A0A087YGF5_POEFO Loading...

Eva-1 homolog C

AlphaFold DB , UniProt , Accession A0A087YGF5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 421 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
1M34.7Very low36Very low230 Ų230176.8 Ų176.8100%1.13385%0.852SS**  01420-6579.4173.300107.3
2R34.3Very low36.7Very low239 Ų239167.7 Ų167.790%0.90284%0.839SS**  54124.965.2-74.9-171.3-175.9-1782.3110.6
3V32.8Very low37.4Very low134 Ų134164.7 Ų164.781%0.81283%0.826SS**  cis-138.6169.612.7-176.60000111
4M36.3Very low38.3Very low166 Ų166160.5 Ų160.582%0.81881%0.808SS**  trans-61160.5176.9-60.9158.2156.900115.7
5S28.7Very low39Very low114 Ų114164.3 Ų164.380%0.79781%0.809SS**  trans-142.6141.9136.4-172.70000109.8
6W33.8Very low40Very low218 Ų218158.6 Ų158.683%0.82679%0.79SS**  trans-113128.4178.1-97.424.2000109.7
7T37Very low40.8Very low138 Ų138155.9 Ų155.985%0.84777%0.774SS**  trans-111.4120.6162.543.60000109.3
8R38.1Very low41.8Very low213 Ų213151.2 Ų151.280%0.80476%0.759SS**  trans-75.4141.7-178.6-67.8177.5174178.1-3.3110.9
9P37.9Very low42.7Very low110 Ų110148.9 Ų148.971%0.71475%0.749SS**  trans-72132.5166.630.4-32.9000110.5H11P9-H11 PolarHBondContact O-N 3.41Å; P9-H11 VanDerWaalsContact O-N 3.16Å
10F35.8Very low43.7Very low215 Ų215148.1 Ų148.194%0.94374%0.74SS**  trans-8380.3171.9-103.8-90.7000110.3
11H46.6Very low44.6Very low168 Ų168148.6 Ų148.678%0.77874%0.735SS**  trans-76.7126.9162-94.7-65.7000109.4P9P9-H11 PolarHBondContact O-N 3.41Å; P9-H11 VanDerWaalsContact O-N 3.16Å
12G44.8Very low45.8Very low67 Ų67142.3 Ų142.369%0.69171%0.705SS**  trans174.8-8.4176.400000119.3
13L45.6Very low47.2Very low129 Ų129134.4 Ų134.468%0.67568%0.684SS**SBendtrans-118.4-18.8-174.2-106.276.4000116.7W15 S16L13-W15 PolarHBondContact O-N 2.9Å; L13-S16 PolarHBondContact O-OG 2.65Å
14D50.6Low48.5Very low106 Ų106131.8 Ų131.857%0.56767%0.665SS**Hα-helixtrans-71.1-27.6-168.8-57.9-64.9000115H17 S18D14-H17 PolarHBondContact O-N 3.41Å; D14-S18 VanDerWaalsContact O-CB 3.28Å; D14-S18 WeakPolarHBondContact O-CB 3.49Å; D14-S18 PolarHBondContact O-N 3.46Å
15W47.8Very low49.5Very low218 Ų218128.8 Ų128.883%0.82665%0.651SS**Hα-helixtrans-70.4-36.8-170.2-79.848.9000113.2L13 L19L13-W15 PolarHBondContact O-N 2.9Å; W15-L19 WeakPolarHBondContact O-CB 3.29Å; W15-L19 VanDerWaalsContact O-CG 3.29Å; W15-L19 WeakPolarHBondContact O-CG 3.25Å; W15-L19 PolarHBondContact O-N 3.36Å
16S55.8Low50.9Low73 Ų73128.3 Ų128.351%0.5164%0.639SS.*Hα-helixtrans-67.4-44.4177.355.60000111.5L13 F20L13-S16 PolarHBondContact O-OG 2.65Å; S16-F20 VanDerWaalsContact O-CB 3.31Å; S16-F20 WeakPolarHBondContact O-CB 3.28Å; S16-F20 PolarHBondContact O-N 2.96Å
17H53Low51.9Low112 Ų112126.2 Ų126.252%0.51963%0.631SS.*Hα-helixtrans-64.9-44.4175.7-72.6-77.3000111.7D14 L19 F20 Y21D14-H17 PolarHBondContact O-N 3.41Å; H17-L19 PolarHBondContact O-N 2.9Å; H17-F20 PolarHBondContact O-N 2.72Å; H17-Y21 WeakPolarHBondContact O-CD2 3.23Å; H17-Y21 PolarHBondContact O-N 2.68Å
18S58.9Low52.7Low71 Ų71122.7 Ų122.750%0.49761%0.61SS.*Hα-helixtrans-58.3-47.5176.6-174.50000112.1D14 F20 Y21 L22D14-S18 VanDerWaalsContact O-CB 3.28Å; D14-S18 WeakPolarHBondContact O-CB 3.49Å; D14-S18 PolarHBondContact O-N 3.46Å; S18-F20 PolarHBondContact O-N 3.04Å; S18-Y21 PolarHBondContact O-N 3.44Å; S18-L22 PolarHBondContact O-N 2.96Å
19L59.1Low53.3Low108 Ų108122 Ų12257%0.56561%0.607SS**Hα-helixtrans-64.5-39.3176.2-71.9169.4000112.7W15 H17 L22 T23W15-L19 WeakPolarHBondContact O-CB 3.29Å; W15-L19 VanDerWaalsContact O-CG 3.29Å; W15-L19 WeakPolarHBondContact O-CG 3.25Å; W15-L19 PolarHBondContact O-N 3.36Å; H17-L19 PolarHBondContact O-N 2.9Å; L19-L22 PolarHBondContact O-N 2.88Å; L19-T23 PolarHBondContact O-N 3.5Å; L19-T23 PolarHBondContact O-OG1 2.99Å
20F62.2Low53.7Low133 Ų133124.8 Ų124.858%0.58360%0.603SS**Hα-helixtrans-67.2-38.7177.5-169-101.1000112.4S16 H17 S18 T23 L24S16-F20 VanDerWaalsContact O-CB 3.31Å; S16-F20 WeakPolarHBondContact O-CB 3.28Å; S16-F20 PolarHBondContact O-N 2.96Å; H17-F20 PolarHBondContact O-N 2.72Å; S18-F20 PolarHBondContact O-N 3.04Å; F20-T23 PolarHBondContact O-OG1 3.14Å; F20-T23 VanDerWaalsContact O-OG1 3.07Å; F20-L24 HydrophobicContact CD1-CD1 3.81Å; F20-L24 HydrophobicContact CE1-CD1 3.49Å; F20-L24 VanDerWaalsContact CE1-CD1 3.49Å; F20-L24 HydrophobicContact CZ-CD1 4.16Å; F20-L24 WeakPolarHBondContact O-CB 3.45Å; F20-L24 PolarHBondContact O-N 3.45Å; F20-L24 VanDerWaalsContact O-N 3.07Å
21Y63.9Low54.1Low158 Ų158119.5 Ų119.562%0.6258%0.583SS**Hα-helixtrans-65.4-39.7170.2-89.6-76.8000111.8H17 S18 L24 L25H17-Y21 WeakPolarHBondContact O-CD2 3.23Å; H17-Y21 PolarHBondContact O-N 2.68Å; S18-Y21 PolarHBondContact O-N 3.44Å; Y21-L24 PolarHBondContact O-N 3.24Å; Y21-L25 WeakPolarHBondContact O-CB 3.25Å; Y21-L25 WeakPolarHBondContact O-CD1 3.39Å; Y21-L25 VanDerWaalsContact O-CG 3.24Å; Y21-L25 WeakPolarHBondContact O-CG 3.5Å; Y21-L25 PolarHBondContact O-N 3.13Å
22L58.1Low54.1Low98 Ų98116.3 Ų116.351%0.51357%0.572SS.*Hα-helixtrans-62.2-44.6176.6-127.587.7000112S18 L19 L25 L26S18-L22 PolarHBondContact O-N 2.96Å; L19-L22 PolarHBondContact O-N 2.88Å; L22-L25 PolarHBondContact O-N 2.71Å; L22-L26 WeakPolarHBondContact O-CB 3.28Å; L22-L26 VanDerWaalsContact O-CG 3.29Å; L22-L26 WeakPolarHBondContact O-CG 3.24Å; L22-L26 PolarHBondContact O-N 3.15Å
23T63.9Low54Low74 Ų74115 Ų11545%0.45456%0.557SS.*Hα-helixtrans-68.1-36.9178.554.60000112.1L19 F20 L26 W27L19-T23 PolarHBondContact O-N 3.5Å; L19-T23 PolarHBondContact O-OG1 2.99Å; F20-T23 PolarHBondContact O-OG1 3.14Å; F20-T23 VanDerWaalsContact O-OG1 3.07Å; T23-L26 PolarHBondContact O-N 3.41Å; T23-W27 WeakPolarHBondContact O-CB 3.45Å; T23-W27 PolarHBondContact O-N 3.38Å
24L61.7Low53.7Low79 Ų79113.7 Ų113.741%0.41455%0.551SS.*Hα-helixtrans-62.1-42.8170.7-101.7154.9000112.9F20 Y21 L26 W27 T28F20-L24 HydrophobicContact CD1-CD1 3.81Å; F20-L24 HydrophobicContact CE1-CD1 3.49Å; F20-L24 VanDerWaalsContact CE1-CD1 3.49Å; F20-L24 HydrophobicContact CZ-CD1 4.16Å; F20-L24 WeakPolarHBondContact O-CB 3.45Å; F20-L24 PolarHBondContact O-N 3.45Å; F20-L24 VanDerWaalsContact O-N 3.07Å; Y21-L24 PolarHBondContact O-N 3.24Å; L24-L26 VanDerWaalsContact C-N 3.34Å; L24-W27 PolarHBondContact O-N 3.11Å; L24-T28 WeakPolarHBondContact O-CB 3.33Å; L24-T28 WeakPolarHBondContact O-CG2 3.32Å; L24-T28 PolarHBondContact O-N 3.17Å; L24-T28 PolarHBondContact O-OG1 3.42Å
25L57.2Low53.3Low102 Ų102111.6 Ų111.653%0.53455%0.548SS..Hα-helixtrans-68.5-32.3177.4-72.9165.5000112.3Y21 L22 T28 R29Y21-L25 WeakPolarHBondContact O-CB 3.25Å; Y21-L25 WeakPolarHBondContact O-CD1 3.39Å; Y21-L25 VanDerWaalsContact O-CG 3.24Å; Y21-L25 WeakPolarHBondContact O-CG 3.5Å; Y21-L25 PolarHBondContact O-N 3.13Å; L22-L25 PolarHBondContact O-N 2.71Å; L25-T28 WeakPolarHBondContact CA-OG1 3.46Å; L25-T28 PolarHBondContact O-OG1 3.25Å; L25-R29 WeakPolarHBondContact O-CB 3.39Å; L25-R29 VanDerWaalsContact O-CG 3.29Å; L25-R29 WeakPolarHBondContact O-CG 3.31Å; L25-R29 PolarHBondContact O-N 3.3Å
26L57.9Low53.3Low104 Ų104106.3 Ų106.355%0.54554%0.536SS..Hα-helixtrans-74.6-41.4172.8-71.1167.8000112.1L22 T23 L24 R30L22-L26 WeakPolarHBondContact O-CB 3.28Å; L22-L26 VanDerWaalsContact O-CG 3.29Å; L22-L26 WeakPolarHBondContact O-CG 3.24Å; L22-L26 PolarHBondContact O-N 3.15Å; T23-L26 PolarHBondContact O-N 3.41Å; L24-L26 VanDerWaalsContact C-N 3.34Å; L26-R30 WeakPolarHBondContact O-CB 3.31Å; L26-R30 PolarHBondContact O-N 3.29Å
27W53.5Low52.6Low175 Ų175107.2 Ų107.266%0.66353%0.531SS*.Hα-helixtrans-61.1-50.5174.9-98.955.7000111.9T23 L24 R29 R30 M31T23-W27 WeakPolarHBondContact O-CB 3.45Å; T23-W27 PolarHBondContact O-N 3.38Å; L24-W27 PolarHBondContact O-N 3.11Å; W27-R29 PolarHBondContact O-N 2.76Å; W27-R30 PolarHBondContact O-N 3.17Å; W27-R30 VanDerWaalsContact O-N 3.15Å; W27-M31 WeakPolarHBondContact O-CB 3.48Å; W27-M31 WeakPolarHBondContact O-CG 3.34Å; W27-M31 PolarHBondContact O-N 3.2Å
28T54.4Low52Low64 Ų64104.9 Ų104.939%0.39353%0.527SS..Hα-helixtrans-61.4-44.9179.248.10000111.8L24 L25 R30 M31 N32L24-T28 WeakPolarHBondContact O-CB 3.33Å; L24-T28 WeakPolarHBondContact O-CG2 3.32Å; L24-T28 PolarHBondContact O-N 3.17Å; L24-T28 PolarHBondContact O-OG1 3.42Å; L25-T28 WeakPolarHBondContact CA-OG1 3.46Å; L25-T28 PolarHBondContact O-OG1 3.25Å; T28-R30 VanDerWaalsContact C-N 3.33Å; T28-R30 PolarHBondContact O-N 2.73Å; T28-M31 PolarHBondContact O-N 2.9Å; T28-N32 WeakPolarHBondContact O-CB 3.35Å; T28-N32 PolarHBondContact O-N 2.87Å; T28-N32 PolarHBondContact O-OD1 3.04Å
29R50.6Low51.6Low199 Ų199105.1 Ų105.175%0.75152%0.523SS*.Hα-helixtrans-58.1-41172.6-78.8179.4170.7-170.6-1.9113L25 W27L25-R29 WeakPolarHBondContact O-CB 3.39Å; L25-R29 VanDerWaalsContact O-CG 3.29Å; L25-R29 WeakPolarHBondContact O-CG 3.31Å; L25-R29 PolarHBondContact O-N 3.3Å; W27-R29 PolarHBondContact O-N 2.76Å
30R46.6Very low51.1Low168 Ų168101.4 Ų101.463%0.63450%0.502SS*.Hα-helixtrans-75.4-31-178.9-155.3175.4-166.4-177.44.4113L26 W27 T28L26-R30 WeakPolarHBondContact O-CB 3.31Å; L26-R30 PolarHBondContact O-N 3.29Å; W27-R30 PolarHBondContact O-N 3.17Å; W27-R30 VanDerWaalsContact O-N 3.15Å; T28-R30 VanDerWaalsContact C-N 3.33Å; T28-R30 PolarHBondContact O-N 2.73Å
31M43.9Very low50.3Low104 Ų10495.5 Ų95.551%0.51248%0.476SS..Hα-helixtrans-74.9-40.7176-68.7-95.265.600112.3W27 T28 G33 L34 A35W27-M31 WeakPolarHBondContact O-CB 3.48Å; W27-M31 WeakPolarHBondContact O-CG 3.34Å; W27-M31 PolarHBondContact O-N 3.2Å; T28-M31 PolarHBondContact O-N 2.9Å; M31-G33 VanDerWaalsContact C-N 3.27Å; M31-G33 PolarHBondContact O-N 2.95Å; M31-L34 HydrophobicContact CE-CD1 3.99Å; M31-L34 PolarHBondContact O-N 3.34Å; M31-A35 PolarHBondContact O-N 3.27Å; M31-A35 VanDerWaalsContact O-N 3.12Å
32N46.3Very low49.6Very low101 Ų10190.1 Ų90.154%0.5446%0.461SS..Hα-helixtrans-56.8-42.5176.7-69.8-3.1000111.5T28 L34 A35 D36T28-N32 WeakPolarHBondContact O-CB 3.35Å; T28-N32 PolarHBondContact O-N 2.87Å; T28-N32 PolarHBondContact O-OD1 3.04Å; N32-L34 PolarHBondContact O-N 3.47Å; N32-L34 VanDerWaalsContact O-N 3.09Å; N32-A35 PolarHBondContact O-N 2.94Å; N32-D36 PolarHBondContact O-N 3.44Å; N32-D36 VanDerWaalsContact O-N 3.08Å
33G42.2Very low49.5Very low38 Ų3890.2 Ų90.239%0.39246%0.455SS..Hα-helixtrans-65.4-7176.500000115.8M31 F37M31-G33 VanDerWaalsContact C-N 3.27Å; M31-G33 PolarHBondContact O-N 2.95Å; G33-F37 WeakPolarHBondContact O-CD2 3.43Å; G33-F37 VanDerWaalsContact O-CE2 3.28Å; G33-F37 WeakPolarHBondContact O-CE2 3.44Å
34L40.9Very low49.1Very low103 Ų10388 Ų8854%0.53944%0.44SS..Hα-helixtrans-101.8-38.1170.1-74.5164.9000111.8M31 N32 D36 F37M31-L34 HydrophobicContact CE-CD1 3.99Å; M31-L34 PolarHBondContact O-N 3.34Å; N32-L34 PolarHBondContact O-N 3.47Å; N32-L34 VanDerWaalsContact O-N 3.09Å; L34-D36 VanDerWaalsContact C-N 3.27Å; L34-D36 PolarHBondContact O-N 3.12Å; L34-F37 PolarHBondContact O-N 3.05Å
35A41.1Very low48.7Very low61 Ų6188.8 Ų88.850%0.50444%0.443SS..Hα-helixtrans-65.2-27.1176.400000113.7M31 N32 F37 N39M31-A35 PolarHBondContact O-N 3.27Å; M31-A35 VanDerWaalsContact O-N 3.12Å; N32-A35 PolarHBondContact O-N 2.94Å; A35-F37 VanDerWaalsContact C-N 3.26Å; A35-F37 PolarHBondContact O-N 3.08Å; A35-N39 PolarHBondContact O-ND2 3.39Å
36D47.5Very low48.9Very low108 Ų10887.6 Ų87.658%0.57844%0.441SS*.Hα-helixtrans-62.3-28.3175.3-91.8-30.2000113.3N32 L34 N39 Y40N32-D36 PolarHBondContact O-N 3.44Å; N32-D36 VanDerWaalsContact O-N 3.08Å; L34-D36 VanDerWaalsContact C-N 3.27Å; L34-D36 PolarHBondContact O-N 3.12Å; D36-N39 PolarHBondContact O-N 3.14Å; D36-Y40 WeakPolarHBondContact O-CB 3.35Å; D36-Y40 PolarHBondContact O-N 2.96Å
37F42.1Very low49.8Very low92 Ų9285.2 Ų85.240%0.40443%0.433SS..Hα-helixtrans-74.8-30-170.4-80.5-69.7000115.2G33 L34 A35 Y40G33-F37 WeakPolarHBondContact O-CD2 3.43Å; G33-F37 VanDerWaalsContact O-CE2 3.28Å; G33-F37 WeakPolarHBondContact O-CE2 3.44Å; L34-F37 PolarHBondContact O-N 3.05Å; A35-F37 VanDerWaalsContact C-N 3.26Å; A35-F37 PolarHBondContact O-N 3.08Å; F37-Y40 HydrophobicContact CD1-CD2 4.42Å; F37-Y40 VanDerWaalsContact O-CB 3.24Å; F37-Y40 WeakPolarHBondContact O-CB 3.31Å; F37-Y40 PolarHBondContact O-N 3.36Å
38S39.5Very low51.2Low62 Ų6278.2 Ų78.243%0.43441%0.407SS..Hα-helixtrans-78.2-34.8172.8165.50000112Y40 S42 E251S38-Y40 PolarHBondContact O-N 2.92Å; S38-S42 PolarHBondContact O-OG 2.99Å; S38-S42 VanDerWaalsContact O-OG 3.12Å; S38-E251 VanDerWaalsContact CA-OE2 3.29Å; S38-E251 WeakPolarHBondContact CA-OE2 3.37Å; S38-E251 WeakPolarHBondContact CB-OE1 3.46Å; S38-E251 PolarHBondContact OG-OE1 3.32Å
39N50.3Low52.9Low76 Ų7679.1 Ų79.141%0.40642%0.416SS..Hα-helixtrans-62.7-26.6168.4-77.4-83.1000112.5A35 D36 S42 R43A35-N39 PolarHBondContact O-ND2 3.39Å; D36-N39 PolarHBondContact O-N 3.14Å; N39-S42 WeakPolarHBondContact CA-OG 3Å; N39-S42 PolarHBondContact O-OG 3.49Å; N39-R43 WeakPolarHBondContact O-CB 3.34Å; N39-R43 VanDerWaalsContact O-CD 3.31Å; N39-R43 WeakPolarHBondContact O-CD 3.04Å; N39-R43 WeakPolarHBondContact O-CG 3.28Å; N39-R43 PolarHBondContact O-N 3.43Å
40Y49.8Very low54.8Low31 Ų3170.4 Ų70.412%0.12239%0.387CS..Hα-helixtrans-61.8-48.3-176.6-162.5-62.3000112.2D36 F37 S38 I44 P63 R64 L248D36-Y40 WeakPolarHBondContact O-CB 3.35Å; D36-Y40 PolarHBondContact O-N 2.96Å; F37-Y40 HydrophobicContact CD1-CD2 4.42Å; F37-Y40 VanDerWaalsContact O-CB 3.24Å; F37-Y40 WeakPolarHBondContact O-CB 3.31Å; F37-Y40 PolarHBondContact O-N 3.36Å; S38-Y40 PolarHBondContact O-N 2.92Å; Y40-I44 HydrophobicContact CD1-CD1 3.66Å; Y40-I44 HydrophobicContact CE1-CD1 3.41Å; Y40-I44 VanDerWaalsContact CE1-CD1 3.41Å; Y40-P63 HydrophobicContact CD1-CB 4.3Å; Y40-P63 HydrophobicContact CD1-CG 3.85Å; Y40-P63 HydrophobicContact CD2-CB 3.78Å; Y40-P63 HydrophobicContact CD2-CG 4.23Å; Y40-P63 HydrophobicContact CE1-CB 4.13Å; Y40-P63 HydrophobicContact CE1-CG 3.77Å; Y40-P63 HydrophobicContact CE2-CB 3.63Å; Y40-P63 HydrophobicContact CE2-CG 4.2Å; Y40-P63 HydrophobicContact CG-CB 4.14Å; Y40-P63 HydrophobicContact CG-CG 4.08Å; Y40-R64 PolarHBondContact OH-O 2.96Å; Y40-L248 HydrophobicContact CD1-CD1 4.27Å; Y40-L248 HydrophobicContact CD1-CD2 3.46Å; Y40-L248 VanDerWaalsContact CD1-CD2 3.46Å; Y40-L248 HydrophobicContact CD1-CG 3.91Å; Y40-L248 HydrophobicContact CE1-CD1 3.81Å; Y40-L248 HydrophobicContact CE1-CD2 3.73Å; Y40-L248 HydrophobicContact CE1-CG 3.98Å
41L46.1Very low56.9Low9 Ų967.9 Ų67.95%0.04738%0.382CS..Hα-helixtrans-77.2-46.5-177.8-176.182000112.6R43 I44 I45 L248 E251 A252L41-R43 PolarHBondContact O-N 3.33Å; L41-R43 VanDerWaalsContact O-N 3.07Å; L41-I44 WeakPolarHBondContact O-CA 3.33Å; L41-I44 PolarHBondContact O-N 3.27Å; L41-I45 HydrophobicContact CD1-CD1 3.64Å; L41-I45 HydrophobicContact CD1-CG1 3.78Å; L41-I45 HydrophobicContact CD2-CD1 4.2Å; L41-I45 HydrophobicContact CG-CD1 4.12Å; L41-I45 HydrophobicContact CG-CG1 4.16Å; L41-I45 PolarHBondContact O-N 3Å; L41-L248 HydrophobicContact CB-CD2 3.94Å; L41-L248 HydrophobicContact CD1-CB 3.9Å; L41-L248 HydrophobicContact CD1-CD2 3.34Å; L41-L248 HydrophobicContact CD1-CG 4.25Å; L41-L248 WeakPolarHBondContact CD1-O 3.42Å; L41-L248 WeakPolarHBondContact CD2-O 3.2Å; L41-L248 HydrophobicContact CG-CD2 4.24Å; L41-E251 HydrophobicContact CB-CB 4.41Å; L41-E251 HydrophobicContact CD2-CB 3.55Å; L41-E251 HydrophobicContact CD2-CG 3.95Å; L41-E251 VanDerWaalsContact CD2-O 3.24Å; L41-E251 WeakPolarHBondContact CD2-O 3.39Å; L41-A252 HydrophobicContact CD1-CB 4.13Å; L41-A252 VanDerWaalsContact CD2-CA 3.43Å; L41-A252 HydrophobicContact CD2-CB 3.7Å
42S49.1Very low59.1Low44 Ų4463.2 Ų63.231%0.30836%0.36SS..Hα-helixtrans-51.3-37.5-178.946.60000110.8S38 N39 T46S38-S42 PolarHBondContact O-OG 2.99Å; S38-S42 VanDerWaalsContact O-OG 3.12Å; N39-S42 WeakPolarHBondContact CA-OG 3Å; N39-S42 PolarHBondContact O-OG 3.49Å; S42-T46 VanDerWaalsContact O-CB 3.28Å; S42-T46 WeakPolarHBondContact O-CB 3.4Å; S42-T46 WeakPolarHBondContact O-CG2 3.38Å; S42-T46 PolarHBondContact O-N 3.26Å; S42-T46 VanDerWaalsContact O-N 3.08Å; S42-T46 PolarHBondContact O-OG1 2.91Å
43R55.1Low61.2Low101 Ų10160.3 Ų60.338%0.38135%0.347SS..Hα-helixtrans-70.4-23.3172.7-67.4178.2174.3-1312.2116.5N39 L41 Q48N39-R43 WeakPolarHBondContact O-CB 3.34Å; N39-R43 VanDerWaalsContact O-CD 3.31Å; N39-R43 WeakPolarHBondContact O-CD 3.04Å; N39-R43 WeakPolarHBondContact O-CG 3.28Å; N39-R43 PolarHBondContact O-N 3.43Å; L41-R43 PolarHBondContact O-N 3.33Å; L41-R43 VanDerWaalsContact O-N 3.07Å; R43-Q48 HydrophobicContact CB-CG 4.49Å; R43-Q48 PolarHBondContact O-OE1 3.3Å
44I54.8Low63.3Low28 Ų2861.1 Ų61.114%0.14434%0.342CS..Hα-helixtrans-90.4-39.5180-83.2169.7000112.6Y40 L41 P63 C142 L248Y40-I44 HydrophobicContact CD1-CD1 3.66Å; Y40-I44 HydrophobicContact CE1-CD1 3.41Å; Y40-I44 VanDerWaalsContact CE1-CD1 3.41Å; L41-I44 WeakPolarHBondContact O-CA 3.33Å; L41-I44 PolarHBondContact O-N 3.27Å; I44-P63 HydrophobicContact CD1-CG 3.85Å; I44-P63 HydrophobicContact CG1-CG 4.32Å; I44-C142 HydrophobicContact CB-CB 4.5Å; I44-C142 HydrophobicContact CG1-CB 3.58Å; I44-C142 WeakPolarHBondContact CG1-O 3.46Å; I44-L248 HydrophobicContact CD1-CD2 3.92Å
45I53.7Low65.4Low94 Ų9459.3 Ų59.348%0.48235%0.349SS..Hα-helixtrans-93.3-41.3-177.5-65.4-167.4000112.6L41 A252L41-I45 HydrophobicContact CD1-CD1 3.64Å; L41-I45 HydrophobicContact CD1-CG1 3.78Å; L41-I45 HydrophobicContact CD2-CD1 4.2Å; L41-I45 HydrophobicContact CG-CD1 4.12Å; L41-I45 HydrophobicContact CG-CG1 4.16Å; L41-I45 PolarHBondContact O-N 3Å; I45-A252 HydrophobicContact CD1-CB 3.47Å; I45-A252 VanDerWaalsContact CD1-CB 3.47Å
46T61.3Low67.7Low78 Ų7859.4 Ų59.448%0.47934%0.344SS..SBendtrans-78155.7179.279.50000111.4S42 Q48S42-T46 VanDerWaalsContact O-CB 3.28Å; S42-T46 WeakPolarHBondContact O-CB 3.4Å; S42-T46 WeakPolarHBondContact O-CG2 3.38Å; S42-T46 PolarHBondContact O-N 3.26Å; S42-T46 VanDerWaalsContact O-N 3.08Å; S42-T46 PolarHBondContact O-OG1 2.91Å; T46-Q48 PolarHBondContact O-N 2.9Å
47S78Confident69.8Low54 Ų5457.2 Ų57.238%0.37834%0.335SS..  trans-78.3114.3174.2-133.90000109.3N139 K141S47-N139 VanDerWaalsContact CB-OD1 3.28Å; S47-N139 WeakPolarHBondContact CB-OD1 3.3Å; S47-N139 PolarHBondContact OG-ND2 3.19Å; S47-N139 PolarHBondContact OG-OD1 3.25Å; S47-K141 VanDerWaalsContact OG-CE 3.23Å; S47-K141 WeakPolarHBondContact OG-CE 3.29Å
48Q83Confident72.3Confident27 Ų2753 Ų5313%0.12632%0.316CS..EExtended strand (participates in β ladder)trans-84.9127.6-179.8-63.4-161-103.500111R43 T46 N139 Y140R43-Q48 HydrophobicContact CB-CG 4.49Å; R43-Q48 PolarHBondContact O-OE1 3.3Å; T46-Q48 PolarHBondContact O-N 2.9Å; Q48-N139 CarbonylContact O-C 3.5Å; Q48-N139 WeakPolarHBondContact O-CA 3.28Å; Q48-N139 PolarHBondContact O-OD1 3.27Å; Q48-Y140 HydrophobicContact CB-CD1 3.88Å; Q48-Y140 HydrophobicContact CB-CE1 3.54Å; Q48-Y140 HydrophobicContact CB-CE2 4.26Å; Q48-Y140 HydrophobicContact CB-CG 4.37Å; Q48-Y140 PolarHBondContact N-O 2.93Å; Q48-Y140 PolarHBondContact NE2-OH 3.43Å; Q48-Y140 VanDerWaalsContact O-CD1 3.24Å; Q48-Y140 WeakPolarHBondContact O-CD1 3.4Å; Q48-Y140 PolarHBondContact O-N 2.92Å
49S88.8Confident74.9Confident83 Ų8357.7 Ų57.758%0.5833%0.325SS*.EExtended strand (participates in β ladder)trans-93.1138.9164.757.80000111.4V138S49-V138 CarbonylContact C-O 3.59Å; S49-V138 VanDerWaalsContact CA-O 3.29Å; S49-V138 WeakPolarHBondContact CA-O 3.43Å
50A90.1Very high76.8Confident16 Ų1654.1 Ų54.113%0.13231%0.306CS..EExtended strand (participates in β ladder)trans-133.5153.2169.800000109.3L58 L60 V138 Y140A50-L58 HydrophobicContact CB-CD1 4.2Å; A50-L60 HydrophobicContact CB-CD2 3.66Å; A50-V138 PolarHBondContact N-O 2.9Å; A50-V138 PolarHBondContact O-N 2.79Å; A50-Y140 HydrophobicContact CB-CE1 3.89Å
51H90.9Very high78.8Confident115 Ų11555.7 Ų55.753%0.53231%0.314SS..EExtended strand (participates in β ladder)trans-145.1156177.862.7-89.9000112.2L82 L136H51-L82 HydrophobicContact CB-CD2 3.59Å; H51-L136 CarbonylContact C-O 3.5Å; H51-L136 WeakPolarHBondContact CA-O 3.43Å; H51-L136 WeakPolarHBondContact CB-O 3.43Å
52A90.9Very high80.5Confident7 Ų755.3 Ų55.36%0.05831%0.312CS..EExtended strand (participates in β ladder)trans-150.5155.8174.400000109.9L58 V119 Y135 L136A52-L58 HydrophobicContact CB-CB 4.06Å; A52-L58 HydrophobicContact CB-CD1 4.21Å; A52-V119 HydrophobicContact CB-CG2 3.72Å; A52-Y135 CarbonylContact O-C 3.45Å; A52-Y135 WeakPolarHBondContact O-CA 3.33Å; A52-L136 PolarHBondContact N-O 2.8Å; A52-L136 PolarHBondContact O-N 2.03Å
53C89.8Confident81.6Confident39 Ų3954.1 Ų54.126%0.26430%0.303SS..EExtended strand (participates in β ladder)trans-92.8157.4-178.4-54.50000110.4G55 T56 C83 V119C53-G55 PolarHBondContact O-N 3.39Å; C53-T56 HydrophobicContact CB-CG2 4.31Å; C53-T56 PolarHBondContact N-OG1 2.96Å; C53-T56 PolarHBondContact O-N 2.77Å; C53-T56 PolarHBondContact O-OG1 3Å; C53-C83 WeakPolarHBondContact CA-SG 3.27Å; C53-C83 HydrophobicContact CB-CB 3.7Å; C53-C83 WeakPolarHBondContact CB-SG 3.26Å; C53-C83 WeakPolarHBondContact SG-CB 3.13Å; C53-C83 CovalentContact SG-SG 2.03Å; C53-C83 PolarHBondContact SG-SG 3.18Å; C53-V119 WeakPolarHBondContact O-CB 3.48Å
54D86.7Confident82.2Confident55 Ų5557.6 Ų57.629%0.29432%0.316SS..THydrogen-bonded Turntrans-53.4126.6168.2-154.75.9000109.5Y75 S120 K134D54-Y75 PolarHBondContact OD1-OH 3.23Å; D54-Y75 PolarHBondContact OD2-OH 3.05Å; D54-S120 WeakPolarHBondContact OD1-CA 3.19Å; D54-K134 HydrophobicContact CB-CB 4.25Å; D54-K134 PolarHBondContact N-O 2.96Å; D54-K134 WeakPolarHBondContact OD2-CE 3Å; D54-K134 IonicContact OD2-NZ 2.99Å
55G84.8Confident83Confident66 Ų6660.9 Ų60.968%0.6833%0.331SS*.THydrogen-bonded Turntrans87.7-12.9-172.900000116.6C53 V119C53-G55 PolarHBondContact O-N 3.39Å; G55-V119 PolarHBondContact N-O 3.01Å
56T89.1Confident84.1Confident63 Ų6356.5 Ų56.539%0.38731%0.308SS..SBendtrans-103143.417668.60000112.4C53 L58 V119C53-T56 HydrophobicContact CB-CG2 4.31Å; C53-T56 PolarHBondContact N-OG1 2.96Å; C53-T56 PolarHBondContact O-N 2.77Å; C53-T56 PolarHBondContact O-OG1 3Å; T56-L58 PolarHBondContact O-N 2.84Å; T56-V119 VanDerWaalsContact O-CB 3.28Å; T56-V119 WeakPolarHBondContact O-CB 3.35Å; T56-V119 VanDerWaalsContact O-CG2 3.32Å; T56-V119 WeakPolarHBondContact O-CG2 3.42Å; T56-V119 PolarHBondContact O-N 2.89Å
57P92.1Very high85.3Confident61 Ų6153.6 Ų53.640%0.39629%0.291SS..EExtended strand (participates in β ladder)trans-76.8125.1-17929.5-33.4000111.3Q116 L117P57-Q116 HydrophobicContact CB-CG 4.07Å; P57-L117 CarbonylContact C-O 3.53Å; P57-L117 WeakPolarHBondContact CA-O 3.35Å
58L94.1Very high85.8Confident3 Ų351 Ų512%0.01627%0.273CS..EExtended strand (participates in β ladder)trans-62.7139.3164.2179.475.5000109A50 A52 T56 L60 L105 Q116 L117 V119 L136 V138A50-L58 HydrophobicContact CB-CD1 4.2Å; A52-L58 HydrophobicContact CB-CB 4.06Å; A52-L58 HydrophobicContact CB-CD1 4.21Å; T56-L58 PolarHBondContact O-N 2.84Å; L58-L60 HydrophobicContact CD1-CD2 4.09Å; L58-L60 HydrophobicContact CD2-CD1 4.11Å; L58-L60 HydrophobicContact CD2-CD2 4.08Å; L58-L60 HydrophobicContact CD2-CG 3.91Å; L58-L60 HydrophobicContact CG-CD2 4.13Å; L58-L60 HydrophobicContact CG-CG 4.16Å; L58-L105 HydrophobicContact CD2-CD2 4.01Å; L58-Q116 CarbonylContact O-C 3.53Å; L58-Q116 VanDerWaalsContact O-CA 3.3Å; L58-Q116 WeakPolarHBondContact O-CA 3.43Å; L58-L117 HydrophobicContact CB-CB 4.36Å; L58-L117 PolarHBondContact N-O 3.44Å; L58-L117 PolarHBondContact O-N 3.48Å; L58-V119 HydrophobicContact CB-CG2 4.03Å; L58-L136 HydrophobicContact CB-CD2 4.18Å; L58-L136 HydrophobicContact CD2-CD2 3.78Å; L58-L136 HydrophobicContact CG-CD2 4.39Å; L58-V138 HydrophobicContact CD1-CG2 4.13Å; L58-V138 HydrophobicContact CD2-CG2 3.82Å
59R93.8Very high86.2Confident162 Ų16250.9 Ų50.961%0.61128%0.275SS*.EExtended strand (participates in β ladder)trans-126.4121.5170.3-62.9177.3-174.9-108.72.2109.5C115 Q116R59-C115 WeakPolarHBondContact CA-O 3.38Å; R59-Q116 HydrophobicContact CG-CG 4.22Å
60L92.1Very high86.4Confident1 Ų147.4 Ų47.41%0.00525%0.25CC..EExtended strand (participates in β ladder)trans-115131.7171.5-55.1-178.8000108.2A50 L58 I68 I70 C109 E114 C115 V138 Y140A50-L60 HydrophobicContact CB-CD2 3.66Å; L58-L60 HydrophobicContact CD1-CD2 4.09Å; L58-L60 HydrophobicContact CD2-CD1 4.11Å; L58-L60 HydrophobicContact CD2-CD2 4.08Å; L58-L60 HydrophobicContact CD2-CG 3.91Å; L58-L60 HydrophobicContact CG-CD2 4.13Å; L58-L60 HydrophobicContact CG-CG 4.16Å; L60-I68 HydrophobicContact CB-CD1 3.65Å; L60-I68 HydrophobicContact CB-CG1 4.32Å; L60-I68 HydrophobicContact CD1-CD1 4.45Å; L60-I68 HydrophobicContact CD1-CG2 4.12Å; L60-I70 HydrophobicContact CD1-CD1 3.79Å; L60-C109 HydrophobicContact CD1-CB 4.17Å; L60-E114 WeakPolarHBondContact O-CA 3.41Å; L60-C115 HydrophobicContact CB-CB 4.33Å; L60-C115 PolarHBondContact N-O 3.1Å; L60-C115 PolarHBondContact O-N 2.85Å; L60-V138 HydrophobicContact CD1-CG1 4.4Å; L60-Y140 HydrophobicContact CD2-CD1 3.95Å; L60-Y140 HydrophobicContact CD2-CE1 3.68Å
61H89.8Confident86.6Confident64 Ų6450.9 Ų50.930%0.29626%0.263SS..EExtended strand (participates in β ladder)trans-140.4117.3-179.7-172.4102.7000111.7R113 E114H61-R113 PolarHBondContact CE1-NH2 2.81Å; H61-R113 PolarHBondContact NE2-NH2 2.94Å; H61-E114 IonicContact CE1-OE2 3.4Å; H61-E114 PolarHBondContact CE1-OE2 3.42Å; H61-E114 VanDerWaalsContact ND1-CD 3.25Å; H61-E114 IonicContact ND1-OE1 3.53Å; H61-E114 IonicContact ND1-OE2 2.69Å; H61-E114 PolarHBondContact ND1-OE2 2.03Å
62C82.7Confident86.7Confident0 Ų048 Ų480%026%0.256CS..  trans-96.1144.9169.2-70.90000111.3I68 R113 C142C62-I68 HydrophobicContact CB-CG1 4.45Å; C62-I68 VanDerWaalsContact SG-CG1 3.55Å; C62-R113 PolarHBondContact N-O 3.46Å; C62-R113 WeakPolarHBondContact O-CG 3.34Å; C62-R113 PolarHBondContact O-NE 2.93Å; C62-C142 WeakPolarHBondContact CA-SG 3.48Å; C62-C142 HydrophobicContact CB-CB 3.74Å; C62-C142 WeakPolarHBondContact CB-SG 3.46Å; C62-C142 VanDerWaalsContact SG-CA 3.51Å; C62-C142 WeakPolarHBondContact SG-CB 3.46Å; C62-C142 CovalentContact SG-SG 2.03Å; C62-C142 PolarHBondContact SG-SG 3.06Å
63P73.1Confident86.8Confident19 Ų1948.6 Ų48.612%0.12326%0.261CS..  trans-69.3175.7178.230.9-36.3000112.1Y40 I44 S66Y40-P63 HydrophobicContact CD1-CB 4.3Å; Y40-P63 HydrophobicContact CD1-CG 3.85Å; Y40-P63 HydrophobicContact CD2-CB 3.78Å; Y40-P63 HydrophobicContact CD2-CG 4.23Å; Y40-P63 HydrophobicContact CE1-CB 4.13Å; Y40-P63 HydrophobicContact CE1-CG 3.77Å; Y40-P63 HydrophobicContact CE2-CB 3.63Å; Y40-P63 HydrophobicContact CE2-CG 4.2Å; Y40-P63 HydrophobicContact CG-CB 4.14Å; Y40-P63 HydrophobicContact CG-CG 4.08Å; I44-P63 HydrophobicContact CD1-CG 3.85Å; I44-P63 HydrophobicContact CG1-CG 4.32Å; P63-S66 WeakPolarHBondContact CD-OG 3.45Å; P63-S66 PolarHBondContact O-N 3.47Å; P63-S66 PolarHBondContact O-OG 2.99Å
64R67.8Low87Confident175 Ų17549.6 Ų49.666%0.6626%0.261SS*.THydrogen-bonded Turntrans-58150.1-173-64.4-159.7-179-1382.6112.7Y40 S66Y40-R64 PolarHBondContact OH-O 2.96Å; R64-S66 PolarHBondContact O-N 3.36Å; R64-S66 VanDerWaalsContact O-N 3.1Å
65H69.7Low87.2Confident96 Ų9647 Ų4744%0.44425%0.247SC..THydrogen-bonded Turntrans53.125.3-175.3-48.6-82000114.6P144 S145 E146H65-P144 WeakPolarHBondContact O-CA 3.29Å; H65-S145 VanDerWaalsContact CA-OG 3.3Å; H65-S145 WeakPolarHBondContact CA-OG 3.02Å; H65-S145 PolarHBondContact O-N 2.82Å; H65-S145 PolarHBondContact O-OG 3.22Å; H65-E146 IonicContact CE1-OE1 2.68Å; H65-E146 IonicContact CG-OE1 3.85Å; H65-E146 IonicContact ND1-OE1 2.81Å; H65-E146 PolarHBondContact ND1-OE1 3.13Å
66S77.2Confident87.4Confident2 Ų243.8 Ų43.81%0.01421%0.214CC..EExtended strand (participates in β ladder)trans-138.1154.2171.572.20000111.4P63 R64 K143P63-S66 WeakPolarHBondContact CD-OG 3.45Å; P63-S66 PolarHBondContact O-N 3.47Å; P63-S66 PolarHBondContact O-OG 2.99Å; R64-S66 PolarHBondContact O-N 3.36Å; R64-S66 VanDerWaalsContact O-N 3.1Å; S66-K143 CarbonylContact C-O 3.54Å; S66-K143 WeakPolarHBondContact CA-O 3.32Å; S66-K143 WeakPolarHBondContact CB-O 3.17Å
67T86.1Confident87.2Confident18 Ų1841.9 Ų41.911%0.1120%0.204CC..EExtended strand (participates in β ladder)trans-135.1154-175.153.90000111.6S69 N111 L112 C142 K143T67-S69 PolarHBondContact O-N 3.43Å; T67-N111 WeakPolarHBondContact CB-O 3.41Å; T67-N111 WeakPolarHBondContact CG2-O 3.35Å; T67-L112 CarbonylContact C-O 3.57Å; T67-L112 VanDerWaalsContact CA-O 3.31Å; T67-L112 WeakPolarHBondContact CA-O 3.18Å; T67-L112 WeakPolarHBondContact CB-O 3.47Å; T67-C142 CarbonylContact O-C 3.58Å; T67-C142 WeakPolarHBondContact O-CA 3.5Å; T67-K143 PolarHBondContact N-O 2.75Å; T67-K143 PolarHBondContact O-N 2.77Å
68I89.9Confident86.5Confident0 Ų040.1 Ų40.10%020%0.196CC..EExtended strand (participates in β ladder)trans-66.4129.6-178.2-62.1158.5000109.3L60 C62 I70 C109 Q110 N111 L112 C115 Y140L60-I68 HydrophobicContact CB-CD1 3.65Å; L60-I68 HydrophobicContact CB-CG1 4.32Å; L60-I68 HydrophobicContact CD1-CD1 4.45Å; L60-I68 HydrophobicContact CD1-CG2 4.12Å; C62-I68 HydrophobicContact CB-CG1 4.45Å; C62-I68 VanDerWaalsContact SG-CG1 3.55Å; I68-I70 HydrophobicContact CG2-CD1 3.55Å; I68-I70 HydrophobicContact CG2-CG1 4.21Å; I68-C109 WeakPolarHBondContact CB-O 3.48Å; I68-C109 HydrophobicContact CG2-CB 4.47Å; I68-Q110 PolarHBondContact O-OE1 3.09Å; I68-N111 PolarHBondContact O-N 2.67Å; I68-L112 WeakPolarHBondContact CG1-O 3.3Å; I68-L112 PolarHBondContact N-O 2.93Å; I68-C115 HydrophobicContact CD1-CB 3.78Å; I68-Y140 HydrophobicContact CG2-CD2 4.21Å
69S91Very high85Confident23 Ų2348.9 Ų48.916%0.16124%0.237CC..EExtended strand (participates in β ladder)trans-123.497.3167.8-164.20000109T67 Q71 Q110 Y140 K141T67-S69 PolarHBondContact O-N 3.43Å; S69-Q71 PolarHBondContact O-N 2.77Å; S69-Q71 PolarHBondContact O-NE2 3.21Å; S69-Q110 VanDerWaalsContact CA-OE1 3.31Å; S69-Y140 WeakPolarHBondContact O-CA 3.4Å; S69-K141 WeakPolarHBondContact CB-O 3.41Å; S69-K141 PolarHBondContact N-O 3.22Å; S69-K141 PolarHBondContact O-N 3Å
70I93.9Very high83.6Confident11 Ų1145.5 Ų45.56%0.05624%0.235CC..EExtended strand (participates in β ladder)trans-58.7135.7176.2-51-61.8000109L60 I68 L102 L105 L106 C109 V138L60-I70 HydrophobicContact CD1-CD1 3.79Å; I68-I70 HydrophobicContact CG2-CD1 3.55Å; I68-I70 HydrophobicContact CG2-CG1 4.21Å; I70-L102 HydrophobicContact CG2-CD1 3.6Å; I70-L105 HydrophobicContact CD1-CB 4.44Å; I70-L105 HydrophobicContact CG1-CB 4.34Å; I70-L106 HydrophobicContact CB-CD2 3.98Å; I70-L106 HydrophobicContact CG1-CD2 4.44Å; I70-C109 HydrophobicContact CD1-CB 4.29Å; I70-V138 HydrophobicContact CD1-CG1 4.04Å; I70-V138 HydrophobicContact CG2-CG1 4.48Å
71Q93.1Very high82.4Confident88 Ų8851.9 Ų51.941%0.41126%0.258SS..EExtended strand (participates in β ladder)trans-104.6-46.1175.5-52.8-64.3-75.600110.2S69 N139 K141S69-Q71 PolarHBondContact O-N 2.77Å; S69-Q71 PolarHBondContact O-NE2 3.21Å; Q71-N139 WeakPolarHBondContact CA-O 3.25Å; Q71-N139 HydrophobicContact CB-CB 4.46Å; Q71-N139 WeakPolarHBondContact CB-O 3.45Å; Q71-N139 PolarHBondContact N-O 2.85Å; Q71-K141 HydrophobicContact CG-CD 4.34Å; Q71-K141 HydrophobicContact CG-CG 4.07Å
72S93.6Very high81.3Confident56 Ų5650.6 Ų50.639%0.39225%0.253SS..EExtended strand (participates in β ladder)trans-154.7158.7173.465.30000111.1N139S72-N139 PolarHBondContact N-O 2.85Å; S72-N139 VanDerWaalsContact N-O 3.13Å; S72-N139 PolarHBondContact O-N 3.38Å; S72-N139 WeakPolarHBondContact OG-CB 3.22Å
73A93.6Very high80.8Confident19 Ų1952.3 Ų52.316%0.15727%0.265CS..EExtended strand (participates in β ladder)trans-146.5145.4171.400000110.8L102 L105 H137A73-L102 HydrophobicContact CB-CB 4.47Å; A73-L102 HydrophobicContact CB-CD1 4.48Å; A73-L105 HydrophobicContact CB-CD2 3.95Å; A73-H137 CarbonylContact C-O 3.55Å; A73-H137 WeakPolarHBondContact CA-O 3.32Å
74F92.2Very high80.6Confident59 Ų5953.6 Ų53.626%0.25927%0.273SS..EExtended strand (participates in β ladder)trans-131.7126.4178.4168.4-82.8000107.8Y135 L136 H137F74-Y135 HydrophobicContact CD1-CD2 4.24Å; F74-Y135 AromaticContact CD1-CE2 3.71Å; F74-Y135 HydrophobicContact CD1-CE2 3.71Å; F74-Y135 HydrophobicContact CE1-CD2 4.24Å; F74-Y135 AromaticContact CE1-CE2 3.58Å; F74-Y135 HydrophobicContact CE1-CE2 3.58Å; F74-Y135 AromaticContact CE1-CZ 3.77Å; F74-L136 CarbonylContact O-C 3.56Å; F74-L136 WeakPolarHBondContact O-CA 3.3Å; F74-H137 PolarHBondContact N-O 2.91Å; F74-H137 PolarHBondContact O-N 2.73Å
75Y91.4Very high80.3Confident0 Ų054.8 Ų54.80%029%0.286CS..EExtended strand (participates in β ladder)trans-121.9121.8168.9175.2-112.6000109.7D54 S97 A98 V119 H121 F124 P128 K134 Y135 L136D54-Y75 PolarHBondContact OD1-OH 3.23Å; D54-Y75 PolarHBondContact OD2-OH 3.05Å; Y75-S97 CarbonylContact O-C 3.43Å; Y75-S97 VanDerWaalsContact O-CA 3.29Å; Y75-S97 WeakPolarHBondContact O-CA 3.44Å; Y75-A98 HydrophobicContact CD1-CB 3.95Å; Y75-A98 PolarHBondContact O-N 3.05Å; Y75-V119 HydrophobicContact CD2-CG1 3.94Å; Y75-V119 HydrophobicContact CE2-CG1 3.55Å; Y75-H121 HydrophobicContact CE1-CB 4.32Å; Y75-H121 PolarHBondContact OH-N 2.9Å; Y75-F124 HydrophobicContact CD1-CB 3.88Å; Y75-F124 AromaticContact CD1-CD2 3.43Å; Y75-F124 HydrophobicContact CD1-CD2 3.43Å; Y75-F124 VanDerWaalsContact CD1-CD2 3.43Å; Y75-F124 HydrophobicContact CD1-CE2 4.23Å; Y75-F124 AromaticContact CD1-CG 3.83Å; Y75-F124 HydrophobicContact CD1-CG 3.83Å; Y75-F124 HydrophobicContact CD2-CD2 4.04Å; Y75-F124 HydrophobicContact CD2-CE2 4.04Å; Y75-F124 HydrophobicContact CE1-CB 4.27Å; Y75-F124 AromaticContact CE1-CD2 3.71Å; Y75-F124 HydrophobicContact CE1-CD2 3.71Å; Y75-F124 HydrophobicContact CE1-CG 4.36Å; Y75-F124 HydrophobicContact CE2-CD2 4.29Å; Y75-F124 HydrophobicContact CE2-CE2 4.4Å; Y75-F124 AromaticContact CG-CD2 3.6Å; Y75-F124 HydrophobicContact CG-CD2 3.6Å; Y75-F124 AromaticContact CG-CE2 3.94Å; Y75-F124 HydrophobicContact CG-CE2 3.94Å; Y75-F124 HydrophobicContact CG-CG 4.18Å; Y75-P128 HydrophobicContact CD1-CG 4.28Å; Y75-P128 HydrophobicContact CE1-CG 4.3Å; Y75-K134 HydrophobicContact CE1-CD 4.12Å; Y75-K134 HydrophobicContact CE2-CB 3.92Å; Y75-K134 WeakPolarHBondContact OH-CE 3.41Å; Y75-Y135 WeakPolarHBondContact CA-O 3.44Å; Y75-L136 HydrophobicContact CD2-CB 4.09Å
76G88.9Confident79.8Confident0 Ų054.9 Ų54.90%029%0.29CS..EExtended strand (participates in β ladder)trans154.4-146.2-179.600000112.9C96 K134 Y135G76-C96 CarbonylContact C-O 3.32Å; G76-C96 VanDerWaalsContact CA-O 3.31Å; G76-C96 WeakPolarHBondContact CA-O 3.16Å; G76-K134 CarbonylContact O-C 3.51Å; G76-K134 VanDerWaalsContact O-CA 3.22Å; G76-K134 WeakPolarHBondContact O-CA 3.04Å; G76-Y135 PolarHBondContact N-O 3.25Å; G76-Y135 PolarHBondContact O-N 3.49Å
77S86.1Confident78.6Confident23 Ų2359.6 Ų59.616%0.16132%0.32CS..EExtended strand (participates in β ladder)trans-129.6136.8-176.9-155.10000109.4S95 C96 N133S77-S95 CarbonylContact O-C 3.53Å; S77-S95 VanDerWaalsContact O-CA 3.29Å; S77-S95 WeakPolarHBondContact O-CA 3.3Å; S77-C96 VanDerWaalsContact CB-SG 3.59Å; S77-C96 PolarHBondContact N-O 2.98Å; S77-C96 PolarHBondContact O-N 2.96Å; S77-N133 WeakPolarHBondContact CB-O 3.23Å; S77-N133 PolarHBondContact OG-O 2.84Å
78G76.4Confident77.1Confident24 Ų2462.7 Ų62.725%0.24735%0.348CS..  trans-150.7-167.4-173.400000112.4V80G78-V80 VanDerWaalsContact C-N 3.31Å; G78-V80 PolarHBondContact O-N 3.14Å
79E62.8Low75.4Confident186 Ų18664.6 Ų64.687%0.86936%0.361SS*.SBendtrans-66.3-30.8-175-64.7171.4-174.200113.3R81E79-R81 PolarHBondContact O-N 3.26Å
80V65.3Low73.7Confident92 Ų9265.6 Ų65.656%0.55838%0.375SS*.SBendtrans-80.2116.1-179.8-157.20000109.5G78 L82 Y135G78-V80 VanDerWaalsContact C-N 3.31Å; G78-V80 PolarHBondContact O-N 3.14Å; V80-L82 HydrophobicContact CB-CD1 4.11Å; V80-L82 HydrophobicContact CG1-CD1 3.44Å; V80-L82 VanDerWaalsContact CG1-CD1 3.44Å; V80-L82 PolarHBondContact O-N 3.33Å; V80-Y135 VanDerWaalsContact O-CE1 3.26Å; V80-Y135 WeakPolarHBondContact O-CE1 3.37Å
81R65.5Low71.6Confident134 Ų13470.9 Ų70.951%0.50641%0.41SS..  trans-72.256.6178.8-69.1-179.4170.2-175.1-7.5113.3E79 P87 S89E79-R81 PolarHBondContact O-N 3.26Å; R81-P87 PolarHBondContact NH1-O 3.45Å; R81-P87 PolarHBondContact NH2-O 3.11Å; R81-P87 VanDerWaalsContact NH2-O 3.07Å; R81-S89 PolarHBondContact NH2-O 3.1Å
82L66.6Low69.9Low37 Ų3773.5 Ų73.519%0.19442%0.416CS..THydrogen-bonded Turntrans-69.8148.5163.1-90.461.2000109.3H51 V80 T84 Y135H51-L82 HydrophobicContact CB-CD2 3.59Å; V80-L82 HydrophobicContact CB-CD1 4.11Å; V80-L82 HydrophobicContact CG1-CD1 3.44Å; V80-L82 VanDerWaalsContact CG1-CD1 3.44Å; V80-L82 PolarHBondContact O-N 3.33Å; L82-T84 VanDerWaalsContact C-N 3.32Å; L82-T84 PolarHBondContact O-N 3.06Å; L82-T84 PolarHBondContact O-OG1 3.38Å; L82-Y135 HydrophobicContact CB-CD1 3.76Å; L82-Y135 HydrophobicContact CB-CD2 4.41Å; L82-Y135 HydrophobicContact CB-CE1 4.25Å; L82-Y135 HydrophobicContact CB-CG 3.85Å; L82-Y135 HydrophobicContact CD2-CD2 4.12Å; L82-Y135 HydrophobicContact CD2-CG 4.31Å
83C72.3Confident68.1Low36 Ų3677.8 Ų77.824%0.24344%0.435CS..THydrogen-bonded Turntrans58.337.6172.4-49.70000114.5C53 N133C53-C83 WeakPolarHBondContact CA-SG 3.27Å; C53-C83 HydrophobicContact CB-CB 3.7Å; C53-C83 WeakPolarHBondContact CB-SG 3.26Å; C53-C83 WeakPolarHBondContact SG-CB 3.13Å; C53-C83 CovalentContact SG-SG 2.03Å; C53-C83 PolarHBondContact SG-SG 3.18Å; C83-N133 PolarHBondContact O-ND2 3.2Å
84T69.3Low66.9Low47 Ų4783.9 Ų83.929%0.28846%0.46SS..  trans-139.4112.8176.3-57.10000109.4L82 D86L82-T84 VanDerWaalsContact C-N 3.32Å; L82-T84 PolarHBondContact O-N 3.06Å; L82-T84 PolarHBondContact O-OG1 3.38Å; T84-D86 HydrophobicContact CG2-CB 4.38Å; T84-D86 WeakPolarHBondContact CG2-O 2.9Å
85E61.6Low66.3Low199 Ų19985.2 Ų85.293%0.9348%0.476SS*.  trans-84.1-14.3173.7-60.8-172149.800112.6P87E85-P87 WeakPolarHBondContact O-CD 3.33Å
86D58.4Low66.1Low99 Ų9986.1 Ų86.153%0.52948%0.482SS..  trans-94.5108.6-170.4-164.5-20.1000112T84 A88T84-D86 HydrophobicContact CG2-CB 4.38Å; T84-D86 WeakPolarHBondContact CG2-O 2.9Å; D86-A88 PolarHBondContact O-N 3.42Å; D86-A88 WeakPolarHBondContact OD1-CB 3.16Å; D86-A88 PolarHBondContact OD1-N 3.39Å
87P53.4Low66.1Low101 Ų10189.1 Ų89.166%0.65650%0.503SS*.THydrogen-bonded Turntrans-70.7-17.6-176.329.3-35.3000113.4R81 E85 S89R81-P87 PolarHBondContact NH1-O 3.45Å; R81-P87 PolarHBondContact NH2-O 3.11Å; R81-P87 VanDerWaalsContact NH2-O 3.07Å; E85-P87 WeakPolarHBondContact O-CD 3.33Å; P87-S89 PolarHBondContact O-N 3.14Å
88A52.9Low66.4Low83 Ų8388.5 Ų88.569%0.68650%0.5SS*.THydrogen-bonded Turntrans-76.4-14.4-167.600000114.8D86 G90D86-A88 PolarHBondContact O-N 3.42Å; D86-A88 WeakPolarHBondContact OD1-CB 3.16Å; D86-A88 PolarHBondContact OD1-N 3.39Å; A88-G90 PolarHBondContact O-N 3.37Å; A88-G90 VanDerWaalsContact O-N 3.1Å
89S55.9Low66.9Low40 Ų4095.4 Ų95.428%0.2853%0.53SS..SBendtrans-75.7102.6179.371.80000111.5R81 P87R81-S89 PolarHBondContact NH2-O 3.1Å; P87-S89 PolarHBondContact O-N 3.14Å
90G53.5Low68.2Low44 Ų4489.4 Ų89.445%0.45451%0.506SS..  trans-55.3164.4-179.300000115A88 R92A88-G90 PolarHBondContact O-N 3.37Å; A88-G90 VanDerWaalsContact O-N 3.1Å; G90-R92 WeakPolarHBondContact O-CG 3.26Å; G90-R92 PolarHBondContact O-N 3.38Å
91P51.6Low69.5Low122 Ų12285 Ų8579%0.79248%0.479SS*.  trans-59.1119.6-173.124.5-34.2000111.6
92R55.7Low70.8Confident143 Ų14381.7 Ų81.754%0.5447%0.471SS..  trans-98.197.8179.9-62.4-175-178.8-172.9-1.7109.1G90 H94G90-R92 WeakPolarHBondContact O-CG 3.26Å; G90-R92 PolarHBondContact O-N 3.38Å; R92-H94 PolarHBondContact O-N 3.35Å
93N56.3Low72.1Confident146 Ų14687.1 Ų87.178%0.78150%0.496SS*.  trans-6827.4179-61.7-1000114.2
94H68.1Low73.1Confident147 Ų14788 Ų8868%0.68150%0.495SS*.  trans-134.583.5-178.6-63.9-39.4000108.7R92 K132R92-H94 PolarHBondContact O-N 3.35Å; H94-K132 PolarHBondContact O-NZ 2.79Å
95S80.7Confident74.3Confident87 Ų8785.8 Ų85.861%0.60848%0.482SS*.  trans-64.2151.716355.60000110.1S77S77-S95 CarbonylContact O-C 3.53Å; S77-S95 VanDerWaalsContact O-CA 3.29Å; S77-S95 WeakPolarHBondContact O-CA 3.3Å
96C87Confident75.9Confident19 Ų1979.8 Ų79.813%0.12846%0.456CS..EExtended strand (participates in β ladder)trans-150.8138.9-178.842.90000109.1G76 S77 P128 C129G76-C96 CarbonylContact C-O 3.32Å; G76-C96 VanDerWaalsContact CA-O 3.31Å; G76-C96 WeakPolarHBondContact CA-O 3.16Å; S77-C96 VanDerWaalsContact CB-SG 3.59Å; S77-C96 PolarHBondContact N-O 2.98Å; S77-C96 PolarHBondContact O-N 2.96Å; C96-P128 WeakPolarHBondContact CB-O 3.29Å; C96-C129 HydrophobicContact CB-CB 4.04Å; C96-C129 WeakPolarHBondContact CB-SG 3.36Å; C96-C129 WeakPolarHBondContact SG-CB 3.48Å; C96-C129 CovalentContact SG-SG 2.02Å; C96-C129 PolarHBondContact SG-SG 2.89Å
97S89.7Confident77.5Confident62 Ų6278.6 Ų78.643%0.43446%0.455SS..EExtended strand (participates in β ladder)trans-143.7148-174.556.90000112.3Y75Y75-S97 CarbonylContact O-C 3.43Å; Y75-S97 VanDerWaalsContact O-CA 3.29Å; Y75-S97 WeakPolarHBondContact O-CA 3.44Å
98A90.7Very high79.4Confident11 Ų1177.3 Ų77.39%0.09144%0.441CS..  trans-88.1116.1167.200000109.8Y75 T100 A101 F124 P128Y75-A98 HydrophobicContact CD1-CB 3.95Å; Y75-A98 PolarHBondContact O-N 3.05Å; A98-T100 PolarHBondContact O-N 3.09Å; A98-A101 VanDerWaalsContact O-CB 3.3Å; A98-A101 WeakPolarHBondContact O-CB 3.42Å; A98-A101 PolarHBondContact O-N 3.48Å; A98-A101 VanDerWaalsContact O-N 3.12Å; A98-F124 HydrophobicContact CB-CB 4.19Å; A98-P128 HydrophobicContact CB-CB 4.37Å; A98-P128 HydrophobicContact CB-CG 4.1Å
99L86.8Confident81.3Confident169 Ų16973.4 Ų73.489%0.88541%0.408SS*.THydrogen-bonded Turntrans-59.3-27.8178.4-64.4169.9000112.8A101L99-A101 VanDerWaalsContact C-N 3.26Å; L99-A101 PolarHBondContact O-N 2.87Å
100T91Very high83.1Confident59 Ų5973.6 Ų73.636%0.36240%0.404SS..Hα-helixtrans-67.3-17.5177.248.50000114.4A98 L102 Q103 K104 F124A98-T100 PolarHBondContact O-N 3.09Å; T100-L102 PolarHBondContact O-N 3.11Å; T100-Q103 PolarHBondContact O-N 3.28Å; T100-K104 PolarHBondContact O-N 2.89Å; T100-F124 WeakPolarHBondContact CB-O 3.01Å; T100-F124 PolarHBondContact OG1-O 3.5Å
101A92.4Very high84.8Confident0 Ų076 Ų760%041%0.407CS..Hα-helixtrans-56.5-46.6-170.900000113.1A98 L99 L105 F124A98-A101 VanDerWaalsContact O-CB 3.3Å; A98-A101 WeakPolarHBondContact O-CB 3.42Å; A98-A101 PolarHBondContact O-N 3.48Å; A98-A101 VanDerWaalsContact O-N 3.12Å; L99-A101 VanDerWaalsContact C-N 3.26Å; L99-A101 PolarHBondContact O-N 2.87Å; A101-L105 WeakPolarHBondContact O-CD1 3.47Å; A101-L105 PolarHBondContact O-N 2.82Å; A101-L105 VanDerWaalsContact O-N 3.08Å; A101-F124 HydrophobicContact CB-CD1 4.4Å
102L94Very high86.6Confident64 Ų6474 Ų7434%0.33539%0.389SS..Hα-helixtrans-67.1-44.9178.3178.656.3000111.9I70 A73 T100 K104 L105 L106I70-L102 HydrophobicContact CG2-CD1 3.6Å; A73-L102 HydrophobicContact CB-CB 4.47Å; A73-L102 HydrophobicContact CB-CD1 4.48Å; T100-L102 PolarHBondContact O-N 3.11Å; L102-K104 VanDerWaalsContact C-N 3.34Å; L102-K104 PolarHBondContact O-N 3.03Å; L102-L105 PolarHBondContact O-N 3.34Å; L102-L106 HydrophobicContact CD1-CD1 3.93Å; L102-L106 HydrophobicContact CD1-CG 4.08Å; L102-L106 HydrophobicContact CG-CD1 3.9Å; L102-L106 HydrophobicContact CG-CG 4.48Å; L102-L106 WeakPolarHBondContact O-CB 3.13Å; L102-L106 VanDerWaalsContact O-CG 3.28Å; L102-L106 WeakPolarHBondContact O-CG 3.05Å; L102-L106 PolarHBondContact O-N 3.32Å
103Q93.6Very high88.1Confident151 Ų15171.8 Ų71.871%0.70638%0.381SS*.Hα-helixtrans-64.1-39.4-179.3-172.8174.40.100111.9T100 L106 S107T100-Q103 PolarHBondContact O-N 3.28Å; Q103-L106 PolarHBondContact O-N 2.91Å; Q103-S107 PolarHBondContact O-N 2.98Å
104K93.2Very high89.8Confident55 Ų5569.9 Ų69.924%0.23937%0.367CS..Hα-helixtrans-69.2-40.9176.2-171.759.6175.2167.20111.9T100 L102 L106 S107 E108 L123 F124T100-K104 PolarHBondContact O-N 2.89Å; L102-K104 VanDerWaalsContact C-N 3.34Å; L102-K104 PolarHBondContact O-N 3.03Å; K104-L106 VanDerWaalsContact C-N 3.26Å; K104-L106 PolarHBondContact O-N 2.87Å; K104-S107 PolarHBondContact O-N 2.9Å; K104-S107 PolarHBondContact O-OG 3.29Å; K104-E108 HydrophobicContact CD-CG 3.86Å; K104-E108 WeakPolarHBondContact CE-OE1 3.38Å; K104-E108 HydrophobicContact CG-CG 4.23Å; K104-E108 IonicContact NZ-OE1 2.79Å; K104-E108 PolarHBondContact NZ-OE1 2.84Å; K104-E108 IonicContact NZ-OE2 2.98Å; K104-E108 PolarHBondContact NZ-OE2 3.14Å; K104-E108 VanDerWaalsContact O-CG 3.31Å; K104-E108 WeakPolarHBondContact O-CG 3.05Å; K104-E108 PolarHBondContact O-N 3.32Å; K104-L123 HydrophobicContact CD-CG 4.49Å; K104-L123 HydrophobicContact CG-CD2 4.34Å; K104-L123 HydrophobicContact CG-CG 4.09Å; K104-F124 HydrophobicContact CB-CD1 4.04Å; K104-F124 HydrophobicContact CB-CE1 3.99Å; K104-F124 HydrophobicContact CG-CD1 4.24Å; K104-F124 HydrophobicContact CG-CE1 4.06Å
105L94Very high91Very high0 Ų063.3 Ų63.30%034%0.338CS..Hα-helixtrans-68.3-28174.4-92.169.9000112.9L58 I70 A73 A101 L102 C109 L117 F124 L136 V138L58-L105 HydrophobicContact CD2-CD2 4.01Å; I70-L105 HydrophobicContact CD1-CB 4.44Å; I70-L105 HydrophobicContact CG1-CB 4.34Å; A73-L105 HydrophobicContact CB-CD2 3.95Å; A101-L105 WeakPolarHBondContact O-CD1 3.47Å; A101-L105 PolarHBondContact O-N 2.82Å; A101-L105 VanDerWaalsContact O-N 3.08Å; L102-L105 PolarHBondContact O-N 3.34Å; L105-C109 WeakPolarHBondContact O-CB 3.14Å; L105-C109 PolarHBondContact O-N 2.99Å; L105-L117 HydrophobicContact CD1-CD2 3.52Å; L105-L117 HydrophobicContact CG-CD2 4.03Å; L105-F124 HydrophobicContact CD1-CE1 3.68Å; L105-F124 HydrophobicContact CD1-CZ 3.89Å; L105-L136 HydrophobicContact CD1-CD1 4.22Å; L105-L136 HydrophobicContact CD1-CD2 4.17Å; L105-L136 HydrophobicContact CD2-CD1 4.42Å; L105-L136 HydrophobicContact CD2-CD2 4.35Å; L105-V138 HydrophobicContact CD2-CB 4.14Å; L105-V138 HydrophobicContact CD2-CG1 3.62Å; L105-V138 HydrophobicContact CD2-CG2 3.35Å
106L94.5Very high91.7Very high73 Ų7364.5 Ų64.538%0.38233%0.334SS..Hα-helixtrans-71.5-29.2171.1-74.3169000113.3I70 L102 Q103 K104 Q110I70-L106 HydrophobicContact CB-CD2 3.98Å; I70-L106 HydrophobicContact CG1-CD2 4.44Å; L102-L106 HydrophobicContact CD1-CD1 3.93Å; L102-L106 HydrophobicContact CD1-CG 4.08Å; L102-L106 HydrophobicContact CG-CD1 3.9Å; L102-L106 HydrophobicContact CG-CG 4.48Å; L102-L106 WeakPolarHBondContact O-CB 3.13Å; L102-L106 VanDerWaalsContact O-CG 3.28Å; L102-L106 WeakPolarHBondContact O-CG 3.05Å; L102-L106 PolarHBondContact O-N 3.32Å; Q103-L106 PolarHBondContact O-N 2.91Å; K104-L106 VanDerWaalsContact C-N 3.26Å; K104-L106 PolarHBondContact O-N 2.87Å; L106-Q110 HydrophobicContact CD2-CB 4.35Å; L106-Q110 HydrophobicContact CD2-CG 4.17Å; L106-Q110 WeakPolarHBondContact O-CB 3.47Å
107S93.4Very high91.9Very high75 Ų7563.9 Ų63.952%0.52433%0.329SS..Hα-helixtrans-79.8-39.7173.568.80000112.9Q103 K104Q103-S107 PolarHBondContact O-N 2.98Å; K104-S107 PolarHBondContact O-N 2.9Å; K104-S107 PolarHBondContact O-OG 3.29Å
108E92.6Very high92Very high74 Ų7464.9 Ų64.935%0.34633%0.334SS..Hα-helixtrans-91-31.3-172.2-50.9-54.2117.100114.6K104 L112 L117K104-E108 HydrophobicContact CD-CG 3.86Å; K104-E108 WeakPolarHBondContact CE-OE1 3.38Å; K104-E108 HydrophobicContact CG-CG 4.23Å; K104-E108 IonicContact NZ-OE1 2.79Å; K104-E108 PolarHBondContact NZ-OE1 2.84Å; K104-E108 IonicContact NZ-OE2 2.98Å; K104-E108 PolarHBondContact NZ-OE2 3.14Å; K104-E108 VanDerWaalsContact O-CG 3.31Å; K104-E108 WeakPolarHBondContact O-CG 3.05Å; K104-E108 PolarHBondContact O-N 3.32Å; E108-L112 WeakPolarHBondContact O-CD1 3.49Å; E108-L117 HydrophobicContact CB-CD1 3.71Å; E108-L117 HydrophobicContact CG-CD1 3.71Å
109C93.6Very high91.9Very high0 Ų064.5 Ų64.50%033%0.33CS..THydrogen-bonded Turntrans-116.3-16.8-171.3-62.20000115.1L60 I68 I70 L105 L112 C115L60-C109 HydrophobicContact CD1-CB 4.17Å; I68-C109 WeakPolarHBondContact CB-O 3.48Å; I68-C109 HydrophobicContact CG2-CB 4.47Å; I70-C109 HydrophobicContact CD1-CB 4.29Å; L105-C109 WeakPolarHBondContact O-CB 3.14Å; L105-C109 PolarHBondContact O-N 2.99Å; C109-L112 PolarHBondContact O-N 3.04Å; C109-C115 WeakPolarHBondContact CA-SG 3.46Å; C109-C115 HydrophobicContact CB-CB 3.55Å; C109-C115 WeakPolarHBondContact CB-SG 3.4Å; C109-C115 WeakPolarHBondContact SG-CB 3.22Å; C109-C115 CovalentContact SG-SG 2.04Å; C109-C115 PolarHBondContact SG-SG 3.28Å
110Q93.1Very high92Very high44 Ų4458 Ų5821%0.20630%0.299CS..THydrogen-bonded Turntrans-66.3137.3-174.3-17169.7-6.400111.4I68 S69 L106 L112I68-Q110 PolarHBondContact O-OE1 3.09Å; S69-Q110 VanDerWaalsContact CA-OE1 3.31Å; L106-Q110 HydrophobicContact CD2-CB 4.35Å; L106-Q110 HydrophobicContact CD2-CG 4.17Å; L106-Q110 WeakPolarHBondContact O-CB 3.47Å; Q110-L112 PolarHBondContact O-N 2.9Å; Q110-L112 VanDerWaalsContact O-N 3.08Å
111N88.9Confident91.7Very high95 Ų9558.2 Ų58.251%0.50830%0.296SS..THydrogen-bonded Turntrans63.11-176.9-46.8-50.8000115.6T67 I68 K143T67-N111 WeakPolarHBondContact CB-O 3.41Å; T67-N111 WeakPolarHBondContact CG2-O 3.35Å; I68-N111 PolarHBondContact O-N 2.67Å; N111-K143 VanDerWaalsContact OD1-CE 3.32Å; N111-K143 WeakPolarHBondContact OD1-CE 3.16Å; N111-K143 PolarHBondContact OD1-NZ 2.94Å
112L89.7Confident91.3Very high80 Ų8064.8 Ų64.842%0.41933%0.331SS..  trans-77.6154.2168.8-59.8-170.1000110.6T67 I68 E108 C109 Q110 C115T67-L112 CarbonylContact C-O 3.57Å; T67-L112 VanDerWaalsContact CA-O 3.31Å; T67-L112 WeakPolarHBondContact CA-O 3.18Å; T67-L112 WeakPolarHBondContact CB-O 3.47Å; I68-L112 WeakPolarHBondContact CG1-O 3.3Å; I68-L112 PolarHBondContact N-O 2.93Å; E108-L112 WeakPolarHBondContact O-CD1 3.49Å; C109-L112 PolarHBondContact O-N 3.04Å; Q110-L112 PolarHBondContact O-N 2.9Å; Q110-L112 VanDerWaalsContact O-N 3.08Å; L112-C115 HydrophobicContact CD1-CB 4.49Å
113R86.1Confident90.9Very high96 Ų9664 Ų6436%0.36233%0.326SS..SBendtrans-78.8-39.5169.3-179.9-179.7158.7-134.3-14.9111.5H61 C62H61-R113 PolarHBondContact CE1-NH2 2.81Å; H61-R113 PolarHBondContact NE2-NH2 2.94Å; C62-R113 PolarHBondContact N-O 3.46Å; C62-R113 WeakPolarHBondContact O-CG 3.34Å; C62-R113 PolarHBondContact O-NE 2.93Å
114E92.1Very high90.6Very high107 Ų10757 Ų5750%0.529%0.293SS..EExtended strand (participates in β ladder)trans-134.2135.2-179.1-177.4163.1176.400108.3L60 H61L60-E114 WeakPolarHBondContact O-CA 3.41Å; H61-E114 IonicContact CE1-OE2 3.4Å; H61-E114 PolarHBondContact CE1-OE2 3.42Å; H61-E114 VanDerWaalsContact ND1-CD 3.25Å; H61-E114 IonicContact ND1-OE1 3.53Å; H61-E114 IonicContact ND1-OE2 2.69Å; H61-E114 PolarHBondContact ND1-OE2 2.03Å
115C94.4Very high90.2Very high8 Ų856.5 Ų56.55%0.05430%0.304CS..EExtended strand (participates in β ladder)trans-133.9126.2178.9-171.40000109.1R59 L60 I68 C109 L112R59-C115 WeakPolarHBondContact CA-O 3.38Å; L60-C115 HydrophobicContact CB-CB 4.33Å; L60-C115 PolarHBondContact N-O 3.1Å; L60-C115 PolarHBondContact O-N 2.85Å; I68-C115 HydrophobicContact CD1-CB 3.78Å; C109-C115 WeakPolarHBondContact CA-SG 3.46Å; C109-C115 HydrophobicContact CB-CB 3.55Å; C109-C115 WeakPolarHBondContact CB-SG 3.4Å; C109-C115 WeakPolarHBondContact SG-CB 3.22Å; C109-C115 CovalentContact SG-SG 2.04Å; C109-C115 PolarHBondContact SG-SG 3.28Å; L112-C115 HydrophobicContact CD1-CB 4.49Å
116Q94.7Very high89.7Confident112 Ų11265.7 Ų65.752%0.52334%0.344SS..EExtended strand (participates in β ladder)trans-117.4122.4169.6-175.6176.8-60.100108.8P57 L58 R59P57-Q116 HydrophobicContact CB-CG 4.07Å; L58-Q116 CarbonylContact O-C 3.53Å; L58-Q116 VanDerWaalsContact O-CA 3.3Å; L58-Q116 WeakPolarHBondContact O-CA 3.43Å; R59-Q116 HydrophobicContact CG-CG 4.22Å
117L91.6Very high89.4Confident6 Ų663.9 Ų63.93%0.03134%0.335CS..EExtended strand (participates in β ladder)trans-131122.6-170.3-166.772.3000111.1P57 L58 L105 E108 V119 L123 F124P57-L117 CarbonylContact C-O 3.53Å; P57-L117 WeakPolarHBondContact CA-O 3.35Å; L58-L117 HydrophobicContact CB-CB 4.36Å; L58-L117 PolarHBondContact N-O 3.44Å; L58-L117 PolarHBondContact O-N 3.48Å; L105-L117 HydrophobicContact CD1-CD2 3.52Å; L105-L117 HydrophobicContact CG-CD2 4.03Å; E108-L117 HydrophobicContact CB-CD1 3.71Å; E108-L117 HydrophobicContact CG-CD1 3.71Å; L117-V119 PolarHBondContact O-N 2.74Å; L117-L123 HydrophobicContact CD1-CD2 3.75Å; L117-L123 HydrophobicContact CD2-CD2 3.79Å; L117-L123 HydrophobicContact CG-CD2 3.58Å; L117-F124 HydrophobicContact CD2-CZ 4.45Å
118P90.8Very high89Confident84 Ų8461.9 Ų61.955%0.54532%0.32SS..EExtended strand (participates in β ladder)trans-70.4114.9177.928.7-32.9000110S120 L123P118-S120 PolarHBondContact O-N 2.92Å; P118-L123 WeakPolarHBondContact O-CD2 3.3Å
119V90.4Very high88.7Confident2 Ų258.9 Ų58.91%0.01231%0.307CS..  trans-76.4111.7176.8-177.30000108.8A52 C53 G55 T56 L58 Y75 L117 F124 L136A52-V119 HydrophobicContact CB-CG2 3.72Å; C53-V119 WeakPolarHBondContact O-CB 3.48Å; G55-V119 PolarHBondContact N-O 3.01Å; T56-V119 VanDerWaalsContact O-CB 3.28Å; T56-V119 WeakPolarHBondContact O-CB 3.35Å; T56-V119 VanDerWaalsContact O-CG2 3.32Å; T56-V119 WeakPolarHBondContact O-CG2 3.42Å; T56-V119 PolarHBondContact O-N 2.89Å; L58-V119 HydrophobicContact CB-CG2 4.03Å; Y75-V119 HydrophobicContact CD2-CG1 3.94Å; Y75-V119 HydrophobicContact CE2-CG1 3.55Å; L117-V119 PolarHBondContact O-N 2.74Å; V119-F124 HydrophobicContact CG1-CE2 4.31Å; V119-L136 HydrophobicContact CG1-CB 3.83Å; V119-L136 HydrophobicContact CG2-CB 3.95Å; V119-L136 HydrophobicContact CG2-CD2 3.57Å; V119-L136 HydrophobicContact CG2-CG 4.43Å
120S87.8Confident88.3Confident32 Ų3263.7 Ų63.722%0.22434%0.338CS..  trans-151.5147174.4-178.30000109.6D54 P118 L122 L123 F124D54-S120 WeakPolarHBondContact OD1-CA 3.19Å; P118-S120 PolarHBondContact O-N 2.92Å; S120-L122 PolarHBondContact O-N 2.96Å; S120-L122 PolarHBondContact OG-N 3.36Å; S120-L123 WeakPolarHBondContact O-CB 3.47Å; S120-L123 PolarHBondContact O-N 2.9Å; S120-F124 VanDerWaalsContact O-CD2 3.23Å; S120-F124 WeakPolarHBondContact O-CD2 3.07Å
121H84.1Confident87.7Confident64 Ų6465.7 Ų65.730%0.29637%0.37SS..Hα-helixtrans-53.4-35.9171.162.8-88.5000112.2Y75 L123 F124 G125 D127Y75-H121 HydrophobicContact CE1-CB 4.32Å; Y75-H121 PolarHBondContact OH-N 2.9Å; H121-L123 PolarHBondContact O-N 3.13Å; H121-L123 VanDerWaalsContact O-N 3.14Å; H121-F124 CarbonylContact O-C 3.6Å; H121-F124 PolarHBondContact O-N 3.46Å; H121-G125 CarbonylContact O-C 3.55Å; H121-G125 PolarHBondContact O-N 2.92Å; H121-D127 HydrophobicContact CB-CB 4.05Å
122L85.1Confident87.3Confident139 Ų13963.2 Ų63.273%0.72836%0.355SS*.Hα-helixtrans-55.5-31.9177-62.3176.3000113.5S120S120-L122 PolarHBondContact O-N 2.96Å; S120-L122 PolarHBondContact OG-N 3.36Å
123L85.5Confident87Confident46 Ų4664.2 Ų64.224%0.24136%0.361CS..Hα-helixtrans-77.9-27.1178.4-167.876000112.5K104 L117 P118 S120 H121K104-L123 HydrophobicContact CD-CG 4.49Å; K104-L123 HydrophobicContact CG-CD2 4.34Å; K104-L123 HydrophobicContact CG-CG 4.09Å; L117-L123 HydrophobicContact CD1-CD2 3.75Å; L117-L123 HydrophobicContact CD2-CD2 3.79Å; L117-L123 HydrophobicContact CG-CD2 3.58Å; P118-L123 WeakPolarHBondContact O-CD2 3.3Å; S120-L123 WeakPolarHBondContact O-CB 3.47Å; S120-L123 PolarHBondContact O-N 2.9Å; H121-L123 PolarHBondContact O-N 3.13Å; H121-L123 VanDerWaalsContact O-N 3.14Å
124F86.9Confident87Confident5 Ų560.1 Ų60.12%0.02235%0.345CS..Hα-helixtrans-104.4-0.8-177-57.7-64.7000113.2Y75 A98 T100 A101 K104 L105 L117 V119 S120 H121 L136Y75-F124 HydrophobicContact CD1-CB 3.88Å; Y75-F124 AromaticContact CD1-CD2 3.43Å; Y75-F124 HydrophobicContact CD1-CD2 3.43Å; Y75-F124 VanDerWaalsContact CD1-CD2 3.43Å; Y75-F124 HydrophobicContact CD1-CE2 4.23Å; Y75-F124 AromaticContact CD1-CG 3.83Å; Y75-F124 HydrophobicContact CD1-CG 3.83Å; Y75-F124 HydrophobicContact CD2-CD2 4.04Å; Y75-F124 HydrophobicContact CD2-CE2 4.04Å; Y75-F124 HydrophobicContact CE1-CB 4.27Å; Y75-F124 AromaticContact CE1-CD2 3.71Å; Y75-F124 HydrophobicContact CE1-CD2 3.71Å; Y75-F124 HydrophobicContact CE1-CG 4.36Å; Y75-F124 HydrophobicContact CE2-CD2 4.29Å; Y75-F124 HydrophobicContact CE2-CE2 4.4Å; Y75-F124 AromaticContact CG-CD2 3.6Å; Y75-F124 HydrophobicContact CG-CD2 3.6Å; Y75-F124 AromaticContact CG-CE2 3.94Å; Y75-F124 HydrophobicContact CG-CE2 3.94Å; Y75-F124 HydrophobicContact CG-CG 4.18Å; A98-F124 HydrophobicContact CB-CB 4.19Å; T100-F124 WeakPolarHBondContact CB-O 3.01Å; T100-F124 PolarHBondContact OG1-O 3.5Å; A101-F124 HydrophobicContact CB-CD1 4.4Å; K104-F124 HydrophobicContact CB-CD1 4.04Å; K104-F124 HydrophobicContact CB-CE1 3.99Å; K104-F124 HydrophobicContact CG-CD1 4.24Å; K104-F124 HydrophobicContact CG-CE1 4.06Å; L105-F124 HydrophobicContact CD1-CE1 3.68Å; L105-F124 HydrophobicContact CD1-CZ 3.89Å; L117-F124 HydrophobicContact CD2-CZ 4.45Å; V119-F124 HydrophobicContact CG1-CE2 4.31Å; S120-F124 VanDerWaalsContact O-CD2 3.23Å; S120-F124 WeakPolarHBondContact O-CD2 3.07Å; H121-F124 CarbonylContact O-C 3.6Å; H121-F124 PolarHBondContact O-N 3.46Å; F124-L136 HydrophobicContact CZ-CD1 4.07Å; F124-L136 HydrophobicContact CZ-CD2 4.03Å
125G84.3Confident86.9Confident44 Ų4455.8 Ų55.845%0.45433%0.325SS..SBendtrans100.2-128.4175.600000113.3H121H121-G125 CarbonylContact O-C 3.55Å; H121-G125 PolarHBondContact O-N 2.92Å
126K85Confident86.8Confident194 Ų19455.4 Ų55.484%0.84332%0.322SS*.SBendtrans-70.3134.2177.3-173.5177-179.5179.90109.8P128K126-P128 WeakPolarHBondContact O-CD 3.45Å; K126-P128 VanDerWaalsContact O-N 3.16Å
127D87.4Confident86.6Confident35 Ų3553.3 Ų53.319%0.18731%0.312CS..  trans-56.2118.1175.9-173.6-10.7000110.4H121 C129 P130 K134H121-D127 HydrophobicContact CB-CB 4.05Å; D127-C129 PolarHBondContact O-N 2.8Å; D127-C129 PolarHBondContact OD1-N 2.78Å; D127-P130 HydrophobicContact CB-CG 4.33Å; D127-P130 WeakPolarHBondContact OD2-CA 3.48Å; D127-K134 WeakPolarHBondContact OD1-CD 3.3Å; D127-K134 WeakPolarHBondContact OD1-CE 3.22Å; D127-K134 IonicContact OD1-NZ 2.82Å; D127-K134 PolarHBondContact OD1-NZ 2.78Å; D127-K134 IonicContact OD2-NZ 3.36Å; D127-K134 PolarHBondContact OD2-NZ 3Å
128P85.4Confident86.7Confident33 Ų3353 Ų5321%0.21431%0.311CS..SBendtrans-71.1-15.917931.1-37.5000112.7Y75 C96 A98 K126 K134Y75-P128 HydrophobicContact CD1-CG 4.28Å; Y75-P128 HydrophobicContact CE1-CG 4.3Å; C96-P128 WeakPolarHBondContact CB-O 3.29Å; A98-P128 HydrophobicContact CB-CB 4.37Å; A98-P128 HydrophobicContact CB-CG 4.1Å; K126-P128 WeakPolarHBondContact O-CD 3.45Å; K126-P128 VanDerWaalsContact O-N 3.16Å; P128-K134 HydrophobicContact CG-CD 4.05Å
129C86.3Confident86.8Confident10 Ų1051.1 Ų51.17%0.06830%0.296CS..SBendtrans-155.679.9-177.6-109.90000112.1C96 D127 K132 K134C96-C129 HydrophobicContact CB-CB 4.04Å; C96-C129 WeakPolarHBondContact CB-SG 3.36Å; C96-C129 WeakPolarHBondContact SG-CB 3.48Å; C96-C129 CovalentContact SG-SG 2.02Å; C96-C129 PolarHBondContact SG-SG 2.89Å; D127-C129 PolarHBondContact O-N 2.8Å; D127-C129 PolarHBondContact OD1-N 2.78Å; C129-K132 HydrophobicContact CB-CB 4.18Å; C129-K132 HydrophobicContact CB-CD 4.17Å; C129-K132 HydrophobicContact CB-CG 4.21Å; C129-K132 PolarHBondContact O-N 2.87Å; C129-K132 WeakPolarHBondContact SG-CD 3.21Å; C129-K132 WeakPolarHBondContact SG-CE 3.39Å; C129-K132 PolarHBondContact SG-NZ 2.04Å; C129-K134 HydrophobicContact CB-CD 4.43Å; C129-K134 HydrophobicContact CB-CG 4.47Å; C129-K134 PolarHBondContact O-NZ 2.87Å
130P85.4Confident86.8Confident102 Ų10251.5 Ų51.566%0.66230%0.297SS*.THydrogen-bonded Turntrans-54.9138.4170.3-2434.5000111.3D127 K132D127-P130 HydrophobicContact CB-CG 4.33Å; D127-P130 WeakPolarHBondContact OD2-CA 3.48Å; P130-K132 PolarHBondContact O-N 3.07Å
131G79.8Confident86.8Confident85 Ų8553.6 Ų53.688%0.87630%0.302SS*.THydrogen-bonded Turntrans67.112.9177.900000115.8
132K81.2Confident86.8Confident43 Ų4350.6 Ų50.619%0.18729%0.289CS..SBendtrans-116147.4165-51-167.1-165.8161.80110.7H94 C129 P130 K134H94-K132 PolarHBondContact O-NZ 2.79Å; C129-K132 HydrophobicContact CB-CB 4.18Å; C129-K132 HydrophobicContact CB-CD 4.17Å; C129-K132 HydrophobicContact CB-CG 4.21Å; C129-K132 PolarHBondContact O-N 2.87Å; C129-K132 WeakPolarHBondContact SG-CD 3.21Å; C129-K132 WeakPolarHBondContact SG-CE 3.39Å; C129-K132 PolarHBondContact SG-NZ 2.04Å; P130-K132 PolarHBondContact O-N 3.07Å; K132-K134 PolarHBondContact O-N 2.85Å; K132-K134 PolarHBondContact O-NZ 2.03Å
133N81.8Confident86.4Confident102 Ų10247.4 Ų47.455%0.54527%0.269SS..  trans-60.5133.1164.6-65.419.6000108.9S77 C83S77-N133 WeakPolarHBondContact CB-O 3.23Å; S77-N133 PolarHBondContact OG-O 2.84Å; C83-N133 PolarHBondContact O-ND2 3.2Å
134K87.9Confident85.9Confident9 Ų946.6 Ų46.64%0.03927%0.267CS..  trans-118.4146.6179.3-67.6174.9-70.3-780109.9D54 Y75 G76 D127 P128 C129 K132D54-K134 HydrophobicContact CB-CB 4.25Å; D54-K134 PolarHBondContact N-O 2.96Å; D54-K134 WeakPolarHBondContact OD2-CE 3Å; D54-K134 IonicContact OD2-NZ 2.99Å; Y75-K134 HydrophobicContact CE1-CD 4.12Å; Y75-K134 HydrophobicContact CE2-CB 3.92Å; Y75-K134 WeakPolarHBondContact OH-CE 3.41Å; G76-K134 CarbonylContact O-C 3.51Å; G76-K134 VanDerWaalsContact O-CA 3.22Å; G76-K134 WeakPolarHBondContact O-CA 3.04Å; D127-K134 WeakPolarHBondContact OD1-CD 3.3Å; D127-K134 WeakPolarHBondContact OD1-CE 3.22Å; D127-K134 IonicContact OD1-NZ 2.82Å; D127-K134 PolarHBondContact OD1-NZ 2.78Å; D127-K134 IonicContact OD2-NZ 3.36Å; D127-K134 PolarHBondContact OD2-NZ 3Å; P128-K134 HydrophobicContact CG-CD 4.05Å; C129-K134 HydrophobicContact CB-CD 4.43Å; C129-K134 HydrophobicContact CB-CG 4.47Å; C129-K134 PolarHBondContact O-NZ 2.87Å; K132-K134 PolarHBondContact O-N 2.85Å; K132-K134 PolarHBondContact O-NZ 2.03Å
135Y89.1Confident84.9Confident16 Ų1648.9 Ų48.96%0.06328%0.283CS..EExtended strand (participates in β ladder)trans-128147.7171.160.5-97000110A52 F74 Y75 G76 V80 L82 H137A52-Y135 CarbonylContact O-C 3.45Å; A52-Y135 WeakPolarHBondContact O-CA 3.33Å; F74-Y135 HydrophobicContact CD1-CD2 4.24Å; F74-Y135 AromaticContact CD1-CE2 3.71Å; F74-Y135 HydrophobicContact CD1-CE2 3.71Å; F74-Y135 HydrophobicContact CE1-CD2 4.24Å; F74-Y135 AromaticContact CE1-CE2 3.58Å; F74-Y135 HydrophobicContact CE1-CE2 3.58Å; F74-Y135 AromaticContact CE1-CZ 3.77Å; Y75-Y135 WeakPolarHBondContact CA-O 3.44Å; G76-Y135 PolarHBondContact N-O 3.25Å; G76-Y135 PolarHBondContact O-N 3.49Å; V80-Y135 VanDerWaalsContact O-CE1 3.26Å; V80-Y135 WeakPolarHBondContact O-CE1 3.37Å; L82-Y135 HydrophobicContact CB-CD1 3.76Å; L82-Y135 HydrophobicContact CB-CD2 4.41Å; L82-Y135 HydrophobicContact CB-CE1 4.25Å; L82-Y135 HydrophobicContact CB-CG 3.85Å; L82-Y135 HydrophobicContact CD2-CD2 4.12Å; L82-Y135 HydrophobicContact CD2-CG 4.31Å; Y135-H137 HydrophobicContact CD2-CB 4.06Å; Y135-H137 HydrophobicContact CE2-CB 4.07Å
136L91.8Very high84.4Confident0 Ų050.7 Ų50.70%028%0.28CS..EExtended strand (participates in β ladder)trans-92.7125.8163.1179.765.3000107.5H51 A52 L58 F74 Y75 L105 V119 F124 V138H51-L136 CarbonylContact C-O 3.5Å; H51-L136 WeakPolarHBondContact CA-O 3.43Å; H51-L136 WeakPolarHBondContact CB-O 3.43Å; A52-L136 PolarHBondContact N-O 2.8Å; A52-L136 PolarHBondContact O-N 2.03Å; L58-L136 HydrophobicContact CB-CD2 4.18Å; L58-L136 HydrophobicContact CD2-CD2 3.78Å; L58-L136 HydrophobicContact CG-CD2 4.39Å; F74-L136 CarbonylContact O-C 3.56Å; F74-L136 WeakPolarHBondContact O-CA 3.3Å; Y75-L136 HydrophobicContact CD2-CB 4.09Å; L105-L136 HydrophobicContact CD1-CD1 4.22Å; L105-L136 HydrophobicContact CD1-CD2 4.17Å; L105-L136 HydrophobicContact CD2-CD1 4.42Å; L105-L136 HydrophobicContact CD2-CD2 4.35Å; V119-L136 HydrophobicContact CG1-CB 3.83Å; V119-L136 HydrophobicContact CG2-CB 3.95Å; V119-L136 HydrophobicContact CG2-CD2 3.57Å; V119-L136 HydrophobicContact CG2-CG 4.43Å; F124-L136 HydrophobicContact CZ-CD1 4.07Å; F124-L136 HydrophobicContact CZ-CD2 4.03Å; L136-V138 HydrophobicContact CD1-CG2 4.23Å; L136-V138 HydrophobicContact CD2-CG2 4.2Å; L136-V138 HydrophobicContact CG-CG2 3.83Å
137H91.9Very high84.2Confident69 Ų6945.8 Ų45.832%0.31926%0.259SS..EExtended strand (participates in β ladder)trans-119.2133.5170.4-175.292.6000108.9A73 F74 Y135A73-H137 CarbonylContact C-O 3.55Å; A73-H137 WeakPolarHBondContact CA-O 3.32Å; F74-H137 PolarHBondContact N-O 2.91Å; F74-H137 PolarHBondContact O-N 2.73Å; Y135-H137 HydrophobicContact CD2-CB 4.06Å; Y135-H137 HydrophobicContact CE2-CB 4.07Å
138V93.1Very high84.2Confident0 Ų048.1 Ų48.10%027%0.268CS..EExtended strand (participates in β ladder)trans-133.4129.9-170.9-169.90000109.1S49 A50 L58 L60 I70 L105 L136S49-V138 CarbonylContact C-O 3.59Å; S49-V138 VanDerWaalsContact CA-O 3.29Å; S49-V138 WeakPolarHBondContact CA-O 3.43Å; A50-V138 PolarHBondContact N-O 2.9Å; A50-V138 PolarHBondContact O-N 2.79Å; L58-V138 HydrophobicContact CD1-CG2 4.13Å; L58-V138 HydrophobicContact CD2-CG2 3.82Å; L60-V138 HydrophobicContact CD1-CG1 4.4Å; I70-V138 HydrophobicContact CD1-CG1 4.04Å; I70-V138 HydrophobicContact CG2-CG1 4.48Å; L105-V138 HydrophobicContact CD2-CB 4.14Å; L105-V138 HydrophobicContact CD2-CG1 3.62Å; L105-V138 HydrophobicContact CD2-CG2 3.35Å; L136-V138 HydrophobicContact CD1-CG2 4.23Å; L136-V138 HydrophobicContact CD2-CG2 4.2Å; L136-V138 HydrophobicContact CG-CG2 3.83Å
139N92.9Very high84.5Confident43 Ų4351 Ų5123%0.2329%0.285CS..EExtended strand (participates in β ladder)trans-108.4124.8167.7-171.6-0000108.6S47 Q48 Q71 S72S47-N139 VanDerWaalsContact CB-OD1 3.28Å; S47-N139 WeakPolarHBondContact CB-OD1 3.3Å; S47-N139 PolarHBondContact OG-ND2 3.19Å; S47-N139 PolarHBondContact OG-OD1 3.25Å; Q48-N139 CarbonylContact O-C 3.5Å; Q48-N139 WeakPolarHBondContact O-CA 3.28Å; Q48-N139 PolarHBondContact O-OD1 3.27Å; Q71-N139 WeakPolarHBondContact CA-O 3.25Å; Q71-N139 HydrophobicContact CB-CB 4.46Å; Q71-N139 WeakPolarHBondContact CB-O 3.45Å; Q71-N139 PolarHBondContact N-O 2.85Å; S72-N139 PolarHBondContact N-O 2.85Å; S72-N139 VanDerWaalsContact N-O 3.13Å; S72-N139 PolarHBondContact O-N 3.38Å; S72-N139 WeakPolarHBondContact OG-CB 3.22Å
140Y91Very high84.9Confident11 Ų1153.4 Ų53.44%0.04330%0.295CS..EExtended strand (participates in β ladder)trans-142.1165.6-176.272.9-74.2000111.8Q48 A50 L60 I68 S69Q48-Y140 HydrophobicContact CB-CD1 3.88Å; Q48-Y140 HydrophobicContact CB-CE1 3.54Å; Q48-Y140 HydrophobicContact CB-CE2 4.26Å; Q48-Y140 HydrophobicContact CB-CG 4.37Å; Q48-Y140 PolarHBondContact N-O 2.93Å; Q48-Y140 PolarHBondContact NE2-OH 3.43Å; Q48-Y140 VanDerWaalsContact O-CD1 3.24Å; Q48-Y140 WeakPolarHBondContact O-CD1 3.4Å; Q48-Y140 PolarHBondContact O-N 2.92Å; A50-Y140 HydrophobicContact CB-CE1 3.89Å; L60-Y140 HydrophobicContact CD2-CD1 3.95Å; L60-Y140 HydrophobicContact CD2-CE1 3.68Å; I68-Y140 HydrophobicContact CG2-CD2 4.21Å; S69-Y140 WeakPolarHBondContact O-CA 3.4Å
141K87.8Confident85.3Confident75 Ų7551.4 Ų51.433%0.32628%0.281SS..EExtended strand (participates in β ladder)trans-135149.8172.6-67.5-179.4-180177.60109.7S47 S69 Q71S47-K141 VanDerWaalsContact OG-CE 3.23Å; S47-K141 WeakPolarHBondContact OG-CE 3.29Å; S69-K141 WeakPolarHBondContact CB-O 3.41Å; S69-K141 PolarHBondContact N-O 3.22Å; S69-K141 PolarHBondContact O-N 3Å; Q71-K141 HydrophobicContact CG-CD 4.34Å; Q71-K141 HydrophobicContact CG-CG 4.07Å
142C83.7Confident86.1Confident2 Ų247.7 Ų47.71%0.01424%0.242CC..EExtended strand (participates in β ladder)trans-93.8111.6173.2-63.70000110.3I44 C62 T67I44-C142 HydrophobicContact CB-CB 4.5Å; I44-C142 HydrophobicContact CG1-CB 3.58Å; I44-C142 WeakPolarHBondContact CG1-O 3.46Å; C62-C142 WeakPolarHBondContact CA-SG 3.48Å; C62-C142 HydrophobicContact CB-CB 3.74Å; C62-C142 WeakPolarHBondContact CB-SG 3.46Å; C62-C142 VanDerWaalsContact SG-CA 3.51Å; C62-C142 WeakPolarHBondContact SG-CB 3.46Å; C62-C142 CovalentContact SG-SG 2.03Å; C62-C142 PolarHBondContact SG-SG 3.06Å; T67-C142 CarbonylContact O-C 3.58Å; T67-C142 WeakPolarHBondContact O-CA 3.5Å
143K77.1Confident86.7Confident71 Ų7146.5 Ų46.531%0.30924%0.239SC..EExtended strand (participates in β ladder)trans-96.5148.4176.863.6179.8177.1-1750110.8S66 T67 N111S66-K143 CarbonylContact C-O 3.54Å; S66-K143 WeakPolarHBondContact CA-O 3.32Å; S66-K143 WeakPolarHBondContact CB-O 3.17Å; T67-K143 PolarHBondContact N-O 2.75Å; T67-K143 PolarHBondContact O-N 2.77Å; N111-K143 VanDerWaalsContact OD1-CE 3.32Å; N111-K143 WeakPolarHBondContact OD1-CE 3.16Å; N111-K143 PolarHBondContact OD1-NZ 2.94Å
144P73.4Confident87.3Confident30 Ų3043.8 Ų43.820%0.19522%0.223CC..EExtended strand (participates in β ladder)trans-57.1138.6174.2-3040.2000112.9H65 H147 Y171H65-P144 WeakPolarHBondContact O-CA 3.29Å; P144-H147 PolarHBondContact O-CE1 3.21Å; P144-Y171 WeakPolarHBondContact CG-OH 3.46Å
145S67.2Low87.5Confident53 Ų5346.8 Ų46.837%0.37126%0.257SS..SBendtrans-86.2-34.7-171.566.40000113.6H65H65-S145 VanDerWaalsContact CA-OG 3.3Å; H65-S145 WeakPolarHBondContact CA-OG 3.02Å; H65-S145 PolarHBondContact O-N 2.82Å; H65-S145 PolarHBondContact O-OG 3.22Å
146E72.9Confident87.8Confident82 Ų8250.3 Ų50.338%0.38327%0.274SS..  trans-106.7100-176.4-72.1170.5-11800110.6H65 K148 S242H65-E146 IonicContact CE1-OE1 2.68Å; H65-E146 IonicContact CG-OE1 3.85Å; H65-E146 IonicContact ND1-OE1 2.81Å; H65-E146 PolarHBondContact ND1-OE1 3.13Å; E146-K148 WeakPolarHBondContact OE2-CE 3.44Å; E146-K148 IonicContact OE2-NZ 2.72Å; E146-K148 PolarHBondContact OE2-NZ 3.19Å; E146-S242 WeakPolarHBondContact O-CB 3.32Å
147H80.4Confident88Confident90 Ų9054.2 Ų54.242%0.41730%0.298SS..  trans-92.1131.1163-60.785.5000108.5P144 Y171 L240P144-H147 PolarHBondContact O-CE1 3.21Å; H147-Y171 AromaticContact CD2-CD2 3.69Å; H147-Y171 AromaticContact CD2-CE2 3.48Å; H147-Y171 VanDerWaalsContact CD2-CE2 3.48Å; H147-Y171 WeakPolarHBondContact CD2-CE2 3.31Å; H147-Y171 AromaticContact NE2-CE2 3.73Å; H147-Y171 AromaticContact NE2-CZ 3.8Å; H147-L240 HydrophobicContact CB-CD1 3.94Å
148K87.9Confident88.2Confident84 Ų8451.1 Ų51.137%0.36528%0.284SS..EExtended strand (participates in β ladder)trans-115.5124.1-177.2-60.8-173.9-176.7-1770108.2E146 Y241E146-K148 WeakPolarHBondContact OE2-CE 3.44Å; E146-K148 IonicContact OE2-NZ 2.72Å; E146-K148 PolarHBondContact OE2-NZ 3.19Å; K148-Y241 HydrophobicContact CB-CD1 4.26Å; K148-Y241 HydrophobicContact CB-CE1 3.88Å; K148-Y241 HydrophobicContact CB-CE2 4.28Å; K148-Y241 PolarHBondContact N-O 3.18Å; K148-Y241 WeakPolarHBondContact O-CD1 3.39Å; K148-Y241 PolarHBondContact O-N 3.29Å
149T91.9Very high88.4Confident93 Ų9354.1 Ų54.157%0.57130%0.299SS*.EExtended strand (participates in β ladder)trans-96.3127.6171.5-53.80000107.9V239 L240T149-V239 WeakPolarHBondContact CA-O 3.34Å; T149-L240 WeakPolarHBondContact OG1-CD1 3.49Å
150Q94.2Very high88.5Confident61 Ų6152.1 Ų52.129%0.28529%0.288SS..EExtended strand (participates in β ladder)trans-127.9136.8171.6-174.7171.8-8.900109.2M158 I159 L160 V239 Y241Q150-M158 HydrophobicContact CG-CE 4.47Å; Q150-M158 VanDerWaalsContact O-CE 3.32Å; Q150-M158 WeakPolarHBondContact O-CE 3.12Å; Q150-I159 PolarHBondContact NE2-O 2.98Å; Q150-L160 HydrophobicContact CB-CD2 4.35Å; Q150-L160 VanDerWaalsContact OE1-CD2 3.3Å; Q150-V239 PolarHBondContact N-O 3.43Å; Q150-V239 PolarHBondContact O-N 3.14Å; Q150-Y241 HydrophobicContact CB-CE1 3.91Å; Q150-Y241 PolarHBondContact OE1-OH 2.76Å
151V95.2Very high88.7Confident61 Ų6158.9 Ų58.937%0.3731%0.314SS..EExtended strand (participates in β ladder)trans-117.5144.8179-179.30000108.6T184 Y236 L237V151-T184 HydrophobicContact CG1-CG2 3.76Å; V151-Y236 HydrophobicContact CG1-CD2 3.79Å; V151-Y236 HydrophobicContact CG1-CG 4.04Å; V151-L237 VanDerWaalsContact CA-O 3.29Å; V151-L237 WeakPolarHBondContact CA-O 3.07Å
152A95.6Very high88.9Confident7 Ų755.9 Ų55.96%0.05830%0.302CS..EExtended strand (participates in β ladder)trans-144.5146.217000000109.7E156 M158 V220 Y236 L237A152-E156 WeakPolarHBondContact CA-OE2 3.43Å; A152-E156 HydrophobicContact CB-CB 4.43Å; A152-M158 HydrophobicContact CB-CB 3.85Å; A152-M158 HydrophobicContact CB-CE 3.74Å; A152-M158 HydrophobicContact CB-CG 4.26Å; A152-V220 HydrophobicContact CB-CG2 4.02Å; A152-Y236 CarbonylContact O-C 3.54Å; A152-Y236 VanDerWaalsContact O-CA 3.3Å; A152-Y236 WeakPolarHBondContact O-CA 3.4Å; A152-Y236 WeakPolarHBondContact O-CB 3.29Å; A152-L237 PolarHBondContact N-O 2.95Å; A152-L237 PolarHBondContact O-N 3.45Å
153C94.1Very high89.1Confident18 Ų1864.5 Ų64.512%0.12234%0.339CS..EExtended strand (participates in β ladder)trans-84.4157.9-170.9-51.60000113G155 E156 C185 V220C153-G155 PolarHBondContact O-N 3.26Å; C153-E156 HydrophobicContact CB-CG 4.14Å; C153-E156 PolarHBondContact N-OE2 3.2Å; C153-E156 VanDerWaalsContact O-CB 3.31Å; C153-E156 WeakPolarHBondContact O-CB 3.44Å; C153-E156 PolarHBondContact O-N 2.95Å; C153-C185 WeakPolarHBondContact CA-SG 3.47Å; C153-C185 HydrophobicContact CB-CB 3.72Å; C153-C185 WeakPolarHBondContact CB-SG 3.43Å; C153-C185 VanDerWaalsContact SG-CA 3.56Å; C153-C185 WeakPolarHBondContact SG-CB 3.17Å; C153-C185 CovalentContact SG-SG 2.03Å; C153-C185 PolarHBondContact SG-SG 3.1Å; C153-V220 WeakPolarHBondContact O-CB 3.32Å; C153-V220 WeakPolarHBondContact O-CG1 3.48Å
154E93.6Very high89.4Confident44 Ų4466.4 Ų66.421%0.20636%0.357CS..THydrogen-bonded Turntrans-53.5122.6168.3-176.5172.1-164.700111.1N222 K235E154-N222 PolarHBondContact OE1-ND2 3.25Å; E154-N222 PolarHBondContact OE1-OD1 2.88Å; E154-K235 HydrophobicContact CB-CB 4.39Å; E154-K235 VanDerWaalsContact CB-O 3.28Å; E154-K235 WeakPolarHBondContact CB-O 3.33Å; E154-K235 PolarHBondContact N-O 3.39Å; E154-K235 WeakPolarHBondContact OE1-CE 3.24Å; E154-K235 IonicContact OE1-NZ 3.68Å; E154-K235 PolarHBondContact OE1-NZ 2.94Å; E154-K235 WeakPolarHBondContact OE2-CE 3.33Å; E154-K235 PolarHBondContact OE2-N 3.36Å; E154-K235 IonicContact OE2-NZ 2.96Å; E154-K235 PolarHBondContact OE2-NZ 3.44Å
155G92.1Very high89.7Confident73 Ų7369 Ų6975%0.75337%0.374SS*.THydrogen-bonded Turntrans102.5-16.1-172.400000115C153 V220C153-G155 PolarHBondContact O-N 3.26Å; G155-V220 PolarHBondContact N-O 2.8Å
156E95.3Very high90.5Very high89 Ų8967.9 Ų67.942%0.41636%0.364SS..  trans-90.1170.1-177.5-61.7176.9176.100113A152 C153 V220A152-E156 WeakPolarHBondContact CA-OE2 3.43Å; A152-E156 HydrophobicContact CB-CB 4.43Å; C153-E156 HydrophobicContact CB-CG 4.14Å; C153-E156 PolarHBondContact N-OE2 3.2Å; C153-E156 VanDerWaalsContact O-CB 3.31Å; C153-E156 WeakPolarHBondContact O-CB 3.44Å; C153-E156 PolarHBondContact O-N 2.95Å; E156-V220 WeakPolarHBondContact O-CB 3.24Å; E156-V220 PolarHBondContact O-N 3.3Å
157T96.3Very high91.3Very high83 Ų8364.2 Ų64.251%0.50935%0.347SS..EExtended strand (participates in β ladder)trans-111.6111166.7-63.80000109.4I159 A217 V218T157-I159 HydrophobicContact CG2-CG1 4.28Å; T157-I159 PolarHBondContact O-N 3.31Å; T157-A217 HydrophobicContact CG2-CB 4Å; T157-V218 CarbonylContact C-O 3.59Å; T157-V218 WeakPolarHBondContact CA-O 3.28Å
158M96.4Very high91.7Very high4 Ų460 Ų602%0.0233%0.327CS..EExtended strand (participates in β ladder)trans-69.4129.6173.3-174.9178.5-76.700109.5Q150 A152 L160 A217 V218 V220 L237 V239Q150-M158 HydrophobicContact CG-CE 4.47Å; Q150-M158 VanDerWaalsContact O-CE 3.32Å; Q150-M158 WeakPolarHBondContact O-CE 3.12Å; A152-M158 HydrophobicContact CB-CB 3.85Å; A152-M158 HydrophobicContact CB-CE 3.74Å; A152-M158 HydrophobicContact CB-CG 4.26Å; M158-L160 HydrophobicContact CG-CD2 3.95Å; M158-L160 HydrophobicContact CG-CG 4.44Å; M158-L160 HydrophobicContact SD-CD2 3.74Å; M158-L160 HydrophobicContact SD-CG 4.38Å; M158-A217 CarbonylContact O-C 3.6Å; M158-A217 VanDerWaalsContact O-CA 3.3Å; M158-A217 WeakPolarHBondContact O-CA 3.38Å; M158-V218 PolarHBondContact N-O 3.07Å; M158-V218 PolarHBondContact O-N 3.2Å; M158-V220 HydrophobicContact CB-CG2 4.17Å; M158-L237 HydrophobicContact CE-CB 4.2Å; M158-L237 HydrophobicContact CE-CD2 3.99Å; M158-L237 HydrophobicContact CE-CG 4.08Å; M158-L237 WeakPolarHBondContact CE-O 3.44Å; M158-L237 HydrophobicContact SD-CD2 3.98Å; M158-V239 HydrophobicContact CE-CB 4.49Å; M158-V239 HydrophobicContact CE-CG2 3.92Å; M158-V239 HydrophobicContact SD-CB 3.98Å; M158-V239 HydrophobicContact SD-CG2 3.41Å; M158-V239 WeakPolarHBondContact SD-CG2 3.47Å
159I96.9Very high91.6Very high63 Ų6356.8 Ų56.832%0.32331%0.314SS..EExtended strand (participates in β ladder)trans-119.7110.2177-52.9178.9000109.6Q150 T157 R161 C216 A217Q150-I159 PolarHBondContact NE2-O 2.98Å; T157-I159 HydrophobicContact CG2-CG1 4.28Å; T157-I159 PolarHBondContact O-N 3.31Å; I159-R161 HydrophobicContact CG2-CG 4.03Å; I159-C216 WeakPolarHBondContact CA-O 3.47Å; I159-C216 WeakPolarHBondContact CG2-O 3.35Å; I159-A217 HydrophobicContact CG1-CB 4.39Å
160L95.9Very high91.4Very high1 Ų152.9 Ų52.91%0.00529%0.29CS..EExtended strand (participates in β ladder)trans-93.4137.7175.4-53.2-178.2000109.6Q150 M158 L168 I170 V206 C210 K215 C216 V239 Y241Q150-L160 HydrophobicContact CB-CD2 4.35Å; Q150-L160 VanDerWaalsContact OE1-CD2 3.3Å; M158-L160 HydrophobicContact CG-CD2 3.95Å; M158-L160 HydrophobicContact CG-CG 4.44Å; M158-L160 HydrophobicContact SD-CD2 3.74Å; M158-L160 HydrophobicContact SD-CG 4.38Å; L160-L168 HydrophobicContact CB-CD1 3.63Å; L160-L168 HydrophobicContact CB-CD2 3.79Å; L160-L168 HydrophobicContact CB-CG 4.39Å; L160-L168 HydrophobicContact CD1-CD1 4.45Å; L160-I170 HydrophobicContact CD1-CD1 3.77Å; L160-V206 HydrophobicContact CD1-CG1 4.47Å; L160-C210 HydrophobicContact CD1-CB 4.38Å; L160-K215 WeakPolarHBondContact O-CA 3.37Å; L160-C216 HydrophobicContact CB-CB 4.31Å; L160-C216 PolarHBondContact N-O 3.1Å; L160-C216 PolarHBondContact O-N 3.08Å; L160-V239 HydrophobicContact CD1-CG1 4.18Å; L160-Y241 HydrophobicContact CD2-CD1 4.07Å; L160-Y241 HydrophobicContact CD2-CE1 3.73Å
161R94.8Very high90.9Very high153 Ų15354.3 Ų54.358%0.57729%0.293SS*.EExtended strand (participates in β ladder)trans-143.4140.3-178.7-56.3-169.5-171.7-154.38.4113.2I159 Q214 K215I159-R161 HydrophobicContact CG2-CG 4.03Å; R161-Q214 CarbonylContact C-O 3.44Å; R161-Q214 WeakPolarHBondContact CA-O 3.09Å; R161-K215 HydrophobicContact CG-CG 4.3Å
162C91.3Very high90.6Very high11 Ų1153.2 Ų53.27%0.07429%0.291CS..  trans-118.4149.5168.1-61.60000111.1N166 L168 Q214 C243C162-N166 HydrophobicContact CB-CB 4.1Å; C162-N166 VanDerWaalsContact CB-O 3.22Å; C162-N166 WeakPolarHBondContact CB-O 3.08Å; C162-L168 WeakPolarHBondContact SG-CD2 3.41Å; C162-Q214 HydrophobicContact CB-CG 4.43Å; C162-Q214 PolarHBondContact N-O 3.19Å; C162-Q214 WeakPolarHBondContact O-CG 3.02Å; C162-Q214 PolarHBondContact O-NE2 2.97Å; C162-C243 WeakPolarHBondContact CA-SG 3.46Å; C162-C243 HydrophobicContact CB-CB 3.79Å; C162-C243 WeakPolarHBondContact CB-SG 3.45Å; C162-C243 VanDerWaalsContact SG-CA 3.5Å; C162-C243 WeakPolarHBondContact SG-CB 3.38Å; C162-C243 CovalentContact SG-SG 2.04Å; C162-C243 PolarHBondContact SG-SG 2.93Å
163K89.3Confident90.5Very high184 Ų18453 Ų5380%0.829%0.289SS*.  trans-76.6144169.4-64.8-175.3179-176.60109.5N166K163-N166 WeakPolarHBondContact O-CA 3.33Å; K163-N166 VanDerWaalsContact O-CB 3.3Å; K163-N166 WeakPolarHBondContact O-CB 3.32Å; K163-N166 PolarHBondContact O-N 2.97Å
164T83.4Confident90.5Very high110 Ų11053.6 Ų53.668%0.67529%0.292SS*.THydrogen-bonded Turntrans-57.8138.6175.9-43.20000109.6Q214T164-Q214 PolarHBondContact OG1-NE2 2.9Å
165P80.1Confident90.6Very high84 Ų8451.5 Ų51.555%0.54528%0.282SS..THydrogen-bonded Turncis-94.222.73.939.9-36.9000114.2K246P165-K246 WeakPolarHBondContact O-CB 3.12Å; P165-K246 PolarHBondContact O-N 2.93Å
166N84Confident90.6Very high30 Ų3048 Ų4816%0.1625%0.246CC..EExtended strand (participates in β ladder)trans-86.7149.5-172.6-58.3-9.6000112.5C162 K163 C243 V244 P245C162-N166 HydrophobicContact CB-CB 4.1Å; C162-N166 VanDerWaalsContact CB-O 3.22Å; C162-N166 WeakPolarHBondContact CB-O 3.08Å; K163-N166 WeakPolarHBondContact O-CA 3.33Å; K163-N166 VanDerWaalsContact O-CB 3.3Å; K163-N166 WeakPolarHBondContact O-CB 3.32Å; K163-N166 PolarHBondContact O-N 2.97Å; N166-C243 HydrophobicContact CB-CB 4.12Å; N166-V244 CarbonylContact C-O 3.57Å; N166-V244 VanDerWaalsContact CA-O 3.25Å; N166-V244 WeakPolarHBondContact CA-O 3.29Å; N166-P245 WeakPolarHBondContact OD1-CA 3.39Å; N166-P245 WeakPolarHBondContact OD1-CD 3.41Å; N166-P245 WeakPolarHBondContact OD1-CG 3.07Å
167V88.1Confident90.3Very high6 Ų644.2 Ų44.24%0.03623%0.228CC..EExtended strand (participates in β ladder)trans-128.1158.8-179.9-70.10000111S212 Q214 C243 V244 K246 L249V167-S212 WeakPolarHBondContact CG1-O 3.37Å; V167-Q214 HydrophobicContact CG1-CB 4.49Å; V167-C243 WeakPolarHBondContact O-CA 3.35Å; V167-V244 WeakPolarHBondContact CG2-O 3.45Å; V167-V244 PolarHBondContact N-O 3.14Å; V167-V244 PolarHBondContact O-N 2.94Å; V167-K246 HydrophobicContact CG1-CB 4.04Å; V167-K246 HydrophobicContact CG1-CD 4.2Å; V167-K246 HydrophobicContact CG1-CG 4.12Å; V167-K246 HydrophobicContact CG2-CB 4.16Å; V167-K246 HydrophobicContact CG2-CG 4.41Å; V167-L249 HydrophobicContact CG2-CD1 3.55Å; V167-L249 HydrophobicContact CG2-CG 4.18Å
168L89.7Confident89.8Confident0 Ų041 Ų410%021%0.211CC..EExtended strand (participates in β ladder)trans-76.4130.7-175-67.2162.8000112L160 C162 C210 S212 K213 C216 Y241L160-L168 HydrophobicContact CB-CD1 3.63Å; L160-L168 HydrophobicContact CB-CD2 3.79Å; L160-L168 HydrophobicContact CB-CG 4.39Å; L160-L168 HydrophobicContact CD1-CD1 4.45Å; C162-L168 WeakPolarHBondContact SG-CD2 3.41Å; L168-C210 HydrophobicContact CD1-CB 4.32Å; L168-S212 PolarHBondContact O-N 3.35Å; L168-K213 WeakPolarHBondContact CB-O 3.28Å; L168-K213 WeakPolarHBondContact CD1-O 3.49Å; L168-K213 VanDerWaalsContact CG-O 3.29Å; L168-K213 WeakPolarHBondContact CG-O 3.33Å; L168-K213 PolarHBondContact N-O 3.44Å; L168-C216 HydrophobicContact CD1-CB 3.7Å; L168-Y241 HydrophobicContact CD2-CD2 3.47Å; L168-Y241 VanDerWaalsContact CD2-CD2 3.47Å; L168-Y241 HydrophobicContact CD2-CE2 3.65Å; L168-Y241 HydrophobicContact CD2-CG 4.41Å
169I85.7Confident89.1Confident17 Ų1746.2 Ų46.29%0.08724%0.239CC..EExtended strand (participates in β ladder)trans-115.8127.9163-70.2-63.5000108.5Y171 Y211 Y241 S242 V244 L249I169-Y171 HydrophobicContact CG2-CD1 4.44Å; I169-Y171 HydrophobicContact CG2-CD2 4.47Å; I169-Y171 HydrophobicContact CG2-CE1 3.89Å; I169-Y171 HydrophobicContact CG2-CE2 3.93Å; I169-Y211 HydrophobicContact CD1-CD2 3.86Å; I169-Y211 HydrophobicContact CD1-CE1 4.18Å; I169-Y211 HydrophobicContact CD1-CE2 3.25Å; I169-Y211 VanDerWaalsContact CD1-CZ 3.42Å; I169-Y241 CarbonylContact O-C 3.57Å; I169-Y241 WeakPolarHBondContact O-CA 3.39Å; I169-Y241 WeakPolarHBondContact O-CB 3.24Å; I169-S242 PolarHBondContact N-O 3.15Å; I169-S242 PolarHBondContact O-N 2.96Å; I169-V244 HydrophobicContact CG1-CG1 4.48Å; I169-V244 HydrophobicContact CG1-CG2 3.66Å; I169-L249 HydrophobicContact CD1-CD1 3.64Å; I169-L249 HydrophobicContact CD1-CD2 3.69Å; I169-L249 HydrophobicContact CD1-CG 4.33Å; I169-L249 HydrophobicContact CG1-CD1 4.29Å; I169-L249 HydrophobicContact CG1-CD2 4.11Å
170I86.8Confident87.7Confident12 Ų1246.5 Ų46.56%0.06226%0.257CS..EExtended strand (participates in β ladder)trans-104125-179.3-47.8-58.6000107.9L160 V203 V206 C210 V239L160-I170 HydrophobicContact CD1-CD1 3.77Å; I170-V203 HydrophobicContact CG2-CG2 4.36Å; I170-V206 HydrophobicContact CD1-CG1 4.05Å; I170-V206 HydrophobicContact CG1-CG1 4.1Å; I170-V206 HydrophobicContact CG2-CB 4.37Å; I170-V206 HydrophobicContact CG2-CG1 3.95Å; I170-C210 HydrophobicContact CD1-CB 4.04Å; I170-C210 HydrophobicContact CG1-CB 4.19Å; I170-V239 HydrophobicContact CD1-CG1 4.21Å; I170-V239 HydrophobicContact CG2-CG1 4.09Å
171Y84.8Confident86.4Confident90 Ų9050.7 Ų50.735%0.35328%0.277SS..EExtended strand (participates in β ladder)trans-99.7-42177.8-61.5-80.3000112P144 H147 I169 L240 S242P144-Y171 WeakPolarHBondContact CG-OH 3.46Å; H147-Y171 AromaticContact CD2-CD2 3.69Å; H147-Y171 AromaticContact CD2-CE2 3.48Å; H147-Y171 VanDerWaalsContact CD2-CE2 3.48Å; H147-Y171 WeakPolarHBondContact CD2-CE2 3.31Å; H147-Y171 AromaticContact NE2-CE2 3.73Å; H147-Y171 AromaticContact NE2-CZ 3.8Å; I169-Y171 HydrophobicContact CG2-CD1 4.44Å; I169-Y171 HydrophobicContact CG2-CD2 4.47Å; I169-Y171 HydrophobicContact CG2-CE1 3.89Å; I169-Y171 HydrophobicContact CG2-CE2 3.93Å; Y171-L240 PolarHBondContact N-O 3.23Å; Y171-S242 WeakPolarHBondContact CE2-OG 3.47Å; Y171-S242 PolarHBondContact OH-OG 2.99Å
172A88.3Confident85Confident39 Ų3947 Ų4732%0.32227%0.272SS..EExtended strand (participates in β ladder)trans-146.2147.1177.300000109.7L240A172-L240 HydrophobicContact CB-CB 4.2Å; A172-L240 PolarHBondContact N-O 2.79Å; A172-L240 PolarHBondContact O-N 3.21Å
173A93.6Very high84.2Confident2 Ų253.1 Ų53.12%0.01730%0.303CS..EExtended strand (participates in β ladder)trans-141.2141.2159.300000109A202 V203 V206 L237 S238 V239A173-A202 HydrophobicContact CB-CB 4.39Å; A173-V203 HydrophobicContact CB-CB 4.44Å; A173-V203 PolarHBondContact O-N 3.06Å; A173-V206 HydrophobicContact CB-CB 3.97Å; A173-V206 HydrophobicContact CB-CG1 4.49Å; A173-V206 HydrophobicContact CB-CG2 3.67Å; A173-L237 HydrophobicContact CB-CD1 4.3Å; A173-S238 CarbonylContact C-O 3.56Å; A173-S238 VanDerWaalsContact CA-O 3.22Å; A173-S238 WeakPolarHBondContact CA-O 3.22Å; A173-V239 HydrophobicContact CB-CB 4.46Å; A173-V239 HydrophobicContact CB-CG1 4.45Å; A173-V239 HydrophobicContact CB-CG2 3.87Å
174V94.8Very high83.9Confident30 Ų3046.3 Ų46.318%0.18228%0.277CS..EExtended strand (participates in β ladder)trans-133.2126.8-179.2-170.60000108.1L198 L237 S238V174-L198 HydrophobicContact CG1-CB 3.77Å; V174-L198 HydrophobicContact CG1-CD2 3.87Å; V174-L198 HydrophobicContact CG1-CG 4.26Å; V174-L237 WeakPolarHBondContact O-CA 3.48Å; V174-S238 PolarHBondContact N-O 3.18Å; V174-S238 PolarHBondContact O-N 3.46Å
175Y95.3Very high84.1Confident0 Ų041.6 Ų41.60%025%0.249CC..EExtended strand (participates in β ladder)trans-108128.3174.2-178.5-115.5000109.9N199 V220 N222 F225 R226 K235 Y236 L237Y175-N199 PolarHBondContact N-O 3.13Å; Y175-N199 VanDerWaalsContact N-O 3.13Å; Y175-N199 WeakPolarHBondContact O-CB 3.28Å; Y175-N199 PolarHBondContact O-N 2.73Å; Y175-V220 HydrophobicContact CD2-CG1 4.09Å; Y175-V220 HydrophobicContact CE2-CG1 3.58Å; Y175-N222 WeakPolarHBondContact CE1-OD1 3.49Å; Y175-N222 PolarHBondContact OH-OD1 2.99Å; Y175-F225 HydrophobicContact CD1-CB 3.36Å; Y175-F225 HydrophobicContact CD1-CD2 4.48Å; Y175-F225 HydrophobicContact CD1-CG 4.17Å; Y175-F225 HydrophobicContact CD2-CB 4.45Å; Y175-F225 HydrophobicContact CD2-CD2 4.14Å; Y175-F225 HydrophobicContact CD2-CG 4.43Å; Y175-F225 HydrophobicContact CE1-CB 3.94Å; Y175-F225 HydrophobicContact CG-CB 3.64Å; Y175-F225 HydrophobicContact CG-CD2 4.11Å; Y175-F225 AromaticContact CG-CG 3.94Å; Y175-F225 HydrophobicContact CG-CG 3.94Å; Y175-R226 WeakPolarHBondContact CD1-O 3.39Å; Y175-K235 HydrophobicContact CE1-CB 4.5Å; Y175-K235 HydrophobicContact CE1-CD 3.91Å; Y175-K235 HydrophobicContact CE2-CB 3.94Å; Y175-K235 WeakPolarHBondContact OH-CE 3.28Å; Y175-Y236 WeakPolarHBondContact CA-O 3.44Å; Y175-Y236 WeakPolarHBondContact CD2-O 3.39Å; Y175-L237 HydrophobicContact CD2-CB 4.15Å
176G92.3Very high84.1Confident1 Ų141.3 Ų41.31%0.0125%0.247CC..EExtended strand (participates in β ladder)trans152.6-147.6-176.700000113.9C197 K235 Y236G176-C197 CarbonylContact C-O 3.57Å; G176-C197 WeakPolarHBondContact CA-O 3.03Å; G176-K235 CarbonylContact O-C 3.58Å; G176-K235 VanDerWaalsContact O-CA 3.28Å; G176-K235 WeakPolarHBondContact O-CA 3.23Å; G176-K235 WeakPolarHBondContact O-CB 3.47Å; G176-Y236 PolarHBondContact N-O 3.17Å; G176-Y236 PolarHBondContact O-N 2.88Å
177R89.4Confident83.5Confident8 Ų842 Ų423%0.0325%0.254CS..EExtended strand (participates in β ladder)trans-141.2128.5169.8-173.1160-152.2104.99.8110.9Q181 T182 T184 C185 E196 C197 T233 R234 Y236R177-Q181 PolarHBondContact NH2-O 2.98Å; R177-T182 PolarHBondContact NH2-O 3.27Å; R177-T184 PolarHBondContact NH1-O 3.33Å; R177-T184 PolarHBondContact NH2-O 3.02Å; R177-C185 PolarHBondContact NH1-O 2.97Å; R177-E196 WeakPolarHBondContact O-CA 3.31Å; R177-C197 PolarHBondContact N-O 3.02Å; R177-C197 PolarHBondContact O-N 2.76Å; R177-T233 HydrophobicContact CB-CG2 4.1Å; R177-R234 PolarHBondContact NH1-O 2.95Å; R177-Y236 HydrophobicContact CB-CE1 4.25Å; R177-Y236 HydrophobicContact CG-CE1 3.95Å
178G85.6Confident82.5Confident15 Ų1550.4 Ų50.416%0.15530%0.298CS..  trans-89.1160.217600000112.7Y236G178-Y236 PolarHBondContact N-OH 3.39Å
179L80.5Confident81.2Confident114 Ų11454.4 Ų54.460%0.59733%0.326SS*.THydrogen-bonded Turntrans-61.2143.3175.7-158.682.4000111.1Q181L179-Q181 PolarHBondContact O-N 3Å
180G67.8Low79.8Confident69 Ų6959 Ų5971%0.71137%0.366SS*.THydrogen-bonded Turntrans71.4-9.5171.400000116.8T182G180-T182 PolarHBondContact O-N 3.07Å
181Q69.6Low78.7Confident90 Ų9069.1 Ų69.142%0.42140%0.403SS..  trans-83.381177.7-64.6-169.4-2.400110.6R177 L179 Y236R177-Q181 PolarHBondContact NH2-O 2.98Å; L179-Q181 PolarHBondContact O-N 3Å; Q181-Y236 PolarHBondContact OE1-OH 3.46Å
182T64.3Low77.6Confident76 Ų7667.2 Ų67.247%0.46640%0.404SS..  trans-69.7-48.1175.845.20000112R177 G180R177-T182 PolarHBondContact NH2-O 3.27Å; G180-T182 PolarHBondContact O-N 3.07Å
183D74.9Confident76.6Confident139 Ų13966.7 Ų66.774%0.74340%0.397SS*.SBendtrans-83.5-21.1-164.4-47.4-16.4000111.9C185D183-C185 PolarHBondContact O-N 3.18Å
184T83.5Confident75.5Confident41 Ų4172 Ų7225%0.25243%0.431SS..SBendtrans-69.3109.4171.7-540000109.7V151 R177 Y236V151-T184 HydrophobicContact CG1-CG2 3.76Å; R177-T184 PolarHBondContact NH1-O 3.33Å; R177-T184 PolarHBondContact NH2-O 3.02Å; T184-Y236 HydrophobicContact CG2-CD1 3.79Å; T184-Y236 HydrophobicContact CG2-CD2 3.9Å; T184-Y236 HydrophobicContact CG2-CE1 3.8Å; T184-Y236 HydrophobicContact CG2-CE2 3.89Å; T184-Y236 HydrophobicContact CG2-CG 3.85Å
185C86.1Confident74.7Confident11 Ų1174.5 Ų74.57%0.07444%0.439CS..SBendtrans51.469177-61.60000112.7C153 R177 D183 Y236C153-C185 WeakPolarHBondContact CA-SG 3.47Å; C153-C185 HydrophobicContact CB-CB 3.72Å; C153-C185 WeakPolarHBondContact CB-SG 3.43Å; C153-C185 VanDerWaalsContact SG-CA 3.56Å; C153-C185 WeakPolarHBondContact SG-CB 3.17Å; C153-C185 CovalentContact SG-SG 2.03Å; C153-C185 PolarHBondContact SG-SG 3.1Å; R177-C185 PolarHBondContact NH1-O 2.97Å; D183-C185 PolarHBondContact O-N 3.18Å; C185-Y236 HydrophobicContact CB-CD1 4.13Å
186P81.2Confident74.4Confident78 Ų7880.4 Ų80.451%0.50647%0.467SS..  trans-61.9145.2-173.924.9-34000112.1R234P186-R234 VanDerWaalsContact O-CD 3.25Å; P186-R234 WeakPolarHBondContact O-CD 3.49Å; P186-R234 PolarHBondContact O-NH1 3.41Å
187S71.8Confident74.3Confident45 Ų4580.9 Ų80.932%0.31547%0.47SS..  trans-93.1152171.6-1690000110.2S189S187-S189 PolarHBondContact O-N 2.81Å; S187-S189 PolarHBondContact OG-N 3.16Å
188L66.3Low74.4Confident182 Ų18283.2 Ų83.295%0.95348%0.483SS*.SBendtrans-68.2-22.3170.9-66.1170.2000111.7A190L188-A190 PolarHBondContact O-N 3.12Å
189S62.2Low74.8Confident83 Ų8383.8 Ų83.858%0.5848%0.482SS*.SBendtrans-81110.1168-64.10000110S187 R191S187-S189 PolarHBondContact O-N 2.81Å; S187-S189 PolarHBondContact OG-N 3.16Å; S189-R191 PolarHBondContact O-N 2.93Å
190A55.8Low75.3Confident113 Ų11383.9 Ų83.993%0.93448%0.48SS*.SBendtrans-64.62.6-175.100000116.1L188L188-A190 PolarHBondContact O-N 3.12Å
191R64.1Low76.3Confident225 Ų22585.4 Ų85.485%0.84947%0.471SS*.  trans-109.4103.6178.5-161.8178.2-163.2-1644.8110.2S189S189-R191 PolarHBondContact O-N 2.93Å
192S63.3Low77.5Confident51 Ų5181.1 Ų81.136%0.35745%0.451SS..  trans-62.4143.8166.7-70.90000110.2
193P65.9Low78.7Confident28 Ų2879.4 Ų79.418%0.18244%0.441CS..  trans-63.3144.417626.1-33.4000110.9F195 T233P193-F195 HydrophobicContact CB-CD2 4.31Å; P193-F195 HydrophobicContact CB-CE1 4.24Å; P193-F195 HydrophobicContact CB-CE2 3.93Å; P193-F195 HydrophobicContact CB-CZ 3.89Å; P193-F195 PolarHBondContact O-N 2.97Å; P193-T233 HydrophobicContact CG-CG2 4.1Å
194P71.7Confident79.4Confident113 Ų11379 Ų7973%0.73444%0.435SS*.SBendtrans-80.410.2-178.634.7-36.9000113.6
195F78.1Confident79.9Confident82 Ų8279.7 Ų79.736%0.3644%0.438SS..SBendtrans-136.5153.6179.951.8-100.7000108.9P193 F230P193-F195 HydrophobicContact CB-CD2 4.31Å; P193-F195 HydrophobicContact CB-CE1 4.24Å; P193-F195 HydrophobicContact CB-CE2 3.93Å; P193-F195 HydrophobicContact CB-CZ 3.89Å; P193-F195 PolarHBondContact O-N 2.97Å; F195-F230 HydrophobicContact CE1-CD2 4.44Å; F195-F230 AromaticContact CE2-CD2 3.63Å; F195-F230 HydrophobicContact CE2-CD2 3.63Å; F195-F230 HydrophobicContact CE2-CE2 4.02Å; F195-F230 AromaticContact CZ-CD2 3.42Å; F195-F230 HydrophobicContact CZ-CD2 3.42Å; F195-F230 VanDerWaalsContact CZ-CD2 3.42Å; F195-F230 AromaticContact CZ-CE2 3.83Å; F195-F230 HydrophobicContact CZ-CE2 3.83Å; F195-F230 HydrophobicContact CZ-CG 4.33Å
196E87.6Confident80.3Confident125 Ų12579.2 Ų79.258%0.58444%0.435SS*.  trans-81.5150.616965.2-173.2168.500111.3R177 L198R177-E196 WeakPolarHBondContact O-CA 3.31Å; E196-L198 HydrophobicContact CB-CD1 4.39Å; E196-L198 HydrophobicContact CB-CG 4.29Å; E196-L198 HydrophobicContact CG-CD1 4.48Å; E196-L198 WeakPolarHBondContact OE2-CD1 3.08Å
197C90.2Very high80.8Confident11 Ų1176.9 Ų76.97%0.07442%0.421CS..EExtended strand (participates in β ladder)trans-140101.6172.852.60000108.3G176 R177 C229G176-C197 CarbonylContact C-O 3.57Å; G176-C197 WeakPolarHBondContact CA-O 3.03Å; R177-C197 PolarHBondContact N-O 3.02Å; R177-C197 PolarHBondContact O-N 2.76Å; C197-C229 HydrophobicContact CB-CB 3.84Å; C197-C229 WeakPolarHBondContact CB-SG 3.4Å; C197-C229 PolarHBondContact O-SG 3.32Å; C197-C229 WeakPolarHBondContact SG-CB 3.39Å; C197-C229 CovalentContact SG-SG 2.03Å; C197-C229 PolarHBondContact SG-SG 2.99Å
198L92.2Very high81.7Confident56 Ų5683.1 Ų83.129%0.29344%0.442SS..EExtended strand (participates in β ladder)trans-129.4125.6-165.2-61.6179.6000111.4V174 E196V174-L198 HydrophobicContact CG1-CB 3.77Å; V174-L198 HydrophobicContact CG1-CD2 3.87Å; V174-L198 HydrophobicContact CG1-CG 4.26Å; E196-L198 HydrophobicContact CB-CD1 4.39Å; E196-L198 HydrophobicContact CB-CG 4.29Å; E196-L198 HydrophobicContact CG-CD1 4.48Å; E196-L198 WeakPolarHBondContact OE2-CD1 3.08Å
199N93.4Very high82.9Confident27 Ų2776.4 Ų76.414%0.14441%0.41CS..EExtended strand (participates in β ladder)trans-103.6100.7171.3-174.32.8000110.8Y175 N201 A202 F225 P228Y175-N199 PolarHBondContact N-O 3.13Å; Y175-N199 VanDerWaalsContact N-O 3.13Å; Y175-N199 WeakPolarHBondContact O-CB 3.28Å; Y175-N199 PolarHBondContact O-N 2.73Å; N199-N201 VanDerWaalsContact C-N 3.31Å; N199-N201 PolarHBondContact O-N 3.45Å; N199-N201 VanDerWaalsContact OD1-CB 3.3Å; N199-N201 WeakPolarHBondContact OD1-CB 3.44Å; N199-N201 PolarHBondContact OD1-N 3.44Å; N199-A202 WeakPolarHBondContact O-CB 3.35Å; N199-A202 PolarHBondContact O-N 3.45Å; N199-F225 PolarHBondContact ND2-O 3.22Å; N199-P228 HydrophobicContact CB-CB 4.1Å; N199-P228 HydrophobicContact CB-CG 3.96Å
200H91.9Very high84.4Confident116 Ų11672.4 Ų72.454%0.53738%0.383SS..THydrogen-bonded Turntrans-73.8-17.8176.5-64.8-90.1000113.5A202 V203H200-A202 PolarHBondContact O-N 2.91Å; H200-A202 VanDerWaalsContact O-N 3.14Å; H200-V203 WeakPolarHBondContact O-CG1 3.38Å; H200-V203 PolarHBondContact O-N 3.4Å
201N89.4Confident86Confident101 Ų10171.3 Ų71.354%0.5436%0.355SS..THydrogen-bonded Turntrans-68.1-10.9175.4-62.2-46.5000112.5N199 V203 Q204N199-N201 VanDerWaalsContact C-N 3.31Å; N199-N201 PolarHBondContact O-N 3.45Å; N199-N201 VanDerWaalsContact OD1-CB 3.3Å; N199-N201 WeakPolarHBondContact OD1-CB 3.44Å; N199-N201 PolarHBondContact OD1-N 3.44Å; N201-V203 PolarHBondContact O-N 2.04Å; N201-V203 VanDerWaalsContact O-N 3.13Å; N201-Q204 WeakPolarHBondContact O-CB 3.4Å; N201-Q204 PolarHBondContact O-N 2.78Å
202A93.1Very high87.1Confident0 Ų062.2 Ų62.20%033%0.326CS..Hα-helixtrans-52.8-29.5169.300000112.6A173 N199 H200 Q204 V205 V206 F225 L237A173-A202 HydrophobicContact CB-CB 4.39Å; N199-A202 WeakPolarHBondContact O-CB 3.35Å; N199-A202 PolarHBondContact O-N 3.45Å; H200-A202 PolarHBondContact O-N 2.91Å; H200-A202 VanDerWaalsContact O-N 3.14Å; A202-Q204 VanDerWaalsContact C-N 3.26Å; A202-Q204 PolarHBondContact O-N 2.83Å; A202-V205 PolarHBondContact O-N 2.72Å; A202-V206 WeakPolarHBondContact O-CG2 3.29Å; A202-V206 PolarHBondContact O-N 3.48Å; A202-F225 HydrophobicContact CB-CD1 3.57Å; A202-F225 HydrophobicContact CB-CE1 3.83Å; A202-F225 HydrophobicContact CB-CG 4.5Å; A202-L237 HydrophobicContact CB-CD1 4.09Å
203V90.5Very high88.4Confident40 Ų4064.7 Ų64.724%0.24233%0.33CS..Hα-helixtrans-56.1-37.9173.674.70000112.8I170 A173 H200 N201 S207I170-V203 HydrophobicContact CG2-CG2 4.36Å; A173-V203 HydrophobicContact CB-CB 4.44Å; A173-V203 PolarHBondContact O-N 3.06Å; H200-V203 WeakPolarHBondContact O-CG1 3.38Å; H200-V203 PolarHBondContact O-N 3.4Å; N201-V203 PolarHBondContact O-N 2.04Å; N201-V203 VanDerWaalsContact O-N 3.13Å; V203-S207 WeakPolarHBondContact O-CB 3.46Å; V203-S207 PolarHBondContact O-N 2.89Å; V203-S207 PolarHBondContact O-OG 2.78Å
204Q89.1Confident89.7Confident132 Ų13267.2 Ų67.262%0.61734%0.339SS*.Hα-helixtrans-67.5-40.5-179.6-60.9-180-7.700111.2N201 A202 K208N201-Q204 WeakPolarHBondContact O-CB 3.4Å; N201-Q204 PolarHBondContact O-N 2.78Å; A202-Q204 VanDerWaalsContact C-N 3.26Å; A202-Q204 PolarHBondContact O-N 2.83Å; Q204-K208 VanDerWaalsContact O-CB 3.24Å; Q204-K208 WeakPolarHBondContact O-CB 3.27Å; Q204-K208 PolarHBondContact O-N 2.03Å
205V93.4Very high90.8Very high54 Ų5467.9 Ų67.933%0.32733%0.331SS..Hα-helixtrans-69.7-46.1179-178.10000111A202 S209 T224 F225A202-V205 PolarHBondContact O-N 2.72Å; V205-S209 WeakPolarHBondContact O-CB 3.29Å; V205-S209 PolarHBondContact O-N 2.69Å; V205-T224 HydrophobicContact CG1-CG2 4.07Å; V205-F225 HydrophobicContact CB-CD1 4.15Å; V205-F225 HydrophobicContact CB-CE1 3.83Å; V205-F225 HydrophobicContact CG1-CD1 4.27Å; V205-F225 HydrophobicContact CG1-CE1 3.85Å; V205-F225 HydrophobicContact CG1-CZ 4.44Å; V205-F225 HydrophobicContact CG2-CD1 4.45Å
206V94.7Very high91.7Very high1 Ų164.3 Ų64.31%0.00632%0.316CS..Hα-helixtrans-66.6-43.4177.6-178.90000111L160 I170 A173 A202 S209 C210 F225 L237 V239L160-V206 HydrophobicContact CD1-CG1 4.47Å; I170-V206 HydrophobicContact CD1-CG1 4.05Å; I170-V206 HydrophobicContact CG1-CG1 4.1Å; I170-V206 HydrophobicContact CG2-CB 4.37Å; I170-V206 HydrophobicContact CG2-CG1 3.95Å; A173-V206 HydrophobicContact CB-CB 3.97Å; A173-V206 HydrophobicContact CB-CG1 4.49Å; A173-V206 HydrophobicContact CB-CG2 3.67Å; A202-V206 WeakPolarHBondContact O-CG2 3.29Å; A202-V206 PolarHBondContact O-N 3.48Å; V206-S209 PolarHBondContact O-N 3.01Å; V206-C210 HydrophobicContact CG1-CB 4.45Å; V206-C210 VanDerWaalsContact O-CB 3.23Å; V206-C210 WeakPolarHBondContact O-CB 3.35Å; V206-C210 PolarHBondContact O-N 3.17Å; V206-C210 PolarHBondContact O-SG 3.38Å; V206-F225 HydrophobicContact CG2-CE1 3.84Å; V206-F225 HydrophobicContact CG2-CZ 3.9Å; V206-L237 HydrophobicContact CG2-CD1 4.24Å; V206-L237 HydrophobicContact CG2-CD2 4.07Å; V206-V239 HydrophobicContact CG1-CG1 4.03Å; V206-V239 HydrophobicContact CG1-CG2 4.13Å; V206-V239 HydrophobicContact CG2-CG2 4.23Å
207S91.5Very high92.1Very high29 Ų2961 Ų6120%0.20331%0.309CS..Hα-helixtrans-60.6-50.2175.1-69.90000111.7V203 S209 C210 Y211V203-S207 WeakPolarHBondContact O-CB 3.46Å; V203-S207 PolarHBondContact O-N 2.89Å; V203-S207 PolarHBondContact O-OG 2.78Å; S207-S209 PolarHBondContact O-N 3.01Å; S207-C210 PolarHBondContact O-N 3.01Å; S207-Y211 WeakPolarHBondContact O-CB 3.28Å; S207-Y211 PolarHBondContact O-N 2.9Å
208K90.6Very high92.4Very high177 Ų17760.9 Ų60.977%0.7731%0.309SS*.Hα-helixtrans-59.1-32.9177-175173.5-180176.40112.6Q204Q204-K208 VanDerWaalsContact O-CB 3.24Å; Q204-K208 WeakPolarHBondContact O-CB 3.27Å; Q204-K208 PolarHBondContact O-N 2.03Å
209S92.9Very high92.6Very high40 Ų4060.5 Ų60.528%0.2831%0.313SS..Hα-helixtrans-80.5-37.2177.6-164.80000113.7V205 V206 S207 K213V205-S209 WeakPolarHBondContact O-CB 3.29Å; V205-S209 PolarHBondContact O-N 2.69Å; V206-S209 PolarHBondContact O-N 3.01Å; S207-S209 PolarHBondContact O-N 3.01Å; S209-K213 VanDerWaalsContact O-CD 3.29Å; S209-K213 WeakPolarHBondContact O-CD 3.24Å; S209-K213 WeakPolarHBondContact O-CE 3.39Å; S209-K213 PolarHBondContact O-NZ 2.98Å
210C94.1Very high92.8Very high0 Ų059.2 Ų59.20%031%0.307CS..Hα-helixtrans-118-20.7-163-58.10000116.5L160 L168 I170 V206 S207 K213 C216 V218L160-C210 HydrophobicContact CD1-CB 4.38Å; L168-C210 HydrophobicContact CD1-CB 4.32Å; I170-C210 HydrophobicContact CD1-CB 4.04Å; I170-C210 HydrophobicContact CG1-CB 4.19Å; V206-C210 HydrophobicContact CG1-CB 4.45Å; V206-C210 VanDerWaalsContact O-CB 3.23Å; V206-C210 WeakPolarHBondContact O-CB 3.35Å; V206-C210 PolarHBondContact O-N 3.17Å; V206-C210 PolarHBondContact O-SG 3.38Å; S207-C210 PolarHBondContact O-N 3.01Å; C210-K213 WeakPolarHBondContact O-CB 3.48Å; C210-K213 PolarHBondContact O-N 3.44Å; C210-C216 WeakPolarHBondContact CA-SG 3.39Å; C210-C216 HydrophobicContact CB-CB 3.48Å; C210-C216 VanDerWaalsContact CB-CB 3.48Å; C210-C216 WeakPolarHBondContact CB-SG 3.31Å; C210-C216 WeakPolarHBondContact SG-CB 3.3Å; C210-C216 CovalentContact SG-SG 2.03Å; C210-C216 PolarHBondContact SG-SG 2.71Å; C210-V218 VanDerWaalsContact SG-CG2 3.51Å
211Y88.4Confident92.9Very high90 Ų9055.1 Ų55.135%0.35329%0.291SS..THydrogen-bonded Turntrans-58.8137.6-174.5-172.8-81.1000111.8I169 S207 K213 L249 I256I169-Y211 HydrophobicContact CD1-CD2 3.86Å; I169-Y211 HydrophobicContact CD1-CE1 4.18Å; I169-Y211 HydrophobicContact CD1-CE2 3.25Å; I169-Y211 VanDerWaalsContact CD1-CZ 3.42Å; S207-Y211 WeakPolarHBondContact O-CB 3.28Å; S207-Y211 PolarHBondContact O-N 2.9Å; Y211-K213 PolarHBondContact O-N 2.92Å; Y211-K213 VanDerWaalsContact O-N 3.07Å; Y211-L249 HydrophobicContact CE1-CD1 4.34Å; Y211-I256 HydrophobicContact CE1-CD1 4.09Å
212S86.8Confident93Very high34 Ų3453.1 Ų53.124%0.23828%0.28CS..THydrogen-bonded Turntrans61.98.5-178.8-156.90000115.5V167 L168V167-S212 WeakPolarHBondContact CG1-O 3.37Å; L168-S212 PolarHBondContact O-N 3.35Å
213K91.4Very high92.9Very high103 Ų10362.3 Ų62.345%0.44832%0.323SS..  trans-96.4147.6173.6-58.6-176.4-171.4170.70111L168 S209 C210 Y211L168-K213 WeakPolarHBondContact CB-O 3.28Å; L168-K213 WeakPolarHBondContact CD1-O 3.49Å; L168-K213 VanDerWaalsContact CG-O 3.29Å; L168-K213 WeakPolarHBondContact CG-O 3.33Å; L168-K213 PolarHBondContact N-O 3.44Å; S209-K213 VanDerWaalsContact O-CD 3.29Å; S209-K213 WeakPolarHBondContact O-CD 3.24Å; S209-K213 WeakPolarHBondContact O-CE 3.39Å; S209-K213 PolarHBondContact O-NZ 2.98Å; C210-K213 WeakPolarHBondContact O-CB 3.48Å; C210-K213 PolarHBondContact O-N 3.44Å; Y211-K213 PolarHBondContact O-N 2.92Å; Y211-K213 VanDerWaalsContact O-N 3.07Å
214Q91.8Very high93Very high80 Ų8062.8 Ų62.837%0.37433%0.326SS..SBendtrans-79.1-33.6175.8-179.1175.7-4.700112.7R161 C162 T164 V167R161-Q214 CarbonylContact C-O 3.44Å; R161-Q214 WeakPolarHBondContact CA-O 3.09Å; C162-Q214 HydrophobicContact CB-CG 4.43Å; C162-Q214 PolarHBondContact N-O 3.19Å; C162-Q214 WeakPolarHBondContact O-CG 3.02Å; C162-Q214 PolarHBondContact O-NE2 2.97Å; T164-Q214 PolarHBondContact OG1-NE2 2.9Å; V167-Q214 HydrophobicContact CG1-CB 4.49Å
215K95.4Very high93.1Very high128 Ų12856.8 Ų56.856%0.55730%0.298SS*.EExtended strand (participates in β ladder)trans-131.1133.8175.5173.4-177172.5-165.80107.8L160 R161L160-K215 WeakPolarHBondContact O-CA 3.37Å; R161-K215 HydrophobicContact CG-CG 4.3Å
216C96.6Very high93Very high6 Ų664 Ų644%0.04132%0.319CS..EExtended strand (participates in β ladder)trans-129.1151.3173.1-169.30000110I159 L160 L168 C210I159-C216 WeakPolarHBondContact CA-O 3.47Å; I159-C216 WeakPolarHBondContact CG2-O 3.35Å; L160-C216 HydrophobicContact CB-CB 4.31Å; L160-C216 PolarHBondContact N-O 3.1Å; L160-C216 PolarHBondContact O-N 3.08Å; L168-C216 HydrophobicContact CD1-CB 3.7Å; C210-C216 WeakPolarHBondContact CA-SG 3.39Å; C210-C216 HydrophobicContact CB-CB 3.48Å; C210-C216 VanDerWaalsContact CB-CB 3.48Å; C210-C216 WeakPolarHBondContact CB-SG 3.31Å; C210-C216 WeakPolarHBondContact SG-CB 3.3Å; C210-C216 CovalentContact SG-SG 2.03Å; C210-C216 PolarHBondContact SG-SG 2.71Å
217A96.8Very high92.6Very high55 Ų5567.1 Ų67.146%0.45534%0.336SS..EExtended strand (participates in β ladder)trans-132.5134.6168.600000108.6T157 M158 I159T157-A217 HydrophobicContact CG2-CB 4Å; M158-A217 CarbonylContact O-C 3.6Å; M158-A217 VanDerWaalsContact O-CA 3.3Å; M158-A217 WeakPolarHBondContact O-CA 3.38Å; I159-A217 HydrophobicContact CG1-CB 4.39Å
218V96.5Very high92.4Very high10 Ų1068.1 Ų68.16%0.06134%0.342CS..EExtended strand (participates in β ladder)trans-137.3123.8179.7-168.90000109.3T157 M158 C210 T224 F225T157-V218 CarbonylContact C-O 3.59Å; T157-V218 WeakPolarHBondContact CA-O 3.28Å; M158-V218 PolarHBondContact N-O 3.07Å; M158-V218 PolarHBondContact O-N 3.2Å; C210-V218 VanDerWaalsContact SG-CG2 3.51Å; V218-T224 HydrophobicContact CG1-CG2 4.25Å; V218-F225 HydrophobicContact CG1-CE2 4.1Å; V218-F225 HydrophobicContact CG1-CZ 3.72Å
219A96.4Very high92.2Very high47 Ų4760.5 Ų60.539%0.38831%0.311SS..EExtended strand (participates in β ladder)trans-70.513117400000110.2S221 T224 F225A219-S221 PolarHBondContact O-N 2.9Å; A219-T224 PolarHBondContact O-OG1 2.66Å; A219-F225 WeakPolarHBondContact O-CE2 3.43Å
220V96.5Very high91.8Very high1 Ų165.1 Ų65.11%0.00633%0.326CS..  trans-94.687.4-177-176.80000109A152 C153 G155 E156 M158 Y175 L237A152-V220 HydrophobicContact CB-CG2 4.02Å; C153-V220 WeakPolarHBondContact O-CB 3.32Å; C153-V220 WeakPolarHBondContact O-CG1 3.48Å; G155-V220 PolarHBondContact N-O 2.8Å; E156-V220 WeakPolarHBondContact O-CB 3.24Å; E156-V220 PolarHBondContact O-N 3.3Å; M158-V220 HydrophobicContact CB-CG2 4.17Å; Y175-V220 HydrophobicContact CD2-CG1 4.09Å; Y175-V220 HydrophobicContact CE2-CG1 3.58Å; V220-L237 HydrophobicContact CG1-CB 3.77Å; V220-L237 HydrophobicContact CG2-CB 3.96Å; V220-L237 HydrophobicContact CG2-CD2 4.12Å
221S94.3Very high91.2Very high30 Ų3071.2 Ų71.221%0.2137%0.366CS..SBendtrans-144159.1-174.884.60000114.2A219 Q223 T224 F225A219-S221 PolarHBondContact O-N 2.9Å; S221-Q223 PolarHBondContact O-N 3.15Å; S221-Q223 PolarHBondContact OG-N 3.35Å; S221-T224 PolarHBondContact O-N 2.9Å; S221-T224 VanDerWaalsContact O-N 3.09Å; S221-T224 PolarHBondContact OG-N 3.49Å; S221-T224 VanDerWaalsContact OG-N 3.14Å; S221-T224 PolarHBondContact OG-OG1 2.9Å; S221-F225 PolarHBondContact O-N 3.36Å
222N92.9Very high90.8Very high58 Ų5870.3 Ų70.331%0.3138%0.384SS..Hα-helixtrans-63.7-25.7173.2-57.5-38.9000112.9E154 Y175 R226 D227 K235E154-N222 PolarHBondContact OE1-ND2 3.25Å; E154-N222 PolarHBondContact OE1-OD1 2.88Å; Y175-N222 WeakPolarHBondContact CE1-OD1 3.49Å; Y175-N222 PolarHBondContact OH-OD1 2.99Å; N222-R226 WeakPolarHBondContact O-CA 3.35Å; N222-R226 PolarHBondContact O-N 2.87Å; N222-D227 HydrophobicContact CB-CB 4.17Å; N222-D227 PolarHBondContact OD1-OD2 3.38Å; N222-K235 WeakPolarHBondContact OD1-CE 3.41Å; N222-K235 PolarHBondContact OD1-NZ 2.95Å
223Q90.7Very high90.7Very high194 Ų19469.5 Ų69.591%0.90738%0.377SS*.Hα-helixtrans-70.4-37.5173.7-58.71764.800111S221S221-Q223 PolarHBondContact O-N 3.15Å; S221-Q223 PolarHBondContact OG-N 3.35Å
224T91.7Very high90.4Very high49 Ų4969.1 Ų69.130%0.30137%0.373SS..Hα-helixtrans-78.3-39.4-177.9-47.40000112.5V205 V218 A219 S221V205-T224 HydrophobicContact CG1-CG2 4.07Å; V218-T224 HydrophobicContact CG1-CG2 4.25Å; A219-T224 PolarHBondContact O-OG1 2.66Å; S221-T224 PolarHBondContact O-N 2.9Å; S221-T224 VanDerWaalsContact O-N 3.09Å; S221-T224 PolarHBondContact OG-N 3.49Å; S221-T224 VanDerWaalsContact OG-N 3.14Å; S221-T224 PolarHBondContact OG-OG1 2.9Å
225F92.7Very high90.4Very high7 Ų765.5 Ų65.53%0.03136%0.356CS..Hα-helixtrans-115.9-12.9-169.7-68.5-69.5000115.4Y175 N199 A202 V205 V206 V218 A219 S221 L237Y175-F225 HydrophobicContact CD1-CB 3.36Å; Y175-F225 HydrophobicContact CD1-CD2 4.48Å; Y175-F225 HydrophobicContact CD1-CG 4.17Å; Y175-F225 HydrophobicContact CD2-CB 4.45Å; Y175-F225 HydrophobicContact CD2-CD2 4.14Å; Y175-F225 HydrophobicContact CD2-CG 4.43Å; Y175-F225 HydrophobicContact CE1-CB 3.94Å; Y175-F225 HydrophobicContact CG-CB 3.64Å; Y175-F225 HydrophobicContact CG-CD2 4.11Å; Y175-F225 AromaticContact CG-CG 3.94Å; Y175-F225 HydrophobicContact CG-CG 3.94Å; N199-F225 PolarHBondContact ND2-O 3.22Å; A202-F225 HydrophobicContact CB-CD1 3.57Å; A202-F225 HydrophobicContact CB-CE1 3.83Å; A202-F225 HydrophobicContact CB-CG 4.5Å; V205-F225 HydrophobicContact CB-CD1 4.15Å; V205-F225 HydrophobicContact CB-CE1 3.83Å; V205-F225 HydrophobicContact CG1-CD1 4.27Å; V205-F225 HydrophobicContact CG1-CE1 3.85Å; V205-F225 HydrophobicContact CG1-CZ 4.44Å; V205-F225 HydrophobicContact CG2-CD1 4.45Å; V206-F225 HydrophobicContact CG2-CE1 3.84Å; V206-F225 HydrophobicContact CG2-CZ 3.9Å; V218-F225 HydrophobicContact CG1-CE2 4.1Å; V218-F225 HydrophobicContact CG1-CZ 3.72Å; A219-F225 WeakPolarHBondContact O-CE2 3.43Å; S221-F225 PolarHBondContact O-N 3.36Å; F225-L237 HydrophobicContact CD1-CD1 4.43Å; F225-L237 HydrophobicContact CE1-CD1 3.89Å; F225-L237 HydrophobicContact CE2-CD1 4.07Å; F225-L237 HydrophobicContact CE2-CD2 3.89Å; F225-L237 HydrophobicContact CE2-CG 4.45Å; F225-L237 HydrophobicContact CZ-CD1 3.69Å; F225-L237 HydrophobicContact CZ-CD2 3.61Å; F225-L237 HydrophobicContact CZ-CG 4.26Å
226R89.5Confident90.3Very high205 Ų20560 Ų6077%0.77433%0.332SS*.  trans63.5143.8-161.4-52-176.8179-166.8-1.7112.4Y175 N222 P228Y175-R226 WeakPolarHBondContact CD1-O 3.39Å; N222-R226 WeakPolarHBondContact O-CA 3.35Å; N222-R226 PolarHBondContact O-N 2.87Å; R226-P228 WeakPolarHBondContact O-CD 3.43Å
227D87.9Confident90.3Very high66 Ų6659.7 Ų59.735%0.35333%0.33SS..  trans-85.8120.1179.4-160.5-22.1000110.4N222 C229 K235N222-D227 HydrophobicContact CB-CB 4.17Å; N222-D227 PolarHBondContact OD1-OD2 3.38Å; D227-C229 WeakPolarHBondContact OD1-CB 3.36Å; D227-C229 PolarHBondContact OD1-N 2.94Å; D227-K235 VanDerWaalsContact CG-NZ 3.32Å; D227-K235 WeakPolarHBondContact OD1-CD 3.29Å; D227-K235 WeakPolarHBondContact OD1-CE 3.47Å; D227-K235 IonicContact OD1-NZ 2.65Å; D227-K235 PolarHBondContact OD1-NZ 3.42Å; D227-K235 VanDerWaalsContact OD2-CE 3.26Å; D227-K235 WeakPolarHBondContact OD2-CE 3.35Å; D227-K235 IonicContact OD2-NZ 3.13Å; D227-K235 PolarHBondContact OD2-NZ 3.28Å
228P86.7Confident90.2Very high50 Ų5058.7 Ų58.733%0.32532%0.32SS..  trans-91.3-3.1172.537.6-35.4000113.4N199 R226N199-P228 HydrophobicContact CB-CB 4.1Å; N199-P228 HydrophobicContact CB-CG 3.96Å; R226-P228 WeakPolarHBondContact O-CD 3.43Å
229C86.9Confident90.1Very high17 Ų1758.2 Ų58.212%0.11532%0.317CS..SBendtrans-107.2163.5-169.9-61.50000112.6C197 D227 T233 K235C197-C229 HydrophobicContact CB-CB 3.84Å; C197-C229 WeakPolarHBondContact CB-SG 3.4Å; C197-C229 PolarHBondContact O-SG 3.32Å; C197-C229 WeakPolarHBondContact SG-CB 3.39Å; C197-C229 CovalentContact SG-SG 2.03Å; C197-C229 PolarHBondContact SG-SG 2.99Å; D227-C229 WeakPolarHBondContact OD1-CB 3.36Å; D227-C229 PolarHBondContact OD1-N 2.94Å; C229-T233 HydrophobicContact CB-CG2 3.95Å; C229-K235 HydrophobicContact CB-CD 4.04Å; C229-K235 HydrophobicContact CB-CG 4.4Å
230F83.6Confident89.9Confident138 Ų13858.8 Ų58.861%0.60531%0.313SS*.  trans-69.1146.6168.4-69.2-92.8000110.8F195 T233F195-F230 HydrophobicContact CE1-CD2 4.44Å; F195-F230 AromaticContact CE2-CD2 3.63Å; F195-F230 HydrophobicContact CE2-CD2 3.63Å; F195-F230 HydrophobicContact CE2-CE2 4.02Å; F195-F230 AromaticContact CZ-CD2 3.42Å; F195-F230 HydrophobicContact CZ-CD2 3.42Å; F195-F230 VanDerWaalsContact CZ-CD2 3.42Å; F195-F230 AromaticContact CZ-CE2 3.83Å; F195-F230 HydrophobicContact CZ-CE2 3.83Å; F195-F230 HydrophobicContact CZ-CG 4.33Å; F230-T233 VanDerWaalsContact O-CB 3.27Å; F230-T233 WeakPolarHBondContact O-CB 3.39Å; F230-T233 PolarHBondContact O-N 3.09Å; F230-T233 VanDerWaalsContact O-N 3.17Å; F230-T233 PolarHBondContact O-OG1 2.88Å
231P82.7Confident89.5Confident128 Ų12859.8 Ų59.883%0.83132%0.317SS*.THydrogen-bonded Turntrans-57.2143.4-177.223.3-34.5000112.2T233P231-T233 VanDerWaalsContact C-N 3.32Å
232G78.6Confident89.2Confident71 Ų7158.4 Ų58.473%0.73231%0.307SS*.THydrogen-bonded Turntrans87.3-9.9-172.400000114.7R234G232-R234 PolarHBondContact O-N 3.49Å
233T84.6Confident88.9Confident17 Ų1756.9 Ų56.910%0.10430%0.301CS..  trans-76.1109.8171.7-50.10000110.3R177 P193 C229 F230 P231 K235R177-T233 HydrophobicContact CB-CG2 4.1Å; P193-T233 HydrophobicContact CG-CG2 4.1Å; C229-T233 HydrophobicContact CB-CG2 3.95Å; F230-T233 VanDerWaalsContact O-CB 3.27Å; F230-T233 WeakPolarHBondContact O-CB 3.39Å; F230-T233 PolarHBondContact O-N 3.09Å; F230-T233 VanDerWaalsContact O-N 3.17Å; F230-T233 PolarHBondContact O-OG1 2.88Å; P231-T233 VanDerWaalsContact C-N 3.32Å; T233-K235 PolarHBondContact O-N 2.94Å; T233-K235 PolarHBondContact O-NZ 2.93Å
234R86.2Confident88.2Confident95 Ų9548.3 Ų48.336%0.35826%0.262SS..  trans-72.2122.1171.3-167.7-178.8-165.3174.95.7110.2R177 P186 G232R177-R234 PolarHBondContact NH1-O 2.95Å; P186-R234 VanDerWaalsContact O-CD 3.25Å; P186-R234 WeakPolarHBondContact O-CD 3.49Å; P186-R234 PolarHBondContact O-NH1 3.41Å; G232-R234 PolarHBondContact O-N 3.49Å
235K91.1Very high87.6Confident4 Ų446.6 Ų46.62%0.01725%0.252CS..  trans-103.3173-174.8-66168-64.4-66.70112.3E154 Y175 G176 N222 D227 C229 T233E154-K235 HydrophobicContact CB-CB 4.39Å; E154-K235 VanDerWaalsContact CB-O 3.28Å; E154-K235 WeakPolarHBondContact CB-O 3.33Å; E154-K235 PolarHBondContact N-O 3.39Å; E154-K235 WeakPolarHBondContact OE1-CE 3.24Å; E154-K235 IonicContact OE1-NZ 3.68Å; E154-K235 PolarHBondContact OE1-NZ 2.94Å; E154-K235 WeakPolarHBondContact OE2-CE 3.33Å; E154-K235 PolarHBondContact OE2-N 3.36Å; E154-K235 IonicContact OE2-NZ 2.96Å; E154-K235 PolarHBondContact OE2-NZ 3.44Å; Y175-K235 HydrophobicContact CE1-CB 4.5Å; Y175-K235 HydrophobicContact CE1-CD 3.91Å; Y175-K235 HydrophobicContact CE2-CB 3.94Å; Y175-K235 WeakPolarHBondContact OH-CE 3.28Å; G176-K235 CarbonylContact O-C 3.58Å; G176-K235 VanDerWaalsContact O-CA 3.28Å; G176-K235 WeakPolarHBondContact O-CA 3.23Å; G176-K235 WeakPolarHBondContact O-CB 3.47Å; N222-K235 WeakPolarHBondContact OD1-CE 3.41Å; N222-K235 PolarHBondContact OD1-NZ 2.95Å; D227-K235 VanDerWaalsContact CG-NZ 3.32Å; D227-K235 WeakPolarHBondContact OD1-CD 3.29Å; D227-K235 WeakPolarHBondContact OD1-CE 3.47Å; D227-K235 IonicContact OD1-NZ 2.65Å; D227-K235 PolarHBondContact OD1-NZ 3.42Å; D227-K235 VanDerWaalsContact OD2-CE 3.26Å; D227-K235 WeakPolarHBondContact OD2-CE 3.35Å; D227-K235 IonicContact OD2-NZ 3.13Å; D227-K235 PolarHBondContact OD2-NZ 3.28Å; C229-K235 HydrophobicContact CB-CD 4.04Å; C229-K235 HydrophobicContact CB-CG 4.4Å; T233-K235 PolarHBondContact O-N 2.94Å; T233-K235 PolarHBondContact O-NZ 2.93Å
236Y93.4Very high86.6Confident11 Ų1151.6 Ų51.64%0.04327%0.273CS..EExtended strand (participates in β ladder)trans-143.8156.517048.9-88.9000110.5V151 A152 Y175 G176 R177 G178 Q181 T184 C185V151-Y236 HydrophobicContact CG1-CD2 3.79Å; V151-Y236 HydrophobicContact CG1-CG 4.04Å; A152-Y236 CarbonylContact O-C 3.54Å; A152-Y236 VanDerWaalsContact O-CA 3.3Å; A152-Y236 WeakPolarHBondContact O-CA 3.4Å; A152-Y236 WeakPolarHBondContact O-CB 3.29Å; Y175-Y236 WeakPolarHBondContact CA-O 3.44Å; Y175-Y236 WeakPolarHBondContact CD2-O 3.39Å; G176-Y236 PolarHBondContact N-O 3.17Å; G176-Y236 PolarHBondContact O-N 2.88Å; R177-Y236 HydrophobicContact CB-CE1 4.25Å; R177-Y236 HydrophobicContact CG-CE1 3.95Å; G178-Y236 PolarHBondContact N-OH 3.39Å; Q181-Y236 PolarHBondContact OE1-OH 3.46Å; T184-Y236 HydrophobicContact CG2-CD1 3.79Å; T184-Y236 HydrophobicContact CG2-CD2 3.9Å; T184-Y236 HydrophobicContact CG2-CE1 3.8Å; T184-Y236 HydrophobicContact CG2-CE2 3.89Å; T184-Y236 HydrophobicContact CG2-CG 3.85Å; C185-Y236 HydrophobicContact CB-CD1 4.13Å
237L96.1Very high85.2Confident0 Ų043.8 Ų43.80%025%0.25CS..EExtended strand (participates in β ladder)trans-97122.8166.3-179.772.6000107.7V151 A152 M158 A173 V174 Y175 A202 V206 V220 F225 V239V151-L237 VanDerWaalsContact CA-O 3.29Å; V151-L237 WeakPolarHBondContact CA-O 3.07Å; A152-L237 PolarHBondContact N-O 2.95Å; A152-L237 PolarHBondContact O-N 3.45Å; M158-L237 HydrophobicContact CE-CB 4.2Å; M158-L237 HydrophobicContact CE-CD2 3.99Å; M158-L237 HydrophobicContact CE-CG 4.08Å; M158-L237 WeakPolarHBondContact CE-O 3.44Å; M158-L237 HydrophobicContact SD-CD2 3.98Å; A173-L237 HydrophobicContact CB-CD1 4.3Å; V174-L237 WeakPolarHBondContact O-CA 3.48Å; Y175-L237 HydrophobicContact CD2-CB 4.15Å; A202-L237 HydrophobicContact CB-CD1 4.09Å; V206-L237 HydrophobicContact CG2-CD1 4.24Å; V206-L237 HydrophobicContact CG2-CD2 4.07Å; V220-L237 HydrophobicContact CG1-CB 3.77Å; V220-L237 HydrophobicContact CG2-CB 3.96Å; V220-L237 HydrophobicContact CG2-CD2 4.12Å; F225-L237 HydrophobicContact CD1-CD1 4.43Å; F225-L237 HydrophobicContact CE1-CD1 3.89Å; F225-L237 HydrophobicContact CE2-CD1 4.07Å; F225-L237 HydrophobicContact CE2-CD2 3.89Å; F225-L237 HydrophobicContact CE2-CG 4.45Å; F225-L237 HydrophobicContact CZ-CD1 3.69Å; F225-L237 HydrophobicContact CZ-CD2 3.61Å; F225-L237 HydrophobicContact CZ-CG 4.26Å; L237-V239 HydrophobicContact CD1-CG2 4.4Å; L237-V239 HydrophobicContact CD2-CG2 3.84Å; L237-V239 HydrophobicContact CG-CG2 3.83Å
238S95.2Very high83.9Confident35 Ų3541.1 Ų41.125%0.24524%0.236CC..EExtended strand (participates in β ladder)trans-105.7129.5167.1-176.20000109.1A173 V174A173-S238 CarbonylContact C-O 3.56Å; A173-S238 VanDerWaalsContact CA-O 3.22Å; A173-S238 WeakPolarHBondContact CA-O 3.22Å; V174-S238 PolarHBondContact N-O 3.18Å; V174-S238 PolarHBondContact O-N 3.46Å
239V94.8Very high82.7Confident0 Ų039.5 Ų39.50%022%0.224CC..EExtended strand (participates in β ladder)trans-124.7127.8179.6-177.10000110.3T149 Q150 M158 L160 I170 A173 V206 L237 Y241T149-V239 WeakPolarHBondContact CA-O 3.34Å; Q150-V239 PolarHBondContact N-O 3.43Å; Q150-V239 PolarHBondContact O-N 3.14Å; M158-V239 HydrophobicContact CE-CB 4.49Å; M158-V239 HydrophobicContact CE-CG2 3.92Å; M158-V239 HydrophobicContact SD-CB 3.98Å; M158-V239 HydrophobicContact SD-CG2 3.41Å; M158-V239 WeakPolarHBondContact SD-CG2 3.47Å; L160-V239 HydrophobicContact CD1-CG1 4.18Å; I170-V239 HydrophobicContact CD1-CG1 4.21Å; I170-V239 HydrophobicContact CG2-CG1 4.09Å; A173-V239 HydrophobicContact CB-CB 4.46Å; A173-V239 HydrophobicContact CB-CG1 4.45Å; A173-V239 HydrophobicContact CB-CG2 3.87Å; V206-V239 HydrophobicContact CG1-CG1 4.03Å; V206-V239 HydrophobicContact CG1-CG2 4.13Å; V206-V239 HydrophobicContact CG2-CG2 4.23Å; L237-V239 HydrophobicContact CD1-CG2 4.4Å; L237-V239 HydrophobicContact CD2-CG2 3.84Å; L237-V239 HydrophobicContact CG-CG2 3.83Å; V239-Y241 HydrophobicContact CG1-CD1 4.32Å
240L91Very high81.4Confident59 Ų5946.2 Ų46.231%0.30925%0.252SS..EExtended strand (participates in β ladder)trans-101.8114.7171.1-174.269.5000109.3H147 T149 Y171 A172H147-L240 HydrophobicContact CB-CD1 3.94Å; T149-L240 WeakPolarHBondContact OG1-CD1 3.49Å; Y171-L240 PolarHBondContact N-O 3.23Å; A172-L240 HydrophobicContact CB-CB 4.2Å; A172-L240 PolarHBondContact N-O 2.79Å; A172-L240 PolarHBondContact O-N 3.21Å
241Y89.2Confident80Confident21 Ų2143.9 Ų43.98%0.08224%0.243CC..EExtended strand (participates in β ladder)trans-139.3166.5-174.473.6-83.1000113.1K148 Q150 L160 L168 I169 V239K148-Y241 HydrophobicContact CB-CD1 4.26Å; K148-Y241 HydrophobicContact CB-CE1 3.88Å; K148-Y241 HydrophobicContact CB-CE2 4.28Å; K148-Y241 PolarHBondContact N-O 3.18Å; K148-Y241 WeakPolarHBondContact O-CD1 3.39Å; K148-Y241 PolarHBondContact O-N 3.29Å; Q150-Y241 HydrophobicContact CB-CE1 3.91Å; Q150-Y241 PolarHBondContact OE1-OH 2.76Å; L160-Y241 HydrophobicContact CD2-CD1 4.07Å; L160-Y241 HydrophobicContact CD2-CE1 3.73Å; L168-Y241 HydrophobicContact CD2-CD2 3.47Å; L168-Y241 VanDerWaalsContact CD2-CD2 3.47Å; L168-Y241 HydrophobicContact CD2-CE2 3.65Å; L168-Y241 HydrophobicContact CD2-CG 4.41Å; I169-Y241 CarbonylContact O-C 3.57Å; I169-Y241 WeakPolarHBondContact O-CA 3.39Å; I169-Y241 WeakPolarHBondContact O-CB 3.24Å; V239-Y241 HydrophobicContact CG1-CD1 4.32Å
242S86.9Confident78.4Confident2 Ų240 Ų401%0.01422%0.221CC..EExtended strand (participates in β ladder)trans-131.1166166.467.90000110.9E146 I169 Y171E146-S242 WeakPolarHBondContact O-CB 3.32Å; I169-S242 PolarHBondContact N-O 3.15Å; I169-S242 PolarHBondContact O-N 2.96Å; Y171-S242 WeakPolarHBondContact CE2-OG 3.47Å; Y171-S242 PolarHBondContact OH-OG 2.99Å
243C87.3Confident77Confident26 Ų2640 Ų4018%0.17620%0.204CC..EExtended strand (participates in β ladder)trans-113.6114172.7-75.30000109C162 N166 V167C162-C243 WeakPolarHBondContact CA-SG 3.46Å; C162-C243 HydrophobicContact CB-CB 3.79Å; C162-C243 WeakPolarHBondContact CB-SG 3.45Å; C162-C243 VanDerWaalsContact SG-CA 3.5Å; C162-C243 WeakPolarHBondContact SG-CB 3.38Å; C162-C243 CovalentContact SG-SG 2.04Å; C162-C243 PolarHBondContact SG-SG 2.93Å; N166-C243 HydrophobicContact CB-CB 4.12Å; V167-C243 WeakPolarHBondContact O-CA 3.35Å
244V76.9Confident75.5Confident14 Ų1444.1 Ų44.19%0.08523%0.232CC..EExtended strand (participates in β ladder)trans-123.6143-175.8-52.30000111.2N166 V167 I169 K246 L248 L249N166-V244 CarbonylContact C-O 3.57Å; N166-V244 VanDerWaalsContact CA-O 3.25Å; N166-V244 WeakPolarHBondContact CA-O 3.29Å; V167-V244 WeakPolarHBondContact CG2-O 3.45Å; V167-V244 PolarHBondContact N-O 3.14Å; V167-V244 PolarHBondContact O-N 2.94Å; I169-V244 HydrophobicContact CG1-CG1 4.48Å; I169-V244 HydrophobicContact CG1-CG2 3.66Å; V244-K246 PolarHBondContact O-N 3.33Å; V244-L248 HydrophobicContact CB-CD1 3.65Å; V244-L248 HydrophobicContact CG2-CD1 4.08Å; V244-L249 HydrophobicContact CG2-CD2 3.85Å; V244-L249 HydrophobicContact CG2-CG 4.23Å
245P77.8Confident73.7Confident13 Ų1344.5 Ų44.58%0.08424%0.241CC..EExtended strand (participates in β ladder)trans-47.4133.6175.9-31.533000114.3N166 S247 L248N166-P245 WeakPolarHBondContact OD1-CA 3.39Å; N166-P245 WeakPolarHBondContact OD1-CD 3.41Å; N166-P245 WeakPolarHBondContact OD1-CG 3.07Å; P245-S247 PolarHBondContact O-N 3.03Å; P245-S247 VanDerWaalsContact O-N 3.13Å; P245-L248 HydrophobicContact CB-CD1 4.1Å; P245-L248 HydrophobicContact CG-CD1 4.15Å; P245-L248 VanDerWaalsContact O-CB 3.29Å; P245-L248 WeakPolarHBondContact O-CB 3.46Å; P245-L248 PolarHBondContact O-N 3.03Å
246K72Confident71.9Confident111 Ų11147.2 Ų47.248%0.48326%0.255SS..Hα-helixtrans-61.4-23.3-178.8-169.3176-179.6-177.90114P165 V167 V244 L248 L249P165-K246 WeakPolarHBondContact O-CB 3.12Å; P165-K246 PolarHBondContact O-N 2.93Å; V167-K246 HydrophobicContact CG1-CB 4.04Å; V167-K246 HydrophobicContact CG1-CD 4.2Å; V167-K246 HydrophobicContact CG1-CG 4.12Å; V167-K246 HydrophobicContact CG2-CB 4.16Å; V167-K246 HydrophobicContact CG2-CG 4.41Å; V244-K246 PolarHBondContact O-N 3.33Å; K246-L248 VanDerWaalsContact C-N 3.3Å; K246-L248 PolarHBondContact O-N 3.08Å; K246-L249 PolarHBondContact O-N 2.97Å
247S60.6Low69.8Low42 Ų4254.5 Ų54.529%0.29429%0.294SS..Hα-helixtrans-58.1-39.6172.937.50000112.5P245 L249P245-S247 PolarHBondContact O-N 3.03Å; P245-S247 VanDerWaalsContact O-N 3.13Å; S247-L249 PolarHBondContact O-N 3.12Å
248L61.3Low67.2Low10 Ų1059.4 Ų59.45%0.05233%0.328CS..Hα-helixtrans-53.1-55.4176.2-77.5153.2000112.1Y40 L41 I44 V244 P245 K246 K250 E251 A252Y40-L248 HydrophobicContact CD1-CD1 4.27Å; Y40-L248 HydrophobicContact CD1-CD2 3.46Å; Y40-L248 VanDerWaalsContact CD1-CD2 3.46Å; Y40-L248 HydrophobicContact CD1-CG 3.91Å; Y40-L248 HydrophobicContact CE1-CD1 3.81Å; Y40-L248 HydrophobicContact CE1-CD2 3.73Å; Y40-L248 HydrophobicContact CE1-CG 3.98Å; L41-L248 HydrophobicContact CB-CD2 3.94Å; L41-L248 HydrophobicContact CD1-CB 3.9Å; L41-L248 HydrophobicContact CD1-CD2 3.34Å; L41-L248 HydrophobicContact CD1-CG 4.25Å; L41-L248 WeakPolarHBondContact CD1-O 3.42Å; L41-L248 WeakPolarHBondContact CD2-O 3.2Å; L41-L248 HydrophobicContact CG-CD2 4.24Å; I44-L248 HydrophobicContact CD1-CD2 3.92Å; V244-L248 HydrophobicContact CB-CD1 3.65Å; V244-L248 HydrophobicContact CG2-CD1 4.08Å; P245-L248 HydrophobicContact CB-CD1 4.1Å; P245-L248 HydrophobicContact CG-CD1 4.15Å; P245-L248 VanDerWaalsContact O-CB 3.29Å; P245-L248 WeakPolarHBondContact O-CB 3.46Å; P245-L248 PolarHBondContact O-N 3.03Å; K246-L248 VanDerWaalsContact C-N 3.3Å; K246-L248 PolarHBondContact O-N 3.08Å; L248-K250 PolarHBondContact O-N 3.46Å; L248-E251 PolarHBondContact O-N 3.2Å; L248-A252 PolarHBondContact O-N 2.62Å
249L61.5Low64.4Low15 Ų1562.2 Ų62.28%0.07935%0.348CS..Hα-helixtrans-68.3-26.1-164.4-54.8-169.5000113.1V167 I169 Y211 V244 K246 S247 E251 A252V167-L249 HydrophobicContact CG2-CD1 3.55Å; V167-L249 HydrophobicContact CG2-CG 4.18Å; I169-L249 HydrophobicContact CD1-CD1 3.64Å; I169-L249 HydrophobicContact CD1-CD2 3.69Å; I169-L249 HydrophobicContact CD1-CG 4.33Å; I169-L249 HydrophobicContact CG1-CD1 4.29Å; I169-L249 HydrophobicContact CG1-CD2 4.11Å; Y211-L249 HydrophobicContact CE1-CD1 4.34Å; V244-L249 HydrophobicContact CG2-CD2 3.85Å; V244-L249 HydrophobicContact CG2-CG 4.23Å; K246-L249 PolarHBondContact O-N 2.97Å; S247-L249 PolarHBondContact O-N 3.12Å; L249-E251 VanDerWaalsContact C-N 3.27Å; L249-E251 PolarHBondContact O-N 3.32Å; L249-A252 PolarHBondContact O-N 3.36Å
250K59.3Low61.8Low159 Ų15968.5 Ų68.569%0.69139%0.386SS*.Hα-helixtrans-64.8-28.8177.8-74.4-170.7167.8-167.30113.9L248L248-K250 PolarHBondContact O-N 3.46Å
251E54.2Low59Low89 Ų8971 Ų7142%0.41641%0.409SS..Hα-helixtrans-101-6.2-174.3-169.1167.3-165.200111.3S38 L41 L248 L249S38-E251 VanDerWaalsContact CA-OE2 3.29Å; S38-E251 WeakPolarHBondContact CA-OE2 3.37Å; S38-E251 WeakPolarHBondContact CB-OE1 3.46Å; S38-E251 PolarHBondContact OG-OE1 3.32Å; L41-E251 HydrophobicContact CB-CB 4.41Å; L41-E251 HydrophobicContact CD2-CB 3.55Å; L41-E251 HydrophobicContact CD2-CG 3.95Å; L41-E251 VanDerWaalsContact CD2-O 3.24Å; L41-E251 WeakPolarHBondContact CD2-O 3.39Å; L248-E251 PolarHBondContact O-N 3.2Å; L249-E251 VanDerWaalsContact C-N 3.27Å; L249-E251 PolarHBondContact O-N 3.32Å
252A47.7Very low56.3Low46 Ų4677.1 Ų77.138%0.3844%0.442SS..Hα-helixtrans-87.9-40.1179.700000112.1L41 I45 L248 L249L41-A252 HydrophobicContact CD1-CB 4.13Å; L41-A252 VanDerWaalsContact CD2-CA 3.43Å; L41-A252 HydrophobicContact CD2-CB 3.7Å; I45-A252 HydrophobicContact CD1-CB 3.47Å; I45-A252 VanDerWaalsContact CD1-CB 3.47Å; L248-A252 PolarHBondContact O-N 2.62Å; L249-A252 PolarHBondContact O-N 3.36Å
253D50Low54Low70 Ų7082 Ų8237%0.37447%0.474SS..  trans-143.698.9172.6179.10.5000108N255 I256D253-N255 PolarHBondContact O-N 3.36Å; D253-N255 VanDerWaalsContact O-N 3.15Å; D253-N255 WeakPolarHBondContact OD1-CB 3.3Å; D253-N255 PolarHBondContact OD1-N 3.01Å; D253-I256 HydrophobicContact CB-CD1 3.85Å; D253-I256 HydrophobicContact CB-CG1 3.81Å; D253-I256 WeakPolarHBondContact OD2-CG1 3.39Å
254P52.3Low51.3Low105 Ų10587.4 Ų87.468%0.68251%0.506SS*.THydrogen-bonded Turntrans-68.1-7.7179.628.1-34.5000113.2
255N49.5Very low49Very low103 Ų10393 Ų9355%0.55154%0.541SS*.THydrogen-bonded Turntrans-96.9-1.2-174.4-58.4-66.6000114.5D253 L257 S258D253-N255 PolarHBondContact O-N 3.36Å; D253-N255 VanDerWaalsContact O-N 3.15Å; D253-N255 WeakPolarHBondContact OD1-CB 3.3Å; D253-N255 PolarHBondContact OD1-N 3.01Å; N255-L257 PolarHBondContact O-N 3Å; N255-S258 PolarHBondContact O-N 3.47Å
256I53.1Low46.9Very low61 Ų61101.1 Ų101.131%0.31358%0.577SS.*THydrogen-bonded Turntrans-56.8-21.8-176.5-71.2-179.4000113.8Y211 D253Y211-I256 HydrophobicContact CE1-CD1 4.09Å; D253-I256 HydrophobicContact CB-CD1 3.85Å; D253-I256 HydrophobicContact CB-CG1 3.81Å; D253-I256 WeakPolarHBondContact OD2-CG1 3.39Å
257L48.9Very low44.8Very low164 Ų164105.8 Ų105.886%0.85960%0.598SS**THydrogen-bonded Turntrans-83.4-14.5175.9-101.576.1000114.9N255N255-L257 PolarHBondContact O-N 3Å
258S41.3Very low43.1Very low102 Ų102108 Ų10871%0.71362%0.619SS**SBendtrans-85.7-5.8-171.1-60.20000114.5N255N255-S258 PolarHBondContact O-N 3.47Å
259S37Very low42.3Very low95 Ų95113.7 Ų113.766%0.66466%0.656SS**  trans-119.848.3-170.352.50000113.9
260T39Very low40.7Very low131 Ų131117 Ų11780%0.80469%0.686SS**  trans-121.171165.2-57.80000111.4
261S34.1Very low39.2Very low112 Ų112113.9 Ų113.978%0.78369%0.689SS**  trans-143135.2156.252.90000109.7
262L32.5Very low37.8Very low149 Ų149116.5 Ų116.578%0.7871%0.706SS**  trans-126.3164.6174.5-91.385.4000107.5
263P38.3Very low37.1Very low105 Ų105121.2 Ų121.268%0.68272%0.724SS**  cis-128.8174.9-22.136-20.1000112.5
264T29.5Very low36.1Very low140 Ų140125.7 Ų125.786%0.85974%0.743SS**  trans-75.4136.6170.2-37.80000111.6
265T28.2Very low34.8Very low132 Ų132125.6 Ų125.681%0.8175%0.745SS**  trans-143140.4164-17.90000109.5
266E35Very low33.9Very low183 Ų183127 Ų12786%0.85575%0.752SS**  trans-94.2132.5-169.8-56.5174.5118.100113.6
267K26.8Very low32.8Very low209 Ų209135.9 Ų135.991%0.90978%0.782SS**  178.9158.8126-103.6176.2177.5-179.80113.8
268A26.6Very low32.2Very low89 Ų89133.4 Ų133.474%0.73678%0.775SS**  trans-152178.117300000107.9
269P43.3Very low32Very low129 Ų129136.3 Ų136.384%0.83878%0.783SS**  cis-114-154.2-6.842-26000110.4
270A27.7Very low32.1Very low85 Ų85137.4 Ų137.470%0.70279%0.791SS**  cis-157.5169.93.300000111.2
271A28.3Very low31.9Very low92 Ų92137.1 Ų137.176%0.7679%0.794SS**  trans66.2147.2159.700000117.6
272D25.1Very low32.1Very low145 Ų145134.9 Ų134.978%0.77579%0.789SS**  cis-153.4167.3-2.7-132.1-22.3000113.8
273L32.9Very low32.6Very low145 Ų145132.4 Ų132.476%0.75979%0.79SS**  trans45.4108.2167.3-8884.9000122.8
274E27.7Very low32.7Very low164 Ų164136.1 Ų136.177%0.76680%0.8SS**  53113.3110.7-143.976.6164.500122.9
275S26.9Very low33.7Very low103 Ų103135.1 Ų135.172%0.7279%0.787SS**  165111108.1-167.70000116.7
276N30.1Very low35.2Very low133 Ų133132.2 Ų132.271%0.71177%0.772SS**  trans36.599.5139.8-59.4-75.4000123
277R29.4Very low36.4Very low246 Ų246129.6 Ų129.693%0.92876%0.764SS**  178163.6100-98.6-167.7169.3177.7-1.5113.1
278P37.2Very low37.9Very low112 Ų112123.9 Ų123.973%0.72775%0.751SS**  trans-104.9161-153.939.5-37.7000117.7
279N36.5Very low39.6Very low164 Ų164124.2 Ų124.288%0.87774%0.739SS**  trans40.2102.3153.5-81.57.4000120.1
280S38.2Very low40.5Very low118 Ų118122.3 Ų122.383%0.82572%0.722SS**  trans-157100.4136.4-171.10000112.2
281S34.8Very low42.2Very low124 Ų124122 Ų12287%0.86771%0.711SS**  trans-162.633.5161.3-81.60000111.9A283S281-A283 PolarHBondContact O-N 3.43Å
282G38.4Very low44Very low66 Ų66124.6 Ų124.668%0.6870%0.702SS**  trans-72.8107.7162.200000108.2M284G282-M284 PolarHBondContact O-N 2.88Å
283A42.8Very low45.9Very low97 Ų97119.9 Ų119.980%0.80268%0.684SS**  trans-69.482.5178.400000110.5S281 M285S281-A283 PolarHBondContact O-N 3.43Å; A283-M285 VanDerWaalsContact C-N 3.3Å; A283-M285 PolarHBondContact O-N 3.48Å
284M42.2Very low47.2Very low183 Ų183118.7 Ų118.790%0.90167%0.673SS**  trans-63.889173.6-76.8-71.8175.900109.5G282 S286G282-M284 PolarHBondContact O-N 2.88Å; M284-S286 PolarHBondContact O-N 2.88Å
285M49.5Very low49.1Very low118 Ų118114.7 Ų114.758%0.58166%0.656SS**  trans-60.8104165.7-74-166.4166.600108A283 L289 L290A283-M285 VanDerWaalsContact C-N 3.3Å; A283-M285 PolarHBondContact O-N 3.48Å; M285-L289 HydrophobicContact CB-CD2 4.44Å; M285-L289 HydrophobicContact CE-CD2 4.46Å; M285-L289 HydrophobicContact CG-CD2 4.06Å; M285-L289 HydrophobicContact SD-CD2 4.46Å; M285-L290 HydrophobicContact CB-CD1 4.45Å; M285-L290 HydrophobicContact CB-CD2 4.14Å; M285-L290 HydrophobicContact CB-CG 4.04Å; M285-L290 HydrophobicContact SD-CD2 3.82Å
286S60.5Low50.9Low71 Ų71116.8 Ų116.850%0.49765%0.652SS.*  trans-50.5145.1172.6174.10000110.1M284 S288 L289 L290M284-S286 PolarHBondContact O-N 2.88Å; S286-S288 PolarHBondContact O-N 3.28Å; S286-S288 PolarHBondContact OG-N 3.46Å; S286-L289 WeakPolarHBondContact O-CA 3.34Å; S286-L289 WeakPolarHBondContact O-CB 3.4Å; S286-L289 PolarHBondContact O-N 2.93Å; S286-L290 PolarHBondContact O-N 3.5Å
287N58.5Low52.4Low128 Ų128116.5 Ų116.568%0.68465%0.65SS**Hα-helixtrans-49.4-36.6174.2-70.1-18.5000111.2L289 L290 T291N287-L289 VanDerWaalsContact C-N 3.32Å; N287-L289 PolarHBondContact O-N 3.25Å; N287-L290 PolarHBondContact O-N 3.4Å; N287-T291 WeakPolarHBondContact O-CB 3.47Å; N287-T291 PolarHBondContact O-N 3.27Å; N287-T291 PolarHBondContact O-OG1 3.07Å
288S59.6Low54Low89 Ų89109.2 Ų109.262%0.62263%0.627SS**Hα-helixtrans-60.3-36.3175.2-45.10000113.7S286 Y292S286-S288 PolarHBondContact O-N 3.28Å; S286-S288 PolarHBondContact OG-N 3.46Å; S288-Y292 VanDerWaalsContact O-CB 3.3Å; S288-Y292 WeakPolarHBondContact O-CB 3.48Å; S288-Y292 PolarHBondContact O-N 2.94Å
289L62.3Low55.5Low96 Ų96108 Ų10850%0.50362%0.619SS.*Hα-helixtrans-75.3-39.7179.3-157.981.7000111.3M285 S286 N287 Y292 A293M285-L289 HydrophobicContact CB-CD2 4.44Å; M285-L289 HydrophobicContact CE-CD2 4.46Å; M285-L289 HydrophobicContact CG-CD2 4.06Å; M285-L289 HydrophobicContact SD-CD2 4.46Å; S286-L289 WeakPolarHBondContact O-CA 3.34Å; S286-L289 WeakPolarHBondContact O-CB 3.4Å; S286-L289 PolarHBondContact O-N 2.93Å; N287-L289 VanDerWaalsContact C-N 3.32Å; N287-L289 PolarHBondContact O-N 3.25Å; L289-Y292 PolarHBondContact O-N 2.93Å; L289-A293 WeakPolarHBondContact O-CB 3.37Å; L289-A293 PolarHBondContact O-N 3.31Å
290L62.7Low57.1Low89 Ų89108 Ų10847%0.46661%0.614SS.*Hα-helixtrans-65.1-42.8173.1-67.6172.2000111.3M285 S286 N287 A293 F294M285-L290 HydrophobicContact CB-CD1 4.45Å; M285-L290 HydrophobicContact CB-CD2 4.14Å; M285-L290 HydrophobicContact CB-CG 4.04Å; M285-L290 HydrophobicContact SD-CD2 3.82Å; S286-L290 PolarHBondContact O-N 3.5Å; N287-L290 PolarHBondContact O-N 3.4Å; L290-A293 PolarHBondContact O-N 2.99Å; L290-F294 WeakPolarHBondContact O-CB 3.29Å; L290-F294 PolarHBondContact O-N 3.44Å
291T61.7Low58.5Low78 Ų78106.7 Ų106.748%0.47960%0.595SS.*Hα-helixtrans-63.5-41.7174.1-60.80000111.5N287 F294 I295N287-T291 WeakPolarHBondContact O-CB 3.47Å; N287-T291 PolarHBondContact O-N 3.27Å; N287-T291 PolarHBondContact O-OG1 3.07Å; T291-F294 PolarHBondContact O-N 3.42Å; T291-I295 HydrophobicContact CG2-CD1 3.8Å; T291-I295 HydrophobicContact CG2-CG1 4.43Å; T291-I295 WeakPolarHBondContact O-CB 3.36Å; T291-I295 VanDerWaalsContact O-CG1 3.28Å; T291-I295 WeakPolarHBondContact O-CG1 3.32Å; T291-I295 PolarHBondContact O-N 2.91Å
292Y65.9Low60.2Low147 Ų147101.9 Ų101.958%0.57656%0.564SS**Hα-helixtrans-63.4-42.8175.2179.2-106.3000112.5S288 L289 I295 K296S288-Y292 VanDerWaalsContact O-CB 3.3Å; S288-Y292 WeakPolarHBondContact O-CB 3.48Å; S288-Y292 PolarHBondContact O-N 2.94Å; L289-Y292 PolarHBondContact O-N 2.93Å; Y292-I295 PolarHBondContact O-N 3.24Å; Y292-K296 WeakPolarHBondContact O-CB 3.28Å; Y292-K296 PolarHBondContact O-N 3.34Å
293A65.6Low61.7Low47 Ų47101.3 Ų101.339%0.38855%0.552SS.*Hα-helixtrans-61.3-45.3174.300000111.8L289 L290 I295 K296 D297L289-A293 WeakPolarHBondContact O-CB 3.37Å; L289-A293 PolarHBondContact O-N 3.31Å; L290-A293 PolarHBondContact O-N 2.99Å; A293-I295 PolarHBondContact O-N 2.96Å; A293-K296 PolarHBondContact O-N 3.41Å; A293-D297 PolarHBondContact O-N 3.43Å
294F61.7Low63Low119 Ų119100.1 Ų100.152%0.52253%0.532SS..Hα-helixtrans-63.4-40.1177.3-175.7-95.4000113L290 T291 H298L290-F294 WeakPolarHBondContact O-CB 3.29Å; L290-F294 PolarHBondContact O-N 3.44Å; T291-F294 PolarHBondContact O-N 3.42Å; F294-H298 AromaticContact CE2-CD2 3.77Å; F294-H298 AromaticContact CZ-CD2 3.98Å; F294-H298 PolarHBondContact O-N 2.82Å
295I67.3Low64.4Low81 Ų8196.8 Ų96.842%0.41552%0.517SS..Hα-helixtrans-63.2-42.1173.7-76.7169.4000111T291 Y292 A293 H298 A302T291-I295 HydrophobicContact CG2-CD1 3.8Å; T291-I295 HydrophobicContact CG2-CG1 4.43Å; T291-I295 WeakPolarHBondContact O-CB 3.36Å; T291-I295 VanDerWaalsContact O-CG1 3.28Å; T291-I295 WeakPolarHBondContact O-CG1 3.32Å; T291-I295 PolarHBondContact O-N 2.91Å; Y292-I295 PolarHBondContact O-N 3.24Å; A293-I295 PolarHBondContact O-N 2.96Å; I295-H298 CarbonylContact O-C 3.55Å; I295-H298 VanDerWaalsContact O-C 3.32Å; I295-H298 PolarHBondContact O-N 2.92Å; I295-A302 HydrophobicContact CB-CB 4.32Å; I295-A302 HydrophobicContact CG1-CB 4.18Å; I295-A302 HydrophobicContact CG2-CB 3.82Å
296K63.2Low65.8Low147 Ų14798.3 Ų98.364%0.63952%0.521SS*.Hα-helixtrans-67.7-37.7179.8-174.7176.5178-179.60112.9Y292 A293 H298Y292-K296 WeakPolarHBondContact O-CB 3.28Å; Y292-K296 PolarHBondContact O-N 3.34Å; A293-K296 PolarHBondContact O-N 3.41Å; K296-H298 VanDerWaalsContact C-N 3.32Å
297D63.5Low66.7Low126 Ų12698.3 Ų98.367%0.67452%0.518SS*.Hα-helixtrans-75.1-20.5176.9-78.7-2.3000112.9A293A293-D297 PolarHBondContact O-N 3.43Å
298H61.5Low67.8Low93 Ų9394.6 Ų94.643%0.43150%0.502SS..  trans-134.463.4-176.3-62.2-35.3000113.5F294 I295 K296 E300 M301 A302F294-H298 AromaticContact CE2-CD2 3.77Å; F294-H298 AromaticContact CZ-CD2 3.98Å; F294-H298 PolarHBondContact O-N 2.82Å; I295-H298 CarbonylContact O-C 3.55Å; I295-H298 VanDerWaalsContact O-C 3.32Å; I295-H298 PolarHBondContact O-N 2.92Å; K296-H298 VanDerWaalsContact C-N 3.32Å; H298-E300 VanDerWaalsContact C-N 3.31Å; H298-E300 PolarHBondContact O-N 2.92Å; H298-M301 HydrophobicContact CB-CB 4.04Å; H298-M301 HydrophobicContact CB-CG 4.22Å; H298-M301 PolarHBondContact O-N 3.17Å; H298-A302 PolarHBondContact O-N 3.38Å
299P68.6Low69Low88 Ų8894.2 Ų94.257%0.57150%0.499SS*.Hα-helixtrans-60.7-35.7-175.724.1-34.6000113.4M301 A302 A303P299-M301 VanDerWaalsContact C-N 3.34Å; P299-M301 PolarHBondContact O-N 3.23Å; P299-A302 PolarHBondContact O-N 2.95Å; P299-A303 WeakPolarHBondContact O-CB 3.47Å; P299-A303 PolarHBondContact O-N 3.48Å
300E71Confident70.2Confident163 Ų16392.7 Ų92.776%0.76249%0.494SS*.Hα-helixtrans-62.1-40.1175.5-63.5176.5-171.100112.3H298 L304H298-E300 VanDerWaalsContact C-N 3.31Å; H298-E300 PolarHBondContact O-N 2.92Å; E300-L304 WeakPolarHBondContact O-CB 3.31Å; E300-L304 VanDerWaalsContact O-CG 3.28Å; E300-L304 WeakPolarHBondContact O-CG 3.1Å; E300-L304 PolarHBondContact O-N 2.8Å
301M66.7Low71.1Confident90 Ų9092.3 Ų92.344%0.44350%0.498SS..Hα-helixtrans-72.9-37.3177.7-66-67.3-72.500111.3H298 P299 L304 L305H298-M301 HydrophobicContact CB-CB 4.04Å; H298-M301 HydrophobicContact CB-CG 4.22Å; H298-M301 PolarHBondContact O-N 3.17Å; P299-M301 VanDerWaalsContact C-N 3.34Å; P299-M301 PolarHBondContact O-N 3.23Å; M301-L304 PolarHBondContact O-N 2.98Å; M301-L304 HydrophobicContact SD-CD1 4.44Å; M301-L305 WeakPolarHBondContact O-CB 3.35Å; M301-L305 VanDerWaalsContact O-CG 3.31Å; M301-L305 WeakPolarHBondContact O-CG 3.38Å; M301-L305 PolarHBondContact O-N 2.85Å
302A71.1Confident72.1Confident24 Ų2492.2 Ų92.220%0.19850%0.497CS..Hα-helixtrans-62.8-44173.700000111.6I295 H298 P299 L305 F306I295-A302 HydrophobicContact CB-CB 4.32Å; I295-A302 HydrophobicContact CG1-CB 4.18Å; I295-A302 HydrophobicContact CG2-CB 3.82Å; H298-A302 PolarHBondContact O-N 3.38Å; P299-A302 PolarHBondContact O-N 2.95Å; A302-L305 PolarHBondContact O-N 3.12Å; A302-F306 WeakPolarHBondContact O-CB 3.28Å; A302-F306 PolarHBondContact O-N 3.26Å
303A70.8Confident73Confident54 Ų5487 Ų8745%0.44649%0.487SS..Hα-helixtrans-62.7-41.4174.600000112.2P299 F306 T307P299-A303 WeakPolarHBondContact O-CB 3.47Å; P299-A303 PolarHBondContact O-N 3.48Å; A303-F306 PolarHBondContact O-N 3.23Å; A303-T307 WeakPolarHBondContact O-CB 3.4Å; A303-T307 WeakPolarHBondContact O-CG2 3.37Å; A303-T307 PolarHBondContact O-N 3.41Å; A303-T307 PolarHBondContact O-OG1 2.82Å
304L69.5Low74Confident72 Ų7289.4 Ų89.438%0.37749%0.493SS..Hα-helixtrans-64.9-38.9175.1-75.9168000112.6E300 M301 T307 S308E300-L304 WeakPolarHBondContact O-CB 3.31Å; E300-L304 VanDerWaalsContact O-CG 3.28Å; E300-L304 WeakPolarHBondContact O-CG 3.1Å; E300-L304 PolarHBondContact O-N 2.8Å; M301-L304 PolarHBondContact O-N 2.98Å; M301-L304 HydrophobicContact SD-CD1 4.44Å; L304-T307 WeakPolarHBondContact CA-OG1 3.23Å; L304-T307 PolarHBondContact O-OG1 3.33Å; L304-S308 VanDerWaalsContact O-CB 3.27Å; L304-S308 WeakPolarHBondContact O-CB 3.24Å; L304-S308 PolarHBondContact O-N 3.18Å; L304-S308 PolarHBondContact O-OG 3.36Å
305L71.2Confident75Confident112 Ų11288.7 Ų88.759%0.58649%0.494SS*.Hα-helixtrans-71-40.4176.6-72.2170.7000112.1M301 A302 S308 S309M301-L305 WeakPolarHBondContact O-CB 3.35Å; M301-L305 VanDerWaalsContact O-CG 3.31Å; M301-L305 WeakPolarHBondContact O-CG 3.38Å; M301-L305 PolarHBondContact O-N 2.85Å; A302-L305 PolarHBondContact O-N 3.12Å; L305-S308 WeakPolarHBondContact CA-OG 3.4Å; L305-S308 PolarHBondContact O-OG 3.36Å; L305-S309 VanDerWaalsContact O-CB 3.22Å; L305-S309 WeakPolarHBondContact O-CB 3.46Å; L305-S309 PolarHBondContact O-N 3.08Å
306F78.5Confident75.6Confident150 Ų15091.3 Ų91.366%0.65850%0.503SS*.Hα-helixtrans-62.8-52.6174-179.5-100.4000111.5A302 A303 S308 S309 V310A302-F306 WeakPolarHBondContact O-CB 3.28Å; A302-F306 PolarHBondContact O-N 3.26Å; A303-F306 PolarHBondContact O-N 3.23Å; F306-S308 PolarHBondContact O-N 2.81Å; F306-S309 WeakPolarHBondContact O-CB 3.28Å; F306-S309 PolarHBondContact O-N 3.38Å; F306-V310 HydrophobicContact CD1-CG2 4.38Å; F306-V310 HydrophobicContact CE1-CG2 4.01Å; F306-V310 HydrophobicContact CE2-CG2 4.25Å; F306-V310 HydrophobicContact CZ-CG2 3.94Å; F306-V310 WeakPolarHBondContact O-CG2 3.49Å; F306-V310 PolarHBondContact O-N 3.18Å
307T80.9Confident76.5Confident71 Ų7187.8 Ų87.844%0.43649%0.494SS..Hα-helixtrans-62.5-41.3179.949.80000112.5A303 L304 V310 C311A303-T307 WeakPolarHBondContact O-CB 3.4Å; A303-T307 WeakPolarHBondContact O-CG2 3.37Å; A303-T307 PolarHBondContact O-N 3.41Å; A303-T307 PolarHBondContact O-OG1 2.82Å; L304-T307 WeakPolarHBondContact CA-OG1 3.23Å; L304-T307 PolarHBondContact O-OG1 3.33Å; T307-V310 PolarHBondContact O-N 2.92Å; T307-C311 WeakPolarHBondContact O-CB 3.37Å; T307-C311 PolarHBondContact O-N 2.6Å; T307-C311 PolarHBondContact O-SG 3.33Å
308S81.4Confident77.4Confident50 Ų5087.3 Ų87.335%0.3549%0.491SS..Hα-helixtrans-67.5-37.2175.455.10000113.1L304 L305 F306 C311 V312L304-S308 VanDerWaalsContact O-CB 3.27Å; L304-S308 WeakPolarHBondContact O-CB 3.24Å; L304-S308 PolarHBondContact O-N 3.18Å; L304-S308 PolarHBondContact O-OG 3.36Å; L305-S308 WeakPolarHBondContact CA-OG 3.4Å; L305-S308 PolarHBondContact O-OG 3.36Å; F306-S308 PolarHBondContact O-N 2.81Å; S308-C311 PolarHBondContact O-N 2.93Å; S308-V312 WeakPolarHBondContact O-CB 3.22Å; S308-V312 VanDerWaalsContact O-CG2 3.29Å; S308-V312 WeakPolarHBondContact O-CG2 3.34Å; S308-V312 PolarHBondContact O-N 3.4Å
309S83.1Confident78.1Confident81 Ų8187.2 Ų87.257%0.56649%0.493SS*.Hα-helixtrans-61.1-48.1171.9-1750000111.7L305 F306 C311 V312 G313L305-S309 VanDerWaalsContact O-CB 3.22Å; L305-S309 WeakPolarHBondContact O-CB 3.46Å; L305-S309 PolarHBondContact O-N 3.08Å; F306-S309 WeakPolarHBondContact O-CB 3.28Å; F306-S309 PolarHBondContact O-N 3.38Å; S309-C311 PolarHBondContact O-N 3.45Å; S309-V312 PolarHBondContact O-N 3.35Å; S309-G313 PolarHBondContact O-N 3.07Å
310V88Confident78.5Confident65 Ų6585.4 Ų85.439%0.39449%0.486SS..Hα-helixtrans-61-44.7176171.60000111.3F306 T307 V312 G313 L314F306-V310 HydrophobicContact CD1-CG2 4.38Å; F306-V310 HydrophobicContact CE1-CG2 4.01Å; F306-V310 HydrophobicContact CE2-CG2 4.25Å; F306-V310 HydrophobicContact CZ-CG2 3.94Å; F306-V310 WeakPolarHBondContact O-CG2 3.49Å; F306-V310 PolarHBondContact O-N 3.18Å; T307-V310 PolarHBondContact O-N 2.92Å; V310-V312 PolarHBondContact O-N 3.34Å; V310-G313 PolarHBondContact O-N 3.06Å; V310-L314 HydrophobicContact CG1-CD1 3.9Å; V310-L314 HydrophobicContact CG1-CG 4.36Å; V310-L314 WeakPolarHBondContact O-CB 3.35Å; V310-L314 WeakPolarHBondContact O-CG 3.31Å; V310-L314 PolarHBondContact O-N 3.29Å
311C82.5Confident79Confident81 Ų8182.2 Ų82.255%0.54747%0.473SS..Hα-helixtrans-62.6-41.1177.5-67.90000112.5T307 S308 S309 L315T307-C311 WeakPolarHBondContact O-CB 3.37Å; T307-C311 PolarHBondContact O-N 2.6Å; T307-C311 PolarHBondContact O-SG 3.33Å; S308-C311 PolarHBondContact O-N 2.93Å; S309-C311 PolarHBondContact O-N 3.45Å; C311-L315 WeakPolarHBondContact O-CB 3.3Å; C311-L315 PolarHBondContact O-N 2.84Å
312V82.1Confident79.5Confident76 Ų7680.6 Ų80.646%0.46147%0.471SS..Hα-helixtrans-66.9-41.8175.6168.40000110.9S308 S309 V310 L315 F316S308-V312 WeakPolarHBondContact O-CB 3.22Å; S308-V312 VanDerWaalsContact O-CG2 3.29Å; S308-V312 WeakPolarHBondContact O-CG2 3.34Å; S308-V312 PolarHBondContact O-N 3.4Å; S309-V312 PolarHBondContact O-N 3.35Å; V310-V312 PolarHBondContact O-N 3.34Å; V312-L315 PolarHBondContact O-N 3.12Å; V312-F316 HydrophobicContact CG1-CD2 3.74Å; V312-F316 HydrophobicContact CG1-CE2 3.6Å; V312-F316 VanDerWaalsContact O-CD2 3.27Å; V312-F316 WeakPolarHBondContact O-CD2 3.23Å; V312-F316 PolarHBondContact O-N 2.86Å
313G84.8Confident79.8Confident36 Ų3683.7 Ų83.737%0.37149%0.487SS..Hα-helixtrans-60-48175.300000112.8S309 V310 L315 F316 T317S309-G313 PolarHBondContact O-N 3.07Å; V310-G313 PolarHBondContact O-N 3.06Å; G313-L315 VanDerWaalsContact C-N 3.31Å; G313-L315 PolarHBondContact O-N 3.41Å; G313-F316 PolarHBondContact O-N 2.88Å; G313-T317 PolarHBondContact O-N 3.32Å
314L86.2Confident80Confident98 Ų9889.6 Ų89.651%0.51350%0.498SS..Hα-helixtrans-61.9-37.1175.1-71171.6000112.3V310 T317 L318V310-L314 HydrophobicContact CG1-CD1 3.9Å; V310-L314 HydrophobicContact CG1-CG 4.36Å; V310-L314 WeakPolarHBondContact O-CB 3.35Å; V310-L314 WeakPolarHBondContact O-CG 3.31Å; V310-L314 PolarHBondContact O-N 3.29Å; L314-T317 WeakPolarHBondContact CA-OG1 3.35Å; L314-T317 PolarHBondContact O-N 2.83Å; L314-T317 PolarHBondContact O-OG1 3.22Å; L314-L318 WeakPolarHBondContact O-CB 3.31Å; L314-L318 VanDerWaalsContact O-CG 3.23Å; L314-L318 WeakPolarHBondContact O-CG 3.27Å; L314-L318 PolarHBondContact O-N 3.39Å
315L83.3Confident80.3Confident104 Ų10491 Ų9155%0.54551%0.509SS..Hα-helixtrans-66.4-40.1175.7-164152.3000111.1C311 V312 G313 L319C311-L315 WeakPolarHBondContact O-CB 3.3Å; C311-L315 PolarHBondContact O-N 2.84Å; V312-L315 PolarHBondContact O-N 3.12Å; G313-L315 VanDerWaalsContact C-N 3.31Å; G313-L315 PolarHBondContact O-N 3.41Å; L315-L319 HydrophobicContact CD2-CD1 3.66Å; L315-L319 HydrophobicContact CD2-CG 4.22Å; L315-L319 WeakPolarHBondContact O-CB 3.49Å; L315-L319 VanDerWaalsContact O-CG 3.31Å; L315-L319 WeakPolarHBondContact O-CG 3.47Å; L315-L319 PolarHBondContact O-N 2.83Å
316F79.2Confident80.4Confident136 Ų13690.5 Ų90.560%0.59651%0.511SS*.Hα-helixtrans-66.7-38.9172.9-82.1-63.9000113.5V312 G313 L319 A320V312-F316 HydrophobicContact CG1-CD2 3.74Å; V312-F316 HydrophobicContact CG1-CE2 3.6Å; V312-F316 VanDerWaalsContact O-CD2 3.27Å; V312-F316 WeakPolarHBondContact O-CD2 3.23Å; V312-F316 PolarHBondContact O-N 2.86Å; G313-F316 PolarHBondContact O-N 2.88Å; F316-L319 PolarHBondContact O-N 3.08Å; F316-A320 WeakPolarHBondContact O-CB 2.99Å; F316-A320 PolarHBondContact O-N 3.2Å
317T83.1Confident79.4Confident74 Ų7486.8 Ų86.845%0.45450%0.503SS..Hα-helixtrans-68.9-39.4176.158.40000111.7G313 L314 L319 A320 L321G313-T317 PolarHBondContact O-N 3.32Å; L314-T317 WeakPolarHBondContact CA-OG1 3.35Å; L314-T317 PolarHBondContact O-N 2.83Å; L314-T317 PolarHBondContact O-OG1 3.22Å; T317-L319 PolarHBondContact O-N 2.92Å; T317-A320 PolarHBondContact O-N 2.85Å; T317-L321 WeakPolarHBondContact O-CB 3.43Å; T317-L321 VanDerWaalsContact O-CG 3.27Å; T317-L321 WeakPolarHBondContact O-CG 3.15Å; T317-L321 PolarHBondContact O-N 3.26Å
318L82.4Confident78.4Confident115 Ų11593 Ų9360%0.60252%0.518SS*.Hα-helixtrans-63.2-38.3173.5-72.4169.8000112.5L314 L321 S322L314-L318 WeakPolarHBondContact O-CB 3.31Å; L314-L318 VanDerWaalsContact O-CG 3.23Å; L314-L318 WeakPolarHBondContact O-CG 3.27Å; L314-L318 PolarHBondContact O-N 3.39Å; L318-L321 PolarHBondContact O-N 2.62Å; L318-S322 WeakPolarHBondContact O-CB 3.29Å; L318-S322 PolarHBondContact O-N 2.8Å; L318-S322 PolarHBondContact O-OG 2.63Å
319L76.4Confident77Confident92 Ų9292.9 Ų92.948%0.48253%0.525SS..Hα-helixtrans-66.7-40.7171.6-73175.8000112.4L315 F316 T317 L321 S322 V323L315-L319 HydrophobicContact CD2-CD1 3.66Å; L315-L319 HydrophobicContact CD2-CG 4.22Å; L315-L319 WeakPolarHBondContact O-CB 3.49Å; L315-L319 VanDerWaalsContact O-CG 3.31Å; L315-L319 WeakPolarHBondContact O-CG 3.47Å; L315-L319 PolarHBondContact O-N 2.83Å; F316-L319 PolarHBondContact O-N 3.08Å; T317-L319 PolarHBondContact O-N 2.92Å; L319-L321 VanDerWaalsContact C-N 3.33Å; L319-L321 PolarHBondContact O-N 2.85Å; L319-S322 PolarHBondContact O-N 2.89Å; L319-S322 PolarHBondContact O-OG 3.37Å; L319-S322 VanDerWaalsContact O-OG 3.08Å; L319-V323 WeakPolarHBondContact O-CB 3.08Å; L319-V323 VanDerWaalsContact O-CG2 3.32Å; L319-V323 WeakPolarHBondContact O-CG2 3.43Å; L319-V323 PolarHBondContact O-N 3.2Å
320A77Confident75.4Confident50 Ų5097.6 Ų97.641%0.41353%0.53SS..Hα-helixtrans-65.3-37.2175.400000112.1F316 T317 R324F316-A320 WeakPolarHBondContact O-CB 2.99Å; F316-A320 PolarHBondContact O-N 3.2Å; T317-A320 PolarHBondContact O-N 2.85Å; A320-R324 WeakPolarHBondContact O-CB 3.33Å; A320-R324 VanDerWaalsContact O-CG 3.25Å; A320-R324 WeakPolarHBondContact O-CG 3.35Å; A320-R324 PolarHBondContact O-N 3.18Å
321L80.6Confident73.4Confident95 Ų95103.8 Ų103.850%0.49755%0.546SS..Hα-helixtrans-69.5-44.6175.1-73169.3000111.8T317 L318 L319 V323 R324 V325T317-L321 WeakPolarHBondContact O-CB 3.43Å; T317-L321 VanDerWaalsContact O-CG 3.27Å; T317-L321 WeakPolarHBondContact O-CG 3.15Å; T317-L321 PolarHBondContact O-N 3.26Å; L318-L321 PolarHBondContact O-N 2.62Å; L319-L321 VanDerWaalsContact C-N 3.33Å; L319-L321 PolarHBondContact O-N 2.85Å; L321-V323 VanDerWaalsContact C-N 3.33Å; L321-V323 PolarHBondContact O-N 2.84Å; L321-R324 PolarHBondContact O-N 3.13Å; L321-R324 VanDerWaalsContact O-N 3.13Å; L321-V325 WeakPolarHBondContact O-CG2 3.09Å; L321-V325 PolarHBondContact O-N 3.27Å
322S78.3Confident71.6Confident56 Ų56107 Ų10739%0.39255%0.553SS.*Hα-helixtrans-64.2-37.9177.971.40000112.1L318 L319 T326L318-S322 WeakPolarHBondContact O-CB 3.29Å; L318-S322 PolarHBondContact O-N 2.8Å; L318-S322 PolarHBondContact O-OG 2.63Å; L319-S322 PolarHBondContact O-N 2.89Å; L319-S322 PolarHBondContact O-OG 3.37Å; L319-S322 VanDerWaalsContact O-OG 3.08Å; S322-T326 VanDerWaalsContact O-CB 3.28Å; S322-T326 WeakPolarHBondContact O-CB 3.18Å; S322-T326 PolarHBondContact O-N 3.4Å; S322-T326 PolarHBondContact O-OG1 2.99Å
323V77.1Confident69.7Low89 Ų89112.3 Ų112.354%0.53957%0.565SS.*Hα-helixtrans-63.1-46.1169.7171.10000111.2L319 L321 V325 T326 C327L319-V323 WeakPolarHBondContact O-CB 3.08Å; L319-V323 VanDerWaalsContact O-CG2 3.32Å; L319-V323 WeakPolarHBondContact O-CG2 3.43Å; L319-V323 PolarHBondContact O-N 3.2Å; L321-V323 VanDerWaalsContact C-N 3.33Å; L321-V323 PolarHBondContact O-N 2.84Å; V323-V325 PolarHBondContact O-N 2.93Å; V323-T326 PolarHBondContact O-N 2.93Å; V323-C327 VanDerWaalsContact O-CB 3.28Å; V323-C327 WeakPolarHBondContact O-CB 3.22Å; V323-C327 PolarHBondContact O-N 3.04Å; V323-C327 PolarHBondContact O-SG 3.16Å; V323-C327 VanDerWaalsContact O-SG 3.34Å
324R74.2Confident67.8Low179 Ų179115.5 Ų115.568%0.67557%0.574SS**Hα-helixtrans-61.3-43.1177.5-78.5174.4179.2-151.40.5112.7A320 L321 R328A320-R324 WeakPolarHBondContact O-CB 3.33Å; A320-R324 VanDerWaalsContact O-CG 3.25Å; A320-R324 WeakPolarHBondContact O-CG 3.35Å; A320-R324 PolarHBondContact O-N 3.18Å; L321-R324 PolarHBondContact O-N 3.13Å; L321-R324 VanDerWaalsContact O-N 3.13Å; R324-R328 WeakPolarHBondContact O-CB 3.43Å; R324-R328 WeakPolarHBondContact O-CG 3.34Å; R324-R328 PolarHBondContact O-N 3.5Å
325V76.9Confident65.9Low102 Ų102118.8 Ų118.862%0.61859%0.586SS**Hα-helixtrans-66.3-46.8177.2171.50000110.6L321 V323 C327 R328 G329L321-V325 WeakPolarHBondContact O-CG2 3.09Å; L321-V325 PolarHBondContact O-N 3.27Å; V323-V325 PolarHBondContact O-N 2.93Å; V325-C327 VanDerWaalsContact C-N 3.35Å; V325-C327 PolarHBondContact O-N 2.91Å; V325-R328 PolarHBondContact O-N 2.88Å; V325-G329 PolarHBondContact O-N 3.21Å
326T73.1Confident64.2Low100 Ų100119.1 Ų119.161%0.61359%0.592SS**Hα-helixtrans-62.6-40.9178.7-53.30000111.6S322 V323 R330S322-T326 VanDerWaalsContact O-CB 3.28Å; S322-T326 WeakPolarHBondContact O-CB 3.18Å; S322-T326 PolarHBondContact O-N 3.4Å; S322-T326 PolarHBondContact O-OG1 2.99Å; V323-T326 PolarHBondContact O-N 2.93Å; T326-R330 PolarHBondContact O-N 2.96Å
327C56.8Low62.6Low73 Ų73119.9 Ų119.949%0.49360%0.602SS.*Hα-helixtrans-72.5-34.7177-71.40000113.5V323 V325 R330 R331V323-C327 VanDerWaalsContact O-CB 3.28Å; V323-C327 WeakPolarHBondContact O-CB 3.22Å; V323-C327 PolarHBondContact O-N 3.04Å; V323-C327 PolarHBondContact O-SG 3.16Å; V323-C327 VanDerWaalsContact O-SG 3.34Å; V325-C327 VanDerWaalsContact C-N 3.35Å; V325-C327 PolarHBondContact O-N 2.91Å; C327-R330 PolarHBondContact O-N 3.43Å; C327-R331 PolarHBondContact O-N 2.86Å; C327-R331 VanDerWaalsContact O-N 3.08Å
328R60.4Low60.5Low201 Ų201119.9 Ų119.976%0.75862%0.616SS**Hα-helixtrans-66.1-44.3170.6-83.8-177.6164.2178.5-6.8111.5R324 V325 R330 R331 H332R324-R328 WeakPolarHBondContact O-CB 3.43Å; R324-R328 WeakPolarHBondContact O-CG 3.34Å; R324-R328 PolarHBondContact O-N 3.5Å; V325-R328 PolarHBondContact O-N 2.88Å; R328-R330 PolarHBondContact O-N 3.27Å; R328-R331 PolarHBondContact O-N 3.25Å; R328-H332 PolarHBondContact O-N 2.95Å
329G51.6Low58.2Low47 Ų47119 Ų11949%0.48563%0.626SS.*Hα-helixtrans-60.2-30.4173.700000113.2V325 R333V325-G329 PolarHBondContact O-N 3.21Å; G329-R333 PolarHBondContact O-N 2.94Å
330R50.3Low56.1Low181 Ų181124.4 Ų124.468%0.68365%0.646SS**Hα-helixtrans-70.2-51.6172.2-148.1172.4-168.7169.23.5111.9T326 C327 R328 H332 R333 D334T326-R330 PolarHBondContact O-N 2.96Å; C327-R330 PolarHBondContact O-N 3.43Å; R328-R330 PolarHBondContact O-N 3.27Å; R330-H332 VanDerWaalsContact C-N 3.29Å; R330-H332 PolarHBondContact O-N 3.07Å; R330-R333 WeakPolarHBondContact O-CA 3.45Å; R330-R333 PolarHBondContact O-N 3.38Å; R330-D334 PolarHBondContact O-N 2.94Å
331R45Very low54Low194 Ų194127.2 Ų127.273%0.73266%0.662SS**Hα-helixtrans-55.5-42.1175.6-77.6-169.9175.2-169.2-1.5112.7C327 R328 R333 D334 H335C327-R331 PolarHBondContact O-N 2.86Å; C327-R331 VanDerWaalsContact O-N 3.08Å; R328-R331 PolarHBondContact O-N 3.25Å; R331-R333 PolarHBondContact O-N 3.06Å; R331-D334 PolarHBondContact O-N 2.84Å; R331-H335 PolarHBondContact O-CD2 3.24Å; R331-H335 VanDerWaalsContact O-CD2 3.27Å; R331-H335 PolarHBondContact O-N 2.8Å
332H43.9Very low51.6Low149 Ų149130.7 Ų130.769%0.6968%0.681SS**Hα-helixtrans-67.2-21.3178.7-154-48.2000113R328 R330 T336R328-H332 PolarHBondContact O-N 2.95Å; R330-H332 VanDerWaalsContact C-N 3.29Å; R330-H332 PolarHBondContact O-N 3.07Å; H332-T336 PolarHBondContact O-OG1 2.95Å
333R42.5Very low49.1Very low187 Ų187131.4 Ų131.471%0.70670%0.698SS**Hα-helixtrans-88.1-28.6175.7-151.4171.986.7162.18.6113.2G329 R330 R331G329-R333 PolarHBondContact O-N 2.94Å; R330-R333 WeakPolarHBondContact O-CA 3.45Å; R330-R333 PolarHBondContact O-N 3.38Å; R331-R333 PolarHBondContact O-N 3.06Å
334D46.5Very low46.8Very low104 Ų104134.9 Ų134.956%0.55671%0.712SS**Hα-helixtrans-73.2-32.1176.5-61-32.1000111.5R330 R331 T336 L337R330-D334 PolarHBondContact O-N 2.94Å; R331-D334 PolarHBondContact O-N 2.84Å; D334-T336 VanDerWaalsContact C-N 3.25Å; D334-T336 PolarHBondContact O-N 3.17Å; D334-L337 PolarHBondContact O-N 3.24Å
335H46.2Very low44.8Very low167 Ų167132.4 Ų132.477%0.77372%0.717SS**THydrogen-bonded Turntrans-67.6-15.5174.9-82.2-69.8000115R331R331-H335 PolarHBondContact O-CD2 3.24Å; R331-H335 VanDerWaalsContact O-CD2 3.27Å; R331-H335 PolarHBondContact O-N 2.8Å
336T46.5Very low42.6Very low110 Ų110133.7 Ų133.768%0.67573%0.728SS**THydrogen-bonded Turntrans-89.2-6178.1-34.70000113.2H332 D334H332-T336 PolarHBondContact O-OG1 2.95Å; D334-T336 VanDerWaalsContact C-N 3.25Å; D334-T336 PolarHBondContact O-N 3.17Å
337L45.4Very low40.4Very low152 Ų152137.1 Ų137.180%0.79674%0.742SS**SBendtrans-131.751-172.3-67.9174.2000112.5D334D334-L337 PolarHBondContact O-N 3.24Å
338G39.9Very low38.9Very low74 Ų74139.2 Ų139.276%0.76376%0.757SS**  trans-145.731.4-17100000117.1
339A34.6Very low37.3Very low97 Ų97134.4 Ų134.480%0.80275%0.754SS**  trans-13676.3-171.800000115.6
340K32.1Very low36.3Very low206 Ų206140.6 Ų140.690%0.89677%0.767SS**  trans174.8109.7142.1-101.4165.3-179.3175.80113.3
341S32.3Very low35.2Very low108 Ų108139.2 Ų139.276%0.75577%0.768SS**  -176.2130.4108.943.70000112.8
342N30.1Very low34.6Very low168 Ų168136.2 Ų136.290%0.89877%0.767SS**  trans45.4118.9150.2-50.9-4.1000120.7
343G26.7Very low33.9Very low72 Ų72136.6 Ų136.674%0.74277%0.774SS**  trans16735.4162.700000122.3
344L27.5Very low33.5Very low161 Ų161136.2 Ų136.284%0.84378%0.78SS**  trans59.2121.1170-85.469.9000119.5
345T31.6Very low32.8Very low127 Ų127139.7 Ų139.778%0.77979%0.793SS**  trans50.8122150.755.60000119.9
346P32Very low32Very low130 Ų130139.1 Ų139.184%0.84480%0.796SS**  -123.1158.5106.636-34.4000113.3
347N26.8Very low31.4Very low171 Ų171142.6 Ų142.691%0.91480%0.804SS**  trans-80.2152.3170.7-161.821.4000110.2
348C25.1Very low30.8Very low118 Ų118140 Ų14080%0.79781%0.805SS**  trans-130.8132.4-169.2-170.30000114.5
349S26.1Very low30.3Very low100 Ų100145 Ų14570%0.69981%0.809SS**  trans-131.9124.6155.851.40000105.3
350K30.8Very low30.3Very low177 Ų177147.3 Ų147.377%0.7781%0.807SS**  54.2137.493.4-65.9-165.4172.9-161.30113.7
351Q27.8Very low30.4Very low151 Ų151144 Ų14471%0.70680%0.8SS**  cis-141.8173.421.6-156.8153.3-67.100113
352D32.3Very low30.8Very low131 Ų131145.7 Ų145.770%0.70180%0.8SS**  trans-65.8172.2164.5-34.1-93.3000111.2
353D29.6Very low31.2Very low157 Ų157144.9 Ų144.984%0.8480%0.796SS**  trans-172.5155.7145.8-85.9-27.9000109.1
354E33.6Very low31.8Very low180 Ų180147.9 Ų147.984%0.84180%0.795SS**  trans-116.2-158.4-170.2-59.2-171.5124.500112.6
355E31.6Very low32.2Very low176 Ų176148.1 Ų148.182%0.82279%0.791SS**  trans71.5154.1165.2-62.7166.6172.400116
356D29.9Very low32.5Very low155 Ų155150.8 Ų150.883%0.82980%0.795SS**  cis-127.5162.713-84-63.7000113.9
357E33.8Very low32.6Very low183 Ų183152.4 Ų152.486%0.85579%0.792SS**  trans-95.4168.8169.7-72.4-74.6-173.300112.6
358A32.5Very low32.8Very low98 Ų98149.5 Ų149.581%0.8178%0.78SS**  trans-155.9121.7160.700000113.1
359E30.5Very low33.1Very low180 Ų180152.2 Ų152.284%0.84178%0.781SS**  trans-79.5145.8-174-61.4164.1155.100113.7
360D32.9Very low33.5Very low144 Ų144151.6 Ų151.677%0.7778%0.777SS**  37162.9116.1-46.7-36.3000120.9
361D35.5Very low33.7Very low138 Ų138147.8 Ų147.874%0.73877%0.772SS**  cis-139.4161.215.6-75.5-58.9000112.8
362D40.3Very low34.3Very low143 Ų143148.9 Ų148.977%0.76578%0.782SS**  trans29.3164.2136.8-54.9-16.2000123
363D38.5Very low34.5Very low150 Ų150150.7 Ų150.780%0.80279%0.791SS**  cis-151.9174.221.2-102.5-30.9000107.7
364D38.8Very low35Very low135 Ų135147.6 Ų147.672%0.72278%0.781SS**  cis-168.8-170-26.3-170.719.1000108.4
365E36.6Very low35.7Very low166 Ų166145.2 Ų145.278%0.77678%0.779SS**  trans75.6103.7171.1-61.4-168.5-170.400117.6
366E37.7Very low36.4Very low184 Ų184140.4 Ų140.486%0.8677%0.77SS**  72.3135.285.7-59.7-111.2125.400112.9
367E33.4Very low37.1Very low164 Ų164140.2 Ų140.277%0.76676%0.764SS**  cis-135.5-177.318.3-145.8-159.8-139.200107.8
368T31Very low37.6Very low110 Ų110141.4 Ų141.468%0.67576%0.761SS**  cis-154.6167.311.1-280000112
369E32.6Very low38.2Very low174 Ų174145.7 Ų145.781%0.81376%0.761SS**  trans-63.6173.7165-68.8-164.511400116.5
370S33.1Very low38.8Very low87 Ų87139.4 Ų139.461%0.60874%0.744SS**  cis-168.4-176.5-29.569.50000110.4
371S35.9Very low39.4Very low97 Ų97138 Ų13868%0.67874%0.736SS**  trans56.198.3152.9-52.10000119.3
372L39.5Very low39.7Very low174 Ų174138.5 Ų138.591%0.91173%0.731SS**  53.8102.882.6-64176.9000116.3
373L38Very low39.6Very low170 Ų170133.4 Ų133.489%0.8971%0.713SS**  trans-135.4156154.2-104.7171.8000111
374S40.1Very low39.7Very low91 Ų91136.5 Ų136.564%0.63671%0.713SS**  trans-79.1152.2-158.9-171.30000115.1A376S374-A376 PolarHBondContact O-N 3.04Å; S374-A376 VanDerWaalsContact O-N 3.1Å
375T47Very low40.1Very low130 Ų130136.6 Ų136.680%0.79871%0.709SS**THydrogen-bonded Turntrans-75.16-174.8500000115.4
376A47.6Very low40.7Very low75 Ų75135.7 Ų135.762%0.6271%0.705SS**THydrogen-bonded Turntrans-73.6-45.9-174.300000114.3S374 R378S374-A376 PolarHBondContact O-N 3.04Å; S374-A376 VanDerWaalsContact O-N 3.1Å; A376-R378 VanDerWaalsContact C-N 3.28Å; A376-R378 PolarHBondContact O-N 2.97Å
377E44Very low41.2Very low152 Ų152131.7 Ų131.771%0.7169%0.693SS**G310 helixtrans-69.4-23.6-172.9-73.3178.4100.800113.7K379 G380E377-K379 PolarHBondContact O-N 2.98Å; E377-G380 PolarHBondContact O-N 2.82Å
378R45.2Very low42.1Very low207 Ų207127.7 Ų127.778%0.78168%0.68SS**G310 helixtrans-65.5-6.9-175.6-152.2171.9-132.2162.26.3114.4A376A376-R378 VanDerWaalsContact C-N 3.28Å; A376-R378 PolarHBondContact O-N 2.97Å
379K44.1Very low43Very low188 Ų188130.7 Ų130.782%0.81768%0.68SS**G310 helixtrans-93.3-21.8173.1-89.3-173172.9-1780115.1E377E377-K379 PolarHBondContact O-N 2.98Å
380G42.6Very low44.2Very low48 Ų48127.1 Ų127.150%0.49567%0.67SS.*THydrogen-bonded Turntrans-73.9-50177.100000111.8E377 K382 G383E377-G380 PolarHBondContact O-N 2.82Å; G380-K382 PolarHBondContact O-N 2.85Å; G380-G383 PolarHBondContact O-N 3.45Å; G380-G383 VanDerWaalsContact O-N 3.11Å
381I45.3Very low45.5Very low114 Ų114126.1 Ų126.159%0.58566%0.663SS**Hα-helixtrans-58.3-45.4-171.1-59.5171.1000112.1G383 W384 E385I381-G383 VanDerWaalsContact C-N 3.26Å; I381-G383 PolarHBondContact O-N 2.98Å; I381-W384 PolarHBondContact O-N 3.01Å; I381-W384 VanDerWaalsContact O-N 3.14Å; I381-E385 PolarHBondContact O-N 3.17Å
382K42.3Very low46.8Very low150 Ų150127.9 Ų127.965%0.65266%0.66SS**Hα-helixtrans-63.1-28-179.9-74.8-162.3168.4-160.70114.4G380 W384 E386G380-K382 PolarHBondContact O-N 2.85Å; K382-W384 VanDerWaalsContact C-N 3.3Å; K382-E386 PolarHBondContact O-N 2.79Å
383G37.7Very low47.9Very low36 Ų36122.1 Ų122.137%0.37164%0.637SS.*Hα-helixtrans-72.5-24.5178.100000113.1G380 I381 V387G380-G383 PolarHBondContact O-N 3.45Å; G380-G383 VanDerWaalsContact O-N 3.11Å; I381-G383 VanDerWaalsContact C-N 3.26Å; I381-G383 PolarHBondContact O-N 2.98Å; G383-V387 VanDerWaalsContact O-CG2 3.26Å; G383-V387 WeakPolarHBondContact O-CG2 3.31Å
384W41.8Very low49.2Very low214 Ų214116.9 Ų116.981%0.81162%0.619SS**Hα-helixtrans-84.5-39.9-179.8-77.635.2000111.8I381 K382 E386 V387 T388I381-W384 PolarHBondContact O-N 3.01Å; I381-W384 VanDerWaalsContact O-N 3.14Å; K382-W384 VanDerWaalsContact C-N 3.3Å; W384-E386 VanDerWaalsContact C-N 3.32Å; W384-E386 PolarHBondContact O-N 2.8Å; W384-V387 PolarHBondContact O-N 3.34Å; W384-T388 WeakPolarHBondContact O-CG2 3.48Å; W384-T388 PolarHBondContact O-N 2.83Å; W384-T388 PolarHBondContact O-OG1 3.48Å
385E45.8Very low50.6Low137 Ų137117.7 Ų117.764%0.6461%0.613SS**Hα-helixtrans-61-36.6174.1-80.7-177.9125.600113.2I381 T388 Y389I381-E385 PolarHBondContact O-N 3.17Å; E385-T388 PolarHBondContact O-OG1 2.82Å; E385-Y389 PolarHBondContact O-N 2.86Å
386E49.1Very low51.7Low148 Ų148115.9 Ų115.969%0.69260%0.598SS**Hα-helixtrans-74.2-36179.9-168.4165-159.800111.9K382 W384 V390K382-E386 PolarHBondContact O-N 2.79Å; W384-E386 VanDerWaalsContact C-N 3.32Å; W384-E386 PolarHBondContact O-N 2.8Å; E386-V390 WeakPolarHBondContact O-CG2 3.29Å; E386-V390 PolarHBondContact O-N 2.7Å
387V48.7Very low52.6Low100 Ų100114.5 Ų114.561%0.60659%0.586SS**Hα-helixtrans-71.2-42.8177.7169.90000112G383 W384 V390 S391G383-V387 VanDerWaalsContact O-CG2 3.26Å; G383-V387 WeakPolarHBondContact O-CG2 3.31Å; W384-V387 PolarHBondContact O-N 3.34Å; V387-V390 PolarHBondContact O-N 3.03Å; V387-S391 PolarHBondContact O-N 3.37Å; V387-S391 VanDerWaalsContact O-N 3.1Å; V387-S391 PolarHBondContact O-OG 3.47Å
388T52.5Low53.9Low79 Ų79111.9 Ų111.949%0.48557%0.574SS.*Hα-helixtrans-63.3-44179.450.90000111.8W384 E385 V390 S391 E392W384-T388 WeakPolarHBondContact O-CG2 3.48Å; W384-T388 PolarHBondContact O-N 2.83Å; W384-T388 PolarHBondContact O-OG1 3.48Å; E385-T388 PolarHBondContact O-OG1 2.82Å; T388-V390 VanDerWaalsContact C-N 3.32Å; T388-V390 PolarHBondContact O-N 3.43Å; T388-S391 WeakPolarHBondContact CA-OG 3.36Å; T388-S391 PolarHBondContact O-N 3.08Å; T388-S391 VanDerWaalsContact O-N 3.14Å; T388-S391 PolarHBondContact O-OG 3.13Å; T388-E392 PolarHBondContact O-N 2.99Å
389Y51Low54.9Low174 Ų174107.3 Ų107.368%0.68256%0.557SS**Hα-helixtrans-61.5-38.3178.9-165.3-99.8000112.8E385 A393E385-Y389 PolarHBondContact O-N 2.86Å; Y389-A393 WeakPolarHBondContact O-CB 3.27Å; Y389-A393 PolarHBondContact O-N 3.48Å; Y389-A393 VanDerWaalsContact O-N 3.09Å
390V56.7Low56.1Low98 Ų98102.2 Ų102.259%0.59454%0.538SS*.Hα-helixtrans-67.1-39.9175171.50000111.5E386 V387 T388 A394E386-V390 WeakPolarHBondContact O-CG2 3.29Å; E386-V390 PolarHBondContact O-N 2.7Å; V387-V390 PolarHBondContact O-N 3.03Å; T388-V390 VanDerWaalsContact C-N 3.32Å; T388-V390 PolarHBondContact O-N 3.43Å; V390-A394 WeakPolarHBondContact O-CB 3.4Å; V390-A394 PolarHBondContact O-N 2.98Å
391S60.8Low57.4Low66 Ų66106.9 Ų106.946%0.46255%0.547SS..Hα-helixtrans-66.3-43.117650.50000113.4V387 T388 A393 A394 E395V387-S391 PolarHBondContact O-N 3.37Å; V387-S391 VanDerWaalsContact O-N 3.1Å; V387-S391 PolarHBondContact O-OG 3.47Å; T388-S391 WeakPolarHBondContact CA-OG 3.36Å; T388-S391 PolarHBondContact O-N 3.08Å; T388-S391 VanDerWaalsContact O-N 3.14Å; T388-S391 PolarHBondContact O-OG 3.13Å; S391-A393 PolarHBondContact O-N 2.88Å; S391-A394 PolarHBondContact O-N 3.46Å; S391-E395 PolarHBondContact O-N 3.43Å
392E63.6Low58.6Low135 Ų135107.9 Ų107.963%0.63154%0.543SS*.Hα-helixtrans-65.1-38.6177.1-70.4-170.3162.600112.2T388 L396T388-E392 PolarHBondContact O-N 2.99Å; E392-L396 VanDerWaalsContact O-CB 3.28Å; E392-L396 WeakPolarHBondContact O-CB 3.43Å; E392-L396 PolarHBondContact O-N 2.83Å
393A62.5Low59.9Low52 Ų52108.4 Ų108.443%0.4354%0.541SS..Hα-helixtrans-65.7-39.8176.200000112.5Y389 S391 A397Y389-A393 WeakPolarHBondContact O-CB 3.27Å; Y389-A393 PolarHBondContact O-N 3.48Å; Y389-A393 VanDerWaalsContact O-N 3.09Å; S391-A393 PolarHBondContact O-N 2.88Å; A393-A397 PolarHBondContact O-N 3.21Å; A393-A397 VanDerWaalsContact O-N 3.11Å
394A64.3Low61.5Low61 Ų61111.1 Ų111.150%0.50455%0.547SS..Hα-helixtrans-68.1-44.4175.900000112.1V390 S391 L396 A397 E398V390-A394 WeakPolarHBondContact O-CB 3.4Å; V390-A394 PolarHBondContact O-N 2.98Å; S391-A394 PolarHBondContact O-N 3.46Å; A394-L396 VanDerWaalsContact C-N 3.31Å; A394-L396 PolarHBondContact O-N 2.86Å; A394-A397 WeakPolarHBondContact O-CB 3.25Å; A394-A397 PolarHBondContact O-N 3.49Å; A394-A397 VanDerWaalsContact O-N 3.14Å; A394-E398 PolarHBondContact O-N 3.32Å
395E69.9Low62.9Low107 Ų107106.4 Ų106.450%0.554%0.535SS..Hα-helixtrans-67.2-33.6178.6-148.5-149.4152.800111.7S391 R399S391-E395 PolarHBondContact O-N 3.43Å; E395-R399 VanDerWaalsContact O-CB 3.24Å; E395-R399 WeakPolarHBondContact O-CB 3.41Å; E395-R399 PolarHBondContact O-N 3.23Å; E395-R399 VanDerWaalsContact O-N 3.12Å; E395-R399 IonicContact OE1-CZ 2.74Å; E395-R399 IonicContact OE1-NH2 3.56Å; E395-R399 PolarHBondContact OE1-NH2 2.91Å; E395-R399 IonicContact OE2-NH2 2.75Å; E395-R399 PolarHBondContact OE2-NH2 2.03Å
396L70.1Confident64.4Low93 Ų93103.6 Ų103.649%0.48752%0.524SS..Hα-helixtrans-64.7-39171.4-174.866.1000111.9E392 A394 R399 I400E392-L396 VanDerWaalsContact O-CB 3.28Å; E392-L396 WeakPolarHBondContact O-CB 3.43Å; E392-L396 PolarHBondContact O-N 2.83Å; A394-L396 VanDerWaalsContact C-N 3.31Å; A394-L396 PolarHBondContact O-N 2.86Å; L396-R399 PolarHBondContact O-N 3.5Å; L396-I400 HydrophobicContact CG-CD1 4.13Å; L396-I400 VanDerWaalsContact O-CG1 3.31Å; L396-I400 WeakPolarHBondContact O-CG1 3.32Å; L396-I400 PolarHBondContact O-N 3.3Å; L396-I400 VanDerWaalsContact O-N 3.08Å
397A67.7Low65.5Low46 Ų46101.5 Ų101.538%0.3852%0.516SS..Hα-helixtrans-65.7-48.6177.900000112.1A393 A394 R399 I400 E401A393-A397 PolarHBondContact O-N 3.21Å; A393-A397 VanDerWaalsContact O-N 3.11Å; A394-A397 WeakPolarHBondContact O-CB 3.25Å; A394-A397 PolarHBondContact O-N 3.49Å; A394-A397 VanDerWaalsContact O-N 3.14Å; A397-R399 PolarHBondContact O-N 2.02Å; A397-I400 WeakPolarHBondContact O-CA 3.46Å; A397-I400 WeakPolarHBondContact O-CB 3.26Å; A397-I400 PolarHBondContact O-N 2.89Å; A397-E401 PolarHBondContact O-N 3.29Å
398E71.2Confident66.4Low97 Ų97103.1 Ų103.145%0.45352%0.517SS..Hα-helixtrans-58.2-38.1175.1-167.1-164.3142.900111.2A394 I400 E401 R402A394-E398 PolarHBondContact O-N 3.32Å; E398-I400 PolarHBondContact O-N 3.45Å; E398-E401 PolarHBondContact O-N 2.99Å; E398-R402 VanDerWaalsContact O-CB 3.29Å; E398-R402 WeakPolarHBondContact O-CB 3.49Å; E398-R402 PolarHBondContact O-N 2.84Å; E398-R402 IonicContact OE1-CZ 2.79Å; E398-R402 IonicContact OE1-NH1 3.12Å; E398-R402 PolarHBondContact OE1-NH1 3.28Å; E398-R402 IonicContact OE1-NH2 3.91Å; E398-R402 PolarHBondContact OE1-NH2 2.87Å
399R65.3Low67.3Low111 Ų111104.4 Ų104.442%0.41952%0.518SS..Hα-helixtrans-73.8-11.9178.1-151.5-176.1-61.9138-12.3113.5E395 L396 A397 R403E395-R399 VanDerWaalsContact O-CB 3.24Å; E395-R399 WeakPolarHBondContact O-CB 3.41Å; E395-R399 PolarHBondContact O-N 3.23Å; E395-R399 VanDerWaalsContact O-N 3.12Å; E395-R399 IonicContact OE1-CZ 2.74Å; E395-R399 IonicContact OE1-NH2 3.56Å; E395-R399 PolarHBondContact OE1-NH2 2.91Å; E395-R399 IonicContact OE2-NH2 2.75Å; E395-R399 PolarHBondContact OE2-NH2 2.03Å; L396-R399 PolarHBondContact O-N 3.5Å; A397-R399 PolarHBondContact O-N 2.02Å; R399-R403 WeakPolarHBondContact O-CD 3.01Å; R399-R403 WeakPolarHBondContact O-CG 3.43Å
400I69Low68.2Low81 Ų81101.4 Ų101.442%0.41551%0.513SS..Hα-helixtrans-91-50.1169.3-71163.8000110L396 A397 E398 R402 R403 D404L396-I400 HydrophobicContact CG-CD1 4.13Å; L396-I400 VanDerWaalsContact O-CG1 3.31Å; L396-I400 WeakPolarHBondContact O-CG1 3.32Å; L396-I400 PolarHBondContact O-N 3.3Å; L396-I400 VanDerWaalsContact O-N 3.08Å; A397-I400 WeakPolarHBondContact O-CA 3.46Å; A397-I400 WeakPolarHBondContact O-CB 3.26Å; A397-I400 PolarHBondContact O-N 2.89Å; E398-I400 PolarHBondContact O-N 3.45Å; I400-R402 VanDerWaalsContact C-N 3.31Å; I400-R402 PolarHBondContact O-N 2.94Å; I400-R403 WeakPolarHBondContact O-CA 3.42Å; I400-R403 WeakPolarHBondContact O-CB 3.02Å; I400-R403 PolarHBondContact O-N 3.3Å; I400-D404 PolarHBondContact O-N 2.89Å
401E69.9Low68.9Low146 Ų146104.2 Ų104.268%0.68251%0.512SS*.Hα-helixtrans-58.7-41.8178.6-68.3-173.915700112A397 E398 R403 D404 M405A397-E401 PolarHBondContact O-N 3.29Å; E398-E401 PolarHBondContact O-N 2.99Å; E401-R403 PolarHBondContact O-N 3.38Å; E401-D404 PolarHBondContact O-N 3.01Å; E401-M405 WeakPolarHBondContact O-CB 3.29Å; E401-M405 PolarHBondContact O-N 3.41Å
402R70.5Confident69.1Low135 Ų135106.3 Ų106.351%0.50952%0.516SS..Hα-helixtrans-63.4-25.5174.1-173.5175-75.9118.92112.9E398 I400 I406E398-R402 VanDerWaalsContact O-CB 3.29Å; E398-R402 WeakPolarHBondContact O-CB 3.49Å; E398-R402 PolarHBondContact O-N 2.84Å; E398-R402 IonicContact OE1-CZ 2.79Å; E398-R402 IonicContact OE1-NH1 3.12Å; E398-R402 PolarHBondContact OE1-NH1 3.28Å; E398-R402 IonicContact OE1-NH2 3.91Å; E398-R402 PolarHBondContact OE1-NH2 2.87Å; I400-R402 VanDerWaalsContact C-N 3.31Å; I400-R402 PolarHBondContact O-N 2.94Å; R402-I406 HydrophobicContact CG-CD1 4.33Å; R402-I406 VanDerWaalsContact O-CD1 3.28Å; R402-I406 WeakPolarHBondContact O-CD1 3.48Å; R402-I406 VanDerWaalsContact O-CG1 3.23Å; R402-I406 WeakPolarHBondContact O-CG1 3.46Å; R402-I406 PolarHBondContact O-N 3.23Å
403R70.6Confident69.2Low160 Ų160103.6 Ų103.660%0.60451%0.506SS*.Hα-helixtrans-78.5-46.2174.2-76.6173.7171.9167.5-2.1111.9R399 I400 E401 M405 I406 I407R399-R403 WeakPolarHBondContact O-CD 3.01Å; R399-R403 WeakPolarHBondContact O-CG 3.43Å; I400-R403 WeakPolarHBondContact O-CA 3.42Å; I400-R403 WeakPolarHBondContact O-CB 3.02Å; I400-R403 PolarHBondContact O-N 3.3Å; E401-R403 PolarHBondContact O-N 3.38Å; R403-M405 VanDerWaalsContact C-N 3.3Å; R403-M405 PolarHBondContact O-N 2.91Å; R403-I406 PolarHBondContact O-N 2.91Å; R403-I407 VanDerWaalsContact O-CG1 3.31Å; R403-I407 WeakPolarHBondContact O-CG1 3.02Å; R403-I407 PolarHBondContact O-N 3.42Å
404D70.8Confident69.1Low94 Ų94104.3 Ų104.350%0.50351%0.508SS..Hα-helixtrans-65.9-35.6-178.9-71.3-14.6000111.4I400 E401 I407 Q408I400-D404 PolarHBondContact O-N 2.89Å; E401-D404 PolarHBondContact O-N 3.01Å; D404-I407 PolarHBondContact O-N 3.4Å; D404-Q408 PolarHBondContact O-N 2.76Å
405M72Confident68.7Low115 Ų115108.9 Ų108.957%0.56751%0.513SS*.Hα-helixtrans-60.1-47.5170.6-174.517769.800112.3E401 R403 I407 Q408 E409E401-M405 WeakPolarHBondContact O-CB 3.29Å; E401-M405 PolarHBondContact O-N 3.41Å; R403-M405 VanDerWaalsContact C-N 3.3Å; R403-M405 PolarHBondContact O-N 2.91Å; M405-I407 VanDerWaalsContact C-N 3.31Å; M405-I407 PolarHBondContact O-N 3.4Å; M405-Q408 PolarHBondContact O-N 3.35Å; M405-E409 PolarHBondContact O-N 3.27Å
406I76.1Confident68Low78 Ų78110 Ų11040%0.452%0.522SS..Hα-helixtrans-63.5-37.4176.6-70.9168.4000111R402 R403 E409 I410R402-I406 HydrophobicContact CG-CD1 4.33Å; R402-I406 VanDerWaalsContact O-CD1 3.28Å; R402-I406 WeakPolarHBondContact O-CD1 3.48Å; R402-I406 VanDerWaalsContact O-CG1 3.23Å; R402-I406 WeakPolarHBondContact O-CG1 3.46Å; R402-I406 PolarHBondContact O-N 3.23Å; R403-I406 PolarHBondContact O-N 2.91Å; I406-E409 PolarHBondContact O-N 3.34Å; I406-I410 HydrophobicContact CG2-CD1 3.79Å; I406-I410 HydrophobicContact CG2-CG1 4.4Å; I406-I410 WeakPolarHBondContact O-CB 3.36Å; I406-I410 VanDerWaalsContact O-CG1 3.25Å; I406-I410 WeakPolarHBondContact O-CG1 3.28Å; I406-I410 PolarHBondContact O-N 2.81Å
407I72.2Confident67.3Low104 Ų104112.6 Ų112.653%0.53354%0.536SS..Hα-helixtrans-66.2-40.5176.6-69.6164.7000111R403 D404 M405 W411R403-I407 VanDerWaalsContact O-CG1 3.31Å; R403-I407 WeakPolarHBondContact O-CG1 3.02Å; R403-I407 PolarHBondContact O-N 3.42Å; D404-I407 PolarHBondContact O-N 3.4Å; M405-I407 VanDerWaalsContact C-N 3.31Å; M405-I407 PolarHBondContact O-N 3.4Å; I407-W411 WeakPolarHBondContact O-CB 3.28Å; I407-W411 PolarHBondContact O-N 3.37Å
408Q66.9Low66.6Low133 Ų133113.4 Ų113.462%0.62155%0.549SS*.Hα-helixtrans-65.7-39.9173.3-75-171.2-30.600112.5D404 M405 W411 M412D404-Q408 PolarHBondContact O-N 2.76Å; M405-Q408 PolarHBondContact O-N 3.35Å; Q408-W411 PolarHBondContact O-N 3.29Å; Q408-M412 WeakPolarHBondContact O-CG 3.39Å; Q408-M412 PolarHBondContact O-N 3.29Å
409E71.9Confident65.7Low107 Ų107113.6 Ų113.650%0.556%0.561SS.*Hα-helixtrans-65.3-43.4176.7-175.4171.6-15700111.9M405 I406 W411 N413M405-E409 PolarHBondContact O-N 3.27Å; I406-E409 PolarHBondContact O-N 3.34Å; E409-W411 VanDerWaalsContact C-N 3.32Å; E409-W411 PolarHBondContact O-N 3.05Å; E409-N413 WeakPolarHBondContact CG-ND2 3.44Å; E409-N413 WeakPolarHBondContact O-CB 3.49Å; E409-N413 PolarHBondContact O-N 3.27Å; E409-N413 PolarHBondContact O-ND2 2.72Å
410I70.8Confident64.9Low111 Ų111113.6 Ų113.657%0.56958%0.578SS**Hα-helixtrans-58.6-44.3171.1-70.4165.8000110.6I406 N413 S414I406-I410 HydrophobicContact CG2-CD1 3.79Å; I406-I410 HydrophobicContact CG2-CG1 4.4Å; I406-I410 WeakPolarHBondContact O-CB 3.36Å; I406-I410 VanDerWaalsContact O-CG1 3.25Å; I406-I410 WeakPolarHBondContact O-CG1 3.28Å; I406-I410 PolarHBondContact O-N 2.81Å; I410-N413 PolarHBondContact O-N 3.28Å; I410-S414 VanDerWaalsContact O-CB 3.32Å; I410-S414 WeakPolarHBondContact O-CB 3.5Å; I410-S414 PolarHBondContact O-N 2.95Å
411W71.2Confident63.7Low156 Ų156119.8 Ų119.859%0.59163%0.626SS**Hα-helixtrans-65.3-46.2-178.8-168.776.5000112.5I407 Q408 E409 S414 Y415I407-W411 WeakPolarHBondContact O-CB 3.28Å; I407-W411 PolarHBondContact O-N 3.37Å; Q408-W411 PolarHBondContact O-N 3.29Å; E409-W411 VanDerWaalsContact C-N 3.32Å; E409-W411 PolarHBondContact O-N 3.05Å; W411-S414 PolarHBondContact O-N 3.07Å; W411-S414 PolarHBondContact O-OG 3.24Å; W411-Y415 HydrophobicContact CD2-CD2 4.28Å; W411-Y415 HydrophobicContact CD2-CE2 4.44Å; W411-Y415 AromaticContact CE2-CD2 3.95Å; W411-Y415 AromaticContact CE2-CE2 3.66Å; W411-Y415 HydrophobicContact CH2-CD2 4.29Å; W411-Y415 AromaticContact CH2-CE2 3.93Å; W411-Y415 HydrophobicContact CH2-CE2 3.93Å; W411-Y415 AromaticContact CZ2-CD2 3.98Å; W411-Y415 HydrophobicContact CZ2-CD2 3.98Å; W411-Y415 AromaticContact CZ2-CE2 3.39Å; W411-Y415 HydrophobicContact CZ2-CE2 3.39Å; W411-Y415 PolarHBondContact O-N 3.18Å; W411-Y415 VanDerWaalsContact O-N 3.13Å
412M64.9Low63.4Low111 Ų111118.5 Ų118.555%0.54762%0.624SS.*Hα-helixtrans-63.2-44.5176.3-70.8-167.9-6300112Q408 S414 Y415 L416Q408-M412 WeakPolarHBondContact O-CG 3.39Å; Q408-M412 PolarHBondContact O-N 3.29Å; M412-S414 VanDerWaalsContact C-N 3.3Å; M412-S414 PolarHBondContact O-N 3.08Å; M412-Y415 WeakPolarHBondContact O-CB 3.36Å; M412-Y415 PolarHBondContact O-N 3.2Å; M412-L416 PolarHBondContact O-N 3.28Å; M412-L416 VanDerWaalsContact O-N 3.14Å
413N65.6Low63Low78 Ų78117.6 Ų117.642%0.41763%0.63SS.*Hα-helixtrans-67.2-31177.8-72.3-40.3000112.5E409 I410 Y415 L416 N417E409-N413 WeakPolarHBondContact CG-ND2 3.44Å; E409-N413 WeakPolarHBondContact O-CB 3.49Å; E409-N413 PolarHBondContact O-N 3.27Å; E409-N413 PolarHBondContact O-ND2 2.72Å; I410-N413 PolarHBondContact O-N 3.28Å; N413-Y415 VanDerWaalsContact C-N 3.33Å; N413-L416 PolarHBondContact O-N 3.1Å; N413-N417 PolarHBondContact O-N 3.41Å; N413-N417 VanDerWaalsContact O-N 3.15Å
414S60.9Low62.6Low66 Ų66115.3 Ų115.346%0.46263%0.631SS.*Hα-helixtrans-67-33.4172.978.50000112.7I410 W411 M412 G418I410-S414 VanDerWaalsContact O-CB 3.32Å; I410-S414 WeakPolarHBondContact O-CB 3.5Å; I410-S414 PolarHBondContact O-N 2.95Å; W411-S414 PolarHBondContact O-N 3.07Å; W411-S414 PolarHBondContact O-OG 3.24Å; M412-S414 VanDerWaalsContact C-N 3.3Å; M412-S414 PolarHBondContact O-N 3.08Å; S414-G418 PolarHBondContact O-N 3.33Å; S414-G418 VanDerWaalsContact O-N 3.11Å
415Y55.5Low62.1Low157 Ų157116.5 Ų116.562%0.61664%0.638SS**Hα-helixtrans-69.3-39.6174.3-106-90.5000112.4W411 M412 N413 G418W411-Y415 HydrophobicContact CD2-CD2 4.28Å; W411-Y415 HydrophobicContact CD2-CE2 4.44Å; W411-Y415 AromaticContact CE2-CD2 3.95Å; W411-Y415 AromaticContact CE2-CE2 3.66Å; W411-Y415 HydrophobicContact CH2-CD2 4.29Å; W411-Y415 AromaticContact CH2-CE2 3.93Å; W411-Y415 HydrophobicContact CH2-CE2 3.93Å; W411-Y415 AromaticContact CZ2-CD2 3.98Å; W411-Y415 HydrophobicContact CZ2-CD2 3.98Å; W411-Y415 AromaticContact CZ2-CE2 3.39Å; W411-Y415 HydrophobicContact CZ2-CE2 3.39Å; W411-Y415 PolarHBondContact O-N 3.18Å; W411-Y415 VanDerWaalsContact O-N 3.13Å; M412-Y415 WeakPolarHBondContact O-CB 3.36Å; M412-Y415 PolarHBondContact O-N 3.2Å; N413-Y415 VanDerWaalsContact C-N 3.33Å; Y415-G418 PolarHBondContact O-N 3.24Å
416L54.6Low61.5Low130 Ų130116.6 Ų116.668%0.68164%0.643SS**Hα-helixtrans-71.5-34.9-179.1-68.7171.1000113.1M412 N413M412-L416 PolarHBondContact O-N 3.28Å; M412-L416 VanDerWaalsContact O-N 3.14Å; N413-L416 PolarHBondContact O-N 3.1Å
417N54.9Low60.5Low149 Ų149119.2 Ų119.280%0.79766%0.659SS**Hα-helixtrans-85-9.4174.7-75-18.1000113.7N413N413-N417 PolarHBondContact O-N 3.41Å; N413-N417 VanDerWaalsContact O-N 3.15Å
418G54.1Low59.7Low62 Ų62120.3 Ų120.364%0.63967%0.668SS**SBendtrans-82.4-13.6-17700000115.4S414 Y415S414-G418 PolarHBondContact O-N 3.33Å; S414-G418 VanDerWaalsContact O-N 3.11Å; Y415-G418 PolarHBondContact O-N 3.24Å
419S52.1Low59.2Low101 Ų101119.3 Ų119.371%0.70667%0.672SS**  trans-107.559.1-17266.20000113.7
420S49.4Very low58.1Low112 Ų112120.3 Ų120.378%0.78369%0.686SS**  trans-152.767.7170-157.60000113.9
421C43.1Very low56.9Low211 Ų211121.2 Ų121.2100%1.42670%0.697SS**  trans-167.10147.7-116.30000110.4

Retrieved 421 of 421 residues in 78.3 ms (Link to these results)