; V163-H165 VanDerWaalsContact C-N 3.33Å; V163-H165 PolarHBondContact O-N 3.1Å
164R37.9Very low50.3Low238 Ų238112.4 Ų112.490%0.89860%0.599SS**  trans-57.2102.2175.1-153.7178-155.9175.74.7106.1P162P162-R164 PolarHBondContact O-N 3.47Å
165H42.7Very low50.1Low116 Ų116113.3 Ų113.354%0.53759%0.588SS.*  trans-51.9138.8171.7-69.4-62.9000107.5V163V163-H165 VanDerWaalsContact C-N 3.33Å; V163-H165 PolarHBondContact O-N 3.1Å
166P47.9Very low49.9Very low87 Ų87112.8 Ų112.857%0.56559%0.593SS**  trans-51.6133.2168.4-18.428.9000107.4H168 Q169P166-H168 PolarHBondContact O-N 3.11Å; P166-Q169 PolarHBondContact O-N 3.36Å
167P45.6Very low50Low101 Ų101108.6 Ų108.666%0.65659%0.585SS**THydrogen-bonded Turntrans-624.1-164.919.4-31.2000116.5
168H52.7Low50.8Low77 Ų77104 Ų10436%0.35656%0.564SS.*THydrogen-bonded Turntrans-120.20.2-169.8-65.7-70.3000115.2P166 E171 W184P166-H168 PolarHBondContact O-N 3.11Å; H168-E171 IonicContact CE1-OE2 3.64Å; H168-E171 IonicContact CG-OE2 3.93Å; H168-E171 IonicContact ND1-OE2 3.52Å; H168-E171 PolarHBondContact ND1-OE2 3.46Å; H168-W184 HydrophobicContact CB-CD2 3.71Å; H168-W184 HydrophobicContact CB-CE3 4.4Å; H168-W184 HydrophobicContact CB-CG 3.76Å; H168-W184 HydrophobicContact CB-CZ2 4.15Å; H168-W184 AromaticContact CG-CE2 3.77Å; H168-W184 AromaticContact CG-CZ2 3.96Å; H168-W184 AromaticContact CG-NE1 3.71Å; H168-W184 AromaticContact ND1-CE2 3.85Å; H168-W184 AromaticContact ND1-CZ2 3.53Å
169Q51.4Low51.7Low97 Ų97101.3 Ų101.345%0.45355%0.547SS..Hα-helixtrans-77.9-28.5174-162.989.416.700111.7P166 E171 Q173P166-Q169 PolarHBondContact O-N 3.36Å; Q169-E171 VanDerWaalsContact C-N 3.32Å; Q169-E171 PolarHBondContact O-N 3.12Å; Q169-Q173 WeakPolarHBondContact O-CG 3.36Å
170E55.7Low53Low129 Ų129103.5 Ų103.560%0.60355%0.547SS*.Hα-helixtrans-68.8-28.2177.8-68.7-179.6171.400112.4Q173E170-Q173 WeakPolarHBondContact O-CB 3.38Å; E170-Q173 PolarHBondContact O-N 3.21Å
171E58.7Low54.7Low95 Ų9597.7 Ų97.744%0.44453%0.526SS..Hα-helixtrans-69.1-36.4179.1-71.2176143.200112.4H168 Q169 Q173 A174 W184H168-E171 IonicContact CE1-OE2 3.64Å; H168-E171 IonicContact CG-OE2 3.93Å; H168-E171 IonicContact ND1-OE2 3.52Å; H168-E171 PolarHBondContact ND1-OE2 3.46Å; Q169-E171 VanDerWaalsContact C-N 3.32Å; Q169-E171 PolarHBondContact O-N 3.12Å; E171-Q173 VanDerWaalsContact C-N 3.29Å; E171-Q173 PolarHBondContact O-N 3.04Å; E171-A174 PolarHBondContact O-N 3.05Å; E171-W184 HydrophobicContact CB-CE3 4.41Å; E171-W184 HydrophobicContact CB-CZ3 3.99Å; E171-W184 WeakPolarHBondContact OE2-CH2 3.46Å; E171-W184 WeakPolarHBondContact OE2-CZ3 3.29Å
172C65.1Low56.7Low4 Ų490.6 Ų90.63%0.02749%0.492CS..Hα-helixtrans-74.9-21173.9-58.80000113.2A174 L175 C191C172-A174 PolarHBondContact O-N 2.89Å; C172-L175 PolarHBondContact O-N 3.47Å; C172-C191 WeakPolarHBondContact CA-SG 3.44Å; C172-C191 HydrophobicContact CB-CB 3.92Å; C172-C191 WeakPolarHBondContact CB-SG 3.37Å; C172-C191 PolarHBondContact N-SG 3.33Å; C172-C191 VanDerWaalsContact SG-CA 3.6Å; C172-C191 WeakPolarHBondContact SG-CB 3.38Å; C172-C191 CovalentContact SG-SG 2.03Å; C172-C191 PolarHBondContact SG-SG 2.92Å
173Q59.9Low58.5Low111 Ų11187.5 Ų87.552%0.51947%0.471SS..Hα-helixtrans-69.5-22.1175.4-70.3172.7-5.600112.5Q169 E170 E171 L175 P179Q169-Q173 WeakPolarHBondContact O-CG 3.36Å; E170-Q173 WeakPolarHBondContact O-CB 3.38Å; E170-Q173 PolarHBondContact O-N 3.21Å; E171-Q173 VanDerWaalsContact C-N 3.29Å; E171-Q173 PolarHBondContact O-N 3.04Å; Q173-L175 VanDerWaalsContact C-N 3.34Å; Q173-P179 HydrophobicContact CB-CB 4.19Å; Q173-P179 HydrophobicContact CG-CB 3.8Å
174A59.3Low59.9Low90 Ų9084.1 Ų84.174%0.74445%0.446SS*.THydrogen-bonded Turntrans-80.4-9.1176.200000114.2E171 C172E171-A174 PolarHBondContact O-N 3.05Å; C172-A174 PolarHBondContact O-N 2.89Å
175L61.2Low61.6Low84 Ų8473.2 Ų73.244%0.4441%0.406SS..THydrogen-bonded Turntrans-87.6-4.8-170-127.281.2000115.3C172 Q173 Y182 C191C172-L175 PolarHBondContact O-N 3.47Å; Q173-L175 VanDerWaalsContact C-N 3.34Å; L175-Y182 HydrophobicContact CD2-CD1 4.41Å; L175-Y182 HydrophobicContact CD2-CE1 4.25Å; L175-C191 HydrophobicContact CD2-CB 4.1Å
176G56.3Low62.9Low32 Ų3276.2 Ų76.233%0.3342%0.417SS..  trans164.5-171.2177.100000116.4A178G176-A178 VanDerWaalsContact C-N 3.32Å; G176-A178 PolarHBondContact O-N 3.43Å
177S54.8Low64Low105 Ų10578.7 Ų78.773%0.73442%0.421SS*.SBendtrans-77.4-8.1-172.651.50000115.2
178A62.7Low65.1Low32 Ų3276.3 Ų76.326%0.26441%0.405SS..  trans-138.374.9-179.100000111.5G176 E180 Q181G176-A178 VanDerWaalsContact C-N 3.32Å; G176-A178 PolarHBondContact O-N 3.43Å; A178-E180 PolarHBondContact O-N 3.43Å; A178-E180 VanDerWaalsContact O-N 3.14Å; A178-Q181 HydrophobicContact CB-CG 4.12Å; A178-Q181 PolarHBondContact O-N 2.89Å; A178-Q181 VanDerWaalsContact O-N 3.15Å
179P63.1Low66.2Low51 Ų5179.6 Ų79.633%0.33142%0.42SS..G310 helixtrans-64.1-21.1-174.827.9-37.2000113.9Q173 Q181 Y182Q173-P179 HydrophobicContact CB-CB 4.19Å; Q173-P179 HydrophobicContact CG-CB 3.8Å; P179-Q181 PolarHBondContact O-N 3.36Å; P179-Y182 PolarHBondContact O-N 3.31Å
180E69.1Low67.4Low172 Ų17277.8 Ų77.880%0.80442%0.416SS*.G310 helixtrans-67.5-15.3177.8-55.3-169.5179.800113.6A178 Q194A178-E180 PolarHBondContact O-N 3.43Å; A178-E180 VanDerWaalsContact O-N 3.14Å; E180-Q194 PolarHBondContact O-NE2 3.18Å
181Q77Confident68.6Low53 Ų5372.7 Ų72.725%0.24840%0.395CS..G310 helixtrans-91.7-5.8-179-61-175.4-15.500113.6A178 P179 L193 Q194 G200A178-Q181 HydrophobicContact CB-CG 4.12Å; A178-Q181 PolarHBondContact O-N 2.89Å; A178-Q181 VanDerWaalsContact O-N 3.15Å; P179-Q181 PolarHBondContact O-N 3.36Å; Q181-L193 HydrophobicContact CB-CD1 4.26Å; Q181-Q194 WeakPolarHBondContact O-CB 3.36Å; Q181-Q194 VanDerWaalsContact O-CG 3.32Å; Q181-Q194 WeakPolarHBondContact O-CG 3.47Å; Q181-Q194 PolarHBondContact O-N 3.44Å; Q181-G200 PolarHBondContact NE2-O 3.44Å; Q181-G200 PolarHBondContact OE1-O 2.6Å
182Y80.9Confident69.7Low25 Ų2568.2 Ų68.210%0.09837%0.374CS..EExtended strand (participates in β ladder)trans-112.9142.4-179.9-68.7-94.6000110.6L175 P179 T192 L193L175-Y182 HydrophobicContact CD2-CD1 4.41Å; L175-Y182 HydrophobicContact CD2-CE1 4.25Å; P179-Y182 PolarHBondContact O-N 3.31Å; Y182-T192 CarbonylContact C-O 3.19Å; Y182-T192 WeakPolarHBondContact CA-O 3.5Å; Y182-L193 HydrophobicContact CD1-CB 4.4Å; Y182-L193 HydrophobicContact CD1-CD1 4.23Å; Y182-L193 HydrophobicContact CD2-CD1 4.32Å; Y182-L193 HydrophobicContact CE1-CB 4.13Å; Y182-L193 HydrophobicContact CE1-CD1 3.78Å; Y182-L193 HydrophobicContact CE2-CD1 3.88Å; Y182-L193 HydrophobicContact CG-CD1 4.48Å
183T78.4Confident70.8Confident26 Ų2669.1 Ų69.116%0.1638%0.378CS..EExtended strand (participates in β ladder)trans-125.4131.9177.9-55.40000109.3L185 T192 Q194T183-L185 PolarHBondContact O-N 3.01Å; T183-T192 PolarHBondContact N-O 3Å; T183-T192 PolarHBondContact O-N 2.77Å; T183-T192 PolarHBondContact O-OG1 2.99Å; T183-Q194 PolarHBondContact OG1-NE2 3.17Å
184W77.5Confident72.2Confident42 Ų4265.3 Ų65.316%0.15936%0.36CS..EExtended strand (participates in β ladder)trans-72.3124174.8-177.8-95.7000110.7H168 E171 E189 C191H168-W184 HydrophobicContact CB-CD2 3.71Å; H168-W184 HydrophobicContact CB-CE3 4.4Å; H168-W184 HydrophobicContact CB-CG 3.76Å; H168-W184 HydrophobicContact CB-CZ2 4.15Å; H168-W184 AromaticContact CG-CE2 3.77Å; H168-W184 AromaticContact CG-CZ2 3.96Å; H168-W184 AromaticContact CG-NE1 3.71Å; H168-W184 AromaticContact ND1-CE2 3.85Å; H168-W184 AromaticContact ND1-CZ2 3.53Å; E171-W184 HydrophobicContact CB-CE3 4.41Å; E171-W184 HydrophobicContact CB-CZ3 3.99Å; E171-W184 WeakPolarHBondContact OE2-CH2 3.46Å; E171-W184 WeakPolarHBondContact OE2-CZ3 3.29Å; W184-E189 VanDerWaalsContact CH2-C 3.41Å; W184-E189 HydrophobicContact CH2-CB 4.39Å; W184-E189 WeakPolarHBondContact CH2-O 3.32Å; W184-E189 VanDerWaalsContact CZ2-C 3.42Å; W184-E189 VanDerWaalsContact CZ2-CA 3.47Å; W184-E189 HydrophobicContact CZ2-CB 3.89Å; W184-C191 VanDerWaalsContact CE3-SG 3.54Å
185L74.3Confident73.6Confident9 Ų961.1 Ų61.15%0.04733%0.325CS..EExtended strand (participates in β ladder)trans-99.3110176.6-172.862.2000110T183 Q187 T188 E189 T190 T192 A277 T278 I282T183-L185 PolarHBondContact O-N 3.01Å; L185-Q187 HydrophobicContact CG-CB 4.23Å; L185-Q187 PolarHBondContact O-N 3.34Å; L185-Q187 VanDerWaalsContact O-N 3.15Å; L185-T188 WeakPolarHBondContact CB-OG1 3.38Å; L185-T188 HydrophobicContact CD2-CG2 3.92Å; L185-T188 WeakPolarHBondContact CD2-OG1 3.44Å; L185-T188 PolarHBondContact O-N 3.14Å; L185-E189 WeakPolarHBondContact O-CA 3.39Å; L185-E189 PolarHBondContact O-N 3.24Å; L185-T190 PolarHBondContact N-O 2.66Å; L185-T192 HydrophobicContact CB-CG2 4.16Å; L185-T192 HydrophobicContact CD2-CG2 4.41Å; L185-A277 HydrophobicContact CD1-CB 4.02Å; L185-T278 HydrophobicContact CD1-CG2 3.68Å; L185-I282 HydrophobicContact CD1-CD1 4.49Å; L185-I282 HydrophobicContact CD2-CD1 4.17Å
186K68.8Low74.9Confident178 Ų17857.5 Ų57.577%0.77431%0.308SS*.THydrogen-bonded Turntrans-59-27179.5-69.7-176-179.9178.10113.7
187Q70.6Confident76.4Confident139 Ų13959.2 Ų59.265%0.6531%0.306SS*.THydrogen-bonded Turntrans-75-32.4-176.7-67.3166-10.900113L185L185-Q187 HydrophobicContact CG-CB 4.23Å; L185-Q187 PolarHBondContact O-N 3.34Å; L185-Q187 VanDerWaalsContact O-N 3.15Å
188T70.2Confident77.9Confident52 Ų5259.9 Ų59.932%0.31930%0.301SS..THydrogen-bonded Turntrans-110.6-7.5-17754.40000112.7L185 T190L185-T188 WeakPolarHBondContact CB-OG1 3.38Å; L185-T188 HydrophobicContact CD2-CG2 3.92Å; L185-T188 WeakPolarHBondContact CD2-OG1 3.44Å; L185-T188 PolarHBondContact O-N 3.14Å; T188-T190 WeakPolarHBondContact CB-OG1 3.41Å; T188-T190 WeakPolarHBondContact O-CG2 3.23Å; T188-T190 PolarHBondContact O-N 3.31Å; T188-T190 PolarHBondContact OG1-OG1 3.14Å
189E75.5Confident79Confident145 Ų14560 Ų6068%0.67830%0.3SS*.THydrogen-bonded Turntrans53.538.8-173.6-58.8-176.816600111.9W184 L185W184-E189 VanDerWaalsContact CH2-C 3.41Å; W184-E189 HydrophobicContact CH2-CB 4.39Å; W184-E189 WeakPolarHBondContact CH2-O 3.32Å; W184-E189 VanDerWaalsContact CZ2-C 3.42Å; W184-E189 VanDerWaalsContact CZ2-CA 3.47Å; W184-E189 HydrophobicContact CZ2-CB 3.89Å; L185-E189 WeakPolarHBondContact O-CA 3.39Å; L185-E189 PolarHBondContact O-N 3.24Å
190T75.6Confident80.1Confident59 Ų5957.7 Ų57.736%0.36229%0.285SS..EExtended strand (participates in β ladder)trans-135152.7-178.3550000112.5L185 T188L185-T190 PolarHBondContact N-O 2.66Å; T188-T190 WeakPolarHBondContact CB-OG1 3.41Å; T188-T190 WeakPolarHBondContact O-CG2 3.23Å; T188-T190 PolarHBondContact O-N 3.31Å; T188-T190 PolarHBondContact OG1-OG1 3.14Å
191C80.8Confident81Confident23 Ų2350.5 Ų50.516%0.15525%0.252CS..EExtended strand (participates in β ladder)trans-79.9126.3170-61.80000110.5C172 L175 W184C172-C191 WeakPolarHBondContact CA-SG 3.44Å; C172-C191 HydrophobicContact CB-CB 3.92Å; C172-C191 WeakPolarHBondContact CB-SG 3.37Å; C172-C191 PolarHBondContact N-SG 3.33Å; C172-C191 VanDerWaalsContact SG-CA 3.6Å; C172-C191 WeakPolarHBondContact SG-CB 3.38Å; C172-C191 CovalentContact SG-SG 2.03Å; C172-C191 PolarHBondContact SG-SG 2.92Å; L175-C191 HydrophobicContact CD2-CB 4.1Å; W184-C191 VanDerWaalsContact CE3-SG 3.54Å
192T83.1Confident81.6Confident1 Ų148.7 Ų48.71%0.00624%0.243CC..EExtended strand (participates in β ladder)trans-118.5142.4-178.863.40000110.5Y182 T183 L185Y182-T192 CarbonylContact C-O 3.19Å; Y182-T192 WeakPolarHBondContact CA-O 3.5Å; T183-T192 PolarHBondContact N-O 3Å; T183-T192 PolarHBondContact O-N 2.77Å; T183-T192 PolarHBondContact O-OG1 2.99Å; L185-T192 HydrophobicContact CB-CG2 4.16Å; L185-T192 HydrophobicContact CD2-CG2 4.41Å
193L87.5Confident82.1Confident23 Ų2358 Ų5812%0.1228%0.278CS..EExtended strand (participates in β ladder)trans-75136.1-179.9-171.870.1000109.8Q181 Y182 L201 L283 D363Q181-L193 HydrophobicContact CB-CD1 4.26Å; Y182-L193 HydrophobicContact CD1-CB 4.4Å; Y182-L193 HydrophobicContact CD1-CD1 4.23Å; Y182-L193 HydrophobicContact CD2-CD1 4.32Å; Y182-L193 HydrophobicContact CE1-CB 4.13Å; Y182-L193 HydrophobicContact CE1-CD1 3.78Å; Y182-L193 HydrophobicContact CE2-CD1 3.88Å; Y182-L193 HydrophobicContact CG-CD1 4.48Å; L193-L201 HydrophobicContact CD2-CB 4.13Å; L193-L283 HydrophobicContact CD2-CD2 4.38Å; L193-L283 WeakPolarHBondContact O-CB 3.48Å; L193-L283 PolarHBondContact O-N 2.93Å; L193-D363 HydrophobicContact CD2-CB 3.85Å
194Q88.8Confident82.7Confident30 Ų3063.4 Ų63.414%0.1430%0.295CS..BIsolated β-bridgetrans-66.7150171.3-68.41752300111.2E180 Q181 T183 G200 V280 P281E180-Q194 PolarHBondContact O-NE2 3.18Å; Q181-Q194 WeakPolarHBondContact O-CB 3.36Å; Q181-Q194 VanDerWaalsContact O-CG 3.32Å; Q181-Q194 WeakPolarHBondContact O-CG 3.47Å; Q181-Q194 PolarHBondContact O-N 3.44Å; T183-Q194 PolarHBondContact OG1-NE2 3.17Å; Q194-G200 WeakPolarHBondContact O-CA 3.31Å; Q194-V280 HydrophobicContact CG-CG1 3.79Å; Q194-P281 WeakPolarHBondContact CA-O 3.35Å
195C89.3Confident83.4Confident2 Ų264 Ų641%0.01431%0.314CS..  trans-120.7140.2-173.1177.70000111.4S272 C273 P281 I282 L283C195-S272 PolarHBondContact SG-O 2.71Å; C195-C273 VanDerWaalsContact C-SG 3.54Å; C195-C273 HydrophobicContact CB-CB 3.63Å; C195-C273 WeakPolarHBondContact CB-SG 3.32Å; C195-C273 WeakPolarHBondContact SG-CA 3.39Å; C195-C273 WeakPolarHBondContact SG-CB 3.37Å; C195-C273 PolarHBondContact SG-N 3.08Å; C195-C273 VanDerWaalsContact SG-N 3.44Å; C195-C273 CovalentContact SG-SG 2.02Å; C195-C273 PolarHBondContact SG-SG 3.42Å; C195-P281 PolarHBondContact N-O 2.01Å; C195-P281 VanDerWaalsContact O-CG 3.32Å; C195-P281 WeakPolarHBondContact O-CG 3.43Å; C195-I282 VanDerWaalsContact CB-C 3.49Å; C195-L283 HydrophobicContact CB-CB 4.27Å; C195-L283 HydrophobicContact CB-CD1 4.31Å
196G87.8Confident84.3Confident8 Ų864.9 Ų64.98%0.08232%0.323CS..SBendtrans153.5-173.4-179.300000113K207G196-K207 WeakPolarHBondContact O-CD 3.09Å; G196-K207 PolarHBondContact O-NZ 3.46Å
197Y88.1Confident85.6Confident69 Ų6956.4 Ų56.427%0.27129%0.286SS..SBendtrans-81.6-35.4172.2-84.7-79.2000112.6R204 K207 V208 D211 R268Y197-R204 VanDerWaalsContact O-CA 3.27Å; Y197-R204 WeakPolarHBondContact O-CA 3.37Å; Y197-R204 WeakPolarHBondContact O-CB 3.44Å; Y197-K207 HydrophobicContact CD1-CB 4.15Å; Y197-K207 HydrophobicContact CE1-CB 4.39Å; Y197-V208 HydrophobicContact CD1-CG2 4.2Å; Y197-V208 HydrophobicContact CE1-CG2 4.13Å; Y197-D211 PolarHBondContact OH-OD2 3.09Å; Y197-R268 HydrophobicContact CE2-CB 4.06Å
198D87.9Confident86.7Confident118 Ų11853.3 Ų53.363%0.63128%0.277SS*.SBendtrans-101.7-9.9-175-57-57.6000113.1R204D198-R204 VanDerWaalsContact OD1-CD 3.3Å; D198-R204 WeakPolarHBondContact OD1-CD 3.36Å; D198-R204 IonicContact OD1-CZ 3.58Å; D198-R204 IonicContact OD1-NE 3.89Å; D198-R204 IonicContact OD1-NH1 3.37Å; D198-R204 PolarHBondContact OD1-NH1 3.04Å; D198-R204 IonicContact OD2-NH1 3.81Å; D198-R204 PolarHBondContact OD2-NH1 3Å
199S84.9Confident88Confident36 Ų3656 Ų5625%0.25228%0.284SS..SBendtrans-113.6163.2176.6-55.40000111.2K207S199-K207 PolarHBondContact O-NZ 3.38Å
200G86.4Confident89Confident1 Ų149.1 Ų49.11%0.0125%0.252CS..SBendtrans96.4-17918000000113.9Q181 Q194 Y202Q181-G200 PolarHBondContact NE2-O 3.44Å; Q181-G200 PolarHBondContact OE1-O 2.6Å; Q194-G200 WeakPolarHBondContact O-CA 3.31Å; G200-Y202 PolarHBondContact O-N 3.45Å
201L87.4Confident90Very high22 Ų2247 Ų4712%0.11524%0.239CC..SBendtrans-65.7-38.1-169.2-168.567.9000112.3L193 D363 P460L193-L201 HydrophobicContact CD2-CB 4.13Å; L201-D363 PolarHBondContact N-OD2 3.19Å; L201-P460 HydrophobicContact CG-CB 4.11Å; L201-P460 HydrophobicContact CG-CG 4.5Å; L201-P460 WeakPolarHBondContact O-CB 3.5Å
202Y90.1Very high90.7Very high15 Ų1548.6 Ų48.66%0.05925%0.253CS..SBendtrans-98141.3-177.2-65-85.1000112.8G200 K207 D363 L364 P460 Y464 V465G200-Y202 PolarHBondContact O-N 3.45Å; Y202-K207 WeakPolarHBondContact O-CE 3.38Å; Y202-D363 PolarHBondContact N-OD2 3.32Å; Y202-L364 HydrophobicContact CD1-CD1 3.99Å; Y202-L364 HydrophobicContact CD2-CB 3.78Å; Y202-L364 HydrophobicContact CD2-CD1 4.23Å; Y202-L364 HydrophobicContact CE2-CB 3.94Å; Y202-L364 HydrophobicContact CG-CB 4.28Å; Y202-L364 HydrophobicContact CG-CD1 3.84Å; Y202-P460 HydrophobicContact CD1-CB 4.14Å; Y202-P460 HydrophobicContact CE1-CB 4.09Å; Y202-Y464 HydrophobicContact CE1-CD1 4.42Å; Y202-Y464 HydrophobicContact CE2-CD1 4.33Å; Y202-Y464 HydrophobicContact CE2-CE1 4.36Å; Y202-Y464 AromaticContact CZ-CD1 3.68Å; Y202-Y464 WeakPolarHBondContact OH-CD1 3.21Å; Y202-V465 HydrophobicContact CD1-CG2 3.9Å; Y202-V465 HydrophobicContact CE1-CG2 3.58Å
203R90.2Very high91.4Very high220 Ų22052.3 Ų52.383%0.8327%0.267SS*.  trans-65.1152.3175.9-63.7-179.3-178.3166.50.9111.6G205 A206 K207R203-G205 PolarHBondContact O-N 3.19Å; R203-G205 VanDerWaalsContact O-N 3.11Å; R203-A206 PolarHBondContact O-N 2.91Å; R203-K207 PolarHBondContact O-N 3.01Å
204R92.1Very high91.9Very high139 Ų13951.2 Ų51.253%0.52526%0.261SS..Hα-helixtrans-45.8-45.1175.2-172.3-174.5-168.2137.8-9113.6Y197 D198 A206 K207 V208Y197-R204 VanDerWaalsContact O-CA 3.27Å; Y197-R204 WeakPolarHBondContact O-CA 3.37Å; Y197-R204 WeakPolarHBondContact O-CB 3.44Å; D198-R204 VanDerWaalsContact OD1-CD 3.3Å; D198-R204 WeakPolarHBondContact OD1-CD 3.36Å; D198-R204 IonicContact OD1-CZ 3.58Å; D198-R204 IonicContact OD1-NE 3.89Å; D198-R204 IonicContact OD1-NH1 3.37Å; D198-R204 PolarHBondContact OD1-NH1 3.04Å; D198-R204 IonicContact OD2-NH1 3.81Å; D198-R204 PolarHBondContact OD2-NH1 3Å; R204-A206 PolarHBondContact O-N 3.35Å; R204-K207 PolarHBondContact O-N 2.99Å; R204-V208 HydrophobicContact CG-CG2 4.22Å; R204-V208 WeakPolarHBondContact O-CG2 3.46Å; R204-V208 PolarHBondContact O-N 3.31Å
205G92.6Very high92.3Very high54 Ų5451.3 Ų51.356%0.55727%0.267SS*.Hα-helixtrans-58.4-43.1-179.700000113.5R203 V208 F209R203-G205 PolarHBondContact O-N 3.19Å; R203-G205 VanDerWaalsContact O-N 3.11Å; G205-V208 PolarHBondContact O-N 3.3Å; G205-F209 WeakPolarHBondContact O-CB 3.25Å; G205-F209 PolarHBondContact O-N 3.05Å
206A92.9Very high92.7Very high29 Ų2955.1 Ų55.124%0.2429%0.29CS..Hα-helixtrans-67.8-38.217800000111.9R203 R204 T210 L364R203-A206 PolarHBondContact O-N 2.91Å; R204-A206 PolarHBondContact O-N 3.35Å; A206-T210 WeakPolarHBondContact O-CB 3.4Å; A206-T210 PolarHBondContact O-N 3.35Å; A206-T210 PolarHBondContact O-OG1 3.44Å; A206-L364 HydrophobicContact CB-CD1 4.3Å
207K94.9Very high93.2Very high0 Ų057.4 Ų57.40%030%0.297CS..Hα-helixtrans-66.2-43.7176.2-66.4177.7174-176.80111.9G196 Y197 S199 Y202 R203 R204 T210 D211 D363G196-K207 WeakPolarHBondContact O-CD 3.09Å; G196-K207 PolarHBondContact O-NZ 3.46Å; Y197-K207 HydrophobicContact CD1-CB 4.15Å; Y197-K207 HydrophobicContact CE1-CB 4.39Å; S199-K207 PolarHBondContact O-NZ 3.38Å; Y202-K207 WeakPolarHBondContact O-CE 3.38Å; R203-K207 PolarHBondContact O-N 3.01Å; R204-K207 PolarHBondContact O-N 2.99Å; K207-T210 WeakPolarHBondContact O-CB 3.34Å; K207-T210 PolarHBondContact O-N 2.94Å; K207-D211 VanDerWaalsContact O-CG 3.27Å; K207-D211 PolarHBondContact O-N 3.26Å; K207-D211 VanDerWaalsContact O-OD1 3.14Å; K207-D363 VanDerWaalsContact CE-O 3.3Å; K207-D363 WeakPolarHBondContact CE-O 3.44Å; K207-D363 WeakPolarHBondContact CE-OD1 3.25Å; K207-D363 WeakPolarHBondContact CE-OD2 3.48Å; K207-D363 VanDerWaalsContact NZ-CG 3.29Å; K207-D363 IonicContact NZ-OD1 3.17Å; K207-D363 PolarHBondContact NZ-OD1 3.02Å; K207-D363 IonicContact NZ-OD2 3.69Å; K207-D363 PolarHBondContact NZ-OD2 2.89Å; K207-D363 VanDerWaalsContact NZ-OD2 3.16Å
208V95.7Very high93.7Very high73 Ų7354.1 Ų54.144%0.44228%0.284SS..Hα-helixtrans-65.6-42.3176.3172.20000111.4Y197 R204 G205 T210 D211 A212Y197-V208 HydrophobicContact CD1-CG2 4.2Å; Y197-V208 HydrophobicContact CE1-CG2 4.13Å; R204-V208 HydrophobicContact CG-CG2 4.22Å; R204-V208 WeakPolarHBondContact O-CG2 3.46Å; R204-V208 PolarHBondContact O-N 3.31Å; G205-V208 PolarHBondContact O-N 3.3Å; V208-T210 VanDerWaalsContact C-N 3.33Å; V208-T210 PolarHBondContact O-N 2.99Å; V208-D211 PolarHBondContact O-N 3.44Å; V208-A212 PolarHBondContact O-N 3.32Å
209F95.9Very high94.2Very high109 Ų10951.6 Ų51.648%0.47827%0.272SS..Hα-helixtrans-59.3-46.2173.9173-101.3000111.5G205 D211 A212 W213 M469G205-F209 WeakPolarHBondContact O-CB 3.25Å; G205-F209 PolarHBondContact O-N 3.05Å; F209-D211 VanDerWaalsContact C-N 3.33Å; F209-D211 PolarHBondContact O-N 3.36Å; F209-A212 PolarHBondContact O-N 3.42Å; F209-W213 HydrophobicContact CZ-CE3 4.24Å; F209-W213 WeakPolarHBondContact O-CB 3.48Å; F209-W213 PolarHBondContact O-N 3.45Å; F209-M469 HydrophobicContact CE1-CG 4.1Å
210T96.3Very high94.7Very high0 Ų053.9 Ų53.90%028%0.281CS..Hα-helixtrans-59.3-43.3177.2-62.20000111.7A206 K207 V208 A212 W213 M214 L364 T365 M469A206-T210 WeakPolarHBondContact O-CB 3.4Å; A206-T210 PolarHBondContact O-N 3.35Å; A206-T210 PolarHBondContact O-OG1 3.44Å; K207-T210 WeakPolarHBondContact O-CB 3.34Å; K207-T210 PolarHBondContact O-N 2.94Å; V208-T210 VanDerWaalsContact C-N 3.33Å; V208-T210 PolarHBondContact O-N 2.99Å; T210-A212 PolarHBondContact O-N 2.9Å; T210-W213 PolarHBondContact O-N 2.86Å; T210-M214 HydrophobicContact CG2-CE 3.92Å; T210-M214 HydrophobicContact CG2-CG 4.45Å; T210-M214 HydrophobicContact CG2-SD 4.27Å; T210-M214 WeakPolarHBondContact O-CB 3.31Å; T210-M214 WeakPolarHBondContact O-CG 3.46Å; T210-M214 PolarHBondContact O-N 3.27Å; T210-L364 HydrophobicContact CG2-CG 4.38Å; T210-L364 WeakPolarHBondContact OG1-CD1 3.5Å; T210-T365 HydrophobicContact CG2-CG2 3.95Å; T210-M469 HydrophobicContact CG2-CE 3.44Å; T210-M469 VanDerWaalsContact CG2-CE 3.44Å; T210-M469 HydrophobicContact CG2-SD 4.09Å
211D96.4Very high95.2Very high16 Ų1653.8 Ų53.89%0.08628%0.281CS..Hα-helixtrans-61.3-45.2176.9-73.59.4000112.2Y197 K207 V208 F209 M214 A215 R263 L264 R268Y197-D211 PolarHBondContact OH-OD2 3.09Å; K207-D211 VanDerWaalsContact O-CG 3.27Å; K207-D211 PolarHBondContact O-N 3.26Å; K207-D211 VanDerWaalsContact O-OD1 3.14Å; V208-D211 PolarHBondContact O-N 3.44Å; F209-D211 VanDerWaalsContact C-N 3.33Å; F209-D211 PolarHBondContact O-N 3.36Å; D211-M214 PolarHBondContact O-N 3.24Å; D211-A215 WeakPolarHBondContact O-CB 3.36Å; D211-A215 PolarHBondContact O-N 3.13Å; D211-R263 IonicContact OD1-CZ 2.72Å; D211-R263 IonicContact OD1-NH1 3.07Å; D211-R263 PolarHBondContact OD1-NH1 3.39Å; D211-R263 IonicContact OD2-CZ 2.84Å; D211-R263 IonicContact OD2-NH1 2.82Å; D211-R263 PolarHBondContact OD2-NH1 3.31Å; D211-R263 IonicContact OD2-NH2 3.83Å; D211-L264 HydrophobicContact CB-CD2 4.01Å; D211-R268 IonicContact OD1-CZ 3.01Å; D211-R268 IonicContact OD1-NH2 3.02Å; D211-R268 PolarHBondContact OD1-NH2 3.4Å
212A96.9Very high95.7Very high55 Ų5555.9 Ų55.946%0.45529%0.289SS..Hα-helixtrans-63.5-43.2176.500000111.7V208 F209 T210 A215 V216V208-A212 PolarHBondContact O-N 3.32Å; F209-A212 PolarHBondContact O-N 3.42Å; T210-A212 PolarHBondContact O-N 2.9Å; A212-A215 PolarHBondContact O-N 3.44Å; A212-V216 WeakPolarHBondContact O-CG2 3.02Å; A212-V216 PolarHBondContact O-N 2.9Å; A212-V216 VanDerWaalsContact O-N 3.07Å
213W97.3Very high96Very high79 Ų7960.1 Ų60.130%0.29931%0.312SS..Hα-helixtrans-59.9-50177-173.4-100.2000111.8F209 T210 A215 V216 W217 M469 F473F209-W213 HydrophobicContact CZ-CE3 4.24Å; F209-W213 WeakPolarHBondContact O-CB 3.48Å; F209-W213 PolarHBondContact O-N 3.45Å; T210-W213 PolarHBondContact O-N 2.86Å; W213-A215 VanDerWaalsContact C-N 3.33Å; W213-A215 PolarHBondContact O-N 3.2Å; W213-V216 PolarHBondContact O-N 3Å; W213-W217 AromaticContact CD1-CD1 3.92Å; W213-W217 AromaticContact CD2-CD1 3.81Å; W213-W217 AromaticContact CD2-NE1 3.59Å; W213-W217 AromaticContact CE2-CD1 3.55Å; W213-W217 AromaticContact CE2-NE1 3.24Å; W213-W217 AromaticContact CE3-NE1 3.88Å; W213-W217 HydrophobicContact CH2-CZ2 4.43Å; W213-W217 AromaticContact CH2-NE1 3.57Å; W213-W217 AromaticContact CZ2-CD1 4Å; W213-W217 AromaticContact CZ2-NE1 3.24Å; W213-W217 AromaticContact CZ3-NE1 3.87Å; W213-W217 AromaticContact NE1-CD1 3.62Å; W213-W217 AromaticContact NE1-NE1 3.8Å; W213-W217 PolarHBondContact O-N 3.22Å; W213-M469 HydrophobicContact CB-SD 3.96Å; W213-M469 HydrophobicContact CG-CG 4.48Å; W213-M469 HydrophobicContact CG-SD 3.76Å; W213-M469 PolarHBondContact NE1-O 3.41Å; W213-M469 VanDerWaalsContact NE1-O 3.08Å; W213-F473 HydrophobicContact CZ2-CB 4.07Å; W213-F473 HydrophobicContact CZ2-CG 4.46Å
214M97.3Very high96.2Very high1 Ų150.5 Ų50.51%0.00528%0.278CS..Hα-helixtrans-59.3-43.3176-71.3-173.3-5900111.6T210 D211 A218 Y260 T365 L367 I472T210-M214 HydrophobicContact CG2-CE 3.92Å; T210-M214 HydrophobicContact CG2-CG 4.45Å; T210-M214 HydrophobicContact CG2-SD 4.27Å; T210-M214 WeakPolarHBondContact O-CB 3.31Å; T210-M214 WeakPolarHBondContact O-CG 3.46Å; T210-M214 PolarHBondContact O-N 3.27Å; D211-M214 PolarHBondContact O-N 3.24Å; M214-A218 WeakPolarHBondContact O-CB 3.48Å; M214-A218 PolarHBondContact O-N 3.08Å; M214-Y260 HydrophobicContact CB-CD1 4.13Å; M214-Y260 HydrophobicContact CG-CD1 3.96Å; M214-Y260 HydrophobicContact CG-CE1 4.33Å; M214-Y260 HydrophobicContact SD-CD1 3.77Å; M214-Y260 HydrophobicContact SD-CE1 4.15Å; M214-T365 HydrophobicContact SD-CG2 4.46Å; M214-L367 HydrophobicContact SD-CD1 3.85Å; M214-L367 HydrophobicContact SD-CG 4.3Å; M214-I472 HydrophobicContact CG-CD1 4.04Å; M214-I472 HydrophobicContact CG-CG2 4.29Å; M214-I472 HydrophobicContact SD-CD1 4.21Å
215A97.9Very high96.3Very high32 Ų3243.9 Ų43.926%0.26425%0.253SS..Hα-helixtrans-60.3-49.2-17900000112.2D211 A212 W213 W217 V219 L264D211-A215 WeakPolarHBondContact O-CB 3.36Å; D211-A215 PolarHBondContact O-N 3.13Å; A212-A215 PolarHBondContact O-N 3.44Å; W213-A215 VanDerWaalsContact C-N 3.33Å; W213-A215 PolarHBondContact O-N 3.2Å; A215-W217 PolarHBondContact O-N 3.23Å; A215-V219 WeakPolarHBondContact O-CB 3.49Å; A215-V219 VanDerWaalsContact O-CG2 3.24Å; A215-V219 WeakPolarHBondContact O-CG2 3.46Å; A215-V219 PolarHBondContact O-N 3.39Å; A215-L264 HydrophobicContact CB-CD1 3.66Å
216V97.9Very high96.3Very high82 Ų8243 Ų4350%0.49724%0.237SC..Hα-helixtrans-58.7-53-178.8170.50000110.8A212 W213 L220A212-V216 WeakPolarHBondContact O-CG2 3.02Å; A212-V216 PolarHBondContact O-N 2.9Å; A212-V216 VanDerWaalsContact O-N 3.07Å; W213-V216 PolarHBondContact O-N 3Å; V216-L220 HydrophobicContact CG1-CD1 4.16Å; V216-L220 WeakPolarHBondContact O-CG 3.41Å; V216-L220 PolarHBondContact O-N 3.04Å; V216-L220 VanDerWaalsContact O-N 3.13Å
217W98.1Very high96.2Very high56 Ų5644.5 Ų44.521%0.21224%0.241CC..Hα-helixtrans-73.1-35.1-175.2-66.2116.6000112.8W213 A215 L220 C221 F473 L476 I480W213-W217 AromaticContact CD1-CD1 3.92Å; W213-W217 AromaticContact CD2-CD1 3.81Å; W213-W217 AromaticContact CD2-NE1 3.59Å; W213-W217 AromaticContact CE2-CD1 3.55Å; W213-W217 AromaticContact CE2-NE1 3.24Å; W213-W217 AromaticContact CE3-NE1 3.88Å; W213-W217 HydrophobicContact CH2-CZ2 4.43Å; W213-W217 AromaticContact CH2-NE1 3.57Å; W213-W217 AromaticContact CZ2-CD1 4Å; W213-W217 AromaticContact CZ2-NE1 3.24Å; W213-W217 AromaticContact CZ3-NE1 3.87Å; W213-W217 AromaticContact NE1-CD1 3.62Å; W213-W217 AromaticContact NE1-NE1 3.8Å; W213-W217 PolarHBondContact O-N 3.22Å; A215-W217 PolarHBondContact O-N 3.23Å; W217-L220 HydrophobicContact CE3-CD1 3.9Å; W217-L220 HydrophobicContact CZ3-CD1 3.93Å; W217-L220 PolarHBondContact O-N 3.46Å; W217-C221 VanDerWaalsContact O-CB 3.24Å; W217-C221 WeakPolarHBondContact O-CB 3.22Å; W217-C221 PolarHBondContact O-N 3.01Å; W217-F473 AromaticContact CD2-CD2 3.63Å; W217-F473 HydrophobicContact CD2-CD2 3.63Å; W217-F473 HydrophobicContact CD2-CE2 4.1Å; W217-F473 AromaticContact CE2-CD2 3.46Å; W217-F473 VanDerWaalsContact CE2-CD2 3.46Å; W217-F473 AromaticContact CE2-CE2 3.9Å; W217-F473 AromaticContact CE3-CD2 3.9Å; W217-F473 HydrophobicContact CE3-CD2 3.9Å; W217-F473 AromaticContact CE3-CE2 3.94Å; W217-F473 HydrophobicContact CE3-CE2 3.94Å; W217-F473 HydrophobicContact CG-CD2 4.23Å; W217-F473 AromaticContact CH2-CD2 3.9Å; W217-F473 HydrophobicContact CH2-CD2 3.9Å; W217-F473 AromaticContact CH2-CE2 3.41Å; W217-F473 HydrophobicContact CH2-CE2 3.41Å; W217-F473 VanDerWaalsContact CH2-CE2 3.41Å; W217-F473 HydrophobicContact CH2-CZ 4.42Å; W217-F473 AromaticContact CZ2-CD2 3.61Å; W217-F473 HydrophobicContact CZ2-CD2 3.61Å; W217-F473 AromaticContact CZ2-CE2 3.56Å; W217-F473 HydrophobicContact CZ2-CE2 3.56Å; W217-F473 HydrophobicContact CZ3-CD2 4.03Å; W217-F473 AromaticContact CZ3-CE2 3.61Å; W217-F473 HydrophobicContact CZ3-CE2 3.61Å; W217-F473 AromaticContact NE1-CD2 3.93Å; W217-L476 HydrophobicContact CB-CB 4.31Å; W217-L476 HydrophobicContact CB-CD1 3.58Å; W217-I480 HydrophobicContact CE3-CD1 3.85Å; W217-I480 HydrophobicContact CZ3-CD1 4.16Å
218A98.2Very high96Very high0 Ų044.6 Ų44.60%024%0.241CC..Hα-helixtrans-66-42.4177.200000111.2M214 C221 F222 Y260 L261 L476M214-A218 WeakPolarHBondContact O-CB 3.48Å; M214-A218 PolarHBondContact O-N 3.08Å; A218-C221 PolarHBondContact O-N 3.25Å; A218-F222 WeakPolarHBondContact O-CB 3.44Å; A218-F222 PolarHBondContact O-N 3.47Å; A218-Y260 HydrophobicContact CB-CG 4.29Å; A218-L261 HydrophobicContact CB-CD2 4.04Å; A218-L261 HydrophobicContact CB-CG 4.33Å; A218-L476 HydrophobicContact CB-CD1 4.45Å
219V98.1Very high95.8Very high64 Ų6442.2 Ų42.239%0.38823%0.227SC..Hα-helixtrans-63.9-45.9176.5170.50000111.2A215 C221 F222 L223 L261A215-V219 WeakPolarHBondContact O-CB 3.49Å; A215-V219 VanDerWaalsContact O-CG2 3.24Å; A215-V219 WeakPolarHBondContact O-CG2 3.46Å; A215-V219 PolarHBondContact O-N 3.39Å; V219-C221 PolarHBondContact O-N 3.48Å; V219-F222 PolarHBondContact O-N 3.33Å; V219-L223 HydrophobicContact CG1-CD1 3.84Å; V219-L223 HydrophobicContact CG1-CG 4.29Å; V219-L223 WeakPolarHBondContact O-CB 3.46Å; V219-L223 VanDerWaalsContact O-CG 3.3Å; V219-L223 WeakPolarHBondContact O-CG 3.44Å; V219-L223 PolarHBondContact O-N 3.2Å; V219-L261 HydrophobicContact CG2-CD2 3.9Å
220L96.4Very high95.4Very high84 Ų8440.6 Ų40.644%0.4422%0.223SC..Hα-helixtrans-61-44.6177.5-71.1174.6000111.9V216 W217 S224 I480V216-L220 HydrophobicContact CG1-CD1 4.16Å; V216-L220 WeakPolarHBondContact O-CG 3.41Å; V216-L220 PolarHBondContact O-N 3.04Å; V216-L220 VanDerWaalsContact O-N 3.13Å; W217-L220 HydrophobicContact CE3-CD1 3.9Å; W217-L220 HydrophobicContact CZ3-CD1 3.93Å; W217-L220 PolarHBondContact O-N 3.46Å; L220-S224 VanDerWaalsContact O-CB 3.29Å; L220-S224 WeakPolarHBondContact O-CB 3.44Å; L220-S224 PolarHBondContact O-N 3.47Å; L220-S224 VanDerWaalsContact O-N 3.07Å; L220-I480 HydrophobicContact CB-CD1 3.95Å; L220-I480 HydrophobicContact CB-CG1 4.43Å
221C97.2Very high95Very high0 Ų040.6 Ų40.60%022%0.223CC..Hα-helixtrans-62.5-47.5175.7-176.80000111.4W217 A218 V219 L223 S224 T225 L476 I480W217-C221 VanDerWaalsContact O-CB 3.24Å; W217-C221 WeakPolarHBondContact O-CB 3.22Å; W217-C221 PolarHBondContact O-N 3.01Å; A218-C221 PolarHBondContact O-N 3.25Å; V219-C221 PolarHBondContact O-N 3.48Å; C221-L223 PolarHBondContact O-N 3.39Å; C221-S224 PolarHBondContact O-N 3.21Å; C221-T225 WeakPolarHBondContact O-CB 3.37Å; C221-T225 VanDerWaalsContact O-CG2 3.27Å; C221-T225 WeakPolarHBondContact O-CG2 3.17Å; C221-T225 PolarHBondContact O-N 3.07Å; C221-T225 PolarHBondContact O-OG1 3.09Å; C221-L476 HydrophobicContact CB-CB 4.17Å; C221-L476 HydrophobicContact CB-CD2 3.93Å; C221-L476 PolarHBondContact SG-O 3.19Å; C221-I480 HydrophobicContact CB-CG1 4.08Å
222F97.6Very high94.5Very high65 Ų6541 Ų4129%0.28522%0.224SC..Hα-helixtrans-59.5-48.6-179.9-178.4-99.3000111.9A218 V219 T225 T226 N254 S257 V258 L261A218-F222 WeakPolarHBondContact O-CB 3.44Å; A218-F222 PolarHBondContact O-N 3.47Å; V219-F222 PolarHBondContact O-N 3.33Å; F222-T225 PolarHBondContact O-OG1 3.26Å; F222-T225 VanDerWaalsContact O-OG1 3.13Å; F222-T226 WeakPolarHBondContact O-CB 3.33Å; F222-T226 PolarHBondContact O-N 3.23Å; F222-T226 PolarHBondContact O-OG1 2.86Å; F222-N254 WeakPolarHBondContact CD2-ND2 3.3Å; F222-N254 PolarHBondContact O-ND2 2.93Å; F222-S257 WeakPolarHBondContact CA-OG 3.26Å; F222-S257 WeakPolarHBondContact CB-OG 3.15Å; F222-V258 HydrophobicContact CD2-CG2 3.7Å; F222-V258 HydrophobicContact CE2-CG2 3.53Å; F222-L261 HydrophobicContact CB-CD1 4.25Å; F222-L261 HydrophobicContact CD2-CD1 4.32Å; F222-L261 HydrophobicContact CG-CD1 4.12Å
223L95.3Very high94Very high104 Ų10444 Ų4455%0.54523%0.232SC..Hα-helixtrans-64.7-45.1179.9-68175.4000111.9V219 C221 T226 L227V219-L223 HydrophobicContact CG1-CD1 3.84Å; V219-L223 HydrophobicContact CG1-CG 4.29Å; V219-L223 WeakPolarHBondContact O-CB 3.46Å; V219-L223 VanDerWaalsContact O-CG 3.3Å; V219-L223 WeakPolarHBondContact O-CG 3.44Å; V219-L223 PolarHBondContact O-N 3.2Å; C221-L223 PolarHBondContact O-N 3.39Å; L223-T226 PolarHBondContact O-N 2.94Å; L223-L227 WeakPolarHBondContact O-CB 3.46Å; L223-L227 PolarHBondContact O-N 3.3Å
224S94.3Very high93.5Very high18 Ų1843.9 Ų43.913%0.12624%0.237CC..Hα-helixtrans-62.4-47.4179.4-174.50000111.9L220 C221 L227 T228 I480 G483L220-S224 VanDerWaalsContact O-CB 3.29Å; L220-S224 WeakPolarHBondContact O-CB 3.44Å; L220-S224 PolarHBondContact O-N 3.47Å; L220-S224 VanDerWaalsContact O-N 3.07Å; C221-S224 PolarHBondContact O-N 3.21Å; S224-L227 PolarHBondContact O-N 2.88Å; S224-T228 PolarHBondContact O-N 2.85Å; S224-T228 PolarHBondContact O-OG1 2.92Å; S224-I480 PolarHBondContact OG-O 3.3Å; S224-G483 WeakPolarHBondContact OG-CA 3.47Å
225T94.8Very high92.7Very high0 Ų046.4 Ų46.40%025%0.25CS..Hα-helixtrans-71.1-36.6179.955.30000112.2C221 F222 L227 T228 V229 S250 C253 N254 G479C221-T225 WeakPolarHBondContact O-CB 3.37Å; C221-T225 VanDerWaalsContact O-CG2 3.27Å; C221-T225 WeakPolarHBondContact O-CG2 3.17Å; C221-T225 PolarHBondContact O-N 3.07Å; C221-T225 PolarHBondContact O-OG1 3.09Å; F222-T225 PolarHBondContact O-OG1 3.26Å; F222-T225 VanDerWaalsContact O-OG1 3.13Å; T225-L227 PolarHBondContact O-N 3.02Å; T225-T228 WeakPolarHBondContact O-CA 3.37Å; T225-T228 VanDerWaalsContact O-CB 3.29Å; T225-T228 WeakPolarHBondContact O-CB 3.48Å; T225-T228 PolarHBondContact O-N 3.12Å; T225-T228 VanDerWaalsContact O-N 3.11Å; T225-V229 WeakPolarHBondContact O-CG2 3.33Å; T225-V229 PolarHBondContact O-N 3.3Å; T225-S250 WeakPolarHBondContact CA-OG 3.26Å; T225-C253 HydrophobicContact CG2-CB 3.87Å; T225-N254 WeakPolarHBondContact OG1-CA 3.24Å; T225-N254 WeakPolarHBondContact OG1-CB 3.16Å; T225-N254 PolarHBondContact OG1-ND2 3.34Å; T225-G479 WeakPolarHBondContact CG2-O 3.31Å
226T93.6Very high92Very high36 Ų3647.8 Ų47.822%0.22126%0.258CS..Hα-helixtrans-61.2-46.1174.6-60.70000111F222 L223 T228 V229 L230 N254F222-T226 WeakPolarHBondContact O-CB 3.33Å; F222-T226 PolarHBondContact O-N 3.23Å; F222-T226 PolarHBondContact O-OG1 2.86Å; L223-T226 PolarHBondContact O-N 2.94Å; T226-T228 PolarHBondContact O-N 3.14Å; T226-V229 PolarHBondContact O-N 2.74Å; T226-L230 HydrophobicContact CG2-CD1 3.73Å; T226-L230 HydrophobicContact CG2-CG 4.11Å; T226-L230 VanDerWaalsContact O-CB 3.31Å; T226-L230 WeakPolarHBondContact O-CB 3.49Å; T226-L230 VanDerWaalsContact O-CG 3.25Å; T226-L230 WeakPolarHBondContact O-CG 3.49Å; T226-L230 PolarHBondContact O-N 3.04Å; T226-N254 PolarHBondContact N-ND2 3.45Å; T226-N254 PolarHBondContact OG1-ND2 3.49Å
227L90.4Very high91.2Very high61 Ų6151.7 Ų51.732%0.31927%0.271SS..Hα-helixtrans-57.3-38.3175.317864.5000111.4L223 S224 T225 T231 W495L223-L227 WeakPolarHBondContact O-CB 3.46Å; L223-L227 PolarHBondContact O-N 3.3Å; S224-L227 PolarHBondContact O-N 2.88Å; T225-L227 PolarHBondContact O-N 3.02Å; L227-T231 WeakPolarHBondContact O-CB 3.42Å; L227-T231 PolarHBondContact O-N 3.01Å; L227-T231 PolarHBondContact O-OG1 2.88Å; L227-W495 HydrophobicContact CD1-CH2 4.35Å; L227-W495 HydrophobicContact CD1-CZ2 3.59Å
228T90.1Very high90.4Very high1 Ų152.5 Ų52.51%0.00627%0.274CS..Hα-helixtrans-66.7-52.1-179.1-55.40000111.3S224 T225 T226 T231 F232 I247 S250 G483 I486S224-T228 PolarHBondContact O-N 2.85Å; S224-T228 PolarHBondContact O-OG1 2.92Å; T225-T228 WeakPolarHBondContact O-CA 3.37Å; T225-T228 VanDerWaalsContact O-CB 3.29Å; T225-T228 WeakPolarHBondContact O-CB 3.48Å; T225-T228 PolarHBondContact O-N 3.12Å; T225-T228 VanDerWaalsContact O-N 3.11Å; T226-T228 PolarHBondContact O-N 3.14Å; T228-T231 PolarHBondContact O-N 2.83Å; T228-F232 PolarHBondContact O-N 2.77Å; T228-F232 VanDerWaalsContact O-N 3.1Å; T228-I247 HydrophobicContact CG2-CD1 4.3Å; T228-S250 WeakPolarHBondContact CB-OG 3.44Å; T228-S250 WeakPolarHBondContact CG2-OG 3.35Å; T228-G483 WeakPolarHBondContact OG1-CA 3.43Å; T228-I486 HydrophobicContact CG2-CD1 3.22Å; T228-I486 HydrophobicContact CG2-CG1 3.89Å
229V90.8Very high89.7Confident23 Ų2352.8 Ų52.814%0.13928%0.275CS..Hα-helixtrans-62.7-45.2178.21750000110.9T225 T226 T231 F232 L233 M251T225-V229 WeakPolarHBondContact O-CG2 3.33Å; T225-V229 PolarHBondContact O-N 3.3Å; T226-V229 PolarHBondContact O-N 2.74Å; V229-T231 VanDerWaalsContact C-N 3.32Å; V229-T231 PolarHBondContact O-N 3.29Å; V229-F232 WeakPolarHBondContact O-CB 2.95Å; V229-F232 PolarHBondContact O-N 3.01Å; V229-F232 VanDerWaalsContact O-N 3.17Å; V229-L233 HydrophobicContact CG1-CD1 4.21Å; V229-L233 HydrophobicContact CG1-CG 4.43Å; V229-L233 WeakPolarHBondContact O-CG 3.35Å; V229-L233 PolarHBondContact O-N 3.15Å; V229-M251 HydrophobicContact CG2-CB 4.15Å
230L89Confident89.1Confident75 Ų7552 Ų5239%0.39327%0.272SS..Hα-helixtrans-61.5-40.6176.8-72.1176.5000112T226 F232 L233 L234 W495T226-L230 HydrophobicContact CG2-CD1 3.73Å; T226-L230 HydrophobicContact CG2-CG 4.11Å; T226-L230 VanDerWaalsContact O-CB 3.31Å; T226-L230 WeakPolarHBondContact O-CB 3.49Å; T226-L230 VanDerWaalsContact O-CG 3.25Å; T226-L230 WeakPolarHBondContact O-CG 3.49Å; T226-L230 PolarHBondContact O-N 3.04Å; L230-F232 VanDerWaalsContact C-N 3.29Å; L230-F232 PolarHBondContact O-N 2.92Å; L230-L233 HydrophobicContact CD2-CD1 4.5Å; L230-L233 PolarHBondContact O-N 2.75Å; L230-L234 VanDerWaalsContact O-CG 3.31Å; L230-L234 WeakPolarHBondContact O-CG 3.36Å; L230-L234 PolarHBondContact O-N 3.03Å; L230-W495 HydrophobicContact CB-CH2 4Å; L230-W495 HydrophobicContact CB-CZ2 3.87Å; L230-W495 HydrophobicContact CD1-CH2 4.05Å
231T87.4Confident88.8Confident1 Ų148.1 Ų48.11%0.00625%0.252CS..Hα-helixtrans-62.3-39.3176.7-58.20000111.4L227 T228 V229 L234 D235 F239 I486 T491 W495L227-T231 WeakPolarHBondContact O-CB 3.42Å; L227-T231 PolarHBondContact O-N 3.01Å; L227-T231 PolarHBondContact O-OG1 2.88Å; T228-T231 PolarHBondContact O-N 2.83Å; V229-T231 VanDerWaalsContact C-N 3.32Å; V229-T231 PolarHBondContact O-N 3.29Å; T231-L234 PolarHBondContact O-N 2.88Å; T231-D235 PolarHBondContact O-N 3.19Å; T231-F239 HydrophobicContact CG2-CZ 4.48Å; T231-I486 HydrophobicContact CG2-CG2 3.55Å; T231-T491 HydrophobicContact CG2-CG2 3.93Å; T231-W495 PolarHBondContact OG1-NE1 2.91Å
232F86.1Confident88.3Confident24 Ų2449 Ų4911%0.10526%0.257CS..Hα-helixtrans-65.4-43.4173.7171.6-99.2000112.5T228 V229 L230 L234 D235 S236 F239 I247T228-F232 PolarHBondContact O-N 2.77Å; T228-F232 VanDerWaalsContact O-N 3.1Å; V229-F232 WeakPolarHBondContact O-CB 2.95Å; V229-F232 PolarHBondContact O-N 3.01Å; V229-F232 VanDerWaalsContact O-N 3.17Å; L230-F232 VanDerWaalsContact C-N 3.29Å; L230-F232 PolarHBondContact O-N 2.92Å; F232-L234 PolarHBondContact O-N 3.28Å; F232-D235 CarbonylContact O-C 3.54Å; F232-D235 PolarHBondContact O-N 2.78Å; F232-S236 VanDerWaalsContact O-CA 3.24Å; F232-S236 WeakPolarHBondContact O-CA 3.39Å; F232-S236 PolarHBondContact O-N 3.34Å; F232-F239 HydrophobicContact CB-CD2 4.43Å; F232-F239 HydrophobicContact CD2-CB 3.98Å; F232-F239 AromaticContact CD2-CD2 3.72Å; F232-F239 HydrophobicContact CD2-CD2 3.72Å; F232-F239 HydrophobicContact CD2-CG 4.14Å; F232-F239 HydrophobicContact CE2-CB 4.16Å; F232-I247 HydrophobicContact CB-CD1 4.24Å; F232-I247 HydrophobicContact CB-CG1 4.39Å; F232-I247 HydrophobicContact CB-CG2 3.7Å; F232-I247 HydrophobicContact CD1-CG2 3.74Å; F232-I247 HydrophobicContact CD2-CB 4.39Å; F232-I247 HydrophobicContact CD2-CD1 4.49Å; F232-I247 HydrophobicContact CD2-CG1 3.9Å; F232-I247 HydrophobicContact CD2-CG2 3.9Å; F232-I247 HydrophobicContact CE1-CG2 4.33Å; F232-I247 HydrophobicContact CE2-CG2 4.48Å; F232-I247 HydrophobicContact CG-CB 4.44Å; F232-I247 HydrophobicContact CG-CG1 4.26Å; F232-I247 HydrophobicContact CG-CG2 3.49Å; F232-I247 VanDerWaalsContact CG-CG2 3.49Å
233L86.4Confident87.8Confident118 Ų11847.8 Ų47.862%0.61825%0.252SS*.Hα-helixtrans-63-31.5178.3-68.2176.2000112.5V229 L230V229-L233 HydrophobicContact CG1-CD1 4.21Å; V229-L233 HydrophobicContact CG1-CG 4.43Å; V229-L233 WeakPolarHBondContact O-CG 3.35Å; V229-L233 PolarHBondContact O-N 3.15Å; L230-L233 HydrophobicContact CD2-CD1 4.5Å; L230-L233 PolarHBondContact O-N 2.75Å
234L85.8Confident87.6Confident77 Ų7746 Ų4640%0.40324%0.239SC..Hα-helixtrans-74.5-30.9175.7-70.2173.8000113.4L230 T231 F232 T494 W495 C498L230-L234 VanDerWaalsContact O-CG 3.31Å; L230-L234 WeakPolarHBondContact O-CG 3.36Å; L230-L234 PolarHBondContact O-N 3.03Å; T231-L234 PolarHBondContact O-N 2.88Å; F232-L234 PolarHBondContact O-N 3.28Å; L234-T494 HydrophobicContact CB-CG2 4.24Å; L234-W495 HydrophobicContact CD1-CD2 4.32Å; L234-W495 HydrophobicContact CD1-CH2 4.32Å; L234-W495 HydrophobicContact CD1-CZ2 4.1Å; L234-C498 HydrophobicContact CD1-CB 4.32Å
235D81.9Confident87.6Confident54 Ų5445.1 Ų45.129%0.28923%0.233SC..  trans-149.173.8-175.5-170.95000111T231 F232 R238 F239 T494T231-D235 PolarHBondContact O-N 3.19Å; F232-D235 CarbonylContact O-C 3.54Å; F232-D235 PolarHBondContact O-N 2.78Å; D235-R238 HydrophobicContact CB-CB 4.48Å; D235-R238 WeakPolarHBondContact O-CB 3.33Å; D235-R238 PolarHBondContact O-N 2.82Å; D235-F239 WeakPolarHBondContact O-CD2 3.49Å; D235-T494 HydrophobicContact CB-CG2 4.31Å
236S83.4Confident87.5Confident60 Ų6045.1 Ų45.142%0.4223%0.233SC..G310 helixtrans-72.8-30.4-17558.60000113F232 R238 F239F232-S236 VanDerWaalsContact O-CA 3.24Å; F232-S236 WeakPolarHBondContact O-CA 3.39Å; F232-S236 PolarHBondContact O-N 3.34Å; S236-R238 PolarHBondContact O-N 2.89Å; S236-F239 PolarHBondContact O-N 3.4Å
237Q80.8Confident87.4Confident164 Ų16443.5 Ų43.577%0.76622%0.223SC*.G310 helixtrans-65.4-20.4179.2-67.5-66.4-29.300112.7F239Q237-F239 VanDerWaalsContact C-N 3.3Å; Q237-F239 PolarHBondContact O-N 3.17Å
238R80.7Confident87.7Confident73 Ų7341.7 Ų41.728%0.27521%0.212SC..G310 helixtrans-70.4-24.2176.9179.7177.3172.3-168.7-5.5113.5D235 S236 S488 T491D235-R238 HydrophobicContact CB-CB 4.48Å; D235-R238 WeakPolarHBondContact O-CB 3.33Å; D235-R238 PolarHBondContact O-N 2.82Å; S236-R238 PolarHBondContact O-N 2.89Å; R238-S488 PolarHBondContact NH2-OG 2.77Å; R238-T491 PolarHBondContact NH1-OG1 3.33Å; R238-T491 VanDerWaalsContact NH1-OG1 3.07Å
239F83.1Confident87.9Confident6 Ų641.7 Ų41.73%0.02621%0.212CC..  trans-113.770.8-169.6-60-81.5000111.6T231 F232 D235 S236 Q237 I247 I486T231-F239 HydrophobicContact CG2-CZ 4.48Å; F232-F239 HydrophobicContact CB-CD2 4.43Å; F232-F239 HydrophobicContact CD2-CB 3.98Å; F232-F239 AromaticContact CD2-CD2 3.72Å; F232-F239 HydrophobicContact CD2-CD2 3.72Å; F232-F239 HydrophobicContact CD2-CG 4.14Å; F232-F239 HydrophobicContact CE2-CB 4.16Å; D235-F239 WeakPolarHBondContact O-CD2 3.49Å; S236-F239 PolarHBondContact O-N 3.4Å; Q237-F239 VanDerWaalsContact C-N 3.3Å; Q237-F239 PolarHBondContact O-N 3.17Å; F239-I247 HydrophobicContact CB-CG1 4.4Å; F239-I247 HydrophobicContact CD1-CD1 4.18Å; F239-I247 HydrophobicContact CE1-CD1 4.38Å; F239-I247 HydrophobicContact CG-CD1 4.35Å; F239-I247 HydrophobicContact CG-CG1 4.42Å; F239-I486 HydrophobicContact CE1-CD1 4.08Å; F239-I486 HydrophobicContact CE1-CG1 4.21Å; F239-I486 HydrophobicContact CZ-CD1 3.82Å; F239-I486 HydrophobicContact CZ-CG1 4.24Å; F239-I486 HydrophobicContact CZ-CG2 4.49Å
240S86.1Confident88.1Confident47 Ų4740.6 Ų40.633%0.32921%0.205SC..  trans-76.3164.5173.1-52.70000111.8E243 R244S240-E243 PolarHBondContact O-N 3.37Å; S240-R244 PolarHBondContact O-N 3.01Å
241Y89.8Confident88.5Confident4 Ų440.3 Ų40.32%0.01620%0.203CC..THydrogen-bonded Turntrans-57.8141.3167.8-75.9-82.1000110.1R244 P245 T317 H328 I331 E332 S335 F338Y241-R244 HydrophobicContact CD1-CB 4.29Å; Y241-R244 HydrophobicContact CD2-CB 4.47Å; Y241-R244 HydrophobicContact CE1-CB 4.29Å; Y241-R244 HydrophobicContact CE2-CB 4.48Å; Y241-R244 HydrophobicContact CG-CB 4.38Å; Y241-P245 HydrophobicContact CD1-CG 4.32Å; Y241-P245 HydrophobicContact CE1-CG 4.06Å; Y241-T317 HydrophobicContact CD1-CG2 4.3Å; Y241-H328 WeakPolarHBondContact O-CB 3.48Å; Y241-I331 HydrophobicContact CD1-CG2 3.7Å; Y241-I331 HydrophobicContact CE1-CG2 4.49Å; Y241-I331 HydrophobicContact CG-CB 4.49Å; Y241-I331 HydrophobicContact CG-CG2 3.79Å; Y241-E332 HydrophobicContact CD2-CB 3.86Å; Y241-E332 HydrophobicContact CD2-CG 4.12Å; Y241-E332 HydrophobicContact CE2-CB 4.38Å; Y241-E332 HydrophobicContact CE2-CG 4.27Å; Y241-S335 WeakPolarHBondContact OH-CB 2.93Å; Y241-F338 HydrophobicContact CE1-CD2 4.08Å; Y241-F338 HydrophobicContact CE1-CE2 4.42Å
242P87.5Confident89Confident18 Ų1840.3 Ų40.312%0.11720%0.203CC..THydrogen-bonded Turncis-91.67.49.135.5-36.1000115.7P245 A321 I331 I428P242-P245 VanDerWaalsContact O-CD 3.28Å; P242-P245 WeakPolarHBondContact O-CD 3.23Å; P242-A321 HydrophobicContact CG-CB 4.13Å; P242-I331 HydrophobicContact CB-CD1 4.46Å; P242-I428 HydrophobicContact CG-CD1 3.79Å
243E87.1Confident89.5Confident39 Ų3939.5 Ų39.518%0.18220%0.2CC..THydrogen-bonded Turntrans-78.8-26.8-178.3-66.1-171.9-138.800113.5S240 I246 L424 I428 W485S240-E243 PolarHBondContact O-N 3.37Å; E243-I246 WeakPolarHBondContact O-CB 3.48Å; E243-I246 WeakPolarHBondContact O-CG1 3.41Å; E243-I246 PolarHBondContact O-N 2.74Å; E243-L424 HydrophobicContact CG-CD1 4.06Å; E243-L424 WeakPolarHBondContact OE1-CD1 3.29Å; E243-I428 HydrophobicContact CG-CD1 3.92Å; E243-I428 HydrophobicContact CG-CG1 4.48Å; E243-W485 HydrophobicContact CG-CZ2 4.13Å; E243-W485 PolarHBondContact OE2-NE1 2.84Å
244R90.6Very high90Very high67 Ų6735 Ų3525%0.25318%0.177SC..Hα-helixtrans-51.3-38.6-174.2-161.3172.4176.5169.7-2.8115.5S240 Y241 I246 I247 F248 E332S240-R244 PolarHBondContact O-N 3.01Å; Y241-R244 HydrophobicContact CD1-CB 4.29Å; Y241-R244 HydrophobicContact CD2-CB 4.47Å; Y241-R244 HydrophobicContact CE1-CB 4.29Å; Y241-R244 HydrophobicContact CE2-CB 4.48Å; Y241-R244 HydrophobicContact CG-CB 4.38Å; R244-I246 PolarHBondContact O-N 2.91Å; R244-I247 WeakPolarHBondContact O-CB 3.48Å; R244-I247 PolarHBondContact O-N 3.17Å; R244-F248 HydrophobicContact CG-CE2 3.86Å; R244-E332 IonicContact NH1-OE1 3.66Å; R244-E332 PolarHBondContact NH1-OE1 3.21Å; R244-E332 VanDerWaalsContact NH1-OE1 3.14Å
245P94.2Very high90.6Very high0 Ų034 Ų340%017%0.172CC..Hα-helixtrans-55.3-30.3174.8-28.437.8000114.9Y241 P242 I247 F248 L249 W310 I313 L314Y241-P245 HydrophobicContact CD1-CG 4.32Å; Y241-P245 HydrophobicContact CE1-CG 4.06Å; P242-P245 VanDerWaalsContact O-CD 3.28Å; P242-P245 WeakPolarHBondContact O-CD 3.23Å; P245-I247 PolarHBondContact O-N 3.47Å; P245-F248 PolarHBondContact O-N 3.23Å; P245-L249 WeakPolarHBondContact O-CB 3.41Å; P245-L249 PolarHBondContact O-N 3.49Å; P245-W310 HydrophobicContact CB-CE3 4.04Å; P245-I313 HydrophobicContact CB-CG2 4.4Å; P245-I313 HydrophobicContact CG-CG2 4.02Å; P245-L314 HydrophobicContact CB-CB 3.99Å; P245-L314 HydrophobicContact CB-CD1 4.23Å
246I92.1Very high91.4Very high0 Ų032.7 Ų32.70%016%0.162CC..Hα-helixtrans-61.1-34.6177.5-60174.7000110.8E243 R244 S250 L314 F431 W485E243-I246 WeakPolarHBondContact O-CB 3.48Å; E243-I246 WeakPolarHBondContact O-CG1 3.41Å; E243-I246 PolarHBondContact O-N 2.74Å; R244-I246 PolarHBondContact O-N 2.91Å; I246-S250 WeakPolarHBondContact O-CB 3.37Å; I246-S250 PolarHBondContact O-N 2.7Å; I246-L314 HydrophobicContact CD1-CD1 4.22Å; I246-L314 HydrophobicContact CD1-CD2 4.41Å; I246-L314 HydrophobicContact CG1-CD1 3.76Å; I246-L314 HydrophobicContact CG1-CD2 3.78Å; I246-L314 HydrophobicContact CG1-CG 4.42Å; I246-F431 HydrophobicContact CD1-CD1 4.07Å; I246-F431 HydrophobicContact CD1-CE1 4.19Å; I246-F431 HydrophobicContact CG1-CD1 4.33Å; I246-F431 HydrophobicContact CG1-CE1 4.04Å; I246-F431 HydrophobicContact CG2-CE1 4.2Å; I246-F431 HydrophobicContact CG2-CZ 4.2Å; I246-W485 HydrophobicContact CD1-CD2 3.75Å; I246-W485 HydrophobicContact CD1-CE3 4.15Å; I246-W485 HydrophobicContact CD1-CG 4.14Å; I246-W485 HydrophobicContact CD1-CH2 4.34Å; I246-W485 HydrophobicContact CD1-CZ2 3.98Å; I246-W485 HydrophobicContact CD1-CZ3 4.4Å; I246-W485 HydrophobicContact CG2-CB 4.37Å; I246-W485 HydrophobicContact CG2-CG 4.26Å
247I92.8Very high92.1Very high2 Ų229.8 Ų29.81%0.0114%0.143CC..Hα-helixtrans-69.7-44.8179.3-53.6-54.7000110.9T228 F232 F239 R244 P245 L249 S250 M251 I486T228-I247 HydrophobicContact CG2-CD1 4.3Å; F232-I247 HydrophobicContact CB-CD1 4.24Å; F232-I247 HydrophobicContact CB-CG1 4.39Å; F232-I247 HydrophobicContact CB-CG2 3.7Å; F232-I247 HydrophobicContact CD1-CG2 3.74Å; F232-I247 HydrophobicContact CD2-CB 4.39Å; F232-I247 HydrophobicContact CD2-CD1 4.49Å; F232-I247 HydrophobicContact CD2-CG1 3.9Å; F232-I247 HydrophobicContact CD2-CG2 3.9Å; F232-I247 HydrophobicContact CE1-CG2 4.33Å; F232-I247 HydrophobicContact CE2-CG2 4.48Å; F232-I247 HydrophobicContact CG-CB 4.44Å; F232-I247 HydrophobicContact CG-CG1 4.26Å; F232-I247 HydrophobicContact CG-CG2 3.49Å; F232-I247 VanDerWaalsContact CG-CG2 3.49Å; F239-I247 HydrophobicContact CB-CG1 4.4Å; F239-I247 HydrophobicContact CD1-CD1 4.18Å; F239-I247 HydrophobicContact CE1-CD1 4.38Å; F239-I247 HydrophobicContact CG-CD1 4.35Å; F239-I247 HydrophobicContact CG-CG1 4.42Å; R244-I247 WeakPolarHBondContact O-CB 3.48Å; R244-I247 PolarHBondContact O-N 3.17Å; P245-I247 PolarHBondContact O-N 3.47Å; I247-L249 VanDerWaalsContact C-N 3.33Å; I247-S250 WeakPolarHBondContact O-CB 3.39Å; I247-S250 PolarHBondContact O-N 3.08Å; I247-M251 PolarHBondContact O-N 2.95Å; I247-I486 HydrophobicContact CD1-CD1 3.77Å
248F95.4Very high92.9Very high23 Ų2323.7 Ų23.710%0.10112%0.116CC..Hα-helixtrans-67.2-36.4177.6-63.9-59.1000112.1R244 P245 M251 C252 W310 H339R244-F248 HydrophobicContact CG-CE2 3.86Å; P245-F248 PolarHBondContact O-N 3.23Å; F248-M251 WeakPolarHBondContact O-CB 3.17Å; F248-M251 PolarHBondContact O-N 3Å; F248-C252 PolarHBondContact O-N 3.29Å; F248-C252 PolarHBondContact O-SG 2.96Å; F248-W310 HydrophobicContact CB-CD2 3.52Å; F248-W310 VanDerWaalsContact CB-CE2 3.42Å; F248-W310 HydrophobicContact CB-CE3 4.01Å; F248-W310 HydrophobicContact CB-CG 3.87Å; F248-W310 HydrophobicContact CB-CH2 4.33Å; F248-W310 HydrophobicContact CB-CZ2 3.86Å; F248-W310 HydrophobicContact CB-CZ3 4.39Å; F248-W310 HydrophobicContact CD1-CZ2 4.47Å; F248-W310 HydrophobicContact CD2-CD2 4.37Å; F248-W310 HydrophobicContact CD2-CE3 4.1Å; F248-W310 AromaticContact CD2-CH2 3.56Å; F248-W310 HydrophobicContact CD2-CH2 3.56Å; F248-W310 AromaticContact CD2-CZ2 3.85Å; F248-W310 HydrophobicContact CD2-CZ2 3.85Å; F248-W310 AromaticContact CD2-CZ3 3.69Å; F248-W310 HydrophobicContact CD2-CZ3 3.69Å; F248-W310 HydrophobicContact CE2-CH2 4.08Å; F248-W310 HydrophobicContact CE2-CZ3 4.41Å; F248-W310 HydrophobicContact CG-CD2 4.28Å; F248-W310 AromaticContact CG-CE2 3.93Å; F248-W310 HydrophobicContact CG-CE3 4.45Å; F248-W310 HydrophobicContact CG-CH2 4.04Å; F248-W310 AromaticContact CG-CZ2 3.82Å; F248-W310 HydrophobicContact CG-CZ2 3.82Å; F248-W310 HydrophobicContact CG-CZ3 4.34Å; F248-H339 AromaticContact CD2-CE1 3.98Å; F248-H339 AromaticContact CE1-CE1 3.84Å; F248-H339 AromaticContact CE2-CE1 3.38Å; F248-H339 WeakPolarHBondContact CE2-CE1 3.47Å; F248-H339 AromaticContact CE2-NE2 3.69Å; F248-H339 AromaticContact CZ-CE1 3.32Å; F248-H339 WeakPolarHBondContact CZ-CE1 3.44Å; F248-H339 AromaticContact CZ-NE2 3.77Å
249L95.4Very high93.7Very high0 Ų020.2 Ų20.20%010%0.103CC..Hα-helixtrans-59.1-46.9169.9-176.3155.4000111.1P245 I247 M251 C252 C253 W310 W311 Y435 V478P245-L249 WeakPolarHBondContact O-CB 3.41Å; P245-L249 PolarHBondContact O-N 3.49Å; I247-L249 VanDerWaalsContact C-N 3.33Å; L249-M251 VanDerWaalsContact C-N 3.34Å; L249-M251 PolarHBondContact O-N 2.86Å; L249-C252 WeakPolarHBondContact O-CB 3.49Å; L249-C252 PolarHBondContact O-N 3.33Å; L249-C253 PolarHBondContact O-N 3.45Å; L249-C253 PolarHBondContact O-SG 2.92Å; L249-C253 VanDerWaalsContact O-SG 3.39Å; L249-W310 HydrophobicContact CB-CB 4.07Å; L249-W311 HydrophobicContact CD1-CB 3.9Å; L249-Y435 HydrophobicContact CD1-CD2 4.13Å; L249-Y435 HydrophobicContact CD1-CE2 3.73Å; L249-Y435 HydrophobicContact CD2-CE2 4.44Å; L249-Y435 HydrophobicContact CG-CE2 4.4Å; L249-V478 HydrophobicContact CD2-CG1 4.02Å
250S95.2Very high94.4Very high0 Ų020 Ų200%010%0.102CC..Hα-helixtrans-63.3-38.4177-158.60000112.5T225 T228 I246 I247 C253 N254 S482T225-S250 WeakPolarHBondContact CA-OG 3.26Å; T228-S250 WeakPolarHBondContact CB-OG 3.44Å; T228-S250 WeakPolarHBondContact CG2-OG 3.35Å; I246-S250 WeakPolarHBondContact O-CB 3.37Å; I246-S250 PolarHBondContact O-N 2.7Å; I247-S250 WeakPolarHBondContact O-CB 3.39Å; I247-S250 PolarHBondContact O-N 3.08Å; S250-C253 PolarHBondContact O-N 3.32Å; S250-N254 WeakPolarHBondContact O-CB 3.4Å; S250-N254 PolarHBondContact O-N 2.88Å; S250-S482 PolarHBondContact OG-OG 3.11Å; S250-S482 VanDerWaalsContact OG-OG 3.04Å
251M95.9Very high95Very high70 Ų7019.8 Ų19.835%0.34510%0.097SC..Hα-helixtrans-61.1-43.4172.8178.7-176-74.500111.7V229 I247 F248 L249 N254 L255V229-M251 HydrophobicContact CG2-CB 4.15Å; I247-M251 PolarHBondContact O-N 2.95Å; F248-M251 WeakPolarHBondContact O-CB 3.17Å; F248-M251 PolarHBondContact O-N 3Å; L249-M251 VanDerWaalsContact C-N 3.34Å; L249-M251 PolarHBondContact O-N 2.86Å; M251-N254 WeakPolarHBondContact O-CB 3.38Å; M251-N254 PolarHBondContact O-N 2.98Å; M251-L255 PolarHBondContact O-N 2.87Å
252C97.9Very high95.3Very high1 Ų121 Ų211%0.00711%0.105CC..Hα-helixtrans-63.5-46.5175.4-64.10000111.2F248 L249 N254 L255 Y256 F303 W343F248-C252 PolarHBondContact O-N 3.29Å; F248-C252 PolarHBondContact O-SG 2.96Å; L249-C252 WeakPolarHBondContact O-CB 3.49Å; L249-C252 PolarHBondContact O-N 3.33Å; C252-N254 VanDerWaalsContact C-N 3.26Å; C252-N254 PolarHBondContact O-N 2.91Å; C252-L255 PolarHBondContact O-N 3.33Å; C252-Y256 VanDerWaalsContact O-CB 3.31Å; C252-Y256 WeakPolarHBondContact O-CB 3.47Å; C252-Y256 PolarHBondContact O-N 3.2Å; C252-F303 HydrophobicContact CB-CB 4.34Å; C252-F303 WeakPolarHBondContact CB-O 3.4Å; C252-F303 WeakPolarHBondContact O-CB 3.44Å; C252-W343 VanDerWaalsContact SG-CH2 3.52Å
253C97.2Very high95.7Very high6 Ų620.4 Ų20.44%0.04110%0.1CC..Hα-helixtrans-62.6-32.2177.4-69.70000113T225 L249 S250 S257 S307T225-C253 HydrophobicContact CG2-CB 3.87Å; L249-C253 PolarHBondContact O-N 3.45Å; L249-C253 PolarHBondContact O-SG 2.92Å; L249-C253 VanDerWaalsContact O-SG 3.39Å; S250-C253 PolarHBondContact O-N 3.32Å; C253-S257 WeakPolarHBondContact O-CB 3.48Å; C253-S257 PolarHBondContact O-N 2.93Å; C253-S307 PolarHBondContact SG-OG 2.88Å
254N97.3Very high96.2Very high25 Ų2520.6 Ų20.613%0.13410%0.103CC..Hα-helixtrans-61.3-54.6173.8-172.3-101.1000111F222 T225 T226 S250 M251 C252 Y256 S257 V258F222-N254 WeakPolarHBondContact CD2-ND2 3.3Å; F222-N254 PolarHBondContact O-ND2 2.93Å; T225-N254 WeakPolarHBondContact OG1-CA 3.24Å; T225-N254 WeakPolarHBondContact OG1-CB 3.16Å; T225-N254 PolarHBondContact OG1-ND2 3.34Å; T226-N254 PolarHBondContact N-ND2 3.45Å; T226-N254 PolarHBondContact OG1-ND2 3.49Å; S250-N254 WeakPolarHBondContact O-CB 3.4Å; S250-N254 PolarHBondContact O-N 2.88Å; M251-N254 WeakPolarHBondContact O-CB 3.38Å; M251-N254 PolarHBondContact O-N 2.98Å; C252-N254 VanDerWaalsContact C-N 3.26Å; C252-N254 PolarHBondContact O-N 2.91Å; N254-Y256 VanDerWaalsContact C-N 3.31Å; N254-Y256 PolarHBondContact O-N 3.42Å; N254-S257 PolarHBondContact O-N 3.04Å; N254-S257 VanDerWaalsContact O-N 3.11Å; N254-S257 PolarHBondContact O-OG 3.39Å; N254-V258 WeakPolarHBondContact O-CG2 3.23Å; N254-V258 PolarHBondContact O-N 3.21Å
255L97.9Very high96.4Very high56 Ų5622.6 Ų22.629%0.29312%0.122SC..Hα-helixtrans-67.2-32.5180-67.5170.3000112.5M251 C252 V258 A259 F303M251-L255 PolarHBondContact O-N 2.87Å; C252-L255 PolarHBondContact O-N 3.33Å; L255-V258 WeakPolarHBondContact O-CB 3.47Å; L255-V258 PolarHBondContact O-N 2.03Å; L255-A259 PolarHBondContact O-N 3.5Å; L255-F303 HydrophobicContact CB-CB 4.41Å; L255-F303 HydrophobicContact CB-CD1 4.01Å; L255-F303 HydrophobicContact CB-CD2 3.59Å; L255-F303 HydrophobicContact CB-CE1 4.2Å; L255-F303 HydrophobicContact CB-CE2 3.82Å; L255-F303 HydrophobicContact CB-CG 3.72Å; L255-F303 HydrophobicContact CB-CZ 4.13Å; L255-F303 HydrophobicContact CD1-CD1 3.87Å; L255-F303 HydrophobicContact CD1-CD2 4.38Å; L255-F303 HydrophobicContact CD1-CE1 3.3Å; L255-F303 HydrophobicContact CD1-CE2 3.9Å; L255-F303 HydrophobicContact CD1-CG 4.39Å; L255-F303 HydrophobicContact CD1-CZ 3.34Å; L255-F303 HydrophobicContact CG-CE1 4.37Å; L255-F303 HydrophobicContact CG-CE2 4.41Å; L255-F303 HydrophobicContact CG-CZ 4.3Å
256Y98.2Very high96.3Very high25 Ų2525.4 Ų25.410%0.09814%0.137CC..Hα-helixtrans-60-45.1169.9-173.6-94.3000111.7C252 N254 V258 A259 Y260 L300 L476C252-Y256 VanDerWaalsContact O-CB 3.31Å; C252-Y256 WeakPolarHBondContact O-CB 3.47Å; C252-Y256 PolarHBondContact O-N 3.2Å; N254-Y256 VanDerWaalsContact C-N 3.31Å; N254-Y256 PolarHBondContact O-N 3.42Å; Y256-V258 VanDerWaalsContact C-N 3.31Å; Y256-V258 PolarHBondContact O-N 2.58Å; Y256-A259 VanDerWaalsContact O-CB 3.27Å; Y256-A259 WeakPolarHBondContact O-CB 3.24Å; Y256-A259 PolarHBondContact O-N 3.4Å; Y256-Y260 AromaticContact CD1-CE2 3.84Å; Y256-Y260 HydrophobicContact CD1-CE2 3.84Å; Y256-Y260 AromaticContact CE1-CE2 3.45Å; Y256-Y260 HydrophobicContact CE1-CE2 3.45Å; Y256-Y260 VanDerWaalsContact CE1-CE2 3.45Å; Y256-Y260 AromaticContact CE1-CZ 3.91Å; Y256-Y260 WeakPolarHBondContact CE1-OH 3.47Å; Y256-Y260 WeakPolarHBondContact O-CD2 3.36Å; Y256-Y260 PolarHBondContact OH-OH 3.01Å; Y256-L300 HydrophobicContact CD2-CD2 4.03Å; Y256-L300 VanDerWaalsContact CD2-O 3.24Å; Y256-L300 WeakPolarHBondContact CD2-O 3.43Å; Y256-L300 HydrophobicContact CE1-CD2 4.24Å; Y256-L300 HydrophobicContact CE2-CB 4.14Å; Y256-L300 HydrophobicContact CE2-CD2 3.63Å; Y256-L300 VanDerWaalsContact CE2-O 3.23Å; Y256-L300 WeakPolarHBondContact CE2-O 3.41Å; Y256-L300 HydrophobicContact CG-CD2 4.48Å; Y256-L476 HydrophobicContact CD1-CD2 4.09Å; Y256-L476 HydrophobicContact CE1-CD2 4.28Å
257S98.3Very high96.3Very high0 Ų026.6 Ų26.60%015%0.149CC..Hα-helixtrans-65.8-32.4176.573.30000113.1F222 C253 N254 A259 Y260 L261F222-S257 WeakPolarHBondContact CA-OG 3.26Å; F222-S257 WeakPolarHBondContact CB-OG 3.15Å; C253-S257 WeakPolarHBondContact O-CB 3.48Å; C253-S257 PolarHBondContact O-N 2.93Å; N254-S257 PolarHBondContact O-N 3.04Å; N254-S257 VanDerWaalsContact O-N 3.11Å; N254-S257 PolarHBondContact O-OG 3.39Å; S257-A259 PolarHBondContact O-N 3.47Å; S257-Y260 PolarHBondContact O-N 2.99Å; S257-L261 PolarHBondContact O-N 3.31Å
258V98.3Very high96.3Very high36 Ų3626.6 Ų26.622%0.21815%0.149CC..Hα-helixtrans-60.7-32.6175.2171.60000111.3F222 N254 L255 Y256 Y260 L261 V262 L299F222-V258 HydrophobicContact CD2-CG2 3.7Å; F222-V258 HydrophobicContact CE2-CG2 3.53Å; N254-V258 WeakPolarHBondContact O-CG2 3.23Å; N254-V258 PolarHBondContact O-N 3.21Å; L255-V258 WeakPolarHBondContact O-CB 3.47Å; L255-V258 PolarHBondContact O-N 2.03Å; Y256-V258 VanDerWaalsContact C-N 3.31Å; Y256-V258 PolarHBondContact O-N 2.58Å; V258-Y260 VanDerWaalsContact C-N 3.3Å; V258-Y260 PolarHBondContact O-N 3.4Å; V258-L261 CarbonylContact O-C 3.58Å; V258-L261 PolarHBondContact O-N 2.9Å; V258-L261 VanDerWaalsContact O-N 3.1Å; V258-V262 HydrophobicContact CG1-CG2 3.79Å; V258-V262 WeakPolarHBondContact O-CB 3.49Å; V258-V262 WeakPolarHBondContact O-CG2 3.43Å; V258-V262 PolarHBondContact O-N 3.24Å; V258-L299 HydrophobicContact CG1-CD1 4.23Å
259A97.9Very high96Very high0 Ų028.4 Ų28.40%016%0.162CC..Hα-helixtrans-56.6-44.3177.700000112.7L255 Y256 S257 V262 R263 L299 L300L255-A259 PolarHBondContact O-N 3.5Å; Y256-A259 VanDerWaalsContact O-CB 3.27Å; Y256-A259 WeakPolarHBondContact O-CB 3.24Å; Y256-A259 PolarHBondContact O-N 3.4Å; S257-A259 PolarHBondContact O-N 3.47Å; A259-V262 PolarHBondContact O-N 2.88Å; A259-R263 PolarHBondContact O-N 3.49Å; A259-L299 HydrophobicContact CB-CB 3.49Å; A259-L299 VanDerWaalsContact CB-CB 3.49Å; A259-L299 HydrophobicContact CB-CD1 4.19Å; A259-L300 HydrophobicContact CB-CD2 3.55Å; A259-L300 HydrophobicContact CB-CG 3.58Å
260Y98.2Very high95.8Very high2 Ų235.9 Ų35.91%0.00819%0.19CC..Hα-helixtrans-64.8-42176.6-62-91.7000111.2M214 A218 Y256 S257 V258 R263 L264 L300 L367 I472 L476M214-Y260 HydrophobicContact CB-CD1 4.13Å; M214-Y260 HydrophobicContact CG-CD1 3.96Å; M214-Y260 HydrophobicContact CG-CE1 4.33Å; M214-Y260 HydrophobicContact SD-CD1 3.77Å; M214-Y260 HydrophobicContact SD-CE1 4.15Å; A218-Y260 HydrophobicContact CB-CG 4.29Å; Y256-Y260 AromaticContact CD1-CE2 3.84Å; Y256-Y260 HydrophobicContact CD1-CE2 3.84Å; Y256-Y260 AromaticContact CE1-CE2 3.45Å; Y256-Y260 HydrophobicContact CE1-CE2 3.45Å; Y256-Y260 VanDerWaalsContact CE1-CE2 3.45Å; Y256-Y260 AromaticContact CE1-CZ 3.91Å; Y256-Y260 WeakPolarHBondContact CE1-OH 3.47Å; Y256-Y260 WeakPolarHBondContact O-CD2 3.36Å; Y256-Y260 PolarHBondContact OH-OH 3.01Å; S257-Y260 PolarHBondContact O-N 2.99Å; V258-Y260 VanDerWaalsContact C-N 3.3Å; V258-Y260 PolarHBondContact O-N 3.4Å; Y260-R263 PolarHBondContact O-N 2.97Å; Y260-L264 WeakPolarHBondContact O-CB 3.4Å; Y260-L264 WeakPolarHBondContact O-CD1 3.31Å; Y260-L264 WeakPolarHBondContact O-CG 3.46Å; Y260-L264 PolarHBondContact O-N 3.23Å; Y260-L300 HydrophobicContact CD2-CD2 4.11Å; Y260-L300 HydrophobicContact CE2-CD2 3.49Å; Y260-L300 VanDerWaalsContact CE2-CD2 3.49Å; Y260-L367 HydrophobicContact CD1-CD1 3.86Å; Y260-L367 HydrophobicContact CD1-CD2 4.34Å; Y260-L367 HydrophobicContact CE1-CD1 3.53Å; Y260-I472 HydrophobicContact CE1-CD1 4.48Å; Y260-I472 HydrophobicContact CE1-CG1 4.29Å; Y260-I472 HydrophobicContact CE1-CG2 3.88Å; Y260-L476 HydrophobicContact CD2-CD2 4.21Å; Y260-L476 HydrophobicContact CE2-CD1 4.44Å; Y260-L476 HydrophobicContact CE2-CD2 3.98Å; Y260-L476 HydrophobicContact CE2-CG 4.42Å
261L97.9Very high95.7Very high42 Ų4235.9 Ų35.922%0.2219%0.19CC..Hα-helixtrans-66-39.5177.7-59.6179.2000112A218 V219 F222 S257 V258 L264 T265A218-L261 HydrophobicContact CB-CD2 4.04Å; A218-L261 HydrophobicContact CB-CG 4.33Å; V219-L261 HydrophobicContact CG2-CD2 3.9Å; F222-L261 HydrophobicContact CB-CD1 4.25Å; F222-L261 HydrophobicContact CD2-CD1 4.32Å; F222-L261 HydrophobicContact CG-CD1 4.12Å; S257-L261 PolarHBondContact O-N 3.31Å; V258-L261 CarbonylContact O-C 3.58Å; V258-L261 PolarHBondContact O-N 2.9Å; V258-L261 VanDerWaalsContact O-N 3.1Å; L261-L264 PolarHBondContact O-N 3.47Å; L261-T265 WeakPolarHBondContact O-CB 3.14Å; L261-T265 VanDerWaalsContact O-CG2 3.3Å; L261-T265 WeakPolarHBondContact O-CG2 3.01Å; L261-T265 PolarHBondContact O-N 3.49Å; L261-T265 PolarHBondContact O-OG1 3.47Å
262V96.5Very high95.5Very high30 Ų3032.6 Ų32.618%0.18217%0.174CC..Hα-helixtrans-62.3-46.9174.3168.10000109.8V258 A259 L264 T265 L266 I295 V296 L299V258-V262 HydrophobicContact CG1-CG2 3.79Å; V258-V262 WeakPolarHBondContact O-CB 3.49Å; V258-V262 WeakPolarHBondContact O-CG2 3.43Å; V258-V262 PolarHBondContact O-N 3.24Å; A259-V262 PolarHBondContact O-N 2.88Å; V262-L264 VanDerWaalsContact C-N 3.32Å; V262-L264 PolarHBondContact O-N 3.02Å; V262-T265 PolarHBondContact O-N 2.82Å; V262-T265 PolarHBondContact O-OG1 2.74Å; V262-L266 HydrophobicContact CG1-CD1 3.59Å; V262-L266 HydrophobicContact CG1-CG 4.18Å; V262-L266 VanDerWaalsContact O-CB 3.25Å; V262-L266 WeakPolarHBondContact O-CB 3.02Å; V262-L266 WeakPolarHBondContact O-CG 3.15Å; V262-L266 PolarHBondContact O-N 3.16Å; V262-I295 HydrophobicContact CG1-CG2 4.26Å; V262-V296 HydrophobicContact CG1-CG2 4.25Å; V262-L299 HydrophobicContact CG2-CD1 4.22Å
263R96.1Very high95.2Very high4 Ų432.9 Ų32.92%0.01518%0.175CC..Hα-helixtrans-57.4-49.3173.5-170.6-96.276.1165.9-4.3110.3D211 A259 Y260 T265 G267 V271 V296 G366 L367D211-R263 IonicContact OD1-CZ 2.72Å; D211-R263 IonicContact OD1-NH1 3.07Å; D211-R263 PolarHBondContact OD1-NH1 3.39Å; D211-R263 IonicContact OD2-CZ 2.84Å; D211-R263 IonicContact OD2-NH1 2.82Å; D211-R263 PolarHBondContact OD2-NH1 3.31Å; D211-R263 IonicContact OD2-NH2 3.83Å; A259-R263 PolarHBondContact O-N 3.49Å; Y260-R263 PolarHBondContact O-N 2.97Å; R263-T265 PolarHBondContact O-N 2.97Å; R263-G267 PolarHBondContact O-N 3.23Å; R263-V271 HydrophobicContact CG-CB 4.44Å; R263-V271 HydrophobicContact CG-CG1 4.11Å; R263-V296 HydrophobicContact CB-CG2 4.23Å; R263-G366 WeakPolarHBondContact CG-O 3.5Å; R263-L367 HydrophobicContact CB-CD2 3.73Å; R263-L367 HydrophobicContact CG-CD2 3.8Å
264L96.5Very high94.7Very high44 Ų4433.6 Ų33.623%0.2318%0.179CC..Hα-helixtrans-60.5-43.9-175.7-73.4163.8000112.5D211 A215 Y260 L261 V262D211-L264 HydrophobicContact CB-CD2 4.01Å; A215-L264 HydrophobicContact CB-CD1 3.66Å; Y260-L264 WeakPolarHBondContact O-CB 3.4Å; Y260-L264 WeakPolarHBondContact O-CD1 3.31Å; Y260-L264 WeakPolarHBondContact O-CG 3.46Å; Y260-L264 PolarHBondContact O-N 3.23Å; L261-L264 PolarHBondContact O-N 3.47Å; V262-L264 VanDerWaalsContact C-N 3.32Å; V262-L264 PolarHBondContact O-N 3.02Å
265T94.8Very high93.8Very high109 Ų10937.4 Ų37.467%0.66920%0.199SC*.Hα-helixtrans-78.5-39-178.153.30000113.5L261 V262 R263 G267L261-T265 WeakPolarHBondContact O-CB 3.14Å; L261-T265 VanDerWaalsContact O-CG2 3.3Å; L261-T265 WeakPolarHBondContact O-CG2 3.01Å; L261-T265 PolarHBondContact O-N 3.49Å; L261-T265 PolarHBondContact O-OG1 3.47Å; V262-T265 PolarHBondContact O-N 2.82Å; V262-T265 PolarHBondContact O-OG1 2.74Å; R263-T265 PolarHBondContact O-N 2.97Å; T265-G267 VanDerWaalsContact C-N 3.25Å; T265-G267 PolarHBondContact O-N 3.27Å
266L92.8Very high92.3Very high59 Ų5942 Ų4231%0.30922%0.224SC..Hα-helixtrans-72.1-23.9174.6-67-179.2000111.8V262 R270 V271V262-L266 HydrophobicContact CG1-CD1 3.59Å; V262-L266 HydrophobicContact CG1-CG 4.18Å; V262-L266 VanDerWaalsContact O-CB 3.25Å; V262-L266 WeakPolarHBondContact O-CB 3.02Å; V262-L266 WeakPolarHBondContact O-CG 3.15Å; V262-L266 PolarHBondContact O-N 3.16Å; L266-R270 VanDerWaalsContact C-NH2 3.35Å; L266-R270 VanDerWaalsContact CA-NH2 3.29Å; L266-R270 PolarHBondContact O-NE 3.48Å; L266-R270 PolarHBondContact O-NH2 3.07Å; L266-V271 HydrophobicContact CB-CG2 3.85Å; L266-V271 HydrophobicContact CD1-CG2 4.33Å
267G91.6Very high90.4Very high24 Ų2441.8 Ų41.825%0.24723%0.227CC..  trans85.1148.3-179.900000112.2R263 T265 V269 R270 V271R263-G267 PolarHBondContact O-N 3.23Å; T265-G267 VanDerWaalsContact C-N 3.25Å; T265-G267 PolarHBondContact O-N 3.27Å; G267-V269 PolarHBondContact O-N 3.49Å; G267-R270 PolarHBondContact O-N 2.88Å; G267-V271 PolarHBondContact O-N 3.13Å
268R92.7Very high88.7Confident3 Ų343.7 Ų43.71%0.01124%0.239CC..Hα-helixtrans-55.6-46.6-173.6178.4177.1-69.5-94.21.5112.9Y197 D211 R270 V271 S272 D363 L364 T365Y197-R268 HydrophobicContact CE2-CB 4.06Å; D211-R268 IonicContact OD1-CZ 3.01Å; D211-R268 IonicContact OD1-NH2 3.02Å; D211-R268 PolarHBondContact OD1-NH2 3.4Å; R268-R270 PolarHBondContact O-N 2.97Å; R268-V271 PolarHBondContact O-N 2.98Å; R268-S272 WeakPolarHBondContact CG-OG 3.42Å; R268-S272 PolarHBondContact O-N 2.68Å; R268-S272 PolarHBondContact O-OG 3.43Å; R268-D363 PolarHBondContact NH1-O 2.8Å; R268-L364 PolarHBondContact NH1-O 3.35Å; R268-L364 PolarHBondContact NH2-O 2.72Å; R268-T365 PolarHBondContact NH2-O 2.81Å
269V90.4Very high87.1Confident61 Ų6146.3 Ų46.337%0.3726%0.264SS..Hα-helixtrans-62.6-45.4-173-178.90000111.8G267 V271 C273 L275G267-V269 PolarHBondContact O-N 3.49Å; V269-V271 VanDerWaalsContact C-N 3.28Å; V269-V271 PolarHBondContact O-N 3.37Å; V269-C273 VanDerWaalsContact CA-SG 3.58Å; V269-C273 HydrophobicContact CG1-CB 4.11Å; V269-C273 WeakPolarHBondContact O-CA 3.43Å; V269-C273 WeakPolarHBondContact O-CB 3.42Å; V269-C273 PolarHBondContact O-N 3.27Å; V269-L275 HydrophobicContact CG1-CD1 4.34Å
270R90.1Very high86Confident157 Ų15748.4 Ų48.459%0.59228%0.277SS*.Hα-helixtrans-69-24.9-179.7-67.3-168.3-64.5-173.7-6.5114.1L266 G267 R268 S290L266-R270 VanDerWaalsContact C-NH2 3.35Å; L266-R270 VanDerWaalsContact CA-NH2 3.29Å; L266-R270 PolarHBondContact O-NE 3.48Å; L266-R270 PolarHBondContact O-NH2 3.07Å; G267-R270 PolarHBondContact O-N 2.88Å; R268-R270 PolarHBondContact O-N 2.97Å; R270-S290 PolarHBondContact O-OG 2.93Å
271V93.3Very high85.4Confident0 Ų050.2 Ų50.20%029%0.289CS..Hα-helixtrans-93.7-45.1-176.1173.90000111.5R263 L266 G267 R268 V269 C293 V296R263-V271 HydrophobicContact CG-CB 4.44Å; R263-V271 HydrophobicContact CG-CG1 4.11Å; L266-V271 HydrophobicContact CB-CG2 3.85Å; L266-V271 HydrophobicContact CD1-CG2 4.33Å; G267-V271 PolarHBondContact O-N 3.13Å; R268-V271 PolarHBondContact O-N 2.98Å; V269-V271 VanDerWaalsContact C-N 3.28Å; V269-V271 PolarHBondContact O-N 3.37Å; V271-C293 WeakPolarHBondContact O-CA 3.25Å; V271-C293 VanDerWaalsContact O-CB 3.24Å; V271-C293 WeakPolarHBondContact O-CB 3.39Å; V271-C293 PolarHBondContact O-N 3.41Å; V271-V296 HydrophobicContact CG1-CB 4.28Å; V271-V296 HydrophobicContact CG1-CG2 3.76Å
272S92.4Very high84.9Confident1 Ų148.4 Ų48.41%0.00728%0.28CS..Hα-helixtrans-106.1-13.8-169.957.70000114.7C195 R268 V284C195-S272 PolarHBondContact SG-O 2.71Å; R268-S272 WeakPolarHBondContact CG-OG 3.42Å; R268-S272 PolarHBondContact O-N 2.68Å; R268-S272 PolarHBondContact O-OG 3.43Å; S272-V284 WeakPolarHBondContact O-CG2 3.44Å; S272-V284 PolarHBondContact O-N 3.3Å
273C90.6Very high84.6Confident6 Ų647.4 Ų47.44%0.04127%0.273CS..EExtended strand (participates in β ladder)trans-106.3139.7-179.9-44.40000112C195 V269 P281 I282C195-C273 VanDerWaalsContact C-SG 3.54Å; C195-C273 HydrophobicContact CB-CB 3.63Å; C195-C273 WeakPolarHBondContact CB-SG 3.32Å; C195-C273 WeakPolarHBondContact SG-CA 3.39Å; C195-C273 WeakPolarHBondContact SG-CB 3.37Å; C195-C273 PolarHBondContact SG-N 3.08Å; C195-C273 VanDerWaalsContact SG-N 3.44Å; C195-C273 CovalentContact SG-SG 2.02Å; C195-C273 PolarHBondContact SG-SG 3.42Å; V269-C273 VanDerWaalsContact CA-SG 3.58Å; V269-C273 HydrophobicContact CG1-CB 4.11Å; V269-C273 WeakPolarHBondContact O-CA 3.43Å; V269-C273 WeakPolarHBondContact O-CB 3.42Å; V269-C273 PolarHBondContact O-N 3.27Å; C273-P281 HydrophobicContact CB-CB 3.99Å; C273-I282 CarbonylContact C-O 3.6Å; C273-I282 VanDerWaalsContact CA-O 3.22Å; C273-I282 WeakPolarHBondContact CA-O 3.29Å
274D87.3Confident84.3Confident22 Ų2247.3 Ų47.312%0.11827%0.273CS..EExtended strand (participates in β ladder)trans-96.7125.3166.3-170.3-7.8000108.6D276 I282 V284D274-D276 PolarHBondContact OD1-N 3.47Å; D274-I282 HydrophobicContact CB-CG1 4.06Å; D274-I282 PolarHBondContact N-O 2.98Å; D274-I282 PolarHBondContact O-N 3.41Å; D274-I282 VanDerWaalsContact O-N 3.11Å; D274-V284 HydrophobicContact CB-CG2 4.1Å
275L78.9Confident83.9Confident104 Ų10448.1 Ų48.155%0.54528%0.275SS..  trans-105.2-12.8-178.9-73.3144.8000111.9V269 P281V269-L275 HydrophobicContact CG1-CD1 4.34Å; L275-P281 HydrophobicContact CD2-CB 4.3Å
276D66.2Low83.3Confident153 Ų15344.9 Ų44.982%0.81825%0.253SS*.SBendtrans-88.5-15.7-170.8-67.5-21.5000112.1D274D274-D276 PolarHBondContact OD1-N 3.47Å
277A58.8Low82.6Confident20 Ų2042.1 Ų42.117%0.16524%0.239CC..SBendtrans-86.5-33.2-175.300000114.1L185 I282L185-A277 HydrophobicContact CD1-CB 4.02Å; A277-I282 HydrophobicContact CB-CD1 3.68Å; A277-I282 HydrophobicContact CB-CG1 4.44Å
278T60.7Low82Confident40 Ų4045.9 Ų45.925%0.24525%0.253CS..SBendtrans-152.4168.1-179.3760000112L185 V280L185-T278 HydrophobicContact CD1-CG2 3.68Å; T278-V280 PolarHBondContact O-N 3.03Å; T278-V280 VanDerWaalsContact O-N 3.1Å; T278-V280 PolarHBondContact OG1-N 3.24Å; T278-V280 PolarHBondContact OG1-O 2.98Å
279A66.3Low81.4Confident92 Ų9250.5 Ų50.576%0.7627%0.273SS*.SBendtrans-65.4-7.117400000114.3
280V74.1Confident81.3Confident43 Ų4348.3 Ų48.326%0.26126%0.26SS..SBendtrans-116.8136.4179.8-176.70000108.6Q194 T278 I282Q194-V280 HydrophobicContact CG-CG1 3.79Å; T278-V280 PolarHBondContact O-N 3.03Å; T278-V280 VanDerWaalsContact O-N 3.1Å; T278-V280 PolarHBondContact OG1-N 3.24Å; T278-V280 PolarHBondContact OG1-O 2.98Å; V280-I282 PolarHBondContact O-N 3.09Å
281P84.9Confident81.3Confident40 Ų4046.1 Ų46.126%0.2626%0.264SS..  trans-63.1120.3175.825.4-34000110.2Q194 C195 C273 L275Q194-P281 WeakPolarHBondContact CA-O 3.35Å; C195-P281 PolarHBondContact N-O 2.01Å; C195-P281 VanDerWaalsContact O-CG 3.32Å; C195-P281 WeakPolarHBondContact O-CG 3.43Å; C273-P281 HydrophobicContact CB-CB 3.99Å; L275-P281 HydrophobicContact CD2-CB 4.3Å
282I88.3Confident81.3Confident5 Ų546.7 Ų46.73%0.02627%0.27CS..EExtended strand (participates in β ladder)trans-108.2155.9176.862.4171.3000110.7L185 C195 C273 D274 A277 V280L185-I282 HydrophobicContact CD1-CD1 4.49Å; L185-I282 HydrophobicContact CD2-CD1 4.17Å; C195-I282 VanDerWaalsContact CB-C 3.49Å; C273-I282 CarbonylContact C-O 3.6Å; C273-I282 VanDerWaalsContact CA-O 3.22Å; C273-I282 WeakPolarHBondContact CA-O 3.29Å; D274-I282 HydrophobicContact CB-CG1 4.06Å; D274-I282 PolarHBondContact N-O 2.98Å; D274-I282 PolarHBondContact O-N 3.41Å; D274-I282 VanDerWaalsContact O-N 3.11Å; A277-I282 HydrophobicContact CB-CD1 3.68Å; A277-I282 HydrophobicContact CB-CG1 4.44Å; V280-I282 PolarHBondContact O-N 3.09Å
283L90.3Very high81.4Confident9 Ų946.6 Ų46.65%0.04727%0.27CS..EExtended strand (participates in β ladder)trans-70.2132.8179.4-167.368.5000110.5L193 C195 Q285 A361 D363L193-L283 HydrophobicContact CD2-CD2 4.38Å; L193-L283 WeakPolarHBondContact O-CB 3.48Å; L193-L283 PolarHBondContact O-N 2.93Å; C195-L283 HydrophobicContact CB-CB 4.27Å; C195-L283 HydrophobicContact CB-CD1 4.31Å; L283-Q285 PolarHBondContact O-N 3.42Å; L283-A361 HydrophobicContact CD1-CB 3.64Å; L283-A361 WeakPolarHBondContact CD2-O 3.5Å; L283-A361 HydrophobicContact CG-CB 3.97Å; L283-D363 HydrophobicContact CD2-CB 4.42Å
284V90.6Very high81.6Confident1 Ų147.2 Ų47.21%0.00628%0.275CS..  trans-62.5119.4-179.2174.80000110.4S272 D274 E286 C293 A361S272-V284 WeakPolarHBondContact O-CG2 3.44Å; S272-V284 PolarHBondContact O-N 3.3Å; D274-V284 HydrophobicContact CB-CG2 4.1Å; V284-E286 WeakPolarHBondContact CG1-O 3.37Å; V284-C293 HydrophobicContact CG1-CB 4.3Å; V284-A361 HydrophobicContact CB-CB 4.11Å; V284-A361 PolarHBondContact O-N 2.71Å
285Q86.8Confident82Confident61 Ų6149.5 Ų49.529%0.28529%0.287SS..SBendtrans-99-18.9175.2-63.5-169.5-35.800113.4L283L283-Q285 PolarHBondContact O-N 3.42Å
286E83.3Confident82.9Confident41 Ų4144.6 Ų44.619%0.19226%0.261CS..SBendtrans-129.4103.3175.8-71175.7-107.700109.1V284 L288 K289 R357 V359V284-E286 WeakPolarHBondContact CG1-O 3.37Å; E286-L288 PolarHBondContact O-N 3.45Å; E286-K289 HydrophobicContact CB-CD 4.15Å; E286-K289 HydrophobicContact CB-CG 4.26Å; E286-K289 WeakPolarHBondContact O-CB 3.3Å; E286-K289 PolarHBondContact O-N 3.3Å; E286-K289 WeakPolarHBondContact OE1-CE 3.4Å; E286-K289 IonicContact OE1-NZ 2.77Å; E286-K289 PolarHBondContact OE1-NZ 3.45Å; E286-R357 VanDerWaalsContact OE2-CD 3.23Å; E286-R357 WeakPolarHBondContact OE2-CD 3.49Å; E286-R357 IonicContact OE2-CZ 3.88Å; E286-R357 IonicContact OE2-NE 3.87Å; E286-R357 IonicContact OE2-NH1 3.52Å; E286-R357 PolarHBondContact OE2-NH1 3.17Å; E286-V359 CarbonylContact C-O 3.39Å
287G76.7Confident84.4Confident2 Ų237.3 Ų37.32%0.02122%0.222CC..G310 helixtrans-59.7-20.4-17300000115.3K289 S290 V359G287-K289 VanDerWaalsContact C-N 3.26Å; G287-K289 PolarHBondContact O-N 3.13Å; G287-S290 PolarHBondContact O-N 3.4Å; G287-V359 PolarHBondContact N-O 2.98Å
288L79.6Confident86.2Confident102 Ų10239.7 Ų39.753%0.53423%0.232SC..G310 helixtrans-69-20.5175.3-79.1162.9000113.6E286 L354 R357E286-L288 PolarHBondContact O-N 3.45Å; L288-L354 WeakPolarHBondContact CD1-O 3.45Å; L288-L354 HydrophobicContact CD2-CD2 4.44Å; L288-R357 HydrophobicContact CD1-CG 4.35Å
289K80.1Confident88Confident101 Ų10139.2 Ų39.244%0.43923%0.227SC..G310 helixtrans-74.6-27.4177.5-68.3178.8174163.90112.3E286 G287E286-K289 HydrophobicContact CB-CD 4.15Å; E286-K289 HydrophobicContact CB-CG 4.26Å; E286-K289 WeakPolarHBondContact O-CB 3.3Å; E286-K289 PolarHBondContact O-N 3.3Å; E286-K289 WeakPolarHBondContact OE1-CE 3.4Å; E286-K289 IonicContact OE1-NZ 2.77Å; E286-K289 PolarHBondContact OE1-NZ 3.45Å; G287-K289 VanDerWaalsContact C-N 3.26Å; G287-K289 PolarHBondContact O-N 3.13Å
290S87.8Confident89.5Confident14 Ų1435 Ų3510%0.09819%0.192CC..  trans-115.4114.8177.4170.90000111.5R270 G287 G292 C293 A294R270-S290 PolarHBondContact O-OG 2.93Å; G287-S290 PolarHBondContact O-N 3.4Å; S290-G292 PolarHBondContact O-N 2.96Å; S290-C293 WeakPolarHBondContact O-CB 3.39Å; S290-C293 PolarHBondContact O-N 3.35Å; S290-C293 VanDerWaalsContact O-N 3.09Å; S290-C293 PolarHBondContact OG-N 2.97Å; S290-A294 PolarHBondContact O-N 3.25Å
291T90.9Very high90.7Very high111 Ų11133 Ų3368%0.68118%0.179SC*.Hα-helixtrans-56-38.9175.7-530000112A294 I295T291-A294 PolarHBondContact O-N 3.23Å; T291-I295 HydrophobicContact CG2-CD1 3.94Å; T291-I295 VanDerWaalsContact O-CG1 3.25Å; T291-I295 WeakPolarHBondContact O-CG1 3.38Å; T291-I295 PolarHBondContact O-N 3.17Å
292G92.3Very high91.3Very high12 Ų1233.2 Ų33.212%0.12418%0.177CC..Hα-helixtrans-63.5-43.6177.600000112S290 I295 V296S290-G292 PolarHBondContact O-N 2.96Å; G292-I295 PolarHBondContact O-N 3.41Å; G292-V296 WeakPolarHBondContact O-CG2 3.47Å; G292-V296 PolarHBondContact O-N 3.1Å; G292-V296 VanDerWaalsContact O-N 3.13Å
293C94.7Very high91.8Very high0 Ų034.6 Ų34.60%018%0.183CC..Hα-helixtrans-60.8-49.6176.4-169.10000111.8V271 V284 S290 I295 V296 F297 C368V271-C293 WeakPolarHBondContact O-CA 3.25Å; V271-C293 VanDerWaalsContact O-CB 3.24Å; V271-C293 WeakPolarHBondContact O-CB 3.39Å; V271-C293 PolarHBondContact O-N 3.41Å; V284-C293 HydrophobicContact CG1-CB 4.3Å; S290-C293 WeakPolarHBondContact O-CB 3.39Å; S290-C293 PolarHBondContact O-N 3.35Å; S290-C293 VanDerWaalsContact O-N 3.09Å; S290-C293 PolarHBondContact OG-N 2.97Å; C293-I295 PolarHBondContact O-N 3.17Å; C293-V296 PolarHBondContact O-N 3.2Å; C293-F297 WeakPolarHBondContact O-CB 3.47Å; C293-F297 PolarHBondContact O-N 3.31Å; C293-C368 WeakPolarHBondContact CA-SG 3.33Å; C293-C368 HydrophobicContact CB-CB 3.94Å; C293-C368 WeakPolarHBondContact CB-SG 3.37Å; C293-C368 VanDerWaalsContact O-CB 3.25Å; C293-C368 WeakPolarHBondContact O-CB 2.92Å; C293-C368 WeakPolarHBondContact SG-CB 3.25Å; C293-C368 CovalentContact SG-SG 2.01Å; C293-C368 PolarHBondContact SG-SG 3.46Å
294A95Very high92.2Very high18 Ų1834.9 Ų34.915%0.14919%0.188CC..Hα-helixtrans-59.6-43.3178.400000112.4S290 T291 F297 L298S290-A294 PolarHBondContact O-N 3.25Å; T291-A294 PolarHBondContact O-N 3.23Å; A294-F297 PolarHBondContact O-N 3.43Å; A294-L298 WeakPolarHBondContact O-CB 3.48Å; A294-L298 VanDerWaalsContact O-CG 3.23Å; A294-L298 WeakPolarHBondContact O-CG 3.36Å; A294-L298 PolarHBondContact O-N 2.85Å
295I95.9Very high92.6Very high71 Ų7134.9 Ų34.936%0.36419%0.188SC..Hα-helixtrans-61.6-47.4178-70.1166.4000111V262 T291 G292 C293 L298 L299V262-I295 HydrophobicContact CG1-CG2 4.26Å; T291-I295 HydrophobicContact CG2-CD1 3.94Å; T291-I295 VanDerWaalsContact O-CG1 3.25Å; T291-I295 WeakPolarHBondContact O-CG1 3.38Å; T291-I295 PolarHBondContact O-N 3.17Å; G292-I295 PolarHBondContact O-N 3.41Å; C293-I295 PolarHBondContact O-N 3.17Å; I295-L298 PolarHBondContact O-N 2.91Å; I295-L299 HydrophobicContact CG2-CD1 4.03Å; I295-L299 HydrophobicContact CG2-CG 4.49Å; I295-L299 WeakPolarHBondContact O-CG 3.24Å; I295-L299 PolarHBondContact O-N 2.95Å
296V97.5Very high93.1Very high0 Ų032 Ų320%017%0.174CC..Hα-helixtrans-63.1-44179.31700000110.9V262 R263 V271 G292 C293 L299 L300 L367V262-V296 HydrophobicContact CG1-CG2 4.25Å; R263-V296 HydrophobicContact CB-CG2 4.23Å; V271-V296 HydrophobicContact CG1-CB 4.28Å; V271-V296 HydrophobicContact CG1-CG2 3.76Å; G292-V296 WeakPolarHBondContact O-CG2 3.47Å; G292-V296 PolarHBondContact O-N 3.1Å; G292-V296 VanDerWaalsContact O-N 3.13Å; C293-V296 PolarHBondContact O-N 3.2Å; V296-L299 PolarHBondContact O-N 2.96Å; V296-L300 HydrophobicContact CG1-CD1 3.81Å; V296-L300 HydrophobicContact CG1-CG 4.37Å; V296-L300 WeakPolarHBondContact O-CB 2.99Å; V296-L300 WeakPolarHBondContact O-CG 3.47Å; V296-L300 PolarHBondContact O-N 2.83Å; V296-L367 HydrophobicContact CG1-CB 4.3Å; V296-L367 HydrophobicContact CG1-CD2 3.72Å
297F97.7Very high93.8Very high0 Ų030.4 Ų30.40%017%0.168CC..Hα-helixtrans-57.8-49.6174.6161-102.3000112C293 A294 L299 L300 Y301 T350 I353 L354 V359 C368 V370C293-F297 WeakPolarHBondContact O-CB 3.47Å; C293-F297 PolarHBondContact O-N 3.31Å; A294-F297 PolarHBondContact O-N 3.43Å; F297-L299 VanDerWaalsContact C-N 3.33Å; F297-L299 PolarHBondContact O-N 3.48Å; F297-L300 PolarHBondContact O-N 3.15Å; F297-Y301 HydrophobicContact CE2-CD1 4.32Å; F297-Y301 HydrophobicContact CE2-CD2 4.18Å; F297-Y301 AromaticContact CE2-CG 3.77Å; F297-Y301 HydrophobicContact CE2-CG 3.77Å; F297-Y301 HydrophobicContact CZ-CD1 4.23Å; F297-Y301 HydrophobicContact CZ-CG 4.13Å; F297-Y301 VanDerWaalsContact O-CB 3.26Å; F297-Y301 WeakPolarHBondContact O-CB 3.39Å; F297-Y301 PolarHBondContact O-N 2.92Å; F297-T350 HydrophobicContact CE1-CG2 3.91Å; F297-T350 HydrophobicContact CZ-CG2 4.23Å; F297-I353 HydrophobicContact CE1-CG2 4.27Å; F297-I353 HydrophobicContact CE2-CG2 3.8Å; F297-I353 HydrophobicContact CZ-CB 4.03Å; F297-I353 HydrophobicContact CZ-CD1 4.28Å; F297-I353 HydrophobicContact CZ-CG2 3.41Å; F297-I353 VanDerWaalsContact CZ-CG2 3.41Å; F297-L354 HydrophobicContact CD1-CD2 4.03Å; F297-L354 HydrophobicContact CE1-CD2 3.73Å; F297-L354 HydrophobicContact CE1-CG 3.93Å; F297-V359 HydrophobicContact CB-CG1 3.64Å; F297-V359 HydrophobicContact CD1-CG1 4.24Å; F297-V359 HydrophobicContact CD1-CG2 3.74Å; F297-V359 HydrophobicContact CD2-CB 4.47Å; F297-V359 HydrophobicContact CD2-CG1 3.91Å; F297-V359 HydrophobicContact CD2-CG2 3.78Å; F297-V359 HydrophobicContact CE1-CG2 3.75Å; F297-V359 HydrophobicContact CE2-CG2 3.78Å; F297-V359 HydrophobicContact CG-CB 4.38Å; F297-V359 HydrophobicContact CG-CG1 3.64Å; F297-V359 HydrophobicContact CG-CG2 3.76Å; F297-V359 HydrophobicContact CZ-CG2 3.77Å; F297-C368 WeakPolarHBondContact CA-O 3.29Å; F297-C368 HydrophobicContact CB-CB 4.28Å; F297-V370 HydrophobicContact CE2-CB 4.27Å
298L97.6Very high94.8Very high71 Ų7131.1 Ų31.137%0.37217%0.172SC..Hα-helixtrans-58.8-45.4-179.9-75.2173.1000111.2A294 I295 F302 T350 L354A294-L298 WeakPolarHBondContact O-CB 3.48Å; A294-L298 VanDerWaalsContact O-CG 3.23Å; A294-L298 WeakPolarHBondContact O-CG 3.36Å; A294-L298 PolarHBondContact O-N 2.85Å; I295-L298 PolarHBondContact O-N 2.91Å; L298-F302 WeakPolarHBondContact O-CB 3.43Å; L298-F302 PolarHBondContact O-N 2.95Å; L298-T350 HydrophobicContact CD2-CG2 3.45Å; L298-T350 VanDerWaalsContact CD2-CG2 3.45Å; L298-L354 HydrophobicContact CD2-CD1 4.16Å
299L98Very high95.7Very high29 Ų2927 Ų2715%0.15215%0.15CC..Hα-helixtrans-66.4-43.1179.8-68.4174.2000112.3V258 A259 V262 I295 V296 F297 F303V258-L299 HydrophobicContact CG1-CD1 4.23Å; A259-L299 HydrophobicContact CB-CB 3.49Å; A259-L299 VanDerWaalsContact CB-CB 3.49Å; A259-L299 HydrophobicContact CB-CD1 4.19Å; V262-L299 HydrophobicContact CG2-CD1 4.22Å; I295-L299 HydrophobicContact CG2-CD1 4.03Å; I295-L299 HydrophobicContact CG2-CG 4.49Å; I295-L299 WeakPolarHBondContact O-CG 3.24Å; I295-L299 PolarHBondContact O-N 2.95Å; V296-L299 PolarHBondContact O-N 2.96Å; F297-L299 VanDerWaalsContact C-N 3.33Å; F297-L299 PolarHBondContact O-N 3.48Å; L299-F303 HydrophobicContact CD2-CD2 4.22Å; L299-F303 HydrophobicContact CD2-CE2 3.9Å; L299-F303 WeakPolarHBondContact O-CB 3.27Å; L299-F303 WeakPolarHBondContact O-CD2 3.49Å
300L98.2Very high96.5Very high4 Ų422.1 Ų22.12%0.02113%0.129CC..Hα-helixtrans-70.8-52.2179.6-71.2174.8000111.9Y256 A259 Y260 V296 F297 G304 L367 Y369Y256-L300 HydrophobicContact CD2-CD2 4.03Å; Y256-L300 VanDerWaalsContact CD2-O 3.24Å; Y256-L300 WeakPolarHBondContact CD2-O 3.43Å; Y256-L300 HydrophobicContact CE1-CD2 4.24Å; Y256-L300 HydrophobicContact CE2-CB 4.14Å; Y256-L300 HydrophobicContact CE2-CD2 3.63Å; Y256-L300 VanDerWaalsContact CE2-O 3.23Å; Y256-L300 WeakPolarHBondContact CE2-O 3.41Å; Y256-L300 HydrophobicContact CG-CD2 4.48Å; A259-L300 HydrophobicContact CB-CD2 3.55Å; A259-L300 HydrophobicContact CB-CG 3.58Å; Y260-L300 HydrophobicContact CD2-CD2 4.11Å; Y260-L300 HydrophobicContact CE2-CD2 3.49Å; Y260-L300 VanDerWaalsContact CE2-CD2 3.49Å; V296-L300 HydrophobicContact CG1-CD1 3.81Å; V296-L300 HydrophobicContact CG1-CG 4.37Å; V296-L300 WeakPolarHBondContact O-CB 2.99Å; V296-L300 WeakPolarHBondContact O-CG 3.47Å; V296-L300 PolarHBondContact O-N 2.83Å; F297-L300 PolarHBondContact O-N 3.15Å; L300-G304 WeakPolarHBondContact O-CA 3.44Å; L300-G304 PolarHBondContact O-N 3.21Å; L300-L367 HydrophobicContact CD1-CB 4.18Å; L300-L367 HydrophobicContact CD1-CD1 4.24Å; L300-L367 HydrophobicContact CD1-CD2 4.24Å; L300-L367 HydrophobicContact CD1-CG 4.46Å; L300-Y369 HydrophobicContact CB-CD2 3.99Å; L300-Y369 HydrophobicContact CB-CE2 4.02Å; L300-Y369 HydrophobicContact CD1-CD2 4.34Å
301Y98.5Very high96.9Very high0 Ų021.6 Ų21.60%013%0.125CC..Hα-helixtrans-73.7-51.4-169.4-173.1-91.8000112.3F297 M305 K349 T350 I353 Y369 V370 F381 V382F297-Y301 HydrophobicContact CE2-CD1 4.32Å; F297-Y301 HydrophobicContact CE2-CD2 4.18Å; F297-Y301 AromaticContact CE2-CG 3.77Å; F297-Y301 HydrophobicContact CE2-CG 3.77Å; F297-Y301 HydrophobicContact CZ-CD1 4.23Å; F297-Y301 HydrophobicContact CZ-CG 4.13Å; F297-Y301 VanDerWaalsContact O-CB 3.26Å; F297-Y301 WeakPolarHBondContact O-CB 3.39Å; F297-Y301 PolarHBondContact O-N 2.92Å; Y301-M305 HydrophobicContact CD1-CG 4.33Å; Y301-M305 HydrophobicContact CD2-CE 4.25Å; Y301-M305 HydrophobicContact CE1-CG 3.97Å; Y301-M305 HydrophobicContact CE2-CE 3.57Å; Y301-M305 HydrophobicContact CE2-CG 4.22Å; Y301-M305 WeakPolarHBondContact O-CB 3.48Å; Y301-M305 WeakPolarHBondContact O-CG 3.37Å; Y301-M305 PolarHBondContact O-N 3.42Å; Y301-K349 HydrophobicContact CE1-CB 3.94Å; Y301-K349 WeakPolarHBondContact OH-CE 3.47Å; Y301-K349 PolarHBondContact OH-NZ 3.11Å; Y301-T350 WeakPolarHBondContact CD1-OG1 3.4Å; Y301-I353 HydrophobicContact CD1-CD1 4.03Å; Y301-I353 HydrophobicContact CD2-CD1 4.21Å; Y301-I353 HydrophobicContact CE1-CD1 3.41Å; Y301-I353 VanDerWaalsContact CE1-CD1 3.41Å; Y301-I353 HydrophobicContact CE2-CD1 3.62Å; Y301-I353 HydrophobicContact CG-CD1 4.4Å; Y301-I353 WeakPolarHBondContact OH-CD1 3.32Å; Y301-Y369 AromaticContact CD2-CE2 3.98Å; Y301-Y369 HydrophobicContact CD2-CE2 3.98Å; Y301-Y369 AromaticContact CD2-CZ 3.91Å; Y301-V370 HydrophobicContact CD2-CG1 3.62Å; Y301-V370 HydrophobicContact CE2-CG1 3.54Å; Y301-F381 PolarHBondContact OH-O 2.95Å; Y301-V382 HydrophobicContact CE2-CG2 4.16Å
302F98.6Very high97.3Very high45 Ų4517.1 Ų17.120%0.19710%0.098CC..Hα-helixtrans-62.7-52.1-176.4178.9-91.7000111.1L298 M305 A306 W343 P346 A347L298-F302 WeakPolarHBondContact O-CB 3.43Å; L298-F302 PolarHBondContact O-N 2.95Å; F302-M305 PolarHBondContact O-N 3.41Å; F302-A306 VanDerWaalsContact O-CB 3.32Å; F302-A306 WeakPolarHBondContact O-CB 3.37Å; F302-A306 PolarHBondContact O-N 3.28Å; F302-W343 AromaticContact CE1-CE3 3.9Å; F302-W343 HydrophobicContact CE1-CE3 3.9Å; F302-W343 AromaticContact CE1-CZ3 3.98Å; F302-W343 HydrophobicContact CE1-CZ3 3.98Å; F302-W343 AromaticContact CZ-CE3 3.86Å; F302-W343 HydrophobicContact CZ-CE3 3.86Å; F302-W343 HydrophobicContact CZ-CZ3 4.41Å; F302-P346 HydrophobicContact CD2-CB 3.84Å; F302-P346 HydrophobicContact CE2-CB 3.99Å; F302-P346 HydrophobicContact CG-CB 4.45Å; F302-A347 HydrophobicContact CE2-CB 3.96Å
303F98.5Very high97.5Very high35 Ų3517.1 Ų17.115%0.15410%0.095CC..Hα-helixtrans-75-29-177.3-63.9-69.9000112.9C252 L255 L299 S307C252-F303 HydrophobicContact CB-CB 4.34Å; C252-F303 WeakPolarHBondContact CB-O 3.4Å; C252-F303 WeakPolarHBondContact O-CB 3.44Å; L255-F303 HydrophobicContact CB-CB 4.41Å; L255-F303 HydrophobicContact CB-CD1 4.01Å; L255-F303 HydrophobicContact CB-CD2 3.59Å; L255-F303 HydrophobicContact CB-CE1 4.2Å; L255-F303 HydrophobicContact CB-CE2 3.82Å; L255-F303 HydrophobicContact CB-CG 3.72Å; L255-F303 HydrophobicContact CB-CZ 4.13Å; L255-F303 HydrophobicContact CD1-CD1 3.87Å; L255-F303 HydrophobicContact CD1-CD2 4.38Å; L255-F303 HydrophobicContact CD1-CE1 3.3Å; L255-F303 HydrophobicContact CD1-CE2 3.9Å; L255-F303 HydrophobicContact CD1-CG 4.39Å; L255-F303 HydrophobicContact CD1-CZ 3.34Å; L255-F303 HydrophobicContact CG-CE1 4.37Å; L255-F303 HydrophobicContact CG-CE2 4.41Å; L255-F303 HydrophobicContact CG-CZ 4.3Å; L299-F303 HydrophobicContact CD2-CD2 4.22Å; L299-F303 HydrophobicContact CD2-CE2 3.9Å; L299-F303 WeakPolarHBondContact O-CB 3.27Å; L299-F303 WeakPolarHBondContact O-CD2 3.49Å; F303-S307 VanDerWaalsContact O-CB 3.25Å; F303-S307 WeakPolarHBondContact O-CB 3.36Å; F303-S307 PolarHBondContact O-N 3.05Å
304G98Very high97.5Very high15 Ų1517.1 Ų17.116%0.15510%0.095CC..Hα-helixtrans-61.2-50.1170.200000111.7L300 S307 S308L300-G304 WeakPolarHBondContact O-CA 3.44Å; L300-G304 PolarHBondContact O-N 3.21Å; G304-S307 WeakPolarHBondContact O-CB 3.4Å; G304-S307 PolarHBondContact O-N 2.64Å; G304-S308 PolarHBondContact O-N 2.94Å; G304-S308 PolarHBondContact O-OG 3.37Å
305M98.4Very high97.6Very high1 Ų116.3 Ų16.31%0.0059%0.088CC..Hα-helixtrans-65.7-41.3178.6-69.1-67.5163.500112.5Y301 F302 S307 S308 L309 P346 K349 F381 V382 L386 Y389Y301-M305 HydrophobicContact CD1-CG 4.33Å; Y301-M305 HydrophobicContact CD2-CE 4.25Å; Y301-M305 HydrophobicContact CE1-CG 3.97Å; Y301-M305 HydrophobicContact CE2-CE 3.57Å; Y301-M305 HydrophobicContact CE2-CG 4.22Å; Y301-M305 WeakPolarHBondContact O-CB 3.48Å; Y301-M305 WeakPolarHBondContact O-CG 3.37Å; Y301-M305 PolarHBondContact O-N 3.42Å; F302-M305 PolarHBondContact O-N 3.41Å; M305-S307 VanDerWaalsContact C-N 3.35Å; M305-S308 PolarHBondContact O-N 3.13Å; M305-L309 PolarHBondContact O-N 3.04Å; M305-L309 VanDerWaalsContact O-N 3.13Å; M305-P346 HydrophobicContact CB-CB 3.91Å; M305-P346 HydrophobicContact CB-CG 3.94Å; M305-K349 PolarHBondContact SD-NZ 3.39Å; M305-F381 WeakPolarHBondContact CE-O 3.4Å; M305-V382 HydrophobicContact CE-CB 4.42Å; M305-V382 HydrophobicContact CE-CG1 4.24Å; M305-L386 HydrophobicContact CE-CD2 4.46Å; M305-L386 HydrophobicContact CE-CG 4.31Å; M305-L386 HydrophobicContact SD-CD2 4.3Å; M305-Y389 HydrophobicContact SD-CE2 4.26Å
306A98.4Very high97.5Very high0 Ų014.8 Ų14.80%08%0.08CC..Hα-helixtrans-63.2-40.6175.700000111.7F302 S308 L309 W310 W343 P346F302-A306 VanDerWaalsContact O-CB 3.32Å; F302-A306 WeakPolarHBondContact O-CB 3.37Å; F302-A306 PolarHBondContact O-N 3.28Å; A306-S308 PolarHBondContact O-N 2.71Å; A306-L309 PolarHBondContact O-N 2.91Å; A306-W310 PolarHBondContact O-N 3.07Å; A306-W343 HydrophobicContact CB-CE3 3.9Å; A306-W343 HydrophobicContact CB-CZ3 3.56Å; A306-P346 HydrophobicContact CB-CG 4.03Å
307S97.3Very high97.4Very high8 Ų814.8 Ų14.86%0.0568%0.08CC..Hα-helixtrans-58.4-45.8175.8-178.20000111.8C253 F303 G304 M305 L309 W310 W311C253-S307 PolarHBondContact SG-OG 2.88Å; F303-S307 VanDerWaalsContact O-CB 3.25Å; F303-S307 WeakPolarHBondContact O-CB 3.36Å; F303-S307 PolarHBondContact O-N 3.05Å; G304-S307 WeakPolarHBondContact O-CB 3.4Å; G304-S307 PolarHBondContact O-N 2.64Å; M305-S307 VanDerWaalsContact C-N 3.35Å; S307-L309 PolarHBondContact O-N 3.37Å; S307-W310 PolarHBondContact O-N 2.88Å; S307-W311 PolarHBondContact O-N 3.35Å
308S97.3Very high97.2Very high17 Ų1714.9 Ų14.912%0.1198%0.081CC..Hα-helixtrans-63.5-38.3176.9-57.20000112.9G304 M305 A306 W311 V312 L386G304-S308 PolarHBondContact O-N 2.94Å; G304-S308 PolarHBondContact O-OG 3.37Å; M305-S308 PolarHBondContact O-N 3.13Å; A306-S308 PolarHBondContact O-N 2.71Å; S308-W311 WeakPolarHBondContact O-CB 3.43Å; S308-W311 PolarHBondContact O-N 2.84Å; S308-V312 PolarHBondContact O-N 3.42Å; S308-L386 WeakPolarHBondContact OG-CD2 3.27Å
309L98.1Very high97Very high14 Ų1413.5 Ų13.57%0.0737%0.072CC..Hα-helixtrans-68.1-39.5174.7-78.3165.9000112.5M305 A306 S307 W311 V312 I313 A342 I345 P346 Y389M305-L309 PolarHBondContact O-N 3.04Å; M305-L309 VanDerWaalsContact O-N 3.13Å; A306-L309 PolarHBondContact O-N 2.91Å; S307-L309 PolarHBondContact O-N 3.37Å; L309-W311 PolarHBondContact O-N 3.11Å; L309-V312 WeakPolarHBondContact O-CB 3.49Å; L309-V312 PolarHBondContact O-N 3.48Å; L309-V312 VanDerWaalsContact O-N 3.1Å; L309-I313 WeakPolarHBondContact O-CG1 3.29Å; L309-I313 PolarHBondContact O-N 3.29Å; L309-A342 HydrophobicContact CB-CB 4.45Å; L309-I345 HydrophobicContact CD1-CB 3.86Å; L309-I345 HydrophobicContact CD1-CD1 4.39Å; L309-I345 HydrophobicContact CD1-CG2 4.05Å; L309-I345 HydrophobicContact CD2-CD1 4.34Å; L309-P346 HydrophobicContact CD1-CG 3.69Å; L309-Y389 HydrophobicContact CD2-CD1 4.04Å; L309-Y389 HydrophobicContact CD2-CE1 3.68Å; L309-Y389 HydrophobicContact CD2-CE2 4.27Å; L309-Y389 HydrophobicContact CG-CD2 4.46Å; L309-Y389 HydrophobicContact CG-CE1 4.3Å; L309-Y389 HydrophobicContact CG-CE2 4Å
310W97.8Very high96.7Very high0 Ų012.9 Ų12.90%07%0.069CC..Hα-helixtrans-62.4-33.2173.2-81.2117.3000112.4P245 F248 L249 A306 S307 I313 L314 H339 A342 W343P245-W310 HydrophobicContact CB-CE3 4.04Å; F248-W310 HydrophobicContact CB-CD2 3.52Å; F248-W310 VanDerWaalsContact CB-CE2 3.42Å; F248-W310 HydrophobicContact CB-CE3 4.01Å; F248-W310 HydrophobicContact CB-CG 3.87Å; F248-W310 HydrophobicContact CB-CH2 4.33Å; F248-W310 HydrophobicContact CB-CZ2 3.86Å; F248-W310 HydrophobicContact CB-CZ3 4.39Å; F248-W310 HydrophobicContact CD1-CZ2 4.47Å; F248-W310 HydrophobicContact CD2-CD2 4.37Å; F248-W310 HydrophobicContact CD2-CE3 4.1Å; F248-W310 AromaticContact CD2-CH2 3.56Å; F248-W310 HydrophobicContact CD2-CH2 3.56Å; F248-W310 AromaticContact CD2-CZ2 3.85Å; F248-W310 HydrophobicContact CD2-CZ2 3.85Å; F248-W310 AromaticContact CD2-CZ3 3.69Å; F248-W310 HydrophobicContact CD2-CZ3 3.69Å; F248-W310 HydrophobicContact CE2-CH2 4.08Å; F248-W310 HydrophobicContact CE2-CZ3 4.41Å; F248-W310 HydrophobicContact CG-CD2 4.28Å; F248-W310 AromaticContact CG-CE2 3.93Å; F248-W310 HydrophobicContact CG-CE3 4.45Å; F248-W310 HydrophobicContact CG-CH2 4.04Å; F248-W310 AromaticContact CG-CZ2 3.82Å; F248-W310 HydrophobicContact CG-CZ2 3.82Å; F248-W310 HydrophobicContact CG-CZ3 4.34Å; L249-W310 HydrophobicContact CB-CB 4.07Å; A306-W310 PolarHBondContact O-N 3.07Å; S307-W310 PolarHBondContact O-N 2.88Å; W310-I313 HydrophobicContact CD2-CD1 4.32Å; W310-I313 HydrophobicContact CE3-CB 4.2Å; W310-I313 HydrophobicContact CE3-CD1 3.8Å; W310-I313 HydrophobicContact CE3-CG2 4.15Å; W310-I313 HydrophobicContact CZ3-CD1 3.93Å; W310-I313 HydrophobicContact CZ3-CG2 4.06Å; W310-I313 PolarHBondContact O-N 2.76Å; W310-L314 WeakPolarHBondContact O-CB 3.5Å; W310-L314 PolarHBondContact O-N 3.38Å; W310-H339 AromaticContact CH2-CE1 3.39Å; W310-H339 WeakPolarHBondContact CH2-CE1 3.44Å; W310-H339 AromaticContact CH2-CG 3.97Å; W310-H339 AromaticContact CH2-ND1 3.37Å; W310-H339 WeakPolarHBondContact CH2-ND1 3.45Å; W310-H339 AromaticContact CH2-NE2 3.98Å; W310-H339 AromaticContact CZ2-CE1 3.69Å; W310-H339 AromaticContact CZ2-ND1 3.44Å; W310-H339 WeakPolarHBondContact CZ2-ND1 3.32Å; W310-A342 HydrophobicContact CD2-CB 3.98Å; W310-A342 VanDerWaalsContact CE2-CB 3.48Å; W310-A342 HydrophobicContact CG-CB 4.39Å; W310-A342 HydrophobicContact CH2-CB 4.3Å; W310-A342 HydrophobicContact CZ2-CB 3.67Å; W310-W343 HydrophobicContact CZ2-CZ2 4.11Å; W310-W343 AromaticContact CZ2-NE1 3.97Å; W310-W343 AromaticContact NE1-CE2 3.84Å; W310-W343 AromaticContact NE1-CH2 3.56Å; W310-W343 AromaticContact NE1-CZ2 3.4Å
311W97.1Very high96.3Very high3 Ų313.5 Ų13.51%0.0117%0.074CC..Hα-helixtrans-66.3-43169.917580.7000112.2L249 S307 S308 L309 I313 L314 T315 Y389 L390 T394 I397 S432 Y435 T436L249-W311 HydrophobicContact CD1-CB 3.9Å; S307-W311 PolarHBondContact O-N 3.35Å; S308-W311 WeakPolarHBondContact O-CB 3.43Å; S308-W311 PolarHBondContact O-N 2.84Å; L309-W311 PolarHBondContact O-N 3.11Å; W311-I313 VanDerWaalsContact C-N 3.31Å; W311-I313 PolarHBondContact O-N 3.24Å; W311-L314 WeakPolarHBondContact O-CB 3.19Å; W311-L314 PolarHBondContact O-N 2.66Å; W311-L314 VanDerWaalsContact O-N 3.13Å; W311-T315 HydrophobicContact CD2-CG2 4.25Å; W311-T315 HydrophobicContact CH2-CG2 4.33Å; W311-T315 HydrophobicContact CZ2-CG2 3.78Å; W311-T315 WeakPolarHBondContact O-CG2 3.35Å; W311-T315 PolarHBondContact O-N 3.04Å; W311-Y389 WeakPolarHBondContact CZ3-O 3.4Å; W311-L390 HydrophobicContact CH2-CD1 3.81Å; W311-L390 HydrophobicContact CZ2-CD1 4.45Å; W311-L390 HydrophobicContact CZ3-CD1 4.22Å; W311-T394 HydrophobicContact CH2-CG2 4.3Å; W311-I397 HydrophobicContact CZ2-CD1 3.83Å; W311-S432 PolarHBondContact NE1-O 3.24Å; W311-Y435 HydrophobicContact CB-CD1 4.19Å; W311-Y435 HydrophobicContact CB-CD2 4.43Å; W311-Y435 HydrophobicContact CB-CE1 3.77Å; W311-Y435 HydrophobicContact CB-CE2 3.98Å; W311-Y435 AromaticContact CD1-CD1 3.19Å; W311-Y435 AromaticContact CD1-CD2 3.67Å; W311-Y435 AromaticContact CD1-CE1 3.71Å; W311-Y435 AromaticContact CD1-CG 3.2Å; W311-Y435 AromaticContact CD2-CD1 3.6Å; W311-Y435 HydrophobicContact CD2-CD1 3.6Å; W311-Y435 AromaticContact CD2-CE1 3.68Å; W311-Y435 HydrophobicContact CD2-CE1 3.68Å; W311-Y435 HydrophobicContact CD2-CG 4.4Å; W311-Y435 AromaticContact CE2-CD1 3.55Å; W311-Y435 HydrophobicContact CE3-CD1 4.49Å; W311-Y435 HydrophobicContact CE3-CE1 4.27Å; W311-Y435 AromaticContact CG-CD1 3.39Å; W311-Y435 HydrophobicContact CG-CD1 3.39Å; W311-Y435 HydrophobicContact CG-CD2 4.16Å; W311-Y435 AromaticContact CG-CE1 3.41Å; W311-Y435 HydrophobicContact CG-CE1 3.41Å; W311-Y435 VanDerWaalsContact CG-CE1 3.41Å; W311-Y435 HydrophobicContact CG-CE2 4.13Å; W311-Y435 AromaticContact CG-CG 3.82Å; W311-Y435 HydrophobicContact CG-CG 3.82Å; W311-Y435 AromaticContact CG-CZ 3.81Å; W311-Y435 HydrophobicContact CZ2-CD1 4.39Å; W311-Y435 AromaticContact NE1-CD1 3.27Å; W311-Y435 VanDerWaalsContact NE1-CD1 3.27Å; W311-Y435 AromaticContact NE1-CG 3.46Å; W311-T436 HydrophobicContact CH2-CG2 4.23Å; W311-T436 HydrophobicContact CZ2-CG2 3.57Å
312V97.8Very high95.6Very high17 Ų1713.5 Ų13.510%0.1037%0.074CC..Hα-helixtrans-58.7-44.9173.3175.90000110.8S308 L309 L314 T315 L316 Y389 I392 F396S308-V312 PolarHBondContact O-N 3.42Å; L309-V312 WeakPolarHBondContact O-CB 3.49Å; L309-V312 PolarHBondContact O-N 3.48Å; L309-V312 VanDerWaalsContact O-N 3.1Å; V312-L314 VanDerWaalsContact C-N 3.3Å; V312-L314 PolarHBondContact O-N 3.42Å; V312-T315 PolarHBondContact O-N 2.68Å; V312-T315 PolarHBondContact O-OG1 3.31Å; V312-L316 WeakPolarHBondContact O-CB 3.41Å; V312-L316 PolarHBondContact O-N 3.19Å; V312-Y389 HydrophobicContact CG2-CG 4.46Å; V312-Y389 WeakPolarHBondContact CG2-O 3.33Å; V312-I392 HydrophobicContact CG1-CG2 3.8Å; V312-F396 HydrophobicContact CG1-CE2 4.48Å
313I97.3Very high94.9Very high12 Ų1212.3 Ų12.36%0.0628%0.075CC..Hα-helixtrans-62.5-38176.5-67.2160000111.2P245 L309 W310 W311 L316 T317 F338 A342P245-I313 HydrophobicContact CB-CG2 4.4Å; P245-I313 HydrophobicContact CG-CG2 4.02Å; L309-I313 WeakPolarHBondContact O-CG1 3.29Å; L309-I313 PolarHBondContact O-N 3.29Å; W310-I313 HydrophobicContact CD2-CD1 4.32Å; W310-I313 HydrophobicContact CE3-CB 4.2Å; W310-I313 HydrophobicContact CE3-CD1 3.8Å; W310-I313 HydrophobicContact CE3-CG2 4.15Å; W310-I313 HydrophobicContact CZ3-CD1 3.93Å; W310-I313 HydrophobicContact CZ3-CG2 4.06Å; W310-I313 PolarHBondContact O-N 2.76Å; W311-I313 VanDerWaalsContact C-N 3.31Å; W311-I313 PolarHBondContact O-N 3.24Å; I313-L316 PolarHBondContact O-N 3.48Å; I313-T317 HydrophobicContact CG2-CG2 4.15Å; I313-T317 WeakPolarHBondContact O-CB 3.45Å; I313-T317 VanDerWaalsContact O-CG2 3.3Å; I313-T317 WeakPolarHBondContact O-CG2 3.34Å; I313-T317 PolarHBondContact O-N 2.78Å; I313-T317 PolarHBondContact O-OG1 3.31Å; I313-F338 HydrophobicContact CD1-CB 4.05Å; I313-F338 WeakPolarHBondContact CD1-O 3.48Å; I313-F338 HydrophobicContact CG1-CB 4.4Å; I313-F338 HydrophobicContact CG2-CB 3.96Å; I313-F338 HydrophobicContact CG2-CD1 4.37Å; I313-F338 HydrophobicContact CG2-CD2 4.26Å; I313-F338 HydrophobicContact CG2-CG 3.95Å; I313-A342 HydrophobicContact CD1-CB 3.75Å
314L95Very high94.3Very high0 Ų015 Ų150%09%0.09CC..Hα-helixtrans-59.6-48.4173.5179.363.3000111.1P245 I246 W310 W311 V312 L316 T317 W318 I428 F431P245-L314 HydrophobicContact CB-CB 3.99Å; P245-L314 HydrophobicContact CB-CD1 4.23Å; I246-L314 HydrophobicContact CD1-CD1 4.22Å; I246-L314 HydrophobicContact CD1-CD2 4.41Å; I246-L314 HydrophobicContact CG1-CD1 3.76Å; I246-L314 HydrophobicContact CG1-CD2 3.78Å; I246-L314 HydrophobicContact CG1-CG 4.42Å; W310-L314 WeakPolarHBondContact O-CB 3.5Å; W310-L314 PolarHBondContact O-N 3.38Å; W311-L314 WeakPolarHBondContact O-CB 3.19Å; W311-L314 PolarHBondContact O-N 2.66Å; W311-L314 VanDerWaalsContact O-N 3.13Å; V312-L314 VanDerWaalsContact C-N 3.3Å; V312-L314 PolarHBondContact O-N 3.42Å; L314-L316 PolarHBondContact O-N 3.23Å; L314-T317 PolarHBondContact O-N 3.29Å; L314-T317 PolarHBondContact O-OG1 3.21Å; L314-T317 VanDerWaalsContact O-OG1 3.11Å; L314-W318 WeakPolarHBondContact O-CB 3.45Å; L314-W318 PolarHBondContact O-N 3.05Å; L314-I428 HydrophobicContact CD1-CG2 3.99Å; L314-F431 HydrophobicContact CD2-CD1 3.86Å; L314-F431 HydrophobicContact CD2-CE1 3.92Å
315T95.8Very high93.8Very high0 Ų021.5 Ų21.50%011%0.114CC..Hα-helixtrans-65.2-38.4178.762.60000112.6W311 V312 F319 G393 I397W311-T315 HydrophobicContact CD2-CG2 4.25Å; W311-T315 HydrophobicContact CH2-CG2 4.33Å; W311-T315 HydrophobicContact CZ2-CG2 3.78Å; W311-T315 WeakPolarHBondContact O-CG2 3.35Å; W311-T315 PolarHBondContact O-N 3.04Å; V312-T315 PolarHBondContact O-N 2.68Å; V312-T315 PolarHBondContact O-OG1 3.31Å; T315-F319 WeakPolarHBondContact O-CB 3.33Å; T315-F319 PolarHBondContact O-N 3.49Å; T315-G393 VanDerWaalsContact OG1-CA 3.24Å; T315-G393 WeakPolarHBondContact OG1-CA 3.49Å; T315-I397 HydrophobicContact CG2-CD1 3.71Å; T315-I397 HydrophobicContact CG2-CG1 3.64Å
316L95.8Very high93.3Very high40 Ų4026 Ų2621%0.20913%0.131CC..Hα-helixtrans-63-53.8174.6171.362.2000111.1V312 I313 L314 W318 F319 L320 F338 F396V312-L316 WeakPolarHBondContact O-CB 3.41Å; V312-L316 PolarHBondContact O-N 3.19Å; I313-L316 PolarHBondContact O-N 3.48Å; L314-L316 PolarHBondContact O-N 3.23Å; L316-W318 VanDerWaalsContact C-N 3.25Å; L316-W318 PolarHBondContact O-N 2.6Å; L316-F319 CarbonylContact O-C 3.19Å; L316-F319 WeakPolarHBondContact O-CA 3.27Å; L316-F319 WeakPolarHBondContact O-CB 3.11Å; L316-F319 PolarHBondContact O-N 3.26Å; L316-L320 HydrophobicContact CD1-CD1 4.16Å; L316-L320 HydrophobicContact CD1-CD2 4.41Å; L316-L320 HydrophobicContact CD1-CG 4.07Å; L316-L320 HydrophobicContact CG-CD1 4.13Å; L316-L320 HydrophobicContact CG-CG 4.42Å; L316-L320 WeakPolarHBondContact O-CG 3.48Å; L316-L320 PolarHBondContact O-N 3.14Å; L316-F338 HydrophobicContact CD2-CE1 4.09Å; L316-F396 HydrophobicContact CB-CD2 3.98Å; L316-F396 HydrophobicContact CB-CE2 3.96Å; L316-F396 HydrophobicContact CB-CZ 4.46Å; L316-F396 HydrophobicContact CD1-CD1 4.28Å; L316-F396 HydrophobicContact CD1-CE1 3.79Å; L316-F396 HydrophobicContact CD1-CE2 4.05Å; L316-F396 HydrophobicContact CD1-CZ 3.68Å; L316-F396 HydrophobicContact CG-CE2 4.48Å
317T94.6Very high92.8Very high0 Ų028 Ų280%015%0.152CC..Hα-helixtrans-64.5-32.8-178.7540000112Y241 I313 L314 L320 A321 I331 F338Y241-T317 HydrophobicContact CD1-CG2 4.3Å; I313-T317 HydrophobicContact CG2-CG2 4.15Å; I313-T317 WeakPolarHBondContact O-CB 3.45Å; I313-T317 VanDerWaalsContact O-CG2 3.3Å; I313-T317 WeakPolarHBondContact O-CG2 3.34Å; I313-T317 PolarHBondContact O-N 2.78Å; I313-T317 PolarHBondContact O-OG1 3.31Å; L314-T317 PolarHBondContact O-N 3.29Å; L314-T317 PolarHBondContact O-OG1 3.21Å; L314-T317 VanDerWaalsContact O-OG1 3.11Å; T317-L320 PolarHBondContact O-N 3.43Å; T317-A321 WeakPolarHBondContact O-CB 3.43Å; T317-A321 PolarHBondContact O-N 3.25Å; T317-I331 HydrophobicContact CG2-CG2 3.68Å; T317-F338 HydrophobicContact CG2-CD2 4.43Å; T317-F338 HydrophobicContact CG2-CE2 3.91Å; T317-F338 HydrophobicContact CG2-CZ 4.15Å
318W93Very high92.4Very high2 Ų231.8 Ų31.81%0.00817%0.169CC..Hα-helixtrans-63.5-46.2169.3179.277.6000112.2L314 L316 A321 A322 I397 G400 L401 L404 M425 I428L314-W318 WeakPolarHBondContact O-CB 3.45Å; L314-W318 PolarHBondContact O-N 3.05Å; L316-W318 VanDerWaalsContact C-N 3.25Å; L316-W318 PolarHBondContact O-N 2.6Å; W318-A321 PolarHBondContact O-N 3.31Å; W318-A322 WeakPolarHBondContact O-CB 3.45Å; W318-A322 PolarHBondContact O-N 2.87Å; W318-I397 WeakPolarHBondContact CZ3-O 3.29Å; W318-G400 VanDerWaalsContact CH2-C 3.44Å; W318-L401 HydrophobicContact CH2-CB 4.47Å; W318-L401 HydrophobicContact CH2-CD2 3.89Å; W318-L401 HydrophobicContact CH2-CG 3.85Å; W318-L401 HydrophobicContact CZ2-CD2 4.34Å; W318-L404 HydrophobicContact CH2-CD1 3.99Å; W318-L404 HydrophobicContact CZ2-CD1 3.41Å; W318-L404 VanDerWaalsContact CZ2-CD1 3.41Å; W318-M425 PolarHBondContact NE1-O 3.37Å; W318-I428 HydrophobicContact CB-CG2 4Å; W318-I428 HydrophobicContact CG-CG2 3.9Å
319F93Very high92.1Very high41 Ų4137.8 Ų37.818%0.1820%0.195CC..Hα-helixtrans-61.9-42.3174.1165.8-106.6000112.5T315 L316 A321 A322 G323 L324 F396 A399T315-F319 WeakPolarHBondContact O-CB 3.33Å; T315-F319 PolarHBondContact O-N 3.49Å; L316-F319 CarbonylContact O-C 3.19Å; L316-F319 WeakPolarHBondContact O-CA 3.27Å; L316-F319 WeakPolarHBondContact O-CB 3.11Å; L316-F319 PolarHBondContact O-N 3.26Å; F319-A321 PolarHBondContact O-N 2.91Å; F319-A322 PolarHBondContact O-N 3.17Å; F319-G323 WeakPolarHBondContact O-CA 3.47Å; F319-G323 PolarHBondContact O-N 3.15Å; F319-L324 HydrophobicContact CE1-CD1 4.3Å; F319-L324 HydrophobicContact CE1-CG 4.3Å; F319-L324 HydrophobicContact CZ-CD2 4.4Å; F319-L324 HydrophobicContact CZ-CG 4.3Å; F319-F396 HydrophobicContact CB-CB 4.23Å; F319-F396 HydrophobicContact CB-CD1 4.41Å; F319-F396 HydrophobicContact CD1-CD1 4.01Å; F319-F396 HydrophobicContact CD1-CE1 4.44Å; F319-F396 HydrophobicContact CG-CD1 4.29Å; F319-A399 HydrophobicContact CD2-CB 3.79Å; F319-A399 HydrophobicContact CE2-CB 3.68Å; F319-A399 HydrophobicContact CZ-CB 4.46Å
320L92.5Very high91.9Very high17 Ų1739 Ų399%0.08921%0.207CC..Hα-helixtrans-62.6-43.9177.4-66.3175.5000111.3L316 T317 L324 K325 W326 I331L316-L320 HydrophobicContact CD1-CD1 4.16Å; L316-L320 HydrophobicContact CD1-CD2 4.41Å; L316-L320 HydrophobicContact CD1-CG 4.07Å; L316-L320 HydrophobicContact CG-CD1 4.13Å; L316-L320 HydrophobicContact CG-CG 4.42Å; L316-L320 WeakPolarHBondContact O-CG 3.48Å; L316-L320 PolarHBondContact O-N 3.14Å; T317-L320 PolarHBondContact O-N 3.43Å; L320-L324 HydrophobicContact CD2-CD1 3.61Å; L320-L324 HydrophobicContact CD2-CG 4.44Å; L320-L324 CarbonylContact O-C 3.55Å; L320-L324 WeakPolarHBondContact O-CA 3.37Å; L320-L324 WeakPolarHBondContact O-CB 3.28Å; L320-L324 PolarHBondContact O-N 3.26Å; L320-K325 PolarHBondContact O-N 2.98Å; L320-K325 VanDerWaalsContact O-N 3.14Å; L320-W326 HydrophobicContact CB-CB 4.35Å; L320-W326 HydrophobicContact CB-CD2 4.23Å; L320-W326 HydrophobicContact CB-CE3 4.3Å; L320-W326 HydrophobicContact CB-CG 4.28Å; L320-W326 HydrophobicContact CD1-CE3 4.02Å; L320-W326 HydrophobicContact CD1-CZ3 4.06Å; L320-W326 HydrophobicContact CD2-CD2 4.37Å; L320-W326 HydrophobicContact CD2-CE3 4.49Å; L320-W326 HydrophobicContact CD2-CZ2 4.45Å; L320-W326 PolarHBondContact O-N 3.04Å; L320-I331 HydrophobicContact CB-CD1 4.47Å
321A89.2Confident91.7Very high17 Ų1739 Ų3914%0.1421%0.207CC..Hα-helixtrans-65-40175.100000111.7P242 T317 W318 F319 K325 I331P242-A321 HydrophobicContact CG-CB 4.13Å; T317-A321 WeakPolarHBondContact O-CB 3.43Å; T317-A321 PolarHBondContact O-N 3.25Å; W318-A321 PolarHBondContact O-N 3.31Å; F319-A321 PolarHBondContact O-N 2.91Å; A321-K325 WeakPolarHBondContact O-CA 3.29Å; A321-K325 PolarHBondContact O-N 2.98Å; A321-I331 HydrophobicContact CB-CD1 4.19Å
322A85Confident91.5Very high0 Ų042.3 Ų42.30%022%0.223CC..Hα-helixtrans-88.8-46.9-171.100000116.4W318 F319 L404 I407 M425W318-A322 WeakPolarHBondContact O-CB 3.45Å; W318-A322 PolarHBondContact O-N 2.87Å; F319-A322 PolarHBondContact O-N 3.17Å; A322-L404 HydrophobicContact CB-CD1 4.23Å; A322-L404 HydrophobicContact CB-CD2 3.9Å; A322-L404 HydrophobicContact CB-CG 3.86Å; A322-I407 WeakPolarHBondContact O-CD1 3.3Å; A322-M425 HydrophobicContact CB-CE 3.28Å
323G83.3Confident91.3Very high20 Ų2048.8 Ų48.821%0.20625%0.253CS..THydrogen-bonded Turntrans-86.6-40.8179.500000113.4F319F319-G323 WeakPolarHBondContact O-CA 3.47Å; F319-G323 PolarHBondContact O-N 3.15Å
324L86.2Confident91.1Very high90 Ų9051.4 Ų51.447%0.47127%0.265SS..SBendtrans-98.4-1.3-176.5-54.1-172.7000113.5F319 L320 W326F319-L324 HydrophobicContact CE1-CD1 4.3Å; F319-L324 HydrophobicContact CE1-CG 4.3Å; F319-L324 HydrophobicContact CZ-CD2 4.4Å; F319-L324 HydrophobicContact CZ-CG 4.3Å; L320-L324 HydrophobicContact CD2-CD1 3.61Å; L320-L324 HydrophobicContact CD2-CG 4.44Å; L320-L324 CarbonylContact O-C 3.55Å; L320-L324 WeakPolarHBondContact O-CA 3.37Å; L320-L324 WeakPolarHBondContact O-CB 3.28Å; L320-L324 PolarHBondContact O-N 3.26Å; L324-W326 HydrophobicContact CB-CG 4.4Å; L324-W326 PolarHBondContact O-N 3.48Å
325K86.3Confident91.1Very high153 Ų15352.6 Ų52.667%0.66527%0.274SS*.  trans56.732.3179.6-55.6-179.5179.2-179.30113.4L320 A321 G327 I407L320-K325 PolarHBondContact O-N 2.98Å; L320-K325 VanDerWaalsContact O-N 3.14Å; A321-K325 WeakPolarHBondContact O-CA 3.29Å; A321-K325 PolarHBondContact O-N 2.98Å; K325-G327 PolarHBondContact O-N 3.37Å; K325-I407 HydrophobicContact CG-CD1 4.45Å
326W89.7Confident91.1Very high94 Ų9456.2 Ų56.236%0.35630%0.299SS..  trans-68.2132.7176.9-73.922.9000110.6L320 L324 A330 I331 H334L320-W326 HydrophobicContact CB-CB 4.35Å; L320-W326 HydrophobicContact CB-CD2 4.23Å; L320-W326 HydrophobicContact CB-CE3 4.3Å; L320-W326 HydrophobicContact CB-CG 4.28Å; L320-W326 HydrophobicContact CD1-CE3 4.02Å; L320-W326 HydrophobicContact CD1-CZ3 4.06Å; L320-W326 HydrophobicContact CD2-CD2 4.37Å; L320-W326 HydrophobicContact CD2-CE3 4.49Å; L320-W326 HydrophobicContact CD2-CZ2 4.45Å; L320-W326 PolarHBondContact O-N 3.04Å; L324-W326 HydrophobicContact CB-CG 4.4Å; L324-W326 PolarHBondContact O-N 3.48Å; W326-A330 HydrophobicContact CB-CB 4.44Å; W326-A330 HydrophobicContact CE3-CB 4.3Å; W326-I331 HydrophobicContact CB-CD1 4.24Å; W326-I331 HydrophobicContact CB-CG1 3.93Å; W326-I331 HydrophobicContact CE3-CG1 3.99Å; W326-H334 AromaticContact CZ3-ND1 3.96Å
327G87.8Confident91.1Very high43 Ų4362.2 Ų62.244%0.44332%0.32SS..  trans-73.6166.5169.900000112K325 E329 A330 I331K325-G327 PolarHBondContact O-N 3.37Å; G327-E329 VanDerWaalsContact C-N 3.28Å; G327-E329 PolarHBondContact O-N 3.48Å; G327-A330 PolarHBondContact O-N 2.82Å; G327-I331 PolarHBondContact O-N 3.21Å
328H88.6Confident91.3Very high88 Ų8863.2 Ų63.241%0.40732%0.324SS..Hα-helixtrans-60.3-37-179.367.684.3000112.7Y241 I331 E332Y241-H328 WeakPolarHBondContact O-CB 3.48Å; H328-I331 PolarHBondContact O-N 2.89Å; H328-E332 VanDerWaalsContact O-CB 3.27Å; H328-E332 WeakPolarHBondContact O-CB 3.42Å; H328-E332 PolarHBondContact O-N 3.2Å
329E91.3Very high91.4Very high142 Ų14265.2 Ų65.266%0.66433%0.334SS*.Hα-helixtrans-64.4-40.6179.4-58-176.816800112.2G327 I331 E332 M333G327-E329 VanDerWaalsContact C-N 3.28Å; G327-E329 PolarHBondContact O-N 3.48Å; E329-I331 PolarHBondContact O-N 3.22Å; E329-E332 PolarHBondContact O-N 2.85Å; E329-M333 PolarHBondContact O-N 3.23Å
330A92.3Very high91.6Very high40 Ų4068.5 Ų68.533%0.33135%0.352SS..Hα-helixtrans-66-39.1178.900000111.9W326 G327 H334W326-A330 HydrophobicContact CB-CB 4.44Å; W326-A330 HydrophobicContact CE3-CB 4.3Å; G327-A330 PolarHBondContact O-N 2.82Å; A330-H334 PolarHBondContact O-ND1 3.34Å
331I94.1Very high91.8Very high1 Ų169.4 Ų69.41%0.00536%0.362CS..Hα-helixtrans-70-42.8175.2-60.9172.7000110.2Y241 P242 T317 L320 A321 W326 G327 H328 E329 M333 H334 F338Y241-I331 HydrophobicContact CD1-CG2 3.7Å; Y241-I331 HydrophobicContact CE1-CG2 4.49Å; Y241-I331 HydrophobicContact CG-CB 4.49Å; Y241-I331 HydrophobicContact CG-CG2 3.79Å; P242-I331 HydrophobicContact CB-CD1 4.46Å; T317-I331 HydrophobicContact CG2-CG2 3.68Å; L320-I331 HydrophobicContact CB-CD1 4.47Å; A321-I331 HydrophobicContact CB-CD1 4.19Å; W326-I331 HydrophobicContact CB-CD1 4.24Å; W326-I331 HydrophobicContact CB-CG1 3.93Å; W326-I331 HydrophobicContact CE3-CG1 3.99Å; G327-I331 PolarHBondContact O-N 3.21Å; H328-I331 PolarHBondContact O-N 2.89Å; E329-I331 PolarHBondContact O-N 3.22Å; I331-M333 VanDerWaalsContact C-N 3.3Å; I331-M333 PolarHBondContact O-N 3.4Å; I331-H334 PolarHBondContact O-N 3.32Å; I331-H334 VanDerWaalsContact O-N 3.07Å; I331-F338 HydrophobicContact CG2-CE2 3.85Å; I331-F338 HydrophobicContact CG2-CZ 4.39Å
332E92.6Very high92.2Very high72 Ų7268.6 Ų68.634%0.33636%0.356SS..Hα-helixtrans-64.4-33.6-178.4-174.5158.1-151.600112.9Y241 R244 H328 E329 H334 S335Y241-E332 HydrophobicContact CD2-CB 3.86Å; Y241-E332 HydrophobicContact CD2-CG 4.12Å; Y241-E332 HydrophobicContact CE2-CB 4.38Å; Y241-E332 HydrophobicContact CE2-CG 4.27Å; R244-E332 IonicContact NH1-OE1 3.66Å; R244-E332 PolarHBondContact NH1-OE1 3.21Å; R244-E332 VanDerWaalsContact NH1-OE1 3.14Å; H328-E332 VanDerWaalsContact O-CB 3.27Å; H328-E332 WeakPolarHBondContact O-CB 3.42Å; H328-E332 PolarHBondContact O-N 3.2Å; E329-E332 PolarHBondContact O-N 2.85Å; E332-H334 PolarHBondContact O-N 2.87Å; E332-H334 VanDerWaalsContact O-N 3.11Å; E332-S335 WeakPolarHBondContact O-CB 3.49Å; E332-S335 PolarHBondContact O-N 3.43Å; E332-S335 PolarHBondContact O-OG 3.01Å
333M94.3Very high92.9Very high152 Ų15272 Ų7275%0.74937%0.368SS*.THydrogen-bonded Turntrans-55.5-27.7172.8-172.7-177.5-67.500113E329 I331E329-M333 PolarHBondContact O-N 3.23Å; I331-M333 VanDerWaalsContact C-N 3.3Å; I331-M333 PolarHBondContact O-N 3.4Å
334H93.9Very high93.5Very high67 Ų6773.1 Ų73.131%0.3138%0.376SS..THydrogen-bonded Turntrans-99.44.9-179.9-63.583.7000113.6W326 A330 I331 E332 S336 Y337 F338W326-H334 AromaticContact CZ3-ND1 3.96Å; A330-H334 PolarHBondContact O-ND1 3.34Å; I331-H334 PolarHBondContact O-N 3.32Å; I331-H334 VanDerWaalsContact O-N 3.07Å; E332-H334 PolarHBondContact O-N 2.87Å; E332-H334 VanDerWaalsContact O-N 3.11Å; H334-S336 VanDerWaalsContact C-N 3.25Å; H334-S336 PolarHBondContact O-N 3.21Å; H334-S336 VanDerWaalsContact O-N 3.16Å; H334-Y337 HydrophobicContact CB-CD2 4.43Å; H334-Y337 PolarHBondContact O-N 3.08Å; H334-Y337 VanDerWaalsContact O-N 3.08Å; H334-F338 HydrophobicContact CB-CE2 4.32Å; H334-F338 HydrophobicContact CB-CZ 3.99Å
335S93.8Very high94.1Very high25 Ų2572.1 Ų72.118%0.17537%0.37CS..Hα-helixtrans-57.6-33-173.359.70000114.4Y241 E332 Y337 F338 H339Y241-S335 WeakPolarHBondContact OH-CB 2.93Å; E332-S335 WeakPolarHBondContact O-CB 3.49Å; E332-S335 PolarHBondContact O-N 3.43Å; E332-S335 PolarHBondContact O-OG 3.01Å; S335-Y337 VanDerWaalsContact C-N 3.3Å; S335-Y337 PolarHBondContact O-N 3.27Å; S335-F338 WeakPolarHBondContact O-CB 3.27Å; S335-F338 PolarHBondContact O-N 2.89Å; S335-F338 VanDerWaalsContact O-N 3.17Å; S335-H339 PolarHBondContact O-CD2 3.38Å; S335-H339 PolarHBondContact O-N 2.78Å
336S95.9Very high94.7Very high77 Ų7764.8 Ų64.854%0.53834%0.339SS..Hα-helixtrans-57.5-40.7176.7-56.20000112.5H334 H339 I340H334-S336 VanDerWaalsContact C-N 3.25Å; H334-S336 PolarHBondContact O-N 3.21Å; H334-S336 VanDerWaalsContact O-N 3.16Å; S336-H339 PolarHBondContact O-N 3.1Å; S336-I340 VanDerWaalsContact O-CG1 3.28Å; S336-I340 WeakPolarHBondContact O-CG1 3.25Å; S336-I340 PolarHBondContact O-N 3.04Å
337Y96.8Very high95.1Very high165 Ų16561.8 Ų61.865%0.64733%0.334SS*.Hα-helixtrans-66.5-39.4177.9-65.1-67.2000112H334 S335 H339 I340 A341H334-Y337 HydrophobicContact CB-CD2 4.43Å; H334-Y337 PolarHBondContact O-N 3.08Å; H334-Y337 VanDerWaalsContact O-N 3.08Å; S335-Y337 VanDerWaalsContact C-N 3.3Å; S335-Y337 PolarHBondContact O-N 3.27Å; Y337-H339 VanDerWaalsContact C-N 3.35Å; Y337-H339 PolarHBondContact O-N 2.97Å; Y337-I340 PolarHBondContact O-N 3.25Å; Y337-A341 WeakPolarHBondContact O-CB 3.32Å; Y337-A341 PolarHBondContact O-N 3.33Å
338F96.9Very high95.6Very high21 Ų2164 Ų649%0.09234%0.338CS..Hα-helixtrans-61.6-45176.6-54.4-30000111.1Y241 I313 L316 T317 I331 H334 S335 A341 A342Y241-F338 HydrophobicContact CE1-CD2 4.08Å; Y241-F338 HydrophobicContact CE1-CE2 4.42Å; I313-F338 HydrophobicContact CD1-CB 4.05Å; I313-F338 WeakPolarHBondContact CD1-O 3.48Å; I313-F338 HydrophobicContact CG1-CB 4.4Å; I313-F338 HydrophobicContact CG2-CB 3.96Å; I313-F338 HydrophobicContact CG2-CD1 4.37Å; I313-F338 HydrophobicContact CG2-CD2 4.26Å; I313-F338 HydrophobicContact CG2-CG 3.95Å; L316-F338 HydrophobicContact CD2-CE1 4.09Å; T317-F338 HydrophobicContact CG2-CD2 4.43Å; T317-F338 HydrophobicContact CG2-CE2 3.91Å; T317-F338 HydrophobicContact CG2-CZ 4.15Å; I331-F338 HydrophobicContact CG2-CE2 3.85Å; I331-F338 HydrophobicContact CG2-CZ 4.39Å; H334-F338 HydrophobicContact CB-CE2 4.32Å; H334-F338 HydrophobicContact CB-CZ 3.99Å; S335-F338 WeakPolarHBondContact O-CB 3.27Å; S335-F338 PolarHBondContact O-N 2.89Å; S335-F338 VanDerWaalsContact O-N 3.17Å; F338-A341 PolarHBondContact O-N 3.44Å; F338-A342 VanDerWaalsContact O-CB 3.32Å; F338-A342 WeakPolarHBondContact O-CB 3.31Å; F338-A342 PolarHBondContact O-N 2.86Å
339H96.4Very high96Very high45 Ų4561 Ų6121%0.20832%0.324CS..Hα-helixtrans-64.6-44.3177.2-79.8-68.8000113F248 W310 S335 S336 Y337 A341 A342 W343F248-H339 AromaticContact CD2-CE1 3.98Å; F248-H339 AromaticContact CE1-CE1 3.84Å; F248-H339 AromaticContact CE2-CE1 3.38Å; F248-H339 WeakPolarHBondContact CE2-CE1 3.47Å; F248-H339 AromaticContact CE2-NE2 3.69Å; F248-H339 AromaticContact CZ-CE1 3.32Å; F248-H339 WeakPolarHBondContact CZ-CE1 3.44Å; F248-H339 AromaticContact CZ-NE2 3.77Å; W310-H339 AromaticContact CH2-CE1 3.39Å; W310-H339 WeakPolarHBondContact CH2-CE1 3.44Å; W310-H339 AromaticContact CH2-CG 3.97Å; W310-H339 AromaticContact CH2-ND1 3.37Å; W310-H339 WeakPolarHBondContact CH2-ND1 3.45Å; W310-H339 AromaticContact CH2-NE2 3.98Å; W310-H339 AromaticContact CZ2-CE1 3.69Å; W310-H339 AromaticContact CZ2-ND1 3.44Å; W310-H339 WeakPolarHBondContact CZ2-ND1 3.32Å; S335-H339 PolarHBondContact O-CD2 3.38Å; S335-H339 PolarHBondContact O-N 2.78Å; S336-H339 PolarHBondContact O-N 3.1Å; Y337-H339 VanDerWaalsContact C-N 3.35Å; Y337-H339 PolarHBondContact O-N 2.97Å; H339-A341 PolarHBondContact O-N 3.23Å; H339-A342 PolarHBondContact O-N 3.11Å; H339-W343 AromaticContact ND1-NE1 3.59Å; H339-W343 WeakPolarHBondContact O-CB 3.21Å; H339-W343 PolarHBondContact O-N 2.79Å; H339-W343 VanDerWaalsContact O-N 3.12Å
340I97.6Very high96.3Very high109 Ų10954.6 Ų54.656%0.55930%0.295SS*.Hα-helixtrans-60.3-47.8177.4-69.2165.4000109.9S336 Y337 A344S336-I340 VanDerWaalsContact O-CG1 3.28Å; S336-I340 WeakPolarHBondContact O-CG1 3.25Å; S336-I340 PolarHBondContact O-N 3.04Å; Y337-I340 PolarHBondContact O-N 3.25Å; I340-A344 HydrophobicContact CG2-CB 4.41Å; I340-A344 WeakPolarHBondContact O-CB 3.22Å; I340-A344 PolarHBondContact O-N 2.95Å
341A96.8Very high96.5Very high37 Ų3757.3 Ų57.331%0.30630%0.302SS..Hα-helixtrans-61.8-47.9178.900000112.3Y337 F338 H339 W343 I345Y337-A341 WeakPolarHBondContact O-CB 3.32Å; Y337-A341 PolarHBondContact O-N 3.33Å; F338-A341 PolarHBondContact O-N 3.44Å; H339-A341 PolarHBondContact O-N 3.23Å; A341-W343 VanDerWaalsContact C-N 3.3Å; A341-W343 PolarHBondContact O-N 3Å; A341-I345 HydrophobicContact CB-CD1 4.35Å; A341-I345 WeakPolarHBondContact O-CB 3.45Å; A341-I345 WeakPolarHBondContact O-CD1 3.37Å; A341-I345 VanDerWaalsContact O-CG1 3.31Å; A341-I345 WeakPolarHBondContact O-CG1 2.97Å; A341-I345 PolarHBondContact O-N 3.37Å
342A97.3Very high96.7Very high0 Ų059.4 Ų59.40%032%0.315CS..Hα-helixtrans-65.4-29.9-17600000113.9L309 W310 I313 F338 H339 P346L309-A342 HydrophobicContact CB-CB 4.45Å; W310-A342 HydrophobicContact CD2-CB 3.98Å; W310-A342 VanDerWaalsContact CE2-CB 3.48Å; W310-A342 HydrophobicContact CG-CB 4.39Å; W310-A342 HydrophobicContact CH2-CB 4.3Å; W310-A342 HydrophobicContact CZ2-CB 3.67Å; I313-A342 HydrophobicContact CD1-CB 3.75Å; F338-A342 VanDerWaalsContact O-CB 3.32Å; F338-A342 WeakPolarHBondContact O-CB 3.31Å; F338-A342 PolarHBondContact O-N 2.86Å; H339-A342 PolarHBondContact O-N 3.11Å; A342-P346 WeakPolarHBondContact O-CD 3.36Å; A342-P346 VanDerWaalsContact O-CG 3.23Å; A342-P346 WeakPolarHBondContact O-CG 3.39Å
343W98.1Very high96.8Very high70 Ų7056 Ų5627%0.26530%0.299SS..Hα-helixtrans-103.2-40.2-176.4-59.8130.4000113.8C252 F302 A306 W310 H339 A341 P346 A347C252-W343 VanDerWaalsContact SG-CH2 3.52Å; F302-W343 AromaticContact CE1-CE3 3.9Å; F302-W343 HydrophobicContact CE1-CE3 3.9Å; F302-W343 AromaticContact CE1-CZ3 3.98Å; F302-W343 HydrophobicContact CE1-CZ3 3.98Å; F302-W343 AromaticContact CZ-CE3 3.86Å; F302-W343 HydrophobicContact CZ-CE3 3.86Å; F302-W343 HydrophobicContact CZ-CZ3 4.41Å; A306-W343 HydrophobicContact CB-CE3 3.9Å; A306-W343 HydrophobicContact CB-CZ3 3.56Å; W310-W343 HydrophobicContact CZ2-CZ2 4.11Å; W310-W343 AromaticContact CZ2-NE1 3.97Å; W310-W343 AromaticContact NE1-CE2 3.84Å; W310-W343 AromaticContact NE1-CH2 3.56Å; W310-W343 AromaticContact NE1-CZ2 3.4Å; H339-W343 AromaticContact ND1-NE1 3.59Å; H339-W343 WeakPolarHBondContact O-CB 3.21Å; H339-W343 PolarHBondContact O-N 2.79Å; H339-W343 VanDerWaalsContact O-N 3.12Å; A341-W343 VanDerWaalsContact C-N 3.3Å; A341-W343 PolarHBondContact O-N 3Å; W343-P346 WeakPolarHBondContact O-CD 3.31Å; W343-A347 VanDerWaalsContact O-CB 3.25Å; W343-A347 WeakPolarHBondContact O-CB 3.47Å; W343-A347 PolarHBondContact O-N 3.18Å; W343-A347 VanDerWaalsContact O-N 3.12Å
344A97.9Very high96.8Very high44 Ų4450.7 Ų50.736%0.36427%0.274SS..Hα-helixtrans-70.2-39.4-177.700000111.8I340 A347 V348I340-A344 HydrophobicContact CG2-CB 4.41Å; I340-A344 WeakPolarHBondContact O-CB 3.22Å; I340-A344 PolarHBondContact O-N 2.95Å; A344-A347 PolarHBondContact O-N 2.82Å; A344-V348 WeakPolarHBondContact O-CB 3.4Å; A344-V348 VanDerWaalsContact O-CG2 3.31Å; A344-V348 WeakPolarHBondContact O-CG2 3.41Å; A344-V348 PolarHBondContact O-N 2.85Å
345I97.9Very high96.8Very high69 Ų6953.7 Ų53.735%0.35429%0.291SS..Hα-helixtrans-62.9-51-178.7-62.7170.3000111.1L309 A341 A347 V348 K349 Y389L309-I345 HydrophobicContact CD1-CB 3.86Å; L309-I345 HydrophobicContact CD1-CD1 4.39Å; L309-I345 HydrophobicContact CD1-CG2 4.05Å; L309-I345 HydrophobicContact CD2-CD1 4.34Å; A341-I345 HydrophobicContact CB-CD1 4.35Å; A341-I345 WeakPolarHBondContact O-CB 3.45Å; A341-I345 WeakPolarHBondContact O-CD1 3.37Å; A341-I345 VanDerWaalsContact O-CG1 3.31Å; A341-I345 WeakPolarHBondContact O-CG1 2.97Å; A341-I345 PolarHBondContact O-N 3.37Å; I345-A347 VanDerWaalsContact C-N 3.33Å; I345-A347 PolarHBondContact O-N 2.02Å; I345-V348 PolarHBondContact O-N 3.34Å; I345-K349 HydrophobicContact CG2-CD 4.22Å; I345-K349 WeakPolarHBondContact O-CG 3.18Å; I345-K349 PolarHBondContact O-N 2.78Å; I345-K349 VanDerWaalsContact O-N 3.09Å; I345-Y389 WeakPolarHBondContact CG2-OH 3.09Å
346P98.2Very high96.8Very high0 Ų057.8 Ų57.80%031%0.309CS..Hα-helixtrans-62.1-37.8173.9-2638.3000113.2F302 M305 A306 L309 A342 W343 K349 T350F302-P346 HydrophobicContact CD2-CB 3.84Å; F302-P346 HydrophobicContact CE2-CB 3.99Å; F302-P346 HydrophobicContact CG-CB 4.45Å; M305-P346 HydrophobicContact CB-CB 3.91Å; M305-P346 HydrophobicContact CB-CG 3.94Å; A306-P346 HydrophobicContact CB-CG 4.03Å; L309-P346 HydrophobicContact CD1-CG 3.69Å; A342-P346 WeakPolarHBondContact O-CD 3.36Å; A342-P346 VanDerWaalsContact O-CG 3.23Å; A342-P346 WeakPolarHBondContact O-CG 3.39Å; W343-P346 WeakPolarHBondContact O-CD 3.31Å; P346-K349 PolarHBondContact O-N 3.1Å; P346-T350 VanDerWaalsContact O-CB 3.31Å; P346-T350 WeakPolarHBondContact O-CB 3.2Å; P346-T350 PolarHBondContact O-N 2.87Å; P346-T350 PolarHBondContact O-OG1 3.25Å
347A98.2Very high96.6Very high31 Ų3161 Ų6126%0.25631%0.309SS..Hα-helixtrans-60.1-51.817800000111.4F302 W343 A344 I345 K349 T350 I351F302-A347 HydrophobicContact CE2-CB 3.96Å; W343-A347 VanDerWaalsContact O-CB 3.25Å; W343-A347 WeakPolarHBondContact O-CB 3.47Å; W343-A347 PolarHBondContact O-N 3.18Å; W343-A347 VanDerWaalsContact O-N 3.12Å; A344-A347 PolarHBondContact O-N 2.82Å; I345-A347 VanDerWaalsContact C-N 3.33Å; I345-A347 PolarHBondContact O-N 2.02Å; A347-K349 PolarHBondContact O-N 3.44Å; A347-T350 WeakPolarHBondContact O-CB 3.41Å; A347-T350 PolarHBondContact O-N 2.67Å; A347-I351 VanDerWaalsContact O-CG1 3.28Å; A347-I351 WeakPolarHBondContact O-CG1 3.22Å; A347-I351 PolarHBondContact O-N 3.48Å
348V98.3Very high96.4Very high88 Ų8854.3 Ų54.353%0.53328%0.284SS..Hα-helixtrans-59.6-46.6178.8171.40000110.5A344 I345 T350 I351 V352A344-V348 WeakPolarHBondContact O-CB 3.4Å; A344-V348 VanDerWaalsContact O-CG2 3.31Å; A344-V348 WeakPolarHBondContact O-CG2 3.41Å; A344-V348 PolarHBondContact O-N 2.85Å; I345-V348 PolarHBondContact O-N 3.34Å; V348-T350 VanDerWaalsContact C-N 3.32Å; V348-T350 PolarHBondContact O-N 2.95Å; V348-I351 PolarHBondContact O-N 3.4Å; V348-V352 HydrophobicContact CG1-CG2 4.46Å; V348-V352 VanDerWaalsContact O-CG2 3.32Å; V348-V352 WeakPolarHBondContact O-CG2 3.32Å; V348-V352 PolarHBondContact O-N 3.5Å
349K97.5Very high96.3Very high27 Ų2753.4 Ų53.412%0.11728%0.28CS..Hα-helixtrans-59.6-43.2177-69.5177.977-153.10112.1Y301 M305 I345 P346 A347 V352 I353 F381 P385Y301-K349 HydrophobicContact CE1-CB 3.94Å; Y301-K349 WeakPolarHBondContact OH-CE 3.47Å; Y301-K349 PolarHBondContact OH-NZ 3.11Å; M305-K349 PolarHBondContact SD-NZ 3.39Å; I345-K349 HydrophobicContact CG2-CD 4.22Å; I345-K349 WeakPolarHBondContact O-CG 3.18Å; I345-K349 PolarHBondContact O-N 2.78Å; I345-K349 VanDerWaalsContact O-N 3.09Å; P346-K349 PolarHBondContact O-N 3.1Å; A347-K349 PolarHBondContact O-N 3.44Å; K349-V352 PolarHBondContact O-N 2.65Å; K349-I353 WeakPolarHBondContact O-CD1 3.4Å; K349-I353 WeakPolarHBondContact O-CG1 3.4Å; K349-I353 PolarHBondContact O-N 3.2Å; K349-F381 WeakPolarHBondContact CE-O 3.4Å; K349-F381 PolarHBondContact NZ-O 3Å; K349-P385 VanDerWaalsContact NZ-CG 3.25Å
350T97.5Very high96.2Very high7 Ų751.5 Ų51.54%0.04327%0.272CS..Hα-helixtrans-62.7-44.9178.5-55.70000111.3F297 L298 Y301 P346 A347 V348 I353 L354F297-T350 HydrophobicContact CE1-CG2 3.91Å; F297-T350 HydrophobicContact CZ-CG2 4.23Å; L298-T350 HydrophobicContact CD2-CG2 3.45Å; L298-T350 VanDerWaalsContact CD2-CG2 3.45Å; Y301-T350 WeakPolarHBondContact CD1-OG1 3.4Å; P346-T350 VanDerWaalsContact O-CB 3.31Å; P346-T350 WeakPolarHBondContact O-CB 3.2Å; P346-T350 PolarHBondContact O-N 2.87Å; P346-T350 PolarHBondContact O-OG1 3.25Å; A347-T350 WeakPolarHBondContact O-CB 3.41Å; A347-T350 PolarHBondContact O-N 2.67Å; V348-T350 VanDerWaalsContact C-N 3.32Å; V348-T350 PolarHBondContact O-N 2.95Å; T350-I353 PolarHBondContact O-N 3.33Å; T350-L354 HydrophobicContact CG2-CD1 4.24Å; T350-L354 WeakPolarHBondContact O-CG 3.3Å; T350-L354 PolarHBondContact O-N 3.49Å
351I97.2Very high96Very high96 Ų9646.3 Ų46.349%0.49225%0.245SC..Hα-helixtrans-60.6-46.7177.1-69164000110.4A347 V348 I353 L354 I355A347-I351 VanDerWaalsContact O-CG1 3.28Å; A347-I351 WeakPolarHBondContact O-CG1 3.22Å; A347-I351 PolarHBondContact O-N 3.48Å; V348-I351 PolarHBondContact O-N 3.4Å; I351-I353 PolarHBondContact O-N 3.31Å; I351-L354 PolarHBondContact O-N 2.9Å; I351-I355 HydrophobicContact CG2-CD1 3.65Å; I351-I355 HydrophobicContact CG2-CG1 4.38Å; I351-I355 VanDerWaalsContact O-CG1 3.29Å; I351-I355 WeakPolarHBondContact O-CG1 3.05Å; I351-I355 PolarHBondContact O-N 3.27Å
352V96.8Very high95.9Very high46 Ų4645.1 Ų45.128%0.27923%0.234SC..Hα-helixtrans-59.7-46.1178.1171.90000111.2V348 K349 L354 I355 M356 F381V348-V352 HydrophobicContact CG1-CG2 4.46Å; V348-V352 VanDerWaalsContact O-CG2 3.32Å; V348-V352 WeakPolarHBondContact O-CG2 3.32Å; V348-V352 PolarHBondContact O-N 3.5Å; K349-V352 PolarHBondContact O-N 2.65Å; V352-L354 PolarHBondContact O-N 2.86Å; V352-I355 PolarHBondContact O-N 3.26Å; V352-M356 HydrophobicContact CG1-CE 3.75Å; V352-M356 HydrophobicContact CG1-CG 4.32Å; V352-M356 HydrophobicContact CG1-SD 3.74Å; V352-M356 WeakPolarHBondContact O-CB 3.5Å; V352-M356 VanDerWaalsContact O-CG 3.31Å; V352-M356 WeakPolarHBondContact O-CG 3.34Å; V352-M356 PolarHBondContact O-N 3.5Å; V352-F381 HydrophobicContact CB-CE1 4.42Å; V352-F381 HydrophobicContact CG1-CE1 3.78Å; V352-F381 HydrophobicContact CG1-CZ 3.78Å
353I96.1Very high95.6Very high0 Ų045.6 Ų45.60%024%0.236CC..Hα-helixtrans-60.5-43.4178.1-73.3159.6000112F297 Y301 K349 T350 I351 M356 R357 L358 V359 V370 F381F297-I353 HydrophobicContact CE1-CG2 4.27Å; F297-I353 HydrophobicContact CE2-CG2 3.8Å; F297-I353 HydrophobicContact CZ-CB 4.03Å; F297-I353 HydrophobicContact CZ-CD1 4.28Å; F297-I353 HydrophobicContact CZ-CG2 3.41Å; F297-I353 VanDerWaalsContact CZ-CG2 3.41Å; Y301-I353 HydrophobicContact CD1-CD1 4.03Å; Y301-I353 HydrophobicContact CD2-CD1 4.21Å; Y301-I353 HydrophobicContact CE1-CD1 3.41Å; Y301-I353 VanDerWaalsContact CE1-CD1 3.41Å; Y301-I353 HydrophobicContact CE2-CD1 3.62Å; Y301-I353 HydrophobicContact CG-CD1 4.4Å; Y301-I353 WeakPolarHBondContact OH-CD1 3.32Å; K349-I353 WeakPolarHBondContact O-CD1 3.4Å; K349-I353 WeakPolarHBondContact O-CG1 3.4Å; K349-I353 PolarHBondContact O-N 3.2Å; T350-I353 PolarHBondContact O-N 3.33Å; I351-I353 PolarHBondContact O-N 3.31Å; I353-M356 CarbonylContact O-C 3.59Å; I353-M356 PolarHBondContact O-N 2.7Å; I353-R357 PolarHBondContact O-N 2.96Å; I353-L358 HydrophobicContact CG2-CB 4.26Å; I353-L358 PolarHBondContact O-N 3.09Å; I353-L358 VanDerWaalsContact O-N 3.14Å; I353-V359 HydrophobicContact CG2-CG2 3.57Å; I353-V370 HydrophobicContact CD1-CB 4.32Å; I353-V370 HydrophobicContact CD1-CG1 4.22Å; I353-V370 HydrophobicContact CD1-CG2 4.22Å; I353-V370 HydrophobicContact CG1-CG2 4.19Å; I353-V370 HydrophobicContact CG2-CB 4.23Å; I353-V370 HydrophobicContact CG2-CG2 4.14Å; I353-F381 HydrophobicContact CD1-CB 3.98Å; I353-F381 HydrophobicContact CD1-CD1 3.92Å; I353-F381 HydrophobicContact CD1-CG 4Å; I353-F381 HydrophobicContact CG1-CB 4.3Å; I353-F381 HydrophobicContact CG1-CD1 3.7Å; I353-F381 HydrophobicContact CG1-CD2 4.23Å; I353-F381 HydrophobicContact CG1-CE1 4.04Å; I353-F381 HydrophobicContact CG1-CG 3.81Å; I353-F381 HydrophobicContact CG1-CZ 4.44Å
354L94.4Very high95.5Very high41 Ų4142.2 Ų42.222%0.21522%0.223CC..Hα-helixtrans-65.7-42.5178.6-71.9172.6000111.7L288 F297 L298 T350 I351 V352 M356 R357 V359L288-L354 WeakPolarHBondContact CD1-O 3.45Å; L288-L354 HydrophobicContact CD2-CD2 4.44Å; F297-L354 HydrophobicContact CD1-CD2 4.03Å; F297-L354 HydrophobicContact CE1-CD2 3.73Å; F297-L354 HydrophobicContact CE1-CG 3.93Å; L298-L354 HydrophobicContact CD2-CD1 4.16Å; T350-L354 HydrophobicContact CG2-CD1 4.24Å; T350-L354 WeakPolarHBondContact O-CG 3.3Å; T350-L354 PolarHBondContact O-N 3.49Å; I351-L354 PolarHBondContact O-N 2.9Å; V352-L354 PolarHBondContact O-N 2.86Å; L354-M356 VanDerWaalsContact C-N 3.33Å; L354-R357 PolarHBondContact O-N 3Å; L354-R357 VanDerWaalsContact O-N 3.17Å; L354-V359 HydrophobicContact CD2-CG2 4.2Å
355I94.3Very high95.4Very high130 Ų13040.2 Ų40.267%0.66721%0.206SC*.Hα-helixtrans-63.2-42.2176.5-69.7170.1000110.7I351 V352 R357I351-I355 HydrophobicContact CG2-CD1 3.65Å; I351-I355 HydrophobicContact CG2-CG1 4.38Å; I351-I355 VanDerWaalsContact O-CG1 3.29Å; I351-I355 WeakPolarHBondContact O-CG1 3.05Å; I351-I355 PolarHBondContact O-N 3.27Å; V352-I355 PolarHBondContact O-N 3.26Å; I355-R357 PolarHBondContact O-N 3.06Å
356M92.6Very high95.2Very high111 Ų11136.9 Ų36.955%0.54719%0.19SC..THydrogen-bonded Turntrans-77.5-3178.1-66.8-177.1174.200113.6V352 I353 L354 L358 F381V352-M356 HydrophobicContact CG1-CE 3.75Å; V352-M356 HydrophobicContact CG1-CG 4.32Å; V352-M356 HydrophobicContact CG1-SD 3.74Å; V352-M356 WeakPolarHBondContact O-CB 3.5Å; V352-M356 VanDerWaalsContact O-CG 3.31Å; V352-M356 WeakPolarHBondContact O-CG 3.34Å; V352-M356 PolarHBondContact O-N 3.5Å; I353-M356 CarbonylContact O-C 3.59Å; I353-M356 PolarHBondContact O-N 2.7Å; L354-M356 VanDerWaalsContact C-N 3.33Å; M356-L358 VanDerWaalsContact C-N 3.25Å; M356-L358 HydrophobicContact CB-CD1 3.75Å; M356-L358 HydrophobicContact CB-CD2 4.37Å; M356-L358 HydrophobicContact CB-CG 3.65Å; M356-L358 PolarHBondContact O-N 2.96Å; M356-L358 HydrophobicContact SD-CD1 4.09Å; M356-F381 HydrophobicContact SD-CE2 4.37Å; M356-F381 HydrophobicContact SD-CZ 3.97Å
357R91.8Very high95.1Very high144 Ų14437.1 Ų37.154%0.54319%0.191SC..THydrogen-bonded Turntrans53.836.5-179.4-52.1-167.9-179.9-1783.7114.3E286 L288 I353 L354 I355 V359E286-R357 VanDerWaalsContact OE2-CD 3.23Å; E286-R357 WeakPolarHBondContact OE2-CD 3.49Å; E286-R357 IonicContact OE2-CZ 3.88Å; E286-R357 IonicContact OE2-NE 3.87Å; E286-R357 IonicContact OE2-NH1 3.52Å; E286-R357 PolarHBondContact OE2-NH1 3.17Å; L288-R357 HydrophobicContact CD1-CG 4.35Å; I353-R357 PolarHBondContact O-N 2.96Å; L354-R357 PolarHBondContact O-N 3Å; L354-R357 VanDerWaalsContact O-N 3.17Å; I355-R357 PolarHBondContact O-N 3.06Å; R357-V359 PolarHBondContact O-N 3.35Å
358L93.4Very high95Very high24 Ų2435.6 Ų35.613%0.12618%0.178CC..  trans-87.921.8-176.5-54.7173.2000113.4I353 M356 V370 G371 A377 F381I353-L358 HydrophobicContact CG2-CB 4.26Å; I353-L358 PolarHBondContact O-N 3.09Å; I353-L358 VanDerWaalsContact O-N 3.14Å; M356-L358 VanDerWaalsContact C-N 3.25Å; M356-L358 HydrophobicContact CB-CD1 3.75Å; M356-L358 HydrophobicContact CB-CD2 4.37Å; M356-L358 HydrophobicContact CB-CG 3.65Å; M356-L358 PolarHBondContact O-N 2.96Å; M356-L358 HydrophobicContact SD-CD1 4.09Å; L358-V370 HydrophobicContact CB-CG2 4.03Å; L358-V370 WeakPolarHBondContact O-CA 3.35Å; L358-V370 WeakPolarHBondContact O-CG2 3.25Å; L358-G371 PolarHBondContact O-N 3.41Å; L358-A377 HydrophobicContact CB-CB 4.21Å; L358-A377 HydrophobicContact CD1-CB 4Å; L358-A377 HydrophobicContact CD2-CB 4.34Å; L358-A377 HydrophobicContact CG-CB 4.42Å; L358-F381 HydrophobicContact CD1-CD2 3.93Å; L358-F381 HydrophobicContact CD1-CE2 3.42Å; L358-F381 VanDerWaalsContact CD1-CE2 3.42Å; L358-F381 HydrophobicContact CD1-CZ 4.25Å
359V95.1Very high94.9Very high2 Ų232.1 Ų32.11%0.01216%0.156CC..EExtended strand (participates in β ladder)trans-101.9125.5-177.7-177.90000109.1E286 G287 F297 I353 L354 R357 C368E286-V359 CarbonylContact C-O 3.39Å; G287-V359 PolarHBondContact N-O 2.98Å; F297-V359 HydrophobicContact CB-CG1 3.64Å; F297-V359 HydrophobicContact CD1-CG1 4.24Å; F297-V359 HydrophobicContact CD1-CG2 3.74Å; F297-V359 HydrophobicContact CD2-CB 4.47Å; F297-V359 HydrophobicContact CD2-CG1 3.91Å; F297-V359 HydrophobicContact CD2-CG2 3.78Å; F297-V359 HydrophobicContact CE1-CG2 3.75Å; F297-V359 HydrophobicContact CE2-CG2 3.78Å; F297-V359 HydrophobicContact CG-CB 4.38Å; F297-V359 HydrophobicContact CG-CG1 3.64Å; F297-V359 HydrophobicContact CG-CG2 3.76Å; F297-V359 HydrophobicContact CZ-CG2 3.77Å; I353-V359 HydrophobicContact CG2-CG2 3.57Å; L354-V359 HydrophobicContact CD2-CG2 4.2Å; R357-V359 PolarHBondContact O-N 3.35Å; V359-C368 HydrophobicContact CG1-CB 4.29Å
360D93.2Very high94.8Very high5 Ų530.9 Ų30.93%0.02715%0.15CC..EExtended strand (participates in β ladder)trans-145.1154.7-175.461.4-62.3000111.7C368 Y369 G371 N372 Q373D360-C368 WeakPolarHBondContact O-CA 3.24Å; D360-Y369 PolarHBondContact N-O 3.31Å; D360-Y369 PolarHBondContact O-N 2.92Å; D360-Y369 VanDerWaalsContact O-O 3.06Å; D360-G371 PolarHBondContact OD1-N 3.46Å; D360-N372 PolarHBondContact O-ND2 2.94Å; D360-N372 PolarHBondContact OD1-N 2.91Å; D360-N372 VanDerWaalsContact OD1-N 3.11Å; D360-N372 VanDerWaalsContact OD2-C 3.27Å; D360-N372 VanDerWaalsContact OD2-CA 3.26Å; D360-N372 WeakPolarHBondContact OD2-CA 3.29Å; D360-N372 WeakPolarHBondContact OD2-CB 3.34Å; D360-N372 PolarHBondContact OD2-N 2.87Å; D360-N372 VanDerWaalsContact OD2-N 3.08Å; D360-Q373 WeakPolarHBondContact OD2-CB 3.21Å; D360-Q373 VanDerWaalsContact OD2-CG 3.3Å; D360-Q373 WeakPolarHBondContact OD2-CG 3.15Å; D360-Q373 PolarHBondContact OD2-N 2.64Å
361A94Very high94.2Very high0 Ų030.5 Ų30.50%015%0.148CC..EExtended strand (participates in β ladder)trans-88.5150.3-178.600000112.1L283 V284 L367L283-A361 HydrophobicContact CD1-CB 3.64Å; L283-A361 WeakPolarHBondContact CD2-O 3.5Å; L283-A361 HydrophobicContact CG-CB 3.97Å; V284-A361 HydrophobicContact CB-CB 4.11Å; V284-A361 PolarHBondContact O-N 2.71Å; A361-L367 WeakPolarHBondContact CA-O 3.48Å
362D93.6Very high93.8Very high13 Ų1327.4 Ų27.47%0.0713%0.133CC..  trans-102.5132.4172.5169.177.5000110.8L364 T365 G366 L367 N372 Y464D362-L364 PolarHBondContact OD2-N 3.49Å; D362-T365 WeakPolarHBondContact OD2-CB 3.42Å; D362-T365 WeakPolarHBondContact OD2-CG2 3.32Å; D362-T365 PolarHBondContact OD2-N 2.81Å; D362-T365 PolarHBondContact OD2-OG1 3.43Å; D362-G366 WeakPolarHBondContact O-CA 3.34Å; D362-G366 PolarHBondContact O-N 2.73Å; D362-L367 PolarHBondContact N-O 3.32Å; D362-N372 HydrophobicContact CB-CB 4.39Å; D362-Y464 PolarHBondContact OD1-OH 3.29Å
363D92.4Very high93.2Very high9 Ų928.1 Ų28.15%0.04813%0.133CC..THydrogen-bonded Turntrans-67.4-36.8-176.4178.860.6000112.8L193 L201 Y202 K207 R268 L283L193-D363 HydrophobicContact CD2-CB 3.85Å; L201-D363 PolarHBondContact N-OD2 3.19Å; Y202-D363 PolarHBondContact N-OD2 3.32Å; K207-D363 VanDerWaalsContact CE-O 3.3Å; K207-D363 WeakPolarHBondContact CE-O 3.44Å; K207-D363 WeakPolarHBondContact CE-OD1 3.25Å; K207-D363 WeakPolarHBondContact CE-OD2 3.48Å; K207-D363 VanDerWaalsContact NZ-CG 3.29Å; K207-D363 IonicContact NZ-OD1 3.17Å; K207-D363 PolarHBondContact NZ-OD1 3.02Å; K207-D363 IonicContact NZ-OD2 3.69Å; K207-D363 PolarHBondContact NZ-OD2 2.89Å; K207-D363 VanDerWaalsContact NZ-OD2 3.16Å; R268-D363 PolarHBondContact NH1-O 2.8Å; L283-D363 HydrophobicContact CD2-CB 4.42Å
364L94.3Very high92.9Very high0 Ų032.6 Ų32.60%015%0.154CC..THydrogen-bonded Turntrans-69.5-52.9-176.6177.963.4000111.1Y202 A206 T210 R268 D362 Y464 V465 E468 M469Y202-L364 HydrophobicContact CD1-CD1 3.99Å; Y202-L364 HydrophobicContact CD2-CB 3.78Å; Y202-L364 HydrophobicContact CD2-CD1 4.23Å; Y202-L364 HydrophobicContact CE2-CB 3.94Å; Y202-L364 HydrophobicContact CG-CB 4.28Å; Y202-L364 HydrophobicContact CG-CD1 3.84Å; A206-L364 HydrophobicContact CB-CD1 4.3Å; T210-L364 HydrophobicContact CG2-CG 4.38Å; T210-L364 WeakPolarHBondContact OG1-CD1 3.5Å; R268-L364 PolarHBondContact NH1-O 3.35Å; R268-L364 PolarHBondContact NH2-O 2.72Å; D362-L364 PolarHBondContact OD2-N 3.49Å; L364-Y464 HydrophobicContact CB-CE1 4.4Å; L364-Y464 HydrophobicContact CD2-CD1 3.95Å; L364-Y464 HydrophobicContact CD2-CE1 3.88Å; L364-V465 HydrophobicContact CD1-CG2 4.13Å; L364-V465 HydrophobicContact CD2-CB 4.18Å; L364-V465 HydrophobicContact CD2-CG1 4.2Å; L364-V465 HydrophobicContact CD2-CG2 3.89Å; L364-E468 HydrophobicContact CD2-CB 4.28Å; L364-E468 HydrophobicContact CD2-CG 4.16Å; L364-M469 HydrophobicContact CD2-CE 4.24Å
365T95.8Very high92.8Very high1 Ų134.7 Ų34.71%0.00616%0.162CC..THydrogen-bonded Turntrans-88.5-28.2-17462.50000113T210 M214 R268 D362 L367 E468 I472T210-T365 HydrophobicContact CG2-CG2 3.95Å; M214-T365 HydrophobicContact SD-CG2 4.46Å; R268-T365 PolarHBondContact NH2-O 2.81Å; D362-T365 WeakPolarHBondContact OD2-CB 3.42Å; D362-T365 WeakPolarHBondContact OD2-CG2 3.32Å; D362-T365 PolarHBondContact OD2-N 2.81Å; D362-T365 PolarHBondContact OD2-OG1 3.43Å; T365-L367 PolarHBondContact O-N 3.48Å; T365-L367 PolarHBondContact OG1-N 2.93Å; T365-E468 HydrophobicContact CG2-CG 4.01Å; T365-I472 HydrophobicContact CG2-CD1 3.98Å
366G94.6Very high92.8Very high0 Ų036.9 Ų36.90%017%0.17CC..  trans67.719.1-170.600000112.8R263 D362R263-G366 WeakPolarHBondContact CG-O 3.5Å; D362-G366 WeakPolarHBondContact O-CA 3.34Å; D362-G366 PolarHBondContact O-N 2.73Å
367L96Very high92.9Very high4 Ų431.8 Ų31.82%0.02115%0.146CC..  trans-91.5151.1173.8-63.3168.9000109.8M214 Y260 R263 V296 L300 A361 D362 T365M214-L367 HydrophobicContact SD-CD1 3.85Å; M214-L367 HydrophobicContact SD-CG 4.3Å; Y260-L367 HydrophobicContact CD1-CD1 3.86Å; Y260-L367 HydrophobicContact CD1-CD2 4.34Å; Y260-L367 HydrophobicContact CE1-CD1 3.53Å; R263-L367 HydrophobicContact CB-CD2 3.73Å; R263-L367 HydrophobicContact CG-CD2 3.8Å; V296-L367 HydrophobicContact CG1-CB 4.3Å; V296-L367 HydrophobicContact CG1-CD2 3.72Å; L300-L367 HydrophobicContact CD1-CB 4.18Å; L300-L367 HydrophobicContact CD1-CD1 4.24Å; L300-L367 HydrophobicContact CD1-CD2 4.24Å; L300-L367 HydrophobicContact CD1-CG 4.46Å; A361-L367 WeakPolarHBondContact CA-O 3.48Å; D362-L367 PolarHBondContact N-O 3.32Å; T365-L367 PolarHBondContact O-N 3.48Å; T365-L367 PolarHBondContact OG1-N 2.93Å
368C96.2Very high93.1Very high0 Ų025.2 Ų25.20%012%0.121CC..EExtended strand (participates in β ladder)trans-101.1129.1171.2-71.20000110.6C293 F297 V359 D360C293-C368 WeakPolarHBondContact CA-SG 3.33Å; C293-C368 HydrophobicContact CB-CB 3.94Å; C293-C368 WeakPolarHBondContact CB-SG 3.37Å; C293-C368 VanDerWaalsContact O-CB 3.25Å; C293-C368 WeakPolarHBondContact O-CB 2.92Å; C293-C368 WeakPolarHBondContact SG-CB 3.25Å; C293-C368 CovalentContact SG-SG 2.01Å; C293-C368 PolarHBondContact SG-SG 3.46Å; F297-C368 WeakPolarHBondContact CA-O 3.29Å; F297-C368 HydrophobicContact CB-CB 4.28Å; V359-C368 HydrophobicContact CG1-CB 4.29Å; D360-C368 WeakPolarHBondContact O-CA 3.24Å
369Y96.6Very high93.2Very high15 Ų1526.7 Ų26.76%0.05913%0.131CC..EExtended strand (participates in β ladder)trans-146.1180-179.2-156-115.2000110.3L300 Y301 D360 V382L300-Y369 HydrophobicContact CB-CD2 3.99Å; L300-Y369 HydrophobicContact CB-CE2 4.02Å; L300-Y369 HydrophobicContact CD1-CD2 4.34Å; Y301-Y369 AromaticContact CD2-CE2 3.98Å; Y301-Y369 HydrophobicContact CD2-CE2 3.98Å; Y301-Y369 AromaticContact CD2-CZ 3.91Å; D360-Y369 PolarHBondContact N-O 3.31Å; D360-Y369 PolarHBondContact O-N 2.92Å; D360-Y369 VanDerWaalsContact O-O 3.06Å; Y369-V382 HydrophobicContact CE1-CG1 4.06Å; Y369-V382 HydrophobicContact CE1-CG2 3.66Å
370V94.8Very high93.3Very high0 Ų028.6 Ų28.60%015%0.152CC..EExtended strand (participates in β ladder)trans-92.2128.4176.555.10000110.3F297 Y301 I353 L358 A377 F381 V382F297-V370 HydrophobicContact CE2-CB 4.27Å; Y301-V370 HydrophobicContact CD2-CG1 3.62Å; Y301-V370 HydrophobicContact CE2-CG1 3.54Å; I353-V370 HydrophobicContact CD1-CB 4.32Å; I353-V370 HydrophobicContact CD1-CG1 4.22Å; I353-V370 HydrophobicContact CD1-CG2 4.22Å; I353-V370 HydrophobicContact CG1-CG2 4.19Å; I353-V370 HydrophobicContact CG2-CB 4.23Å; I353-V370 HydrophobicContact CG2-CG2 4.14Å; L358-V370 HydrophobicContact CB-CG2 4.03Å; L358-V370 WeakPolarHBondContact O-CA 3.35Å; L358-V370 WeakPolarHBondContact O-CG2 3.25Å; V370-A377 HydrophobicContact CG2-CB 4.08Å; V370-F381 HydrophobicContact CG1-CB 4.47Å; V370-F381 HydrophobicContact CG2-CB 4.25Å; V370-V382 HydrophobicContact CG1-CG2 3.36Å
371G85.1Confident93.5Very high0 Ų030.5 Ų30.50%016%0.16CC..SBendtrans75.133.9169.500000114.3L358 D360 Q374 L378 W453L358-G371 PolarHBondContact O-N 3.41Å; D360-G371 PolarHBondContact OD1-N 3.46Å; G371-Q374 WeakPolarHBondContact CA-O 3.41Å; G371-L378 WeakPolarHBondContact O-CB 3.42Å; G371-W453 WeakPolarHBondContact O-CH2 3.08Å
372N88.9Confident93.7Very high31 Ų3130.5 Ų30.517%0.16616%0.16CC..SBendtrans-70.7-27.4170-55.9-51.3000111D360 D362 W453D360-N372 PolarHBondContact O-ND2 2.94Å; D360-N372 PolarHBondContact OD1-N 2.91Å; D360-N372 VanDerWaalsContact OD1-N 3.11Å; D360-N372 VanDerWaalsContact OD2-C 3.27Å; D360-N372 VanDerWaalsContact OD2-CA 3.26Å; D360-N372 WeakPolarHBondContact OD2-CA 3.29Å; D360-N372 WeakPolarHBondContact OD2-CB 3.34Å; D360-N372 PolarHBondContact OD2-N 2.87Å; D360-N372 VanDerWaalsContact OD2-N 3.08Å; D362-N372 HydrophobicContact CB-CB 4.39Å; N372-W453 VanDerWaalsContact O-CH2 3.31Å; N372-W453 WeakPolarHBondContact O-CH2 3.33Å
373Q84.5Confident93.9Very high61 Ų6130.3 Ų30.329%0.28516%0.159SC..SBendtrans-112.4-6.8178.7-65.2177.139.900113.4D360 W453D360-Q373 WeakPolarHBondContact OD2-CB 3.21Å; D360-Q373 VanDerWaalsContact OD2-CG 3.3Å; D360-Q373 WeakPolarHBondContact OD2-CG 3.15Å; D360-Q373 PolarHBondContact OD2-N 2.64Å; Q373-W453 VanDerWaalsContact C-CZ2 3.5Å
374Q89.5Confident94.2Very high93 Ų9332.1 Ų32.144%0.43518%0.175SC..  trans-126.9109.6-178.4-62.9-174.627.800111.9G371 E376 A377 L378G371-Q374 WeakPolarHBondContact CA-O 3.41Å; Q374-E376 PolarHBondContact O-N 3.07Å; Q374-A377 HydrophobicContact CB-CB 4.02Å; Q374-A377 PolarHBondContact O-N 3.16Å; Q374-L378 PolarHBondContact O-N 2.93Å; Q374-L378 VanDerWaalsContact O-N 3.15Å
375Q92.6Very high94.3Very high86 Ų8633 Ų3340%0.40218%0.181SC..Hα-helixtrans-61-40.9-177.5-169.6-174.1-35.700112.9L378 T379 L450 W453Q375-L378 PolarHBondContact O-N 2.94Å; Q375-T379 WeakPolarHBondContact O-CB 3.32Å; Q375-T379 PolarHBondContact O-N 3.13Å; Q375-T379 PolarHBondContact O-OG1 3.23Å; Q375-L450 HydrophobicContact CG-CD2 3.49Å; Q375-L450 VanDerWaalsContact CG-CD2 3.49Å; Q375-W453 HydrophobicContact CB-CD2 4.13Å; Q375-W453 HydrophobicContact CB-CE3 4.5Å; Q375-W453 HydrophobicContact CB-CZ2 4.13Å; Q375-W453 HydrophobicContact CG-CD2 4.32Å
376E93.9Very high94.4Very high175 Ų17534 Ų3482%0.81819%0.186SC*.Hα-helixtrans-65.1-43.4-178.5-63.4-174.1178.400111.7Q374 T379 G380Q374-E376 PolarHBondContact O-N 3.07Å; E376-T379 PolarHBondContact O-N 3.07Å; E376-G380 PolarHBondContact O-N 3.24Å
377A94.9Very high94.6Very high5 Ų535.9 Ų35.94%0.04120%0.202CC..Hα-helixtrans-63.3-45.2177.100000111.3L358 V370 Q374 T379 F381L358-A377 HydrophobicContact CB-CB 4.21Å; L358-A377 HydrophobicContact CD1-CB 4Å; L358-A377 HydrophobicContact CD2-CB 4.34Å; L358-A377 HydrophobicContact CG-CB 4.42Å; V370-A377 HydrophobicContact CG2-CB 4.08Å; Q374-A377 HydrophobicContact CB-CB 4.02Å; Q374-A377 PolarHBondContact O-N 3.16Å; A377-T379 PolarHBondContact O-N 3.25Å; A377-F381 WeakPolarHBondContact O-CB 3.43Å; A377-F381 PolarHBondContact O-N 3.31Å
378L95.3Very high94.7Very high5 Ų539.1 Ų39.13%0.02622%0.222CC..Hα-helixtrans-60.2-46.7176.4-176.259.2000111.7G371 Q374 Q375 V382 V383 Y446 L450 W453G371-L378 WeakPolarHBondContact O-CB 3.42Å; Q374-L378 PolarHBondContact O-N 2.93Å; Q374-L378 VanDerWaalsContact O-N 3.15Å; Q375-L378 PolarHBondContact O-N 2.94Å; L378-V382 HydrophobicContact CD1-CB 4Å; L378-V382 HydrophobicContact CD1-CG1 4.42Å; L378-V382 HydrophobicContact CD1-CG2 3.95Å; L378-V382 WeakPolarHBondContact O-CA 3.5Å; L378-V382 VanDerWaalsContact O-CB 3.25Å; L378-V382 WeakPolarHBondContact O-CB 3.37Å; L378-V382 PolarHBondContact O-N 3.41Å; L378-V382 VanDerWaalsContact O-N 3.08Å; L378-V383 PolarHBondContact O-N 3.05Å; L378-V383 VanDerWaalsContact O-N 3.1Å; L378-Y446 HydrophobicContact CD1-CD1 3.96Å; L378-Y446 HydrophobicContact CD1-CE1 3.79Å; L378-Y446 HydrophobicContact CD2-CD1 4.39Å; L378-L450 HydrophobicContact CD2-CD2 3.88Å; L378-L450 HydrophobicContact CD2-CG 4.3Å; L378-L450 HydrophobicContact CG-CD2 4.38Å; L378-W453 HydrophobicContact CD2-CZ3 3.89Å
379T96.3Very high94.8Very high55 Ų5540.2 Ų40.234%0.33723%0.226SC..Iπ-helixtrans-64-50.4-179.3-55.20000111.4Q375 E376 A377 V383 A384Q375-T379 WeakPolarHBondContact O-CB 3.32Å; Q375-T379 PolarHBondContact O-N 3.13Å; Q375-T379 PolarHBondContact O-OG1 3.23Å; E376-T379 PolarHBondContact O-N 3.07Å; A377-T379 PolarHBondContact O-N 3.25Å; T379-V383 PolarHBondContact O-N 3.48Å; T379-A384 WeakPolarHBondContact O-CB 3.24Å; T379-A384 PolarHBondContact O-N 3.05Å
380G96.9Very high94.9Very high43 Ų4341 Ų4144%0.44323%0.231SC..Iπ-helixtrans-73.8-41.2-174.300000114E376 P385E376-G380 PolarHBondContact O-N 3.24Å; G380-P385 WeakPolarHBondContact O-CD 3.24Å; G380-P385 WeakPolarHBondContact O-CG 3.3Å
381F97.7Very high95Very high44 Ų4445.9 Ų45.919%0.19326%0.257CS..Iπ-helixtrans-95-19.3-173.5-71.2-75.2000114.4Y301 M305 K349 V352 I353 M356 L358 V370 A377Y301-F381 PolarHBondContact OH-O 2.95Å; M305-F381 WeakPolarHBondContact CE-O 3.4Å; K349-F381 WeakPolarHBondContact CE-O 3.4Å; K349-F381 PolarHBondContact NZ-O 3Å; V352-F381 HydrophobicContact CB-CE1 4.42Å; V352-F381 HydrophobicContact CG1-CE1 3.78Å; V352-F381 HydrophobicContact CG1-CZ 3.78Å; I353-F381 HydrophobicContact CD1-CB 3.98Å; I353-F381 HydrophobicContact CD1-CD1 3.92Å; I353-F381 HydrophobicContact CD1-CG 4Å; I353-F381 HydrophobicContact CG1-CB 4.3Å; I353-F381 HydrophobicContact CG1-CD1 3.7Å; I353-F381 HydrophobicContact CG1-CD2 4.23Å; I353-F381 HydrophobicContact CG1-CE1 4.04Å; I353-F381 HydrophobicContact CG1-CG 3.81Å; I353-F381 HydrophobicContact CG1-CZ 4.44Å; M356-F381 HydrophobicContact SD-CE2 4.37Å; M356-F381 HydrophobicContact SD-CZ 3.97Å; L358-F381 HydrophobicContact CD1-CD2 3.93Å; L358-F381 HydrophobicContact CD1-CE2 3.42Å; L358-F381 VanDerWaalsContact CD1-CE2 3.42Å; L358-F381 HydrophobicContact CD1-CZ 4.25Å; V370-F381 HydrophobicContact CG1-CB 4.47Å; V370-F381 HydrophobicContact CG2-CB 4.25Å; A377-F381 WeakPolarHBondContact O-CB 3.43Å; A377-F381 PolarHBondContact O-N 3.31Å
382V97.7Very high95.7Very high0 Ų049.1 Ų49.10%027%0.273CS..Iπ-helixtrans-116.2-65.3-176.3-171.50000111.1Y301 M305 Y369 V370 L378 P385 L386 Y446Y301-V382 HydrophobicContact CE2-CG2 4.16Å; M305-V382 HydrophobicContact CE-CB 4.42Å; M305-V382 HydrophobicContact CE-CG1 4.24Å; Y369-V382 HydrophobicContact CE1-CG1 4.06Å; Y369-V382 HydrophobicContact CE1-CG2 3.66Å; V370-V382 HydrophobicContact CG1-CG2 3.36Å; L378-V382 HydrophobicContact CD1-CB 4Å; L378-V382 HydrophobicContact CD1-CG1 4.42Å; L378-V382 HydrophobicContact CD1-CG2 3.95Å; L378-V382 WeakPolarHBondContact O-CA 3.5Å; L378-V382 VanDerWaalsContact O-CB 3.25Å; L378-V382 WeakPolarHBondContact O-CB 3.37Å; L378-V382 PolarHBondContact O-N 3.41Å; L378-V382 VanDerWaalsContact O-N 3.08Å; V382-P385 WeakPolarHBondContact O-CD 3.4Å; V382-L386 HydrophobicContact CG1-CD1 3.8Å; V382-L386 WeakPolarHBondContact O-CB 3.3Å; V382-L386 VanDerWaalsContact O-CG 3.22Å; V382-L386 WeakPolarHBondContact O-CG 3.35Å; V382-L386 PolarHBondContact O-N 3.5Å; V382-Y446 HydrophobicContact CG1-CD2 4.42Å; V382-Y446 HydrophobicContact CG1-CE1 4.28Å; V382-Y446 HydrophobicContact CG1-CE2 3.79Å
383V97.9Very high96Very high10 Ų1047.7 Ų47.76%0.06127%0.265CS..Iπ-helixtrans-67.3-51.2-169.2-179.10000111.9L378 T379 L386 A387 Y446 L447 L450L378-V383 PolarHBondContact O-N 3.05Å; L378-V383 VanDerWaalsContact O-N 3.1Å; T379-V383 PolarHBondContact O-N 3.48Å; V383-L386 PolarHBondContact O-N 3.32Å; V383-A387 VanDerWaalsContact O-CB 3.3Å; V383-A387 WeakPolarHBondContact O-CB 3.34Å; V383-A387 PolarHBondContact O-N 2.91Å; V383-Y446 HydrophobicContact CG2-CG 4.06Å; V383-L447 HydrophobicContact CG1-CD2 4.02Å; V383-L450 HydrophobicContact CG2-CD1 3.91Å
384A98Very high96.6Very high47 Ų4746.8 Ų46.839%0.38826%0.264SS..Hα-helixtrans-60.8-44.9-178.500000112.8T379 T388T379-A384 WeakPolarHBondContact O-CB 3.24Å; T379-A384 PolarHBondContact O-N 3.05Å; A384-T388 WeakPolarHBondContact O-CB 3.41Å; A384-T388 PolarHBondContact O-N 3.5Å; A384-T388 PolarHBondContact O-OG1 3.29Å
385P98.1Very high96.9Very high18 Ų1847.4 Ų47.412%0.11727%0.27CS..Hα-helixtrans-62.5-46173.7-28.738.5000113.6K349 G380 V382 A387 T388 Y389K349-P385 VanDerWaalsContact NZ-CG 3.25Å; G380-P385 WeakPolarHBondContact O-CD 3.24Å; G380-P385 WeakPolarHBondContact O-CG 3.3Å; V382-P385 WeakPolarHBondContact O-CD 3.4Å; P385-A387 PolarHBondContact O-N 3.16Å; P385-T388 PolarHBondContact O-N 3.46Å; P385-Y389 HydrophobicContact CB-CE2 4.21Å; P385-Y389 WeakPolarHBondContact O-CD1 3.39Å; P385-Y389 VanDerWaalsContact O-CD2 3.29Å; P385-Y389 WeakPolarHBondContact O-CD2 3.23Å; P385-Y389 PolarHBondContact O-N 2.77Å
386L98.1Very high97.1Very high22 Ų2245.9 Ų45.912%0.11526%0.262CS..Hα-helixtrans-62.8-42.4178.9-70.7177.7000111.9M305 S308 V382 V383 Y389 L390 I443 Y446M305-L386 HydrophobicContact CE-CD2 4.46Å; M305-L386 HydrophobicContact CE-CG 4.31Å; M305-L386 HydrophobicContact SD-CD2 4.3Å; S308-L386 WeakPolarHBondContact OG-CD2 3.27Å; V382-L386 HydrophobicContact CG1-CD1 3.8Å; V382-L386 WeakPolarHBondContact O-CB 3.3Å; V382-L386 VanDerWaalsContact O-CG 3.22Å; V382-L386 WeakPolarHBondContact O-CG 3.35Å; V382-L386 PolarHBondContact O-N 3.5Å; V383-L386 PolarHBondContact O-N 3.32Å; L386-Y389 PolarHBondContact O-N 3.38Å; L386-L390 WeakPolarHBondContact O-CB 3.47Å; L386-L390 PolarHBondContact O-N 3.2Å; L386-I443 HydrophobicContact CB-CD1 4.07Å; L386-I443 HydrophobicContact CB-CG1 4.01Å; L386-Y446 HydrophobicContact CD1-CE2 4.11Å
387A98.3Very high97.1Very high40 Ų4038 Ų3833%0.33123%0.226SC..Hα-helixtrans-63.2-42175.100000111.8V383 P385 L390 L391V383-A387 VanDerWaalsContact O-CB 3.3Å; V383-A387 WeakPolarHBondContact O-CB 3.34Å; V383-A387 PolarHBondContact O-N 2.91Å; P385-A387 PolarHBondContact O-N 3.16Å; A387-L390 PolarHBondContact O-N 3.47Å; A387-L391 WeakPolarHBondContact O-CB 3.3Å; A387-L391 PolarHBondContact O-N 3.43Å
388T98.3Very high97Very high72 Ų7241.3 Ų41.344%0.44225%0.248SC..Hα-helixtrans-62.3-45.7176.3-58.70000111.1A384 P385 L391 I392A384-T388 WeakPolarHBondContact O-CB 3.41Å; A384-T388 PolarHBondContact O-N 3.5Å; A384-T388 PolarHBondContact O-OG1 3.29Å; P385-T388 PolarHBondContact O-N 3.46Å; T388-L391 PolarHBondContact O-N 3.43Å; T388-I392 HydrophobicContact CG2-CD1 3.81Å; T388-I392 HydrophobicContact CG2-CG1 4.49Å; T388-I392 VanDerWaalsContact O-CG1 3.28Å; T388-I392 WeakPolarHBondContact O-CG1 3.43Å; T388-I392 PolarHBondContact O-N 2.72Å
389Y98.2Very high96.9Very high23 Ų2343 Ų439%0.0926%0.262CS..Hα-helixtrans-62.6-47.4177.2-59.5-21.6000111.2M305 L309 W311 V312 I345 P385 L386 L391 I392 G393M305-Y389 HydrophobicContact SD-CE2 4.26Å; L309-Y389 HydrophobicContact CD2-CD1 4.04Å; L309-Y389 HydrophobicContact CD2-CE1 3.68Å; L309-Y389 HydrophobicContact CD2-CE2 4.27Å; L309-Y389 HydrophobicContact CG-CD2 4.46Å; L309-Y389 HydrophobicContact CG-CE1 4.3Å; L309-Y389 HydrophobicContact CG-CE2 4Å; W311-Y389 WeakPolarHBondContact CZ3-O 3.4Å; V312-Y389 HydrophobicContact CG2-CG 4.46Å; V312-Y389 WeakPolarHBondContact CG2-O 3.33Å; I345-Y389 WeakPolarHBondContact CG2-OH 3.09Å; P385-Y389 HydrophobicContact CB-CE2 4.21Å; P385-Y389 WeakPolarHBondContact O-CD1 3.39Å; P385-Y389 VanDerWaalsContact O-CD2 3.29Å; P385-Y389 WeakPolarHBondContact O-CD2 3.23Å; P385-Y389 PolarHBondContact O-N 2.77Å; L386-Y389 PolarHBondContact O-N 3.38Å; Y389-L391 VanDerWaalsContact C-N 3.32Å; Y389-L391 PolarHBondContact O-N 3Å; Y389-I392 PolarHBondContact O-N 2.75Å; Y389-G393 PolarHBondContact O-N 3.45Å
390L97.7Very high96.6Very high30 Ų3040.4 Ų40.416%0.15725%0.246CC..Hα-helixtrans-58.5-44.1177.2-174.464.9000111.4W311 L386 A387 T394 T436 A439 I443W311-L390 HydrophobicContact CH2-CD1 3.81Å; W311-L390 HydrophobicContact CZ2-CD1 4.45Å; W311-L390 HydrophobicContact CZ3-CD1 4.22Å; L386-L390 WeakPolarHBondContact O-CB 3.47Å; L386-L390 PolarHBondContact O-N 3.2Å; A387-L390 PolarHBondContact O-N 3.47Å; L390-T394 HydrophobicContact CD1-CG2 4.13Å; L390-T394 HydrophobicContact CG-CG2 4.36Å; L390-T394 WeakPolarHBondContact O-CB 3.25Å; L390-T394 WeakPolarHBondContact O-CG2 3.38Å; L390-T394 PolarHBondContact O-N 3.19Å; L390-T394 PolarHBondContact O-OG1 3.14Å; L390-T436 HydrophobicContact CD1-CG2 4.42Å; L390-A439 HydrophobicContact CD1-CB 4.09Å; L390-I443 HydrophobicContact CB-CD1 4.08Å; L390-I443 HydrophobicContact CD2-CD1 3.69Å
391L98.1Very high96.2Very high104 Ų10441.4 Ų41.455%0.54524%0.241SC..Hα-helixtrans-61.8-51177.2-178.965.5000111.4A387 T388 Y389 G393 T394 L395A387-L391 WeakPolarHBondContact O-CB 3.3Å; A387-L391 PolarHBondContact O-N 3.43Å; T388-L391 PolarHBondContact O-N 3.43Å; Y389-L391 VanDerWaalsContact C-N 3.32Å; Y389-L391 PolarHBondContact O-N 3Å; L391-G393 PolarHBondContact O-N 3.42Å; L391-T394 WeakPolarHBondContact CA-OG1 3.36Å; L391-T394 PolarHBondContact O-N 2.78Å; L391-T394 PolarHBondContact O-OG1 2.98Å; L391-L395 HydrophobicContact CG-CD1 4.27Å; L391-L395 VanDerWaalsContact O-CG 3.25Å; L391-L395 WeakPolarHBondContact O-CG 3.47Å; L391-L395 PolarHBondContact O-N 3.31Å
392I98.1Very high95.8Very high68 Ų6844.1 Ų44.135%0.34926%0.261SS..Hα-helixtrans-60.2-46.6179.9-67.4168.9000110.9V312 T388 Y389 L395 F396V312-I392 HydrophobicContact CG1-CG2 3.8Å; T388-I392 HydrophobicContact CG2-CD1 3.81Å; T388-I392 HydrophobicContact CG2-CG1 4.49Å; T388-I392 VanDerWaalsContact O-CG1 3.28Å; T388-I392 WeakPolarHBondContact O-CG1 3.43Å; T388-I392 PolarHBondContact O-N 2.72Å; Y389-I392 PolarHBondContact O-N 2.75Å; I392-L395 PolarHBondContact O-N 2.87Å; I392-F396 HydrophobicContact CG2-CD2 4.01Å; I392-F396 HydrophobicContact CG2-CE2 3.51Å; I392-F396 HydrophobicContact CG2-CZ 4.31Å; I392-F396 WeakPolarHBondContact O-CD2 3.46Å; I392-F396 PolarHBondContact O-N 3.46Å; I392-F396 VanDerWaalsContact O-N 3.15Å
393G96.8Very high95.2Very high0 Ų045 Ų450%027%0.269CS..Hα-helixtrans-68.3-37.3-17900000113.3T315 Y389 L391 L395 F396 I397T315-G393 VanDerWaalsContact OG1-CA 3.24Å; T315-G393 WeakPolarHBondContact OG1-CA 3.49Å; Y389-G393 PolarHBondContact O-N 3.45Å; L391-G393 PolarHBondContact O-N 3.42Å; G393-L395 VanDerWaalsContact C-N 3.35Å; G393-F396 PolarHBondContact O-N 2.92Å; G393-I397 WeakPolarHBondContact O-CG1 3.34Å; G393-I397 PolarHBondContact O-N 2.89Å
394T95.8Very high94.4Very high43 Ų4346.1 Ų46.126%0.26427%0.274SS..Hα-helixtrans-66.5-36.1174.651.10000112.1W311 L390 L391 F396 I397 C398 T436W311-T394 HydrophobicContact CH2-CG2 4.3Å; L390-T394 HydrophobicContact CD1-CG2 4.13Å; L390-T394 HydrophobicContact CG-CG2 4.36Å; L390-T394 WeakPolarHBondContact O-CB 3.25Å; L390-T394 WeakPolarHBondContact O-CG2 3.38Å; L390-T394 PolarHBondContact O-N 3.19Å; L390-T394 PolarHBondContact O-OG1 3.14Å; L391-T394 WeakPolarHBondContact CA-OG1 3.36Å; L391-T394 PolarHBondContact O-N 2.78Å; L391-T394 PolarHBondContact O-OG1 2.98Å; T394-F396 PolarHBondContact O-N 3.44Å; T394-I397 PolarHBondContact O-N 3.26Å; T394-C398 PolarHBondContact O-N 2.91Å; T394-C398 PolarHBondContact O-SG 3.42Å; T394-C398 VanDerWaalsContact O-SG 3.35Å; T394-T436 HydrophobicContact CG2-CG2 3.95Å
395L96.8Very high93.7Very high105 Ų10550.7 Ų50.755%0.5529%0.285SS..Hα-helixtrans-60.3-43.4172.1-70.7171.1000111.9L391 I392 G393 C398 A399L391-L395 HydrophobicContact CG-CD1 4.27Å; L391-L395 VanDerWaalsContact O-CG 3.25Å; L391-L395 WeakPolarHBondContact O-CG 3.47Å; L391-L395 PolarHBondContact O-N 3.31Å; I392-L395 PolarHBondContact O-N 2.87Å; G393-L395 VanDerWaalsContact C-N 3.35Å; L395-C398 PolarHBondContact O-N 3.36Å; L395-A399 WeakPolarHBondContact O-CB 3.44Å; L395-A399 PolarHBondContact O-N 3.36Å
396F96.1Very high92.9Very high55 Ų5556.8 Ų56.824%0.24131%0.31CS..Hα-helixtrans-65.1-38.8174.2-70.5-48.5000112.7V312 L316 F319 I392 G393 T394 A399 G400V312-F396 HydrophobicContact CG1-CE2 4.48Å; L316-F396 HydrophobicContact CB-CD2 3.98Å; L316-F396 HydrophobicContact CB-CE2 3.96Å; L316-F396 HydrophobicContact CB-CZ 4.46Å; L316-F396 HydrophobicContact CD1-CD1 4.28Å; L316-F396 HydrophobicContact CD1-CE1 3.79Å; L316-F396 HydrophobicContact CD1-CE2 4.05Å; L316-F396 HydrophobicContact CD1-CZ 3.68Å; L316-F396 HydrophobicContact CG-CE2 4.48Å; F319-F396 HydrophobicContact CB-CB 4.23Å; F319-F396 HydrophobicContact CB-CD1 4.41Å; F319-F396 HydrophobicContact CD1-CD1 4.01Å; F319-F396 HydrophobicContact CD1-CE1 4.44Å; F319-F396 HydrophobicContact CG-CD1 4.29Å; I392-F396 HydrophobicContact CG2-CD2 4.01Å; I392-F396 HydrophobicContact CG2-CE2 3.51Å; I392-F396 HydrophobicContact CG2-CZ 4.31Å; I392-F396 WeakPolarHBondContact O-CD2 3.46Å; I392-F396 PolarHBondContact O-N 3.46Å; I392-F396 VanDerWaalsContact O-N 3.15Å; G393-F396 PolarHBondContact O-N 2.92Å; T394-F396 PolarHBondContact O-N 3.44Å; F396-A399 PolarHBondContact O-N 2.89Å; F396-G400 PolarHBondContact O-N 2.95Å
397I93.6Very high91.8Very high9 Ų958 Ų585%0.04632%0.316CS..Hα-helixtrans-60-49.7174-69.3169.4000110.2W311 T315 W318 G393 T394 A399 G400 L401 V433 T436W311-I397 HydrophobicContact CZ2-CD1 3.83Å; T315-I397 HydrophobicContact CG2-CD1 3.71Å; T315-I397 HydrophobicContact CG2-CG1 3.64Å; W318-I397 WeakPolarHBondContact CZ3-O 3.29Å; G393-I397 WeakPolarHBondContact O-CG1 3.34Å; G393-I397 PolarHBondContact O-N 2.89Å; T394-I397 PolarHBondContact O-N 3.26Å; I397-A399 PolarHBondContact O-N 3.35Å; I397-G400 PolarHBondContact O-N 2.81Å; I397-L401 HydrophobicContact CG2-CD1 3.94Å; I397-L401 HydrophobicContact CG2-CG 4.29Å; I397-L401 WeakPolarHBondContact O-CB 3.18Å; I397-L401 VanDerWaalsContact O-CG 3.3Å; I397-L401 WeakPolarHBondContact O-CG 3.39Å; I397-L401 PolarHBondContact O-N 2.82Å; I397-V433 HydrophobicContact CG2-CG2 4.08Å; I397-T436 HydrophobicContact CD1-CG2 3.9Å
398C92.9Very high90.6Very high75 Ų7562.1 Ų62.151%0.50732%0.323SS..Hα-helixtrans-60.2-47.4178.7-70.40000111.8T394 L395 G400 L401 V402T394-C398 PolarHBondContact O-N 2.91Å; T394-C398 PolarHBondContact O-SG 3.42Å; T394-C398 VanDerWaalsContact O-SG 3.35Å; L395-C398 PolarHBondContact O-N 3.36Å; C398-G400 PolarHBondContact O-N 2.85Å; C398-L401 PolarHBondContact O-N 3.47Å; C398-V402 WeakPolarHBondContact O-CG2 3.28Å; C398-V402 PolarHBondContact O-N 3.02Å
399A92.9Very high89.5Confident40 Ų4062 Ų6233%0.33133%0.325SS..Hα-helixtrans-61.1-42.6178.200000112.2F319 L395 F396 I397 A403F319-A399 HydrophobicContact CD2-CB 3.79Å; F319-A399 HydrophobicContact CE2-CB 3.68Å; F319-A399 HydrophobicContact CZ-CB 4.46Å; L395-A399 WeakPolarHBondContact O-CB 3.44Å; L395-A399 PolarHBondContact O-N 3.36Å; F396-A399 PolarHBondContact O-N 2.89Å; I397-A399 PolarHBondContact O-N 3.35Å; A399-A403 WeakPolarHBondContact O-CB 3.21Å; A399-A403 PolarHBondContact O-N 2.84Å
400G89.8Confident88.1Confident0 Ų065 Ų650%034%0.343CS..Hα-helixtrans-70.5-35.5178.500000113W318 F396 I397 C398 A403 L404W318-G400 VanDerWaalsContact CH2-C 3.44Å; F396-G400 PolarHBondContact O-N 2.95Å; I397-G400 PolarHBondContact O-N 2.81Å; C398-G400 PolarHBondContact O-N 2.85Å; G400-A403 PolarHBondContact O-N 2.74Å; G400-L404 WeakPolarHBondContact O-CB 2.94Å; G400-L404 WeakPolarHBondContact O-CG 3.5Å; G400-L404 PolarHBondContact O-N 2.53Å
401L89.1Confident86.5Confident64 Ų6466 Ų6634%0.33535%0.348SS..Hα-helixtrans-63.1-48.3173.6-74.6175.7000110.8W318 I397 C398 A403 L404 F405W318-L401 HydrophobicContact CH2-CB 4.47Å; W318-L401 HydrophobicContact CH2-CD2 3.89Å; W318-L401 HydrophobicContact CH2-CG 3.85Å; W318-L401 HydrophobicContact CZ2-CD2 4.34Å; I397-L401 HydrophobicContact CG2-CD1 3.94Å; I397-L401 HydrophobicContact CG2-CG 4.29Å; I397-L401 WeakPolarHBondContact O-CB 3.18Å; I397-L401 VanDerWaalsContact O-CG 3.3Å; I397-L401 WeakPolarHBondContact O-CG 3.39Å; I397-L401 PolarHBondContact O-N 2.82Å; C398-L401 PolarHBondContact O-N 3.47Å; L401-A403 VanDerWaalsContact C-N 3.29Å; L401-A403 PolarHBondContact O-N 3.5Å; L401-L404 PolarHBondContact O-N 3.48Å; L401-F405 HydrophobicContact CB-CE2 4.4Å; L401-F405 WeakPolarHBondContact O-CD2 3.33Å; L401-F405 PolarHBondContact O-N 2.9Å
402V89.6Confident84.8Confident102 Ų10268 Ų6862%0.61836%0.355SS*.Hα-helixtrans-57.5-44.2177170.80000110.9C398 F405 K406C398-V402 WeakPolarHBondContact O-CG2 3.28Å; C398-V402 PolarHBondContact O-N 3.02Å; V402-F405 PolarHBondContact O-N 3.22Å; V402-K406 WeakPolarHBondContact O-CB 3.49Å; V402-K406 PolarHBondContact O-N 2.95Å
403A85.6Confident83.1Confident19 Ų1972.6 Ų72.616%0.15737%0.372CS..Hα-helixtrans-68.5-38.4-18000000112.8A399 G400 L401 K406 I407A399-A403 WeakPolarHBondContact O-CB 3.21Å; A399-A403 PolarHBondContact O-N 2.84Å; G400-A403 PolarHBondContact O-N 2.74Å; L401-A403 VanDerWaalsContact C-N 3.29Å; L401-A403 PolarHBondContact O-N 3.5Å; A403-K406 PolarHBondContact O-N 3.35Å; A403-I407 VanDerWaalsContact O-CG1 3.29Å; A403-I407 WeakPolarHBondContact O-CG1 3.26Å; A403-I407 PolarHBondContact O-N 3.13Å
404L80.8Confident81.3Confident32 Ų3278.7 Ų78.717%0.16840%0.404CS..Hα-helixtrans-60.7-45.8172.8-79.4174.7000112.2W318 A322 G400 L401 K406 I407 R408 M425W318-L404 HydrophobicContact CH2-CD1 3.99Å; W318-L404 HydrophobicContact CZ2-CD1 3.41Å; W318-L404 VanDerWaalsContact CZ2-CD1 3.41Å; A322-L404 HydrophobicContact CB-CD1 4.23Å; A322-L404 HydrophobicContact CB-CD2 3.9Å; A322-L404 HydrophobicContact CB-CG 3.86Å; G400-L404 WeakPolarHBondContact O-CB 2.94Å; G400-L404 WeakPolarHBondContact O-CG 3.5Å; G400-L404 PolarHBondContact O-N 2.53Å; L401-L404 PolarHBondContact O-N 3.48Å; L404-K406 VanDerWaalsContact C-N 3.34Å; L404-K406 PolarHBondContact O-N 3.27Å; L404-I407 PolarHBondContact O-N 3.2Å; L404-R408 WeakPolarHBondContact O-CB 3.3Å; L404-R408 PolarHBondContact O-N 3.4Å; L404-M425 HydrophobicContact CD2-CE 3.59Å; L404-M425 HydrophobicContact CD2-SD 4.41Å
405F82.7Confident79.5Confident143 Ų14380.2 Ų80.263%0.62743%0.429SS*.Hα-helixtrans-63.3-40.6177.4-75.3-61.8000111.9L401 V402 R408 S409L401-F405 HydrophobicContact CB-CE2 4.4Å; L401-F405 WeakPolarHBondContact O-CD2 3.33Å; L401-F405 PolarHBondContact O-N 2.9Å; V402-F405 PolarHBondContact O-N 3.22Å; F405-R408 PolarHBondContact O-N 2.95Å; F405-S409 WeakPolarHBondContact O-CB 3.33Å; F405-S409 PolarHBondContact O-N 3.48Å
406K82.1Confident77.8Confident147 Ų14777.8 Ų77.864%0.63942%0.424SS*.Hα-helixtrans-62.7-42.5175.8-170.9174.5-178.3177.40112V402 A403 L404 N410V402-K406 WeakPolarHBondContact O-CB 3.49Å; V402-K406 PolarHBondContact O-N 2.95Å; A403-K406 PolarHBondContact O-N 3.35Å; L404-K406 VanDerWaalsContact C-N 3.34Å; L404-K406 PolarHBondContact O-N 3.27Å; K406-N410 PolarHBondContact O-N 3.31Å; K406-N410 PolarHBondContact O-ND2 3.3Å
407I74.9Confident76.1Confident47 Ų4785 Ų8524%0.24146%0.455CS..Hα-helixtrans-66.3-47.9176.8-68.3165.6000110.2A322 K325 A403 L404 S409 N410 L411A322-I407 WeakPolarHBondContact O-CD1 3.3Å; K325-I407 HydrophobicContact CG-CD1 4.45Å; A403-I407 VanDerWaalsContact O-CG1 3.29Å; A403-I407 WeakPolarHBondContact O-CG1 3.26Å; A403-I407 PolarHBondContact O-N 3.13Å; L404-I407 PolarHBondContact O-N 3.2Å; I407-S409 VanDerWaalsContact C-N 3.34Å; I407-S409 PolarHBondContact O-N 3.04Å; I407-N410 PolarHBondContact O-N 3.43Å; I407-N410 VanDerWaalsContact O-N 3.15Å; I407-L411 WeakPolarHBondContact O-CB 3.4Å; I407-L411 PolarHBondContact O-N 3.26Å
408R73.5Confident74.6Confident127 Ų12787 Ų8748%0.47947%0.468SS..Hα-helixtrans-62.3-39.7-178.9-175.9171.4171.4167.1-4.7112.7L404 F405 N410 L411 Q412 E422L404-R408 WeakPolarHBondContact O-CB 3.3Å; L404-R408 PolarHBondContact O-N 3.4Å; F405-R408 PolarHBondContact O-N 2.95Å; R408-N410 VanDerWaalsContact C-N 3.29Å; R408-N410 PolarHBondContact O-N 3.48Å; R408-L411 PolarHBondContact O-N 2.9Å; R408-Q412 WeakPolarHBondContact O-CB 3.46Å; R408-Q412 WeakPolarHBondContact O-CG 3.35Å; R408-Q412 PolarHBondContact O-N 3.24Å; R408-Q412 VanDerWaalsContact O-N 3.07Å; R408-E422 IonicContact CZ-OE1 3.16Å; R408-E422 IonicContact NE-OE1 2.74Å; R408-E422 IonicContact NH1-OE1 2.85Å
409S73.3Confident73.5Confident69 Ų6987.9 Ų87.948%0.48347%0.468SS..Hα-helixtrans-62-36.1175.4-179.70000112.5F405 I407F405-S409 WeakPolarHBondContact O-CB 3.33Å; F405-S409 PolarHBondContact O-N 3.48Å; I407-S409 VanDerWaalsContact C-N 3.34Å; I407-S409 PolarHBondContact O-N 3.04Å
410N70.6Confident72.5Confident86 Ų8695 Ų9546%0.4649%0.491SS..Hα-helixtrans-80.9-39.5177-69.5-20.2000112.2K406 I407 R408 Q412 K413K406-N410 PolarHBondContact O-N 3.31Å; K406-N410 PolarHBondContact O-ND2 3.3Å; I407-N410 PolarHBondContact O-N 3.43Å; I407-N410 VanDerWaalsContact O-N 3.15Å; R408-N410 VanDerWaalsContact C-N 3.29Å; R408-N410 PolarHBondContact O-N 3.48Å; N410-Q412 PolarHBondContact O-N 2.93Å; N410-K413 WeakPolarHBondContact O-CB 3.33Å; N410-K413 PolarHBondContact O-N 3.07Å; N410-K413 VanDerWaalsContact O-N 3.15Å
411L63.5Low71.5Confident50 Ų50100.3 Ų100.326%0.26252%0.519SS..Hα-helixtrans-72.9-27.7-175.4-145.494.1000113.3I407 R408 K413 D414 G415 T418I407-L411 WeakPolarHBondContact O-CB 3.4Å; I407-L411 PolarHBondContact O-N 3.26Å; R408-L411 PolarHBondContact O-N 2.9Å; L411-K413 PolarHBondContact O-N 3.11Å; L411-K413 VanDerWaalsContact O-N 3.1Å; L411-D414 PolarHBondContact O-N 3.01Å; L411-G415 PolarHBondContact O-N 2.96Å; L411-T418 HydrophobicContact CD2-CG2 3.88Å; L411-T418 WeakPolarHBondContact CD2-OG1 3.47Å
412Q61.8Low70.7Confident148 Ų148100.1 Ų100.169%0.69252%0.516SS*.THydrogen-bonded Turntrans-59.7-16170.7-86.2-179.5-3300113.1R408 N410R408-Q412 WeakPolarHBondContact O-CB 3.46Å; R408-Q412 WeakPolarHBondContact O-CG 3.35Å; R408-Q412 PolarHBondContact O-N 3.24Å; R408-Q412 VanDerWaalsContact O-N 3.07Å; N410-Q412 PolarHBondContact O-N 2.93Å
413K62.4Low70.1Confident163 Ų163104.3 Ų104.371%0.70952%0.521SS*.THydrogen-bonded Turntrans-87.4-21.9174.6-58.3-179.5-179.9176.40113.4N410 L411N410-K413 WeakPolarHBondContact O-CB 3.33Å; N410-K413 PolarHBondContact O-N 3.07Å; N410-K413 VanDerWaalsContact O-N 3.15Å; L411-K413 PolarHBondContact O-N 3.11Å; L411-K413 VanDerWaalsContact O-N 3.1Å
414D59.2Low69.5Low128 Ų128105.8 Ų105.868%0.68453%0.526SS*.THydrogen-bonded Turntrans-111.60.6-166.2-69.2-19000115L411 A416L411-D414 PolarHBondContact O-N 3.01Å; D414-A416 VanDerWaalsContact C-N 3.26Å; D414-A416 PolarHBondContact O-N 3.05Å; D414-A416 VanDerWaalsContact O-N 3.09Å
415G58.9Low69.4Low76 Ų76105.1 Ų105.178%0.78452%0.522SS*.THydrogen-bonded Turntrans63.918167.600000116.8L411L411-G415 PolarHBondContact O-N 2.96Å
416A59.9Low69.3Low53 Ų53101.8 Ų101.844%0.43851%0.514SS..  trans-81.1136.2-177.500000113.4D414 T418D414-A416 VanDerWaalsContact C-N 3.26Å; D414-A416 PolarHBondContact O-N 3.05Å; D414-A416 VanDerWaalsContact O-N 3.09Å; A416-T418 PolarHBondContact O-N 3.19Å
417K59.9Low69.4Low206 Ų20699.3 Ų99.390%0.89650%0.503SS*.  trans-75.983176.8-75.9-178.3176.8175.30112.2
418T64.1Low69.8Low53 Ų5397.1 Ų97.133%0.32549%0.492SS..  trans-103.610.7174.253.50000114.5L411 A416 K420 L421 E422L411-T418 HydrophobicContact CD2-CG2 3.88Å; L411-T418 WeakPolarHBondContact CD2-OG1 3.47Å; A416-T418 PolarHBondContact O-N 3.19Å; T418-K420 VanDerWaalsContact C-N 3.28Å; T418-K420 PolarHBondContact O-N 3.31Å; T418-L421 PolarHBondContact O-N 3.4Å; T418-L421 VanDerWaalsContact O-N 3.12Å; T418-E422 PolarHBondContact O-N 3.38Å; T418-E422 VanDerWaalsContact O-N 3.11Å
419D68.6Low70.3Confident92 Ų9291.4 Ų91.449%0.49247%0.472SS..Hα-helixtrans-52.8-35-167.4-59.8-5.7000115.7R423D419-R423 WeakPolarHBondContact O-CB 3.12Å; D419-R423 WeakPolarHBondContact O-CG 3.48Å; D419-R423 PolarHBondContact O-N 3.45Å; D419-R423 VanDerWaalsContact O-N 3.1Å
420K72.1Confident70.9Confident191 Ų19192 Ų9283%0.8347%0.472SS*.Hα-helixtrans-72.9-43.2-178.4-72.4-176.3-177.6173.60112.3T418 L424T418-K420 VanDerWaalsContact C-N 3.28Å; T418-K420 PolarHBondContact O-N 3.31Å; K420-L424 PolarHBondContact O-N 3.04Å
421L68.6Low71.6Confident110 Ų11088.5 Ų88.558%0.57645%0.453SS*.Hα-helixtrans-69.7-42.4179.9-173.664.3000109.7T418 R423 L424 M425T418-L421 PolarHBondContact O-N 3.4Å; T418-L421 VanDerWaalsContact O-N 3.12Å; L421-R423 PolarHBondContact O-N 2.87Å; L421-L424 WeakPolarHBondContact O-CB 3.01Å; L421-L424 PolarHBondContact O-N 2.9Å; L421-M425 HydrophobicContact CD1-SD 4.3Å; L421-M425 HydrophobicContact CD2-SD 4.39Å; L421-M425 HydrophobicContact CG-SD 3.73Å; L421-M425 WeakPolarHBondContact O-CG 3.19Å; L421-M425 PolarHBondContact O-N 3.37Å; L421-M425 VanDerWaalsContact O-SD 3.42Å
422E72.4Confident72.6Confident61 Ų6186.1 Ų86.129%0.28544%0.44SS..Hα-helixtrans-60.6-45.9176-172.1178173.800112.1R408 T418 L424 M425 V426R408-E422 IonicContact CZ-OE1 3.16Å; R408-E422 IonicContact NE-OE1 2.74Å; R408-E422 IonicContact NH1-OE1 2.85Å; T418-E422 PolarHBondContact O-N 3.38Å; T418-E422 VanDerWaalsContact O-N 3.11Å; E422-L424 VanDerWaalsContact C-N 3.3Å; E422-L424 PolarHBondContact O-N 2.89Å; E422-M425 PolarHBondContact O-N 2.94Å; E422-V426 HydrophobicContact CG-CG2 4.41Å; E422-V426 WeakPolarHBondContact O-CB 3.36Å; E422-V426 VanDerWaalsContact O-CG2 3.3Å; E422-V426 WeakPolarHBondContact O-CG2 3.33Å; E422-V426 PolarHBondContact O-N 2.87Å
423R77.4Confident73.7Confident190 Ų19082 Ų8272%0.71743%0.426SS*.Hα-helixtrans-59.3-40.3175.9-77174.5-169.5-144.44.3112.5D419 L421 K427D419-R423 WeakPolarHBondContact O-CB 3.12Å; D419-R423 WeakPolarHBondContact O-CG 3.48Å; D419-R423 PolarHBondContact O-N 3.45Å; D419-R423 VanDerWaalsContact O-N 3.1Å; L421-R423 PolarHBondContact O-N 2.87Å; R423-K427 WeakPolarHBondContact O-CB 3.49Å; R423-K427 PolarHBondContact O-N 3.26Å
424L73.8Confident74.9Confident49 Ų4979 Ų7926%0.25742%0.417SS..Hα-helixtrans-64.3-46.6177.3174.658.4000111.1E243 K420 L421 E422 K427 I428E243-L424 HydrophobicContact CG-CD1 4.06Å; E243-L424 WeakPolarHBondContact OE1-CD1 3.29Å; K420-L424 PolarHBondContact O-N 3.04Å; L421-L424 WeakPolarHBondContact O-CB 3.01Å; L421-L424 PolarHBondContact O-N 2.9Å; E422-L424 VanDerWaalsContact C-N 3.3Å; E422-L424 PolarHBondContact O-N 2.89Å; L424-K427 WeakPolarHBondContact O-CB 3.46Å; L424-K427 PolarHBondContact O-N 3.09Å; L424-I428 HydrophobicContact CD1-CD1 3.94Å; L424-I428 HydrophobicContact CD1-CG1 4.2Å; L424-I428 HydrophobicContact CG-CD1 4.1Å; L424-I428 WeakPolarHBondContact O-CG1 3.03Å; L424-I428 PolarHBondContact O-N 3.48Å
425M78.2Confident76.4Confident18 Ų1873.6 Ų73.69%0.08939%0.387CS..Hα-helixtrans-67.7-39.2-177.8-63.4161.684.200112.3W318 A322 L404 L421 E422 K427 I428 G429W318-M425 PolarHBondContact NE1-O 3.37Å; A322-M425 HydrophobicContact CB-CE 3.28Å; L404-M425 HydrophobicContact CD2-CE 3.59Å; L404-M425 HydrophobicContact CD2-SD 4.41Å; L421-M425 HydrophobicContact CD1-SD 4.3Å; L421-M425 HydrophobicContact CD2-SD 4.39Å; L421-M425 HydrophobicContact CG-SD 3.73Å; L421-M425 WeakPolarHBondContact O-CG 3.19Å; L421-M425 PolarHBondContact O-N 3.37Å; L421-M425 VanDerWaalsContact O-SD 3.42Å; E422-M425 PolarHBondContact O-N 2.94Å; M425-K427 VanDerWaalsContact C-N 3.33Å; M425-I428 PolarHBondContact O-N 3.4Å; M425-G429 PolarHBondContact O-N 3.15Å
426V80.5Confident78Confident74 Ų7471.2 Ų71.245%0.44836%0.357SS..Hα-helixtrans-61.9-43.2172.4171.50000110.4E422 I428 G429 V430E422-V426 HydrophobicContact CG-CG2 4.41Å; E422-V426 WeakPolarHBondContact O-CB 3.36Å; E422-V426 VanDerWaalsContact O-CG2 3.3Å; E422-V426 WeakPolarHBondContact O-CG2 3.33Å; E422-V426 PolarHBondContact O-N 2.87Å; V426-I428 PolarHBondContact O-N 2.86Å; V426-G429 PolarHBondContact O-N 3.39Å; V426-V430 HydrophobicContact CG1-CG2 4.37Å; V426-V430 WeakPolarHBondContact O-CG2 3.25Å; V426-V430 PolarHBondContact O-N 2.75Å
427K84.6Confident79.7Confident95 Ų9572.5 Ų72.541%0.41336%0.36SS..Hα-helixtrans-60.5-46.9178.6-162.2-162.3167.1-157.60111.6R423 L424 M425 V430 F431 W485R423-K427 WeakPolarHBondContact O-CB 3.49Å; R423-K427 PolarHBondContact O-N 3.26Å; L424-K427 WeakPolarHBondContact O-CB 3.46Å; L424-K427 PolarHBondContact O-N 3.09Å; M425-K427 VanDerWaalsContact C-N 3.33Å; K427-V430 PolarHBondContact O-N 3.28Å; K427-F431 PolarHBondContact O-N 2.98Å; K427-W485 HydrophobicContact CB-CH2 3.83Å; K427-W485 HydrophobicContact CB-CZ3 4.17Å; K427-W485 HydrophobicContact CD-CE3 4.23Å; K427-W485 HydrophobicContact CD-CH2 3.32Å; K427-W485 HydrophobicContact CD-CZ2 3.81Å; K427-W485 HydrophobicContact CD-CZ3 3.57Å; K427-W485 HydrophobicContact CG-CE3 4.38Å; K427-W485 HydrophobicContact CG-CH2 3.46Å; K427-W485 VanDerWaalsContact CG-CH2 3.46Å; K427-W485 HydrophobicContact CG-CZ2 4.42Å; K427-W485 HydrophobicContact CG-CZ3 3.44Å; K427-W485 VanDerWaalsContact CG-CZ3 3.44Å; K427-W485 PolarHBondContact NZ-O 2.82Å; K427-W485 VanDerWaalsContact NZ-O 3.17Å; K427-W485 WeakPolarHBondContact O-CZ3 3.11Å
428I83.1Confident81.4Confident1 Ų163 Ų631%0.00532%0.319CS..Hα-helixtrans-66.2-39.2178.5-62.7171.8000110.9P242 E243 L314 W318 L424 M425 V426 F431 S432 W485P242-I428 HydrophobicContact CG-CD1 3.79Å; E243-I428 HydrophobicContact CG-CD1 3.92Å; E243-I428 HydrophobicContact CG-CG1 4.48Å; L314-I428 HydrophobicContact CD1-CG2 3.99Å; W318-I428 HydrophobicContact CB-CG2 4Å; W318-I428 HydrophobicContact CG-CG2 3.9Å; L424-I428 HydrophobicContact CD1-CD1 3.94Å; L424-I428 HydrophobicContact CD1-CG1 4.2Å; L424-I428 HydrophobicContact CG-CD1 4.1Å; L424-I428 WeakPolarHBondContact O-CG1 3.03Å; L424-I428 PolarHBondContact O-N 3.48Å; M425-I428 PolarHBondContact O-N 3.4Å; V426-I428 PolarHBondContact O-N 2.86Å; I428-F431 PolarHBondContact O-N 3.31Å; I428-S432 WeakPolarHBondContact O-CB 3.41Å; I428-S432 PolarHBondContact O-N 3.47Å; I428-S432 PolarHBondContact O-OG 3.25Å; I428-W485 HydrophobicContact CB-CH2 4.29Å; I428-W485 HydrophobicContact CG1-CH2 3.53Å; I428-W485 HydrophobicContact CG1-CZ2 3.88Å
429G83Confident82.9Confident6 Ų661.4 Ų61.46%0.06231%0.311CS..Hα-helixtrans-61.5-47.7176.100000112.2M425 V426 F431 S432 V433M425-G429 PolarHBondContact O-N 3.15Å; V426-G429 PolarHBondContact O-N 3.39Å; G429-F431 PolarHBondContact O-N 3.32Å; G429-S432 PolarHBondContact O-N 3.31Å; G429-V433 WeakPolarHBondContact O-CG2 3.35Å; G429-V433 PolarHBondContact O-N 3.32Å
430V85.9Confident84.3Confident81 Ų8159.8 Ų59.849%0.49131%0.307SS..Hα-helixtrans-60.2-45.31761710000111.1V426 K427 S432 V433 L434V426-V430 HydrophobicContact CG1-CG2 4.37Å; V426-V430 WeakPolarHBondContact O-CG2 3.25Å; V426-V430 PolarHBondContact O-N 2.75Å; K427-V430 PolarHBondContact O-N 3.28Å; V430-S432 VanDerWaalsContact C-N 3.32Å; V430-S432 PolarHBondContact O-N 3.01Å; V430-V433 PolarHBondContact O-N 3.42Å; V430-L434 HydrophobicContact CG1-CD1 4.02Å; V430-L434 HydrophobicContact CG1-CG 4.39Å; V430-L434 WeakPolarHBondContact O-CG 3.46Å; V430-L434 PolarHBondContact O-N 3.32Å
431F84.8Confident85.5Confident13 Ų1352.4 Ų52.46%0.05728%0.278CS..Hα-helixtrans-61.7-41.2177.2-179.5-96.4000112.3I246 L314 K427 I428 G429 V433 L434 Y435 W485I246-F431 HydrophobicContact CD1-CD1 4.07Å; I246-F431 HydrophobicContact CD1-CE1 4.19Å; I246-F431 HydrophobicContact CG1-CD1 4.33Å; I246-F431 HydrophobicContact CG1-CE1 4.04Å; I246-F431 HydrophobicContact CG2-CE1 4.2Å; I246-F431 HydrophobicContact CG2-CZ 4.2Å; L314-F431 HydrophobicContact CD2-CD1 3.86Å; L314-F431 HydrophobicContact CD2-CE1 3.92Å; K427-F431 PolarHBondContact O-N 2.98Å; I428-F431 PolarHBondContact O-N 3.31Å; G429-F431 PolarHBondContact O-N 3.32Å; F431-V433 VanDerWaalsContact C-N 3.35Å; F431-V433 PolarHBondContact O-N 2.87Å; F431-L434 PolarHBondContact O-N 2.87Å; F431-Y435 PolarHBondContact O-N 2.94Å; F431-Y435 VanDerWaalsContact O-N 3.08Å; F431-W485 HydrophobicContact CB-CE3 4.05Å; F431-W485 HydrophobicContact CB-CZ3 3.75Å; F431-W485 HydrophobicContact CD2-CE3 4.1Å; F431-W485 HydrophobicContact CG-CE3 4.04Å; F431-W485 HydrophobicContact CG-CZ3 4.22Å
432S84.5Confident86.9Confident0 Ų047.9 Ų47.90%025%0.254CS..Hα-helixtrans-63.9-39.9178.1-57.70000111.9W311 I428 G429 V430 Y435 T436W311-S432 PolarHBondContact NE1-O 3.24Å; I428-S432 WeakPolarHBondContact O-CB 3.41Å; I428-S432 PolarHBondContact O-N 3.47Å; I428-S432 PolarHBondContact O-OG 3.25Å; G429-S432 PolarHBondContact O-N 3.31Å; V430-S432 VanDerWaalsContact C-N 3.32Å; V430-S432 PolarHBondContact O-N 3.01Å; S432-Y435 PolarHBondContact O-N 3.05Å; S432-T436 PolarHBondContact O-N 3.26Å
433V86Confident88.1Confident63 Ų6345.8 Ų45.838%0.38225%0.245SC..Hα-helixtrans-67.1-42.2173.4173.30000111.1I397 G429 V430 F431 Y435 T436I397-V433 HydrophobicContact CG2-CG2 4.08Å; G429-V433 WeakPolarHBondContact O-CG2 3.35Å; G429-V433 PolarHBondContact O-N 3.32Å; V430-V433 PolarHBondContact O-N 3.42Å; F431-V433 VanDerWaalsContact C-N 3.35Å; F431-V433 PolarHBondContact O-N 2.87Å; V433-Y435 PolarHBondContact O-N 3.17Å; V433-T436 WeakPolarHBondContact O-CB 3.38Å; V433-T436 PolarHBondContact O-N 3.43Å; V433-T436 PolarHBondContact O-OG1 2.85Å
434L88.5Confident89.1Confident100 Ų10038.5 Ų38.552%0.52423%0.229SC..Hα-helixtrans-59.7-32.4176.9-75.5171.8000112.5V430 F431 P438V430-L434 HydrophobicContact CG1-CD1 4.02Å; V430-L434 HydrophobicContact CG1-CG 4.39Å; V430-L434 WeakPolarHBondContact O-CG 3.46Å; V430-L434 PolarHBondContact O-N 3.32Å; F431-L434 PolarHBondContact O-N 2.87Å; L434-P438 WeakPolarHBondContact O-CD 3.49Å
435Y89.9Confident90.2Very high13 Ų1336.5 Ų36.55%0.05122%0.219CC..Hα-helixtrans-69.8-32.1173.7-175.2-74.6000113.2L249 W311 F431 S432 V433 V437 P438 A439 V478L249-Y435 HydrophobicContact CD1-CD2 4.13Å; L249-Y435 HydrophobicContact CD1-CE2 3.73Å; L249-Y435 HydrophobicContact CD2-CE2 4.44Å; L249-Y435 HydrophobicContact CG-CE2 4.4Å; W311-Y435 HydrophobicContact CB-CD1 4.19Å; W311-Y435 HydrophobicContact CB-CD2 4.43Å; W311-Y435 HydrophobicContact CB-CE1 3.77Å; W311-Y435 HydrophobicContact CB-CE2 3.98Å; W311-Y435 AromaticContact CD1-CD1 3.19Å; W311-Y435 AromaticContact CD1-CD2 3.67Å; W311-Y435 AromaticContact CD1-CE1 3.71Å; W311-Y435 AromaticContact CD1-CG 3.2Å; W311-Y435 AromaticContact CD2-CD1 3.6Å; W311-Y435 HydrophobicContact CD2-CD1 3.6Å; W311-Y435 AromaticContact CD2-CE1 3.68Å; W311-Y435 HydrophobicContact CD2-CE1 3.68Å; W311-Y435 HydrophobicContact CD2-CG 4.4Å; W311-Y435 AromaticContact CE2-CD1 3.55Å; W311-Y435 HydrophobicContact CE3-CD1 4.49Å; W311-Y435 HydrophobicContact CE3-CE1 4.27Å; W311-Y435 AromaticContact CG-CD1 3.39Å; W311-Y435 HydrophobicContact CG-CD1 3.39Å; W311-Y435 HydrophobicContact CG-CD2 4.16Å; W311-Y435 AromaticContact CG-CE1 3.41Å; W311-Y435 HydrophobicContact CG-CE1 3.41Å; W311-Y435 VanDerWaalsContact CG-CE1 3.41Å; W311-Y435 HydrophobicContact CG-CE2 4.13Å; W311-Y435 AromaticContact CG-CG 3.82Å; W311-Y435 HydrophobicContact CG-CG 3.82Å; W311-Y435 AromaticContact CG-CZ 3.81Å; W311-Y435 HydrophobicContact CZ2-CD1 4.39Å; W311-Y435 AromaticContact NE1-CD1 3.27Å; W311-Y435 VanDerWaalsContact NE1-CD1 3.27Å; W311-Y435 AromaticContact NE1-CG 3.46Å; F431-Y435 PolarHBondContact O-N 2.94Å; F431-Y435 VanDerWaalsContact O-N 3.08Å; S432-Y435 PolarHBondContact O-N 3.05Å; V433-Y435 PolarHBondContact O-N 3.17Å; Y435-V437 PolarHBondContact O-N 2.84Å; Y435-P438 WeakPolarHBondContact O-CD 3.46Å; Y435-A439 HydrophobicContact CD1-CB 4Å; Y435-A439 HydrophobicContact CE1-CB 3.75Å; Y435-A439 WeakPolarHBondContact O-CB 3.36Å; Y435-A439 PolarHBondContact O-N 3.3Å; Y435-V478 HydrophobicContact CD2-CB 4.46Å; Y435-V478 HydrophobicContact CD2-CG1 3.58Å; Y435-V478 HydrophobicContact CD2-CG2 4.13Å; Y435-V478 HydrophobicContact CE2-CB 4.22Å; Y435-V478 HydrophobicContact CE2-CG1 3.15Å; Y435-V478 HydrophobicContact CE2-CG2 3.99Å
436T93.1Very high91.1Very high26 Ų2636 Ų3616%0.1622%0.216CC..Hα-helixtrans-60.3-32.3-178.762.20000112.6W311 L390 T394 I397 S432 V433 S440W311-T436 HydrophobicContact CH2-CG2 4.23Å; W311-T436 HydrophobicContact CZ2-CG2 3.57Å; L390-T436 HydrophobicContact CD1-CG2 4.42Å; T394-T436 HydrophobicContact CG2-CG2 3.95Å; I397-T436 HydrophobicContact CD1-CG2 3.9Å; S432-T436 PolarHBondContact O-N 3.26Å; V433-T436 WeakPolarHBondContact O-CB 3.38Å; V433-T436 PolarHBondContact O-N 3.43Å; V433-T436 PolarHBondContact O-OG1 2.85Å; T436-S440 VanDerWaalsContact O-CB 3.29Å; T436-S440 WeakPolarHBondContact O-CB 3.35Å; T436-S440 PolarHBondContact O-N 2.88Å; T436-S440 PolarHBondContact O-OG 2.74Å
437V94.4Very high91.9Very high81 Ų8136.9 Ų36.949%0.49122%0.218SC..Hα-helixtrans-69.1-52.6-177173.60000112.2Y435 A439 S440 T441Y435-V437 PolarHBondContact O-N 2.84Å; V437-A439 VanDerWaalsContact C-N 3.34Å; V437-A439 PolarHBondContact O-N 2.83Å; V437-S440 PolarHBondContact O-OG 2.94Å; V437-T441 WeakPolarHBondContact O-CB 3.32Å; V437-T441 PolarHBondContact O-N 3.19Å; V437-T441 PolarHBondContact O-OG1 3.34Å
438P95.8Very high92.5Very high7 Ų737 Ų375%0.04522%0.216CC..Hα-helixtrans-59.2-42.3171.7-25.332.8000113.1L434 Y435 T441 V442 M474 L477 V478L434-P438 WeakPolarHBondContact O-CD 3.49Å; Y435-P438 WeakPolarHBondContact O-CD 3.46Å; P438-T441 PolarHBondContact O-N 3.09Å; P438-V442 WeakPolarHBondContact O-CG2 3.44Å; P438-V442 PolarHBondContact O-N 3.29Å; P438-M474 HydrophobicContact CB-CB 4.2Å; P438-M474 WeakPolarHBondContact CB-O 3.37Å; P438-M474 HydrophobicContact CB-SD 4.24Å; P438-M474 HydrophobicContact CG-SD 4.49Å; P438-L477 HydrophobicContact CG-CD2 4.25Å; P438-V478 HydrophobicContact CB-CG2 3.77Å; P438-V478 HydrophobicContact CG-CG2 4.29Å
439A95.8Very high93Very high19 Ų1937.4 Ų37.416%0.15722%0.219CC..Hα-helixtrans-64.6-44.2-17800000112.7L390 Y435 V437 T441 V442 I443L390-A439 HydrophobicContact CD1-CB 4.09Å; Y435-A439 HydrophobicContact CD1-CB 4Å; Y435-A439 HydrophobicContact CE1-CB 3.75Å; Y435-A439 WeakPolarHBondContact O-CB 3.36Å; Y435-A439 PolarHBondContact O-N 3.3Å; V437-A439 VanDerWaalsContact C-N 3.34Å; V437-A439 PolarHBondContact O-N 2.83Å; A439-T441 VanDerWaalsContact C-N 3.34Å; A439-V442 PolarHBondContact O-N 3.43Å; A439-I443 WeakPolarHBondContact O-CG1 3.41Å; A439-I443 PolarHBondContact O-N 3.26Å; A439-I443 VanDerWaalsContact O-N 3.13Å
440S97.2Very high93.6Very high57 Ų5738.3 Ų38.340%0.39922%0.222SC..Hα-helixtrans-66.4-37175.565.50000111.8T436 V437 I443 G444T436-S440 VanDerWaalsContact O-CB 3.29Å; T436-S440 WeakPolarHBondContact O-CB 3.35Å; T436-S440 PolarHBondContact O-N 2.88Å; T436-S440 PolarHBondContact O-OG 2.74Å; V437-S440 PolarHBondContact O-OG 2.94Å; S440-I443 PolarHBondContact O-N 2.04Å; S440-G444 PolarHBondContact O-N 2.81Å
441T97.9Very high94Very high37 Ų3739.1 Ų39.123%0.22723%0.231CC..Hα-helixtrans-63.7-44.5175.8-53.90000111.2V437 P438 A439 I443 G444 C445 L470 M474V437-T441 WeakPolarHBondContact O-CB 3.32Å; V437-T441 PolarHBondContact O-N 3.19Å; V437-T441 PolarHBondContact O-OG1 3.34Å; P438-T441 PolarHBondContact O-N 3.09Å; A439-T441 VanDerWaalsContact C-N 3.34Å; T441-I443 VanDerWaalsContact C-N 3.35Å; T441-I443 PolarHBondContact O-N 3.05Å; T441-G444 CarbonylContact O-C 3.6Å; T441-G444 WeakPolarHBondContact O-CA 3.47Å; T441-G444 PolarHBondContact O-N 2.96Å; T441-G444 VanDerWaalsContact O-N 3.14Å; T441-C445 PolarHBondContact O-N 3.39Å; T441-C445 PolarHBondContact O-SG 2.99Å; T441-L470 HydrophobicContact CG2-CD1 4.34Å; T441-L470 HydrophobicContact CG2-CD2 3.92Å; T441-L470 HydrophobicContact CG2-CG 4Å; T441-M474 HydrophobicContact CG2-CE 4.24Å; T441-M474 HydrophobicContact CG2-CG 3.74Å; T441-M474 HydrophobicContact CG2-SD 4.5Å
442V98Very high94.5Very high14 Ų1440.6 Ų40.69%0.08524%0.239CC..Hα-helixtrans-58.9-45.5175.8167.20000111.3P438 A439 G444 C445 Y446 R471 M474 S475P438-V442 WeakPolarHBondContact O-CG2 3.44Å; P438-V442 PolarHBondContact O-N 3.29Å; A439-V442 PolarHBondContact O-N 3.43Å; V442-G444 VanDerWaalsContact C-N 3.34Å; V442-C445 PolarHBondContact O-N 3.18Å; V442-Y446 HydrophobicContact CG1-CD2 3.96Å; V442-Y446 HydrophobicContact CG1-CE2 3.64Å; V442-Y446 VanDerWaalsContact O-CD2 3.22Å; V442-Y446 WeakPolarHBondContact O-CD2 3.15Å; V442-Y446 PolarHBondContact O-N 3.43Å; V442-Y446 VanDerWaalsContact O-N 3.09Å; V442-R471 HydrophobicContact CG1-CG 4.2Å; V442-M474 HydrophobicContact CG2-CB 3.78Å; V442-S475 WeakPolarHBondContact CG2-OG 3.46Å
443I98.1Very high94.7Very high18 Ų1842.1 Ų42.19%0.09225%0.245CC..Hα-helixtrans-63.2-42.1175.5-65.9165.7000110.6L386 L390 A439 S440 T441 C445 Y446 L447L386-I443 HydrophobicContact CB-CD1 4.07Å; L386-I443 HydrophobicContact CB-CG1 4.01Å; L390-I443 HydrophobicContact CB-CD1 4.08Å; L390-I443 HydrophobicContact CD2-CD1 3.69Å; A439-I443 WeakPolarHBondContact O-CG1 3.41Å; A439-I443 PolarHBondContact O-N 3.26Å; A439-I443 VanDerWaalsContact O-N 3.13Å; S440-I443 PolarHBondContact O-N 2.04Å; T441-I443 VanDerWaalsContact C-N 3.35Å; T441-I443 PolarHBondContact O-N 3.05Å; I443-C445 VanDerWaalsContact C-N 3.34Å; I443-C445 PolarHBondContact O-N 2.72Å; I443-Y446 PolarHBondContact O-N 3.22Å; I443-L447 HydrophobicContact CG2-CD1 4.07Å; I443-L447 HydrophobicContact CG2-CG 4.3Å; I443-L447 WeakPolarHBondContact O-CG 3.47Å; I443-L447 PolarHBondContact O-N 3.21Å
444G98.1Very high94.9Very high36 Ų3645.5 Ų45.537%0.37126%0.257SS..Hα-helixtrans-58.7-41.8175.300000112.9S440 T441 V442 L447 Y448S440-G444 PolarHBondContact O-N 2.81Å; T441-G444 CarbonylContact O-C 3.6Å; T441-G444 WeakPolarHBondContact O-CA 3.47Å; T441-G444 PolarHBondContact O-N 2.96Å; T441-G444 VanDerWaalsContact O-N 3.14Å; V442-G444 VanDerWaalsContact C-N 3.34Å; G444-L447 PolarHBondContact O-N 2.8Å; G444-Y448 WeakPolarHBondContact O-CB 3.49Å; G444-Y448 PolarHBondContact O-N 3.18Å
445C97.8Very high94.8Very high8 Ų844.2 Ų44.25%0.05425%0.248CC..Hα-helixtrans-61.3-44.9173.5-66.80000111.6T441 V442 I443 Y448 Q449 S467 R471T441-C445 PolarHBondContact O-N 3.39Å; T441-C445 PolarHBondContact O-SG 2.99Å; V442-C445 PolarHBondContact O-N 3.18Å; I443-C445 VanDerWaalsContact C-N 3.34Å; I443-C445 PolarHBondContact O-N 2.72Å; C445-Y448 WeakPolarHBondContact O-CB 3.42Å; C445-Y448 PolarHBondContact O-N 3.42Å; C445-Q449 WeakPolarHBondContact O-CG 3.3Å; C445-Q449 PolarHBondContact O-N 3.46Å; C445-S467 PolarHBondContact SG-O 3.18Å; C445-R471 HydrophobicContact CB-CB 3.96Å; C445-R471 HydrophobicContact CB-CG 4.38Å
446Y97.1Very high94.8Very high6 Ų644.4 Ų44.42%0.02425%0.249CC..Hα-helixtrans-62.4-43.9175.7-77-60.4000112.6L378 V382 V383 L386 V442 I443 Y448 Q449 L450 R471L378-Y446 HydrophobicContact CD1-CD1 3.96Å; L378-Y446 HydrophobicContact CD1-CE1 3.79Å; L378-Y446 HydrophobicContact CD2-CD1 4.39Å; V382-Y446 HydrophobicContact CG1-CD2 4.42Å; V382-Y446 HydrophobicContact CG1-CE1 4.28Å; V382-Y446 HydrophobicContact CG1-CE2 3.79Å; V383-Y446 HydrophobicContact CG2-CG 4.06Å; L386-Y446 HydrophobicContact CD1-CE2 4.11Å; V442-Y446 HydrophobicContact CG1-CD2 3.96Å; V442-Y446 HydrophobicContact CG1-CE2 3.64Å; V442-Y446 VanDerWaalsContact O-CD2 3.22Å; V442-Y446 WeakPolarHBondContact O-CD2 3.15Å; V442-Y446 PolarHBondContact O-N 3.43Å; V442-Y446 VanDerWaalsContact O-N 3.09Å; I443-Y446 PolarHBondContact O-N 3.22Å; Y446-Y448 VanDerWaalsContact C-N 3.3Å; Y446-Y448 PolarHBondContact O-N 2.77Å; Y446-Q449 PolarHBondContact O-N 3.29Å; Y446-L450 WeakPolarHBondContact O-CB 3.49Å; Y446-L450 VanDerWaalsContact O-CG 3.28Å; Y446-L450 WeakPolarHBondContact O-CG 3.29Å; Y446-L450 PolarHBondContact O-N 3.3Å; Y446-R471 VanDerWaalsContact CZ-NH1 3.28Å; Y446-R471 PolarHBondContact OH-NH1 3.3Å
447L97.3Very high94.3Very high93 Ų9348.9 Ų48.949%0.48727%0.266SS..Hα-helixtrans-63.4-38176.9-68.7175.6000111.7V383 I443 G444 L450 S451V383-L447 HydrophobicContact CG1-CD2 4.02Å; I443-L447 HydrophobicContact CG2-CD1 4.07Å; I443-L447 HydrophobicContact CG2-CG 4.3Å; I443-L447 WeakPolarHBondContact O-CG 3.47Å; I443-L447 PolarHBondContact O-N 3.21Å; G444-L447 PolarHBondContact O-N 2.8Å; L447-L450 PolarHBondContact O-N 2.94Å; L447-S451 WeakPolarHBondContact O-CB 3.45Å; L447-S451 PolarHBondContact O-N 3.49Å
448Y96.6Very high93.5Very high97 Ų9747.7 Ų47.738%0.3826%0.259SS..Hα-helixtrans-63.4-43.9174.4178.4-106.6000111.9G444 C445 Y446 S451 N452 F456 S463G444-Y448 WeakPolarHBondContact O-CB 3.49Å; G444-Y448 PolarHBondContact O-N 3.18Å; C445-Y448 WeakPolarHBondContact O-CB 3.42Å; C445-Y448 PolarHBondContact O-N 3.42Å; Y446-Y448 VanDerWaalsContact C-N 3.3Å; Y446-Y448 PolarHBondContact O-N 2.77Å; Y448-S451 PolarHBondContact O-N 3.15Å; Y448-N452 WeakPolarHBondContact CE2-ND2 3.27Å; Y448-N452 PolarHBondContact O-N 3.15Å; Y448-N452 PolarHBondContact O-ND2 3.38Å; Y448-F456 HydrophobicContact CD1-CE2 4.36Å; Y448-F456 HydrophobicContact CE1-CE2 4.05Å; Y448-F456 AromaticContact CE1-CZ 3.78Å; Y448-F456 HydrophobicContact CE1-CZ 3.78Å; Y448-S463 WeakPolarHBondContact OH-CB 3.45Å
449Q94Very high92.8Very high11 Ų1149 Ų495%0.05127%0.269CS..Hα-helixtrans-63.4-44.6175-70.5172.1-0.300111.7C445 Y446 S451 N452 W453 Y464 S467 E468C445-Q449 WeakPolarHBondContact O-CG 3.3Å; C445-Q449 PolarHBondContact O-N 3.46Å; Y446-Q449 PolarHBondContact O-N 3.29Å; Q449-S451 PolarHBondContact O-N 3Å; Q449-N452 CarbonylContact O-C 3.49Å; Q449-N452 PolarHBondContact O-N 2.89Å; Q449-W453 WeakPolarHBondContact O-CA 3.36Å; Q449-W453 PolarHBondContact O-N 3.18Å; Q449-W453 VanDerWaalsContact O-N 3.12Å; Q449-Y464 HydrophobicContact CG-CD2 4.14Å; Q449-Y464 HydrophobicContact CG-CE2 4.11Å; Q449-S467 PolarHBondContact NE2-OG 2.04Å; Q449-E468 PolarHBondContact NE2-OE2 2.86Å
450L94.4Very high92.3Very high24 Ų2451.3 Ų51.313%0.12628%0.282CS..Hα-helixtrans-62.9-39.3176.7-73.3172.5000112.5Q375 L378 V383 Y446 L447 N452 W453Q375-L450 HydrophobicContact CG-CD2 3.49Å; Q375-L450 VanDerWaalsContact CG-CD2 3.49Å; L378-L450 HydrophobicContact CD2-CD2 3.88Å; L378-L450 HydrophobicContact CD2-CG 4.3Å; L378-L450 HydrophobicContact CG-CD2 4.38Å; V383-L450 HydrophobicContact CG2-CD1 3.91Å; Y446-L450 WeakPolarHBondContact O-CB 3.49Å; Y446-L450 VanDerWaalsContact O-CG 3.28Å; Y446-L450 WeakPolarHBondContact O-CG 3.29Å; Y446-L450 PolarHBondContact O-N 3.3Å; L447-L450 PolarHBondContact O-N 2.94Å; L450-N452 PolarHBondContact O-N 3.43Å; L450-W453 HydrophobicContact CD2-CE3 4.32Å; L450-W453 WeakPolarHBondContact O-CB 3.36Å; L450-W453 PolarHBondContact O-N 3.35Å
451S95.3Very high92Very high98 Ų9854 Ų5469%0.68528%0.283SS*.Hα-helixtrans-67.4-23.2179.2-175.40000113.4L447 Y448 Q449L447-S451 WeakPolarHBondContact O-CB 3.45Å; L447-S451 PolarHBondContact O-N 3.49Å; Y448-S451 PolarHBondContact O-N 3.15Å; Q449-S451 PolarHBondContact O-N 3Å
452N94.3Very high91.6Very high44 Ų4458.9 Ų58.924%0.23531%0.309CS..THydrogen-bonded Turntrans-118.625.6-177.5-59.4-83.7000111.5Y448 Q449 L450 E454 E455 F456Y448-N452 WeakPolarHBondContact CE2-ND2 3.27Å; Y448-N452 PolarHBondContact O-N 3.15Å; Y448-N452 PolarHBondContact O-ND2 3.38Å; Q449-N452 CarbonylContact O-C 3.49Å; Q449-N452 PolarHBondContact O-N 2.89Å; L450-N452 PolarHBondContact O-N 3.43Å; N452-E454 PolarHBondContact O-N 3.24Å; N452-E455 PolarHBondContact O-N 2.9Å; N452-F456 HydrophobicContact CB-CD2 3.99Å; N452-F456 HydrophobicContact CB-CE1 4.17Å; N452-F456 HydrophobicContact CB-CE2 3.62Å; N452-F456 HydrophobicContact CB-CG 4.46Å; N452-F456 HydrophobicContact CB-CZ 3.71Å; N452-F456 WeakPolarHBondContact O-CG 3.29Å; N452-F456 PolarHBondContact O-N 3.22Å; N452-F456 VanDerWaalsContact O-N 3.09Å
453W90.4Very high91.4Very high33 Ų3361.2 Ų61.213%0.12533%0.325CS..Hα-helixtrans-55-51.2-169.7-178.5-94.2000113.7G371 N372 Q373 Q375 L378 Q449 L450 E455 F456 K457G371-W453 WeakPolarHBondContact O-CH2 3.08Å; N372-W453 VanDerWaalsContact O-CH2 3.31Å; N372-W453 WeakPolarHBondContact O-CH2 3.33Å; Q373-W453 VanDerWaalsContact C-CZ2 3.5Å; Q375-W453 HydrophobicContact CB-CD2 4.13Å; Q375-W453 HydrophobicContact CB-CE3 4.5Å; Q375-W453 HydrophobicContact CB-CZ2 4.13Å; Q375-W453 HydrophobicContact CG-CD2 4.32Å; L378-W453 HydrophobicContact CD2-CZ3 3.89Å; Q449-W453 WeakPolarHBondContact O-CA 3.36Å; Q449-W453 PolarHBondContact O-N 3.18Å; Q449-W453 VanDerWaalsContact O-N 3.12Å; L450-W453 HydrophobicContact CD2-CE3 4.32Å; L450-W453 WeakPolarHBondContact O-CB 3.36Å; L450-W453 PolarHBondContact O-N 3.35Å; W453-E455 VanDerWaalsContact C-N 3.29Å; W453-E455 PolarHBondContact O-N 3.27Å; W453-F456 PolarHBondContact O-N 3.47Å; W453-K457 WeakPolarHBondContact O-CB 3.46Å; W453-K457 PolarHBondContact O-N 3.34Å
454E88.6Confident91.2Very high134 Ų13461.5 Ų61.563%0.62633%0.325SS*.Hα-helixtrans-59.1-40.3-178.8-66.1-56132.700112.5N452 T458N452-E454 PolarHBondContact O-N 3.24Å; E454-T458 PolarHBondContact O-OG1 2.82Å
455E87.4Confident91Very high72 Ų7260.6 Ų60.634%0.33631%0.313SS..Hα-helixtrans-68.4-46.8179.5-174.5173.7-172.100111.5N452 W453 K457 T458 S459 R461N452-E455 PolarHBondContact O-N 2.9Å; W453-E455 VanDerWaalsContact C-N 3.29Å; W453-E455 PolarHBondContact O-N 3.27Å; E455-K457 VanDerWaalsContact C-N 3.3Å; E455-K457 PolarHBondContact O-N 3.35Å; E455-T458 PolarHBondContact O-N 2.93Å; E455-T458 PolarHBondContact O-OG1 3.01Å; E455-S459 PolarHBondContact O-N 3Å; E455-R461 HydrophobicContact CG-CG 4.32Å; E455-R461 IonicContact OE1-CZ 2.58Å; E455-R461 IonicContact OE1-NE 3.25Å; E455-R461 PolarHBondContact OE1-NE 3.27Å; E455-R461 IonicContact OE1-NH2 3.4Å; E455-R461 PolarHBondContact OE1-NH2 2.96Å
456F89.1Confident90.9Very high17 Ų1763.2 Ų63.28%0.07533%0.334CS..Hα-helixtrans-70.1-25.4-178-64.3-20000113.8Y448 N452 W453 R461 Y464Y448-F456 HydrophobicContact CD1-CE2 4.36Å; Y448-F456 HydrophobicContact CE1-CE2 4.05Å; Y448-F456 AromaticContact CE1-CZ 3.78Å; Y448-F456 HydrophobicContact CE1-CZ 3.78Å; N452-F456 HydrophobicContact CB-CD2 3.99Å; N452-F456 HydrophobicContact CB-CE1 4.17Å; N452-F456 HydrophobicContact CB-CE2 3.62Å; N452-F456 HydrophobicContact CB-CG 4.46Å; N452-F456 HydrophobicContact CB-CZ 3.71Å; N452-F456 WeakPolarHBondContact O-CG 3.29Å; N452-F456 PolarHBondContact O-N 3.22Å; N452-F456 VanDerWaalsContact O-N 3.09Å; W453-F456 PolarHBondContact O-N 3.47Å; F456-R461 HydrophobicContact CD1-CB 3.94Å; F456-R461 HydrophobicContact CD1-CG 3.98Å; F456-R461 HydrophobicContact CE1-CB 3.81Å; F456-R461 HydrophobicContact CE1-CG 4.03Å; F456-Y464 HydrophobicContact CB-CD2 4.06Å; F456-Y464 AromaticContact CD2-CD2 3.57Å; F456-Y464 HydrophobicContact CD2-CD2 3.57Å; F456-Y464 HydrophobicContact CD2-CE2 4.47Å; F456-Y464 HydrophobicContact CD2-CG 4.34Å; F456-Y464 HydrophobicContact CE2-CD2 4.11Å; F456-Y464 AromaticContact CG-CD2 3.87Å; F456-Y464 HydrophobicContact CG-CD2 3.87Å; F456-Y464 HydrophobicContact CG-CG 4.33Å
457K82.8Confident90.9Very high120 Ų12063.4 Ų63.452%0.52234%0.337SS..Hα-helixtrans-70.8-31.2176.6-171174.9178.6-178.90113W453 E455W453-K457 WeakPolarHBondContact O-CB 3.46Å; W453-K457 PolarHBondContact O-N 3.34Å; E455-K457 VanDerWaalsContact C-N 3.3Å; E455-K457 PolarHBondContact O-N 3.35Å
458T77.1Confident90.8Very high56 Ų5659 Ų5934%0.34431%0.314SS..Hα-helixtrans-103.4-26.5-171.358.90000113.8E454 E455E454-T458 PolarHBondContact O-OG1 2.82Å; E455-T458 PolarHBondContact O-N 2.93Å; E455-T458 PolarHBondContact O-OG1 3.01Å
459S82.2Confident90.9Very high35 Ų3555 Ų5525%0.24530%0.299CS..SBendtrans-135.3134.1-169.6-67.20000112.4E455 R461E455-S459 PolarHBondContact O-N 3Å; S459-R461 PolarHBondContact O-N 3.31Å; S459-R461 VanDerWaalsContact O-N 3.16Å
460P85.1Confident91.1Very high67 Ų6757.8 Ų57.844%0.43531%0.314SS..  trans-68.1117.217427-30000109.5L201 Y202L201-P460 HydrophobicContact CG-CB 4.11Å; L201-P460 HydrophobicContact CG-CG 4.5Å; L201-P460 WeakPolarHBondContact O-CB 3.5Å; Y202-P460 HydrophobicContact CD1-CB 4.14Å; Y202-P460 HydrophobicContact CE1-CB 4.09Å
461R90.1Very high91.2Very high113 Ų11357.4 Ų57.443%0.42631%0.311SS..  trans-117.8131.7176.5-67.7-60.3-160.9-172.32111.3E455 F456 S459 S463 Y464 V465E455-R461 HydrophobicContact CG-CG 4.32Å; E455-R461 IonicContact OE1-CZ 2.58Å; E455-R461 IonicContact OE1-NE 3.25Å; E455-R461 PolarHBondContact OE1-NE 3.27Å; E455-R461 IonicContact OE1-NH2 3.4Å; E455-R461 PolarHBondContact OE1-NH2 2.96Å; F456-R461 HydrophobicContact CD1-CB 3.94Å; F456-R461 HydrophobicContact CD1-CG 3.98Å; F456-R461 HydrophobicContact CE1-CB 3.81Å; F456-R461 HydrophobicContact CE1-CG 4.03Å; S459-R461 PolarHBondContact O-N 3.31Å; S459-R461 VanDerWaalsContact O-N 3.16Å; R461-S463 PolarHBondContact O-N 3.18Å; R461-Y464 WeakPolarHBondContact O-CB 2.73Å; R461-Y464 PolarHBondContact O-N 3.35Å; R461-Y464 VanDerWaalsContact O-N 3.08Å; R461-V465 PolarHBondContact O-N 3.02Å
462D90.1Very high91.3Very high141 Ų14152.8 Ų52.875%0.75428%0.278SS*.Hα-helixtrans-60.5-31.1173.3-64.9-25.3000111.7Y464 V465 A466D462-Y464 VanDerWaalsContact C-N 3.32Å; D462-Y464 PolarHBondContact O-N 2.98Å; D462-V465 WeakPolarHBondContact O-CB 3.5Å; D462-V465 PolarHBondContact O-N 3.48Å; D462-A466 WeakPolarHBondContact O-CB 3.24Å; D462-A466 PolarHBondContact O-N 3.37Å
463S93.4Very high91.5Very high62 Ų6252.7 Ų52.743%0.43428%0.276SS..Hα-helixtrans-62.4-36.6175-54.20000112.9Y448 R461 S467Y448-S463 WeakPolarHBondContact OH-CB 3.45Å; R461-S463 PolarHBondContact O-N 3.18Å; S463-S467 WeakPolarHBondContact O-CB 3.34Å; S463-S467 PolarHBondContact O-N 2.85Å; S463-S467 PolarHBondContact O-OG 3.19Å
464Y93.3Very high91.9Very high25 Ų2552.6 Ų52.610%0.09828%0.277CS..Hα-helixtrans-64.3-50172.6177.6-94.3000109.9Y202 D362 L364 Q449 F456 R461 D462 A466 S467 E468Y202-Y464 HydrophobicContact CE1-CD1 4.42Å; Y202-Y464 HydrophobicContact CE2-CD1 4.33Å; Y202-Y464 HydrophobicContact CE2-CE1 4.36Å; Y202-Y464 AromaticContact CZ-CD1 3.68Å; Y202-Y464 WeakPolarHBondContact OH-CD1 3.21Å; D362-Y464 PolarHBondContact OD1-OH 3.29Å; L364-Y464 HydrophobicContact CB-CE1 4.4Å; L364-Y464 HydrophobicContact CD2-CD1 3.95Å; L364-Y464 HydrophobicContact CD2-CE1 3.88Å; Q449-Y464 HydrophobicContact CG-CD2 4.14Å; Q449-Y464 HydrophobicContact CG-CE2 4.11Å; F456-Y464 HydrophobicContact CB-CD2 4.06Å; F456-Y464 AromaticContact CD2-CD2 3.57Å; F456-Y464 HydrophobicContact CD2-CD2 3.57Å; F456-Y464 HydrophobicContact CD2-CE2 4.47Å; F456-Y464 HydrophobicContact CD2-CG 4.34Å; F456-Y464 HydrophobicContact CE2-CD2 4.11Å; F456-Y464 AromaticContact CG-CD2 3.87Å; F456-Y464 HydrophobicContact CG-CD2 3.87Å; F456-Y464 HydrophobicContact CG-CG 4.33Å; R461-Y464 WeakPolarHBondContact O-CB 2.73Å; R461-Y464 PolarHBondContact O-N 3.35Å; R461-Y464 VanDerWaalsContact O-N 3.08Å; D462-Y464 VanDerWaalsContact C-N 3.32Å; D462-Y464 PolarHBondContact O-N 2.98Å; Y464-A466 VanDerWaalsContact C-N 3.31Å; Y464-A466 PolarHBondContact O-N 3.18Å; Y464-S467 PolarHBondContact O-N 3.03Å; Y464-S467 VanDerWaalsContact O-N 3.13Å; Y464-S467 PolarHBondContact O-OG 3.47Å; Y464-E468 HydrophobicContact CE1-CB 4.49Å; Y464-E468 HydrophobicContact CE1-CG 4.49Å; Y464-E468 VanDerWaalsContact O-CB 3.28Å; Y464-E468 WeakPolarHBondContact O-CB 3.28Å; Y464-E468 PolarHBondContact O-N 3.4Å
465V94.9Very high92.3Very high17 Ų1747.2 Ų47.210%0.10325%0.254CS..Hα-helixtrans-54.4-48.2178.5-177.90000110.8Y202 L364 R461 D462 E468 M469Y202-V465 HydrophobicContact CD1-CG2 3.9Å; Y202-V465 HydrophobicContact CE1-CG2 3.58Å; L364-V465 HydrophobicContact CD1-CG2 4.13Å; L364-V465 HydrophobicContact CD2-CB 4.18Å; L364-V465 HydrophobicContact CD2-CG1 4.2Å; L364-V465 HydrophobicContact CD2-CG2 3.89Å; R461-V465 PolarHBondContact O-N 3.02Å; D462-V465 WeakPolarHBondContact O-CB 3.5Å; D462-V465 PolarHBondContact O-N 3.48Å; V465-E468 PolarHBondContact O-N 3Å; V465-M469 HydrophobicContact CG1-CG 4.31Å; V465-M469 VanDerWaalsContact O-CG 3.27Å; V465-M469 WeakPolarHBondContact O-CG 3.3Å; V465-M469 PolarHBondContact O-N 2.85Å
466A96.2Very high92.8Very high62 Ų6243.9 Ų43.951%0.51224%0.239SC..Hα-helixtrans-62.4-45.1178.500000112.5D462 Y464 E468 M469 L470D462-A466 WeakPolarHBondContact O-CB 3.24Å; D462-A466 PolarHBondContact O-N 3.37Å; Y464-A466 VanDerWaalsContact C-N 3.31Å; Y464-A466 PolarHBondContact O-N 3.18Å; A466-E468 PolarHBondContact O-N 2.95Å; A466-M469 PolarHBondContact O-N 3.26Å; A466-L470 WeakPolarHBondContact O-CB 3.15Å; A466-L470 PolarHBondContact O-N 3.22Å
467S96.4Very high93.1Very high11 Ų1145 Ų458%0.07725%0.246CC..Hα-helixtrans-59.9-38.7176.778.30000111.9C445 Q449 S463 Y464 R471C445-S467 PolarHBondContact SG-O 3.18Å; Q449-S467 PolarHBondContact NE2-OG 2.04Å; S463-S467 WeakPolarHBondContact O-CB 3.34Å; S463-S467 PolarHBondContact O-N 2.85Å; S463-S467 PolarHBondContact O-OG 3.19Å; Y464-S467 PolarHBondContact O-N 3.03Å; Y464-S467 VanDerWaalsContact O-N 3.13Å; Y464-S467 PolarHBondContact O-OG 3.47Å; S467-R471 WeakPolarHBondContact O-CB 3.41Å; S467-R471 PolarHBondContact O-N 3.46Å
468E95.9Very high93.6Very high1 Ų139.7 Ų39.71%0.00522%0.223CC..Hα-helixtrans-74-42.1-177.3-170.945-126.700111.4L364 T365 Q449 Y464 V465 A466 L470 R471 I472L364-E468 HydrophobicContact CD2-CB 4.28Å; L364-E468 HydrophobicContact CD2-CG 4.16Å; T365-E468 HydrophobicContact CG2-CG 4.01Å; Q449-E468 PolarHBondContact NE2-OE2 2.86Å; Y464-E468 HydrophobicContact CE1-CB 4.49Å; Y464-E468 HydrophobicContact CE1-CG 4.49Å; Y464-E468 VanDerWaalsContact O-CB 3.28Å; Y464-E468 WeakPolarHBondContact O-CB 3.28Å; Y464-E468 PolarHBondContact O-N 3.4Å; V465-E468 PolarHBondContact O-N 3Å; A466-E468 PolarHBondContact O-N 2.95Å; E468-L470 VanDerWaalsContact C-N 3.32Å; E468-L470 PolarHBondContact O-N 3.39Å; E468-R471 VanDerWaalsContact CD-NE 3.3Å; E468-R471 VanDerWaalsContact CD-NH2 3.28Å; E468-R471 WeakPolarHBondContact O-CB 3.32Å; E468-R471 PolarHBondContact O-N 2.85Å; E468-R471 IonicContact OE1-CZ 3.89Å; E468-R471 IonicContact OE1-NE 3.83Å; E468-R471 PolarHBondContact OE1-NE 3.3Å; E468-R471 IonicContact OE1-NH2 3.83Å; E468-R471 PolarHBondContact OE1-NH2 3.44Å; E468-R471 IonicContact OE2-CZ 2.77Å; E468-R471 VanDerWaalsContact OE2-CZ 3.25Å; E468-R471 IonicContact OE2-NE 2.91Å; E468-R471 PolarHBondContact OE2-NE 3.47Å; E468-R471 IonicContact OE2-NH2 3.14Å; E468-R471 PolarHBondContact OE2-NH2 2.92Å; E468-I472 HydrophobicContact CG-CD1 4.45Å; E468-I472 WeakPolarHBondContact O-CG1 3.37Å; E468-I472 PolarHBondContact O-N 3.19Å
469M97.3Very high94.4Very high12 Ų1237 Ų376%0.05921%0.207CC..Hα-helixtrans-63.9-39.1175-68.8-47.1100.700111.8F209 T210 W213 L364 V465 A466 I472 F473F209-M469 HydrophobicContact CE1-CG 4.1Å; T210-M469 HydrophobicContact CG2-CE 3.44Å; T210-M469 VanDerWaalsContact CG2-CE 3.44Å; T210-M469 HydrophobicContact CG2-SD 4.09Å; W213-M469 HydrophobicContact CB-SD 3.96Å; W213-M469 HydrophobicContact CG-CG 4.48Å; W213-M469 HydrophobicContact CG-SD 3.76Å; W213-M469 PolarHBondContact NE1-O 3.41Å; W213-M469 VanDerWaalsContact NE1-O 3.08Å; L364-M469 HydrophobicContact CD2-CE 4.24Å; V465-M469 HydrophobicContact CG1-CG 4.31Å; V465-M469 VanDerWaalsContact O-CG 3.27Å; V465-M469 WeakPolarHBondContact O-CG 3.3Å; V465-M469 PolarHBondContact O-N 2.85Å; A466-M469 PolarHBondContact O-N 3.26Å; M469-I472 HydrophobicContact CE-CD1 4.09Å; M469-F473 WeakPolarHBondContact O-CB 3.46Å; M469-F473 PolarHBondContact O-N 2.71Å
470L98.1Very high94.9Very high70 Ų7037 Ų3737%0.36620%0.203SC..Hα-helixtrans-64.7-44.8174.7-179.261.6000111.4T441 A466 E468 I472 F473 M474T441-L470 HydrophobicContact CG2-CD1 4.34Å; T441-L470 HydrophobicContact CG2-CD2 3.92Å; T441-L470 HydrophobicContact CG2-CG 4Å; A466-L470 WeakPolarHBondContact O-CB 3.15Å; A466-L470 PolarHBondContact O-N 3.22Å; E468-L470 VanDerWaalsContact C-N 3.32Å; E468-L470 PolarHBondContact O-N 3.39Å; L470-I472 PolarHBondContact O-N 2.8Å; L470-F473 HydrophobicContact CD1-CD1 4.39Å; L470-F473 PolarHBondContact O-N 3.07Å; L470-M474 HydrophobicContact CD1-CE 3.74Å; L470-M474 HydrophobicContact CD1-CG 3.98Å; L470-M474 HydrophobicContact CG-CG 4.4Å; L470-M474 WeakPolarHBondContact O-CB 3.46Å; L470-M474 VanDerWaalsContact O-CG 3.3Å; L470-M474 WeakPolarHBondContact O-CG 3.38Å; L470-M474 PolarHBondContact O-N 3.26Å
471R97.8Very high95.1Very high16 Ų1635 Ų356%0.0619%0.19CC..Hα-helixtrans-56.2-50.1175.9-175.6-171.176.2147.7-2.5111.4V442 C445 Y446 S467 E468 M474 S475V442-R471 HydrophobicContact CG1-CG 4.2Å; C445-R471 HydrophobicContact CB-CB 3.96Å; C445-R471 HydrophobicContact CB-CG 4.38Å; Y446-R471 VanDerWaalsContact CZ-NH1 3.28Å; Y446-R471 PolarHBondContact OH-NH1 3.3Å; S467-R471 WeakPolarHBondContact O-CB 3.41Å; S467-R471 PolarHBondContact O-N 3.46Å; E468-R471 VanDerWaalsContact CD-NE 3.3Å; E468-R471 VanDerWaalsContact CD-NH2 3.28Å; E468-R471 WeakPolarHBondContact O-CB 3.32Å; E468-R471 PolarHBondContact O-N 2.85Å; E468-R471 IonicContact OE1-CZ 3.89Å; E468-R471 IonicContact OE1-NE 3.83Å; E468-R471 PolarHBondContact OE1-NE 3.3Å; E468-R471 IonicContact OE1-NH2 3.83Å; E468-R471 PolarHBondContact OE1-NH2 3.44Å; E468-R471 IonicContact OE2-CZ 2.77Å; E468-R471 VanDerWaalsContact OE2-CZ 3.25Å; E468-R471 IonicContact OE2-NE 2.91Å; E468-R471 PolarHBondContact OE2-NE 3.47Å; E468-R471 IonicContact OE2-NH2 3.14Å; E468-R471 PolarHBondContact OE2-NH2 2.92Å; R471-M474 PolarHBondContact O-N 3.13Å; R471-S475 WeakPolarHBondContact O-CB 3.05Å; R471-S475 PolarHBondContact O-N 3.23Å; R471-S475 PolarHBondContact O-OG 2.64Å
472I97.9Very high94.9Very high0 Ų029.6 Ų29.60%017%0.169CC..Hα-helixtrans-62.6-48.1179.7-68.8168.3000110.6M214 Y260 T365 E468 M469 L470 M474 S475 L476M214-I472 HydrophobicContact CG-CD1 4.04Å; M214-I472 HydrophobicContact CG-CG2 4.29Å; M214-I472 HydrophobicContact SD-CD1 4.21Å; Y260-I472 HydrophobicContact CE1-CD1 4.48Å; Y260-I472 HydrophobicContact CE1-CG1 4.29Å; Y260-I472 HydrophobicContact CE1-CG2 3.88Å; T365-I472 HydrophobicContact CG2-CD1 3.98Å; E468-I472 HydrophobicContact CG-CD1 4.45Å; E468-I472 WeakPolarHBondContact O-CG1 3.37Å; E468-I472 PolarHBondContact O-N 3.19Å; M469-I472 HydrophobicContact CE-CD1 4.09Å; L470-I472 PolarHBondContact O-N 2.8Å; I472-M474 PolarHBondContact O-N 3.17Å; I472-S475 PolarHBondContact O-N 2.7Å; I472-L476 HydrophobicContact CG2-CD1 3.81Å; I472-L476 WeakPolarHBondContact O-CG 3.43Å; I472-L476 PolarHBondContact O-N 3.06Å
473F98.1Very high94.3Very high43 Ų4322.9 Ų22.919%0.18913%0.133CC..Hα-helixtrans-57.3-51.1178.2165.8-111.9000111.5W213 W217 M469 L470 S475 L476 L477W213-F473 HydrophobicContact CZ2-CB 4.07Å; W213-F473 HydrophobicContact CZ2-CG 4.46Å; W217-F473 AromaticContact CD2-CD2 3.63Å; W217-F473 HydrophobicContact CD2-CD2 3.63Å; W217-F473 HydrophobicContact CD2-CE2 4.1Å; W217-F473 AromaticContact CE2-CD2 3.46Å; W217-F473 VanDerWaalsContact CE2-CD2 3.46Å; W217-F473 AromaticContact CE2-CE2 3.9Å; W217-F473 AromaticContact CE3-CD2 3.9Å; W217-F473 HydrophobicContact CE3-CD2 3.9Å; W217-F473 AromaticContact CE3-CE2 3.94Å; W217-F473 HydrophobicContact CE3-CE2 3.94Å; W217-F473 HydrophobicContact CG-CD2 4.23Å; W217-F473 AromaticContact CH2-CD2 3.9Å; W217-F473 HydrophobicContact CH2-CD2 3.9Å; W217-F473 AromaticContact CH2-CE2 3.41Å; W217-F473 HydrophobicContact CH2-CE2 3.41Å; W217-F473 VanDerWaalsContact CH2-CE2 3.41Å; W217-F473 HydrophobicContact CH2-CZ 4.42Å; W217-F473 AromaticContact CZ2-CD2 3.61Å; W217-F473 HydrophobicContact CZ2-CD2 3.61Å; W217-F473 AromaticContact CZ2-CE2 3.56Å; W217-F473 HydrophobicContact CZ2-CE2 3.56Å; W217-F473 HydrophobicContact CZ3-CD2 4.03Å; W217-F473 AromaticContact CZ3-CE2 3.61Å; W217-F473 HydrophobicContact CZ3-CE2 3.61Å; W217-F473 AromaticContact NE1-CD2 3.93Å; M469-F473 WeakPolarHBondContact O-CB 3.46Å; M469-F473 PolarHBondContact O-N 2.71Å; L470-F473 HydrophobicContact CD1-CD1 4.39Å; L470-F473 PolarHBondContact O-N 3.07Å; F473-S475 VanDerWaalsContact C-N 3.32Å; F473-S475 PolarHBondContact O-N 3.42Å; F473-L476 PolarHBondContact O-N 3.39Å; F473-L477 HydrophobicContact CE1-CD2 4.1Å; F473-L477 HydrophobicContact CE2-CB 4.47Å; F473-L477 HydrophobicContact CE2-CD1 4.37Å; F473-L477 HydrophobicContact CZ-CD1 4.28Å; F473-L477 HydrophobicContact CZ-CD2 3.89Å; F473-L477 HydrophobicContact CZ-CG 4.47Å; F473-L477 VanDerWaalsContact O-CB 3.29Å; F473-L477 WeakPolarHBondContact O-CB 3.31Å; F473-L477 PolarHBondContact O-N 2.89Å
474M97.8Very high93.5Very high30 Ų3024.7 Ų24.715%0.14814%0.136CC..Hα-helixtrans-63.9-37-179.1-70.6-64.1178.700112.2P438 T441 V442 L470 R471 I472 L476 L477P438-M474 HydrophobicContact CB-CB 4.2Å; P438-M474 WeakPolarHBondContact CB-O 3.37Å; P438-M474 HydrophobicContact CB-SD 4.24Å; P438-M474 HydrophobicContact CG-SD 4.49Å; T441-M474 HydrophobicContact CG2-CE 4.24Å; T441-M474 HydrophobicContact CG2-CG 3.74Å; T441-M474 HydrophobicContact CG2-SD 4.5Å; V442-M474 HydrophobicContact CG2-CB 3.78Å; L470-M474 HydrophobicContact CD1-CE 3.74Å; L470-M474 HydrophobicContact CD1-CG 3.98Å; L470-M474 HydrophobicContact CG-CG 4.4Å; L470-M474 WeakPolarHBondContact O-CB 3.46Å; L470-M474 VanDerWaalsContact O-CG 3.3Å; L470-M474 WeakPolarHBondContact O-CG 3.38Å; L470-M474 PolarHBondContact O-N 3.26Å; R471-M474 PolarHBondContact O-N 3.13Å; I472-M474 PolarHBondContact O-N 3.17Å; M474-L476 PolarHBondContact O-N 3.2Å; M474-L477 PolarHBondContact O-N 3.18Å; M474-L477 HydrophobicContact SD-CD2 3.99Å
475S97.2Very high92.6Very high22 Ų2224.3 Ų24.315%0.15414%0.135CC..Hα-helixtrans-63.6-40.4175.5-57.80000112.3V442 R471 I472 F473V442-S475 WeakPolarHBondContact CG2-OG 3.46Å; R471-S475 WeakPolarHBondContact O-CB 3.05Å; R471-S475 PolarHBondContact O-N 3.23Å; R471-S475 PolarHBondContact O-OG 2.64Å; I472-S475 PolarHBondContact O-N 2.7Å; F473-S475 VanDerWaalsContact C-N 3.32Å; F473-S475 PolarHBondContact O-N 3.42Å
476L97.4Very high91.6Very high1 Ų123.7 Ų23.71%0.00513%0.131CC..Hα-helixtrans-80.7-29179.7-68.1168.9000112.8W217 A218 C221 Y256 Y260 I472 F473 M474 V478 G479 I480W217-L476 HydrophobicContact CB-CB 4.31Å; W217-L476 HydrophobicContact CB-CD1 3.58Å; A218-L476 HydrophobicContact CB-CD1 4.45Å; C221-L476 HydrophobicContact CB-CB 4.17Å; C221-L476 HydrophobicContact CB-CD2 3.93Å; C221-L476 PolarHBondContact SG-O 3.19Å; Y256-L476 HydrophobicContact CD1-CD2 4.09Å; Y256-L476 HydrophobicContact CE1-CD2 4.28Å; Y260-L476 HydrophobicContact CD2-CD2 4.21Å; Y260-L476 HydrophobicContact CE2-CD1 4.44Å; Y260-L476 HydrophobicContact CE2-CD2 3.98Å; Y260-L476 HydrophobicContact CE2-CG 4.42Å; I472-L476 HydrophobicContact CG2-CD1 3.81Å; I472-L476 WeakPolarHBondContact O-CG 3.43Å; I472-L476 PolarHBondContact O-N 3.06Å; F473-L476 PolarHBondContact O-N 3.39Å; M474-L476 PolarHBondContact O-N 3.2Å; L476-V478 PolarHBondContact O-N 2.87Å; L476-G479 PolarHBondContact O-N 3.11Å; L476-I480 PolarHBondContact O-N 2.98Å
477L96.1Very high90.5Very high42 Ų4228.9 Ų28.922%0.2214%0.137CC..Hα-helixtrans-59-33.9176.8-177.762.5000112.1P438 F473 M474 G479 I480 T481P438-L477 HydrophobicContact CG-CD2 4.25Å; F473-L477 HydrophobicContact CE1-CD2 4.1Å; F473-L477 HydrophobicContact CE2-CB 4.47Å; F473-L477 HydrophobicContact CE2-CD1 4.37Å; F473-L477 HydrophobicContact CZ-CD1 4.28Å; F473-L477 HydrophobicContact CZ-CD2 3.89Å; F473-L477 HydrophobicContact CZ-CG 4.47Å; F473-L477 VanDerWaalsContact O-CB 3.29Å; F473-L477 WeakPolarHBondContact O-CB 3.31Å; F473-L477 PolarHBondContact O-N 2.89Å; M474-L477 PolarHBondContact O-N 3.18Å; M474-L477 HydrophobicContact SD-CD2 3.99Å; L477-G479 VanDerWaalsContact C-N 3.32Å; L477-G479 PolarHBondContact O-N 3.38Å; L477-I480 PolarHBondContact O-N 3.15Å; L477-T481 HydrophobicContact CD1-CG2 4.1Å; L477-T481 HydrophobicContact CG-CG2 4.14Å; L477-T481 WeakPolarHBondContact O-CB 3.36Å; L477-T481 VanDerWaalsContact O-CG2 3.29Å; L477-T481 WeakPolarHBondContact O-CG2 3.41Å; L477-T481 PolarHBondContact O-N 3.2Å; L477-T481 PolarHBondContact O-OG1 3.41Å
478V93.4Very high89.5Confident8 Ų830.6 Ų30.65%0.04815%0.149CC..Hα-helixtrans-54.6-47172.2168.20000111.8L249 Y435 P438 L476 T481 S482L249-V478 HydrophobicContact CD2-CG1 4.02Å; Y435-V478 HydrophobicContact CD2-CB 4.46Å; Y435-V478 HydrophobicContact CD2-CG1 3.58Å; Y435-V478 HydrophobicContact CD2-CG2 4.13Å; Y435-V478 HydrophobicContact CE2-CB 4.22Å; Y435-V478 HydrophobicContact CE2-CG1 3.15Å; Y435-V478 HydrophobicContact CE2-CG2 3.99Å; P438-V478 HydrophobicContact CB-CG2 3.77Å; P438-V478 HydrophobicContact CG-CG2 4.29Å; L476-V478 PolarHBondContact O-N 2.87Å; V478-T481 PolarHBondContact O-OG1 3.49Å; V478-S482 PolarHBondContact O-N 3.3Å
479G93.1Very high88.3Confident0 Ų034 Ų340%018%0.178CC..Hα-helixtrans-66.1-42177.600000112T225 L476 L477 T481 S482 G483T225-G479 WeakPolarHBondContact CG2-O 3.31Å; L476-G479 PolarHBondContact O-N 3.11Å; L477-G479 VanDerWaalsContact C-N 3.32Å; L477-G479 PolarHBondContact O-N 3.38Å; G479-T481 PolarHBondContact O-N 3.45Å; G479-S482 PolarHBondContact O-N 3.35Å; G479-S482 PolarHBondContact O-OG 3.48Å; G479-G483 PolarHBondContact O-N 3.5Å
480I93.2Very high87.2Confident34 Ų3440.5 Ų40.517%0.17421%0.205CC..Hα-helixtrans-60.3-48178-62.3171.3000110.8W217 L220 C221 S224 L476 L477 S482 G483W217-I480 HydrophobicContact CE3-CD1 3.85Å; W217-I480 HydrophobicContact CZ3-CD1 4.16Å; L220-I480 HydrophobicContact CB-CD1 3.95Å; L220-I480 HydrophobicContact CB-CG1 4.43Å; C221-I480 HydrophobicContact CB-CG1 4.08Å; S224-I480 PolarHBondContact OG-O 3.3Å; L476-I480 PolarHBondContact O-N 2.98Å; L477-I480 PolarHBondContact O-N 3.15Å; I480-S482 VanDerWaalsContact C-N 3.34Å; I480-S482 PolarHBondContact O-N 2.64Å; I480-G483 PolarHBondContact O-N 3.19Å
481T90.3Very high86.2Confident24 Ų2437.7 Ų37.715%0.14719%0.191CC..Hα-helixtrans-66.1-34179.855.20000112.7L477 V478 G479 G483 M484L477-T481 HydrophobicContact CD1-CG2 4.1Å; L477-T481 HydrophobicContact CG-CG2 4.14Å; L477-T481 WeakPolarHBondContact O-CB 3.36Å; L477-T481 VanDerWaalsContact O-CG2 3.29Å; L477-T481 WeakPolarHBondContact O-CG2 3.41Å; L477-T481 PolarHBondContact O-N 3.2Å; L477-T481 PolarHBondContact O-OG1 3.41Å; V478-T481 PolarHBondContact O-OG1 3.49Å; G479-T481 PolarHBondContact O-N 3.45Å; T481-G483 PolarHBondContact O-N 3.23Å; T481-M484 HydrophobicContact CG2-CE 3.64Å; T481-M484 WeakPolarHBondContact O-CB 3.29Å; T481-M484 PolarHBondContact O-N 3.21Å
482S85.6Confident85.1Confident0 Ų042 Ų420%022%0.215CC..Hα-helixtrans-59.1-34.6173.479.60000112.7S250 V478 G479 I480 W485S250-S482 PolarHBondContact OG-OG 3.11Å; S250-S482 VanDerWaalsContact OG-OG 3.04Å; V478-S482 PolarHBondContact O-N 3.3Å; G479-S482 PolarHBondContact O-N 3.35Å; G479-S482 PolarHBondContact O-OG 3.48Å; I480-S482 VanDerWaalsContact C-N 3.34Å; I480-S482 PolarHBondContact O-N 2.64Å; S482-W485 WeakPolarHBondContact O-CB 3.22Å; S482-W485 PolarHBondContact O-N 3.28Å
483G77.3Confident84.1Confident0 Ų047.9 Ų47.90%024%0.242CC..Hα-helixtrans-74.5-25.8179.300000115S224 T228 G479 I480 T481 W485 I486 W487S224-G483 WeakPolarHBondContact OG-CA 3.47Å; T228-G483 WeakPolarHBondContact OG1-CA 3.43Å; G479-G483 PolarHBondContact O-N 3.5Å; I480-G483 PolarHBondContact O-N 3.19Å; T481-G483 PolarHBondContact O-N 3.23Å; G483-W485 PolarHBondContact O-N 2.88Å; G483-I486 PolarHBondContact O-N 3.44Å; G483-W487 VanDerWaalsContact O-CD1 3.29Å
484M76.3Confident83.1Confident100 Ų10047.2 Ų47.249%0.49324%0.242SC..Hα-helixtrans-62.1-24170.9-63.7-167.1-75.900112.1T481 I486 W487T481-M484 HydrophobicContact CG2-CE 3.64Å; T481-M484 WeakPolarHBondContact O-CB 3.29Å; T481-M484 PolarHBondContact O-N 3.21Å; M484-I486 PolarHBondContact O-N 2.03Å; M484-W487 PolarHBondContact O-N 2.91Å
485W74Confident82.3Confident17 Ų1749.6 Ų49.66%0.06425%0.249CC..THydrogen-bonded Turntrans-58.2-36.8178.7-175.4-101.5000113.1E243 I246 K427 I428 F431 S482 G483E243-W485 HydrophobicContact CG-CZ2 4.13Å; E243-W485 PolarHBondContact OE2-NE1 2.84Å; I246-W485 HydrophobicContact CD1-CD2 3.75Å; I246-W485 HydrophobicContact CD1-CE3 4.15Å; I246-W485 HydrophobicContact CD1-CG 4.14Å; I246-W485 HydrophobicContact CD1-CH2 4.34Å; I246-W485 HydrophobicContact CD1-CZ2 3.98Å; I246-W485 HydrophobicContact CD1-CZ3 4.4Å; I246-W485 HydrophobicContact CG2-CB 4.37Å; I246-W485 HydrophobicContact CG2-CG 4.26Å; K427-W485 HydrophobicContact CB-CH2 3.83Å; K427-W485 HydrophobicContact CB-CZ3 4.17Å; K427-W485 HydrophobicContact CD-CE3 4.23Å; K427-W485 HydrophobicContact CD-CH2 3.32Å; K427-W485 HydrophobicContact CD-CZ2 3.81Å; K427-W485 HydrophobicContact CD-CZ3 3.57Å; K427-W485 HydrophobicContact CG-CE3 4.38Å; K427-W485 HydrophobicContact CG-CH2 3.46Å; K427-W485 VanDerWaalsContact CG-CH2 3.46Å; K427-W485 HydrophobicContact CG-CZ2 4.42Å; K427-W485 HydrophobicContact CG-CZ3 3.44Å; K427-W485 VanDerWaalsContact CG-CZ3 3.44Å; K427-W485 PolarHBondContact NZ-O 2.82Å; K427-W485 VanDerWaalsContact NZ-O 3.17Å; K427-W485 WeakPolarHBondContact O-CZ3 3.11Å; I428-W485 HydrophobicContact CB-CH2 4.29Å; I428-W485 HydrophobicContact CG1-CH2 3.53Å; I428-W485 HydrophobicContact CG1-CZ2 3.88Å; F431-W485 HydrophobicContact CB-CE3 4.05Å; F431-W485 HydrophobicContact CB-CZ3 3.75Å; F431-W485 HydrophobicContact CD2-CE3 4.1Å; F431-W485 HydrophobicContact CG-CE3 4.04Å; F431-W485 HydrophobicContact CG-CZ3 4.22Å; S482-W485 WeakPolarHBondContact O-CB 3.22Å; S482-W485 PolarHBondContact O-N 3.28Å; G483-W485 PolarHBondContact O-N 2.88Å
486I73.8Confident81.5Confident4 Ų452.9 Ų52.92%0.02126%0.262CS..THydrogen-bonded Turntrans-89-11.7-172.8-62.8-162.3000111.7T228 T231 F239 I247 G483 M484 S488 T491T228-I486 HydrophobicContact CG2-CD1 3.22Å; T228-I486 HydrophobicContact CG2-CG1 3.89Å; T231-I486 HydrophobicContact CG2-CG2 3.55Å; F239-I486 HydrophobicContact CE1-CD1 4.08Å; F239-I486 HydrophobicContact CE1-CG1 4.21Å; F239-I486 HydrophobicContact CZ-CD1 3.82Å; F239-I486 HydrophobicContact CZ-CG1 4.24Å; F239-I486 HydrophobicContact CZ-CG2 4.49Å; I247-I486 HydrophobicContact CD1-CD1 3.77Å; G483-I486 PolarHBondContact O-N 3.44Å; M484-I486 PolarHBondContact O-N 2.03Å; I486-S488 PolarHBondContact O-N 3.41Å; I486-S488 PolarHBondContact O-OG 3.24Å; I486-T491 HydrophobicContact CG2-CG2 3.83Å; I486-T491 WeakPolarHBondContact CG2-OG1 3.04Å; I486-T491 VanDerWaalsContact O-CB 3.3Å; I486-T491 WeakPolarHBondContact O-CB 3.06Å; I486-T491 PolarHBondContact O-OG1 3.42Å
487W74.1Confident80.6Confident171 Ų17160.7 Ų60.765%0.64829%0.292SS*.  trans-66.1102.8177.7-69.47.9000110.6G483 M484G483-W487 VanDerWaalsContact O-CD1 3.29Å; M484-W487 PolarHBondContact O-N 2.91Å
488S74.1Confident79.7Confident47 Ų4760 Ų6033%0.32929%0.29SS..SBendtrans-154.7155.1-179.861.80000109.8R238 I486 K490 T491 L492R238-S488 PolarHBondContact NH2-OG 2.77Å; I486-S488 PolarHBondContact O-N 3.41Å; I486-S488 PolarHBondContact O-OG 3.24Å; S488-K490 PolarHBondContact O-N 3.35Å; S488-K490 VanDerWaalsContact O-N 3.13Å; S488-T491 WeakPolarHBondContact O-CB 3.19Å; S488-T491 PolarHBondContact O-N 3.37Å; S488-T491 PolarHBondContact OG-N 3.48Å; S488-T491 PolarHBondContact OG-OG1 2.89Å; S488-T491 VanDerWaalsContact OG-OG1 3.05Å; S488-L492 PolarHBondContact O-N 3.33Å
489A72.3Confident79Confident73 Ų7362.1 Ų62.160%0.60331%0.305SS*.Hα-helixtrans-54.7-32.3174.600000112.3T491 L492 H493A489-T491 PolarHBondContact O-N 3.32Å; A489-L492 PolarHBondContact O-N 3.39Å; A489-H493 PolarHBondContact O-CD2 3.31Å; A489-H493 VanDerWaalsContact O-CD2 3.23Å; A489-H493 PolarHBondContact O-N 2.97Å
490K73.3Confident78.3Confident148 Ų14866.1 Ų66.164%0.64333%0.329SS*.Hα-helixtrans-61.8-41.5174.7-66.3-175.4179.4-177.60112.4S488 H493 T494S488-K490 PolarHBondContact O-N 3.35Å; S488-K490 VanDerWaalsContact O-N 3.13Å; K490-H493 PolarHBondContact O-N 3.36Å; K490-T494 PolarHBondContact O-N 2.04Å; K490-T494 PolarHBondContact O-OG1 3.45Å; K490-T494 VanDerWaalsContact O-OG1 3.09Å
491T76.3Confident77.5Confident11 Ų1171.1 Ų71.17%0.06735%0.346CS..Hα-helixtrans-63.4-44.6176.5-60.20000110.8T231 R238 I486 S488 A489 H493 T494 W495T231-T491 HydrophobicContact CG2-CG2 3.93Å; R238-T491 PolarHBondContact NH1-OG1 3.33Å; R238-T491 VanDerWaalsContact NH1-OG1 3.07Å; I486-T491 HydrophobicContact CG2-CG2 3.83Å; I486-T491 WeakPolarHBondContact CG2-OG1 3.04Å; I486-T491 VanDerWaalsContact O-CB 3.3Å; I486-T491 WeakPolarHBondContact O-CB 3.06Å; I486-T491 PolarHBondContact O-OG1 3.42Å; S488-T491 WeakPolarHBondContact O-CB 3.19Å; S488-T491 PolarHBondContact O-N 3.37Å; S488-T491 PolarHBondContact OG-N 3.48Å; S488-T491 PolarHBondContact OG-OG1 2.89Å; S488-T491 VanDerWaalsContact OG-OG1 3.05Å; A489-T491 PolarHBondContact O-N 3.32Å; T491-H493 VanDerWaalsContact C-N 3.3Å; T491-H493 PolarHBondContact O-N 3.15Å; T491-T494 PolarHBondContact O-N 3.08Å; T491-W495 VanDerWaalsContact O-CD1 3.22Å; T491-W495 PolarHBondContact O-N 3.38Å
492L75.4Confident76.8Confident107 Ų10775.1 Ų75.156%0.5637%0.366SS*.Hα-helixtrans-58.3-43.1176-172.967.4000111.6S488 A489 W495 Q496S488-L492 PolarHBondContact O-N 3.33Å; A489-L492 PolarHBondContact O-N 3.39Å; L492-W495 PolarHBondContact O-N 2.84Å; L492-Q496 WeakPolarHBondContact O-CB 3.44Å; L492-Q496 VanDerWaalsContact O-CG 3.24Å; L492-Q496 WeakPolarHBondContact O-CG 3.22Å; L492-Q496 PolarHBondContact O-N 2.96Å
493H78.3Confident76.3Confident123 Ų12379.8 Ų79.857%0.56939%0.391SS*.Hα-helixtrans-64.2-41175.5-77.2-56.9000113.4A489 K490 T491 W495 Q496 R497A489-H493 PolarHBondContact O-CD2 3.31Å; A489-H493 VanDerWaalsContact O-CD2 3.23Å; A489-H493 PolarHBondContact O-N 2.97Å; K490-H493 PolarHBondContact O-N 3.36Å; T491-H493 VanDerWaalsContact C-N 3.3Å; T491-H493 PolarHBondContact O-N 3.15Å; H493-W495 VanDerWaalsContact C-N 3.33Å; H493-W495 PolarHBondContact O-N 2.89Å; H493-Q496 PolarHBondContact ND1-OE1 2.7Å; H493-Q496 PolarHBondContact O-N 3.49Å; H493-R497 WeakPolarHBondContact O-CB 3.45Å; H493-R497 PolarHBondContact O-N 3.4Å
494T76.4Confident76.1Confident30 Ų3088.3 Ų88.318%0.18442%0.423CS..Hα-helixtrans-59.3-45.4174.6-56.20000110.9L234 D235 K490 T491 R497 C498L234-T494 HydrophobicContact CB-CG2 4.24Å; D235-T494 HydrophobicContact CB-CG2 4.31Å; K490-T494 PolarHBondContact O-N 2.04Å; K490-T494 PolarHBondContact O-OG1 3.45Å; K490-T494 VanDerWaalsContact O-OG1 3.09Å; T491-T494 PolarHBondContact O-N 3.08Å; T494-R497 PolarHBondContact O-N 2.77Å; T494-C498 WeakPolarHBondContact O-CB 3.49Å; T494-C498 PolarHBondContact O-N 3.45Å
495W80.4Confident75.7Confident80 Ų8088.1 Ų88.130%0.30342%0.424SS..Hα-helixtrans-69.9-35.5178-79.594.5000113.2L227 L230 T231 L234 T491 L492 H493 C498 S499L227-W495 HydrophobicContact CD1-CH2 4.35Å; L227-W495 HydrophobicContact CD1-CZ2 3.59Å; L230-W495 HydrophobicContact CB-CH2 4Å; L230-W495 HydrophobicContact CB-CZ2 3.87Å; L230-W495 HydrophobicContact CD1-CH2 4.05Å; T231-W495 PolarHBondContact OG1-NE1 2.91Å; L234-W495 HydrophobicContact CD1-CD2 4.32Å; L234-W495 HydrophobicContact CD1-CH2 4.32Å; L234-W495 HydrophobicContact CD1-CZ2 4.1Å; T491-W495 VanDerWaalsContact O-CD1 3.22Å; T491-W495 PolarHBondContact O-N 3.38Å; L492-W495 PolarHBondContact O-N 2.84Å; H493-W495 VanDerWaalsContact C-N 3.33Å; H493-W495 PolarHBondContact O-N 2.89Å; W495-C498 PolarHBondContact O-N 3.09Å; W495-S499 WeakPolarHBondContact O-CB 3.42Å; W495-S499 PolarHBondContact O-N 2.83Å; W495-S499 PolarHBondContact O-OG 2.99Å
496Q80.1Confident75.1Confident90 Ų9090.7 Ų90.742%0.42144%0.444SS..Hα-helixtrans-62.4-42.4170.4-76.7172.6-8.700111.5L492 H493 S499 T500L492-Q496 WeakPolarHBondContact O-CB 3.44Å; L492-Q496 VanDerWaalsContact O-CG 3.24Å; L492-Q496 WeakPolarHBondContact O-CG 3.22Å; L492-Q496 PolarHBondContact O-N 2.96Å; H493-Q496 PolarHBondContact ND1-OE1 2.7Å; H493-Q496 PolarHBondContact O-N 3.49Å; Q496-S499 WeakPolarHBondContact CA-OG 3.44Å; Q496-S499 PolarHBondContact O-OG 3.4Å; Q496-T500 WeakPolarHBondContact O-CB 3.45Å; Q496-T500 VanDerWaalsContact O-CG2 3.25Å; Q496-T500 WeakPolarHBondContact O-CG2 3.49Å; Q496-T500 PolarHBondContact O-N 2.69Å; Q496-T500 PolarHBondContact O-OG1 3.21Å
497R78.4Confident74.5Confident166 Ų16699.4 Ų99.463%0.62648%0.477SS*.Hα-helixtrans-68-37.8177.5-162.4179-160.3179.44.3112.1H493 T494 T500 R501H493-R497 WeakPolarHBondContact O-CB 3.45Å; H493-R497 PolarHBondContact O-N 3.4Å; T494-R497 PolarHBondContact O-N 2.77Å; R497-T500 WeakPolarHBondContact CA-OG1 3.36Å; R497-T500 PolarHBondContact O-OG1 2.8Å; R497-R501 WeakPolarHBondContact O-CB 3.39Å; R497-R501 VanDerWaalsContact O-CG 3.25Å; R497-R501 WeakPolarHBondContact O-CG 3.31Å; R497-R501 PolarHBondContact O-N 3.45Å; R497-R501 VanDerWaalsContact O-N 3.14Å
498C77Confident73.7Confident28 Ų2894.3 Ų94.319%0.18947%0.471CS..Hα-helixtrans-68-50176.1-173.20000111.5L234 T494 W495 T500 R501 L502L234-C498 HydrophobicContact CD1-CB 4.32Å; T494-C498 WeakPolarHBondContact O-CB 3.49Å; T494-C498 PolarHBondContact O-N 3.45Å; W495-C498 PolarHBondContact O-N 3.09Å; C498-T500 VanDerWaalsContact C-N 3.34Å; C498-T500 PolarHBondContact O-N 3.02Å; C498-R501 WeakPolarHBondContact O-CB 3Å; C498-R501 PolarHBondContact O-N 2.97Å; C498-R501 VanDerWaalsContact O-N 3.15Å; C498-L502 WeakPolarHBondContact O-CG 3.27Å; C498-L502 PolarHBondContact O-N 3.44Å
499S79.3Confident72.8Confident52 Ų5296.3 Ų96.336%0.36449%0.485SS..Hα-helixtrans-61.2-40.3178.255.10000112.6W495 Q496 L502 L503W495-S499 WeakPolarHBondContact O-CB 3.42Å; W495-S499 PolarHBondContact O-N 2.83Å; W495-S499 PolarHBondContact O-OG 2.99Å; Q496-S499 WeakPolarHBondContact CA-OG 3.44Å; Q496-S499 PolarHBondContact O-OG 3.4Å; S499-L502 PolarHBondContact O-N 3.16Å; S499-L503 VanDerWaalsContact O-CB 3.29Å; S499-L503 WeakPolarHBondContact O-CB 3.37Å; S499-L503 WeakPolarHBondContact O-CD1 3.26Å; S499-L503 WeakPolarHBondContact O-CG 3.11Å; S499-L503 PolarHBondContact O-N 3.42Å
500T78.4Confident72Confident83 Ų83103.1 Ų103.151%0.50950%0.495SS..Hα-helixtrans-65.2-37.5174.8490000112.7Q496 R497 C498 R504Q496-T500 WeakPolarHBondContact O-CB 3.45Å; Q496-T500 VanDerWaalsContact O-CG2 3.25Å; Q496-T500 WeakPolarHBondContact O-CG2 3.49Å; Q496-T500 PolarHBondContact O-N 2.69Å; Q496-T500 PolarHBondContact O-OG1 3.21Å; R497-T500 WeakPolarHBondContact CA-OG1 3.36Å; R497-T500 PolarHBondContact O-OG1 2.8Å; C498-T500 VanDerWaalsContact C-N 3.34Å; C498-T500 PolarHBondContact O-N 3.02Å; T500-R504 WeakPolarHBondContact O-CB 3.23Å; T500-R504 PolarHBondContact O-N 2.97Å
501R76.5Confident70.9Confident140 Ų14098.3 Ų98.353%0.52849%0.488SS..Hα-helixtrans-65.5-48.7172.9-75.5174.3178-174.4-1.9112.1R497 C498 L503 R504 D505R497-R501 WeakPolarHBondContact O-CB 3.39Å; R497-R501 VanDerWaalsContact O-CG 3.25Å; R497-R501 WeakPolarHBondContact O-CG 3.31Å; R497-R501 PolarHBondContact O-N 3.45Å; R497-R501 VanDerWaalsContact O-N 3.14Å; C498-R501 WeakPolarHBondContact O-CB 3Å; C498-R501 PolarHBondContact O-N 2.97Å; C498-R501 VanDerWaalsContact O-N 3.15Å; R501-L503 VanDerWaalsContact C-N 3.32Å; R501-L503 PolarHBondContact O-N 3.03Å; R501-R504 WeakPolarHBondContact O-CA 3.12Å; R501-R504 WeakPolarHBondContact O-CB 3.45Å; R501-R504 PolarHBondContact O-N 3.29Å; R501-D505 PolarHBondContact O-N 3.3Å
502L75.8Confident69.5Low107 Ų107101 Ų10156%0.5652%0.518SS*.Hα-helixtrans-60.9-40177.7-72.4169.6000112.3C498 S499 R504 S506C498-L502 WeakPolarHBondContact O-CG 3.27Å; C498-L502 PolarHBondContact O-N 3.44Å; S499-L502 PolarHBondContact O-N 3.16Å; L502-R504 VanDerWaalsContact C-N 3.34Å; L502-S506 VanDerWaalsContact O-CB 3.26Å; L502-S506 WeakPolarHBondContact O-CB 3.45Å; L502-S506 PolarHBondContact O-N 3.35Å; L502-S506 PolarHBondContact O-OG 2.92Å
503L75.7Confident68Low99 Ų99104.9 Ų104.952%0.51853%0.53SS..Hα-helixtrans-67.1-34.1174-73.5168.8000112.2S499 R501 R507S499-L503 VanDerWaalsContact O-CB 3.29Å; S499-L503 WeakPolarHBondContact O-CB 3.37Å; S499-L503 WeakPolarHBondContact O-CD1 3.26Å; S499-L503 WeakPolarHBondContact O-CG 3.11Å; S499-L503 PolarHBondContact O-N 3.42Å; R501-L503 VanDerWaalsContact C-N 3.32Å; R501-L503 PolarHBondContact O-N 3.03Å; L503-R507 WeakPolarHBondContact O-CB 3.49Å; L503-R507 WeakPolarHBondContact O-CG 3.22Å; L503-R507 PolarHBondContact O-N 2.95Å; L503-R507 VanDerWaalsContact O-N 3.09Å
504R72.2Confident66.2Low179 Ų179110.1 Ų110.168%0.67555%0.545SS*.Hα-helixtrans-70.6-44.6176.2-165.7177.680.6168.78.2111.5T500 R501 L502 R507 A508T500-R504 WeakPolarHBondContact O-CB 3.23Å; T500-R504 PolarHBondContact O-N 2.97Å; R501-R504 WeakPolarHBondContact O-CA 3.12Å; R501-R504 WeakPolarHBondContact O-CB 3.45Å; R501-R504 PolarHBondContact O-N 3.29Å; L502-R504 VanDerWaalsContact C-N 3.34Å; R504-R507 CarbonylContact O-C 3.46Å; R504-R507 PolarHBondContact O-N 2.79Å; R504-A508 WeakPolarHBondContact O-CB 3.09Å; R504-A508 PolarHBondContact O-N 2.81Å
505D67.9Low64.2Low96 Ų96112.8 Ų112.851%0.51357%0.57SS.*Hα-helixtrans-68.4-36.5178.1-69.5-13.2000111.5R501 R507 A508 S509R501-D505 PolarHBondContact O-N 3.3Å; D505-R507 VanDerWaalsContact C-N 3.31Å; D505-R507 PolarHBondContact O-N 3.25Å; D505-A508 PolarHBondContact O-N 3.25Å; D505-S509 WeakPolarHBondContact O-CB 3.06Å; D505-S509 PolarHBondContact O-N 3.2Å
506S61.7Low62.1Low71 Ų71114.9 Ų114.950%0.49759%0.593SS.*Hα-helixtrans-63.7-35.3171.6-61.10000112.5L502 R510L502-S506 VanDerWaalsContact O-CB 3.26Å; L502-S506 WeakPolarHBondContact O-CB 3.45Å; L502-S506 PolarHBondContact O-N 3.35Å; L502-S506 PolarHBondContact O-OG 2.92Å; S506-R510 PolarHBondContact O-N 2.03Å
507R60.8Low60.1Low187 Ų187117.5 Ų117.571%0.70662%0.616SS**Hα-helixtrans-74.5-37.7173.8-78.1179.8-171.6178.25112.4L503 R504 D505 R510 G511L503-R507 WeakPolarHBondContact O-CB 3.49Å; L503-R507 WeakPolarHBondContact O-CG 3.22Å; L503-R507 PolarHBondContact O-N 2.95Å; L503-R507 VanDerWaalsContact O-N 3.09Å; R504-R507 CarbonylContact O-C 3.46Å; R504-R507 PolarHBondContact O-N 2.79Å; D505-R507 VanDerWaalsContact C-N 3.31Å; D505-R507 PolarHBondContact O-N 3.25Å; R507-R510 PolarHBondContact O-N 3.23Å; R507-G511 PolarHBondContact O-N 3.12Å
508A58.4Low57.9Low63 Ų63118.1 Ų118.152%0.52163%0.625SS.*Hα-helixtrans-65.1-41.1174.700000111.4R504 D505 R510 G511 G512R504-A508 WeakPolarHBondContact O-CB 3.09Å; R504-A508 PolarHBondContact O-N 2.81Å; D505-A508 PolarHBondContact O-N 3.25Å; A508-R510 PolarHBondContact O-N 3.13Å; A508-G511 PolarHBondContact O-N 3.04Å; A508-G512 PolarHBondContact O-N 3.11Å
509S55.1Low55.7Low90 Ų90121.2 Ų121.263%0.62965%0.647SS**Hα-helixtrans-63.8-36173.9-177.80000112.9D505D505-S509 WeakPolarHBondContact O-CB 3.06Å; D505-S509 PolarHBondContact O-N 3.2Å
510R54.6Low53.5Low215 Ų215130.6 Ų130.681%0.81168%0.675SS**Hα-helixtrans-76.3-30.6172.1-80.6-177.7-179.5177.50.8113.7S506 R507 A508S506-R510 PolarHBondContact O-N 2.03Å; R507-R510 PolarHBondContact O-N 3.23Å; A508-R510 PolarHBondContact O-N 3.13Å
511G49.7Very low51.3Low48 Ų48133.5 Ų133.550%0.49569%0.686SS.*Hα-helixtrans-76.7-30.9177.900000113.8R507 A508 K513 R514R507-G511 PolarHBondContact O-N 3.12Å; A508-G511 PolarHBondContact O-N 3.04Å; G511-K513 PolarHBondContact O-N 3.44Å; G511-K513 VanDerWaalsContact O-N 3.15Å; G511-R514 PolarHBondContact O-N 3.04Å
512G46.6Very low49.4Very low67 Ų67135.8 Ų135.869%0.69170%0.7SS**THydrogen-bonded Turntrans-68.8-5.5177.400000115.4A508A508-G512 PolarHBondContact O-N 3.11Å
513K45.3Very low47.5Very low188 Ų188136.5 Ų136.582%0.81771%0.711SS**THydrogen-bonded Turntrans-94.67.3173-72.8-171.2176.9-175.30114.1G511G511-K513 PolarHBondContact O-N 3.44Å; G511-K513 VanDerWaalsContact O-N 3.15Å
514R39.8Very low45.5Very low234 Ų234135.5 Ų135.588%0.88372%0.724SS**  trans-135.273.4171.6-76.1-175.8-179.1173.7-0.9110.8G511G511-R514 PolarHBondContact O-N 3.04Å
515A33.9Very low43.8Very low85 Ų85137.2 Ų137.270%0.70274%0.736SS**  trans-116.2121.2153.700000106.9
516P38Very low42.2Very low124 Ų124136.3 Ų136.381%0.80575%0.75SS**  trans-66136.9168.3-8.824.6000108.6E518P516-E518 PolarHBondContact O-N 2.79Å
517V36.7Very low40.9Very low146 Ų146140.6 Ų140.689%0.88577%0.767SS**  trans-62103.4170.3173.70000108.2
518E33.4Very low39.8Very low178 Ų178141.1 Ų141.183%0.83278%0.777SS**  trans-83.4128162.2-103.2176.3171.200109.1P516P516-E518 PolarHBondContact O-N 2.79Å
519S30.5Very low38.8Very low93 Ų93144.1 Ų144.165%0.6579%0.789SS**  trans-68.5124-171490000112.3I521S519-I521 PolarHBondContact O-N 3.14Å; S519-I521 VanDerWaalsContact O-N 3.17Å
520W31.7Very low37.9Very low250 Ų250146.1 Ų146.195%0.94780%0.798SS**  trans-79.590.1162.6-7787.4000109.5
521I33.5Very low37Very low143 Ų143146.1 Ų146.173%0.73382%0.821SS**  trans-84112163.4-61.7175.9000107.6S519S519-I521 PolarHBondContact O-N 3.14Å; S519-I521 VanDerWaalsContact O-N 3.17Å
522K36.5Very low36.3Very low189 Ų189151 Ų15182%0.82284%0.837SS**PPolyproline II helixtrans-84.1131.1166.4-73.9-176.9177179.90109.5
523P35.2Very low35.8Very low122 Ų122155.4 Ų155.479%0.79285%0.845SS**PPolyproline II helixtrans-89.2134158.527.5-17.1000110.1
524G33.8Very low35.3Very low77 Ų77153.6 Ų153.679%0.79485%0.846SS**PPolyproline II helixtrans-71154.8-178.600000114
525K36.4Very low35Very low216 Ų216148.9 Ų148.994%0.93984%0.844SS**  trans-113.8120.4160.8-87.3-174.5172.8-1760108
526G33.8Very low35.1Very low77 Ų77152.9 Ų152.979%0.79485%0.853SS**  trans-72.7158.9173.500000112.3
527N35.7Very low34.9Very low160 Ų160154.8 Ų154.886%0.85686%0.856SS**  trans-59.7138.3175.7-71.9-20.1000112.7
528E37.3Very low34.8Very low198 Ų198155.4 Ų155.493%0.92585%0.854SS**  trans-130.4116.8144.4-81.6-176.714800108.4
529T37.8Very low34.9Very low126 Ų126153.7 Ų153.777%0.77386%0.856SS**  trans-94.2141.7159.244.30000108
530V35.8Very low35.2Very low133 Ų133158.8 Ų158.881%0.80687%0.873SS**  trans173.7120.1134.91590000109
531V35.3Very low35.5Very low214 Ų214150.5 Ų150.5100%1.29787%0.866SS**  trans58.70157.8-175.60000119.2

Retrieved 531 of 531 residues in 161.6 ms (Link to these results)