A0A087YK30_POEFO Loading...

Sodium/bile acid cotransporter 4

Transporter for bile acids.

AlphaFold DB , UniProt , Accession A0A087YK30, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 360 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
1M46.3Very low40.4Very low244 Ų244151.1 Ų151.1100%1.20284%0.835SS**  0115.10-61.4165-178.800105.3
2T37.4Very low40.6Very low130 Ų130149.4 Ų149.480%0.79883%0.832SS**  cis-143.4133.923.944.90000111.6
3S43.6Very low40.6Very low117 Ų117145.8 Ų145.882%0.81882%0.819SS**  trans-79.8140.8146.648.60000107.3
4P41.6Very low40.9Very low112 Ų112138.9 Ų138.973%0.72779%0.789SS**  -150.3-170.790.645.4-28.6000111.7
5Q32.6Very low41.4Very low178 Ų178138.7 Ų138.783%0.83278%0.776SS**  cis-121.7167-9.3-74.7-177.9-12.400109.2
6T40.4Very low41.5Very low137 Ų137138.6 Ų138.684%0.8476%0.76SS**  trans-106.4131.4154.47.90000108
7E34.5Very low42.1Very low173 Ų173137.8 Ų137.881%0.80876%0.755SS**PPolyproline II helixtrans-61.3143.1173.6-65.5179.5130.100110.3
8P40Very low43Very low109 Ų109131.7 Ų131.771%0.70872%0.724SS**PPolyproline II helixtrans-65.9138.2175.728.8-33.5000109.3H10P8-H10 PolarHBondContact O-N 3.43Å
9P41.6Very low44.3Very low115 Ų115131.1 Ų131.175%0.74773%0.727SS**PPolyproline II helixtrans-60.3127.7174.826.2-33.3000108.6L11P9-L11 PolarHBondContact O-N 3.13Å
10H42.2Very low45.2Very low182 Ų182129.9 Ų129.984%0.84372%0.719SS**  trans-53.2112.8173.5-71.9-85.9000108.8P8 V12P8-H10 PolarHBondContact O-N 3.43Å; H10-V12 VanDerWaalsContact C-N 3.35Å; H10-V12 PolarHBondContact O-N 3.01Å
11L43.8Very low45.8Very low165 Ų165124 Ų12486%0.86469%0.687SS**  trans-61.8103.7166.9-85.297.2000107.1P9 P13P9-L11 PolarHBondContact O-N 3.13Å; L11-P13 WeakPolarHBondContact O-CD 3.1Å; L11-P13 VanDerWaalsContact O-N 3.12Å
12V43.7Very low46.8Very low131 Ų131118.2 Ų118.279%0.79466%0.656SS**PPolyproline II helixtrans-54.1116.5154.5-178.50000104.8H10 A14H10-V12 VanDerWaalsContact C-N 3.35Å; H10-V12 PolarHBondContact O-N 3.01Å; V12-A14 PolarHBondContact O-N 2.86Å; V12-A14 VanDerWaalsContact O-N 3.14Å
13P39.5Very low48.4Very low103 Ų103114.1 Ų114.167%0.66964%0.64SS**PPolyproline II helixtrans-57.6127.7178.522.9-30.9000106.7L11 F15L11-P13 WeakPolarHBondContact O-CD 3.1Å; L11-P13 VanDerWaalsContact O-N 3.12Å; P13-F15 PolarHBondContact O-N 2.89Å
14A45.9Very low49.5Very low48 Ų48112.3 Ų112.340%0.39762%0.62SS.*PPolyproline II helixtrans-53.5131.5-177.800000107.9V12 W16 D17V12-A14 PolarHBondContact O-N 2.86Å; V12-A14 VanDerWaalsContact O-N 3.14Å; A14-W16 HydrophobicContact CB-CB 4.47Å; A14-W16 PolarHBondContact O-N 3.39Å; A14-D17 PolarHBondContact O-N 3.07Å
15F47.6Very low50.7Low136 Ų136111.2 Ų111.260%0.59661%0.608SS**G310 helixtrans-48.5-28.3-178.6172.9-101.7000112.7P13 D17 S18 L20P13-F15 PolarHBondContact O-N 2.89Å; F15-D17 PolarHBondContact O-N 3.42Å; F15-S18 WeakPolarHBondContact O-CB 3.47Å; F15-S18 PolarHBondContact O-N 3.27Å; F15-S18 PolarHBondContact O-OG 3.29Å; F15-L20 HydrophobicContact CE2-CD2 4.2Å; F15-L20 HydrophobicContact CZ-CD2 4.2Å
16W43.9Very low52.7Low137 Ų137107.1 Ų107.152%0.51960%0.595SS.*G310 helixtrans-61.3-25.5174.3-51.1112.9000116.5A14 S21 P273A14-W16 HydrophobicContact CB-CB 4.47Å; A14-W16 PolarHBondContact O-N 3.39Å; W16-S21 PolarHBondContact O-OG 3.2Å; W16-P273 HydrophobicContact CD2-CB 4.04Å; W16-P273 HydrophobicContact CE3-CB 3.97Å; W16-P273 HydrophobicContact CZ3-CB 4.22Å
17D50.6Low54.3Low125 Ų125106.7 Ų106.767%0.66858%0.582SS**G310 helixtrans-94.85.6177.5-67.7-41.2000113.1A14 F15A14-D17 PolarHBondContact O-N 3.07Å; F15-D17 PolarHBondContact O-N 3.42Å
18S59.4Low55.9Low29 Ų2999.8 Ų99.820%0.20355%0.551CS.*SBendtrans-73.2147.3179.6670000112.3F15 L20 S21 H22F15-S18 WeakPolarHBondContact O-CB 3.47Å; F15-S18 PolarHBondContact O-N 3.27Å; F15-S18 PolarHBondContact O-OG 3.29Å; S18-L20 PolarHBondContact O-N 3.39Å; S18-S21 PolarHBondContact O-N 3.26Å; S18-S21 PolarHBondContact O-OG 3.4Å; S18-S21 PolarHBondContact OG-N 3.01Å; S18-H22 PolarHBondContact O-N 3.47Å
19P66.7Low57.4Low120 Ų12095.9 Ų95.978%0.77953%0.53SS*.Hα-helixtrans-55.9-26.4171.1-26.435.1000113.3G23P19-G23 PolarHBondContact O-N 3.06Å
20L62.9Low59.2Low107 Ų10795.9 Ų95.956%0.5652%0.524SS*.Hα-helixtrans-65.2-44174.6-167.8103.7000112.2F15 S18 G23 I24F15-L20 HydrophobicContact CE2-CD2 4.2Å; F15-L20 HydrophobicContact CZ-CD2 4.2Å; S18-L20 PolarHBondContact O-N 3.39Å; L20-G23 PolarHBondContact O-N 3Å; L20-I24 HydrophobicContact CD2-CD1 3.88Å; L20-I24 HydrophobicContact CG-CD1 4.07Å; L20-I24 VanDerWaalsContact O-CG1 3.29Å; L20-I24 WeakPolarHBondContact O-CG1 3.38Å; L20-I24 PolarHBondContact O-N 3.3Å
21S58.2Low60.7Low7 Ų788.8 Ų88.85%0.04949%0.493CS..Hα-helixtrans-64.6-41.2178.871.60000111.3W16 S18 I24 N25W16-S21 PolarHBondContact O-OG 3.2Å; S18-S21 PolarHBondContact O-N 3.26Å; S18-S21 PolarHBondContact O-OG 3.4Å; S18-S21 PolarHBondContact OG-N 3.01Å; S21-I24 PolarHBondContact O-N 2.99Å; S21-N25 WeakPolarHBondContact O-CB 3.46Å; S21-N25 VanDerWaalsContact O-CG 3.31Å; S21-N25 PolarHBondContact O-N 3Å; S21-N25 PolarHBondContact O-ND2 3.48Å
22H67Low62Low122 Ų12281.9 Ų81.957%0.56546%0.457SS*.Hα-helixtrans-61-45.2172.6-87.3-71.4000111.9S18 I24 N25 V26S18-H22 PolarHBondContact O-N 3.47Å; H22-I24 PolarHBondContact O-N 3.39Å; H22-N25 PolarHBondContact O-N 3.49Å; H22-V26 WeakPolarHBondContact O-CG2 2.87Å; H22-V26 PolarHBondContact O-N 2.84Å
23G70.8Confident63.7Low43 Ų4378.9 Ų78.944%0.44344%0.441SS..Hα-helixtrans-59-43.817500000113P19 L20 V26 F27P19-G23 PolarHBondContact O-N 3.06Å; L20-G23 PolarHBondContact O-N 3Å; G23-V26 PolarHBondContact O-N 3.2Å; G23-F27 WeakPolarHBondContact O-CB 3.42Å; G23-F27 PolarHBondContact O-N 3.34Å
24I67.8Low65.8Low80 Ų8077.6 Ų77.641%0.4143%0.425SS..Hα-helixtrans-63.9-43.9176.4-69.2163.5000111.2L20 S21 H22 F27 V28L20-I24 HydrophobicContact CD2-CD1 3.88Å; L20-I24 HydrophobicContact CG-CD1 4.07Å; L20-I24 VanDerWaalsContact O-CG1 3.29Å; L20-I24 WeakPolarHBondContact O-CG1 3.38Å; L20-I24 PolarHBondContact O-N 3.3Å; S21-I24 PolarHBondContact O-N 2.99Å; H22-I24 PolarHBondContact O-N 3.39Å; I24-F27 PolarHBondContact O-N 3.47Å; I24-V28 HydrophobicContact CG2-CG2 4.42Å; I24-V28 WeakPolarHBondContact O-CG2 3.38Å; I24-V28 PolarHBondContact O-N 3.24Å
25N66.6Low67.1Low89 Ų8975.9 Ų75.948%0.47641%0.41SS..Hα-helixtrans-64.8-42.3179.2-74.2-23.8000112.1S21 H22 G29S21-N25 WeakPolarHBondContact O-CB 3.46Å; S21-N25 VanDerWaalsContact O-CG 3.31Å; S21-N25 PolarHBondContact O-N 3Å; S21-N25 PolarHBondContact O-ND2 3.48Å; H22-N25 PolarHBondContact O-N 3.49Å; N25-G29 PolarHBondContact O-N 3.05Å
26V74.8Confident68.6Low92 Ų9269.6 Ų69.656%0.55838%0.382SS*.Hα-helixtrans-63.8-45.1173.9172.30000111H22 G23 V28 G29 L30H22-V26 WeakPolarHBondContact O-CG2 2.87Å; H22-V26 PolarHBondContact O-N 2.84Å; G23-V26 PolarHBondContact O-N 3.2Å; V26-V28 PolarHBondContact O-N 2.9Å; V26-G29 PolarHBondContact O-N 2.59Å; V26-L30 HydrophobicContact CG1-CD1 4.13Å; V26-L30 WeakPolarHBondContact O-CG 3.36Å; V26-L30 PolarHBondContact O-N 3.01Å
27F73.4Confident70.5Confident127 Ų12765 Ų6556%0.55737%0.367SS*.Hα-helixtrans-60.1-47177.6178.1-100.5000112.1G23 I24 G29 L30 V31G23-F27 WeakPolarHBondContact O-CB 3.42Å; G23-F27 PolarHBondContact O-N 3.34Å; I24-F27 PolarHBondContact O-N 3.47Å; F27-G29 PolarHBondContact O-N 3.4Å; F27-L30 PolarHBondContact O-N 3.16Å; F27-V31 HydrophobicContact CD1-CG2 4.31Å; F27-V31 HydrophobicContact CE1-CG2 3.87Å; F27-V31 HydrophobicContact CE2-CG2 4.24Å; F27-V31 HydrophobicContact CZ-CG2 3.84Å; F27-V31 WeakPolarHBondContact O-CG2 3.48Å; F27-V31 PolarHBondContact O-N 3.21Å
28V67.4Low71.9Confident29 Ų2959 Ų5918%0.17634%0.335CS..Hα-helixtrans-65.2-39.8177.11770000111.2I24 V26 L30 V31 L32 K268I24-V28 HydrophobicContact CG2-CG2 4.42Å; I24-V28 WeakPolarHBondContact O-CG2 3.38Å; I24-V28 PolarHBondContact O-N 3.24Å; V26-V28 PolarHBondContact O-N 2.9Å; V28-L30 VanDerWaalsContact C-N 3.32Å; V28-L30 PolarHBondContact O-N 2.98Å; V28-V31 PolarHBondContact O-N 2.66Å; V28-L32 HydrophobicContact CG1-CD1 3.81Å; V28-L32 HydrophobicContact CG1-CG 4.13Å; V28-L32 WeakPolarHBondContact O-CB 3.47Å; V28-L32 VanDerWaalsContact O-CG 3.26Å; V28-L32 WeakPolarHBondContact O-CG 3.4Å; V28-L32 PolarHBondContact O-N 3.12Å; V28-K268 HydrophobicContact CB-CD 4.2Å; V28-K268 HydrophobicContact CG1-CD 3.52Å
29G72.6Confident72.6Confident26 Ų2657.9 Ų57.927%0.26833%0.327SS..Hα-helixtrans-57.4-43.4173.300000112.6N25 V26 F27 L32 C33N25-G29 PolarHBondContact O-N 3.05Å; V26-G29 PolarHBondContact O-N 2.59Å; F27-G29 PolarHBondContact O-N 3.4Å; G29-L32 PolarHBondContact O-N 3.36Å; G29-C33 WeakPolarHBondContact O-CB 3.39Å; G29-C33 PolarHBondContact O-N 3.13Å; G29-C33 PolarHBondContact O-SG 3.36Å; G29-C33 VanDerWaalsContact O-SG 3.39Å
30L78.4Confident73.2Confident116 Ų11652.2 Ų52.261%0.60729%0.29SS*.Hα-helixtrans-65.1-43.4175.3-71.4170.9000112.6V26 F27 V28 L32 C33 F34V26-L30 HydrophobicContact CG1-CD1 4.13Å; V26-L30 WeakPolarHBondContact O-CG 3.36Å; V26-L30 PolarHBondContact O-N 3.01Å; F27-L30 PolarHBondContact O-N 3.16Å; V28-L30 VanDerWaalsContact C-N 3.32Å; V28-L30 PolarHBondContact O-N 2.98Å; L30-L32 VanDerWaalsContact C-N 3.34Å; L30-L32 PolarHBondContact O-N 3.25Å; L30-C33 PolarHBondContact O-N 3.07Å; L30-F34 WeakPolarHBondContact O-CB 3.4Å; L30-F34 PolarHBondContact O-N 3.38Å
31V73.6Confident74Confident32 Ų3247.1 Ų47.119%0.19426%0.264CS..Hα-helixtrans-62.6-40.7175.5171.90000111.2F27 V28 F34 T35F27-V31 HydrophobicContact CD1-CG2 4.31Å; F27-V31 HydrophobicContact CE1-CG2 3.87Å; F27-V31 HydrophobicContact CE2-CG2 4.24Å; F27-V31 HydrophobicContact CZ-CG2 3.84Å; F27-V31 WeakPolarHBondContact O-CG2 3.48Å; F27-V31 PolarHBondContact O-N 3.21Å; V28-V31 PolarHBondContact O-N 2.66Å; V31-F34 PolarHBondContact O-N 2.91Å; V31-T35 WeakPolarHBondContact O-CG2 3.46Å; V31-T35 PolarHBondContact O-N 3.21Å; V31-T35 PolarHBondContact O-OG1 2.75Å
32L71.8Confident74.6Confident21 Ų2147.7 Ų47.711%0.1127%0.267CS..Hα-helixtrans-65.1-48.1175.4-71.2170.7000111.4V28 G29 L30 F34 T35 M36 A265V28-L32 HydrophobicContact CG1-CD1 3.81Å; V28-L32 HydrophobicContact CG1-CG 4.13Å; V28-L32 WeakPolarHBondContact O-CB 3.47Å; V28-L32 VanDerWaalsContact O-CG 3.26Å; V28-L32 WeakPolarHBondContact O-CG 3.4Å; V28-L32 PolarHBondContact O-N 3.12Å; G29-L32 PolarHBondContact O-N 3.36Å; L30-L32 VanDerWaalsContact C-N 3.34Å; L30-L32 PolarHBondContact O-N 3.25Å; L32-F34 VanDerWaalsContact C-N 3.29Å; L32-F34 PolarHBondContact O-N 3.48Å; L32-T35 WeakPolarHBondContact CA-OG1 3.38Å; L32-T35 PolarHBondContact O-N 2.98Å; L32-T35 PolarHBondContact O-OG1 2.92Å; L32-M36 WeakPolarHBondContact O-CB 3.45Å; L32-M36 VanDerWaalsContact O-CG 3.25Å; L32-M36 WeakPolarHBondContact O-CG 3.32Å; L32-M36 PolarHBondContact O-N 2.95Å; L32-A265 HydrophobicContact CD1-CB 3.65Å; L32-A265 HydrophobicContact CD2-CB 3.99Å; L32-A265 HydrophobicContact CG-CB 4.32Å
33C79.8Confident74.8Confident68 Ų6842.4 Ų42.446%0.45924%0.243SC..Hα-helixtrans-58.3-40174.3-74.60000112.3G29 L30 L37 P166G29-C33 WeakPolarHBondContact O-CB 3.39Å; G29-C33 PolarHBondContact O-N 3.13Å; G29-C33 PolarHBondContact O-SG 3.36Å; G29-C33 VanDerWaalsContact O-SG 3.39Å; L30-C33 PolarHBondContact O-N 3.07Å; C33-L37 VanDerWaalsContact O-CB 3.3Å; C33-L37 WeakPolarHBondContact O-CB 3.39Å; C33-L37 PolarHBondContact O-N 2.94Å; C33-P166 WeakPolarHBondContact O-CB 3.42Å
34F82.4Confident74.9Confident76 Ų7643.1 Ų43.133%0.33324%0.235SC..Hα-helixtrans-67.8-41.1177.5-174.6-105.5000112.8L30 V31 L32 L37 G38 A187L30-F34 WeakPolarHBondContact O-CB 3.4Å; L30-F34 PolarHBondContact O-N 3.38Å; V31-F34 PolarHBondContact O-N 2.91Å; L32-F34 VanDerWaalsContact C-N 3.29Å; L32-F34 PolarHBondContact O-N 3.48Å; F34-L37 HydrophobicContact CD2-CD2 4.49Å; F34-L37 WeakPolarHBondContact O-CB 3.43Å; F34-L37 PolarHBondContact O-N 3.31Å; F34-G38 PolarHBondContact O-N 3.34Å; F34-A187 HydrophobicContact CE1-CB 4.33Å; F34-A187 HydrophobicContact CZ-CB 3.87Å
35T74.1Confident74.9Confident12 Ų1242.3 Ų42.37%0.07423%0.234CC..Hα-helixtrans-70.3-34.1176.551.60000112.7V31 L32 G38 L39 S188V31-T35 WeakPolarHBondContact O-CG2 3.46Å; V31-T35 PolarHBondContact O-N 3.21Å; V31-T35 PolarHBondContact O-OG1 2.75Å; L32-T35 WeakPolarHBondContact CA-OG1 3.38Å; L32-T35 PolarHBondContact O-N 2.98Å; L32-T35 PolarHBondContact O-OG1 2.92Å; T35-G38 PolarHBondContact O-N 2.97Å; T35-L39 PolarHBondContact O-N 3.02Å; T35-S188 WeakPolarHBondContact CA-OG 3.35Å
36M77.8Confident74.9Confident4 Ų441.7 Ų41.72%0.0224%0.236CC..Hα-helixtrans-72.3-32.8172.9-65.6-61.7151.100112.5L32 L39 G40 T163 P166 I167 Q261 L262L32-M36 WeakPolarHBondContact O-CB 3.45Å; L32-M36 VanDerWaalsContact O-CG 3.25Å; L32-M36 WeakPolarHBondContact O-CG 3.32Å; L32-M36 PolarHBondContact O-N 2.95Å; M36-L39 WeakPolarHBondContact O-CB 3.26Å; M36-L39 PolarHBondContact O-N 3.05Å; M36-L39 HydrophobicContact SD-CD2 3.98Å; M36-G40 PolarHBondContact O-N 2.92Å; M36-T163 HydrophobicContact CG-CG2 4.31Å; M36-P166 HydrophobicContact CB-CB 4.17Å; M36-P166 HydrophobicContact CB-CG 3.75Å; M36-I167 HydrophobicContact CB-CG1 4.15Å; M36-I167 WeakPolarHBondContact O-CG1 3.37Å; M36-I167 HydrophobicContact SD-CD1 4.35Å; M36-Q261 HydrophobicContact CE-CB 3.75Å; M36-L262 HydrophobicContact CE-CB 3.92Å
37L84.3Confident74.6Confident39 Ų3938.2 Ų38.220%0.20421%0.214CC..Hα-helixtrans-62.5-44.6168.4-177.683.3000110.7C33 F34 G40 C41 P166 L169 V184C33-L37 VanDerWaalsContact O-CB 3.3Å; C33-L37 WeakPolarHBondContact O-CB 3.39Å; C33-L37 PolarHBondContact O-N 2.94Å; F34-L37 HydrophobicContact CD2-CD2 4.49Å; F34-L37 WeakPolarHBondContact O-CB 3.43Å; F34-L37 PolarHBondContact O-N 3.31Å; L37-G40 CarbonylContact O-C 3.57Å; L37-G40 WeakPolarHBondContact O-CA 3.42Å; L37-G40 PolarHBondContact O-N 3.43Å; L37-G40 VanDerWaalsContact O-N 3.11Å; L37-C41 PolarHBondContact O-N 2.83Å; L37-C41 PolarHBondContact O-SG 2.94Å; L37-C41 VanDerWaalsContact O-SG 3.35Å; L37-P166 WeakPolarHBondContact CA-O 3.24Å; L37-P166 HydrophobicContact CB-CB 4.25Å; L37-L169 HydrophobicContact CD1-CB 3.87Å; L37-V184 HydrophobicContact CD2-CG1 3.76Å; L37-V184 HydrophobicContact CG-CG1 4.17Å
38G79.8Confident74.3Confident0 Ų035.4 Ų35.40%020%0.204CC..Hα-helixtrans-63-38.5175.300000113.8F34 T35 C41 T42F34-G38 PolarHBondContact O-N 3.34Å; T35-G38 PolarHBondContact O-N 2.97Å; G38-C41 WeakPolarHBondContact O-CB 3.49Å; G38-C41 PolarHBondContact O-N 2.99Å; G38-T42 PolarHBondContact O-N 2.66Å
39L75.3Confident74.3Confident6 Ų639.1 Ų39.13%0.03122%0.22CC..Hα-helixtrans-58.7-46167.5173.562.8000111T35 M36 C41 T42 N100 T120 T124 I167T35-L39 PolarHBondContact O-N 3.02Å; M36-L39 WeakPolarHBondContact O-CB 3.26Å; M36-L39 PolarHBondContact O-N 3.05Å; M36-L39 HydrophobicContact SD-CD2 3.98Å; L39-C41 VanDerWaalsContact C-N 3.27Å; L39-C41 PolarHBondContact O-N 3.37Å; L39-T42 PolarHBondContact O-N 3.44Å; L39-T42 VanDerWaalsContact O-N 3.16Å; L39-T42 PolarHBondContact O-OG1 3.27Å; L39-N100 WeakPolarHBondContact CD1-OD1 3.34Å; L39-T120 HydrophobicContact CD1-CG2 4.22Å; L39-T124 HydrophobicContact CD2-CG2 4.47Å; L39-I167 HydrophobicContact CD2-CD1 3.93Å; L39-I167 HydrophobicContact CD2-CG1 4.2Å; L39-I167 HydrophobicContact CG-CG1 4.47Å
40G77.8Confident73.9Confident0 Ų040.3 Ų40.30%022%0.218CC..Hα-helixtrans-57.8-37.5172.900000113.7M36 L37 T42 V43 I167 G170 V171M36-G40 PolarHBondContact O-N 2.92Å; L37-G40 CarbonylContact O-C 3.57Å; L37-G40 WeakPolarHBondContact O-CA 3.42Å; L37-G40 PolarHBondContact O-N 3.43Å; L37-G40 VanDerWaalsContact O-N 3.11Å; G40-T42 PolarHBondContact O-N 3.11Å; G40-V43 WeakPolarHBondContact O-CB 3.21Å; G40-V43 PolarHBondContact O-N 3.45Å; G40-V43 VanDerWaalsContact O-N 3.11Å; G40-I167 VanDerWaalsContact CA-O 3.25Å; G40-I167 WeakPolarHBondContact CA-O 3.42Å; G40-G170 VanDerWaalsContact C-C 3.41Å; G40-G170 CarbonylContact O-C 3.59Å; G40-V171 PolarHBondContact O-N 3.28Å
41C80.8Confident73.3Confident0 Ų037 Ų370%020%0.2CC..THydrogen-bonded Turntrans-69.4-10.7178.3-700000114.9L37 G38 L39 V43 R174 A181 L185L37-C41 PolarHBondContact O-N 2.83Å; L37-C41 PolarHBondContact O-SG 2.94Å; L37-C41 VanDerWaalsContact O-SG 3.35Å; G38-C41 WeakPolarHBondContact O-CB 3.49Å; G38-C41 PolarHBondContact O-N 2.99Å; L39-C41 VanDerWaalsContact C-N 3.27Å; L39-C41 PolarHBondContact O-N 3.37Å; C41-V43 VanDerWaalsContact C-N 3.34Å; C41-R174 WeakPolarHBondContact O-CD 3.2Å; C41-R174 PolarHBondContact O-NH1 3.11Å; C41-A181 HydrophobicContact CB-CB 4.08Å; C41-L185 HydrophobicContact CB-CB 4.11Å
42T71.2Confident72.9Confident19 Ų1942.2 Ų42.212%0.11723%0.225CC..THydrogen-bonded Turntrans-78.3-20.9169.567.60000112.6G38 L39 G40 E44 L185G38-T42 PolarHBondContact O-N 2.66Å; L39-T42 PolarHBondContact O-N 3.44Å; L39-T42 VanDerWaalsContact O-N 3.16Å; L39-T42 PolarHBondContact O-OG1 3.27Å; G40-T42 PolarHBondContact O-N 3.11Å; T42-E44 PolarHBondContact O-N 2.76Å; T42-L185 HydrophobicContact CG2-CD1 3.42Å; T42-L185 VanDerWaalsContact CG2-CD1 3.42Å; T42-L185 HydrophobicContact CG2-CD2 4.06Å; T42-L185 HydrophobicContact CG2-CG 4.38Å
43V70.7Confident72.7Confident12 Ų1249.9 Ų49.97%0.07325%0.253CS..  trans-83.9102.5-169.7-174.10000110.5G40 C41 L48 I121 V171 R174G40-V43 WeakPolarHBondContact O-CB 3.21Å; G40-V43 PolarHBondContact O-N 3.45Å; G40-V43 VanDerWaalsContact O-N 3.11Å; C41-V43 VanDerWaalsContact C-N 3.34Å; V43-L48 HydrophobicContact CG1-CD1 3.9Å; V43-I121 HydrophobicContact CB-CD1 4.34Å; V43-I121 HydrophobicContact CB-CG1 4.45Å; V43-I121 HydrophobicContact CG1-CD1 3.83Å; V43-I121 HydrophobicContact CG1-CG1 4.09Å; V43-I121 HydrophobicContact CG1-CG2 4.49Å; V43-I121 HydrophobicContact CG2-CD1 4.26Å; V43-I121 HydrophobicContact CG2-CG1 3.86Å; V43-V171 HydrophobicContact CB-CG1 4.26Å; V43-V171 HydrophobicContact CB-CG2 3.78Å; V43-V171 HydrophobicContact CG1-CG1 4.04Å; V43-V171 HydrophobicContact CG1-CG2 4.03Å; V43-V171 HydrophobicContact CG2-CG2 4.12Å; V43-R174 WeakPolarHBondContact O-CG 3.14Å
44E72.1Confident72.3Confident57 Ų5751.1 Ų51.127%0.26625%0.247SC..  trans-83.5136.5171.2-61.7-170.1147.100111.5T42 S46 Q47 L48 R174T42-E44 PolarHBondContact O-N 2.76Å; E44-S46 WeakPolarHBondContact CB-OG 3.38Å; E44-S46 PolarHBondContact O-N 2.74Å; E44-Q47 HydrophobicContact CB-CB 4.37Å; E44-Q47 HydrophobicContact CB-CG 3.95Å; E44-Q47 WeakPolarHBondContact O-CB 3.23Å; E44-Q47 PolarHBondContact O-N 2.87Å; E44-Q47 PolarHBondContact OE2-NE2 3.4Å; E44-L48 PolarHBondContact O-N 3.45Å; E44-L48 VanDerWaalsContact O-N 3.12Å; E44-R174 HydrophobicContact CG-CG 4.2Å; E44-R174 IonicContact OE1-CZ 3.15Å; E44-R174 IonicContact OE1-NE 3.39Å; E44-R174 PolarHBondContact OE1-NE 2.97Å; E44-R174 IonicContact OE1-NH2 2.74Å; E44-R174 PolarHBondContact OE1-NH2 3.27Å
45V68.6Low72.2Confident64 Ų6451.8 Ų51.839%0.38826%0.26SS..Hα-helixtrans-65.2-29.5-179.8-179.40000111.8Q47 L48 E49 V171 Y175V45-Q47 VanDerWaalsContact C-N 3.34Å; V45-Q47 PolarHBondContact O-N 2.78Å; V45-L48 VanDerWaalsContact O-CB 3.25Å; V45-L48 WeakPolarHBondContact O-CB 3.45Å; V45-L48 PolarHBondContact O-N 2.99Å; V45-L48 VanDerWaalsContact O-N 3.17Å; V45-E49 PolarHBondContact O-N 2.84Å; V45-E49 VanDerWaalsContact O-N 3.11Å; V45-V171 HydrophobicContact CG2-CG1 4.35Å; V45-Y175 HydrophobicContact CB-CD2 4.08Å; V45-Y175 HydrophobicContact CG1-CD2 4.42Å; V45-Y175 HydrophobicContact CG2-CD2 3.64Å; V45-Y175 HydrophobicContact CG2-CG 4.11Å
46S67.4Low72.8Confident75 Ų7555.5 Ų55.552%0.52428%0.278SS..Hα-helixtrans-59.8-40.2169.444.20000112.8E44 L48 E49 E50E44-S46 WeakPolarHBondContact CB-OG 3.38Å; E44-S46 PolarHBondContact O-N 2.74Å; S46-L48 VanDerWaalsContact C-N 3.3Å; S46-E49 WeakPolarHBondContact O-CB 3.48Å; S46-E49 PolarHBondContact O-N 3.04Å; S46-E50 PolarHBondContact O-N 3.34Å
47Q67.2Low73.2Confident20 Ų2055.3 Ų55.39%0.09328%0.278CS..Hα-helixtrans-73.4-25.1176.4-60.3173.324.800111.6E44 V45 E49 E50 H51E44-Q47 HydrophobicContact CB-CB 4.37Å; E44-Q47 HydrophobicContact CB-CG 3.95Å; E44-Q47 WeakPolarHBondContact O-CB 3.23Å; E44-Q47 PolarHBondContact O-N 2.87Å; E44-Q47 PolarHBondContact OE2-NE2 3.4Å; V45-Q47 VanDerWaalsContact C-N 3.34Å; V45-Q47 PolarHBondContact O-N 2.78Å; Q47-E49 VanDerWaalsContact C-N 3.34Å; Q47-E50 PolarHBondContact O-N 3.5Å; Q47-H51 WeakPolarHBondContact O-CB 3.29Å; Q47-H51 PolarHBondContact O-N 3.1Å
48L67.6Low73.4Confident68 Ų6855.2 Ų55.236%0.35628%0.278SS..Hα-helixtrans-68.8-31.2169.1-134.581.5000112.5V43 E44 V45 S46 H51 I121V43-L48 HydrophobicContact CG1-CD1 3.9Å; E44-L48 PolarHBondContact O-N 3.45Å; E44-L48 VanDerWaalsContact O-N 3.12Å; V45-L48 VanDerWaalsContact O-CB 3.25Å; V45-L48 WeakPolarHBondContact O-CB 3.45Å; V45-L48 PolarHBondContact O-N 2.99Å; V45-L48 VanDerWaalsContact O-N 3.17Å; S46-L48 VanDerWaalsContact C-N 3.3Å; L48-H51 WeakPolarHBondContact O-CB 3.48Å; L48-I121 HydrophobicContact CD1-CG2 3.87Å
49E67.4Low73.9Confident106 Ų10659.1 Ų59.150%0.49530%0.299SS..Hα-helixtrans-72.4-41.1169.4-162.5-171152.700111V45 S46 Q47 H51 I52 R53V45-E49 PolarHBondContact O-N 2.84Å; V45-E49 VanDerWaalsContact O-N 3.11Å; S46-E49 WeakPolarHBondContact O-CB 3.48Å; S46-E49 PolarHBondContact O-N 3.04Å; Q47-E49 VanDerWaalsContact C-N 3.34Å; E49-H51 VanDerWaalsContact C-N 3.27Å; E49-H51 PolarHBondContact O-N 2.91Å; E49-I52 PolarHBondContact O-N 3.12Å; E49-I52 VanDerWaalsContact O-N 3.14Å; E49-R53 PolarHBondContact O-N 2.94Å; E49-R53 IonicContact OE1-CZ 3.24Å; E49-R53 IonicContact OE1-NE 2.92Å; E49-R53 PolarHBondContact OE1-NE 3.28Å; E49-R53 IonicContact OE1-NH2 2.75Å; E49-R53 PolarHBondContact OE1-NH2 3.19Å
50E64.8Low74.7Confident51 Ų5158.9 Ų58.924%0.23830%0.297CS..Hα-helixtrans-65-29.9175.6-160.7171.8-157.700112.5S46 Q47 I52 R53 R54 I118S46-E50 PolarHBondContact O-N 3.34Å; Q47-E50 PolarHBondContact O-N 3.5Å; E50-I52 VanDerWaalsContact C-N 3.3Å; E50-I52 PolarHBondContact O-N 3.34Å; E50-R53 CarbonylContact O-C 3.35Å; E50-R53 WeakPolarHBondContact O-CA 3.42Å; E50-R53 PolarHBondContact O-N 2.7Å; E50-R54 HydrophobicContact CG-CG 4.02Å; E50-R54 PolarHBondContact O-N 3.48Å; E50-R54 IonicContact OE1-CZ 2.95Å; E50-R54 IonicContact OE1-NE 3.45Å; E50-R54 PolarHBondContact OE1-NE 3.37Å; E50-R54 IonicContact OE1-NH2 2.66Å; E50-R54 PolarHBondContact OE1-NH2 3.11Å; E50-I118 HydrophobicContact CB-CD1 4.46Å; E50-I118 HydrophobicContact CG-CD1 4.29Å
51H66.1Low75.4Confident47 Ų4758.9 Ų58.922%0.21830%0.297CS..Hα-helixtrans-58.4-36.7171169.899000112.8Q47 L48 E49 R53 V58 S122Q47-H51 WeakPolarHBondContact O-CB 3.29Å; Q47-H51 PolarHBondContact O-N 3.1Å; L48-H51 WeakPolarHBondContact O-CB 3.48Å; E49-H51 VanDerWaalsContact C-N 3.27Å; E49-H51 PolarHBondContact O-N 2.91Å; H51-R53 VanDerWaalsContact C-N 3.33Å; H51-V58 VanDerWaalsContact CE1-CG2 3.45Å; H51-V58 WeakPolarHBondContact CE1-CG2 3.48Å; H51-S122 PolarHBondContact CE1-OG 2.83Å; H51-S122 PolarHBondContact ND1-OG 2.96Å
52I63.5Low76Confident142 Ų14262 Ų6273%0.72831%0.314SS*.Hα-helixtrans-70.5-31.9173.1-62176000111E49 E50E49-I52 PolarHBondContact O-N 3.12Å; E49-I52 VanDerWaalsContact O-N 3.14Å; E50-I52 VanDerWaalsContact C-N 3.3Å; E50-I52 PolarHBondContact O-N 3.34Å
53R67.9Low77.2Confident182 Ų18262.7 Ų62.769%0.68732%0.318SS*.Hα-helixtrans-86.5-22.2-176.8-60.4-176.8-174.4-152.15.2114.3E49 E50 H51 P55E49-R53 PolarHBondContact O-N 2.94Å; E49-R53 IonicContact OE1-CZ 3.24Å; E49-R53 IonicContact OE1-NE 2.92Å; E49-R53 PolarHBondContact OE1-NE 3.28Å; E49-R53 IonicContact OE1-NH2 2.75Å; E49-R53 PolarHBondContact OE1-NH2 3.19Å; E50-R53 CarbonylContact O-C 3.35Å; E50-R53 WeakPolarHBondContact O-CA 3.42Å; E50-R53 PolarHBondContact O-N 2.7Å; H51-R53 VanDerWaalsContact C-N 3.33Å; R53-P55 VanDerWaalsContact O-CD 3.29Å; R53-P55 WeakPolarHBondContact O-CD 3.14Å
54R71.3Confident78.3Confident93 Ų9362.1 Ų62.135%0.35131%0.314SS..  trans-115.676.4-177.9-66.9-166.7-173.4-153.216.3112.6E50 I56 G57 E112E50-R54 HydrophobicContact CG-CG 4.02Å; E50-R54 PolarHBondContact O-N 3.48Å; E50-R54 IonicContact OE1-CZ 2.95Å; E50-R54 IonicContact OE1-NE 3.45Å; E50-R54 PolarHBondContact OE1-NE 3.37Å; E50-R54 IonicContact OE1-NH2 2.66Å; E50-R54 PolarHBondContact OE1-NH2 3.11Å; R54-I56 PolarHBondContact O-N 3.26Å; R54-I56 VanDerWaalsContact O-N 3.11Å; R54-G57 PolarHBondContact O-N 3.25Å; R54-E112 IonicContact CZ-OE1 3.4Å; R54-E112 IonicContact NH1-OE1 3.88Å; R54-E112 PolarHBondContact NH1-OE1 2.9Å
55P81.8Confident79.4Confident91 Ų9159.4 Ų59.459%0.59130%0.302SS*.Hα-helixtrans-62.2-24.3-176.225.7-35.7000114.2R53 G57 V58 L59R53-P55 VanDerWaalsContact O-CD 3.29Å; R53-P55 WeakPolarHBondContact O-CD 3.14Å; P55-G57 PolarHBondContact O-N 2.8Å; P55-V58 PolarHBondContact O-N 2.78Å; P55-L59 PolarHBondContact O-N 3.41Å
56I85.8Confident80.6Confident89 Ų8956.9 Ų56.946%0.45629%0.286SS..Hα-helixtrans-60.4-42.7179.6-64.2166.6000111.3R54 V58 L59 L60 L243R54-I56 PolarHBondContact O-N 3.26Å; R54-I56 VanDerWaalsContact O-N 3.11Å; I56-V58 VanDerWaalsContact C-N 3.33Å; I56-V58 PolarHBondContact O-N 2.84Å; I56-L59 PolarHBondContact O-N 3.48Å; I56-L60 HydrophobicContact CG2-CD1 3.68Å; I56-L60 HydrophobicContact CG2-CG 4.26Å; I56-L60 WeakPolarHBondContact O-CB 3.35Å; I56-L60 WeakPolarHBondContact O-CD1 3.38Å; I56-L60 VanDerWaalsContact O-CG 3.23Å; I56-L60 WeakPolarHBondContact O-CG 3.38Å; I56-L60 PolarHBondContact O-N 3.4Å; I56-L243 HydrophobicContact CG2-CD2 4.1Å
57G85.1Confident82Confident1 Ų156.5 Ų56.51%0.0128%0.28CS..Hα-helixtrans-64-38.3179.100000112.6R54 P55 A61 M119R54-G57 PolarHBondContact O-N 3.25Å; P55-G57 PolarHBondContact O-N 2.8Å; G57-A61 WeakPolarHBondContact O-CB 3.37Å; G57-A61 PolarHBondContact O-N 2.84Å; G57-M119 WeakPolarHBondContact O-CG 3.47Å
58V88.4Confident83.3Confident37 Ų3757 Ų5722%0.22428%0.283CS..Hα-helixtrans-67.8-43.3177.3-169.10000111.1H51 P55 I56 A61 L62H51-V58 VanDerWaalsContact CE1-CG2 3.45Å; H51-V58 WeakPolarHBondContact CE1-CG2 3.48Å; P55-V58 PolarHBondContact O-N 2.78Å; I56-V58 VanDerWaalsContact C-N 3.33Å; I56-V58 PolarHBondContact O-N 2.84Å; V58-A61 PolarHBondContact O-N 3.4Å; V58-L62 PolarHBondContact O-N 3.44Å
59L91.9Very high84.7Confident81 Ų8153.8 Ų53.842%0.42427%0.266SS..Hα-helixtrans-64-44.3177-179.960.9000111.9P55 I56 L62 V63 F241P55-L59 PolarHBondContact O-N 3.41Å; I56-L59 PolarHBondContact O-N 3.48Å; L59-L62 PolarHBondContact O-N 2.87Å; L59-V63 HydrophobicContact CD1-CG2 4.12Å; L59-V63 WeakPolarHBondContact O-CG2 3.49Å; L59-V63 PolarHBondContact O-N 3.25Å; L59-F241 HydrophobicContact CD2-CE1 3.79Å; L59-F241 HydrophobicContact CD2-CZ 3.93Å; L59-F241 HydrophobicContact CG-CZ 4.46Å
60L92.5Very high86Confident1 Ų148.7 Ų48.71%0.00524%0.243CC..Hα-helixtrans-62.2-43.2175.3-69.2165000111.2I56 L62 V63 C64 M119 L237 F241 L243 V251I56-L60 HydrophobicContact CG2-CD1 3.68Å; I56-L60 HydrophobicContact CG2-CG 4.26Å; I56-L60 WeakPolarHBondContact O-CB 3.35Å; I56-L60 WeakPolarHBondContact O-CD1 3.38Å; I56-L60 VanDerWaalsContact O-CG 3.23Å; I56-L60 WeakPolarHBondContact O-CG 3.38Å; I56-L60 PolarHBondContact O-N 3.4Å; L60-L62 VanDerWaalsContact C-N 3.33Å; L60-L62 PolarHBondContact O-N 2.88Å; L60-V63 PolarHBondContact O-N 2.87Å; L60-C64 WeakPolarHBondContact O-CB 3.33Å; L60-C64 PolarHBondContact O-N 3.47Å; L60-C64 PolarHBondContact O-SG 3.34Å; L60-C64 VanDerWaalsContact O-SG 3.36Å; L60-M119 HydrophobicContact CB-CE 3.9Å; L60-M119 HydrophobicContact CB-SD 4.11Å; L60-L237 HydrophobicContact CD2-CD2 3.77Å; L60-L237 HydrophobicContact CD2-CG 4.15Å; L60-F241 HydrophobicContact CD2-CD2 4.08Å; L60-F241 HydrophobicContact CD2-CE2 4.37Å; L60-F241 HydrophobicContact CD2-CG 4.23Å; L60-L243 HydrophobicContact CD1-CD1 3.61Å; L60-V251 HydrophobicContact CD1-CG2 3.97Å; L60-V251 HydrophobicContact CD2-CG1 4.45Å
61A90.9Very high87.5Confident0 Ų049.6 Ų49.60%025%0.248CC..Hα-helixtrans-59.9-42.8176.100000112.3G57 V58 Q65 M119G57-A61 WeakPolarHBondContact O-CB 3.37Å; G57-A61 PolarHBondContact O-N 2.84Å; V58-A61 PolarHBondContact O-N 3.4Å; A61-Q65 WeakPolarHBondContact O-CB 3.42Å; A61-Q65 WeakPolarHBondContact O-CG 3.31Å; A61-Q65 PolarHBondContact O-N 2.9Å; A61-M119 HydrophobicContact CB-CB 4.11Å; A61-M119 HydrophobicContact CB-CG 4.21Å
62L93.9Very high89Confident65 Ų6548.4 Ų48.434%0.3425%0.245SC..Hα-helixtrans-63.7-50.8177.1-174.3155000111.5V58 L59 L60 F66 V67 L126 L130V58-L62 PolarHBondContact O-N 3.44Å; L59-L62 PolarHBondContact O-N 2.87Å; L60-L62 VanDerWaalsContact C-N 3.33Å; L60-L62 PolarHBondContact O-N 2.88Å; L62-F66 WeakPolarHBondContact O-CB 3.29Å; L62-F66 PolarHBondContact O-N 3.4Å; L62-V67 HydrophobicContact CD2-CG2 4.43Å; L62-L126 HydrophobicContact CB-CD1 4.06Å; L62-L126 HydrophobicContact CD1-CD1 4.41Å; L62-L126 HydrophobicContact CG-CD1 4.49Å; L62-L130 HydrophobicContact CD1-CD1 4.42Å; L62-L130 HydrophobicContact CG-CD1 4.24Å
63V95.6Very high90.5Very high34 Ų3441.7 Ų41.721%0.20621%0.21CC..Hα-helixtrans-69.1-45.5-176.8176.20000111.2L59 L60 V67 I68 L237L59-V63 HydrophobicContact CD1-CG2 4.12Å; L59-V63 WeakPolarHBondContact O-CG2 3.49Å; L59-V63 PolarHBondContact O-N 3.25Å; L60-V63 PolarHBondContact O-N 2.87Å; V63-V67 WeakPolarHBondContact O-CA 3.41Å; V63-V67 VanDerWaalsContact O-CB 3.31Å; V63-V67 WeakPolarHBondContact O-CB 3.28Å; V63-V67 PolarHBondContact O-N 2.86Å; V63-I68 HydrophobicContact CG1-CD1 4.09Å; V63-I68 HydrophobicContact CG1-CG1 4.29Å; V63-I68 PolarHBondContact O-N 3.21Å; V63-L237 HydrophobicContact CB-CD2 4.09Å; V63-L237 HydrophobicContact CG1-CD1 4.17Å; V63-L237 HydrophobicContact CG1-CD2 3.7Å
64C94.7Very high91.8Very high0 Ų034.9 Ų34.90%019%0.186CC..Iπ-helixtrans-64.1-53.5178.8-710000112.2L60 M69 M119 L237 T255L60-C64 WeakPolarHBondContact O-CB 3.33Å; L60-C64 PolarHBondContact O-N 3.47Å; L60-C64 PolarHBondContact O-SG 3.34Å; L60-C64 VanDerWaalsContact O-SG 3.36Å; C64-M69 WeakPolarHBondContact O-CB 3.24Å; C64-M69 PolarHBondContact O-N 3.4Å; C64-M119 HydrophobicContact CB-CE 4.47Å; C64-L237 VanDerWaalsContact SG-CD2 3.5Å; C64-T255 HydrophobicContact CB-CG2 3.86Å; C64-T255 WeakPolarHBondContact CB-OG1 3.45Å; C64-T255 PolarHBondContact SG-OG1 2.91Å
65Q94.9Very high92.9Very high1 Ų134.9 Ų34.91%0.00519%0.192CC..Iπ-helixtrans-88.3-22.3-168.4-50.7-60.727.700114.6A61 P70 G98 E254 Q258A61-Q65 WeakPolarHBondContact O-CB 3.42Å; A61-Q65 WeakPolarHBondContact O-CG 3.31Å; A61-Q65 PolarHBondContact O-N 2.9Å; Q65-P70 VanDerWaalsContact O-CD 3.28Å; Q65-P70 WeakPolarHBondContact O-CD 3.31Å; Q65-G98 VanDerWaalsContact NE2-CA 3.34Å; Q65-E254 PolarHBondContact NE2-O 2.98Å; Q65-Q258 VanDerWaalsContact OE1-NE2 3.08Å
66F94.8Very high93.6Very high10 Ų1031.4 Ų31.44%0.04417%0.168CC..Iπ-helixtrans-120-3.6-178-58.2-69.5000114.7L62 S123 L126 A127 L130 M131 C134L62-F66 WeakPolarHBondContact O-CB 3.29Å; L62-F66 PolarHBondContact O-N 3.4Å; F66-S123 WeakPolarHBondContact CZ-O 3.38Å; F66-L126 HydrophobicContact CD2-CB 4.28Å; F66-L126 HydrophobicContact CE2-CB 3.69Å; F66-L126 HydrophobicContact CZ-CB 4.35Å; F66-A127 HydrophobicContact CE1-CB 4.28Å; F66-A127 VanDerWaalsContact CZ-CA 3.5Å; F66-A127 HydrophobicContact CZ-CB 3.84Å; F66-L130 HydrophobicContact CB-CB 4.1Å; F66-L130 HydrophobicContact CB-CD1 3.83Å; F66-L130 HydrophobicContact CD1-CB 3.45Å; F66-L130 VanDerWaalsContact CD1-CB 3.45Å; F66-L130 HydrophobicContact CD1-CD1 4.44Å; F66-L130 HydrophobicContact CD2-CB 4.03Å; F66-L130 HydrophobicContact CD2-CD1 3.56Å; F66-L130 HydrophobicContact CD2-CG 4.42Å; F66-L130 HydrophobicContact CE1-CB 3.84Å; F66-L130 HydrophobicContact CE2-CB 4.35Å; F66-L130 HydrophobicContact CE2-CD1 4.26Å; F66-L130 HydrophobicContact CG-CB 3.55Å; F66-L130 HydrophobicContact CG-CD1 3.66Å; F66-L130 HydrophobicContact CG-CG 4.26Å; F66-L130 HydrophobicContact CZ-CB 4.28Å; F66-M131 HydrophobicContact CE1-CB 4.36Å; F66-C134 PolarHBondContact O-SG 2.86Å; F66-C134 VanDerWaalsContact O-SG 3.37Å
67V95.4Very high93.9Very high68 Ų6827.2 Ų27.241%0.41215%0.147SC..Iπ-helixtrans-116-61.1170.2-171.90000110.7L62 V63 L71L62-V67 HydrophobicContact CD2-CG2 4.43Å; V63-V67 WeakPolarHBondContact O-CA 3.41Å; V63-V67 VanDerWaalsContact O-CB 3.31Å; V63-V67 WeakPolarHBondContact O-CB 3.28Å; V63-V67 PolarHBondContact O-N 2.86Å; V67-L71 WeakPolarHBondContact O-CB 3.31Å; V67-L71 PolarHBondContact O-N 3.26Å
68I96Very high94.3Very high30 Ų3031 Ų3115%0.15417%0.167CC..Iπ-helixtrans-66.7-54.6-174.6-65.7174.7000111.1V63 L71 V72 A233 L237V63-I68 HydrophobicContact CG1-CD1 4.09Å; V63-I68 HydrophobicContact CG1-CG1 4.29Å; V63-I68 PolarHBondContact O-N 3.21Å; I68-L71 PolarHBondContact O-N 3.43Å; I68-V72 HydrophobicContact CG2-CG2 4.19Å; I68-V72 WeakPolarHBondContact O-CB 3.49Å; I68-V72 VanDerWaalsContact O-CG2 3.32Å; I68-V72 WeakPolarHBondContact O-CG2 3.33Å; I68-V72 PolarHBondContact O-N 3.39Å; I68-A233 HydrophobicContact CG2-CB 3.58Å; I68-L237 HydrophobicContact CD1-CB 4.44Å; I68-L237 HydrophobicContact CD1-CD1 4.5Å; I68-L237 HydrophobicContact CD1-CD2 4.06Å
69M95.8Very high94.5Very high0 Ų033 Ų330%019%0.187CC..Hα-helixtrans-63.4-46-174-93.9-81.7146.900114.7C64 L71 V72 A73 G94 M226 T255 Q258C64-M69 WeakPolarHBondContact O-CB 3.24Å; C64-M69 PolarHBondContact O-N 3.4Å; M69-L71 VanDerWaalsContact C-N 3.32Å; M69-L71 PolarHBondContact O-N 3.03Å; M69-V72 PolarHBondContact O-N 3.14Å; M69-A73 WeakPolarHBondContact O-CB 3.36Å; M69-A73 PolarHBondContact O-N 2.97Å; M69-G94 CarbonylContact C-O 3.5Å; M69-G94 WeakPolarHBondContact CB-O 3.46Å; M69-M226 WeakPolarHBondContact CE-O 3.36Å; M69-M226 HydrophobicContact SD-CE 4.09Å; M69-T255 HydrophobicContact CE-CG2 4.48Å; M69-T255 WeakPolarHBondContact CE-O 3.29Å; M69-T255 HydrophobicContact CG-CG2 4.17Å; M69-T255 WeakPolarHBondContact CG-O 3.25Å; M69-Q258 HydrophobicContact SD-CG 4.11Å; M69-Q258 PolarHBondContact SD-NE2 2.77Å
70P95.7Very high94.6Very high0 Ų032.6 Ų32.60%018%0.182CC..Hα-helixtrans-61.9-38.1172.8-2736.5000112.8Q65 A73 F74 G94 C134 Y138Q65-P70 VanDerWaalsContact O-CD 3.28Å; Q65-P70 WeakPolarHBondContact O-CD 3.31Å; P70-A73 PolarHBondContact O-N 3.02Å; P70-F74 VanDerWaalsContact O-CB 3.23Å; P70-F74 WeakPolarHBondContact O-CB 3.48Å; P70-F74 PolarHBondContact O-N 3Å; P70-G94 VanDerWaalsContact CD-O 3.28Å; P70-G94 WeakPolarHBondContact CD-O 3.14Å; P70-G94 WeakPolarHBondContact CG-O 3.47Å; P70-C134 HydrophobicContact CB-CB 4.33Å; P70-C134 HydrophobicContact CG-CB 4.22Å; P70-Y138 HydrophobicContact CB-CD2 3.68Å; P70-Y138 HydrophobicContact CB-CE2 3.36Å; P70-Y138 HydrophobicContact CG-CE2 4.48Å
71L95.8Very high94.4Very high69 Ų6937.5 Ų37.536%0.36122%0.216SC..Hα-helixtrans-67.5-42177.2-179.563.1000111.8V67 I68 M69 F74 L75 Y138V67-L71 WeakPolarHBondContact O-CB 3.31Å; V67-L71 PolarHBondContact O-N 3.26Å; I68-L71 PolarHBondContact O-N 3.43Å; M69-L71 VanDerWaalsContact C-N 3.32Å; M69-L71 PolarHBondContact O-N 3.03Å; L71-F74 PolarHBondContact O-N 3.36Å; L71-L75 HydrophobicContact CD1-CD1 3.96Å; L71-L75 HydrophobicContact CD1-CG 4Å; L71-L75 HydrophobicContact CG-CD1 3.89Å; L71-L75 HydrophobicContact CG-CG 4.32Å; L71-L75 WeakPolarHBondContact O-CB 3.43Å; L71-L75 VanDerWaalsContact O-CG 3.24Å; L71-L75 WeakPolarHBondContact O-CG 3.35Å; L71-L75 PolarHBondContact O-N 2.96Å; L71-Y138 HydrophobicContact CD1-CE1 4.25Å
72V96.6Very high94.2Very high23 Ų2338 Ų3814%0.13922%0.219CC..Hα-helixtrans-61.8-47.7174.7167.80000110.2I68 M69 F74 L75 L76 M226 C229I68-V72 HydrophobicContact CG2-CG2 4.19Å; I68-V72 WeakPolarHBondContact O-CB 3.49Å; I68-V72 VanDerWaalsContact O-CG2 3.32Å; I68-V72 WeakPolarHBondContact O-CG2 3.33Å; I68-V72 PolarHBondContact O-N 3.39Å; M69-V72 PolarHBondContact O-N 3.14Å; V72-F74 VanDerWaalsContact C-N 3.35Å; V72-F74 PolarHBondContact O-N 3.38Å; V72-L75 PolarHBondContact O-N 2.84Å; V72-L76 HydrophobicContact CG1-CD1 3.71Å; V72-L76 HydrophobicContact CG1-CG 4.35Å; V72-L76 WeakPolarHBondContact O-CB 3.47Å; V72-L76 VanDerWaalsContact O-CG 3.26Å; V72-L76 WeakPolarHBondContact O-CG 3.43Å; V72-L76 PolarHBondContact O-N 3.02Å; V72-M226 HydrophobicContact CG1-CG 4.15Å; V72-C229 HydrophobicContact CG1-CB 3.61Å; V72-C229 HydrophobicContact CG2-CB 4.34Å
73A95.8Very high93.9Very high0 Ų038.3 Ų38.30%022%0.221CC..Hα-helixtrans-57.7-46175.900000112.1M69 P70 A77 V90 L91 M226M69-A73 WeakPolarHBondContact O-CB 3.36Å; M69-A73 PolarHBondContact O-N 2.97Å; P70-A73 PolarHBondContact O-N 3.02Å; A73-A77 VanDerWaalsContact O-CB 3.31Å; A73-A77 WeakPolarHBondContact O-CB 3.45Å; A73-A77 PolarHBondContact O-N 3.35Å; A73-V90 HydrophobicContact CB-CG1 3.9Å; A73-V90 WeakPolarHBondContact O-CG1 3.42Å; A73-L91 HydrophobicContact CB-CD2 4.42Å; A73-M226 HydrophobicContact CB-CE 3.92Å; A73-M226 HydrophobicContact CB-SD 4.04Å
74F94.9Very high93.4Very high40 Ų4039.3 Ų39.318%0.17523%0.225CC..Hα-helixtrans-62-50177.3178.4-100.2000112.9P70 L71 V72 A77 L78 L91 Y138 A141 W142P70-F74 VanDerWaalsContact O-CB 3.23Å; P70-F74 WeakPolarHBondContact O-CB 3.48Å; P70-F74 PolarHBondContact O-N 3Å; L71-F74 PolarHBondContact O-N 3.36Å; V72-F74 VanDerWaalsContact C-N 3.35Å; V72-F74 PolarHBondContact O-N 3.38Å; F74-A77 PolarHBondContact O-N 3.21Å; F74-L78 HydrophobicContact CD1-CD1 4.02Å; F74-L78 HydrophobicContact CE1-CD1 3.44Å; F74-L78 VanDerWaalsContact CE1-CD1 3.44Å; F74-L78 HydrophobicContact CE2-CD1 4.2Å; F74-L78 HydrophobicContact CZ-CD1 3.55Å; F74-L78 HydrophobicContact CZ-CG 4.47Å; F74-L78 PolarHBondContact O-N 3.39Å; F74-L91 HydrophobicContact CB-CD2 3.93Å; F74-L91 HydrophobicContact CD2-CD2 4.33Å; F74-Y138 HydrophobicContact CB-CD1 3.68Å; F74-Y138 HydrophobicContact CB-CE1 4.16Å; F74-Y138 HydrophobicContact CB-CG 4.32Å; F74-Y138 HydrophobicContact CD1-CD1 4.11Å; F74-Y138 HydrophobicContact CD1-CE1 4.4Å; F74-Y138 AromaticContact CD2-CD1 3.6Å; F74-Y138 HydrophobicContact CD2-CD1 3.6Å; F74-Y138 HydrophobicContact CD2-CG 4.22Å; F74-Y138 HydrophobicContact CE2-CD1 4.21Å; F74-Y138 WeakPolarHBondContact CE2-O 3.41Å; F74-Y138 AromaticContact CG-CD1 3.54Å; F74-Y138 HydrophobicContact CG-CD1 3.54Å; F74-Y138 HydrophobicContact CG-CE1 4.17Å; F74-Y138 HydrophobicContact CG-CG 4.41Å; F74-A141 HydrophobicContact CE2-CB 3.65Å; F74-A141 HydrophobicContact CZ-CB 4Å; F74-W142 AromaticContact CD2-CH2 3.83Å; F74-W142 HydrophobicContact CD2-CH2 3.83Å; F74-W142 AromaticContact CD2-CZ3 3.57Å; F74-W142 HydrophobicContact CD2-CZ3 3.57Å; F74-W142 HydrophobicContact CE2-CH2 4.01Å; F74-W142 AromaticContact CE2-CZ3 3.6Å; F74-W142 HydrophobicContact CE2-CZ3 3.6Å
75L95.4Very high92.9Very high92 Ų9240.8 Ų40.848%0.48223%0.234SC..Hα-helixtrans-66.2-38.4-179-70.6175.2000111.8L71 V72 A79L71-L75 HydrophobicContact CD1-CD1 3.96Å; L71-L75 HydrophobicContact CD1-CG 4Å; L71-L75 HydrophobicContact CG-CD1 3.89Å; L71-L75 HydrophobicContact CG-CG 4.32Å; L71-L75 WeakPolarHBondContact O-CB 3.43Å; L71-L75 VanDerWaalsContact O-CG 3.24Å; L71-L75 WeakPolarHBondContact O-CG 3.35Å; L71-L75 PolarHBondContact O-N 2.96Å; V72-L75 PolarHBondContact O-N 2.84Å; L75-A79 WeakPolarHBondContact O-CB 3.24Å; L75-A79 PolarHBondContact O-N 3.36Å
76L95.5Very high92.5Very high19 Ų1941.1 Ų41.110%0.09924%0.237CC..Hα-helixtrans-67.4-42.8174.8-71.6173.5000111.7V72 L78 A79 F80 V222 L225 M226V72-L76 HydrophobicContact CG1-CD1 3.71Å; V72-L76 HydrophobicContact CG1-CG 4.35Å; V72-L76 WeakPolarHBondContact O-CB 3.47Å; V72-L76 VanDerWaalsContact O-CG 3.26Å; V72-L76 WeakPolarHBondContact O-CG 3.43Å; V72-L76 PolarHBondContact O-N 3.02Å; L76-L78 VanDerWaalsContact C-N 3.31Å; L76-L78 PolarHBondContact O-N 2.87Å; L76-A79 PolarHBondContact O-N 2.83Å; L76-F80 HydrophobicContact CD2-CD2 4.19Å; L76-F80 HydrophobicContact CD2-CE2 3.82Å; L76-F80 WeakPolarHBondContact O-CD2 3.32Å; L76-F80 PolarHBondContact O-N 2.92Å; L76-V222 HydrophobicContact CB-CG1 3.92Å; L76-V222 HydrophobicContact CB-CG2 4.11Å; L76-V222 HydrophobicContact CD1-CG1 4.32Å; L76-L225 HydrophobicContact CD1-CB 4.29Å; L76-L225 HydrophobicContact CD2-CB 4.14Å; L76-L225 HydrophobicContact CD2-CD1 4.27Å; L76-M226 HydrophobicContact CD1-CB 3.6Å; L76-M226 HydrophobicContact CD1-CG 4.14Å
77A93.1Very high92.2Very high1 Ų140.6 Ų40.61%0.00824%0.235CC..Hα-helixtrans-60.5-39.617700000112.5A73 F74 S81 L82 A87 V90 W142A73-A77 VanDerWaalsContact O-CB 3.31Å; A73-A77 WeakPolarHBondContact O-CB 3.45Å; A73-A77 PolarHBondContact O-N 3.35Å; F74-A77 PolarHBondContact O-N 3.21Å; A77-S81 PolarHBondContact O-N 3.34Å; A77-L82 HydrophobicContact CB-CD1 4.1Å; A77-L82 PolarHBondContact O-N 2.83Å; A77-A87 HydrophobicContact CB-CB 4.14Å; A77-V90 HydrophobicContact CB-CG1 4.39Å; A77-W142 HydrophobicContact CB-CH2 3.9Å; A77-W142 HydrophobicContact CB-CZ2 3.82Å
78L91.6Very high91.8Very high80 Ų8037.5 Ų37.542%0.41922%0.216SC..Hα-helixtrans-71.7-48.2173.9-72.6179.1000112.9F74 L76 F80 S81 W142F74-L78 HydrophobicContact CD1-CD1 4.02Å; F74-L78 HydrophobicContact CE1-CD1 3.44Å; F74-L78 VanDerWaalsContact CE1-CD1 3.44Å; F74-L78 HydrophobicContact CE2-CD1 4.2Å; F74-L78 HydrophobicContact CZ-CD1 3.55Å; F74-L78 HydrophobicContact CZ-CG 4.47Å; F74-L78 PolarHBondContact O-N 3.39Å; L76-L78 VanDerWaalsContact C-N 3.31Å; L76-L78 PolarHBondContact O-N 2.87Å; L78-F80 VanDerWaalsContact C-N 3.28Å; L78-F80 PolarHBondContact O-N 2.94Å; L78-S81 PolarHBondContact O-N 3.14Å; L78-S81 VanDerWaalsContact O-N 3.1Å; L78-W142 HydrophobicContact CD2-CH2 4.04Å; L78-W142 HydrophobicContact CD2-CZ2 3.82Å; L78-W142 HydrophobicContact CG-CH2 4.04Å; L78-W142 HydrophobicContact CG-CZ2 4.19Å
79A94.1Very high91.5Very high78 Ų7836.1 Ų36.165%0.64521%0.208SC*.Hα-helixtrans-64.4-32.4-174.800000113L75 L76L75-A79 WeakPolarHBondContact O-CB 3.24Å; L75-A79 PolarHBondContact O-N 3.36Å; L76-A79 PolarHBondContact O-N 2.83Å
80F92.8Very high91.4Very high74 Ų7436.1 Ų36.133%0.32521%0.208SC..THydrogen-bonded Turntrans-97.18.6176.4-70.5-79.8000113.7L76 L78 L82 V221 V222 L225L76-F80 HydrophobicContact CD2-CD2 4.19Å; L76-F80 HydrophobicContact CD2-CE2 3.82Å; L76-F80 WeakPolarHBondContact O-CD2 3.32Å; L76-F80 PolarHBondContact O-N 2.92Å; L78-F80 VanDerWaalsContact C-N 3.28Å; L78-F80 PolarHBondContact O-N 2.94Å; F80-L82 VanDerWaalsContact C-N 3.3Å; F80-L82 HydrophobicContact CB-CD2 4.39Å; F80-L82 PolarHBondContact O-N 3.11Å; F80-V221 HydrophobicContact CD1-CG1 4.15Å; F80-V221 HydrophobicContact CE1-CB 4.29Å; F80-V221 HydrophobicContact CE1-CG1 3.46Å; F80-V221 VanDerWaalsContact CE1-CG1 3.46Å; F80-V221 HydrophobicContact CE2-CG1 4.2Å; F80-V221 HydrophobicContact CZ-CG1 3.49Å; F80-V221 VanDerWaalsContact CZ-CG1 3.49Å; F80-V222 HydrophobicContact CB-CG2 3.87Å; F80-V222 HydrophobicContact CD2-CG2 3.56Å; F80-V222 HydrophobicContact CE2-CG2 4.39Å; F80-V222 HydrophobicContact CG-CG2 3.85Å; F80-L225 HydrophobicContact CE2-CD1 3.67Å; F80-L225 HydrophobicContact CZ-CD1 3.6Å
81S89.4Confident91.2Very high104 Ų10436.1 Ų36.173%0.72721%0.208SC*.THydrogen-bonded Turntrans45.751.6178.6-60.50000112.8A77 L78A77-S81 PolarHBondContact O-N 3.34Å; L78-S81 PolarHBondContact O-N 3.14Å; L78-S81 VanDerWaalsContact O-N 3.1Å
82L87.2Confident91Very high9 Ų932.9 Ų32.95%0.04719%0.192CC..  trans-63.9146.2179.3-64.5-172.7000111.3A77 F80 A86 A87 V90 S218 V219 V222A77-L82 HydrophobicContact CB-CD1 4.1Å; A77-L82 PolarHBondContact O-N 2.83Å; F80-L82 VanDerWaalsContact C-N 3.3Å; F80-L82 HydrophobicContact CB-CD2 4.39Å; F80-L82 PolarHBondContact O-N 3.11Å; L82-A86 HydrophobicContact CB-CB 4.39Å; L82-A86 HydrophobicContact CD1-CB 4.44Å; L82-A87 HydrophobicContact CB-CB 4.09Å; L82-V90 HydrophobicContact CD1-CB 4.39Å; L82-V90 HydrophobicContact CD1-CG2 3.65Å; L82-S218 WeakPolarHBondContact CD2-OG 3.5Å; L82-V219 HydrophobicContact CD2-CG2 4.15Å; L82-V222 HydrophobicContact CD1-CG1 4.41Å; L82-V222 HydrophobicContact CD1-CG2 4.21Å; L82-V222 HydrophobicContact CD2-CG2 4.43Å
83D86.8Confident90.8Very high72 Ų7231.8 Ų31.839%0.38519%0.185SC..  trans-62.3155.2168.164.7-81.4000110.9V85 A86 A87D83-V85 PolarHBondContact O-N 3.36Å; D83-V85 VanDerWaalsContact O-N 3.07Å; D83-V85 WeakPolarHBondContact OD2-CB 3.37Å; D83-V85 PolarHBondContact OD2-N 3.47Å; D83-A86 PolarHBondContact O-N 3.07Å; D83-A86 WeakPolarHBondContact OD1-CB 3.4Å; D83-A86 PolarHBondContact OD2-N 3.38Å; D83-A87 VanDerWaalsContact O-CB 3.28Å; D83-A87 WeakPolarHBondContact O-CB 3.3Å; D83-A87 PolarHBondContact O-N 2.65Å
84D85.3Confident90.7Very high56 Ų5631.8 Ų31.830%0.29919%0.185SC..Hα-helixtrans-54.5-34-174.6-51.4-28.6000113.2M88 T145 V147D84-M88 WeakPolarHBondContact O-CB 3.44Å; D84-M88 VanDerWaalsContact O-CG 3.25Å; D84-M88 WeakPolarHBondContact O-CG 3.5Å; D84-M88 PolarHBondContact O-N 3.4Å; D84-M88 VanDerWaalsContact O-N 3.08Å; D84-T145 HydrophobicContact CB-CG2 4.21Å; D84-T145 VanDerWaalsContact OD1-CG2 3.3Å; D84-T145 WeakPolarHBondContact OD1-CG2 3.28Å; D84-T145 VanDerWaalsContact OD2-CB 3.31Å; D84-T145 WeakPolarHBondContact OD2-CB 3.42Å; D84-T145 WeakPolarHBondContact OD2-CG2 3.35Å; D84-V147 HydrophobicContact CB-CB 4.19Å; D84-V147 HydrophobicContact CB-CG2 3.81Å
85V83.9Confident90.6Very high30 Ų3029.9 Ų29.918%0.18218%0.177CC..Hα-helixtrans-75.4-47-176.7-176.90000110.2D83 A89 V147 L275 M279D83-V85 PolarHBondContact O-N 3.36Å; D83-V85 VanDerWaalsContact O-N 3.07Å; D83-V85 WeakPolarHBondContact OD2-CB 3.37Å; D83-V85 PolarHBondContact OD2-N 3.47Å; V85-A89 PolarHBondContact O-N 3.26Å; V85-V147 HydrophobicContact CG2-CG2 4Å; V85-L275 HydrophobicContact CG2-CD2 4.44Å; V85-M279 HydrophobicContact CG1-CG 3.34Å; V85-M279 HydrophobicContact CG1-SD 4.32Å
86A86.3Confident90.4Very high8 Ų825.5 Ų25.57%0.06615%0.154CC..Hα-helixtrans-66.3-43.1173.900000112.2L82 D83 M88 A89 V90 V219L82-A86 HydrophobicContact CB-CB 4.39Å; L82-A86 HydrophobicContact CD1-CB 4.44Å; D83-A86 PolarHBondContact O-N 3.07Å; D83-A86 WeakPolarHBondContact OD1-CB 3.4Å; D83-A86 PolarHBondContact OD2-N 3.38Å; A86-M88 VanDerWaalsContact C-N 3.3Å; A86-M88 PolarHBondContact O-N 3.41Å; A86-A89 PolarHBondContact O-N 2.98Å; A86-A89 VanDerWaalsContact O-N 3.13Å; A86-V90 VanDerWaalsContact O-CG2 3.3Å; A86-V90 WeakPolarHBondContact O-CG2 3.17Å; A86-V90 PolarHBondContact O-N 3.19Å; A86-V219 HydrophobicContact CB-CG2 3.85Å
87A89.3Confident90.2Very high0 Ų024.6 Ų24.60%015%0.149CC..Hα-helixtrans-57.3-42.9177.200000111.6A77 L82 D83 V90 L91 W142A77-A87 HydrophobicContact CB-CB 4.14Å; L82-A87 HydrophobicContact CB-CB 4.09Å; D83-A87 VanDerWaalsContact O-CB 3.28Å; D83-A87 WeakPolarHBondContact O-CB 3.3Å; D83-A87 PolarHBondContact O-N 2.65Å; A87-V90 PolarHBondContact O-N 3.14Å; A87-L91 WeakPolarHBondContact O-CB 3.27Å; A87-L91 WeakPolarHBondContact O-CG 3.28Å; A87-L91 PolarHBondContact O-N 3.03Å; A87-W142 HydrophobicContact CB-CD2 4.41Å; A87-W142 HydrophobicContact CB-CZ2 3.85Å
88M87.6Confident89.9Confident3 Ų324.6 Ų24.62%0.01515%0.149CC..Hα-helixtrans-67.8-35.7176.2-75.3-51.9-35.500113.4D84 A86 L91 L92 L135 V147 V148 L151D84-M88 WeakPolarHBondContact O-CB 3.44Å; D84-M88 VanDerWaalsContact O-CG 3.25Å; D84-M88 WeakPolarHBondContact O-CG 3.5Å; D84-M88 PolarHBondContact O-N 3.4Å; D84-M88 VanDerWaalsContact O-N 3.08Å; A86-M88 VanDerWaalsContact C-N 3.3Å; A86-M88 PolarHBondContact O-N 3.41Å; M88-L91 HydrophobicContact CE-CB 4.39Å; M88-L91 HydrophobicContact CE-CD1 4.22Å; M88-L91 HydrophobicContact SD-CD1 4.05Å; M88-L92 VanDerWaalsContact O-CB 3.26Å; M88-L92 WeakPolarHBondContact O-CB 3.47Å; M88-L92 PolarHBondContact O-N 3.02Å; M88-L135 HydrophobicContact CE-CD2 4.45Å; M88-V147 HydrophobicContact CB-CG1 4.34Å; M88-V147 HydrophobicContact CG-CG1 3.89Å; M88-V148 HydrophobicContact CG-CG2 4.48Å; M88-V148 HydrophobicContact SD-CG2 3.82Å; M88-L151 HydrophobicContact CE-CD1 3.76Å; M88-L151 HydrophobicContact CE-CD2 3.63Å; M88-L151 HydrophobicContact CE-CG 4.18Å; M88-L151 HydrophobicContact SD-CD1 4.17Å
89A89.1Confident89.3Confident0 Ų020.8 Ų20.80%013%0.129CC..Hα-helixtrans-67.6-38.5173.900000112.5V85 A86 L92 C93 M279 F282V85-A89 PolarHBondContact O-N 3.26Å; A86-A89 PolarHBondContact O-N 2.98Å; A86-A89 VanDerWaalsContact O-N 3.13Å; A89-L92 PolarHBondContact O-N 2.82Å; A89-C93 WeakPolarHBondContact O-CB 3.36Å; A89-C93 PolarHBondContact O-N 3.29Å; A89-M279 HydrophobicContact CB-CB 4.05Å; A89-M279 HydrophobicContact CB-CG 4.32Å; A89-M279 WeakPolarHBondContact CB-O 3.21Å; A89-F282 HydrophobicContact CB-CB 4.1Å
90V92.6Very high88.5Confident0 Ų017.7 Ų17.70%010%0.102CC..Hα-helixtrans-62.7-50.7173.9169.50000110.9A73 A77 L82 A86 A87 L92 C93 G94 V222 M226 F282A73-V90 HydrophobicContact CB-CG1 3.9Å; A73-V90 WeakPolarHBondContact O-CG1 3.42Å; A77-V90 HydrophobicContact CB-CG1 4.39Å; L82-V90 HydrophobicContact CD1-CB 4.39Å; L82-V90 HydrophobicContact CD1-CG2 3.65Å; A86-V90 VanDerWaalsContact O-CG2 3.3Å; A86-V90 WeakPolarHBondContact O-CG2 3.17Å; A86-V90 PolarHBondContact O-N 3.19Å; A87-V90 PolarHBondContact O-N 3.14Å; V90-L92 VanDerWaalsContact C-N 3.33Å; V90-L92 PolarHBondContact O-N 3.24Å; V90-C93 PolarHBondContact O-N 2.84Å; V90-G94 PolarHBondContact O-N 3.31Å; V90-V222 HydrophobicContact CG1-CG1 3.95Å; V90-V222 HydrophobicContact CG2-CG1 3.93Å; V90-M226 HydrophobicContact CG1-SD 4.08Å; V90-F282 HydrophobicContact CB-CD1 4.45Å; V90-F282 HydrophobicContact CB-CE1 4.28Å; V90-F282 HydrophobicContact CB-CZ 4.36Å; V90-F282 HydrophobicContact CG1-CZ 4.43Å; V90-F282 HydrophobicContact CG2-CD1 3.88Å; V90-F282 HydrophobicContact CG2-CD2 3.58Å; V90-F282 HydrophobicContact CG2-CE1 3.88Å; V90-F282 HydrophobicContact CG2-CE2 3.55Å; V90-F282 HydrophobicContact CG2-CG 3.73Å; V90-F282 HydrophobicContact CG2-CZ 3.71Å
91L92.3Very high87.9Confident0 Ų015.3 Ų15.30%09%0.092CC..Hα-helixtrans-59.4-42.7175.8-75.4177000112.2A73 F74 A87 M88 G94 C95 L135 W142A73-L91 HydrophobicContact CB-CD2 4.42Å; F74-L91 HydrophobicContact CB-CD2 3.93Å; F74-L91 HydrophobicContact CD2-CD2 4.33Å; A87-L91 WeakPolarHBondContact O-CB 3.27Å; A87-L91 WeakPolarHBondContact O-CG 3.28Å; A87-L91 PolarHBondContact O-N 3.03Å; M88-L91 HydrophobicContact CE-CB 4.39Å; M88-L91 HydrophobicContact CE-CD1 4.22Å; M88-L91 HydrophobicContact SD-CD1 4.05Å; L91-G94 PolarHBondContact O-N 3.46Å; L91-C95 WeakPolarHBondContact O-CB 3.4Å; L91-C95 PolarHBondContact O-N 2.99Å; L91-C95 PolarHBondContact O-SG 3.08Å; L91-L135 HydrophobicContact CB-CD2 4.39Å; L91-W142 HydrophobicContact CD1-CE3 3.97Å; L91-W142 HydrophobicContact CD1-CH2 4.38Å; L91-W142 HydrophobicContact CD1-CZ3 3.66Å; L91-W142 HydrophobicContact CG-CZ3 4.48Å
92L90.9Very high87.7Confident2 Ų210.4 Ų10.41%0.016%0.058CC..Hα-helixtrans-61.9-44.3178.4-173.569.2000112.1M88 A89 V90 G94 C95 C96 M131 L135 I266 L267 F271M88-L92 VanDerWaalsContact O-CB 3.26Å; M88-L92 WeakPolarHBondContact O-CB 3.47Å; M88-L92 PolarHBondContact O-N 3.02Å; A89-L92 PolarHBondContact O-N 2.82Å; V90-L92 VanDerWaalsContact C-N 3.33Å; V90-L92 PolarHBondContact O-N 3.24Å; L92-G94 VanDerWaalsContact C-N 3.34Å; L92-C95 PolarHBondContact O-N 2.75Å; L92-C96 PolarHBondContact O-N 3.1Å; L92-C96 PolarHBondContact O-SG 3.33Å; L92-C96 VanDerWaalsContact O-SG 3.36Å; L92-M131 HydrophobicContact CD1-CE 3.49Å; L92-M131 VanDerWaalsContact CD1-CE 3.49Å; L92-M131 HydrophobicContact CG-CE 4.15Å; L92-M131 WeakPolarHBondContact O-CE 3.31Å; L92-L135 HydrophobicContact CD1-CD1 3.7Å; L92-L135 HydrophobicContact CD1-CD2 4.2Å; L92-I266 HydrophobicContact CD1-CG2 3.91Å; L92-I266 HydrophobicContact CD2-CB 4.37Å; L92-I266 HydrophobicContact CD2-CG2 4.09Å; L92-L267 HydrophobicContact CD2-CD1 4.46Å; L92-L267 HydrophobicContact CD2-CD2 3.37Å; L92-L267 HydrophobicContact CD2-CG 3.52Å; L92-F271 HydrophobicContact CD2-CE2 4.33Å
93C92.7Very high87.6Confident0 Ų010.8 Ų10.80%06%0.06CC..Hα-helixtrans-66.6-36176.6-164.60000112A89 V90 C96 F282A89-C93 WeakPolarHBondContact O-CB 3.36Å; A89-C93 PolarHBondContact O-N 3.29Å; V90-C93 PolarHBondContact O-N 2.84Å; C93-C96 WeakPolarHBondContact O-CB 3.33Å; C93-C96 PolarHBondContact O-N 3.44Å; C93-F282 HydrophobicContact CB-CD1 4.1Å; C93-F282 HydrophobicContact CB-CE1 3.75Å
94G93.9Very high87.4Confident0 Ų010.3 Ų10.30%06%0.057CC..Hα-helixtrans-77.2-17.2177.800000115.1M69 P70 V90 L91 L92M69-G94 CarbonylContact C-O 3.5Å; M69-G94 WeakPolarHBondContact CB-O 3.46Å; P70-G94 VanDerWaalsContact CD-O 3.28Å; P70-G94 WeakPolarHBondContact CD-O 3.14Å; P70-G94 WeakPolarHBondContact CG-O 3.47Å; V90-G94 PolarHBondContact O-N 3.31Å; L91-G94 PolarHBondContact O-N 3.46Å; L92-G94 VanDerWaalsContact C-N 3.34Å
95C93.1Very high87.4Confident0 Ų08.7 Ų8.70%05%0.047CC..THydrogen-bonded Turntrans-92.51.1171.8-61.50000112.9L91 L92 M131 C134 L135L91-C95 WeakPolarHBondContact O-CB 3.4Å; L91-C95 PolarHBondContact O-N 2.99Å; L91-C95 PolarHBondContact O-SG 3.08Å; L92-C95 PolarHBondContact O-N 2.75Å; C95-M131 HydrophobicContact CB-CG 3.94Å; C95-M131 WeakPolarHBondContact O-CB 3.25Å; C95-M131 WeakPolarHBondContact O-CG 3.47Å; C95-C134 HydrophobicContact CB-CB 4.31Å; C95-C134 VanDerWaalsContact SG-CB 3.6Å; C95-L135 HydrophobicContact CB-CD2 4.19Å; C95-L135 HydrophobicContact CB-CG 4.04Å
96C91.1Very high87.5Confident0 Ų07.2 Ų7.20%04%0.039CC..SBendtrans-69157.5173.3-760000112L92 C93 Q258L92-C96 PolarHBondContact O-N 3.1Å; L92-C96 PolarHBondContact O-SG 3.33Å; L92-C96 VanDerWaalsContact O-SG 3.36Å; C93-C96 WeakPolarHBondContact O-CB 3.33Å; C93-C96 PolarHBondContact O-N 3.44Å; C96-Q258 VanDerWaalsContact C-OE1 3.3Å; C96-Q258 PolarHBondContact O-OE1 3.41Å
97P91.1Very high87.4Confident0 Ų011.7 Ų11.70%06%0.061CC..PPolyproline II helixtrans-75.7169.5163.334.6-35.8000111.3S123 A127 Q258 N259 L262P97-S123 VanDerWaalsContact CB-C 3.48Å; P97-A127 HydrophobicContact CB-CB 4.23Å; P97-A127 HydrophobicContact CG-CB 4.05Å; P97-Q258 PolarHBondContact O-OE1 2.88Å; P97-N259 HydrophobicContact CG-CB 4.35Å; P97-N259 WeakPolarHBondContact O-CB 3.44Å; P97-N259 PolarHBondContact O-N 3.42Å; P97-L262 HydrophobicContact CG-CD2 3.86Å
98G86.3Confident87.2Confident0 Ų015 Ų150%08%0.078CC..BIsolated β-bridgetrans-55.3145175.200000112.7Q65 S123Q65-G98 VanDerWaalsContact NE2-CA 3.34Å; G98-S123 PolarHBondContact N-OG 3.16Å
99G80.7Confident87.3Confident1 Ų114.9 Ų14.91%0.018%0.078CC..  trans-104.5148.2-179.400000112.7L101 S102 C257G99-L101 PolarHBondContact O-N 2.83Å; G99-S102 PolarHBondContact O-N 3.31Å; G99-S102 PolarHBondContact O-OG 3.41Å; G99-C257 PolarHBondContact N-O 3.25Å
100N76.2Confident87.2Confident13 Ų1319.6 Ų19.67%0.0710%0.1CC..THydrogen-bonded Turntrans-47.6-19.6179.3-79.7-34.2000116.4L39 S102 N103 L189L39-N100 WeakPolarHBondContact CD1-OD1 3.34Å; N100-S102 VanDerWaalsContact C-N 3.28Å; N100-S102 PolarHBondContact O-N 2.76Å; N100-N103 PolarHBondContact O-N 3.17Å; N100-L189 HydrophobicContact CB-CD2 4.37Å
101L81Confident86.9Confident24 Ų2420.3 Ų20.313%0.12611%0.107CC..Hα-helixtrans-58.7-39.8172.6-165.368.2000111.6G99 N103 I104 M105 Q290 A291G99-L101 PolarHBondContact O-N 2.83Å; L101-N103 VanDerWaalsContact C-N 3.34Å; L101-N103 PolarHBondContact O-N 2.83Å; L101-I104 PolarHBondContact O-N 3.05Å; L101-M105 HydrophobicContact CD1-CE 3.52Å; L101-M105 HydrophobicContact CD2-CE 4.41Å; L101-M105 HydrophobicContact CG-CE 3.89Å; L101-M105 HydrophobicContact CG-CG 4.24Å; L101-M105 VanDerWaalsContact O-CG 3.24Å; L101-M105 WeakPolarHBondContact O-CG 3.38Å; L101-M105 PolarHBondContact O-N 3.06Å; L101-Q290 HydrophobicContact CD2-CG 3.83Å; L101-A291 HydrophobicContact CD2-CB 4.21Å
102S84.6Confident86.7Confident0 Ų022.2 Ų22.20%012%0.116CC..Hα-helixtrans-53.8-49177.961.70000111.8G99 N100 I104 M105 S106 E254G99-S102 PolarHBondContact O-N 3.31Å; G99-S102 PolarHBondContact O-OG 3.41Å; N100-S102 VanDerWaalsContact C-N 3.28Å; N100-S102 PolarHBondContact O-N 2.76Å; S102-I104 VanDerWaalsContact C-N 3.33Å; S102-I104 PolarHBondContact O-N 3.28Å; S102-M105 PolarHBondContact O-N 3.03Å; S102-M105 VanDerWaalsContact O-N 3.08Å; S102-S106 VanDerWaalsContact O-CB 3.31Å; S102-S106 WeakPolarHBondContact O-CB 3.21Å; S102-S106 PolarHBondContact O-N 3.48Å; S102-S106 PolarHBondContact O-OG 3.15Å; S102-S106 VanDerWaalsContact O-OG 3.06Å; S102-E254 WeakPolarHBondContact CB-OE2 3.22Å; S102-E254 PolarHBondContact OG-OE2 3.36Å
103N84.6Confident86.3Confident17 Ų1725.8 Ų25.89%0.09113%0.133CC..Hα-helixtrans-58.9-41.5-177.7-67.2-44.6000112.3N100 L101 L107 S116 I117 T120N100-N103 PolarHBondContact O-N 3.17Å; L101-N103 VanDerWaalsContact C-N 3.34Å; L101-N103 PolarHBondContact O-N 2.83Å; N103-L107 PolarHBondContact O-N 3.34Å; N103-L107 VanDerWaalsContact O-N 3.14Å; N103-S116 VanDerWaalsContact OD1-C 3.26Å; N103-S116 WeakPolarHBondContact OD1-CB 3.32Å; N103-S116 PolarHBondContact OD1-OG 3.22Å; N103-I117 HydrophobicContact CB-CG1 4.5Å; N103-I117 WeakPolarHBondContact OD1-CG1 3.46Å; N103-I117 PolarHBondContact OD1-N 3.1Å; N103-T120 PolarHBondContact ND2-OG1 2.96Å; N103-T120 VanDerWaalsContact ND2-OG1 3.15Å
104I82.6Confident85.9Confident62 Ų6228.7 Ų28.732%0.31815%0.149SC..Hα-helixtrans-66.6-45.9174.7-65.3166.7000110.8L101 S102 L107 L108 L189L101-I104 PolarHBondContact O-N 3.05Å; S102-I104 VanDerWaalsContact C-N 3.33Å; S102-I104 PolarHBondContact O-N 3.28Å; I104-L107 PolarHBondContact O-N 3.04Å; I104-L108 HydrophobicContact CG2-CD1 3.96Å; I104-L108 HydrophobicContact CG2-CG 4.5Å; I104-L108 WeakPolarHBondContact O-CG 3.43Å; I104-L108 PolarHBondContact O-N 3.33Å; I104-L189 HydrophobicContact CD1-CD1 4.11Å; I104-L189 HydrophobicContact CD1-CD2 3.87Å; I104-L189 HydrophobicContact CD1-CG 4.46Å
105M85.2Confident85.6Confident22 Ų2229.2 Ų29.211%0.10815%0.152CC..Hα-helixtrans-68.1-39.8-177.1-59.7-58.2176.800111.3L101 S102 L107 L108 V109 L253 A294 I298L101-M105 HydrophobicContact CD1-CE 3.52Å; L101-M105 HydrophobicContact CD2-CE 4.41Å; L101-M105 HydrophobicContact CG-CE 3.89Å; L101-M105 HydrophobicContact CG-CG 4.24Å; L101-M105 VanDerWaalsContact O-CG 3.24Å; L101-M105 WeakPolarHBondContact O-CG 3.38Å; L101-M105 PolarHBondContact O-N 3.06Å; S102-M105 PolarHBondContact O-N 3.03Å; S102-M105 VanDerWaalsContact O-N 3.08Å; M105-L107 PolarHBondContact O-N 3.48Å; M105-L108 PolarHBondContact O-N 2.86Å; M105-L108 VanDerWaalsContact O-N 3.15Å; M105-L108 HydrophobicContact SD-CD1 4.25Å; M105-V109 PolarHBondContact O-N 3.48Å; M105-V109 VanDerWaalsContact O-N 3.1Å; M105-L253 HydrophobicContact CB-CD1 3.92Å; M105-L253 HydrophobicContact CB-CD2 4.22Å; M105-A294 HydrophobicContact CB-CB 4.4Å; M105-A294 HydrophobicContact CE-CB 4.26Å; M105-A294 HydrophobicContact CG-CB 3.78Å; M105-A294 HydrophobicContact SD-CB 3.98Å; M105-I298 HydrophobicContact CB-CD1 4.13Å; M105-I298 HydrophobicContact CG-CD1 4.24Å; M105-I298 HydrophobicContact SD-CD1 3.2Å; M105-I298 WeakPolarHBondContact SD-CD1 3.46Å
106S86.9Confident85.3Confident0 Ų029.2 Ų29.20%015%0.152CC..Hα-helixtrans-56.2-46.7172.2-69.60000111.2S102 L108 V109 H110 G111 S116S102-S106 VanDerWaalsContact O-CB 3.31Å; S102-S106 WeakPolarHBondContact O-CB 3.21Å; S102-S106 PolarHBondContact O-N 3.48Å; S102-S106 PolarHBondContact O-OG 3.15Å; S102-S106 VanDerWaalsContact O-OG 3.06Å; S106-L108 PolarHBondContact O-N 3.23Å; S106-V109 WeakPolarHBondContact O-CG2 3.17Å; S106-V109 PolarHBondContact O-N 2.95Å; S106-H110 PolarHBondContact O-N 3.37Å; S106-G111 WeakPolarHBondContact O-CA 3.41Å; S106-G111 PolarHBondContact O-N 3.42Å; S106-S116 PolarHBondContact OG-OG 3.11Å
107L84.2Confident84.9Confident102 Ų10230 Ų3053%0.53416%0.155SC..Hα-helixtrans-60.4-44.1174.3-179.463.9000112N103 I104 M105 V109 H110 M113N103-L107 PolarHBondContact O-N 3.34Å; N103-L107 VanDerWaalsContact O-N 3.14Å; I104-L107 PolarHBondContact O-N 3.04Å; M105-L107 PolarHBondContact O-N 3.48Å; L107-V109 VanDerWaalsContact C-N 3.26Å; L107-V109 PolarHBondContact O-N 3.43Å; L107-H110 PolarHBondContact O-N 3.1Å; L107-H110 VanDerWaalsContact O-N 3.17Å; L107-M113 HydrophobicContact CB-SD 4.49Å; L107-M113 HydrophobicContact CD1-SD 4.14Å
108L85.4Confident84.7Confident69 Ų6930 Ų3036%0.36116%0.156SC..Hα-helixtrans-68.1-18.7-178.7-70.5172.3000114.6I104 M105 S106 I298I104-L108 HydrophobicContact CG2-CD1 3.96Å; I104-L108 HydrophobicContact CG2-CG 4.5Å; I104-L108 WeakPolarHBondContact O-CG 3.43Å; I104-L108 PolarHBondContact O-N 3.33Å; M105-L108 PolarHBondContact O-N 2.86Å; M105-L108 VanDerWaalsContact O-N 3.15Å; M105-L108 HydrophobicContact SD-CD1 4.25Å; S106-L108 PolarHBondContact O-N 3.23Å; L108-I298 HydrophobicContact CB-CD1 3.72Å; L108-I298 HydrophobicContact CB-CG1 4.04Å; L108-I298 HydrophobicContact CB-CG2 4.24Å; L108-I298 HydrophobicContact CD1-CD1 3.81Å; L108-I298 HydrophobicContact CG-CD1 4.43Å
109V87.9Confident84.8Confident0 Ų030.1 Ų30.10%016%0.156CC..THydrogen-bonded Turntrans-103.414.2173.6-560000114M105 S106 L107 G111 R249 L253 F297 I298 Y301M105-V109 PolarHBondContact O-N 3.48Å; M105-V109 VanDerWaalsContact O-N 3.1Å; S106-V109 WeakPolarHBondContact O-CG2 3.17Å; S106-V109 PolarHBondContact O-N 2.95Å; L107-V109 VanDerWaalsContact C-N 3.26Å; L107-V109 PolarHBondContact O-N 3.43Å; V109-G111 PolarHBondContact O-N 3.25Å; V109-R249 HydrophobicContact CG2-CB 3.86Å; V109-R249 HydrophobicContact CG2-CG 4.47Å; V109-R249 PolarHBondContact O-NE 3.4Å; V109-R249 PolarHBondContact O-NH2 3.48Å; V109-L253 HydrophobicContact CG1-CD1 4.3Å; V109-L253 HydrophobicContact CG2-CD1 3.61Å; V109-F297 HydrophobicContact CG1-CD1 4.1Å; V109-F297 HydrophobicContact CG1-CE1 4.28Å; V109-I298 HydrophobicContact CG1-CB 4.33Å; V109-I298 HydrophobicContact CG1-CG1 3.44Å; V109-I298 VanDerWaalsContact CG1-CG1 3.44Å; V109-Y301 VanDerWaalsContact C-CE1 3.44Å; V109-Y301 HydrophobicContact CB-CD1 3.86Å; V109-Y301 HydrophobicContact CB-CE1 4.14Å; V109-Y301 HydrophobicContact CB-CG 4.27Å; V109-Y301 HydrophobicContact CG1-CD1 4.13Å; V109-Y301 HydrophobicContact CG1-CG 4.41Å; V109-Y301 VanDerWaalsContact O-CE1 3.24Å; V109-Y301 WeakPolarHBondContact O-CE1 3.45Å; V109-Y301 VanDerWaalsContact O-CZ 3.26Å; V109-Y301 PolarHBondContact O-OH 3.46Å
110H86.9Confident85.1Confident100 Ų10030.1 Ų30.146%0.46316%0.156SC..THydrogen-bonded Turntrans48.245.4-171.2-55.5-74.1000111.8S106 L107 R249 Y301 R305S106-H110 PolarHBondContact O-N 3.37Å; L107-H110 PolarHBondContact O-N 3.1Å; L107-H110 VanDerWaalsContact O-N 3.17Å; H110-R249 PolarHBondContact O-NH2 2.83Å; H110-Y301 AromaticContact CD2-CE1 3.86Å; H110-R305 PolarHBondContact NE2-NH1 2.89Å
111G86.8Confident85.4Confident15 Ų1530 Ų3016%0.15516%0.155CC..  trans-76.1168.7169.400000111.4S106 V109 M113 N246S106-G111 WeakPolarHBondContact O-CA 3.41Å; S106-G111 PolarHBondContact O-N 3.42Å; V109-G111 PolarHBondContact O-N 3.25Å; G111-M113 PolarHBondContact O-N 2.9Å; G111-M113 VanDerWaalsContact O-N 3.11Å; G111-N246 WeakPolarHBondContact CA-O 3.44Å
112E88.8Confident85.7Confident39 Ų3929 Ų2918%0.18215%0.15CC..  trans-72.1101.4168.5-171.7-179.2-172.200109.4R54 L115 S116 N246 S247 S250R54-E112 IonicContact CZ-OE1 3.4Å; R54-E112 IonicContact NH1-OE1 3.88Å; R54-E112 PolarHBondContact NH1-OE1 2.9Å; E112-L115 HydrophobicContact CB-CB 4.08Å; E112-L115 HydrophobicContact CG-CB 3.83Å; E112-L115 PolarHBondContact O-N 3.12Å; E112-S116 PolarHBondContact O-N 2.91Å; E112-N246 PolarHBondContact N-O 2.72Å; E112-S247 WeakPolarHBondContact OE2-CB 3.35Å; E112-S247 PolarHBondContact OE2-OG 3.32Å; E112-S250 VanDerWaalsContact C-OG 3.31Å; E112-S250 PolarHBondContact N-OG 3.48Å; E112-S250 WeakPolarHBondContact O-CB 3.35Å; E112-S250 PolarHBondContact O-OG 3.41Å
113M83.3Confident86Confident77 Ų7729 Ų2938%0.37915%0.15SC..Hα-helixtrans-65.9-42.7-176-173.917567.100112L107 G111 L115 S116 I117L107-M113 HydrophobicContact CB-SD 4.49Å; L107-M113 HydrophobicContact CD1-SD 4.14Å; G111-M113 PolarHBondContact O-N 2.9Å; G111-M113 VanDerWaalsContact O-N 3.11Å; M113-L115 VanDerWaalsContact C-N 3.26Å; M113-L115 PolarHBondContact O-N 3.45Å; M113-S116 WeakPolarHBondContact O-CB 3.28Å; M113-S116 PolarHBondContact O-N 2.95Å; M113-S116 VanDerWaalsContact O-N 3.1Å; M113-I117 HydrophobicContact CG-CD1 3.83Å; M113-I117 HydrophobicContact CG-CG1 4.37Å; M113-I117 WeakPolarHBondContact O-CG1 3.31Å; M113-I117 PolarHBondContact O-N 2.87Å
114N83.5Confident86Confident61 Ų6128.8 Ų28.833%0.32615%0.15SC..Hα-helixtrans-57.3-40.1178.1-64.626.5000111.7I117 I118N114-I117 PolarHBondContact O-N 2.6Å; N114-I118 WeakPolarHBondContact O-CB 3.43Å; N114-I118 WeakPolarHBondContact O-CD1 3.42Å; N114-I118 WeakPolarHBondContact O-CG1 3.32Å; N114-I118 PolarHBondContact O-N 3.12Å
115L86.6Confident86Confident12 Ų1230.1 Ų30.16%0.06316%0.157CC..Hα-helixtrans-65.1-42.8176.7-179.762.7000112E112 M113 I118 M119 V251E112-L115 HydrophobicContact CB-CB 4.08Å; E112-L115 HydrophobicContact CG-CB 3.83Å; E112-L115 PolarHBondContact O-N 3.12Å; M113-L115 VanDerWaalsContact C-N 3.26Å; M113-L115 PolarHBondContact O-N 3.45Å; L115-I118 PolarHBondContact O-N 3.45Å; L115-M119 HydrophobicContact CD1-CG 4.33Å; L115-M119 HydrophobicContact CD1-SD 4.36Å; L115-M119 HydrophobicContact CG-SD 4.21Å; L115-M119 WeakPolarHBondContact O-CB 3.04Å; L115-M119 VanDerWaalsContact O-CG 3.3Å; L115-M119 WeakPolarHBondContact O-CG 3.37Å; L115-M119 PolarHBondContact O-N 3.38Å; L115-V251 HydrophobicContact CD2-CG2 3.83Å
116S88.3Confident86.1Confident0 Ų031.5 Ų31.50%016%0.164CC..Hα-helixtrans-58.9-50.2176.1-145.20000110.2N103 S106 E112 M113 I118 M119 T120 E254N103-S116 VanDerWaalsContact OD1-C 3.26Å; N103-S116 WeakPolarHBondContact OD1-CB 3.32Å; N103-S116 PolarHBondContact OD1-OG 3.22Å; S106-S116 PolarHBondContact OG-OG 3.11Å; E112-S116 PolarHBondContact O-N 2.91Å; M113-S116 WeakPolarHBondContact O-CB 3.28Å; M113-S116 PolarHBondContact O-N 2.95Å; M113-S116 VanDerWaalsContact O-N 3.1Å; S116-I118 PolarHBondContact O-N 3.5Å; S116-M119 WeakPolarHBondContact O-CB 3.43Å; S116-M119 PolarHBondContact O-N 2.85Å; S116-M119 VanDerWaalsContact O-N 3.11Å; S116-T120 PolarHBondContact O-N 3.33Å; S116-T120 PolarHBondContact O-OG1 2.93Å; S116-T120 VanDerWaalsContact O-OG1 3.06Å; S116-E254 PolarHBondContact OG-OE2 3.17Å
117I82.8Confident86.2Confident15 Ų1531.5 Ų31.58%0.07717%0.165CC..Hα-helixtrans-64.9-43.5-178.8-57.9164.4000111.4N103 M113 N114 M119 T120 I121N103-I117 HydrophobicContact CB-CG1 4.5Å; N103-I117 WeakPolarHBondContact OD1-CG1 3.46Å; N103-I117 PolarHBondContact OD1-N 3.1Å; M113-I117 HydrophobicContact CG-CD1 3.83Å; M113-I117 HydrophobicContact CG-CG1 4.37Å; M113-I117 WeakPolarHBondContact O-CG1 3.31Å; M113-I117 PolarHBondContact O-N 2.87Å; N114-I117 PolarHBondContact O-N 2.6Å; I117-M119 VanDerWaalsContact C-N 3.28Å; I117-M119 PolarHBondContact O-N 3.1Å; I117-T120 PolarHBondContact O-N 3.05Å; I117-I121 HydrophobicContact CG2-CD1 3.64Å; I117-I121 HydrophobicContact CG2-CG1 4.24Å; I117-I121 WeakPolarHBondContact O-CD1 3.21Å; I117-I121 VanDerWaalsContact O-CG1 3.27Å; I117-I121 WeakPolarHBondContact O-CG1 3.44Å; I117-I121 PolarHBondContact O-N 3.41Å
118I85.7Confident86.2Confident2 Ų229.1 Ų29.11%0.0115%0.152CC..Hα-helixtrans-57.6-42.6173.9-72.2167000110.3E50 N114 L115 S116 S122E50-I118 HydrophobicContact CB-CD1 4.46Å; E50-I118 HydrophobicContact CG-CD1 4.29Å; N114-I118 WeakPolarHBondContact O-CB 3.43Å; N114-I118 WeakPolarHBondContact O-CD1 3.42Å; N114-I118 WeakPolarHBondContact O-CG1 3.32Å; N114-I118 PolarHBondContact O-N 3.12Å; L115-I118 PolarHBondContact O-N 3.45Å; S116-I118 PolarHBondContact O-N 3.5Å; I118-S122 VanDerWaalsContact O-CB 3.22Å; I118-S122 WeakPolarHBondContact O-CB 3.34Å; I118-S122 PolarHBondContact O-N 3.3Å; I118-S122 PolarHBondContact O-OG 2.77Å
119M89.3Confident86.3Confident1 Ų130.9 Ų30.91%0.00517%0.165CC..Hα-helixtrans-67.4-41176.8-73.7177.768.500112.9G57 L60 A61 C64 L115 S116 I117 S122 S123 V251 E254G57-M119 WeakPolarHBondContact O-CG 3.47Å; L60-M119 HydrophobicContact CB-CE 3.9Å; L60-M119 HydrophobicContact CB-SD 4.11Å; A61-M119 HydrophobicContact CB-CB 4.11Å; A61-M119 HydrophobicContact CB-CG 4.21Å; C64-M119 HydrophobicContact CB-CE 4.47Å; L115-M119 HydrophobicContact CD1-CG 4.33Å; L115-M119 HydrophobicContact CD1-SD 4.36Å; L115-M119 HydrophobicContact CG-SD 4.21Å; L115-M119 WeakPolarHBondContact O-CB 3.04Å; L115-M119 VanDerWaalsContact O-CG 3.3Å; L115-M119 WeakPolarHBondContact O-CG 3.37Å; L115-M119 PolarHBondContact O-N 3.38Å; S116-M119 WeakPolarHBondContact O-CB 3.43Å; S116-M119 PolarHBondContact O-N 2.85Å; S116-M119 VanDerWaalsContact O-N 3.11Å; I117-M119 VanDerWaalsContact C-N 3.28Å; I117-M119 PolarHBondContact O-N 3.1Å; M119-S122 PolarHBondContact O-N 3.3Å; M119-S123 WeakPolarHBondContact O-CB 3.42Å; M119-S123 PolarHBondContact O-N 2.9Å; M119-S123 PolarHBondContact O-OG 3.22Å; M119-V251 HydrophobicContact CE-CG1 4.12Å; M119-V251 HydrophobicContact CE-CG2 4.47Å; M119-V251 HydrophobicContact SD-CB 4.42Å; M119-V251 HydrophobicContact SD-CG2 3.84Å; M119-E254 HydrophobicContact CB-CG 3.67Å; M119-E254 HydrophobicContact CE-CB 4.09Å; M119-E254 HydrophobicContact CE-CG 3.76Å; M119-E254 HydrophobicContact SD-CB 4.43Å; M119-E254 HydrophobicContact SD-CG 4.17Å
120T87.6Confident86.5Confident2 Ų232.5 Ų32.51%0.01217%0.174CC..Hα-helixtrans-61.3-47.5175.9-51.20000110.9L39 N103 S116 I117 S123 T124 E254L39-T120 HydrophobicContact CD1-CG2 4.22Å; N103-T120 PolarHBondContact ND2-OG1 2.96Å; N103-T120 VanDerWaalsContact ND2-OG1 3.15Å; S116-T120 PolarHBondContact O-N 3.33Å; S116-T120 PolarHBondContact O-OG1 2.93Å; S116-T120 VanDerWaalsContact O-OG1 3.06Å; I117-T120 PolarHBondContact O-N 3.05Å; T120-S123 PolarHBondContact O-OG 2.9Å; T120-S123 VanDerWaalsContact O-OG 3.13Å; T120-T124 VanDerWaalsContact O-CB 3.27Å; T120-T124 WeakPolarHBondContact O-CB 3.23Å; T120-T124 PolarHBondContact O-N 3.46Å; T120-T124 PolarHBondContact O-OG1 3.35Å; T120-E254 WeakPolarHBondContact CA-OE1 3.31Å; T120-E254 WeakPolarHBondContact CB-OE1 3.43Å; T120-E254 PolarHBondContact N-OE1 3.39Å; T120-E254 VanDerWaalsContact N-OE1 3.16Å; T120-E254 VanDerWaalsContact OG1-CD 3.3Å; T120-E254 PolarHBondContact OG1-OE1 3.48Å; T120-E254 PolarHBondContact OG1-OE2 3.37Å
121I82.5Confident86.6Confident10 Ų1027.7 Ų27.75%0.05115%0.152CC..Hα-helixtrans-62-50.9177.5-66.1161.1000110.3V43 L48 I117 S123 T124 L125V43-I121 HydrophobicContact CB-CD1 4.34Å; V43-I121 HydrophobicContact CB-CG1 4.45Å; V43-I121 HydrophobicContact CG1-CD1 3.83Å; V43-I121 HydrophobicContact CG1-CG1 4.09Å; V43-I121 HydrophobicContact CG1-CG2 4.49Å; V43-I121 HydrophobicContact CG2-CD1 4.26Å; V43-I121 HydrophobicContact CG2-CG1 3.86Å; L48-I121 HydrophobicContact CD1-CG2 3.87Å; I117-I121 HydrophobicContact CG2-CD1 3.64Å; I117-I121 HydrophobicContact CG2-CG1 4.24Å; I117-I121 WeakPolarHBondContact O-CD1 3.21Å; I117-I121 VanDerWaalsContact O-CG1 3.27Å; I117-I121 WeakPolarHBondContact O-CG1 3.44Å; I117-I121 PolarHBondContact O-N 3.41Å; I121-S123 VanDerWaalsContact C-N 3.34Å; I121-S123 PolarHBondContact O-N 2.73Å; I121-T124 PolarHBondContact O-N 3.44Å; I121-L125 HydrophobicContact CG2-CD1 3.96Å; I121-L125 HydrophobicContact CG2-CG 4.45Å; I121-L125 WeakPolarHBondContact O-CG 3.28Å; I121-L125 PolarHBondContact O-N 2.95Å
122S86.3Confident86.7Confident2 Ų227.6 Ų27.61%0.01415%0.148CC..Hα-helixtrans-58.1-47.6-178.5-57.30000111.1H51 I118 M119 L125 L126H51-S122 PolarHBondContact CE1-OG 2.83Å; H51-S122 PolarHBondContact ND1-OG 2.96Å; I118-S122 VanDerWaalsContact O-CB 3.22Å; I118-S122 WeakPolarHBondContact O-CB 3.34Å; I118-S122 PolarHBondContact O-N 3.3Å; I118-S122 PolarHBondContact O-OG 2.77Å; M119-S122 PolarHBondContact O-N 3.3Å; S122-L125 PolarHBondContact O-N 3.13Å; S122-L126 WeakPolarHBondContact O-CB 3.28Å; S122-L126 WeakPolarHBondContact O-CG 3.39Å; S122-L126 PolarHBondContact O-N 3.31Å
123S90Very high86.8Confident0 Ų029.3 Ų29.30%016%0.158CC..Hα-helixtrans-67.1-39.4178.958.30000112.1F66 P97 G98 M119 T120 I121 L125 L126 A127F66-S123 WeakPolarHBondContact CZ-O 3.38Å; P97-S123 VanDerWaalsContact CB-C 3.48Å; G98-S123 PolarHBondContact N-OG 3.16Å; M119-S123 WeakPolarHBondContact O-CB 3.42Å; M119-S123 PolarHBondContact O-N 2.9Å; M119-S123 PolarHBondContact O-OG 3.22Å; T120-S123 PolarHBondContact O-OG 2.9Å; T120-S123 VanDerWaalsContact O-OG 3.13Å; I121-S123 VanDerWaalsContact C-N 3.34Å; I121-S123 PolarHBondContact O-N 2.73Å; S123-L125 PolarHBondContact O-N 2.85Å; S123-L126 PolarHBondContact O-N 3.04Å; S123-A127 WeakPolarHBondContact O-CB 3.37Å; S123-A127 PolarHBondContact O-N 3Å
124T85.7Confident87.2Confident14 Ų1426 Ų269%0.08614%0.143CC..Hα-helixtrans-62.8-40.5176.9-59.60000112.3L39 T120 I121 A127 I167L39-T124 HydrophobicContact CD2-CG2 4.47Å; T120-T124 VanDerWaalsContact O-CB 3.27Å; T120-T124 WeakPolarHBondContact O-CB 3.23Å; T120-T124 PolarHBondContact O-N 3.46Å; T120-T124 PolarHBondContact O-OG1 3.35Å; I121-T124 PolarHBondContact O-N 3.44Å; T124-A127 WeakPolarHBondContact O-CB 3.36Å; T124-I167 HydrophobicContact CG2-CD1 3.99Å
125L82.9Confident87.5Confident90 Ų9023.1 Ų23.147%0.47113%0.127SC..Hα-helixtrans-68.8-43.3174.8-68.7173.9000112I121 S122 S123 A127 L128I121-L125 HydrophobicContact CG2-CD1 3.96Å; I121-L125 HydrophobicContact CG2-CG 4.45Å; I121-L125 WeakPolarHBondContact O-CG 3.28Å; I121-L125 PolarHBondContact O-N 2.95Å; S122-L125 PolarHBondContact O-N 3.13Å; S123-L125 PolarHBondContact O-N 2.85Å; L125-A127 VanDerWaalsContact C-N 3.3Å; L125-A127 PolarHBondContact O-N 3.01Å; L125-L128 WeakPolarHBondContact O-CG 3.28Å
126L87.8Confident87.5Confident50 Ų5028.5 Ų28.526%0.26215%0.147SC..Hα-helixtrans-66.9-29.7178-72.9171.2000112.8L62 F66 S122 S123 L128 V129 L130L62-L126 HydrophobicContact CB-CD1 4.06Å; L62-L126 HydrophobicContact CD1-CD1 4.41Å; L62-L126 HydrophobicContact CG-CD1 4.49Å; F66-L126 HydrophobicContact CD2-CB 4.28Å; F66-L126 HydrophobicContact CE2-CB 3.69Å; F66-L126 HydrophobicContact CZ-CB 4.35Å; S122-L126 WeakPolarHBondContact O-CB 3.28Å; S122-L126 WeakPolarHBondContact O-CG 3.39Å; S122-L126 PolarHBondContact O-N 3.31Å; S123-L126 PolarHBondContact O-N 3.04Å; L126-L128 PolarHBondContact O-N 3.37Å; L126-L128 VanDerWaalsContact O-N 3.11Å; L126-V129 PolarHBondContact O-N 2.94Å; L126-V129 VanDerWaalsContact O-N 3.14Å; L126-L130 HydrophobicContact CB-CD1 4.02Å; L126-L130 HydrophobicContact CB-CG 4.4Å; L126-L130 HydrophobicContact CD1-CD1 4.48Å; L126-L130 HydrophobicContact CD2-CD1 4.29Å; L126-L130 WeakPolarHBondContact O-CB 3.42Å; L126-L130 PolarHBondContact O-N 2.71Å
127A88.1Confident87.5Confident1 Ų132.4 Ų32.41%0.00817%0.167CC..Hα-helixtrans-54.3-32.9-178.600000113F66 P97 S123 T124 L125 V129 M131 P132F66-A127 HydrophobicContact CE1-CB 4.28Å; F66-A127 VanDerWaalsContact CZ-CA 3.5Å; F66-A127 HydrophobicContact CZ-CB 3.84Å; P97-A127 HydrophobicContact CB-CB 4.23Å; P97-A127 HydrophobicContact CG-CB 4.05Å; S123-A127 WeakPolarHBondContact O-CB 3.37Å; S123-A127 PolarHBondContact O-N 3Å; T124-A127 WeakPolarHBondContact O-CB 3.36Å; L125-A127 VanDerWaalsContact C-N 3.3Å; L125-A127 PolarHBondContact O-N 3.01Å; A127-V129 PolarHBondContact O-N 3.01Å; A127-V129 VanDerWaalsContact O-N 3.12Å; A127-M131 HydrophobicContact CB-CB 4.29Å; A127-M131 WeakPolarHBondContact O-CB 3.22Å; A127-M131 PolarHBondContact O-N 3.21Å; A127-P132 VanDerWaalsContact O-CD 3.27Å; A127-P132 WeakPolarHBondContact O-CD 3.42Å
128L84.3Confident87.8Confident52 Ų5233.6 Ų33.627%0.27217%0.171SC..Hα-helixtrans-53.9-35.4179.9-57.7176.9000113.9L125 L126 L160 L164L125-L128 WeakPolarHBondContact O-CG 3.28Å; L126-L128 PolarHBondContact O-N 3.37Å; L126-L128 VanDerWaalsContact O-N 3.11Å; L128-L160 HydrophobicContact CD2-CB 4.07Å; L128-L164 HydrophobicContact CD1-CD1 3.52Å; L128-L164 HydrophobicContact CD1-CD2 4.01Å; L128-L164 HydrophobicContact CD1-CG 4.21Å; L128-L164 HydrophobicContact CD2-CD1 3.58Å; L128-L164 HydrophobicContact CD2-CD2 3.81Å; L128-L164 HydrophobicContact CD2-CG 3.63Å; L128-L164 HydrophobicContact CG-CD1 4.14Å; L128-L164 HydrophobicContact CG-CD2 4.31Å; L128-L164 HydrophobicContact CG-CG 4.47Å
129V87.3Confident87.7Confident105 Ų10533.7 Ų33.764%0.63617%0.171SC*.Hα-helixtrans-106.5-44.5179.7-177.30000110.2L126 A127 L133L126-V129 PolarHBondContact O-N 2.94Å; L126-V129 VanDerWaalsContact O-N 3.14Å; A127-V129 PolarHBondContact O-N 3.01Å; A127-V129 VanDerWaalsContact O-N 3.12Å; V129-L133 VanDerWaalsContact O-CB 3.25Å; V129-L133 WeakPolarHBondContact O-CB 3.26Å; V129-L133 PolarHBondContact O-N 2.59Å
130L91.2Very high87.3Confident34 Ų3440 Ų4018%0.17820%0.195CC..Hα-helixtrans-77.7-30.4-172.6-61.2-170.7000113.5L62 F66 L126 L133 C134L62-L130 HydrophobicContact CD1-CD1 4.42Å; L62-L130 HydrophobicContact CG-CD1 4.24Å; F66-L130 HydrophobicContact CB-CB 4.1Å; F66-L130 HydrophobicContact CB-CD1 3.83Å; F66-L130 HydrophobicContact CD1-CB 3.45Å; F66-L130 VanDerWaalsContact CD1-CB 3.45Å; F66-L130 HydrophobicContact CD1-CD1 4.44Å; F66-L130 HydrophobicContact CD2-CB 4.03Å; F66-L130 HydrophobicContact CD2-CD1 3.56Å; F66-L130 HydrophobicContact CD2-CG 4.42Å; F66-L130 HydrophobicContact CE1-CB 3.84Å; F66-L130 HydrophobicContact CE2-CB 4.35Å; F66-L130 HydrophobicContact CE2-CD1 4.26Å; F66-L130 HydrophobicContact CG-CB 3.55Å; F66-L130 HydrophobicContact CG-CD1 3.66Å; F66-L130 HydrophobicContact CG-CG 4.26Å; F66-L130 HydrophobicContact CZ-CB 4.28Å; L126-L130 HydrophobicContact CB-CD1 4.02Å; L126-L130 HydrophobicContact CB-CG 4.4Å; L126-L130 HydrophobicContact CD1-CD1 4.48Å; L126-L130 HydrophobicContact CD2-CD1 4.29Å; L126-L130 WeakPolarHBondContact O-CB 3.42Å; L126-L130 PolarHBondContact O-N 2.71Å; L130-L133 HydrophobicContact CD2-CD2 4.15Å; L130-L133 PolarHBondContact O-N 3.06Å; L130-C134 VanDerWaalsContact O-CB 3.28Å; L130-C134 WeakPolarHBondContact O-CB 3.33Å; L130-C134 PolarHBondContact O-N 3.2Å; L130-C134 PolarHBondContact O-SG 3.12Å
131M91.1Very high86.7Confident0 Ų042.7 Ų42.70%022%0.218CC..Hα-helixtrans-67.5-50.8177.5179.7175.5-170.800111.8F66 L92 C95 A127 L133 C134 L135 L160 I266F66-M131 HydrophobicContact CE1-CB 4.36Å; L92-M131 HydrophobicContact CD1-CE 3.49Å; L92-M131 VanDerWaalsContact CD1-CE 3.49Å; L92-M131 HydrophobicContact CG-CE 4.15Å; L92-M131 WeakPolarHBondContact O-CE 3.31Å; C95-M131 HydrophobicContact CB-CG 3.94Å; C95-M131 WeakPolarHBondContact O-CB 3.25Å; C95-M131 WeakPolarHBondContact O-CG 3.47Å; A127-M131 HydrophobicContact CB-CB 4.29Å; A127-M131 WeakPolarHBondContact O-CB 3.22Å; A127-M131 PolarHBondContact O-N 3.21Å; M131-L133 VanDerWaalsContact C-N 3.29Å; M131-L133 PolarHBondContact O-N 3.15Å; M131-C134 PolarHBondContact O-N 2.94Å; M131-L135 HydrophobicContact CE-CD1 4.5Å; M131-L135 HydrophobicContact CG-CD1 4.12Å; M131-L135 WeakPolarHBondContact O-CB 3.43Å; M131-L135 VanDerWaalsContact O-CG 3.24Å; M131-L135 WeakPolarHBondContact O-CG 3.15Å; M131-L135 PolarHBondContact O-N 3.43Å; M131-L160 HydrophobicContact CB-CD1 4.38Å; M131-L160 HydrophobicContact SD-CD1 4.35Å; M131-L160 HydrophobicContact SD-CD2 4.05Å; M131-I266 HydrophobicContact CE-CD1 3.48Å; M131-I266 VanDerWaalsContact CE-CD1 3.48Å; M131-I266 HydrophobicContact SD-CD1 3.77Å
132P88Confident86.4Confident13 Ų1343.2 Ų43.28%0.08422%0.219CC..Hα-helixtrans-59.7-37.6172.7-23.333.7000113.2A127 W136 I157 L160A127-P132 VanDerWaalsContact O-CD 3.27Å; A127-P132 WeakPolarHBondContact O-CD 3.42Å; P132-W136 WeakPolarHBondContact O-CB 3.41Å; P132-W136 PolarHBondContact O-N 2.88Å; P132-I157 HydrophobicContact CB-CD1 4.36Å; P132-I157 HydrophobicContact CB-CG1 4.1Å; P132-I157 HydrophobicContact CG-CD1 4.43Å; P132-I157 HydrophobicContact CG-CG1 3.7Å; P132-L160 HydrophobicContact CG-CD1 3.85Å
133L90.3Very high85.3Confident74 Ų7447.1 Ų47.139%0.38724%0.239SC..Hα-helixtrans-67.2-47.3179.1-179.763.4000112.2V129 L130 M131 W136 I137V129-L133 VanDerWaalsContact O-CB 3.25Å; V129-L133 WeakPolarHBondContact O-CB 3.26Å; V129-L133 PolarHBondContact O-N 2.59Å; L130-L133 HydrophobicContact CD2-CD2 4.15Å; L130-L133 PolarHBondContact O-N 3.06Å; M131-L133 VanDerWaalsContact C-N 3.29Å; M131-L133 PolarHBondContact O-N 3.15Å; L133-W136 HydrophobicContact CD1-CE3 4.33Å; L133-W136 PolarHBondContact O-N 2.92Å; L133-I137 HydrophobicContact CD1-CD1 4.14Å; L133-I137 HydrophobicContact CD1-CG1 4.45Å; L133-I137 HydrophobicContact CG-CD1 4.01Å; L133-I137 VanDerWaalsContact O-CG1 3.31Å; L133-I137 WeakPolarHBondContact O-CG1 3.47Å; L133-I137 PolarHBondContact O-N 3.39Å
134C91.8Very high83.8Confident8 Ų854.6 Ų54.65%0.05428%0.279CS..Hα-helixtrans-61.8-45.3176.7-690000110.7F66 P70 C95 L130 M131 W136 I137 Y138F66-C134 PolarHBondContact O-SG 2.86Å; F66-C134 VanDerWaalsContact O-SG 3.37Å; P70-C134 HydrophobicContact CB-CB 4.33Å; P70-C134 HydrophobicContact CG-CB 4.22Å; C95-C134 HydrophobicContact CB-CB 4.31Å; C95-C134 VanDerWaalsContact SG-CB 3.6Å; L130-C134 VanDerWaalsContact O-CB 3.28Å; L130-C134 WeakPolarHBondContact O-CB 3.33Å; L130-C134 PolarHBondContact O-N 3.2Å; L130-C134 PolarHBondContact O-SG 3.12Å; M131-C134 PolarHBondContact O-N 2.94Å; C134-W136 VanDerWaalsContact C-N 3.31Å; C134-W136 PolarHBondContact O-N 3.47Å; C134-I137 PolarHBondContact O-N 3.39Å; C134-I137 VanDerWaalsContact O-N 3.16Å; C134-Y138 HydrophobicContact CB-CD2 4.24Å; C134-Y138 HydrophobicContact CB-CE2 4.44Å; C134-Y138 VanDerWaalsContact O-CD2 3.23Å; C134-Y138 WeakPolarHBondContact O-CD2 3.44Å; C134-Y138 PolarHBondContact O-N 3.21Å
135L89.5Confident82.8Confident0 Ų054.8 Ų54.80%028%0.28CS..Hα-helixtrans-55.7-46.7173.8-72.7170000111.7M88 L91 L92 C95 M131 I137 S139 F153 I156M88-L135 HydrophobicContact CE-CD2 4.45Å; L91-L135 HydrophobicContact CB-CD2 4.39Å; L92-L135 HydrophobicContact CD1-CD1 3.7Å; L92-L135 HydrophobicContact CD1-CD2 4.2Å; C95-L135 HydrophobicContact CB-CD2 4.19Å; C95-L135 HydrophobicContact CB-CG 4.04Å; M131-L135 HydrophobicContact CE-CD1 4.5Å; M131-L135 HydrophobicContact CG-CD1 4.12Å; M131-L135 WeakPolarHBondContact O-CB 3.43Å; M131-L135 VanDerWaalsContact O-CG 3.24Å; M131-L135 WeakPolarHBondContact O-CG 3.15Å; M131-L135 PolarHBondContact O-N 3.43Å; L135-I137 VanDerWaalsContact C-N 3.33Å; L135-I137 PolarHBondContact O-N 3.29Å; L135-S139 WeakPolarHBondContact O-CB 3.27Å; L135-S139 PolarHBondContact O-N 3.38Å; L135-S139 PolarHBondContact O-OG 3.41Å; L135-F153 HydrophobicContact CB-CE1 4.18Å; L135-I156 HydrophobicContact CD1-CD1 4.17Å; L135-I156 HydrophobicContact CD1-CG2 4.36Å
136W86.6Confident81.7Confident125 Ų12554.9 Ų54.947%0.47329%0.286SS..Hα-helixtrans-66.5-29.6178.7-179.584.3000114.1P132 L133 C134 R140 F153P132-W136 WeakPolarHBondContact O-CB 3.41Å; P132-W136 PolarHBondContact O-N 2.88Å; L133-W136 HydrophobicContact CD1-CE3 4.33Å; L133-W136 PolarHBondContact O-N 2.92Å; C134-W136 VanDerWaalsContact C-N 3.31Å; C134-W136 PolarHBondContact O-N 3.47Å; W136-R140 WeakPolarHBondContact O-CG 3.47Å; W136-F153 HydrophobicContact CB-CE1 3.75Å; W136-F153 HydrophobicContact CB-CZ 4.01Å; W136-F153 HydrophobicContact CG-CZ 4.46Å
137I89.8Confident80.5Confident82 Ų8253 Ų5342%0.42128%0.277SS..Hα-helixtrans-74.6-55.8174.7-68.8168.3000110L133 C134 L135 R140L133-I137 HydrophobicContact CD1-CD1 4.14Å; L133-I137 HydrophobicContact CD1-CG1 4.45Å; L133-I137 HydrophobicContact CG-CD1 4.01Å; L133-I137 VanDerWaalsContact O-CG1 3.31Å; L133-I137 WeakPolarHBondContact O-CG1 3.47Å; L133-I137 PolarHBondContact O-N 3.39Å; C134-I137 PolarHBondContact O-N 3.39Å; C134-I137 VanDerWaalsContact O-N 3.16Å; L135-I137 VanDerWaalsContact C-N 3.33Å; L135-I137 PolarHBondContact O-N 3.29Å; I137-R140 WeakPolarHBondContact O-CB 3.2Å; I137-R140 PolarHBondContact O-N 3.07Å
138Y87.8Confident79.2Confident40 Ų4053.5 Ų53.516%0.15728%0.28CS..Hα-helixtrans-78.3-28.3-170.2-70-71000113.4P70 L71 F74 C134 R140 W142P70-Y138 HydrophobicContact CB-CD2 3.68Å; P70-Y138 HydrophobicContact CB-CE2 3.36Å; P70-Y138 HydrophobicContact CG-CE2 4.48Å; L71-Y138 HydrophobicContact CD1-CE1 4.25Å; F74-Y138 HydrophobicContact CB-CD1 3.68Å; F74-Y138 HydrophobicContact CB-CE1 4.16Å; F74-Y138 HydrophobicContact CB-CG 4.32Å; F74-Y138 HydrophobicContact CD1-CD1 4.11Å; F74-Y138 HydrophobicContact CD1-CE1 4.4Å; F74-Y138 AromaticContact CD2-CD1 3.6Å; F74-Y138 HydrophobicContact CD2-CD1 3.6Å; F74-Y138 HydrophobicContact CD2-CG 4.22Å; F74-Y138 HydrophobicContact CE2-CD1 4.21Å; F74-Y138 WeakPolarHBondContact CE2-O 3.41Å; F74-Y138 AromaticContact CG-CD1 3.54Å; F74-Y138 HydrophobicContact CG-CD1 3.54Å; F74-Y138 HydrophobicContact CG-CE1 4.17Å; F74-Y138 HydrophobicContact CG-CG 4.41Å; C134-Y138 HydrophobicContact CB-CD2 4.24Å; C134-Y138 HydrophobicContact CB-CE2 4.44Å; C134-Y138 VanDerWaalsContact O-CD2 3.23Å; C134-Y138 WeakPolarHBondContact O-CD2 3.44Å; C134-Y138 PolarHBondContact O-N 3.21Å; Y138-R140 PolarHBondContact O-N 3.02Å; Y138-R140 VanDerWaalsContact O-N 3.15Å; Y138-W142 WeakPolarHBondContact O-CZ3 3.33Å
139S84.4Confident78.1Confident4 Ų456.8 Ų56.83%0.02830%0.297CS..G310 helixtrans-66.5-14.2175.275.20000113.4L135 A141 W142 I143L135-S139 WeakPolarHBondContact O-CB 3.27Å; L135-S139 PolarHBondContact O-N 3.38Å; L135-S139 PolarHBondContact O-OG 3.41Å; S139-A141 PolarHBondContact O-N 3.36Å; S139-W142 CarbonylContact O-C 3.51Å; S139-W142 PolarHBondContact O-N 3.32Å; S139-I143 PolarHBondContact O-N 3.48Å
140R80.9Confident76.9Confident134 Ų13456.2 Ų56.251%0.50629%0.29SS..G310 helixtrans-59.7-27.2-179.6-74.6-176.4172.1-133.11.2114.1W136 I137 Y138 W142 I143W136-R140 WeakPolarHBondContact O-CG 3.47Å; I137-R140 WeakPolarHBondContact O-CB 3.2Å; I137-R140 PolarHBondContact O-N 3.07Å; Y138-R140 PolarHBondContact O-N 3.02Å; Y138-R140 VanDerWaalsContact O-N 3.15Å; R140-W142 PolarHBondContact O-N 3.14Å; R140-I143 WeakPolarHBondContact O-CB 3.43Å; R140-I143 VanDerWaalsContact O-CG2 3.27Å; R140-I143 WeakPolarHBondContact O-CG2 3.11Å; R140-I143 PolarHBondContact O-N 3.26Å
141A74.6Confident76Confident58 Ų5855.1 Ų55.148%0.47929%0.285SS..G310 helixtrans-65.4-24.4175.600000112.7F74 S139F74-A141 HydrophobicContact CE2-CB 3.65Å; F74-A141 HydrophobicContact CZ-CB 4Å; S139-A141 PolarHBondContact O-N 3.36Å
142W77.1Confident75.2Confident21 Ų2156.9 Ų56.98%0.0830%0.296CS..G310 helixtrans-105.817.7176.9-62.5-95.4000112.6F74 A77 L78 A87 L91 Y138 S139 R140 N144 T145 V148F74-W142 AromaticContact CD2-CH2 3.83Å; F74-W142 HydrophobicContact CD2-CH2 3.83Å; F74-W142 AromaticContact CD2-CZ3 3.57Å; F74-W142 HydrophobicContact CD2-CZ3 3.57Å; F74-W142 HydrophobicContact CE2-CH2 4.01Å; F74-W142 AromaticContact CE2-CZ3 3.6Å; F74-W142 HydrophobicContact CE2-CZ3 3.6Å; A77-W142 HydrophobicContact CB-CH2 3.9Å; A77-W142 HydrophobicContact CB-CZ2 3.82Å; L78-W142 HydrophobicContact CD2-CH2 4.04Å; L78-W142 HydrophobicContact CD2-CZ2 3.82Å; L78-W142 HydrophobicContact CG-CH2 4.04Å; L78-W142 HydrophobicContact CG-CZ2 4.19Å; A87-W142 HydrophobicContact CB-CD2 4.41Å; A87-W142 HydrophobicContact CB-CZ2 3.85Å; L91-W142 HydrophobicContact CD1-CE3 3.97Å; L91-W142 HydrophobicContact CD1-CH2 4.38Å; L91-W142 HydrophobicContact CD1-CZ3 3.66Å; L91-W142 HydrophobicContact CG-CZ3 4.48Å; Y138-W142 WeakPolarHBondContact O-CZ3 3.33Å; S139-W142 CarbonylContact O-C 3.51Å; S139-W142 PolarHBondContact O-N 3.32Å; R140-W142 PolarHBondContact O-N 3.14Å; W142-N144 PolarHBondContact O-N 2.72Å; W142-N144 VanDerWaalsContact O-N 3.11Å; W142-T145 HydrophobicContact CB-CG2 4.08Å; W142-T145 VanDerWaalsContact O-CB 3.27Å; W142-T145 WeakPolarHBondContact O-CB 3.42Å; W142-T145 WeakPolarHBondContact O-CG2 3.15Å; W142-T145 PolarHBondContact O-N 3.46Å; W142-T145 PolarHBondContact O-OG1 3.44Å; W142-V148 HydrophobicContact CB-CG2 3.58Å; W142-V148 WeakPolarHBondContact O-CB 3.41Å; W142-V148 VanDerWaalsContact O-CG2 3.23Å; W142-V148 WeakPolarHBondContact O-CG2 3.44Å
143I62.1Low74.8Confident84 Ų8458.9 Ų58.943%0.43130%0.303SS..THydrogen-bonded Turntrans-62.6-23.1-171.4-160.5162.8000115.2S139 R140 T145 V148 N149S139-I143 PolarHBondContact O-N 3.48Å; R140-I143 WeakPolarHBondContact O-CB 3.43Å; R140-I143 VanDerWaalsContact O-CG2 3.27Å; R140-I143 WeakPolarHBondContact O-CG2 3.11Å; R140-I143 PolarHBondContact O-N 3.26Å; I143-T145 PolarHBondContact O-N 3.18Å; I143-V148 HydrophobicContact CB-CG1 4.43Å; I143-V148 HydrophobicContact CG1-CG1 4.33Å; I143-N149 PolarHBondContact O-ND2 3.08Å
144N59Low74.1Confident158 Ų15858.1 Ų58.185%0.84531%0.313SS*.THydrogen-bonded Turntrans-78.3-1176.7-62.7-36.5000113.1W142W142-N144 PolarHBondContact O-N 2.72Å; W142-N144 VanDerWaalsContact O-N 3.11Å
145T63.4Low73.4Confident18 Ų1859 Ų5911%0.1132%0.322CS..SBendtrans-95148.5-176.373.60000110.5D84 W142 I143 V147 V148 N149D84-T145 HydrophobicContact CB-CG2 4.21Å; D84-T145 VanDerWaalsContact OD1-CG2 3.3Å; D84-T145 WeakPolarHBondContact OD1-CG2 3.28Å; D84-T145 VanDerWaalsContact OD2-CB 3.31Å; D84-T145 WeakPolarHBondContact OD2-CB 3.42Å; D84-T145 WeakPolarHBondContact OD2-CG2 3.35Å; W142-T145 HydrophobicContact CB-CG2 4.08Å; W142-T145 VanDerWaalsContact O-CB 3.27Å; W142-T145 WeakPolarHBondContact O-CB 3.42Å; W142-T145 WeakPolarHBondContact O-CG2 3.15Å; W142-T145 PolarHBondContact O-N 3.46Å; W142-T145 PolarHBondContact O-OG1 3.44Å; I143-T145 PolarHBondContact O-N 3.18Å; T145-V147 PolarHBondContact O-N 3.21Å; T145-V148 PolarHBondContact O-N 2.84Å; T145-V148 PolarHBondContact OG1-N 3.2Å; T145-N149 PolarHBondContact O-N 3.02Å; T145-N149 PolarHBondContact O-ND2 2.9Å
146P61.5Low73Confident92 Ų9259 Ų5960%0.59732%0.322SS*.Hα-helixtrans-63-27.8174.525.3-32.9000111.8N149 L150P146-N149 PolarHBondContact O-N 2.85Å; P146-L150 WeakPolarHBondContact O-CB 3.33Å; P146-L150 WeakPolarHBondContact O-CD1 3.15Å; P146-L150 WeakPolarHBondContact O-CG 3.47Å; P146-L150 PolarHBondContact O-N 3.34Å
147V61.6Low72.8Confident10 Ų1056.7 Ų56.76%0.06132%0.317CS..Hα-helixtrans-65.9-41.1-178.8-169.30000111.9D84 V85 M88 T145 L150 L151D84-V147 HydrophobicContact CB-CB 4.19Å; D84-V147 HydrophobicContact CB-CG2 3.81Å; V85-V147 HydrophobicContact CG2-CG2 4Å; M88-V147 HydrophobicContact CB-CG1 4.34Å; M88-V147 HydrophobicContact CG-CG1 3.89Å; T145-V147 PolarHBondContact O-N 3.21Å; V147-L150 CarbonylContact O-C 3.55Å; V147-L150 PolarHBondContact O-N 2.88Å; V147-L151 PolarHBondContact O-N 3.31Å
148V61.4Low72.4Confident12 Ų1258.6 Ų58.67%0.07333%0.328CS..Hα-helixtrans-72-35.7176.9172.80000112.2M88 W142 I143 T145 L150 L151M88-V148 HydrophobicContact CG-CG2 4.48Å; M88-V148 HydrophobicContact SD-CG2 3.82Å; W142-V148 HydrophobicContact CB-CG2 3.58Å; W142-V148 WeakPolarHBondContact O-CB 3.41Å; W142-V148 VanDerWaalsContact O-CG2 3.23Å; W142-V148 WeakPolarHBondContact O-CG2 3.44Å; I143-V148 HydrophobicContact CB-CG1 4.43Å; I143-V148 HydrophobicContact CG1-CG1 4.33Å; T145-V148 PolarHBondContact O-N 2.84Å; T145-V148 PolarHBondContact OG1-N 3.2Å; V148-L150 PolarHBondContact O-N 3.23Å; V148-L151 HydrophobicContact CB-CD1 4.41Å; V148-L151 HydrophobicContact CG1-CD1 4.05Å; V148-L151 HydrophobicContact CG2-CD1 4.43Å; V148-L151 VanDerWaalsContact O-CB 3.31Å; V148-L151 WeakPolarHBondContact O-CB 3.44Å; V148-L151 PolarHBondContact O-N 3.38Å; V148-L151 VanDerWaalsContact O-N 3.08Å
149N60.9Low72Confident120 Ų12057 Ų5764%0.64232%0.322SS*.Hα-helixtrans-67.8-22.2173.1-70.4-69.8000112.6I143 T145 P146I143-N149 PolarHBondContact O-ND2 3.08Å; T145-N149 PolarHBondContact O-N 3.02Å; T145-N149 PolarHBondContact O-ND2 2.9Å; P146-N149 PolarHBondContact O-N 2.85Å
150L63Low71.8Confident94 Ų9457 Ų5749%0.49232%0.322SS..THydrogen-bonded Turntrans-86.81.1171.9-71.9167.5000113.6P146 V147 V148 P152 L275P146-L150 WeakPolarHBondContact O-CB 3.33Å; P146-L150 WeakPolarHBondContact O-CD1 3.15Å; P146-L150 WeakPolarHBondContact O-CG 3.47Å; P146-L150 PolarHBondContact O-N 3.34Å; V147-L150 CarbonylContact O-C 3.55Å; V147-L150 PolarHBondContact O-N 2.88Å; V148-L150 PolarHBondContact O-N 3.23Å; L150-P152 WeakPolarHBondContact O-CD 3.27Å; L150-L275 HydrophobicContact CD1-CD1 4.2Å
151L70.3Confident71.8Confident11 Ų1153.6 Ų53.66%0.05832%0.318CS..  trans-62.9108.3176.2-82.4170.1000110.4M88 V147 V148 F153 I156 F271M88-L151 HydrophobicContact CE-CD1 3.76Å; M88-L151 HydrophobicContact CE-CD2 3.63Å; M88-L151 HydrophobicContact CE-CG 4.18Å; M88-L151 HydrophobicContact SD-CD1 4.17Å; V147-L151 PolarHBondContact O-N 3.31Å; V148-L151 HydrophobicContact CB-CD1 4.41Å; V148-L151 HydrophobicContact CG1-CD1 4.05Å; V148-L151 HydrophobicContact CG2-CD1 4.43Å; V148-L151 VanDerWaalsContact O-CB 3.31Å; V148-L151 WeakPolarHBondContact O-CB 3.44Å; V148-L151 PolarHBondContact O-N 3.38Å; V148-L151 VanDerWaalsContact O-N 3.08Å; L151-F153 VanDerWaalsContact C-N 3.25Å; L151-F153 HydrophobicContact CB-CD2 4.07Å; L151-F153 HydrophobicContact CB-CE2 3.62Å; L151-F153 HydrophobicContact CB-CZ 4Å; L151-F153 HydrophobicContact CD1-CE2 4.23Å; L151-F153 HydrophobicContact CD1-CZ 3.86Å; L151-F153 VanDerWaalsContact O-CD2 3.3Å; L151-F153 WeakPolarHBondContact O-CD2 3.32Å; L151-F153 PolarHBondContact O-N 2.98Å; L151-I156 HydrophobicContact CD2-CD1 4.38Å; L151-F271 HydrophobicContact CD2-CE1 3.94Å; L151-F271 HydrophobicContact CD2-CZ 3.6Å
152P75.3Confident72Confident36 Ų3653.2 Ų53.223%0.23431%0.312CS..  trans-91.473.4-172.627.4-13.1000107L150 G154 A155 I156 A270L150-P152 WeakPolarHBondContact O-CD 3.27Å; P152-G154 PolarHBondContact O-N 3.15Å; P152-G154 VanDerWaalsContact O-N 3.08Å; P152-A155 HydrophobicContact CB-CB 3.88Å; P152-A155 HydrophobicContact CG-CB 4.24Å; P152-A155 CarbonylContact O-C 3.4Å; P152-A155 WeakPolarHBondContact O-CA 3.44Å; P152-A155 WeakPolarHBondContact O-CB 3.17Å; P152-A155 PolarHBondContact O-N 3.18Å; P152-I156 PolarHBondContact O-N 3.24Å; P152-A270 HydrophobicContact CG-CB 4.01Å; P152-A270 WeakPolarHBondContact CG-O 3.24Å
153F78.7Confident72Confident56 Ų5653 Ų5325%0.24631%0.313CS..Hα-helixtrans-49.9-37.3-179.5-69.5-81000112.1L135 W136 L151 I156 I157L135-F153 HydrophobicContact CB-CE1 4.18Å; W136-F153 HydrophobicContact CB-CE1 3.75Å; W136-F153 HydrophobicContact CB-CZ 4.01Å; W136-F153 HydrophobicContact CG-CZ 4.46Å; L151-F153 VanDerWaalsContact C-N 3.25Å; L151-F153 HydrophobicContact CB-CD2 4.07Å; L151-F153 HydrophobicContact CB-CE2 3.62Å; L151-F153 HydrophobicContact CB-CZ 4Å; L151-F153 HydrophobicContact CD1-CE2 4.23Å; L151-F153 HydrophobicContact CD1-CZ 3.86Å; L151-F153 VanDerWaalsContact O-CD2 3.3Å; L151-F153 WeakPolarHBondContact O-CD2 3.32Å; L151-F153 PolarHBondContact O-N 2.98Å; F153-I156 PolarHBondContact O-N 2.88Å; F153-I157 WeakPolarHBondContact O-CB 3.34Å; F153-I157 VanDerWaalsContact O-CG1 3.25Å; F153-I157 WeakPolarHBondContact O-CG1 3.33Å; F153-I157 PolarHBondContact O-N 3.42Å
154G76.2Confident72.7Confident58 Ų5851.5 Ų51.560%0.59831%0.306SS*.Hα-helixtrans-61.7-40.8172.300000113.9P152 L158P152-G154 PolarHBondContact O-N 3.15Å; P152-G154 VanDerWaalsContact O-N 3.08Å; G154-L158 WeakPolarHBondContact O-CB 3.19Å; G154-L158 PolarHBondContact O-N 2.93Å
155A77Confident74Confident27 Ų2749.3 Ų49.322%0.22329%0.292CS..Hα-helixtrans-75.2-31.2175.900000112.6P152 T159 A270P152-A155 HydrophobicContact CB-CB 3.88Å; P152-A155 HydrophobicContact CG-CB 4.24Å; P152-A155 CarbonylContact O-C 3.4Å; P152-A155 WeakPolarHBondContact O-CA 3.44Å; P152-A155 WeakPolarHBondContact O-CB 3.17Å; P152-A155 PolarHBondContact O-N 3.18Å; A155-T159 VanDerWaalsContact O-CB 3.28Å; A155-T159 WeakPolarHBondContact O-CB 3.41Å; A155-T159 PolarHBondContact O-N 3.23Å; A155-T159 PolarHBondContact O-OG1 3.44Å; A155-A270 HydrophobicContact CB-CB 3.9Å
156I81.6Confident75.1Confident0 Ų049 Ų490%029%0.291CS..Hα-helixtrans-65.2-49.1172.1-62.3169.3000109.8L135 L151 P152 F153 T159 L160 I266 A270L135-I156 HydrophobicContact CD1-CD1 4.17Å; L135-I156 HydrophobicContact CD1-CG2 4.36Å; L151-I156 HydrophobicContact CD2-CD1 4.38Å; P152-I156 PolarHBondContact O-N 3.24Å; F153-I156 PolarHBondContact O-N 2.88Å; I156-T159 PolarHBondContact O-N 2.95Å; I156-L160 HydrophobicContact CG2-CD1 4.1Å; I156-L160 WeakPolarHBondContact O-CG 3.2Å; I156-L160 PolarHBondContact O-N 2.87Å; I156-I266 HydrophobicContact CB-CG2 4.31Å; I156-I266 HydrophobicContact CG1-CG2 3.83Å; I156-I266 HydrophobicContact CG2-CG2 4.04Å; I156-A270 HydrophobicContact CG1-CB 3.93Å
157I82.3Confident76Confident75 Ų7545.5 Ų45.539%0.38527%0.267SS..Hα-helixtrans-61.7-45.3175.1-68.2164.6000110.5P132 F153 T159 L160 C161P132-I157 HydrophobicContact CB-CD1 4.36Å; P132-I157 HydrophobicContact CB-CG1 4.1Å; P132-I157 HydrophobicContact CG-CD1 4.43Å; P132-I157 HydrophobicContact CG-CG1 3.7Å; F153-I157 WeakPolarHBondContact O-CB 3.34Å; F153-I157 VanDerWaalsContact O-CG1 3.25Å; F153-I157 WeakPolarHBondContact O-CG1 3.33Å; F153-I157 PolarHBondContact O-N 3.42Å; I157-T159 VanDerWaalsContact C-N 3.29Å; I157-T159 PolarHBondContact O-N 2.95Å; I157-L160 PolarHBondContact O-N 3.16Å; I157-C161 WeakPolarHBondContact O-CB 3.44Å; I157-C161 PolarHBondContact O-N 2.81Å; I157-C161 PolarHBondContact O-SG 3.44Å
158L81.6Confident77Confident122 Ų12246.9 Ų46.964%0.63928%0.283SS*.Hα-helixtrans-60-39.3176.2-17667.4000111.9G154 S162G154-L158 WeakPolarHBondContact O-CB 3.19Å; G154-L158 PolarHBondContact O-N 2.93Å; L158-S162 WeakPolarHBondContact O-CB 3.45Å; L158-S162 PolarHBondContact O-N 3.27Å; L158-S162 PolarHBondContact O-OG 3.38Å
159T78.7Confident78.3Confident6 Ų650.4 Ų50.44%0.03730%0.301CS..Hα-helixtrans-68.2-43.2176-580000111.3A155 I156 I157 S162 T163 I266 L269A155-T159 VanDerWaalsContact O-CB 3.28Å; A155-T159 WeakPolarHBondContact O-CB 3.41Å; A155-T159 PolarHBondContact O-N 3.23Å; A155-T159 PolarHBondContact O-OG1 3.44Å; I156-T159 PolarHBondContact O-N 2.95Å; I157-T159 VanDerWaalsContact C-N 3.29Å; I157-T159 PolarHBondContact O-N 2.95Å; T159-S162 WeakPolarHBondContact CA-OG 3.27Å; T159-S162 PolarHBondContact O-N 2.89Å; T159-S162 PolarHBondContact O-OG 3.02Å; T159-T163 HydrophobicContact CG2-CG2 4.41Å; T159-T163 WeakPolarHBondContact O-CG2 3.09Å; T159-T163 PolarHBondContact O-N 3.12Å; T159-T163 PolarHBondContact O-OG1 3.32Å; T159-I266 HydrophobicContact CG2-CB 4.48Å; T159-I266 HydrophobicContact CG2-CG1 3.71Å; T159-L269 HydrophobicContact CG2-CB 4.19Å; T159-L269 HydrophobicContact CG2-CD1 3.78Å
160L80.3Confident79.5Confident4 Ų444.7 Ų44.72%0.02127%0.271CS..Hα-helixtrans-59.3-48.9174-74.9166.6000110.8L128 M131 P132 I156 I157 S162 T163 L164 L262 I266L128-L160 HydrophobicContact CD2-CB 4.07Å; M131-L160 HydrophobicContact CB-CD1 4.38Å; M131-L160 HydrophobicContact SD-CD1 4.35Å; M131-L160 HydrophobicContact SD-CD2 4.05Å; P132-L160 HydrophobicContact CG-CD1 3.85Å; I156-L160 HydrophobicContact CG2-CD1 4.1Å; I156-L160 WeakPolarHBondContact O-CG 3.2Å; I156-L160 PolarHBondContact O-N 2.87Å; I157-L160 PolarHBondContact O-N 3.16Å; L160-S162 VanDerWaalsContact C-N 3.32Å; L160-S162 PolarHBondContact O-N 2.88Å; L160-T163 PolarHBondContact O-N 3.14Å; L160-T163 PolarHBondContact O-OG1 2.98Å; L160-L164 PolarHBondContact O-N 3.45Å; L160-L262 HydrophobicContact CD2-CD1 4.26Å; L160-L262 HydrophobicContact CD2-CD2 4.03Å; L160-I266 HydrophobicContact CD2-CD1 4.06Å; L160-I266 HydrophobicContact CG-CD1 4.25Å
161C81.4Confident80.4Confident64 Ų6441.8 Ų41.843%0.43226%0.257SS..Hα-helixtrans-60.1-37.4174.1-68.30000112.9I157 L164I157-C161 WeakPolarHBondContact O-CB 3.44Å; I157-C161 PolarHBondContact O-N 2.81Å; I157-C161 PolarHBondContact O-SG 3.44Å; C161-L164 WeakPolarHBondContact O-CB 3.23Å; C161-L164 PolarHBondContact O-N 3.37Å
162S79.1Confident81.2Confident50 Ų5045.6 Ų45.635%0.3528%0.275SS..Hα-helixtrans-72.6-30.5177.377.70000112.7L158 T159 L160 I165 P166L158-S162 WeakPolarHBondContact O-CB 3.45Å; L158-S162 PolarHBondContact O-N 3.27Å; L158-S162 PolarHBondContact O-OG 3.38Å; T159-S162 WeakPolarHBondContact CA-OG 3.27Å; T159-S162 PolarHBondContact O-N 2.89Å; T159-S162 PolarHBondContact O-OG 3.02Å; L160-S162 VanDerWaalsContact C-N 3.32Å; L160-S162 PolarHBondContact O-N 2.88Å; S162-I165 PolarHBondContact O-N 3.13Å; S162-P166 WeakPolarHBondContact O-CD 3.27Å
163T75.6Confident81.8Confident15 Ų1545.8 Ų45.89%0.09227%0.274CS..Hα-helixtrans-75.9-24.8173.660.50000113.5M36 T159 L160 I165 P166 I167 L262M36-T163 HydrophobicContact CG-CG2 4.31Å; T159-T163 HydrophobicContact CG2-CG2 4.41Å; T159-T163 WeakPolarHBondContact O-CG2 3.09Å; T159-T163 PolarHBondContact O-N 3.12Å; T159-T163 PolarHBondContact O-OG1 3.32Å; L160-T163 PolarHBondContact O-N 3.14Å; L160-T163 PolarHBondContact O-OG1 2.98Å; T163-I165 VanDerWaalsContact C-N 3.26Å; T163-I165 PolarHBondContact O-N 2.83Å; T163-P166 VanDerWaalsContact O-CD 3.25Å; T163-P166 WeakPolarHBondContact O-CD 3.1Å; T163-P166 WeakPolarHBondContact O-CG 3.33Å; T163-I167 WeakPolarHBondContact O-CD1 3.33Å; T163-I167 VanDerWaalsContact O-CG1 3.24Å; T163-I167 WeakPolarHBondContact O-CG1 3.25Å; T163-I167 PolarHBondContact O-N 3.11Å; T163-L262 HydrophobicContact CG2-CD1 3.85Å
164L78.4Confident82.2Confident54 Ų5443.9 Ų43.928%0.28327%0.265SS..Hα-helixtrans-61.9-32.5169.2-73.5178.9000113.3L128 L160 C161 I167 G168L128-L164 HydrophobicContact CD1-CD1 3.52Å; L128-L164 HydrophobicContact CD1-CD2 4.01Å; L128-L164 HydrophobicContact CD1-CG 4.21Å; L128-L164 HydrophobicContact CD2-CD1 3.58Å; L128-L164 HydrophobicContact CD2-CD2 3.81Å; L128-L164 HydrophobicContact CD2-CG 3.63Å; L128-L164 HydrophobicContact CG-CD1 4.14Å; L128-L164 HydrophobicContact CG-CD2 4.31Å; L128-L164 HydrophobicContact CG-CG 4.47Å; L160-L164 PolarHBondContact O-N 3.45Å; C161-L164 WeakPolarHBondContact O-CB 3.23Å; C161-L164 PolarHBondContact O-N 3.37Å; L164-I167 PolarHBondContact O-N 3.44Å; L164-G168 PolarHBondContact O-N 2.92Å
165I86.1Confident82.7Confident111 Ų11149.3 Ų49.357%0.56927%0.269SS*.Hα-helixtrans-60.5-56.1-177.6-62170.1000111S162 T163 I167 G168 L169S162-I165 PolarHBondContact O-N 3.13Å; T163-I165 VanDerWaalsContact C-N 3.26Å; T163-I165 PolarHBondContact O-N 2.83Å; I165-I167 PolarHBondContact O-N 2.93Å; I165-G168 PolarHBondContact O-N 3.43Å; I165-L169 HydrophobicContact CG2-CD1 4.21Å; I165-L169 WeakPolarHBondContact O-CB 3.46Å; I165-L169 VanDerWaalsContact O-CG 3.29Å; I165-L169 WeakPolarHBondContact O-CG 3.17Å; I165-L169 PolarHBondContact O-N 3.31Å
166P85.6Confident83.2Confident12 Ų1256.1 Ų56.18%0.07829%0.289CS..Hα-helixtrans-64.7-35.5174.824.7-32.1000112.7C33 M36 L37 S162 T163 L169 G170C33-P166 WeakPolarHBondContact O-CB 3.42Å; M36-P166 HydrophobicContact CB-CB 4.17Å; M36-P166 HydrophobicContact CB-CG 3.75Å; L37-P166 WeakPolarHBondContact CA-O 3.24Å; L37-P166 HydrophobicContact CB-CB 4.25Å; S162-P166 WeakPolarHBondContact O-CD 3.27Å; T163-P166 VanDerWaalsContact O-CD 3.25Å; T163-P166 WeakPolarHBondContact O-CD 3.1Å; T163-P166 WeakPolarHBondContact O-CG 3.33Å; P166-L169 PolarHBondContact O-N 3.38Å; P166-G170 PolarHBondContact O-N 3.46Å
167I82Confident83.7Confident19 Ų1961.3 Ų61.310%0.09731%0.313CS..Hα-helixtrans-59.3-52.1174.7-66.9165.9000110.3M36 L39 G40 T124 T163 L164 I165 L169 G170 V171M36-I167 HydrophobicContact CB-CG1 4.15Å; M36-I167 WeakPolarHBondContact O-CG1 3.37Å; M36-I167 HydrophobicContact SD-CD1 4.35Å; L39-I167 HydrophobicContact CD2-CD1 3.93Å; L39-I167 HydrophobicContact CD2-CG1 4.2Å; L39-I167 HydrophobicContact CG-CG1 4.47Å; G40-I167 VanDerWaalsContact CA-O 3.25Å; G40-I167 WeakPolarHBondContact CA-O 3.42Å; T124-I167 HydrophobicContact CG2-CD1 3.99Å; T163-I167 WeakPolarHBondContact O-CD1 3.33Å; T163-I167 VanDerWaalsContact O-CG1 3.24Å; T163-I167 WeakPolarHBondContact O-CG1 3.25Å; T163-I167 PolarHBondContact O-N 3.11Å; L164-I167 PolarHBondContact O-N 3.44Å; I165-I167 PolarHBondContact O-N 2.93Å; I167-L169 VanDerWaalsContact C-N 3.34Å; I167-L169 PolarHBondContact O-N 3.4Å; I167-G170 CarbonylContact O-C 3.43Å; I167-G170 WeakPolarHBondContact O-CA 3.44Å; I167-G170 PolarHBondContact O-N 3.02Å; I167-V171 HydrophobicContact CG2-CG2 4.41Å; I167-V171 VanDerWaalsContact O-CG2 3.27Å; I167-V171 WeakPolarHBondContact O-CG2 3.5Å; I167-V171 PolarHBondContact O-N 3.36Å
168G82.6Confident83.8Confident39 Ų3961.4 Ų61.440%0.40232%0.317SS..Hα-helixtrans-62.5-36.417900000113.4L164 I165 G170 V171 M172L164-G168 PolarHBondContact O-N 2.92Å; I165-G168 PolarHBondContact O-N 3.43Å; G168-G170 VanDerWaalsContact C-N 3.33Å; G168-V171 PolarHBondContact O-N 2.92Å; G168-M172 WeakPolarHBondContact O-CB 3.47Å; G168-M172 PolarHBondContact O-N 3.02Å
169L87.2Confident84.1Confident86 Ų8665.5 Ų65.545%0.4532%0.324SS..Hα-helixtrans-63.6-38.1170.1-71.9173000111.8L37 I165 P166 I167 M172 L173L37-L169 HydrophobicContact CD1-CB 3.87Å; I165-L169 HydrophobicContact CG2-CD1 4.21Å; I165-L169 WeakPolarHBondContact O-CB 3.46Å; I165-L169 VanDerWaalsContact O-CG 3.29Å; I165-L169 WeakPolarHBondContact O-CG 3.17Å; I165-L169 PolarHBondContact O-N 3.31Å; P166-L169 PolarHBondContact O-N 3.38Å; I167-L169 VanDerWaalsContact C-N 3.34Å; I167-L169 PolarHBondContact O-N 3.4Å; L169-M172 HydrophobicContact CD2-CE 3.83Å; L169-M172 PolarHBondContact O-N 3.36Å; L169-L173 VanDerWaalsContact O-CB 3.31Å; L169-L173 WeakPolarHBondContact O-CB 3.38Å; L169-L173 PolarHBondContact O-N 3.43Å
170G85.6Confident84.5Confident0 Ų068.5 Ų68.50%034%0.342CS..Hα-helixtrans-65.1-43.7173.800000112.5G40 P166 I167 G168 L173 R174G40-G170 VanDerWaalsContact C-C 3.41Å; G40-G170 CarbonylContact O-C 3.59Å; P166-G170 PolarHBondContact O-N 3.46Å; I167-G170 CarbonylContact O-C 3.43Å; I167-G170 WeakPolarHBondContact O-CA 3.44Å; I167-G170 PolarHBondContact O-N 3.02Å; G168-G170 VanDerWaalsContact C-N 3.33Å; G170-L173 WeakPolarHBondContact O-CB 3.37Å; G170-L173 PolarHBondContact O-N 2.92Å; G170-R174 PolarHBondContact O-N 2.9Å
171V83.4Confident84.7Confident33 Ų3368.3 Ų68.320%0.234%0.341CS..Hα-helixtrans-62.8-43.8174.5-169.90000110.8G40 V43 V45 I167 G168 L173 R174 Y175G40-V171 PolarHBondContact O-N 3.28Å; V43-V171 HydrophobicContact CB-CG1 4.26Å; V43-V171 HydrophobicContact CB-CG2 3.78Å; V43-V171 HydrophobicContact CG1-CG1 4.04Å; V43-V171 HydrophobicContact CG1-CG2 4.03Å; V43-V171 HydrophobicContact CG2-CG2 4.12Å; V45-V171 HydrophobicContact CG2-CG1 4.35Å; I167-V171 HydrophobicContact CG2-CG2 4.41Å; I167-V171 VanDerWaalsContact O-CG2 3.27Å; I167-V171 WeakPolarHBondContact O-CG2 3.5Å; I167-V171 PolarHBondContact O-N 3.36Å; G168-V171 PolarHBondContact O-N 2.92Å; V171-L173 VanDerWaalsContact C-N 3.31Å; V171-L173 PolarHBondContact O-N 3.26Å; V171-R174 WeakPolarHBondContact O-CB 3.28Å; V171-R174 PolarHBondContact O-N 2.97Å; V171-Y175 WeakPolarHBondContact O-CB 3.42Å; V171-Y175 PolarHBondContact O-N 3.36Å
172M86.2Confident84.8Confident90 Ų9066.9 Ų66.944%0.44333%0.329SS..Hα-helixtrans-63.2-37.4175.9-175.4-176.76500111.9G168 L169 Y175 R176G168-M172 WeakPolarHBondContact O-CB 3.47Å; G168-M172 PolarHBondContact O-N 3.02Å; L169-M172 HydrophobicContact CD2-CE 3.83Å; L169-M172 PolarHBondContact O-N 3.36Å; M172-Y175 PolarHBondContact O-N 2.77Å; M172-R176 PolarHBondContact O-N 3.42Å
173L88.5Confident85.1Confident41 Ų4170.2 Ų70.222%0.21534%0.342CS..Hα-helixtrans-67-42175.1-175.961.7000111.2L169 G170 V171 Y175 R176 H177 V180 A181 V184L169-L173 VanDerWaalsContact O-CB 3.31Å; L169-L173 WeakPolarHBondContact O-CB 3.38Å; L169-L173 PolarHBondContact O-N 3.43Å; G170-L173 WeakPolarHBondContact O-CB 3.37Å; G170-L173 PolarHBondContact O-N 2.92Å; V171-L173 VanDerWaalsContact C-N 3.31Å; V171-L173 PolarHBondContact O-N 3.26Å; L173-Y175 VanDerWaalsContact C-N 3.34Å; L173-Y175 PolarHBondContact O-N 2.88Å; L173-R176 PolarHBondContact O-N 3.42Å; L173-H177 HydrophobicContact CD1-CB 4.3Å; L173-H177 CarbonylContact O-C 3.56Å; L173-H177 WeakPolarHBondContact O-CA 3.27Å; L173-H177 PolarHBondContact O-N 2.72Å; L173-V180 HydrophobicContact CD1-CB 4.31Å; L173-V180 HydrophobicContact CD1-CG1 4.07Å; L173-V180 HydrophobicContact CD2-CG1 4.3Å; L173-A181 HydrophobicContact CG-CB 4.35Å; L173-V184 HydrophobicContact CD2-CB 4.49Å; L173-V184 HydrophobicContact CD2-CG2 4.03Å
174R86.9Confident85.6Confident16 Ų1670.6 Ų70.66%0.0634%0.344CS..Hα-helixtrans-59.6-43.3173.3-172.659.9172.6-162.918.6111.7C41 V43 E44 G170 V171 T178 A181 D182C41-R174 WeakPolarHBondContact O-CD 3.2Å; C41-R174 PolarHBondContact O-NH1 3.11Å; V43-R174 WeakPolarHBondContact O-CG 3.14Å; E44-R174 HydrophobicContact CG-CG 4.2Å; E44-R174 IonicContact OE1-CZ 3.15Å; E44-R174 IonicContact OE1-NE 3.39Å; E44-R174 PolarHBondContact OE1-NE 2.97Å; E44-R174 IonicContact OE1-NH2 2.74Å; E44-R174 PolarHBondContact OE1-NH2 3.27Å; G170-R174 PolarHBondContact O-N 2.9Å; V171-R174 WeakPolarHBondContact O-CB 3.28Å; V171-R174 PolarHBondContact O-N 2.97Å; R174-T178 WeakPolarHBondContact O-CG2 3.38Å; R174-A181 HydrophobicContact CB-CB 4.02Å; R174-A181 HydrophobicContact CG-CB 4.48Å; R174-D182 IonicContact CZ-OD1 2.76Å; R174-D182 IonicContact NH1-OD1 2.78Å; R174-D182 PolarHBondContact NH1-OD1 3.26Å; R174-D182 IonicContact NH2-OD1 3.83Å; R174-D182 PolarHBondContact NH2-OD1 2.88Å
175Y85.8Confident85.8Confident171 Ų17169.1 Ų69.167%0.67134%0.337SS*.Hα-helixtrans-66.3-43.7178.6-178.8-111.4000113.4V45 V171 M172 L173V45-Y175 HydrophobicContact CB-CD2 4.08Å; V45-Y175 HydrophobicContact CG1-CD2 4.42Å; V45-Y175 HydrophobicContact CG2-CD2 3.64Å; V45-Y175 HydrophobicContact CG2-CG 4.11Å; V171-Y175 WeakPolarHBondContact O-CB 3.42Å; V171-Y175 PolarHBondContact O-N 3.36Å; M172-Y175 PolarHBondContact O-N 2.77Å; L173-Y175 VanDerWaalsContact C-N 3.34Å; L173-Y175 PolarHBondContact O-N 2.88Å
176R89.1Confident85.6Confident171 Ų17170.4 Ų70.465%0.64534%0.338SS*.Hα-helixtrans-82.9-38.6-179.1-85.5-171.1165.6121.5-4.5114.5M172 L173M172-R176 PolarHBondContact O-N 3.42Å; L173-R176 PolarHBondContact O-N 3.42Å
177H90.4Very high85.5Confident109 Ų10971.8 Ų71.851%0.50535%0.35SS..  trans-143.971.5-167.8-60.4115.8000111L173 R179 V180 A181L173-H177 HydrophobicContact CD1-CB 4.3Å; L173-H177 CarbonylContact O-C 3.56Å; L173-H177 WeakPolarHBondContact O-CA 3.27Å; L173-H177 PolarHBondContact O-N 2.72Å; H177-R179 VanDerWaalsContact C-N 3.31Å; H177-R179 PolarHBondContact O-N 3.07Å; H177-V180 HydrophobicContact CB-CB 3.99Å; H177-V180 HydrophobicContact CB-CG2 3.94Å; H177-V180 PolarHBondContact O-N 3.48Å; H177-A181 PolarHBondContact O-N 3.13Å
178T86Confident85.3Confident76 Ų7671 Ų7147%0.46635%0.347SS..Hα-helixtrans-43.8-52.7178.751.10000112.9R174 V180 A181 D182R174-T178 WeakPolarHBondContact O-CG2 3.38Å; T178-V180 VanDerWaalsContact C-N 3.26Å; T178-V180 PolarHBondContact O-N 2.65Å; T178-V180 VanDerWaalsContact O-N 3.16Å; T178-A181 CarbonylContact O-C 3.56Å; T178-A181 WeakPolarHBondContact O-CA 3.47Å; T178-A181 WeakPolarHBondContact O-CB 3.43Å; T178-A181 PolarHBondContact O-N 3.31Å; T178-D182 PolarHBondContact O-N 3.33Å
179R87.6Confident85Confident208 Ų20871.5 Ų71.579%0.78534%0.34SS*.Hα-helixtrans-54.8-35177.8-66.4-176.4179.81750.1114.5H177 D182 I183H177-R179 VanDerWaalsContact C-N 3.31Å; H177-R179 PolarHBondContact O-N 3.07Å; R179-D182 WeakPolarHBondContact CA-OD2 3.5Å; R179-I183 WeakPolarHBondContact O-CD1 3.34Å; R179-I183 WeakPolarHBondContact O-CG1 3.36Å; R179-I183 PolarHBondContact O-N 2.92Å
180V86.9Confident84.5Confident69 Ų6975 Ų7542%0.41835%0.347SS..Hα-helixtrans-78.6-39.9177.6-177.70000109.9L173 H177 T178 D182 I183 V184L173-V180 HydrophobicContact CD1-CB 4.31Å; L173-V180 HydrophobicContact CD1-CG1 4.07Å; L173-V180 HydrophobicContact CD2-CG1 4.3Å; H177-V180 HydrophobicContact CB-CB 3.99Å; H177-V180 HydrophobicContact CB-CG2 3.94Å; H177-V180 PolarHBondContact O-N 3.48Å; T178-V180 VanDerWaalsContact C-N 3.26Å; T178-V180 PolarHBondContact O-N 2.65Å; T178-V180 VanDerWaalsContact O-N 3.16Å; V180-D182 VanDerWaalsContact C-N 3.28Å; V180-D182 PolarHBondContact O-N 2.92Å; V180-I183 PolarHBondContact O-N 3.44Å; V180-V184 HydrophobicContact CG1-CG2 4.44Å; V180-V184 WeakPolarHBondContact O-CG2 3.46Å; V180-V184 PolarHBondContact O-N 3.33Å
181A83.3Confident84.1Confident0 Ų076.3 Ų76.30%036%0.356CS..Hα-helixtrans-61.3-35.3173.800000112.4C41 L173 R174 H177 T178 V184 L185C41-A181 HydrophobicContact CB-CB 4.08Å; L173-A181 HydrophobicContact CG-CB 4.35Å; R174-A181 HydrophobicContact CB-CB 4.02Å; R174-A181 HydrophobicContact CG-CB 4.48Å; H177-A181 PolarHBondContact O-N 3.13Å; T178-A181 CarbonylContact O-C 3.56Å; T178-A181 WeakPolarHBondContact O-CA 3.47Å; T178-A181 WeakPolarHBondContact O-CB 3.43Å; T178-A181 PolarHBondContact O-N 3.31Å; A181-V184 PolarHBondContact O-N 2.94Å; A181-L185 WeakPolarHBondContact O-CB 3.3Å; A181-L185 PolarHBondContact O-N 3.4Å
182D83.8Confident83.5Confident34 Ų3475.8 Ų75.818%0.18235%0.352CS..Hα-helixtrans-61.3-44.7173.6-58.3-35.3000112.1R174 T178 R179 V180 K186 Y337R174-D182 IonicContact CZ-OD1 2.76Å; R174-D182 IonicContact NH1-OD1 2.78Å; R174-D182 PolarHBondContact NH1-OD1 3.26Å; R174-D182 IonicContact NH2-OD1 3.83Å; R174-D182 PolarHBondContact NH2-OD1 2.88Å; T178-D182 PolarHBondContact O-N 3.33Å; R179-D182 WeakPolarHBondContact CA-OD2 3.5Å; V180-D182 VanDerWaalsContact C-N 3.28Å; V180-D182 PolarHBondContact O-N 2.92Å; D182-K186 VanDerWaalsContact O-CB 3.26Å; D182-K186 WeakPolarHBondContact O-CB 3.44Å; D182-K186 PolarHBondContact O-N 3.35Å; D182-Y337 WeakPolarHBondContact OD1-CE1 3.34Å; D182-Y337 PolarHBondContact OD1-OH 2.84Å
183I87.1Confident82.9Confident120 Ų12075.7 Ų75.762%0.61535%0.353SS*.Hα-helixtrans-65.9-45.5178.2-64.7166.5000110R179 V180 K186 A187R179-I183 WeakPolarHBondContact O-CD1 3.34Å; R179-I183 WeakPolarHBondContact O-CG1 3.36Å; R179-I183 PolarHBondContact O-N 2.92Å; V180-I183 PolarHBondContact O-N 3.44Å; I183-K186 PolarHBondContact O-N 2.91Å; I183-A187 VanDerWaalsContact O-CB 3.26Å; I183-A187 WeakPolarHBondContact O-CB 3.38Å; I183-A187 PolarHBondContact O-N 3.37Å
184V85.2Confident82.3Confident24 Ų2478 Ų7815%0.14537%0.369CS..Hα-helixtrans-64.5-43.6177.71720000111.4L37 L173 V180 A181 A187 S188L37-V184 HydrophobicContact CD2-CG1 3.76Å; L37-V184 HydrophobicContact CG-CG1 4.17Å; L173-V184 HydrophobicContact CD2-CB 4.49Å; L173-V184 HydrophobicContact CD2-CG2 4.03Å; V180-V184 HydrophobicContact CG1-CG2 4.44Å; V180-V184 WeakPolarHBondContact O-CG2 3.46Å; V180-V184 PolarHBondContact O-N 3.33Å; A181-V184 PolarHBondContact O-N 2.94Å; V184-A187 PolarHBondContact O-N 3.47Å; V184-S188 WeakPolarHBondContact O-CB 3.33Å; V184-S188 PolarHBondContact O-N 3.03Å
185L81.6Confident81.5Confident23 Ų2379.7 Ų79.712%0.1238%0.381CS..Hα-helixtrans-58.8-52.4174.5171.555.3000110.5C41 T42 A181 A187 S188 L189C41-L185 HydrophobicContact CB-CB 4.11Å; T42-L185 HydrophobicContact CG2-CD1 3.42Å; T42-L185 VanDerWaalsContact CG2-CD1 3.42Å; T42-L185 HydrophobicContact CG2-CD2 4.06Å; T42-L185 HydrophobicContact CG2-CG 4.38Å; A181-L185 WeakPolarHBondContact O-CB 3.3Å; A181-L185 PolarHBondContact O-N 3.4Å; L185-A187 VanDerWaalsContact C-N 3.33Å; L185-A187 PolarHBondContact O-N 3.04Å; L185-S188 WeakPolarHBondContact O-CB 3.3Å; L185-S188 PolarHBondContact O-N 3.16Å; L185-S188 VanDerWaalsContact O-N 3.12Å; L185-L189 HydrophobicContact CD1-CD1 3.99Å; L185-L189 HydrophobicContact CD1-CD2 4.44Å; L185-L189 HydrophobicContact CD1-CG 3.97Å; L185-L189 HydrophobicContact CG-CD1 4.27Å; L185-L189 WeakPolarHBondContact O-CG 3.43Å; L185-L189 PolarHBondContact O-N 3Å
186K82.1Confident80.6Confident138 Ų13873.2 Ų73.260%0.636%0.358SS*.Hα-helixtrans-58.9-45178.9-168.2168.7-1751730111.1D182 I183 S188 L189 W190D182-K186 VanDerWaalsContact O-CB 3.26Å; D182-K186 WeakPolarHBondContact O-CB 3.44Å; D182-K186 PolarHBondContact O-N 3.35Å; I183-K186 PolarHBondContact O-N 2.91Å; K186-S188 PolarHBondContact O-N 2.94Å; K186-L189 PolarHBondContact O-N 3.41Å; K186-W190 PolarHBondContact O-N 3.33Å
187A84.1Confident79.8Confident41 Ų4168.6 Ų68.634%0.33935%0.348SS..Hα-helixtrans-63.1-38.2175.700000112.7F34 I183 V184 L185 W190 S191F34-A187 HydrophobicContact CE1-CB 4.33Å; F34-A187 HydrophobicContact CZ-CB 3.87Å; I183-A187 VanDerWaalsContact O-CB 3.26Å; I183-A187 WeakPolarHBondContact O-CB 3.38Å; I183-A187 PolarHBondContact O-N 3.37Å; V184-A187 PolarHBondContact O-N 3.47Å; L185-A187 VanDerWaalsContact C-N 3.33Å; L185-A187 PolarHBondContact O-N 3.04Å; A187-W190 PolarHBondContact O-N 3.15Å; A187-S191 WeakPolarHBondContact O-CB 3.14Å; A187-S191 PolarHBondContact O-N 2.94Å
188S78.4Confident78.7Confident3 Ų368 Ų682%0.02135%0.347CS..Hα-helixtrans-66.7-37.7174178.50000112.6T35 V184 L185 K186 S191 L192T35-S188 WeakPolarHBondContact CA-OG 3.35Å; V184-S188 WeakPolarHBondContact O-CB 3.33Å; V184-S188 PolarHBondContact O-N 3.03Å; L185-S188 WeakPolarHBondContact O-CB 3.3Å; L185-S188 PolarHBondContact O-N 3.16Å; L185-S188 VanDerWaalsContact O-N 3.12Å; K186-S188 PolarHBondContact O-N 2.94Å; S188-S191 PolarHBondContact O-N 3.36Å; S188-L192 WeakPolarHBondContact O-CB 3.35Å; S188-L192 PolarHBondContact O-N 2.98Å
189L75.6Confident77.7Confident48 Ų4866.6 Ų66.625%0.25134%0.336SS..Hα-helixtrans-69.3-38.3175.5-66.9178.4000111.5N100 I104 L185 K186 L192 L193N100-L189 HydrophobicContact CB-CD2 4.37Å; I104-L189 HydrophobicContact CD1-CD1 4.11Å; I104-L189 HydrophobicContact CD1-CD2 3.87Å; I104-L189 HydrophobicContact CD1-CG 4.46Å; L185-L189 HydrophobicContact CD1-CD1 3.99Å; L185-L189 HydrophobicContact CD1-CD2 4.44Å; L185-L189 HydrophobicContact CD1-CG 3.97Å; L185-L189 HydrophobicContact CG-CD1 4.27Å; L185-L189 WeakPolarHBondContact O-CG 3.43Å; L185-L189 PolarHBondContact O-N 3Å; K186-L189 PolarHBondContact O-N 3.41Å; L189-L192 PolarHBondContact O-N 3.11Å; L189-L193 WeakPolarHBondContact O-CB 3.39Å; L189-L193 PolarHBondContact O-N 2.69Å
190W77.6Confident76.8Confident159 Ų15962.1 Ų62.160%0.60232%0.323SS*.Hα-helixtrans-64.3-41.8169.1-79.4108.5000112.1K186 A187 L192 L193 V194K186-W190 PolarHBondContact O-N 3.33Å; A187-W190 PolarHBondContact O-N 3.15Å; W190-L192 VanDerWaalsContact C-N 3.35Å; W190-L192 PolarHBondContact O-N 3.18Å; W190-L193 HydrophobicContact CE3-CD2 4.11Å; W190-L193 HydrophobicContact CZ3-CD2 4.04Å; W190-L193 PolarHBondContact O-N 3.41Å; W190-V194 WeakPolarHBondContact O-CB 3.25Å; W190-V194 VanDerWaalsContact O-CG2 3.27Å; W190-V194 WeakPolarHBondContact O-CG2 3.27Å; W190-V194 PolarHBondContact O-N 2.78Å
191S75.9Confident75.9Confident28 Ų2862.5 Ų62.520%0.19633%0.325CS..Hα-helixtrans-62.4-41.1175.1177.20000111.6A187 S188 T195A187-S191 WeakPolarHBondContact O-CB 3.14Å; A187-S191 PolarHBondContact O-N 2.94Å; S188-S191 PolarHBondContact O-N 3.36Å; S191-T195 VanDerWaalsContact O-CB 3.25Å; S191-T195 WeakPolarHBondContact O-CB 3.23Å; S191-T195 PolarHBondContact O-N 2.91Å; S191-T195 PolarHBondContact O-OG1 3.36Å
192L71.8Confident74.9Confident22 Ų2266.5 Ų66.512%0.11535%0.346CS..Hα-helixtrans-61.5-49.4172.9171.159.2000111.5S188 L189 W190 T195 L196 Q261S188-L192 WeakPolarHBondContact O-CB 3.35Å; S188-L192 PolarHBondContact O-N 2.98Å; L189-L192 PolarHBondContact O-N 3.11Å; W190-L192 VanDerWaalsContact C-N 3.35Å; W190-L192 PolarHBondContact O-N 3.18Å; L192-T195 PolarHBondContact O-N 3.46Å; L192-L196 WeakPolarHBondContact O-CB 3.44Å; L192-L196 PolarHBondContact O-N 3.08Å; L192-Q261 HydrophobicContact CD1-CG 4.03Å
193L73.7Confident73.7Confident89 Ų8965.7 Ų65.747%0.46634%0.342SS..Hα-helixtrans-61.5-47.3178.6-179.464.7000111.6L189 W190 T195 L196 V197L189-L193 WeakPolarHBondContact O-CB 3.39Å; L189-L193 PolarHBondContact O-N 2.69Å; W190-L193 HydrophobicContact CE3-CD2 4.11Å; W190-L193 HydrophobicContact CZ3-CD2 4.04Å; W190-L193 PolarHBondContact O-N 3.41Å; L193-T195 VanDerWaalsContact C-N 3.31Å; L193-T195 PolarHBondContact O-N 3.4Å; L193-L196 PolarHBondContact O-N 2.81Å; L193-V197 HydrophobicContact CD1-CG2 4.29Å; L193-V197 HydrophobicContact CG-CG2 4.5Å; L193-V197 WeakPolarHBondContact O-CB 3.26Å; L193-V197 VanDerWaalsContact O-CG2 3.3Å; L193-V197 WeakPolarHBondContact O-CG2 3.3Å; L193-V197 PolarHBondContact O-N 2.9Å
194V75.8Confident72.6Confident90 Ų9062.9 Ų62.955%0.54534%0.343SS..Hα-helixtrans-62.1-39.6175.81690000110.9W190 M198W190-V194 WeakPolarHBondContact O-CB 3.25Å; W190-V194 VanDerWaalsContact O-CG2 3.27Å; W190-V194 WeakPolarHBondContact O-CG2 3.27Å; W190-V194 PolarHBondContact O-N 2.78Å; V194-M198 WeakPolarHBondContact O-CB 3.17Å; V194-M198 PolarHBondContact O-N 3.13Å
195T69.3Low71.5Confident51 Ų5166.4 Ų66.431%0.31336%0.364SS..Hα-helixtrans-64-44.6175.3-57.70000110.9S191 L192 L193 M198 L199S191-T195 VanDerWaalsContact O-CB 3.25Å; S191-T195 WeakPolarHBondContact O-CB 3.23Å; S191-T195 PolarHBondContact O-N 2.91Å; S191-T195 PolarHBondContact O-OG1 3.36Å; L192-T195 PolarHBondContact O-N 3.46Å; L193-T195 VanDerWaalsContact C-N 3.31Å; L193-T195 PolarHBondContact O-N 3.4Å; T195-M198 PolarHBondContact O-N 3.2Å; T195-L199 WeakPolarHBondContact O-CB 3.3Å; T195-L199 PolarHBondContact O-N 3.07Å
196L67.9Low70Confident34 Ų3470.8 Ų70.818%0.17839%0.386CS..Hα-helixtrans-66.3-42.1178.6-164.5158.7000111.6L192 L193 L199 F200 A291L192-L196 WeakPolarHBondContact O-CB 3.44Å; L192-L196 PolarHBondContact O-N 3.08Å; L193-L196 PolarHBondContact O-N 2.81Å; L196-L199 PolarHBondContact O-N 3.2Å; L196-F200 VanDerWaalsContact O-CB 3.32Å; L196-F200 WeakPolarHBondContact O-CB 3.5Å; L196-F200 PolarHBondContact O-N 2.93Å; L196-A291 HydrophobicContact CD1-CB 4.3Å
197V71.1Confident68.6Low75 Ų7565 Ų6546%0.45536%0.362SS..Hα-helixtrans-66.7-44.1175.2170.90000111.4L193 L199 F200 V201L193-V197 HydrophobicContact CD1-CG2 4.29Å; L193-V197 HydrophobicContact CG-CG2 4.5Å; L193-V197 WeakPolarHBondContact O-CB 3.26Å; L193-V197 VanDerWaalsContact O-CG2 3.3Å; L193-V197 WeakPolarHBondContact O-CG2 3.3Å; L193-V197 PolarHBondContact O-N 2.9Å; V197-L199 VanDerWaalsContact C-N 3.33Å; V197-L199 PolarHBondContact O-N 3.47Å; V197-F200 PolarHBondContact O-N 3.42Å; V197-V201 HydrophobicContact CG1-CG2 4.47Å; V197-V201 WeakPolarHBondContact O-CB 3.13Å; V197-V201 VanDerWaalsContact O-CG2 3.32Å; V197-V201 WeakPolarHBondContact O-CG2 3.25Å; V197-V201 PolarHBondContact O-N 3.08Å
198M68.9Low67.3Low96 Ų9664.4 Ų64.447%0.47336%0.359SS..Hα-helixtrans-64.1-40.2176178.3-94.3-89.100111V194 T195 V201 L202V194-M198 WeakPolarHBondContact O-CB 3.17Å; V194-M198 PolarHBondContact O-N 3.13Å; T195-M198 PolarHBondContact O-N 3.2Å; M198-V201 PolarHBondContact O-N 2.91Å; M198-L202 HydrophobicContact CG-CD1 4.45Å; M198-L202 HydrophobicContact CG-CG 4.47Å; M198-L202 WeakPolarHBondContact O-CB 3.38Å; M198-L202 WeakPolarHBondContact O-CG 3.49Å; M198-L202 PolarHBondContact O-N 3.19Å; M198-L202 HydrophobicContact SD-CD1 3.38Å; M198-L202 WeakPolarHBondContact SD-CD1 3.27Å; M198-L202 HydrophobicContact SD-CG 3.98Å
199L65.1Low66.3Low46 Ų4669.5 Ų69.524%0.24139%0.392CS..Hα-helixtrans-65.1-39.2173.9176.2139.8000111.8T195 L196 V197 T203 L284T195-L199 WeakPolarHBondContact O-CB 3.3Å; T195-L199 PolarHBondContact O-N 3.07Å; L196-L199 PolarHBondContact O-N 3.2Å; V197-L199 VanDerWaalsContact C-N 3.33Å; V197-L199 PolarHBondContact O-N 3.47Å; L199-T203 WeakPolarHBondContact O-CB 3.41Å; L199-T203 PolarHBondContact O-N 2.93Å; L199-T203 PolarHBondContact O-OG1 2.89Å; L199-L284 HydrophobicContact CD1-CB 4.28Å; L199-L284 HydrophobicContact CD1-CD1 3.9Å; L199-L284 HydrophobicContact CD1-CG 4.17Å; L199-L284 HydrophobicContact CD2-CB 4.31Å; L199-L284 HydrophobicContact CD2-CD1 4.12Å; L199-L284 HydrophobicContact CD2-CG 3.74Å; L199-L284 HydrophobicContact CG-CD1 3.67Å; L199-L284 HydrophobicContact CG-CG 3.88Å
200F68.1Low65.3Low114 Ų11474.9 Ų74.950%0.542%0.416SS..Hα-helixtrans-66.1-42.2172.3178.8-105.8000112.5L196 V197 T203 G204 L288L196-F200 VanDerWaalsContact O-CB 3.32Å; L196-F200 WeakPolarHBondContact O-CB 3.5Å; L196-F200 PolarHBondContact O-N 2.93Å; V197-F200 PolarHBondContact O-N 3.42Å; F200-T203 WeakPolarHBondContact O-CB 3.45Å; F200-T203 PolarHBondContact O-N 3.14Å; F200-G204 PolarHBondContact O-N 3.32Å; F200-L288 HydrophobicContact CD2-CD1 3.47Å; F200-L288 VanDerWaalsContact CD2-CD1 3.47Å; F200-L288 HydrophobicContact CD2-CD2 3.91Å; F200-L288 HydrophobicContact CD2-CG 4.32Å; F200-L288 HydrophobicContact CE2-CD1 3.73Å; F200-L288 HydrophobicContact CE2-CD2 4.01Å; F200-L288 HydrophobicContact CG-CD1 4.47Å
201V68.6Low64.3Low78 Ų7871.7 Ų71.747%0.47341%0.41SS..Hα-helixtrans-68.3-44.7176.1170.90000111V197 M198 T203 G204 V205V197-V201 HydrophobicContact CG1-CG2 4.47Å; V197-V201 WeakPolarHBondContact O-CB 3.13Å; V197-V201 VanDerWaalsContact O-CG2 3.32Å; V197-V201 WeakPolarHBondContact O-CG2 3.25Å; V197-V201 PolarHBondContact O-N 3.08Å; M198-V201 PolarHBondContact O-N 2.91Å; V201-T203 PolarHBondContact O-N 3.43Å; V201-G204 PolarHBondContact O-N 2.92Å; V201-V205 HydrophobicContact CG1-CG2 4.03Å; V201-V205 VanDerWaalsContact O-CB 3.23Å; V201-V205 WeakPolarHBondContact O-CB 3.41Å; V201-V205 VanDerWaalsContact O-CG2 3.23Å; V201-V205 WeakPolarHBondContact O-CG2 3.31Å; V201-V205 PolarHBondContact O-N 3.2Å
202L61.7Low63.5Low83 Ų8373.8 Ų73.844%0.43542%0.419SS..Hα-helixtrans-61-34.8171.5-73.8-176.6000111.1M198 M206M198-L202 HydrophobicContact CG-CD1 4.45Å; M198-L202 HydrophobicContact CG-CG 4.47Å; M198-L202 WeakPolarHBondContact O-CB 3.38Å; M198-L202 WeakPolarHBondContact O-CG 3.49Å; M198-L202 PolarHBondContact O-N 3.19Å; M198-L202 HydrophobicContact SD-CD1 3.38Å; M198-L202 WeakPolarHBondContact SD-CD1 3.27Å; M198-L202 HydrophobicContact SD-CG 3.98Å; L202-M206 HydrophobicContact CB-CG 4.33Å; L202-M206 HydrophobicContact CD2-CG 3.8Å; L202-M206 WeakPolarHBondContact O-CA 3.49Å; L202-M206 WeakPolarHBondContact O-CB 3.26Å; L202-M206 WeakPolarHBondContact O-CG 3.4Å; L202-M206 PolarHBondContact O-N 3.26Å
203T58.8Low63Low17 Ų1777.3 Ų77.310%0.10445%0.445CS..Hα-helixtrans-62.9-56.3172-55.60000109.9L199 F200 V201 V205 L207 L284L199-T203 WeakPolarHBondContact O-CB 3.41Å; L199-T203 PolarHBondContact O-N 2.93Å; L199-T203 PolarHBondContact O-OG1 2.89Å; F200-T203 WeakPolarHBondContact O-CB 3.45Å; F200-T203 PolarHBondContact O-N 3.14Å; V201-T203 PolarHBondContact O-N 3.43Å; T203-V205 VanDerWaalsContact C-N 3.28Å; T203-V205 PolarHBondContact O-N 2.95Å; T203-L207 HydrophobicContact CG2-CD1 4.16Å; T203-L207 HydrophobicContact CG2-CD2 4.35Å; T203-L207 CarbonylContact O-C 3.58Å; T203-L207 VanDerWaalsContact O-CA 3.24Å; T203-L207 WeakPolarHBondContact O-CA 3.3Å; T203-L207 WeakPolarHBondContact O-CB 3.35Å; T203-L207 PolarHBondContact O-N 2.99Å; T203-L284 HydrophobicContact CG2-CD2 4.23Å
204G63.3Low62.8Low62 Ų6278.1 Ų78.164%0.63945%0.454SS*.Hα-helixtrans-66.5-19.8-178.900000116.2F200 V201F200-G204 PolarHBondContact O-N 3.32Å; V201-G204 PolarHBondContact O-N 2.92Å
205V62.4Low62.7Low97 Ų9774.7 Ų74.759%0.58843%0.432SS*.Hα-helixtrans-108.1-39-175.6179.40000112.9V201 T203V201-V205 HydrophobicContact CG1-CG2 4.03Å; V201-V205 VanDerWaalsContact O-CB 3.23Å; V201-V205 WeakPolarHBondContact O-CB 3.41Å; V201-V205 VanDerWaalsContact O-CG2 3.23Å; V201-V205 WeakPolarHBondContact O-CG2 3.31Å; V201-V205 PolarHBondContact O-N 3.2Å; T203-V205 VanDerWaalsContact C-N 3.28Å; T203-V205 PolarHBondContact O-N 2.95Å
206M49.4Very low63.4Low116 Ų11674.7 Ų74.757%0.57143%0.433SS*.Hα-helixtrans-86-39.2174.9-54.6-76.991.300111.1L202 G208 L211L202-M206 HydrophobicContact CB-CG 4.33Å; L202-M206 HydrophobicContact CD2-CG 3.8Å; L202-M206 WeakPolarHBondContact O-CA 3.49Å; L202-M206 WeakPolarHBondContact O-CB 3.26Å; L202-M206 WeakPolarHBondContact O-CG 3.4Å; L202-M206 PolarHBondContact O-N 3.26Å; M206-G208 PolarHBondContact O-N 3.3Å; M206-L211 WeakPolarHBondContact O-CD1 3.25Å
207L54.2Low64.3Low17 Ų1778.1 Ų78.19%0.08946%0.457CS..SBendtrans-80.772.5166-63.377.5000109.8T203 L211 L212 I215 M281T203-L207 HydrophobicContact CG2-CD1 4.16Å; T203-L207 HydrophobicContact CG2-CD2 4.35Å; T203-L207 CarbonylContact O-C 3.58Å; T203-L207 VanDerWaalsContact O-CA 3.24Å; T203-L207 WeakPolarHBondContact O-CA 3.3Å; T203-L207 WeakPolarHBondContact O-CB 3.35Å; T203-L207 PolarHBondContact O-N 2.99Å; L207-L211 HydrophobicContact CB-CB 4.08Å; L207-L211 HydrophobicContact CD2-CB 4.41Å; L207-L211 HydrophobicContact CG-CB 3.82Å; L207-L211 HydrophobicContact CG-CD1 4.36Å; L207-L212 HydrophobicContact CB-CD2 3.99Å; L207-L212 HydrophobicContact CB-CG 3.97Å; L207-L212 HydrophobicContact CD2-CD2 3.74Å; L207-L212 HydrophobicContact CD2-CG 4.39Å; L207-I215 HydrophobicContact CD2-CD1 3.52Å; L207-M281 HydrophobicContact CD1-CE 4.5Å; L207-M281 HydrophobicContact CD2-CE 3.97Å; L207-M281 HydrophobicContact CD2-SD 3.81Å
208G56.4Low65.1Low27 Ų2775.8 Ų75.828%0.27845%0.445SS..  trans-55.2168.6152.200000110.9M206 E210 L211 L212M206-G208 PolarHBondContact O-N 3.3Å; G208-E210 PolarHBondContact O-N 3.11Å; G208-L211 PolarHBondContact O-N 2.8Å; G208-L212 PolarHBondContact O-N 3.16Å
209P56.3Low66.1Low111 Ų11171.5 Ų71.572%0.72142%0.424SS*.Hα-helixtrans-54.4-21.7-174.818.6-31.3000114.7S213P209-S213 WeakPolarHBondContact O-CB 3.37Å; P209-S213 PolarHBondContact O-N 3.35Å; P209-S213 PolarHBondContact O-OG 2.84Å
210E55.7Low67.2Low161 Ų16171.9 Ų71.975%0.75242%0.423SS*.Hα-helixtrans-73.3-36.5177.2-60.2-176165.900114.3G208 S213 T214G208-E210 PolarHBondContact O-N 3.11Å; E210-S213 PolarHBondContact O-OG 3.42Å; E210-T214 PolarHBondContact O-N 2.89Å; E210-T214 PolarHBondContact O-OG1 3.46Å
211L55.5Low68.3Low91 Ų9169.4 Ų69.448%0.47642%0.417SS..Hα-helixtrans-82.8-32174.7-67.3-176.1000111.9M206 L207 G208 S213 T214M206-L211 WeakPolarHBondContact O-CD1 3.25Å; L207-L211 HydrophobicContact CB-CB 4.08Å; L207-L211 HydrophobicContact CD2-CB 4.41Å; L207-L211 HydrophobicContact CG-CB 3.82Å; L207-L211 HydrophobicContact CG-CD1 4.36Å; G208-L211 PolarHBondContact O-N 2.8Å; L211-S213 VanDerWaalsContact C-N 3.26Å; L211-S213 PolarHBondContact O-N 3.25Å; L211-T214 WeakPolarHBondContact O-CB 3.48Å; L211-T214 PolarHBondContact O-N 3.23Å; L211-T214 VanDerWaalsContact O-N 3.15Å
212L58.9Low69.6Low72 Ų7265.7 Ų65.738%0.37739%0.394SS..Hα-helixtrans-59.6-38.8172.4-70.9174.5000111.7L207 G208 T214 I215 Y220L207-L212 HydrophobicContact CB-CD2 3.99Å; L207-L212 HydrophobicContact CB-CG 3.97Å; L207-L212 HydrophobicContact CD2-CD2 3.74Å; L207-L212 HydrophobicContact CD2-CG 4.39Å; G208-L212 PolarHBondContact O-N 3.16Å; L212-T214 VanDerWaalsContact C-N 3.3Å; L212-T214 PolarHBondContact O-N 2.83Å; L212-I215 PolarHBondContact O-N 3.02Å; L212-Y220 WeakPolarHBondContact CA-OH 3.46Å; L212-Y220 HydrophobicContact CD2-CE1 4.49Å; L212-Y220 WeakPolarHBondContact CD2-OH 3.19Å; L212-Y220 PolarHBondContact O-OH 2.87Å; L212-Y220 VanDerWaalsContact O-OH 3.1Å
213S61.5Low71Confident97 Ų9761.8 Ų61.868%0.67837%0.374SS*.THydrogen-bonded Turntrans-75.8-14.4177.868.30000114.2P209 E210 L211 I215P209-S213 WeakPolarHBondContact O-CB 3.37Å; P209-S213 PolarHBondContact O-N 3.35Å; P209-S213 PolarHBondContact O-OG 2.84Å; E210-S213 PolarHBondContact O-OG 3.42Å; L211-S213 VanDerWaalsContact C-N 3.26Å; L211-S213 PolarHBondContact O-N 3.25Å; S213-I215 VanDerWaalsContact C-N 3.34Å
214T69.3Low72.7Confident105 Ų10563.1 Ų63.164%0.64438%0.382SS*.THydrogen-bonded Turntrans-78.8-21.2174.5-44.10000111.8E210 L211 L212E210-T214 PolarHBondContact O-N 2.89Å; E210-T214 PolarHBondContact O-OG1 3.46Å; L211-T214 WeakPolarHBondContact O-CB 3.48Å; L211-T214 PolarHBondContact O-N 3.23Å; L211-T214 VanDerWaalsContact O-N 3.15Å; L212-T214 VanDerWaalsContact C-N 3.3Å; L212-T214 PolarHBondContact O-N 2.83Å
215I75.1Confident74.3Confident18 Ų1863 Ų639%0.09237%0.366CS..SBendtrans-85.4127.9-177.6-60.8156.9000109.3L207 L212 S213 V219 Y220 M281L207-I215 HydrophobicContact CD2-CD1 3.52Å; L212-I215 PolarHBondContact O-N 3.02Å; S213-I215 VanDerWaalsContact C-N 3.34Å; I215-V219 HydrophobicContact CG2-CB 4.04Å; I215-V219 HydrophobicContact CG2-CG1 4.28Å; I215-Y220 HydrophobicContact CB-CE2 3.64Å; I215-Y220 VanDerWaalsContact CD1-OH 3.31Å; I215-Y220 WeakPolarHBondContact CD1-OH 3.01Å; I215-Y220 HydrophobicContact CG2-CD2 3.96Å; I215-Y220 HydrophobicContact CG2-CE2 3.44Å; I215-Y220 VanDerWaalsContact CG2-CE2 3.44Å; I215-M281 HydrophobicContact CD1-CE 3.71Å; I215-M281 HydrophobicContact CD1-CG 3.52Å; I215-M281 HydrophobicContact CD1-SD 3.49Å; I215-M281 WeakPolarHBondContact CD1-SD 3.49Å; I215-M281 HydrophobicContact CG1-CE 4.17Å; I215-M281 HydrophobicContact CG1-CG 3.88Å; I215-M281 HydrophobicContact CG1-SD 4.33Å; I215-M281 HydrophobicContact CG2-CG 4.32Å
216P82.6Confident75.9Confident52 Ų5258.3 Ų58.334%0.33834%0.338SS..  trans-58.9134.2178.9-22.632000111.6S218 V219P216-S218 PolarHBondContact O-N 3.49Å; P216-V219 HydrophobicContact CB-CG2 4.13Å; P216-V219 HydrophobicContact CG-CG2 4.2Å; P216-V219 WeakPolarHBondContact O-CB 3.5Å; P216-V219 PolarHBondContact O-N 3.46Å
217P86.3Confident78.1Confident105 Ų10552.8 Ų52.868%0.68231%0.311SS*.Hα-helixtrans-53.7-31.1178.1-29.836.4000114V219 Y220 V221P217-V219 VanDerWaalsContact C-N 3.31Å; P217-V219 PolarHBondContact O-N 3.2Å; P217-Y220 PolarHBondContact O-N 2.7Å; P217-V221 WeakPolarHBondContact O-CG2 3.43Å; P217-V221 PolarHBondContact O-N 3.43Å; P217-V221 VanDerWaalsContact O-N 3.13Å
218S89.1Confident80.1Confident27 Ų2755.6 Ų55.619%0.18933%0.325CS..Hα-helixtrans-58.8-36.6174.547.40000113.3L82 P216 V221 V222L82-S218 WeakPolarHBondContact CD2-OG 3.5Å; P216-S218 PolarHBondContact O-N 3.49Å; S218-V221 PolarHBondContact O-N 2.92Å; S218-V222 WeakPolarHBondContact O-CG2 3.47Å; S218-V222 PolarHBondContact O-N 3Å
219V88.8Confident82Confident6 Ų656.6 Ų56.64%0.03633%0.327CS..Hα-helixtrans-65.8-40.9178.8-179.20000111.1L82 A86 I215 P216 P217 A223 F282 L285L82-V219 HydrophobicContact CD2-CG2 4.15Å; A86-V219 HydrophobicContact CB-CG2 3.85Å; I215-V219 HydrophobicContact CG2-CB 4.04Å; I215-V219 HydrophobicContact CG2-CG1 4.28Å; P216-V219 HydrophobicContact CB-CG2 4.13Å; P216-V219 HydrophobicContact CG-CG2 4.2Å; P216-V219 WeakPolarHBondContact O-CB 3.5Å; P216-V219 PolarHBondContact O-N 3.46Å; P217-V219 VanDerWaalsContact C-N 3.31Å; P217-V219 PolarHBondContact O-N 3.2Å; V219-A223 VanDerWaalsContact O-CB 3.3Å; V219-A223 WeakPolarHBondContact O-CB 3.5Å; V219-A223 PolarHBondContact O-N 3.4Å; V219-F282 HydrophobicContact CG1-CB 4.32Å; V219-F282 HydrophobicContact CG1-CD2 4.01Å; V219-L285 HydrophobicContact CG1-CD1 4.25Å
220Y88.7Confident83.9Confident54 Ų5451.3 Ų51.321%0.21229%0.293CS..Hα-helixtrans-64.4-45.7174-66.4-85.7000111.9L212 I215 P217 V222 A223 V224 L285L212-Y220 WeakPolarHBondContact CA-OH 3.46Å; L212-Y220 HydrophobicContact CD2-CE1 4.49Å; L212-Y220 WeakPolarHBondContact CD2-OH 3.19Å; L212-Y220 PolarHBondContact O-OH 2.87Å; L212-Y220 VanDerWaalsContact O-OH 3.1Å; I215-Y220 HydrophobicContact CB-CE2 3.64Å; I215-Y220 VanDerWaalsContact CD1-OH 3.31Å; I215-Y220 WeakPolarHBondContact CD1-OH 3.01Å; I215-Y220 HydrophobicContact CG2-CD2 3.96Å; I215-Y220 HydrophobicContact CG2-CE2 3.44Å; I215-Y220 VanDerWaalsContact CG2-CE2 3.44Å; P217-Y220 PolarHBondContact O-N 2.7Å; Y220-V222 VanDerWaalsContact C-N 3.33Å; Y220-V222 PolarHBondContact O-N 3Å; Y220-A223 PolarHBondContact O-N 3.16Å; Y220-A223 VanDerWaalsContact O-N 3.16Å; Y220-V224 WeakPolarHBondContact O-CG2 3.35Å; Y220-V224 PolarHBondContact O-N 2.85Å; Y220-L285 HydrophobicContact CD1-CD1 3.77Å; Y220-L285 HydrophobicContact CD1-CD2 3.93Å; Y220-L285 HydrophobicContact CE1-CD1 3.88Å; Y220-L285 HydrophobicContact CE1-CD2 3.74Å; Y220-L285 HydrophobicContact CE1-CG 4.5Å; Y220-L285 HydrophobicContact CG-CD1 4.33Å
221V92.6Very high85.9Confident62 Ų6244.8 Ų44.838%0.37626%0.262SS..Hα-helixtrans-62.1-42.4-179.9175.10000110.6F80 P217 S218 V224 L225F80-V221 HydrophobicContact CD1-CG1 4.15Å; F80-V221 HydrophobicContact CE1-CB 4.29Å; F80-V221 HydrophobicContact CE1-CG1 3.46Å; F80-V221 VanDerWaalsContact CE1-CG1 3.46Å; F80-V221 HydrophobicContact CE2-CG1 4.2Å; F80-V221 HydrophobicContact CZ-CG1 3.49Å; F80-V221 VanDerWaalsContact CZ-CG1 3.49Å; P217-V221 WeakPolarHBondContact O-CG2 3.43Å; P217-V221 PolarHBondContact O-N 3.43Å; P217-V221 VanDerWaalsContact O-N 3.13Å; S218-V221 PolarHBondContact O-N 2.92Å; V221-V224 PolarHBondContact O-N 3.42Å; V221-L225 HydrophobicContact CG1-CD1 3.62Å; V221-L225 HydrophobicContact CG1-CG 4.16Å; V221-L225 WeakPolarHBondContact O-CB 3.31Å; V221-L225 VanDerWaalsContact O-CG 3.28Å; V221-L225 WeakPolarHBondContact O-CG 3.28Å; V221-L225 PolarHBondContact O-N 2.78Å
222V94.7Very high87.8Confident0 Ų043.6 Ų43.60%027%0.265CS..Hα-helixtrans-66.4-37.3174.6174.30000111.8L76 F80 L82 V90 S218 Y220 V224 L225 M226 F282L76-V222 HydrophobicContact CB-CG1 3.92Å; L76-V222 HydrophobicContact CB-CG2 4.11Å; L76-V222 HydrophobicContact CD1-CG1 4.32Å; F80-V222 HydrophobicContact CB-CG2 3.87Å; F80-V222 HydrophobicContact CD2-CG2 3.56Å; F80-V222 HydrophobicContact CE2-CG2 4.39Å; F80-V222 HydrophobicContact CG-CG2 3.85Å; L82-V222 HydrophobicContact CD1-CG1 4.41Å; L82-V222 HydrophobicContact CD1-CG2 4.21Å; L82-V222 HydrophobicContact CD2-CG2 4.43Å; V90-V222 HydrophobicContact CG1-CG1 3.95Å; V90-V222 HydrophobicContact CG2-CG1 3.93Å; S218-V222 WeakPolarHBondContact O-CG2 3.47Å; S218-V222 PolarHBondContact O-N 3Å; Y220-V222 VanDerWaalsContact C-N 3.33Å; Y220-V222 PolarHBondContact O-N 3Å; V222-V224 VanDerWaalsContact C-N 3.3Å; V222-V224 PolarHBondContact O-N 3.22Å; V222-L225 PolarHBondContact O-N 2.91Å; V222-M226 WeakPolarHBondContact O-CB 3.45Å; V222-M226 PolarHBondContact O-N 3.44Å; V222-F282 HydrophobicContact CB-CE2 4.42Å; V222-F282 HydrophobicContact CG1-CE2 3.92Å; V222-F282 HydrophobicContact CG1-CZ 4.3Å
223A92.4Very high89.6Confident0 Ų041.8 Ų41.80%026%0.261CS..Hα-helixtrans-67.5-27.4178.700000113.7V219 Y220 P227 F282 L285 F289V219-A223 VanDerWaalsContact O-CB 3.3Å; V219-A223 WeakPolarHBondContact O-CB 3.5Å; V219-A223 PolarHBondContact O-N 3.4Å; Y220-A223 PolarHBondContact O-N 3.16Å; Y220-A223 VanDerWaalsContact O-N 3.16Å; A223-P227 WeakPolarHBondContact O-CD 3.44Å; A223-P227 WeakPolarHBondContact O-CG 3.38Å; A223-F282 HydrophobicContact CB-CD2 4.07Å; A223-F282 HydrophobicContact CB-CE2 3.66Å; A223-F282 HydrophobicContact CB-CZ 4.5Å; A223-L285 HydrophobicContact CB-CB 3.73Å; A223-F289 HydrophobicContact CB-CD2 3.77Å; A223-F289 HydrophobicContact CB-CE2 4.12Å; A223-F289 WeakPolarHBondContact O-CB 3.15Å
224V94.1Very high91.2Very high45 Ų4537.2 Ų37.227%0.27323%0.228SC..Hα-helixtrans-82.8-44.3170.9175.40000111.7Y220 V221 V222 P227 L228 F289Y220-V224 WeakPolarHBondContact O-CG2 3.35Å; Y220-V224 PolarHBondContact O-N 2.85Å; V221-V224 PolarHBondContact O-N 3.42Å; V222-V224 VanDerWaalsContact C-N 3.3Å; V222-V224 PolarHBondContact O-N 3.22Å; V224-P227 WeakPolarHBondContact O-CD 3.38Å; V224-L228 HydrophobicContact CG1-CD1 4.07Å; V224-L228 WeakPolarHBondContact O-CG 3.43Å; V224-F289 HydrophobicContact CG2-CB 4.48Å; V224-F289 HydrophobicContact CG2-CD1 3.59Å; V224-F289 HydrophobicContact CG2-CD2 3.72Å; V224-F289 HydrophobicContact CG2-CE1 3.58Å; V224-F289 HydrophobicContact CG2-CE2 3.71Å; V224-F289 HydrophobicContact CG2-CG 3.67Å; V224-F289 HydrophobicContact CG2-CZ 3.64Å
225L96.4Very high92.5Very high59 Ų5936.8 Ų36.831%0.30922%0.216SC..Hα-helixtrans-72.9-32-174.7-71.3179000112.9L76 F80 V221 V222 L228 C229L76-L225 HydrophobicContact CD1-CB 4.29Å; L76-L225 HydrophobicContact CD2-CB 4.14Å; L76-L225 HydrophobicContact CD2-CD1 4.27Å; F80-L225 HydrophobicContact CE2-CD1 3.67Å; F80-L225 HydrophobicContact CZ-CD1 3.6Å; V221-L225 HydrophobicContact CG1-CD1 3.62Å; V221-L225 HydrophobicContact CG1-CG 4.16Å; V221-L225 WeakPolarHBondContact O-CB 3.31Å; V221-L225 VanDerWaalsContact O-CG 3.28Å; V221-L225 WeakPolarHBondContact O-CG 3.28Å; V221-L225 PolarHBondContact O-N 2.78Å; V222-L225 PolarHBondContact O-N 2.91Å; L225-L228 PolarHBondContact O-N 2.99Å; L225-C229 VanDerWaalsContact O-CB 3.27Å; L225-C229 WeakPolarHBondContact O-CB 3.49Å; L225-C229 PolarHBondContact O-N 3.2Å; L225-C229 PolarHBondContact O-SG 3.25Å
226M96.1Very high93.5Very high0 Ų037.3 Ų37.30%023%0.226CC..Hα-helixtrans-68-45.9-173-174.4-178.7152.900113.9M69 V72 A73 L76 V90 V222 G230 F282 Y286M69-M226 WeakPolarHBondContact CE-O 3.36Å; M69-M226 HydrophobicContact SD-CE 4.09Å; V72-M226 HydrophobicContact CG1-CG 4.15Å; A73-M226 HydrophobicContact CB-CE 3.92Å; A73-M226 HydrophobicContact CB-SD 4.04Å; L76-M226 HydrophobicContact CD1-CB 3.6Å; L76-M226 HydrophobicContact CD1-CG 4.14Å; V90-M226 HydrophobicContact CG1-SD 4.08Å; V222-M226 WeakPolarHBondContact O-CB 3.45Å; V222-M226 PolarHBondContact O-N 3.44Å; M226-G230 PolarHBondContact O-N 2.87Å; M226-F282 HydrophobicContact SD-CE1 4.2Å; M226-F282 HydrophobicContact SD-CZ 3.8Å; M226-Y286 HydrophobicContact CB-CD2 4.45Å; M226-Y286 HydrophobicContact CB-CE2 3.82Å; M226-Y286 HydrophobicContact CE-CE2 3.79Å; M226-Y286 HydrophobicContact CG-CE2 3.68Å; M226-Y286 HydrophobicContact SD-CD2 4.26Å; M226-Y286 HydrophobicContact SD-CE2 3.72Å
227P95.4Very high94.1Very high0 Ų035.9 Ų35.90%022%0.215CC..Hα-helixtrans-65.2-43.2172-6.518.2000111.9A223 V224 C229 G230 Y231 Y286 Q290 E293A223-P227 WeakPolarHBondContact O-CD 3.44Å; A223-P227 WeakPolarHBondContact O-CG 3.38Å; V224-P227 WeakPolarHBondContact O-CD 3.38Å; P227-C229 PolarHBondContact O-N 3.35Å; P227-G230 CarbonylContact O-C 3.53Å; P227-G230 VanDerWaalsContact O-CA 3.28Å; P227-G230 WeakPolarHBondContact O-CA 3.37Å; P227-G230 PolarHBondContact O-N 3.28Å; P227-Y231 HydrophobicContact CB-CE2 3.83Å; P227-Y231 WeakPolarHBondContact O-CD2 3.35Å; P227-Y231 PolarHBondContact O-N 2.91Å; P227-Y286 HydrophobicContact CB-CE2 4.38Å; P227-Y286 HydrophobicContact CG-CD2 3.97Å; P227-Y286 HydrophobicContact CG-CE1 4.33Å; P227-Y286 HydrophobicContact CG-CE2 3.57Å; P227-Q290 HydrophobicContact CB-CB 3.92Å; P227-Q290 HydrophobicContact CG-CB 4.06Å; P227-E293 WeakPolarHBondContact CB-OE2 3.44Å
228L96Very high94.5Very high76 Ų7630.9 Ų30.940%0.39818%0.182SC..Hα-helixtrans-54.2-49.5174.2-71.1-180000113.2V224 L225 G230 Y231 A232 E293V224-L228 HydrophobicContact CG1-CD1 4.07Å; V224-L228 WeakPolarHBondContact O-CG 3.43Å; L225-L228 PolarHBondContact O-N 2.99Å; L228-G230 PolarHBondContact O-N 3.43Å; L228-Y231 PolarHBondContact O-N 2.82Å; L228-A232 WeakPolarHBondContact O-CB 3.31Å; L228-A232 PolarHBondContact O-N 3.49Å; L228-E293 HydrophobicContact CD2-CB 4.4Å; L228-E293 HydrophobicContact CD2-CG 3.94Å; L228-E293 VanDerWaalsContact CD2-OE2 3.32Å; L228-E293 WeakPolarHBondContact CD2-OE2 3.36Å; L228-E293 HydrophobicContact CG-CG 4.4Å; L228-E293 VanDerWaalsContact CG-OE2 3.28Å; L228-E293 WeakPolarHBondContact CG-OE2 3.26Å; L228-E293 PolarHBondContact N-OE2 3.48Å
229C97.1Very high94.8Very high48 Ų4832.5 Ų32.532%0.32419%0.191SC..Hα-helixtrans-60.2-36.2175-75.90000111.2V72 L225 P227 A233V72-C229 HydrophobicContact CG1-CB 3.61Å; V72-C229 HydrophobicContact CG2-CB 4.34Å; L225-C229 VanDerWaalsContact O-CB 3.27Å; L225-C229 WeakPolarHBondContact O-CB 3.49Å; L225-C229 PolarHBondContact O-N 3.2Å; L225-C229 PolarHBondContact O-SG 3.25Å; P227-C229 PolarHBondContact O-N 3.35Å; C229-A233 WeakPolarHBondContact O-CB 3.47Å; C229-A233 PolarHBondContact O-N 2.92Å
230G96.4Very high95.1Very high0 Ų039.1 Ų39.10%023%0.226CC..Hα-helixtrans-61-53.8171.700000114.1M226 P227 L228 A232 A233 G234 T255M226-G230 PolarHBondContact O-N 2.87Å; P227-G230 CarbonylContact O-C 3.53Å; P227-G230 VanDerWaalsContact O-CA 3.28Å; P227-G230 WeakPolarHBondContact O-CA 3.37Å; P227-G230 PolarHBondContact O-N 3.28Å; L228-G230 PolarHBondContact O-N 3.43Å; G230-A232 VanDerWaalsContact C-N 3.32Å; G230-A232 PolarHBondContact O-N 2.9Å; G230-A233 PolarHBondContact O-N 3.32Å; G230-G234 PolarHBondContact O-N 2.97Å; G230-T255 WeakPolarHBondContact O-CB 3.29Å; G230-T255 WeakPolarHBondContact O-CG2 3.4Å
231Y95.8Very high95.3Very high23 Ų2340.6 Ų40.69%0.0923%0.233CC..Hα-helixtrans-57.9-46177.6-59.4-46.8000110.9P227 L228 Y235 S252 L253 G256 C257 Q290 E293P227-Y231 HydrophobicContact CB-CE2 3.83Å; P227-Y231 WeakPolarHBondContact O-CD2 3.35Å; P227-Y231 PolarHBondContact O-N 2.91Å; L228-Y231 PolarHBondContact O-N 2.82Å; Y231-Y235 VanDerWaalsContact O-CB 3.31Å; Y231-Y235 WeakPolarHBondContact O-CB 3.42Å; Y231-Y235 PolarHBondContact O-N 3.08Å; Y231-S252 WeakPolarHBondContact CA-OG 3.33Å; Y231-S252 WeakPolarHBondContact CD1-O 3.02Å; Y231-S252 PolarHBondContact O-OG 2.97Å; Y231-L253 HydrophobicContact CD1-CD2 4.24Å; Y231-L253 HydrophobicContact CE1-CD2 4.05Å; Y231-G256 VanDerWaalsContact CE1-CA 3.47Å; Y231-C257 PolarHBondContact OH-SG 3.12Å; Y231-Q290 PolarHBondContact OH-O 3.38Å; Y231-Q290 VanDerWaalsContact OH-O 3.07Å; Y231-E293 HydrophobicContact CE2-CB 3.93Å
232A96.6Very high95.3Very high67 Ų6743.8 Ų43.855%0.55425%0.248SC*.Hα-helixtrans-64.7-48.3178.700000112.8L228 G230 Y235 G236L228-A232 WeakPolarHBondContact O-CB 3.31Å; L228-A232 PolarHBondContact O-N 3.49Å; G230-A232 VanDerWaalsContact C-N 3.32Å; G230-A232 PolarHBondContact O-N 2.9Å; A232-Y235 PolarHBondContact O-N 3.1Å; A232-G236 PolarHBondContact O-N 3.29Å
233A96.7Very high95.2Very high34 Ų3444.6 Ų44.628%0.28125%0.253SS..Hα-helixtrans-69.2-39.6-179.100000112.3I68 C229 G230 G236 L237I68-A233 HydrophobicContact CG2-CB 3.58Å; C229-A233 WeakPolarHBondContact O-CB 3.47Å; C229-A233 PolarHBondContact O-N 2.92Å; G230-A233 PolarHBondContact O-N 3.32Å; A233-G236 PolarHBondContact O-N 3.44Å; A233-L237 WeakPolarHBondContact O-CB 3.31Å; A233-L237 PolarHBondContact O-N 3.35Å
234G95.9Very high95.2Very high0 Ų047.9 Ų47.90%027%0.274CS..Hα-helixtrans-63.6-42.3173.900000112.5G230 L237 A238 V251 T255G230-G234 PolarHBondContact O-N 2.97Å; G234-L237 PolarHBondContact O-N 3.01Å; G234-A238 WeakPolarHBondContact O-CB 3.41Å; G234-A238 PolarHBondContact O-N 3.31Å; G234-V251 WeakPolarHBondContact O-CG1 3.43Å; G234-T255 WeakPolarHBondContact CA-OG1 3.2Å
235Y95.8Very high95Very high96 Ų9649.4 Ų49.438%0.37629%0.285SS..Hα-helixtrans-63.5-45.3173.4-167.1-88.7000111.4Y231 A232 L237 A238 V239 R248Y231-Y235 VanDerWaalsContact O-CB 3.31Å; Y231-Y235 WeakPolarHBondContact O-CB 3.42Å; Y231-Y235 PolarHBondContact O-N 3.08Å; A232-Y235 PolarHBondContact O-N 3.1Å; Y235-L237 PolarHBondContact O-N 3.27Å; Y235-A238 PolarHBondContact O-N 2.94Å; Y235-V239 HydrophobicContact CD1-CG2 3.94Å; Y235-V239 HydrophobicContact CE1-CG2 3.67Å; Y235-V239 WeakPolarHBondContact O-CG2 3.05Å; Y235-V239 PolarHBondContact O-N 2.89Å; Y235-R248 HydrophobicContact CD2-CB 4.03Å; Y235-R248 HydrophobicContact CE2-CB 3.68Å
236G96.3Very high94.8Very high29 Ų2949.5 Ų49.530%0.29929%0.285SS..Hα-helixtrans-59-45.5176.600000112.6A232 A233 A238 V239 L240A232-G236 PolarHBondContact O-N 3.29Å; A233-G236 PolarHBondContact O-N 3.44Å; G236-A238 PolarHBondContact O-N 3.33Å; G236-V239 WeakPolarHBondContact O-CB 3.45Å; G236-V239 PolarHBondContact O-N 3.45Å; G236-L240 WeakPolarHBondContact O-CG 3.39Å; G236-L240 PolarHBondContact O-N 2.88Å
237L95.5Very high94.6Very high22 Ų2249.6 Ų49.612%0.11529%0.286CS..Hα-helixtrans-61-44.6175.2-167.373.1000111.2L60 V63 C64 I68 A233 G234 Y235 V239 L240 F241L60-L237 HydrophobicContact CD2-CD2 3.77Å; L60-L237 HydrophobicContact CD2-CG 4.15Å; V63-L237 HydrophobicContact CB-CD2 4.09Å; V63-L237 HydrophobicContact CG1-CD1 4.17Å; V63-L237 HydrophobicContact CG1-CD2 3.7Å; C64-L237 VanDerWaalsContact SG-CD2 3.5Å; I68-L237 HydrophobicContact CD1-CB 4.44Å; I68-L237 HydrophobicContact CD1-CD1 4.5Å; I68-L237 HydrophobicContact CD1-CD2 4.06Å; A233-L237 WeakPolarHBondContact O-CB 3.31Å; A233-L237 PolarHBondContact O-N 3.35Å; G234-L237 PolarHBondContact O-N 3.01Å; Y235-L237 PolarHBondContact O-N 3.27Å; L237-V239 VanDerWaalsContact C-N 3.25Å; L237-V239 PolarHBondContact O-N 3.39Å; L237-L240 WeakPolarHBondContact O-CB 3.48Å; L237-L240 PolarHBondContact O-N 2.79Å; L237-F241 HydrophobicContact CD1-CD2 4.18Å; L237-F241 HydrophobicContact CD1-CE2 3.86Å; L237-F241 HydrophobicContact CG-CD2 4.02Å; L237-F241 HydrophobicContact CG-CE2 4.04Å; L237-F241 WeakPolarHBondContact O-CD2 3.22Å; L237-F241 PolarHBondContact O-N 3.08Å
238A94.4Very high94.6Very high0 Ų051.8 Ų51.80%030%0.295CS..Hα-helixtrans-64.6-26.9177.500000114G234 Y235 G236 L243 R248 V251G234-A238 WeakPolarHBondContact O-CB 3.41Å; G234-A238 PolarHBondContact O-N 3.31Å; Y235-A238 PolarHBondContact O-N 2.94Å; G236-A238 PolarHBondContact O-N 3.33Å; A238-L243 HydrophobicContact CB-CD1 3.88Å; A238-L243 HydrophobicContact CB-CG 4.49Å; A238-L243 PolarHBondContact O-N 2.86Å; A238-R248 HydrophobicContact CB-CB 4.03Å; A238-R248 HydrophobicContact CB-CG 3.81Å; A238-V251 HydrophobicContact CB-CB 3.85Å; A238-V251 HydrophobicContact CB-CG1 3.99Å; A238-V251 HydrophobicContact CB-CG2 4.15Å
239V94.9Very high94.5Very high61 Ų6150.3 Ų50.337%0.3728%0.284SS..Hα-helixtrans-72.3-41.8169.31730000111Y235 G236 L237 F241 D242Y235-V239 HydrophobicContact CD1-CG2 3.94Å; Y235-V239 HydrophobicContact CE1-CG2 3.67Å; Y235-V239 WeakPolarHBondContact O-CG2 3.05Å; Y235-V239 PolarHBondContact O-N 2.89Å; G236-V239 WeakPolarHBondContact O-CB 3.45Å; G236-V239 PolarHBondContact O-N 3.45Å; L237-V239 VanDerWaalsContact C-N 3.25Å; L237-V239 PolarHBondContact O-N 3.39Å; V239-F241 VanDerWaalsContact C-N 3.28Å; V239-F241 PolarHBondContact O-N 3.25Å; V239-D242 WeakPolarHBondContact O-CA 3.42Å; V239-D242 PolarHBondContact O-N 3.37Å
240L94.8Very high94.3Very high145 Ų14548 Ų4876%0.75927%0.268SS*.Hα-helixtrans-64.5-30.7177.4-68.1172.6000113.1G236 L237 D242G236-L240 WeakPolarHBondContact O-CG 3.39Å; G236-L240 PolarHBondContact O-N 2.88Å; L237-L240 WeakPolarHBondContact O-CB 3.48Å; L237-L240 PolarHBondContact O-N 2.79Å; L240-D242 VanDerWaalsContact C-N 3.27Å
241F92.5Very high94.3Very high86 Ų8648 Ų4838%0.37727%0.268SS..THydrogen-bonded Turntrans-85.36.7172.6-82.5-98.1000113.7L59 L60 L237 V239 L243L59-F241 HydrophobicContact CD2-CE1 3.79Å; L59-F241 HydrophobicContact CD2-CZ 3.93Å; L59-F241 HydrophobicContact CG-CZ 4.46Å; L60-F241 HydrophobicContact CD2-CD2 4.08Å; L60-F241 HydrophobicContact CD2-CE2 4.37Å; L60-F241 HydrophobicContact CD2-CG 4.23Å; L237-F241 HydrophobicContact CD1-CD2 4.18Å; L237-F241 HydrophobicContact CD1-CE2 3.86Å; L237-F241 HydrophobicContact CG-CD2 4.02Å; L237-F241 HydrophobicContact CG-CE2 4.04Å; L237-F241 WeakPolarHBondContact O-CD2 3.22Å; L237-F241 PolarHBondContact O-N 3.08Å; V239-F241 VanDerWaalsContact C-N 3.28Å; V239-F241 PolarHBondContact O-N 3.25Å; F241-L243 HydrophobicContact CB-CD2 4.13Å; F241-L243 HydrophobicContact CB-CG 3.98Å; F241-L243 PolarHBondContact O-N 2.84Å; F241-L243 VanDerWaalsContact O-N 3.13Å
242D93Very high94.2Very high128 Ų12847.1 Ų47.168%0.68427%0.265SS*.THydrogen-bonded Turntrans45.438.1-176.7-158.828.4000115.3V239 L240 R248V239-D242 WeakPolarHBondContact O-CA 3.42Å; V239-D242 PolarHBondContact O-N 3.37Å; L240-D242 VanDerWaalsContact C-N 3.27Å; D242-R248 IonicContact OD1-NH2 2.86Å; D242-R248 PolarHBondContact OD1-NH2 3.23Å
243L92.6Very high94.1Very high18 Ų1844 Ų449%0.09424%0.239CC..  trans-67.9155.2178.3-54.4-178.6000110.7I56 L60 A238 F241 R248 V251I56-L243 HydrophobicContact CG2-CD2 4.1Å; L60-L243 HydrophobicContact CD1-CD1 3.61Å; A238-L243 HydrophobicContact CB-CD1 3.88Å; A238-L243 HydrophobicContact CB-CG 4.49Å; A238-L243 PolarHBondContact O-N 2.86Å; F241-L243 HydrophobicContact CB-CD2 4.13Å; F241-L243 HydrophobicContact CB-CG 3.98Å; F241-L243 PolarHBondContact O-N 2.84Å; F241-L243 VanDerWaalsContact O-N 3.13Å; L243-R248 HydrophobicContact CB-CG 4.32Å; L243-R248 PolarHBondContact O-NE 3.47Å; L243-R248 PolarHBondContact O-NH2 3.46Å; L243-V251 HydrophobicContact CD1-CG2 3.84Å
244P92.5Very high94Very high68 Ų6842.4 Ų42.444%0.44223%0.226SC..  trans-69.3160.6176.926.8-31.8000112.3N246 S247 R248P244-N246 VanDerWaalsContact C-N 3.27Å; P244-N246 WeakPolarHBondContact CB-OD1 3.39Å; P244-N246 WeakPolarHBondContact CG-OD1 3.28Å; P244-N246 PolarHBondContact O-N 3.37Å; P244-N246 VanDerWaalsContact O-N 3.13Å; P244-S247 WeakPolarHBondContact CG-OG 3.49Å; P244-S247 WeakPolarHBondContact O-CB 3.05Å; P244-S247 PolarHBondContact O-N 2.88Å; P244-R248 PolarHBondContact O-N 2.84Å
245P91.4Very high93.9Very high78 Ų7842.4 Ų42.451%0.50623%0.226SC..Hα-helixtrans-60.9-27.6-168.7-26.935.9000115.9R249P245-R249 WeakPolarHBondContact O-CG 3.18Å; P245-R249 PolarHBondContact O-N 2.86Å
246N91.5Very high93.8Very high60 Ų6037.8 Ų37.832%0.32121%0.208SC..Hα-helixtrans-67.1-47.7171.656.4-29000111.5G111 E112 P244 R249 S250G111-N246 WeakPolarHBondContact CA-O 3.44Å; E112-N246 PolarHBondContact N-O 2.72Å; P244-N246 VanDerWaalsContact C-N 3.27Å; P244-N246 WeakPolarHBondContact CB-OD1 3.39Å; P244-N246 WeakPolarHBondContact CG-OD1 3.28Å; P244-N246 PolarHBondContact O-N 3.37Å; P244-N246 VanDerWaalsContact O-N 3.13Å; N246-R249 PolarHBondContact O-N 2.9Å; N246-S250 PolarHBondContact O-N 3.26Å; N246-S250 PolarHBondContact O-OG 2.84Å
247S91.8Very high93.6Very high3 Ų336.4 Ų36.42%0.02119%0.194CC..Hα-helixtrans-64.5-38.7176.3-47.90000111.7E112 P244 R249 S250 V251E112-S247 WeakPolarHBondContact OE2-CB 3.35Å; E112-S247 PolarHBondContact OE2-OG 3.32Å; P244-S247 WeakPolarHBondContact CG-OG 3.49Å; P244-S247 WeakPolarHBondContact O-CB 3.05Å; P244-S247 PolarHBondContact O-N 2.88Å; S247-R249 VanDerWaalsContact C-N 3.29Å; S247-R249 PolarHBondContact O-N 3.37Å; S247-S250 PolarHBondContact O-N 3.19Å; S247-S250 VanDerWaalsContact O-N 3.12Å; S247-V251 WeakPolarHBondContact O-CG2 3.32Å; S247-V251 PolarHBondContact O-N 2.87Å
248R94.9Very high93.5Very high46 Ų4635.4 Ų35.417%0.17419%0.188CC..Hα-helixtrans-57-40.3173.9-65179.3-169.7179.68.6112.7Y235 A238 D242 L243 P244 S252Y235-R248 HydrophobicContact CD2-CB 4.03Å; Y235-R248 HydrophobicContact CE2-CB 3.68Å; A238-R248 HydrophobicContact CB-CB 4.03Å; A238-R248 HydrophobicContact CB-CG 3.81Å; D242-R248 IonicContact OD1-NH2 2.86Å; D242-R248 PolarHBondContact OD1-NH2 3.23Å; L243-R248 HydrophobicContact CB-CG 4.32Å; L243-R248 PolarHBondContact O-NE 3.47Å; L243-R248 PolarHBondContact O-NH2 3.46Å; P244-R248 PolarHBondContact O-N 2.84Å; R248-S252 VanDerWaalsContact O-CB 3.29Å; R248-S252 WeakPolarHBondContact O-CB 3.48Å; R248-S252 PolarHBondContact O-N 3.03Å; R248-S252 VanDerWaalsContact O-N 3.1Å
249R94.1Very high93.2Very high44 Ų4435.6 Ų35.617%0.16619%0.189CC..Hα-helixtrans-66-43174.7-69.6-171.4-62.4-993.3111.9V109 H110 P245 N246 S247 S252 L253V109-R249 HydrophobicContact CG2-CB 3.86Å; V109-R249 HydrophobicContact CG2-CG 4.47Å; V109-R249 PolarHBondContact O-NE 3.4Å; V109-R249 PolarHBondContact O-NH2 3.48Å; H110-R249 PolarHBondContact O-NH2 2.83Å; P245-R249 WeakPolarHBondContact O-CG 3.18Å; P245-R249 PolarHBondContact O-N 2.86Å; N246-R249 PolarHBondContact O-N 2.9Å; S247-R249 VanDerWaalsContact C-N 3.29Å; S247-R249 PolarHBondContact O-N 3.37Å; R249-S252 WeakPolarHBondContact O-CB 3.25Å; R249-S252 PolarHBondContact O-N 2.95Å; R249-L253 WeakPolarHBondContact O-CG 3.35Å; R249-L253 PolarHBondContact O-N 3.37Å
250S93.3Very high92.8Very high0 Ų033 Ų330%017%0.173CC..Hα-helixtrans-62-51.4176.5-59.20000112.2E112 N246 S247 S252 L253 E254E112-S250 VanDerWaalsContact C-OG 3.31Å; E112-S250 PolarHBondContact N-OG 3.48Å; E112-S250 WeakPolarHBondContact O-CB 3.35Å; E112-S250 PolarHBondContact O-OG 3.41Å; N246-S250 PolarHBondContact O-N 3.26Å; N246-S250 PolarHBondContact O-OG 2.84Å; S247-S250 PolarHBondContact O-N 3.19Å; S247-S250 VanDerWaalsContact O-N 3.12Å; S250-S252 VanDerWaalsContact C-N 3.29Å; S250-S252 PolarHBondContact O-N 3.38Å; S250-L253 PolarHBondContact O-N 3.19Å; S250-E254 WeakPolarHBondContact O-CB 3.24Å; S250-E254 PolarHBondContact O-N 3.4Å
251V95.2Very high92Very high0 Ų027.8 Ų27.80%015%0.145CC..Hα-helixtrans-60.6-40.2-179.8177.90000111.2L60 L115 M119 G234 A238 L243 S247 T255L60-V251 HydrophobicContact CD1-CG2 3.97Å; L60-V251 HydrophobicContact CD2-CG1 4.45Å; L115-V251 HydrophobicContact CD2-CG2 3.83Å; M119-V251 HydrophobicContact CE-CG1 4.12Å; M119-V251 HydrophobicContact CE-CG2 4.47Å; M119-V251 HydrophobicContact SD-CB 4.42Å; M119-V251 HydrophobicContact SD-CG2 3.84Å; G234-V251 WeakPolarHBondContact O-CG1 3.43Å; A238-V251 HydrophobicContact CB-CB 3.85Å; A238-V251 HydrophobicContact CB-CG1 3.99Å; A238-V251 HydrophobicContact CB-CG2 4.15Å; L243-V251 HydrophobicContact CD1-CG2 3.84Å; S247-V251 WeakPolarHBondContact O-CG2 3.32Å; S247-V251 PolarHBondContact O-N 2.87Å; V251-T255 WeakPolarHBondContact O-CB 3.49Å; V251-T255 PolarHBondContact O-N 2.97Å; V251-T255 PolarHBondContact O-OG1 3.5Å
252S95.6Very high91.4Very high4 Ų424 Ų243%0.02813%0.129CC..Hα-helixtrans-55.9-59.4173.1-178.50000111.2Y231 R248 R249 S250 E254 T255 G256Y231-S252 WeakPolarHBondContact CA-OG 3.33Å; Y231-S252 WeakPolarHBondContact CD1-O 3.02Å; Y231-S252 PolarHBondContact O-OG 2.97Å; R248-S252 VanDerWaalsContact O-CB 3.29Å; R248-S252 WeakPolarHBondContact O-CB 3.48Å; R248-S252 PolarHBondContact O-N 3.03Å; R248-S252 VanDerWaalsContact O-N 3.1Å; R249-S252 WeakPolarHBondContact O-CB 3.25Å; R249-S252 PolarHBondContact O-N 2.95Å; S250-S252 VanDerWaalsContact C-N 3.29Å; S250-S252 PolarHBondContact O-N 3.38Å; S252-E254 VanDerWaalsContact C-N 3.34Å; S252-E254 PolarHBondContact O-N 3.44Å; S252-T255 PolarHBondContact O-N 3.29Å; S252-T255 VanDerWaalsContact O-N 3.14Å; S252-G256 PolarHBondContact O-N 3.35Å
253L93.8Very high91.1Very high2 Ų217.9 Ų17.91%0.0110%0.096CC..Hα-helixtrans-63.4-38-176.9-70.5170.6000112.7M105 V109 Y231 R249 S250 T255 C257 A294 F297M105-L253 HydrophobicContact CB-CD1 3.92Å; M105-L253 HydrophobicContact CB-CD2 4.22Å; V109-L253 HydrophobicContact CG1-CD1 4.3Å; V109-L253 HydrophobicContact CG2-CD1 3.61Å; Y231-L253 HydrophobicContact CD1-CD2 4.24Å; Y231-L253 HydrophobicContact CE1-CD2 4.05Å; R249-L253 WeakPolarHBondContact O-CG 3.35Å; R249-L253 PolarHBondContact O-N 3.37Å; S250-L253 PolarHBondContact O-N 3.19Å; L253-T255 VanDerWaalsContact C-N 3.34Å; L253-C257 WeakPolarHBondContact O-CB 3.39Å; L253-C257 PolarHBondContact O-N 3.5Å; L253-C257 PolarHBondContact O-SG 2.88Å; L253-C257 VanDerWaalsContact O-SG 3.38Å; L253-A294 HydrophobicContact CD2-CB 4.33Å; L253-F297 HydrophobicContact CD2-CD1 4.1Å
254E93.7Very high90.5Very high0 Ų018.5 Ų18.50%010%0.101CC..Hα-helixtrans-61.2-41.5174.2-169.868.2-155.200111.9Q65 S102 S116 M119 T120 S250 S252Q65-E254 PolarHBondContact NE2-O 2.98Å; S102-E254 WeakPolarHBondContact CB-OE2 3.22Å; S102-E254 PolarHBondContact OG-OE2 3.36Å; S116-E254 PolarHBondContact OG-OE2 3.17Å; M119-E254 HydrophobicContact CB-CG 3.67Å; M119-E254 HydrophobicContact CE-CB 4.09Å; M119-E254 HydrophobicContact CE-CG 3.76Å; M119-E254 HydrophobicContact SD-CB 4.43Å; M119-E254 HydrophobicContact SD-CG 4.17Å; T120-E254 WeakPolarHBondContact CA-OE1 3.31Å; T120-E254 WeakPolarHBondContact CB-OE1 3.43Å; T120-E254 PolarHBondContact N-OE1 3.39Å; T120-E254 VanDerWaalsContact N-OE1 3.16Å; T120-E254 VanDerWaalsContact OG1-CD 3.3Å; T120-E254 PolarHBondContact OG1-OE1 3.48Å; T120-E254 PolarHBondContact OG1-OE2 3.37Å; S250-E254 WeakPolarHBondContact O-CB 3.24Å; S250-E254 PolarHBondContact O-N 3.4Å; S252-E254 VanDerWaalsContact C-N 3.34Å; S252-E254 PolarHBondContact O-N 3.44Å
255T95.2Very high89.7Confident0 Ų015.3 Ų15.30%08%0.08CC..Hα-helixtrans-68.9-44-178.3-53.60000112C64 M69 G230 G234 V251 S252 L253C64-T255 HydrophobicContact CB-CG2 3.86Å; C64-T255 WeakPolarHBondContact CB-OG1 3.45Å; C64-T255 PolarHBondContact SG-OG1 2.91Å; M69-T255 HydrophobicContact CE-CG2 4.48Å; M69-T255 WeakPolarHBondContact CE-O 3.29Å; M69-T255 HydrophobicContact CG-CG2 4.17Å; M69-T255 WeakPolarHBondContact CG-O 3.25Å; G230-T255 WeakPolarHBondContact O-CB 3.29Å; G230-T255 WeakPolarHBondContact O-CG2 3.4Å; G234-T255 WeakPolarHBondContact CA-OG1 3.2Å; V251-T255 WeakPolarHBondContact O-CB 3.49Å; V251-T255 PolarHBondContact O-N 2.97Å; V251-T255 PolarHBondContact O-OG1 3.5Å; S252-T255 PolarHBondContact O-N 3.29Å; S252-T255 VanDerWaalsContact O-N 3.14Å; L253-T255 VanDerWaalsContact C-N 3.34Å
256G93.3Very high89.2Confident0 Ų011.6 Ų11.60%06%0.056CC..Hα-helixtrans-81.7-23.5-178.600000115.1Y231 S252 Q258 Y286Y231-G256 VanDerWaalsContact CE1-CA 3.47Å; S252-G256 PolarHBondContact O-N 3.35Å; G256-Q258 PolarHBondContact O-N 2.93Å; G256-Y286 PolarHBondContact O-OH 3.25Å
257C92.1Very high88.6Confident0 Ų08.8 Ų8.80%04%0.041CC..  trans-89.893.9179.3-72.80000112G99 Y231 L253G99-C257 PolarHBondContact N-O 3.25Å; Y231-C257 PolarHBondContact OH-SG 3.12Å; L253-C257 WeakPolarHBondContact O-CB 3.39Å; L253-C257 PolarHBondContact O-N 3.5Å; L253-C257 PolarHBondContact O-SG 2.88Å; L253-C257 VanDerWaalsContact O-SG 3.38Å
258Q92.6Very high87.8Confident1 Ų111.6 Ų11.61%0.0055%0.053CC..BIsolated β-bridgetrans-81.1155.7178.7-68.9-64.3-8.400114Q65 M69 C96 P97 G256 V260 Y286Q65-Q258 VanDerWaalsContact OE1-NE2 3.08Å; M69-Q258 HydrophobicContact SD-CG 4.11Å; M69-Q258 PolarHBondContact SD-NE2 2.77Å; C96-Q258 VanDerWaalsContact C-OE1 3.3Å; C96-Q258 PolarHBondContact O-OE1 3.41Å; P97-Q258 PolarHBondContact O-OE1 2.88Å; G256-Q258 PolarHBondContact O-N 2.93Å; Q258-V260 PolarHBondContact O-N 2.94Å; Q258-Y286 HydrophobicContact CB-CE1 3.7Å; Q258-Y286 HydrophobicContact CG-CE1 4.03Å; Q258-Y286 WeakPolarHBondContact CG-OH 3.35Å
259N88.9Confident86.7Confident3 Ų314.1 Ų14.12%0.0167%0.069CC..  trans-74.875.6172.4-166.8-26.3000111.6P97 Q261 L262 C263P97-N259 HydrophobicContact CG-CB 4.35Å; P97-N259 WeakPolarHBondContact O-CB 3.44Å; P97-N259 PolarHBondContact O-N 3.42Å; N259-Q261 PolarHBondContact O-N 2.88Å; N259-Q261 PolarHBondContact OD1-N 3.29Å; N259-Q261 PolarHBondContact OD1-OE1 2.87Å; N259-L262 HydrophobicContact CB-CB 4.17Å; N259-L262 PolarHBondContact O-N 3.44Å; N259-L262 VanDerWaalsContact O-N 3.14Å; N259-L262 WeakPolarHBondContact OD1-CB 3.4Å; N259-L262 PolarHBondContact OD1-N 3.26Å; N259-C263 PolarHBondContact O-N 3.42Å; N259-C263 VanDerWaalsContact O-N 3.08Å
260V85.5Confident85.7Confident6 Ų612.7 Ų12.74%0.0367%0.067CC..Hα-helixtrans-57.8-30.1177175.30000112.2Q258 C263 T264 P283 Y286 A287Q258-V260 PolarHBondContact O-N 2.94Å; V260-C263 PolarHBondContact O-N 2.9Å; V260-T264 VanDerWaalsContact O-CB 3.28Å; V260-T264 WeakPolarHBondContact O-CB 3.47Å; V260-T264 PolarHBondContact O-N 2.89Å; V260-T264 PolarHBondContact O-OG1 3.4Å; V260-P283 HydrophobicContact CG1-CB 3.85Å; V260-P283 VanDerWaalsContact CG1-O 3.31Å; V260-P283 WeakPolarHBondContact CG1-O 3.39Å; V260-Y286 HydrophobicContact CG2-CD1 3.72Å; V260-Y286 HydrophobicContact CG2-CE1 4.44Å; V260-A287 HydrophobicContact CB-CB 4.36Å; V260-A287 HydrophobicContact CG1-CB 3.99Å; V260-A287 HydrophobicContact CG2-CB 4.15Å
261Q77.9Confident84.8Confident37 Ų3713.3 Ų13.317%0.1737%0.069CC..Hα-helixtrans-65.3-43.6178.7-61.171.254.700110.5M36 L192 N259 T264 A265M36-Q261 HydrophobicContact CE-CB 3.75Å; L192-Q261 HydrophobicContact CD1-CG 4.03Å; N259-Q261 PolarHBondContact O-N 2.88Å; N259-Q261 PolarHBondContact OD1-N 3.29Å; N259-Q261 PolarHBondContact OD1-OE1 2.87Å; Q261-T264 PolarHBondContact O-N 3.01Å; Q261-A265 WeakPolarHBondContact O-CB 3.42Å; Q261-A265 PolarHBondContact O-N 3.26Å
262L80.8Confident83.5Confident6 Ų615.7 Ų15.73%0.0319%0.085CC..Hα-helixtrans-67.7-42.3175.6-176.457.8000111.8M36 P97 L160 T163 N259 T264 A265 I266M36-L262 HydrophobicContact CE-CB 3.92Å; P97-L262 HydrophobicContact CG-CD2 3.86Å; L160-L262 HydrophobicContact CD2-CD1 4.26Å; L160-L262 HydrophobicContact CD2-CD2 4.03Å; T163-L262 HydrophobicContact CG2-CD1 3.85Å; N259-L262 HydrophobicContact CB-CB 4.17Å; N259-L262 PolarHBondContact O-N 3.44Å; N259-L262 VanDerWaalsContact O-N 3.14Å; N259-L262 WeakPolarHBondContact OD1-CB 3.4Å; N259-L262 PolarHBondContact OD1-N 3.26Å; L262-T264 VanDerWaalsContact C-N 3.31Å; L262-T264 PolarHBondContact O-N 3.24Å; L262-A265 WeakPolarHBondContact O-CB 3.3Å; L262-A265 PolarHBondContact O-N 2.91Å; L262-I266 HydrophobicContact CD1-CD1 3.93Å; L262-I266 HydrophobicContact CD1-CG1 4.2Å; L262-I266 HydrophobicContact CG-CD1 3.88Å; L262-I266 WeakPolarHBondContact O-CG1 3.46Å; L262-I266 PolarHBondContact O-N 2.96Å
263C86.5Confident81.9Confident0 Ų018.2 Ų18.20%010%0.101CC..Hα-helixtrans-55.1-49.1172.6-174.40000111.2N259 V260 A265 I266 L267N259-C263 PolarHBondContact O-N 3.42Å; N259-C263 VanDerWaalsContact O-N 3.08Å; V260-C263 PolarHBondContact O-N 2.9Å; C263-A265 PolarHBondContact O-N 3.33Å; C263-I266 PolarHBondContact O-N 2.95Å; C263-L267 WeakPolarHBondContact O-CG 3.31Å; C263-L267 PolarHBondContact O-N 3.5Å
264T79.2Confident80.4Confident30 Ų3025 Ų2518%0.18413%0.133CC..Hα-helixtrans-61.9-44.3178.9-56.50000111.1V260 Q261 L262 I266 L267 K268 Y280V260-T264 VanDerWaalsContact O-CB 3.28Å; V260-T264 WeakPolarHBondContact O-CB 3.47Å; V260-T264 PolarHBondContact O-N 2.89Å; V260-T264 PolarHBondContact O-OG1 3.4Å; Q261-T264 PolarHBondContact O-N 3.01Å; L262-T264 VanDerWaalsContact C-N 3.31Å; L262-T264 PolarHBondContact O-N 3.24Å; T264-I266 PolarHBondContact O-N 3.22Å; T264-L267 PolarHBondContact O-N 3.43Å; T264-K268 PolarHBondContact O-N 2.99Å; T264-Y280 HydrophobicContact CG2-CD1 4.48Å; T264-Y280 HydrophobicContact CG2-CE1 3.5Å; T264-Y280 VanDerWaalsContact CG2-OH 3.31Å; T264-Y280 WeakPolarHBondContact CG2-OH 3.25Å; T264-Y280 PolarHBondContact O-OH 3.36Å
265A77.2Confident79Confident1 Ų127.2 Ų27.21%0.00815%0.145CC..Hα-helixtrans-58-48.4176.200000112.1L32 Q261 L262 C263 K268 L269L32-A265 HydrophobicContact CD1-CB 3.65Å; L32-A265 HydrophobicContact CD2-CB 3.99Å; L32-A265 HydrophobicContact CG-CB 4.32Å; Q261-A265 WeakPolarHBondContact O-CB 3.42Å; Q261-A265 PolarHBondContact O-N 3.26Å; L262-A265 WeakPolarHBondContact O-CB 3.3Å; L262-A265 PolarHBondContact O-N 2.91Å; C263-A265 PolarHBondContact O-N 3.33Å; A265-K268 PolarHBondContact O-N 2.81Å; A265-K268 VanDerWaalsContact O-N 3.12Å; A265-L269 WeakPolarHBondContact O-CB 3.48Å; A265-L269 WeakPolarHBondContact O-CG 3.43Å; A265-L269 PolarHBondContact O-N 3.49Å
266I79.9Confident77.4Confident0 Ų028.3 Ų28.30%015%0.15CC..Hα-helixtrans-65.1-41.9-179.9-66.5164.6000110.6L92 M131 I156 T159 L160 L262 C263 T264 K268 L269 A270L92-I266 HydrophobicContact CD1-CG2 3.91Å; L92-I266 HydrophobicContact CD2-CB 4.37Å; L92-I266 HydrophobicContact CD2-CG2 4.09Å; M131-I266 HydrophobicContact CE-CD1 3.48Å; M131-I266 VanDerWaalsContact CE-CD1 3.48Å; M131-I266 HydrophobicContact SD-CD1 3.77Å; I156-I266 HydrophobicContact CB-CG2 4.31Å; I156-I266 HydrophobicContact CG1-CG2 3.83Å; I156-I266 HydrophobicContact CG2-CG2 4.04Å; T159-I266 HydrophobicContact CG2-CB 4.48Å; T159-I266 HydrophobicContact CG2-CG1 3.71Å; L160-I266 HydrophobicContact CD2-CD1 4.06Å; L160-I266 HydrophobicContact CG-CD1 4.25Å; L262-I266 HydrophobicContact CD1-CD1 3.93Å; L262-I266 HydrophobicContact CD1-CG1 4.2Å; L262-I266 HydrophobicContact CG-CD1 3.88Å; L262-I266 WeakPolarHBondContact O-CG1 3.46Å; L262-I266 PolarHBondContact O-N 2.96Å; C263-I266 PolarHBondContact O-N 2.95Å; T264-I266 PolarHBondContact O-N 3.22Å; I266-K268 VanDerWaalsContact C-N 3.31Å; I266-K268 PolarHBondContact O-N 3.4Å; I266-L269 PolarHBondContact O-N 2.67Å; I266-A270 HydrophobicContact CG2-CB 4.17Å; I266-A270 WeakPolarHBondContact O-CA 3.45Å; I266-A270 WeakPolarHBondContact O-CB 3.46Å; I266-A270 PolarHBondContact O-N 2.82Å
267L79.4Confident76Confident1 Ų131 Ų311%0.00518%0.177CC..Hα-helixtrans-56.2-47.9170.9-68.9174.6000111.1L92 C263 T264 L269 F271 M276 M279 Y280 P283L92-L267 HydrophobicContact CD2-CD1 4.46Å; L92-L267 HydrophobicContact CD2-CD2 3.37Å; L92-L267 HydrophobicContact CD2-CG 3.52Å; C263-L267 WeakPolarHBondContact O-CG 3.31Å; C263-L267 PolarHBondContact O-N 3.5Å; T264-L267 PolarHBondContact O-N 3.43Å; L267-L269 PolarHBondContact O-N 3.36Å; L267-F271 HydrophobicContact CD2-CD2 3.98Å; L267-F271 HydrophobicContact CD2-CE2 4.04Å; L267-F271 PolarHBondContact O-N 2.81Å; L267-M276 HydrophobicContact CB-SD 4.31Å; L267-M279 HydrophobicContact CD1-CB 4.07Å; L267-M279 WeakPolarHBondContact CD1-O 3.5Å; L267-M279 HydrophobicContact CD2-CB 3.81Å; L267-M279 HydrophobicContact CD2-CE 4.25Å; L267-M279 HydrophobicContact CD2-CG 4.39Å; L267-M279 HydrophobicContact CD2-SD 3.89Å; L267-Y280 HydrophobicContact CB-CD2 4.18Å; L267-Y280 HydrophobicContact CB-CE2 3.5Å; L267-Y280 VanDerWaalsContact CB-CE2 3.5Å; L267-Y280 HydrophobicContact CD1-CD2 4.21Å; L267-Y280 HydrophobicContact CD1-CE2 4.22Å; L267-P283 HydrophobicContact CD1-CG 3.74Å
268K74.3Confident74.8Confident62 Ų6233.2 Ų33.227%0.2720%0.201SC..Hα-helixtrans-65.1-35.7-175.6-133.3153.5-135.5164.50115V28 T264 A265 I266 M276 Y280V28-K268 HydrophobicContact CB-CD 4.2Å; V28-K268 HydrophobicContact CG1-CD 3.52Å; T264-K268 PolarHBondContact O-N 2.99Å; A265-K268 PolarHBondContact O-N 2.81Å; A265-K268 VanDerWaalsContact O-N 3.12Å; I266-K268 VanDerWaalsContact C-N 3.31Å; I266-K268 PolarHBondContact O-N 3.4Å; K268-M276 HydrophobicContact CB-CE 4.24Å; K268-M276 HydrophobicContact CG-CE 3.78Å; K268-Y280 WeakPolarHBondContact CB-OH 3.29Å; K268-Y280 HydrophobicContact CD-CE1 4.49Å; K268-Y280 WeakPolarHBondContact CD-OH 3.32Å; K268-Y280 WeakPolarHBondContact CE-OH 3.26Å; K268-Y280 WeakPolarHBondContact CG-OH 3.31Å
269L73.2Confident73.9Confident100 Ų10033.2 Ų33.252%0.52420%0.2SC..Hα-helixtrans-102.2-23.4-169.9-63.9172000112.7T159 A265 I266 L267T159-L269 HydrophobicContact CG2-CB 4.19Å; T159-L269 HydrophobicContact CG2-CD1 3.78Å; A265-L269 WeakPolarHBondContact O-CB 3.48Å; A265-L269 WeakPolarHBondContact O-CG 3.43Å; A265-L269 PolarHBondContact O-N 3.49Å; I266-L269 PolarHBondContact O-N 2.67Å; L267-L269 PolarHBondContact O-N 3.36Å
270A73.1Confident73.2Confident13 Ų1335.2 Ų35.211%0.10721%0.208CC..Hα-helixtrans-98.3-35.5-178.800000112.9P152 A155 I156 I266P152-A270 HydrophobicContact CG-CB 4.01Å; P152-A270 WeakPolarHBondContact CG-O 3.24Å; A155-A270 HydrophobicContact CB-CB 3.9Å; I156-A270 HydrophobicContact CG1-CB 3.93Å; I266-A270 HydrophobicContact CG2-CB 4.17Å; I266-A270 WeakPolarHBondContact O-CA 3.45Å; I266-A270 WeakPolarHBondContact O-CB 3.46Å; I266-A270 PolarHBondContact O-N 2.82Å
271F73.6Confident72.8Confident13 Ų1336.7 Ų36.76%0.05722%0.215CC..SBendtrans-103.1148.5-170.8-67.2-99.3000114L92 L151 L267 M276 M279L92-F271 HydrophobicContact CD2-CE2 4.33Å; L151-F271 HydrophobicContact CD2-CE1 3.94Å; L151-F271 HydrophobicContact CD2-CZ 3.6Å; L267-F271 HydrophobicContact CD2-CD2 3.98Å; L267-F271 HydrophobicContact CD2-CE2 4.04Å; L267-F271 PolarHBondContact O-N 2.81Å; F271-M276 HydrophobicContact CB-SD 4.4Å; F271-M279 HydrophobicContact CB-CE 3.53Å; F271-M279 HydrophobicContact CD1-CE 3.64Å; F271-M279 HydrophobicContact CD1-SD 3.95Å; F271-M279 HydrophobicContact CD2-CE 4.48Å; F271-M279 HydrophobicContact CE1-CE 4.44Å; F271-M279 HydrophobicContact CE1-SD 4.17Å; F271-M279 HydrophobicContact CG-CE 3.64Å; F271-M279 HydrophobicContact CG-SD 4.29Å
272P68.1Low73.2Confident51 Ų5135 Ų3533%0.33121%0.207SC..  trans-72146-177.929.2-35.6000112.9Q274 L275 M276P272-Q274 PolarHBondContact O-N 3.44Å; P272-L275 HydrophobicContact CG-CD1 4.25Å; P272-L275 PolarHBondContact O-N 3.39Å; P272-M276 VanDerWaalsContact O-CG 3.32Å; P272-M276 WeakPolarHBondContact O-CG 3.33Å
273P62.5Low73.4Confident57 Ų5734.8 Ų34.837%0.3721%0.206SC..Hα-helixtrans-50.3-29.5-173.4-31.236.4000116.6W16 M276W16-P273 HydrophobicContact CD2-CB 4.04Å; W16-P273 HydrophobicContact CE3-CB 3.97Å; W16-P273 HydrophobicContact CZ3-CB 4.22Å; P273-M276 WeakPolarHBondContact O-CB 3.38Å; P273-M276 PolarHBondContact O-N 3.5Å
274Q62.2Low73.1Confident145 Ų14536.3 Ų36.368%0.67821%0.214SC*.Hα-helixtrans-72.7-29.7-172.8-60.977.310.100113P272P272-Q274 PolarHBondContact O-N 3.44Å
275L64.4Low73.4Confident46 Ų4635.1 Ų35.124%0.24121%0.207CC..Hα-helixtrans-89.9-11.8177.5-63.6174.5000112.5V85 L150 P272 G277 M279V85-L275 HydrophobicContact CG2-CD2 4.44Å; L150-L275 HydrophobicContact CD1-CD1 4.2Å; P272-L275 HydrophobicContact CG-CD1 4.25Å; P272-L275 PolarHBondContact O-N 3.39Å; L275-G277 PolarHBondContact O-N 2.87Å; L275-M279 HydrophobicContact CB-CE 3.66Å; L275-M279 PolarHBondContact O-N 3.44Å
276M61.8Low74Confident23 Ų2335.1 Ų35.111%0.11321%0.206CC..Hα-helixtrans-67.3-37.8-166-75.3-88.8-7800114.2L267 K268 F271 P272 P273 G278 M279 Y280L267-M276 HydrophobicContact CB-SD 4.31Å; K268-M276 HydrophobicContact CB-CE 4.24Å; K268-M276 HydrophobicContact CG-CE 3.78Å; F271-M276 HydrophobicContact CB-SD 4.4Å; P272-M276 VanDerWaalsContact O-CG 3.32Å; P272-M276 WeakPolarHBondContact O-CG 3.33Å; P273-M276 WeakPolarHBondContact O-CB 3.38Å; P273-M276 PolarHBondContact O-N 3.5Å; M276-G278 VanDerWaalsContact C-N 3.31Å; M276-G278 PolarHBondContact O-N 3.5Å; M276-M279 PolarHBondContact O-N 2.96Å; M276-Y280 HydrophobicContact CB-CD2 4.38Å; M276-Y280 HydrophobicContact CE-CD2 3.98Å; M276-Y280 HydrophobicContact CE-CE2 3.34Å; M276-Y280 VanDerWaalsContact O-CB 3.29Å; M276-Y280 WeakPolarHBondContact O-CB 3.33Å; M276-Y280 WeakPolarHBondContact O-CD2 3.49Å; M276-Y280 PolarHBondContact O-N 3.19Å; M276-Y280 HydrophobicContact SD-CD2 3.9Å; M276-Y280 HydrophobicContact SD-CE2 3.53Å; M276-Y280 VanDerWaalsContact SD-CE2 3.53Å
277G63.5Low74.3Confident56 Ų5635.4 Ų35.458%0.57721%0.209SC*.Hα-helixtrans-57-42.6-176.500000113.2L275L275-G277 PolarHBondContact O-N 2.87Å
278G67.4Low74.6Confident47 Ų4737.5 Ų37.549%0.48522%0.22SC..Hα-helixtrans-70.4-48.5175.600000112.6M276 Y280 M281M276-G278 VanDerWaalsContact C-N 3.31Å; M276-G278 PolarHBondContact O-N 3.5Å; G278-Y280 VanDerWaalsContact C-N 3.27Å; G278-Y280 PolarHBondContact O-N 3.4Å; G278-M281 WeakPolarHBondContact O-CB 3.25Å; G278-M281 PolarHBondContact O-N 3.15Å
279M73.3Confident75.3Confident0 Ų036.9 Ų36.90%022%0.217CC..Hα-helixtrans-65.2-29.1-178.1-63.9-171.7-68.200113.5V85 A89 L267 F271 L275 M276 M281 P283V85-M279 HydrophobicContact CG1-CG 3.34Å; V85-M279 HydrophobicContact CG1-SD 4.32Å; A89-M279 HydrophobicContact CB-CB 4.05Å; A89-M279 HydrophobicContact CB-CG 4.32Å; A89-M279 WeakPolarHBondContact CB-O 3.21Å; L267-M279 HydrophobicContact CD1-CB 4.07Å; L267-M279 WeakPolarHBondContact CD1-O 3.5Å; L267-M279 HydrophobicContact CD2-CB 3.81Å; L267-M279 HydrophobicContact CD2-CE 4.25Å; L267-M279 HydrophobicContact CD2-CG 4.39Å; L267-M279 HydrophobicContact CD2-SD 3.89Å; F271-M279 HydrophobicContact CB-CE 3.53Å; F271-M279 HydrophobicContact CD1-CE 3.64Å; F271-M279 HydrophobicContact CD1-SD 3.95Å; F271-M279 HydrophobicContact CD2-CE 4.48Å; F271-M279 HydrophobicContact CE1-CE 4.44Å; F271-M279 HydrophobicContact CE1-SD 4.17Å; F271-M279 HydrophobicContact CG-CE 3.64Å; F271-M279 HydrophobicContact CG-SD 4.29Å; L275-M279 HydrophobicContact CB-CE 3.66Å; L275-M279 PolarHBondContact O-N 3.44Å; M276-M279 PolarHBondContact O-N 2.96Å; M279-M281 VanDerWaalsContact C-N 3.28Å; M279-M281 PolarHBondContact O-N 3.22Å; M279-P283 WeakPolarHBondContact O-CD 3.33Å
280Y72.9Confident76.2Confident45 Ų4532.3 Ų32.318%0.17619%0.193CC..Hα-helixtrans-70.5-23179-100.5-109.2000114.3T264 L267 K268 M276 G278 L284T264-Y280 HydrophobicContact CG2-CD1 4.48Å; T264-Y280 HydrophobicContact CG2-CE1 3.5Å; T264-Y280 VanDerWaalsContact CG2-OH 3.31Å; T264-Y280 WeakPolarHBondContact CG2-OH 3.25Å; T264-Y280 PolarHBondContact O-OH 3.36Å; L267-Y280 HydrophobicContact CB-CD2 4.18Å; L267-Y280 HydrophobicContact CB-CE2 3.5Å; L267-Y280 VanDerWaalsContact CB-CE2 3.5Å; L267-Y280 HydrophobicContact CD1-CD2 4.21Å; L267-Y280 HydrophobicContact CD1-CE2 4.22Å; K268-Y280 WeakPolarHBondContact CB-OH 3.29Å; K268-Y280 HydrophobicContact CD-CE1 4.49Å; K268-Y280 WeakPolarHBondContact CD-OH 3.32Å; K268-Y280 WeakPolarHBondContact CE-OH 3.26Å; K268-Y280 WeakPolarHBondContact CG-OH 3.31Å; M276-Y280 HydrophobicContact CB-CD2 4.38Å; M276-Y280 HydrophobicContact CE-CD2 3.98Å; M276-Y280 HydrophobicContact CE-CE2 3.34Å; M276-Y280 VanDerWaalsContact O-CB 3.29Å; M276-Y280 WeakPolarHBondContact O-CB 3.33Å; M276-Y280 WeakPolarHBondContact O-CD2 3.49Å; M276-Y280 PolarHBondContact O-N 3.19Å; M276-Y280 HydrophobicContact SD-CD2 3.9Å; M276-Y280 HydrophobicContact SD-CE2 3.53Å; M276-Y280 VanDerWaalsContact SD-CE2 3.53Å; G278-Y280 VanDerWaalsContact C-N 3.27Å; G278-Y280 PolarHBondContact O-N 3.4Å; Y280-L284 WeakPolarHBondContact O-CB 3.4Å
281M77.9Confident76.9Confident37 Ų3732.8 Ų32.818%0.18220%0.197CC..Hα-helixtrans-69.8-39.3-175.6-162.163.865.300112L207 I215 G278 M279 L284 L285L207-M281 HydrophobicContact CD1-CE 4.5Å; L207-M281 HydrophobicContact CD2-CE 3.97Å; L207-M281 HydrophobicContact CD2-SD 3.81Å; I215-M281 HydrophobicContact CD1-CE 3.71Å; I215-M281 HydrophobicContact CD1-CG 3.52Å; I215-M281 HydrophobicContact CD1-SD 3.49Å; I215-M281 WeakPolarHBondContact CD1-SD 3.49Å; I215-M281 HydrophobicContact CG1-CE 4.17Å; I215-M281 HydrophobicContact CG1-CG 3.88Å; I215-M281 HydrophobicContact CG1-SD 4.33Å; I215-M281 HydrophobicContact CG2-CG 4.32Å; G278-M281 WeakPolarHBondContact O-CB 3.25Å; G278-M281 PolarHBondContact O-N 3.15Å; M279-M281 VanDerWaalsContact C-N 3.28Å; M279-M281 PolarHBondContact O-N 3.22Å; M281-L284 PolarHBondContact O-N 3.32Å; M281-L284 HydrophobicContact SD-CD2 3.82Å; M281-L285 HydrophobicContact CG-CD1 4.1Å; M281-L285 HydrophobicContact CG-CG 4.47Å; M281-L285 WeakPolarHBondContact O-CG 3.12Å; M281-L285 PolarHBondContact O-N 2.64Å
282F85.8Confident77.6Confident2 Ų234.3 Ų34.31%0.00921%0.212CC..Hα-helixtrans-66-51.4-176.8-179.9-94.1000113.4A89 V90 C93 V219 V222 A223 M226 L284 L285 Y286A89-F282 HydrophobicContact CB-CB 4.1Å; V90-F282 HydrophobicContact CB-CD1 4.45Å; V90-F282 HydrophobicContact CB-CE1 4.28Å; V90-F282 HydrophobicContact CB-CZ 4.36Å; V90-F282 HydrophobicContact CG1-CZ 4.43Å; V90-F282 HydrophobicContact CG2-CD1 3.88Å; V90-F282 HydrophobicContact CG2-CD2 3.58Å; V90-F282 HydrophobicContact CG2-CE1 3.88Å; V90-F282 HydrophobicContact CG2-CE2 3.55Å; V90-F282 HydrophobicContact CG2-CG 3.73Å; V90-F282 HydrophobicContact CG2-CZ 3.71Å; C93-F282 HydrophobicContact CB-CD1 4.1Å; C93-F282 HydrophobicContact CB-CE1 3.75Å; V219-F282 HydrophobicContact CG1-CB 4.32Å; V219-F282 HydrophobicContact CG1-CD2 4.01Å; V222-F282 HydrophobicContact CB-CE2 4.42Å; V222-F282 HydrophobicContact CG1-CE2 3.92Å; V222-F282 HydrophobicContact CG1-CZ 4.3Å; A223-F282 HydrophobicContact CB-CD2 4.07Å; A223-F282 HydrophobicContact CB-CE2 3.66Å; A223-F282 HydrophobicContact CB-CZ 4.5Å; M226-F282 HydrophobicContact SD-CE1 4.2Å; M226-F282 HydrophobicContact SD-CZ 3.8Å; F282-L284 PolarHBondContact O-N 2.82Å; F282-L285 PolarHBondContact O-N 3.25Å; F282-Y286 AromaticContact CE1-CD2 3.87Å; F282-Y286 HydrophobicContact CE1-CD2 3.87Å; F282-Y286 HydrophobicContact CE1-CG 4.32Å; F282-Y286 AromaticContact CZ-CD2 3.63Å; F282-Y286 HydrophobicContact CZ-CD2 3.63Å; F282-Y286 HydrophobicContact CZ-CE2 4.42Å; F282-Y286 HydrophobicContact CZ-CG 4.41Å; F282-Y286 WeakPolarHBondContact O-CB 3.3Å; F282-Y286 PolarHBondContact O-N 2.82Å
283P86.1Confident78.7Confident1 Ų133 Ų331%0.00620%0.201CC..Hα-helixtrans-61.3-32.5177.8-21.432.5000112.7V260 L267 M279 Y286 A287V260-P283 HydrophobicContact CG1-CB 3.85Å; V260-P283 VanDerWaalsContact CG1-O 3.31Å; V260-P283 WeakPolarHBondContact CG1-O 3.39Å; L267-P283 HydrophobicContact CD1-CG 3.74Å; M279-P283 WeakPolarHBondContact O-CD 3.33Å; P283-Y286 PolarHBondContact O-N 3.5Å; P283-A287 WeakPolarHBondContact O-CB 3.12Å; P283-A287 PolarHBondContact O-N 2.85Å
284L80.7Confident79.9Confident33 Ų3330.3 Ų30.317%0.17318%0.184CC..Hα-helixtrans-64.3-47.8175.2168.4146000111.9L199 T203 Y280 M281 F282 L288L199-L284 HydrophobicContact CD1-CB 4.28Å; L199-L284 HydrophobicContact CD1-CD1 3.9Å; L199-L284 HydrophobicContact CD1-CG 4.17Å; L199-L284 HydrophobicContact CD2-CB 4.31Å; L199-L284 HydrophobicContact CD2-CD1 4.12Å; L199-L284 HydrophobicContact CD2-CG 3.74Å; L199-L284 HydrophobicContact CG-CD1 3.67Å; L199-L284 HydrophobicContact CG-CG 3.88Å; T203-L284 HydrophobicContact CG2-CD2 4.23Å; Y280-L284 WeakPolarHBondContact O-CB 3.4Å; M281-L284 PolarHBondContact O-N 3.32Å; M281-L284 HydrophobicContact SD-CD2 3.82Å; F282-L284 PolarHBondContact O-N 2.82Å; L284-L288 PolarHBondContact O-N 3.36Å
285L85.4Confident81.2Confident5 Ų525 Ų253%0.02617%0.169CC..Hα-helixtrans-65.9-41.5173.8-68.7172.6000111.5V219 Y220 A223 M281 F282 A287 L288 F289V219-L285 HydrophobicContact CG1-CD1 4.25Å; Y220-L285 HydrophobicContact CD1-CD1 3.77Å; Y220-L285 HydrophobicContact CD1-CD2 3.93Å; Y220-L285 HydrophobicContact CE1-CD1 3.88Å; Y220-L285 HydrophobicContact CE1-CD2 3.74Å; Y220-L285 HydrophobicContact CE1-CG 4.5Å; Y220-L285 HydrophobicContact CG-CD1 4.33Å; A223-L285 HydrophobicContact CB-CB 3.73Å; M281-L285 HydrophobicContact CG-CD1 4.1Å; M281-L285 HydrophobicContact CG-CG 4.47Å; M281-L285 WeakPolarHBondContact O-CG 3.12Å; M281-L285 PolarHBondContact O-N 2.64Å; F282-L285 PolarHBondContact O-N 3.25Å; L285-A287 PolarHBondContact O-N 2.81Å; L285-L288 WeakPolarHBondContact O-CB 3.01Å; L285-L288 PolarHBondContact O-N 3.27Å; L285-L288 VanDerWaalsContact O-N 3.15Å; L285-F289 HydrophobicContact CB-CD2 4.28Å; L285-F289 HydrophobicContact CB-CE2 4.17Å; L285-F289 HydrophobicContact CD2-CE2 4.26Å; L285-F289 WeakPolarHBondContact O-CD2 3.32Å; L285-F289 PolarHBondContact O-N 3.45Å
286Y89.6Confident82.4Confident0 Ų028.4 Ų28.40%019%0.186CC..Hα-helixtrans-60.7-44.5178.4-167.2-85000112M226 P227 G256 Q258 V260 F282 P283 L288 F289 Q290M226-Y286 HydrophobicContact CB-CD2 4.45Å; M226-Y286 HydrophobicContact CB-CE2 3.82Å; M226-Y286 HydrophobicContact CE-CE2 3.79Å; M226-Y286 HydrophobicContact CG-CE2 3.68Å; M226-Y286 HydrophobicContact SD-CD2 4.26Å; M226-Y286 HydrophobicContact SD-CE2 3.72Å; P227-Y286 HydrophobicContact CB-CE2 4.38Å; P227-Y286 HydrophobicContact CG-CD2 3.97Å; P227-Y286 HydrophobicContact CG-CE1 4.33Å; P227-Y286 HydrophobicContact CG-CE2 3.57Å; G256-Y286 PolarHBondContact O-OH 3.25Å; Q258-Y286 HydrophobicContact CB-CE1 3.7Å; Q258-Y286 HydrophobicContact CG-CE1 4.03Å; Q258-Y286 WeakPolarHBondContact CG-OH 3.35Å; V260-Y286 HydrophobicContact CG2-CD1 3.72Å; V260-Y286 HydrophobicContact CG2-CE1 4.44Å; F282-Y286 AromaticContact CE1-CD2 3.87Å; F282-Y286 HydrophobicContact CE1-CD2 3.87Å; F282-Y286 HydrophobicContact CE1-CG 4.32Å; F282-Y286 AromaticContact CZ-CD2 3.63Å; F282-Y286 HydrophobicContact CZ-CD2 3.63Å; F282-Y286 HydrophobicContact CZ-CE2 4.42Å; F282-Y286 HydrophobicContact CZ-CG 4.41Å; F282-Y286 WeakPolarHBondContact O-CB 3.3Å; F282-Y286 PolarHBondContact O-N 2.82Å; P283-Y286 PolarHBondContact O-N 3.5Å; Y286-L288 VanDerWaalsContact C-N 3.27Å; Y286-L288 PolarHBondContact O-N 3.47Å; Y286-F289 PolarHBondContact O-N 2.8Å; Y286-Q290 HydrophobicContact CD1-CB 4.47Å; Y286-Q290 HydrophobicContact CD1-CG 4.5Å; Y286-Q290 HydrophobicContact CE1-CB 4.29Å; Y286-Q290 WeakPolarHBondContact O-CB 3.43Å; Y286-Q290 VanDerWaalsContact O-CG 3.3Å; Y286-Q290 WeakPolarHBondContact O-CG 3.27Å; Y286-Q290 PolarHBondContact O-N 2.84Å
287A86.4Confident83.7Confident6 Ų631.1 Ų31.15%0.0520%0.197CC..Hα-helixtrans-59-37.5174.700000113V260 P283 L285 A291V260-A287 HydrophobicContact CB-CB 4.36Å; V260-A287 HydrophobicContact CG1-CB 3.99Å; V260-A287 HydrophobicContact CG2-CB 4.15Å; P283-A287 WeakPolarHBondContact O-CB 3.12Å; P283-A287 PolarHBondContact O-N 2.85Å; L285-A287 PolarHBondContact O-N 2.81Å; A287-A291 VanDerWaalsContact O-CB 3.26Å; A287-A291 WeakPolarHBondContact O-CB 3.24Å; A287-A291 PolarHBondContact O-N 3.22Å
288L84.9Confident84.9Confident45 Ų4529.1 Ų29.124%0.23617%0.173CC..Hα-helixtrans-68.9-51.7177177.858.9000111.2F200 L284 L285 Y286 A291 A292F200-L288 HydrophobicContact CD2-CD1 3.47Å; F200-L288 VanDerWaalsContact CD2-CD1 3.47Å; F200-L288 HydrophobicContact CD2-CD2 3.91Å; F200-L288 HydrophobicContact CD2-CG 4.32Å; F200-L288 HydrophobicContact CE2-CD1 3.73Å; F200-L288 HydrophobicContact CE2-CD2 4.01Å; F200-L288 HydrophobicContact CG-CD1 4.47Å; L284-L288 PolarHBondContact O-N 3.36Å; L285-L288 WeakPolarHBondContact O-CB 3.01Å; L285-L288 PolarHBondContact O-N 3.27Å; L285-L288 VanDerWaalsContact O-N 3.15Å; Y286-L288 VanDerWaalsContact C-N 3.27Å; Y286-L288 PolarHBondContact O-N 3.47Å; L288-A291 PolarHBondContact O-N 3.45Å; L288-A292 WeakPolarHBondContact O-CB 3.41Å; L288-A292 PolarHBondContact O-N 3.25Å
289F89.8Confident86Confident50 Ų5031.9 Ų31.922%0.21918%0.176CC..Hα-helixtrans-69.1-44.5-175.6-68.5-57000112.7A223 V224 L285 Y286 A291 A292 E293A223-F289 HydrophobicContact CB-CD2 3.77Å; A223-F289 HydrophobicContact CB-CE2 4.12Å; A223-F289 WeakPolarHBondContact O-CB 3.15Å; V224-F289 HydrophobicContact CG2-CB 4.48Å; V224-F289 HydrophobicContact CG2-CD1 3.59Å; V224-F289 HydrophobicContact CG2-CD2 3.72Å; V224-F289 HydrophobicContact CG2-CE1 3.58Å; V224-F289 HydrophobicContact CG2-CE2 3.71Å; V224-F289 HydrophobicContact CG2-CG 3.67Å; V224-F289 HydrophobicContact CG2-CZ 3.64Å; L285-F289 HydrophobicContact CB-CD2 4.28Å; L285-F289 HydrophobicContact CB-CE2 4.17Å; L285-F289 HydrophobicContact CD2-CE2 4.26Å; L285-F289 WeakPolarHBondContact O-CD2 3.32Å; L285-F289 PolarHBondContact O-N 3.45Å; Y286-F289 PolarHBondContact O-N 2.8Å; F289-A291 PolarHBondContact O-N 2.83Å; F289-A292 PolarHBondContact O-N 2.82Å; F289-E293 WeakPolarHBondContact O-CB 3.32Å; F289-E293 VanDerWaalsContact O-CG 3.27Å; F289-E293 WeakPolarHBondContact O-CG 3.48Å; F289-E293 PolarHBondContact O-N 2.92Å
290Q91.2Very high86.7Confident4 Ų434.5 Ų34.52%0.01920%0.198CC..Hα-helixtrans-57.6-37.8174.880.2176.1-3.800111.8L101 P227 Y231 Y286 A294L101-Q290 HydrophobicContact CD2-CG 3.83Å; P227-Q290 HydrophobicContact CB-CB 3.92Å; P227-Q290 HydrophobicContact CG-CB 4.06Å; Y231-Q290 PolarHBondContact OH-O 3.38Å; Y231-Q290 VanDerWaalsContact OH-O 3.07Å; Y286-Q290 HydrophobicContact CD1-CB 4.47Å; Y286-Q290 HydrophobicContact CD1-CG 4.5Å; Y286-Q290 HydrophobicContact CE1-CB 4.29Å; Y286-Q290 WeakPolarHBondContact O-CB 3.43Å; Y286-Q290 VanDerWaalsContact O-CG 3.3Å; Y286-Q290 WeakPolarHBondContact O-CG 3.27Å; Y286-Q290 PolarHBondContact O-N 2.84Å; Q290-A294 WeakPolarHBondContact O-CB 3Å; Q290-A294 PolarHBondContact O-N 3.21Å
291A87.3Confident87.5Confident23 Ų2334.2 Ų34.219%0.1920%0.197CC..Hα-helixtrans-74.1-39.7179.700000112.2L101 L196 A287 L288 F289 G295L101-A291 HydrophobicContact CD2-CB 4.21Å; L196-A291 HydrophobicContact CD1-CB 4.3Å; A287-A291 VanDerWaalsContact O-CB 3.26Å; A287-A291 WeakPolarHBondContact O-CB 3.24Å; A287-A291 PolarHBondContact O-N 3.22Å; L288-A291 PolarHBondContact O-N 3.45Å; F289-A291 PolarHBondContact O-N 2.83Å; A291-G295 PolarHBondContact O-N 2.84Å
292A88.6Confident88Confident45 Ų4537.7 Ų37.737%0.37221%0.211SC..Hα-helixtrans-65.5-46.2175.900000111.7L288 F289 G295 I296L288-A292 WeakPolarHBondContact O-CB 3.41Å; L288-A292 PolarHBondContact O-N 3.25Å; F289-A292 PolarHBondContact O-N 2.82Å; A292-G295 PolarHBondContact O-N 3.47Å; A292-I296 WeakPolarHBondContact O-CG1 3.32Å; A292-I296 PolarHBondContact O-N 2.95Å
293E91.6Very high88.2Confident23 Ų2342.6 Ų42.611%0.10724%0.237CC..Hα-helixtrans-66-45.5179.4-71.2164.9-157.500112.1P227 L228 Y231 F289 G295 I296 F297P227-E293 WeakPolarHBondContact CB-OE2 3.44Å; L228-E293 HydrophobicContact CD2-CB 4.4Å; L228-E293 HydrophobicContact CD2-CG 3.94Å; L228-E293 VanDerWaalsContact CD2-OE2 3.32Å; L228-E293 WeakPolarHBondContact CD2-OE2 3.36Å; L228-E293 HydrophobicContact CG-CG 4.4Å; L228-E293 VanDerWaalsContact CG-OE2 3.28Å; L228-E293 WeakPolarHBondContact CG-OE2 3.26Å; L228-E293 PolarHBondContact N-OE2 3.48Å; Y231-E293 HydrophobicContact CE2-CB 3.93Å; F289-E293 WeakPolarHBondContact O-CB 3.32Å; F289-E293 VanDerWaalsContact O-CG 3.27Å; F289-E293 WeakPolarHBondContact O-CG 3.48Å; F289-E293 PolarHBondContact O-N 2.92Å; E293-G295 VanDerWaalsContact C-N 3.27Å; E293-G295 PolarHBondContact O-N 3.24Å; E293-I296 PolarHBondContact O-N 2.83Å; E293-F297 WeakPolarHBondContact O-CB 3.37Å; E293-F297 PolarHBondContact O-N 3.18Å
294A87.9Confident88.2Confident1 Ų150.1 Ų50.11%0.00827%0.266CS..Hα-helixtrans-60.4-38.4172.300000111.7M105 L253 Q290 F297 I298M105-A294 HydrophobicContact CB-CB 4.4Å; M105-A294 HydrophobicContact CE-CB 4.26Å; M105-A294 HydrophobicContact CG-CB 3.78Å; M105-A294 HydrophobicContact SD-CB 3.98Å; L253-A294 HydrophobicContact CD2-CB 4.33Å; Q290-A294 WeakPolarHBondContact O-CB 3Å; Q290-A294 PolarHBondContact O-N 3.21Å; A294-F297 PolarHBondContact O-N 3.37Å; A294-I298 WeakPolarHBondContact O-CD1 3.36Å; A294-I298 VanDerWaalsContact O-CG1 3.32Å; A294-I298 WeakPolarHBondContact O-CG1 3.13Å; A294-I298 PolarHBondContact O-N 3.44Å
295G88Confident88.4Confident34 Ų3453 Ų5335%0.35127%0.274SS..Hα-helixtrans-61.9-44173.300000113.3A291 A292 E293 I298 L299A291-G295 PolarHBondContact O-N 2.84Å; A292-G295 PolarHBondContact O-N 3.47Å; E293-G295 VanDerWaalsContact C-N 3.27Å; E293-G295 PolarHBondContact O-N 3.24Å; G295-I298 PolarHBondContact O-N 3.41Å; G295-L299 WeakPolarHBondContact O-CB 3.41Å; G295-L299 PolarHBondContact O-N 3.39Å
296I91.1Very high88.4Confident117 Ų11760 Ų6060%0.630%0.304SS*.Hα-helixtrans-63-43.7174.1-69.1163.9000110.4A292 E293 I298 L299 A300A292-I296 WeakPolarHBondContact O-CG1 3.32Å; A292-I296 PolarHBondContact O-N 2.95Å; E293-I296 PolarHBondContact O-N 2.83Å; I296-I298 PolarHBondContact O-N 3.12Å; I296-L299 PolarHBondContact O-N 3.41Å; I296-A300 WeakPolarHBondContact O-CB 3.16Å; I296-A300 PolarHBondContact O-N 2.95Å
297F88.8Confident88.1Confident79 Ų7963.8 Ų63.835%0.34632%0.322SS..Hα-helixtrans-61.8-43177.8-171.3-103000111.9V109 L253 E293 A294 Y301V109-F297 HydrophobicContact CG1-CD1 4.1Å; V109-F297 HydrophobicContact CG1-CE1 4.28Å; L253-F297 HydrophobicContact CD2-CD1 4.1Å; E293-F297 WeakPolarHBondContact O-CB 3.37Å; E293-F297 PolarHBondContact O-N 3.18Å; A294-F297 PolarHBondContact O-N 3.37Å; F297-Y301 VanDerWaalsContact O-CB 3.28Å; F297-Y301 WeakPolarHBondContact O-CB 3.09Å; F297-Y301 PolarHBondContact O-N 3.31Å
298I88.4Confident87.7Confident15 Ų1566.4 Ų66.48%0.07734%0.338CS..Hα-helixtrans-63.3-43.4173.6-73158.3000111.6M105 L108 V109 A294 G295 I296 Y301 K302M105-I298 HydrophobicContact CB-CD1 4.13Å; M105-I298 HydrophobicContact CG-CD1 4.24Å; M105-I298 HydrophobicContact SD-CD1 3.2Å; M105-I298 WeakPolarHBondContact SD-CD1 3.46Å; L108-I298 HydrophobicContact CB-CD1 3.72Å; L108-I298 HydrophobicContact CB-CG1 4.04Å; L108-I298 HydrophobicContact CB-CG2 4.24Å; L108-I298 HydrophobicContact CD1-CD1 3.81Å; L108-I298 HydrophobicContact CG-CD1 4.43Å; V109-I298 HydrophobicContact CG1-CB 4.33Å; V109-I298 HydrophobicContact CG1-CG1 3.44Å; V109-I298 VanDerWaalsContact CG1-CG1 3.44Å; A294-I298 WeakPolarHBondContact O-CD1 3.36Å; A294-I298 VanDerWaalsContact O-CG1 3.32Å; A294-I298 WeakPolarHBondContact O-CG1 3.13Å; A294-I298 PolarHBondContact O-N 3.44Å; G295-I298 PolarHBondContact O-N 3.41Å; I296-I298 PolarHBondContact O-N 3.12Å; I298-Y301 PolarHBondContact O-N 2.86Å; I298-K302 HydrophobicContact CG2-CD 4.07Å; I298-K302 HydrophobicContact CG2-CG 4.46Å; I298-K302 WeakPolarHBondContact O-CB 3.39Å; I298-K302 WeakPolarHBondContact O-CG 3.19Å; I298-K302 PolarHBondContact O-N 3.38Å
299L89.7Confident86.6Confident104 Ų10469 Ų6955%0.54535%0.352SS..Hα-helixtrans-63.5-48178.5-18060.7000110.8G295 I296 Y301 K302 L303G295-L299 WeakPolarHBondContact O-CB 3.41Å; G295-L299 PolarHBondContact O-N 3.39Å; I296-L299 PolarHBondContact O-N 3.41Å; L299-Y301 VanDerWaalsContact C-N 3.33Å; L299-Y301 PolarHBondContact O-N 3.49Å; L299-K302 PolarHBondContact O-N 2.88Å; L299-L303 HydrophobicContact CD1-CD1 4.21Å; L299-L303 HydrophobicContact CD1-CG 4.27Å; L299-L303 HydrophobicContact CG-CD1 4.08Å; L299-L303 WeakPolarHBondContact O-CB 3.35Å; L299-L303 VanDerWaalsContact O-CG 3.29Å; L299-L303 WeakPolarHBondContact O-CG 3.47Å; L299-L303 PolarHBondContact O-N 2.96Å
300A89.4Confident85.3Confident56 Ų5674.5 Ų74.546%0.46337%0.371SS..Hα-helixtrans-58.3-44.8175.700000111.6I296 L303 Y304I296-A300 WeakPolarHBondContact O-CB 3.16Å; I296-A300 PolarHBondContact O-N 2.95Å; A300-L303 PolarHBondContact O-N 2.9Å; A300-Y304 WeakPolarHBondContact O-CB 3.11Å; A300-Y304 PolarHBondContact O-N 3.39Å
301Y88.4Confident83.5Confident39 Ų3981.8 Ų81.815%0.15340%0.402CS..Hα-helixtrans-62.7-43.3176174.2-105.3000112.8V109 H110 F297 I298 L299 Y304 R305V109-Y301 VanDerWaalsContact C-CE1 3.44Å; V109-Y301 HydrophobicContact CB-CD1 3.86Å; V109-Y301 HydrophobicContact CB-CE1 4.14Å; V109-Y301 HydrophobicContact CB-CG 4.27Å; V109-Y301 HydrophobicContact CG1-CD1 4.13Å; V109-Y301 HydrophobicContact CG1-CG 4.41Å; V109-Y301 VanDerWaalsContact O-CE1 3.24Å; V109-Y301 WeakPolarHBondContact O-CE1 3.45Å; V109-Y301 VanDerWaalsContact O-CZ 3.26Å; V109-Y301 PolarHBondContact O-OH 3.46Å; H110-Y301 AromaticContact CD2-CE1 3.86Å; F297-Y301 VanDerWaalsContact O-CB 3.28Å; F297-Y301 WeakPolarHBondContact O-CB 3.09Å; F297-Y301 PolarHBondContact O-N 3.31Å; I298-Y301 PolarHBondContact O-N 2.86Å; L299-Y301 VanDerWaalsContact C-N 3.33Å; L299-Y301 PolarHBondContact O-N 3.49Å; Y301-Y304 PolarHBondContact O-N 3.42Å; Y301-R305 WeakPolarHBondContact O-CB 3.26Å; Y301-R305 PolarHBondContact O-N 3.27Å
302K88.4Confident81.6Confident110 Ų11085.2 Ų85.248%0.47843%0.425SS..Hα-helixtrans-66.1-39.2177-76.3-178.4177.2-177.20112.3I298 L299 K306I298-K302 HydrophobicContact CG2-CD 4.07Å; I298-K302 HydrophobicContact CG2-CG 4.46Å; I298-K302 WeakPolarHBondContact O-CB 3.39Å; I298-K302 WeakPolarHBondContact O-CG 3.19Å; I298-K302 PolarHBondContact O-N 3.38Å; L299-K302 PolarHBondContact O-N 2.88Å; K302-K306 VanDerWaalsContact O-CB 3.31Å; K302-K306 WeakPolarHBondContact O-CB 3.41Å; K302-K306 PolarHBondContact O-N 2.96Å
303L89.8Confident79.7Confident105 Ų10589 Ų8955%0.5544%0.439SS..Hα-helixtrans-65.3-45.2174.2-69.7172.5000111.3L299 A300 K306 E307L299-L303 HydrophobicContact CD1-CD1 4.21Å; L299-L303 HydrophobicContact CD1-CG 4.27Å; L299-L303 HydrophobicContact CG-CD1 4.08Å; L299-L303 WeakPolarHBondContact O-CB 3.35Å; L299-L303 VanDerWaalsContact O-CG 3.29Å; L299-L303 WeakPolarHBondContact O-CG 3.47Å; L299-L303 PolarHBondContact O-N 2.96Å; A300-L303 PolarHBondContact O-N 2.9Å; L303-K306 PolarHBondContact O-N 2.81Å; L303-E307 PolarHBondContact O-N 2.79Å
304Y87.6Confident77.5Confident158 Ų15892.2 Ų92.262%0.6246%0.462SS*.Hα-helixtrans-60.1-49.6174.9177.4-97.8000111.9A300 Y301 K306 E307 V308A300-Y304 WeakPolarHBondContact O-CB 3.11Å; A300-Y304 PolarHBondContact O-N 3.39Å; Y301-Y304 PolarHBondContact O-N 3.42Å; Y304-K306 VanDerWaalsContact C-N 3.32Å; Y304-K306 PolarHBondContact O-N 3.03Å; Y304-E307 PolarHBondContact O-N 3.37Å; Y304-V308 HydrophobicContact CD1-CG2 4.25Å; Y304-V308 HydrophobicContact CD2-CG2 4.17Å; Y304-V308 HydrophobicContact CE1-CG2 3.85Å; Y304-V308 HydrophobicContact CE2-CG2 3.76Å; Y304-V308 HydrophobicContact CG-CG2 4.4Å; Y304-V308 WeakPolarHBondContact O-CG2 3.34Å; Y304-V308 PolarHBondContact O-N 2.76Å
305R85Confident75.4Confident94 Ų94100.9 Ų100.936%0.35550%0.504SS..Hα-helixtrans-58.1-44.1176.9-172-179.2-176-149.7-3.4111H110 Y301 L309H110-R305 PolarHBondContact NE2-NH1 2.89Å; Y301-R305 WeakPolarHBondContact O-CB 3.26Å; Y301-R305 PolarHBondContact O-N 3.27Å; R305-L309 HydrophobicContact CG-CD1 3.82Å; R305-L309 HydrophobicContact CG-CG 4.32Å; R305-L309 WeakPolarHBondContact O-CB 3.43Å; R305-L309 VanDerWaalsContact O-CG 3.26Å; R305-L309 WeakPolarHBondContact O-CG 3.32Å; R305-L309 PolarHBondContact O-N 3.27Å
306K84.3Confident73.1Confident151 Ų151108 Ų10866%0.65753%0.531SS*.Hα-helixtrans-61.6-43.1177.8-174.1179-179.9-178.30112.1K302 L303 Y304 R310K302-K306 VanDerWaalsContact O-CB 3.31Å; K302-K306 WeakPolarHBondContact O-CB 3.41Å; K302-K306 PolarHBondContact O-N 2.96Å; L303-K306 PolarHBondContact O-N 2.81Å; Y304-K306 VanDerWaalsContact C-N 3.32Å; Y304-K306 PolarHBondContact O-N 3.03Å; K306-R310 WeakPolarHBondContact O-CB 3.38Å; K306-R310 PolarHBondContact O-N 2.93Å
307E82.8Confident70.6Confident80 Ų80110.1 Ų110.137%0.37454%0.543SS..Hα-helixtrans-74.6-37.3-178.3-170.661.4-174.600112.9L303 Y304 R310 K311L303-E307 PolarHBondContact O-N 2.79Å; Y304-E307 PolarHBondContact O-N 3.37Å; E307-R310 VanDerWaalsContact CD-NH2 3.26Å; E307-R310 PolarHBondContact O-N 2.83Å; E307-R310 IonicContact OE1-CZ 2.65Å; E307-R310 IonicContact OE1-NH2 3.33Å; E307-R310 PolarHBondContact OE1-NH2 3.3Å; E307-R310 IonicContact OE2-CZ 3.41Å; E307-R310 VanDerWaalsContact OE2-CZ 3.24Å; E307-R310 IonicContact OE2-NE 2.72Å; E307-R310 PolarHBondContact OE2-NE 2.91Å; E307-R310 IonicContact OE2-NH2 3.42Å; E307-R310 PolarHBondContact OE2-NH2 2.89Å; E307-K311 WeakPolarHBondContact O-CB 3.35Å; E307-K311 PolarHBondContact O-N 3.5Å
308V79.1Confident68.3Low62 Ų62109.5 Ų109.538%0.37656%0.559SS.*Hα-helixtrans-66.2-47.5174.7173.10000111Y304 R310 K311 S312Y304-V308 HydrophobicContact CD1-CG2 4.25Å; Y304-V308 HydrophobicContact CD2-CG2 4.17Å; Y304-V308 HydrophobicContact CE1-CG2 3.85Å; Y304-V308 HydrophobicContact CE2-CG2 3.76Å; Y304-V308 HydrophobicContact CG-CG2 4.4Å; Y304-V308 WeakPolarHBondContact O-CG2 3.34Å; Y304-V308 PolarHBondContact O-N 2.76Å; V308-R310 VanDerWaalsContact C-N 3.3Å; V308-R310 PolarHBondContact O-N 3.35Å; V308-K311 PolarHBondContact O-N 3.25Å; V308-S312 PolarHBondContact O-N 2.93Å; V308-S312 PolarHBondContact O-OG 3.49Å
309L61.8Low66.1Low100 Ų100111.7 Ų111.752%0.52459%0.586SS.*Hα-helixtrans-61.3-39.2176.4-71174.1000111.9R305 K311 S312R305-L309 HydrophobicContact CG-CD1 3.82Å; R305-L309 HydrophobicContact CG-CG 4.32Å; R305-L309 WeakPolarHBondContact O-CB 3.43Å; R305-L309 VanDerWaalsContact O-CG 3.26Å; R305-L309 WeakPolarHBondContact O-CG 3.32Å; R305-L309 PolarHBondContact O-N 3.27Å; L309-K311 VanDerWaalsContact C-N 3.28Å; L309-K311 PolarHBondContact O-N 2.92Å; L309-S312 PolarHBondContact O-N 3.49Å
310R61.5Low63.7Low164 Ų164113.7 Ų113.762%0.61960%0.602SS**Hα-helixtrans-66.7-26.8174.9-170.4172.1751183.6113.2K306 E307 V308K306-R310 WeakPolarHBondContact O-CB 3.38Å; K306-R310 PolarHBondContact O-N 2.93Å; E307-R310 VanDerWaalsContact CD-NH2 3.26Å; E307-R310 PolarHBondContact O-N 2.83Å; E307-R310 IonicContact OE1-CZ 2.65Å; E307-R310 IonicContact OE1-NH2 3.33Å; E307-R310 PolarHBondContact OE1-NH2 3.3Å; E307-R310 IonicContact OE2-CZ 3.41Å; E307-R310 VanDerWaalsContact OE2-CZ 3.24Å; E307-R310 IonicContact OE2-NE 2.72Å; E307-R310 PolarHBondContact OE2-NE 2.91Å; E307-R310 IonicContact OE2-NH2 3.42Å; E307-R310 PolarHBondContact OE2-NH2 2.89Å; V308-R310 VanDerWaalsContact C-N 3.3Å; V308-R310 PolarHBondContact O-N 3.35Å
311K54.9Low61.4Low157 Ų157113.9 Ų113.968%0.68360%0.6SS**Hα-helixtrans-81.6-13.9175.1-100.7-173.7174.7-1780114.6E307 V308 L309 P314E307-K311 WeakPolarHBondContact O-CB 3.35Å; E307-K311 PolarHBondContact O-N 3.5Å; V308-K311 PolarHBondContact O-N 3.25Å; L309-K311 VanDerWaalsContact C-N 3.28Å; L309-K311 PolarHBondContact O-N 2.92Å; K311-P314 WeakPolarHBondContact O-CD 3.23Å
312S47.4Very low59.3Low96 Ų96118.5 Ų118.567%0.67163%0.627SS**THydrogen-bonded Turntrans-79.1-6.6171.6-59.70000113.4V308 L309 P314V308-S312 PolarHBondContact O-N 2.93Å; V308-S312 PolarHBondContact O-OG 3.49Å; L309-S312 PolarHBondContact O-N 3.49Å; S312-P314 VanDerWaalsContact C-CD 3.4Å
313D47.3Very low57.3Low124 Ų124120 Ų12066%0.66364%0.639SS**  trans-108.330.2-172.2-1365.5000116.8
314P46.3Very low55.1Low91 Ų91119.1 Ų119.159%0.59164%0.638SS**SBendtrans-107.4125.8159.334.9-26.7000111.6K311 S312K311-P314 WeakPolarHBondContact O-CD 3.23Å; S312-P314 VanDerWaalsContact C-CD 3.4Å
315M43.6Very low53.1Low183 Ų183118.6 Ų118.690%0.90164%0.636SS**  trans81.370177.1-51.7-76.6-175.500116.6
316M39.2Very low51Low182 Ų182119.6 Ų119.690%0.89765%0.645SS**  trans-127.696.7142.6-84.9-64.917500109.5
317D39.7Very low48.7Very low163 Ų163121 Ų12187%0.87265%0.646SS**  trans-76.6145.5162.8-17822.6000109.2
318G39.3Very low46.6Very low66 Ų66123.6 Ų123.668%0.6866%0.656SS**SBendtrans82.536.9156.800000120.7
319G42.3Very low44.8Very low61 Ų61128.5 Ų128.563%0.62967%0.668SS**  trans76.8-179.415400000118.8
320V40.3Very low43.7Very low145 Ų145128.1 Ų128.188%0.87967%0.666SS**  trans68.235.2-175.6-154.90000114.7
321S41.5Very low42.9Very low61 Ų61126.6 Ų126.643%0.42767%0.666SS.*  trans-120.226.3177.8610000115.6Y325S321-Y325 WeakPolarHBondContact O-CD2 3.45Å; S321-Y325 WeakPolarHBondContact O-CE2 3.34Å
322D43.3Very low42.2Very low135 Ų135124.9 Ų124.972%0.72266%0.664SS**SBendtrans-88-35.8171.9-84.8-49.4000113.5T324 Y325 Q326D322-T324 PolarHBondContact O-N 2.66Å; D322-Y325 PolarHBondContact O-N 3.36Å; D322-Q326 PolarHBondContact O-N 2.97Å
323I47.6Very low41.8Very low141 Ų141126.5 Ų126.572%0.72367%0.665SS**Hα-helixtrans-67.7-37-170.5-57.2175.6000112
324T42.3Very low40.9Very low87 Ų87128.7 Ų128.753%0.53467%0.671SS.*Hα-helixtrans-71.2-35.1177.7-530000112.2D322 F328D322-T324 PolarHBondContact O-N 2.66Å; T324-F328 HydrophobicContact CG2-CD2 4.08Å; T324-F328 HydrophobicContact CG2-CE2 4.26Å; T324-F328 PolarHBondContact O-N 3.46Å
325Y46.6Very low40.3Very low147 Ų147129.8 Ų129.858%0.57668%0.678SS**Hα-helixtrans-70.1-37-177.1-83-111.2000112.1S321 D322 R329S321-Y325 WeakPolarHBondContact O-CD2 3.45Å; S321-Y325 WeakPolarHBondContact O-CE2 3.34Å; D322-Y325 PolarHBondContact O-N 3.36Å; Y325-R329 WeakPolarHBondContact O-CB 3.23Å; Y325-R329 PolarHBondContact O-N 3.26Å; Y325-R329 VanDerWaalsContact O-N 3.16Å
326Q40Very low39.9Very low116 Ų116126.8 Ų126.854%0.54268%0.675SS.*Hα-helixtrans-68.7-42.5178.8-153.2158.1-10.700111D322 F328 R329 D330D322-Q326 PolarHBondContact O-N 2.97Å; Q326-F328 PolarHBondContact O-N 3.34Å; Q326-R329 PolarHBondContact O-N 3.03Å; Q326-D330 WeakPolarHBondContact O-CB 3.4Å; Q326-D330 VanDerWaalsContact O-CG 3.29Å; Q326-D330 PolarHBondContact O-N 2.85Å
327R36.8Very low39.5Very low180 Ų180124.9 Ų124.968%0.67966%0.659SS**Hα-helixtrans-61.7-45.5178.8-160.9172.4-170141.34.2113.4E331R327-E331 IonicContact NE-OE1 3.95Å; R327-E331 WeakPolarHBondContact O-CB 3.38Å; R327-E331 WeakPolarHBondContact O-CG 3.29Å; R327-E331 PolarHBondContact O-N 2.8Å
328F38.8Very low39.2Very low134 Ų134121 Ų12159%0.58866%0.657SS**Hα-helixtrans-66.3-35.8175.3-93.6-79.3000113.1T324 Q326 D332T324-F328 HydrophobicContact CG2-CD2 4.08Å; T324-F328 HydrophobicContact CG2-CE2 4.26Å; T324-F328 PolarHBondContact O-N 3.46Å; Q326-F328 PolarHBondContact O-N 3.34Å; F328-D332 WeakPolarHBondContact O-CB 3.33Å; F328-D332 PolarHBondContact O-N 2.92Å; F328-D332 VanDerWaalsContact O-N 3.12Å
329R39.9Very low38.6Very low165 Ų165122.1 Ų122.162%0.62366%0.66SS**Hα-helixtrans-73.2-33.7179.8-164.3177.871.3-176.20.4112.4Y325 Q326 L333Y325-R329 WeakPolarHBondContact O-CB 3.23Å; Y325-R329 PolarHBondContact O-N 3.26Å; Y325-R329 VanDerWaalsContact O-N 3.16Å; Q326-R329 PolarHBondContact O-N 3.03Å; R329-L333 VanDerWaalsContact O-CB 3.25Å; R329-L333 WeakPolarHBondContact O-CB 3.39Å; R329-L333 PolarHBondContact O-N 3.19Å
330D39.8Very low37.9Very low92 Ų92125.8 Ų125.849%0.49267%0.67SS.*Hα-helixtrans-78.9-30.4178.7-63-20.2000111.4Q326Q326-D330 WeakPolarHBondContact O-CB 3.4Å; Q326-D330 VanDerWaalsContact O-CG 3.29Å; Q326-D330 PolarHBondContact O-N 2.85Å
331E43.8Very low37.2Very low132 Ų132124.3 Ų124.362%0.61766%0.662SS**Hα-helixtrans-71.3-34.8171.4-74.4174.5176.100113.4R327 L333R327-E331 IonicContact NE-OE1 3.95Å; R327-E331 WeakPolarHBondContact O-CB 3.38Å; R327-E331 WeakPolarHBondContact O-CG 3.29Å; R327-E331 PolarHBondContact O-N 2.8Å; E331-L333 VanDerWaalsContact C-N 3.32Å; E331-L333 PolarHBondContact O-N 3.39Å
332D41.4Very low36.7Very low121 Ų121127.4 Ų127.465%0.64768%0.677SS**THydrogen-bonded Turntrans-79.5-6.4177.6-96.7-10000113.9F328F328-D332 WeakPolarHBondContact O-CB 3.33Å; F328-D332 PolarHBondContact O-N 2.92Å; F328-D332 VanDerWaalsContact O-N 3.12Å
333L37.8Very low35.9Very low130 Ų130125.7 Ų125.768%0.68168%0.676SS**THydrogen-bonded Turntrans-122.120.1-168.9-14486000115.7R329 E331 P335R329-L333 VanDerWaalsContact O-CB 3.25Å; R329-L333 WeakPolarHBondContact O-CB 3.39Å; R329-L333 PolarHBondContact O-N 3.19Å; E331-L333 VanDerWaalsContact C-N 3.32Å; E331-L333 PolarHBondContact O-N 3.39Å; L333-P335 WeakPolarHBondContact O-CD 3.37Å
334E28.1Very low34.9Very low171 Ų171125.9 Ų125.980%0.79968%0.678SS**  trans-82.6105.4158.8-79.4-153.7144.600110.8S336E334-S336 PolarHBondContact O-N 3.01Å
335P35.5Very low34.4Very low114 Ų114127.3 Ų127.374%0.7469%0.689SS**  trans-70.2101.8162.130.4-32.7000107.7L333 Y337L333-P335 WeakPolarHBondContact O-CD 3.37Å; P335-Y337 PolarHBondContact O-N 3.46Å
336S33.7Very low33.7Very low119 Ų119127.9 Ų127.983%0.83270%0.702SS**  trans-67.182.5173.2-160.50000110.5E334E334-S336 PolarHBondContact O-N 3.01Å
337Y30.9Very low33.2Very low143 Ų143128.2 Ų128.256%0.56171%0.712SS**  trans-125.6119.8165.8-117-87.1000105.9D182 P335 A339D182-Y337 WeakPolarHBondContact OD1-CE1 3.34Å; D182-Y337 PolarHBondContact OD1-OH 2.84Å; P335-Y337 PolarHBondContact O-N 3.46Å; Y337-A339 PolarHBondContact O-N 3.14Å
338G32.9Very low32.9Very low80 Ų80127.1 Ų127.183%0.82572%0.719SS**  trans-59131.6-150.700000116.8
339A26.8Very low32.5Very low90 Ų90126.9 Ų126.974%0.74473%0.728SS**  trans-123.893.6154.200000108.6Y337 T341Y337-A339 PolarHBondContact O-N 3.14Å; A339-T341 PolarHBondContact O-N 2.74Å; A339-T341 VanDerWaalsContact O-N 3.12Å
340V28.7Very low32Very low138 Ų138126.3 Ų126.384%0.83674%0.736SS**  trans-76.695167.6176.90000107.5V342V340-V342 PolarHBondContact O-N 3.21Å
341T26.2Very low31.7Very low115 Ų115130.8 Ų130.871%0.70675%0.754SS**  trans-77.8110.8163.640.60000108.4A339 S343A339-T341 PolarHBondContact O-N 2.74Å; A339-T341 VanDerWaalsContact O-N 3.12Å; T341-S343 PolarHBondContact O-N 3.05Å; T341-S343 VanDerWaalsContact O-N 3.08Å
342V29.1Very low31.3Very low125 Ų125130.2 Ų130.276%0.75876%0.762SS**  trans-68.1105.5168178.20000107.1V340V340-V342 PolarHBondContact O-N 3.21Å
343S28.1Very low31Very low100 Ų100130.1 Ų130.170%0.69977%0.77SS**  trans-91.1110173.9-610000109.1T341T341-S343 PolarHBondContact O-N 3.05Å; T341-S343 VanDerWaalsContact O-N 3.08Å
344D26.7Very low31.1Very low144 Ų144129.2 Ų129.277%0.7777%0.771SS**  trans-57.9127.7174.6-84.5-55.9000111.1N346D344-N346 VanDerWaalsContact C-N 3.34Å; D344-N346 PolarHBondContact O-N 3.33Å
345P31.8Very low32Very low117 Ų117127.2 Ų127.276%0.7677%0.773SS**SBendtrans-86.370.1-177.735-35.2000111.1
346N31.5Very low32.2Very low159 Ų159129.2 Ų129.285%0.8578%0.778SS**  trans-166.460.5168.2-105.1-23.9000115.9D344D344-N346 VanDerWaalsContact C-N 3.34Å; D344-N346 PolarHBondContact O-N 3.33Å
347T28.8Very low32.9Very low123 Ų123129 Ų12976%0.75577%0.773SS**  trans-141.6100.9161.8-35.30000111.8V349T347-V349 HydrophobicContact CG2-CG2 4.15Å; T347-V349 PolarHBondContact O-N 2.96Å
348I30.1Very low33.4Very low158 Ų158128.4 Ų128.481%0.8179%0.785SS**  trans-80.9105.4166.1-58.5174.9000107.2L350I348-L350 HydrophobicContact CG2-CG 4.45Å; I348-L350 PolarHBondContact O-N 2.89Å
349V30.8Very low34Very low129 Ų129130.6 Ų130.678%0.78279%0.785SS**  trans-84.3106172.2-178.40000108.1T347T347-V349 HydrophobicContact CG2-CG2 4.15Å; T347-V349 PolarHBondContact O-N 2.96Å
350L29.4Very low34.8Very low153 Ų153136.6 Ų136.680%0.80181%0.812SS**PPolyproline II helixtrans-79.3124.2171.2-80.9160.4000109.7I348I348-L350 HydrophobicContact CG2-CG 4.45Å; I348-L350 PolarHBondContact O-N 2.89Å
351E33.9Very low35.2Very low186 Ų186136.6 Ų136.687%0.86981%0.81SS**PPolyproline II helixtrans-80.5127.1174-155.8172.5-174.100109.6C353E351-C353 PolarHBondContact O-N 3.21Å
352P35.2Very low35.6Very low120 Ų120137.7 Ų137.778%0.77982%0.816SS**PPolyproline II helixtrans-78.2121-177.828.9-31.9000111.5
353C34.8Very low36Very low119 Ų119138.4 Ų138.480%0.80482%0.819SS**PPolyproline II helixtrans-65.3136.5175.1-163.10000111.2E351E351-C353 PolarHBondContact O-N 3.21Å
354P41Very low36.4Very low110 Ų110140.6 Ų140.671%0.71483%0.826SS**PPolyproline II helixtrans-68.9152176.628.7-35.2000112.2
355P45.4Very low37.1Very low130 Ų130140.4 Ų140.484%0.84483%0.83SS**PPolyproline II helixtrans-76.6136.9-176.430.4-34.7000113.1
356D39.5Very low37.4Very low156 Ų156142 Ų14283%0.83483%0.834SS**PPolyproline II helixtrans-68.1147.6172.5-103.9-35.9000112.4
357P48.8Very low37.8Very low114 Ų114140.8 Ų140.874%0.7483%0.833SS**PPolyproline II helixtrans-76.9131.8176.631-32.7000112.1
358T41.8Very low38.5Very low131 Ų131142.2 Ų142.280%0.80484%0.839SS**PPolyproline II helixtrans-66.6131.9174.748.30000112.4
359P45.7Very low39.2Very low126 Ų126140.8 Ų140.882%0.81884%0.842SS**PPolyproline II helixtrans-80.6155.7165.131.3-28.5000111.9
360V44.4Very low40Very low216 Ų216141.9 Ų141.9100%1.30985%0.847SS**  trans-85.90179.1178.60000111.3

Retrieved 360 of 360 residues in 450.4 ms (Link to these results)