A0A087XU92_POEFO Loading...

Complement C1q like 1

AlphaFold DB , UniProt , Accession A0A087XU92, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 268 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
1M64Low68.8Low201 Ų201110.4 Ų110.499%0.9961%0.608SS**  0-35.20-71.6-147.179.800113.9V3 L4 V5M1-V3 PolarHBondContact O-N 3.24Å; M1-L4 PolarHBondContact O-N 2.92Å; M1-V5 WeakPolarHBondContact O-CG2 3.22Å; M1-V5 PolarHBondContact O-N 2.97Å
2L64.4Low68.5Low141 Ų141108.8 Ų108.874%0.73860%0.603SS**Hα-helixtrans-62.8-37.7179.9-136.788000114.4V5 L6L2-V5 PolarHBondContact O-N 3.31Å; L2-L6 PolarHBondContact O-N 3.11Å
3V69.3Low67.6Low115 Ų115108.5 Ų108.570%0.69760%0.6SS**Hα-helixtrans-68.7-37.3-179-1780000111.6M1 V5 L6 V7M1-V3 PolarHBondContact O-N 3.24Å; V3-V5 VanDerWaalsContact C-N 3.3Å; V3-V5 PolarHBondContact O-N 3.39Å; V3-L6 PolarHBondContact O-N 2.86Å; V3-V7 VanDerWaalsContact O-CG2 3.31Å; V3-V7 WeakPolarHBondContact O-CG2 3.46Å; V3-V7 PolarHBondContact O-N 2.77Å
4L70.9Confident67Low131 Ų131108.5 Ų108.569%0.68660%0.603SS**Hα-helixtrans-68.6-32.5178-139.2101.9000111.8M1 V8M1-L4 PolarHBondContact O-N 2.92Å; L4-V8 WeakPolarHBondContact O-CG2 3.13Å; L4-V8 PolarHBondContact O-N 3.48Å
5V72.4Confident66.1Low79 Ų79107.8 Ų107.848%0.47961%0.609SS.*Hα-helixtrans-68.5-40.3176.8170.70000111M1 L2 V3 V8 L9M1-V5 WeakPolarHBondContact O-CG2 3.22Å; M1-V5 PolarHBondContact O-N 2.97Å; L2-V5 PolarHBondContact O-N 3.31Å; V3-V5 VanDerWaalsContact C-N 3.3Å; V3-V5 PolarHBondContact O-N 3.39Å; V5-V8 PolarHBondContact O-N 3.03Å; V5-L9 HydrophobicContact CG1-CD1 3.59Å; V5-L9 WeakPolarHBondContact O-CB 3.41Å; V5-L9 PolarHBondContact O-N 3.12Å
6L71.9Confident65Low97 Ų97106.2 Ų106.251%0.50861%0.607SS.*Hα-helixtrans-67.2-39.5176.6-94.5148.6000113.2L2 V3 V8 I10L2-L6 PolarHBondContact O-N 3.11Å; V3-L6 PolarHBondContact O-N 2.86Å; L6-V8 VanDerWaalsContact C-N 3.26Å; L6-V8 PolarHBondContact O-N 3.37Å; L6-I10 HydrophobicContact CD2-CD1 3.97Å; L6-I10 WeakPolarHBondContact O-CD1 3.15Å; L6-I10 VanDerWaalsContact O-CG1 3.29Å; L6-I10 WeakPolarHBondContact O-CG1 3.42Å; L6-I10 PolarHBondContact O-N 3.46Å
7V76Confident63.9Low98 Ų98107.6 Ų107.659%0.59462%0.618SS**Hα-helixtrans-69.3-24.4-179.3177.90000112.3V3 P11V3-V7 VanDerWaalsContact O-CG2 3.31Å; V3-V7 WeakPolarHBondContact O-CG2 3.46Å; V3-V7 PolarHBondContact O-N 2.77Å; V7-P11 WeakPolarHBondContact O-CD 3.5Å; V7-P11 VanDerWaalsContact O-CG 3.3Å; V7-P11 WeakPolarHBondContact O-CG 3.45Å
8V73Confident63.1Low91 Ų91105.6 Ų105.655%0.55262%0.624SS**Hα-helixtrans-93.3-33.6177.7179.90000112.5L4 V5 L6 P11 V12L4-V8 WeakPolarHBondContact O-CG2 3.13Å; L4-V8 PolarHBondContact O-N 3.48Å; V5-V8 PolarHBondContact O-N 3.03Å; L6-V8 VanDerWaalsContact C-N 3.26Å; L6-V8 PolarHBondContact O-N 3.37Å; V8-P11 WeakPolarHBondContact O-CD 3.31Å; V8-V12 VanDerWaalsContact O-CG2 3.26Å; V8-V12 WeakPolarHBondContact O-CG2 3.39Å
9L68.2Low62.2Low92 Ų92105.3 Ų105.348%0.48263%0.634SS.*Hα-helixtrans-72.6-36.6-179.2-92.5160.6000113.7V5 V12 L13V5-L9 HydrophobicContact CG1-CD1 3.59Å; V5-L9 WeakPolarHBondContact O-CB 3.41Å; V5-L9 PolarHBondContact O-N 3.12Å; L9-V12 PolarHBondContact O-N 3.36Å; L9-L13 PolarHBondContact O-N 3.02Å
10I66.1Low61.2Low99 Ų99104.3 Ų104.351%0.50865%0.646SS.*Hα-helixtrans-65.8-46-175.8-64168.2000111.9L6 V12 L13 V14L6-I10 HydrophobicContact CD2-CD1 3.97Å; L6-I10 WeakPolarHBondContact O-CD1 3.15Å; L6-I10 VanDerWaalsContact O-CG1 3.29Å; L6-I10 WeakPolarHBondContact O-CG1 3.42Å; L6-I10 PolarHBondContact O-N 3.46Å; I10-V12 VanDerWaalsContact C-N 3.32Å; I10-V12 PolarHBondContact O-N 3.31Å; I10-L13 PolarHBondContact O-N 2.71Å; I10-V14 VanDerWaalsContact O-CG2 3.3Å; I10-V14 WeakPolarHBondContact O-CG2 3.21Å; I10-V14 PolarHBondContact O-N 3.09Å; I10-V14 VanDerWaalsContact O-N 3.16Å
11P60.5Low60.1Low70 Ų70103 Ų10346%0.45565%0.653SS.*Hα-helixtrans-65.2-32.8176.1-20.431.8000113.7V7 V8 S15V7-P11 WeakPolarHBondContact O-CD 3.5Å; V7-P11 VanDerWaalsContact O-CG 3.3Å; V7-P11 WeakPolarHBondContact O-CG 3.45Å; V8-P11 WeakPolarHBondContact O-CD 3.31Å; P11-S15 WeakPolarHBondContact O-CB 3.47Å; P11-S15 PolarHBondContact O-N 3.36Å; P11-S15 VanDerWaalsContact O-N 3.09Å; P11-S15 PolarHBondContact O-OG 2.97Å
12V64.9Low59.2Low91 Ų91100 Ų10055%0.55265%0.647SS**Hα-helixtrans-71.7-40.1179.9173.50000111.2V8 L9 I10 S15 S16V8-V12 VanDerWaalsContact O-CG2 3.26Å; V8-V12 WeakPolarHBondContact O-CG2 3.39Å; L9-V12 PolarHBondContact O-N 3.36Å; I10-V12 VanDerWaalsContact C-N 3.32Å; I10-V12 PolarHBondContact O-N 3.31Å; V12-S15 PolarHBondContact O-N 3.01Å; V12-S16 PolarHBondContact O-N 3.11Å
13L57.2Low58.2Low106 Ų106100.3 Ų100.356%0.55565%0.649SS**Hα-helixtrans-64.9-41.9174.4-84.5157.2000112L9 I10 S15 S16L9-L13 PolarHBondContact O-N 3.02Å; I10-L13 PolarHBondContact O-N 2.71Å; L13-S15 VanDerWaalsContact C-N 3.29Å; L13-S15 PolarHBondContact O-N 3.46Å; L13-S16 PolarHBondContact O-N 3.34Å; L13-S16 PolarHBondContact O-OG 3.39Å
14V59Low57Low108 Ų108103.1 Ų103.166%0.65566%0.66SS**Hα-helixtrans-64.3-33.8176.9173.90000111.9I10 S16I10-V14 VanDerWaalsContact O-CG2 3.3Å; I10-V14 WeakPolarHBondContact O-CG2 3.21Å; I10-V14 PolarHBondContact O-N 3.09Å; I10-V14 VanDerWaalsContact O-N 3.16Å; V14-S16 VanDerWaalsContact C-N 3.31Å; V14-S16 PolarHBondContact O-N 2.91Å
15S53.3Low55.6Low98 Ų98101.3 Ų101.369%0.68566%0.659SS**Hα-helixtrans-76.9-15.8177.7-53.40000113.6P11 V12 L13P11-S15 WeakPolarHBondContact O-CB 3.47Å; P11-S15 PolarHBondContact O-N 3.36Å; P11-S15 VanDerWaalsContact O-N 3.09Å; P11-S15 PolarHBondContact O-OG 2.97Å; V12-S15 PolarHBondContact O-N 3.01Å; L13-S15 VanDerWaalsContact C-N 3.29Å; L13-S15 PolarHBondContact O-N 3.46Å
16S49.1Very low54.1Low82 Ų82102.4 Ų102.457%0.57368%0.676SS**Hα-helixtrans-92.6-9.5-177.369.60000114.7V12 L13 V14 G18V12-S16 PolarHBondContact O-N 3.11Å; L13-S16 PolarHBondContact O-N 3.34Å; L13-S16 PolarHBondContact O-OG 3.39Å; V14-S16 VanDerWaalsContact C-N 3.31Å; V14-S16 PolarHBondContact O-N 2.91Å; S16-G18 VanDerWaalsContact C-N 3.34Å
17V46.9Very low52.5Low131 Ų131101.8 Ų101.879%0.79468%0.68SS**SBendtrans-88.7-0.8178.51730000112.6
18G47.8Very low50.5Low71 Ų71103.8 Ų103.873%0.73268%0.682SS**SBendtrans-109.650.3-179.400000114.4S16S16-G18 VanDerWaalsContact C-N 3.34Å
19A47.8Very low48.9Very low99 Ų99108.6 Ų108.682%0.81869%0.692SS**SBendtrans-162.985.1167.700000111.6
20G41.9Very low47.6Very low85 Ų85110.8 Ų110.888%0.87670%0.7SS**  trans16790.6170.500000112.6
21G37.7Very low46.6Very low77 Ų77114.8 Ų114.879%0.79472%0.718SS**  trans169.567.9175.200000112.6D23G21-D23 PolarHBondContact O-N 2.94Å
22T46Very low46Very low138 Ų138119.3 Ų119.385%0.84774%0.738SS**  trans-71.2110.4154.443.30000107.5
23D41.4Very low45.1Very low148 Ų148118 Ų11879%0.79174%0.743SS**  trans-151.595.1158.1-99.9-22.1000108.7G21 S25G21-D23 PolarHBondContact O-N 2.94Å; D23-S25 VanDerWaalsContact C-N 3.29Å; D23-S25 PolarHBondContact O-N 3.11Å
24D45.4Very low44.7Very low174 Ų174119.7 Ų119.793%0.9376%0.758SS**  trans-67.393156.6-90.2-33.1000107.3
25S41.7Very low44Very low94 Ų94121.1 Ų121.166%0.65777%0.771SS**  trans-142.874.2165.4-71.40000107.6D23 S27D23-S25 VanDerWaalsContact C-N 3.29Å; D23-S25 PolarHBondContact O-N 3.11Å; S25-S27 PolarHBondContact O-N 3.15Å
26A40.6Very low43.5Very low101 Ų101127.1 Ų127.184%0.83578%0.779SS**  trans-53.7103.616300000107.9H28A26-H28 PolarHBondContact O-N 2.78Å
27S38.5Very low43.4Very low84 Ų84131.1 Ų131.159%0.58779%0.79SS**  trans-70.686.216926.90000107.2S25 Y29S25-S27 PolarHBondContact O-N 3.15Å; S27-Y29 WeakPolarHBondContact O-CD1 3.46Å; S27-Y29 WeakPolarHBondContact O-CE1 3.36Å; S27-Y29 PolarHBondContact O-N 3.17Å
28H32.6Very low43.3Very low140 Ų140130.4 Ų130.465%0.64879%0.786SS**  trans-75.698172.7-170.2-71.4000108.5A26 E30A26-H28 PolarHBondContact O-N 2.78Å; H28-E30 IonicContact CE1-OE1 3.39Å; H28-E30 PolarHBondContact CE1-OE1 3.19Å; H28-E30 PolarHBondContact O-N 2.74Å
29Y40.6Very low43.2Very low193 Ų193131.9 Ų131.976%0.75778%0.784SS**  trans-82.299.4167.46.3-90.4000108S27 M31S27-Y29 WeakPolarHBondContact O-CD1 3.46Å; S27-Y29 WeakPolarHBondContact O-CE1 3.36Å; S27-Y29 PolarHBondContact O-N 3.17Å; Y29-M31 PolarHBondContact O-N 3.29Å
30E41Very low43Very low138 Ų138133.4 Ų133.465%0.64578%0.778SS**  trans-85.7105.3174.4-149.1165.1-133.600108.5H28 L32H28-E30 IonicContact CE1-OE1 3.39Å; H28-E30 PolarHBondContact CE1-OE1 3.19Å; H28-E30 PolarHBondContact O-N 2.74Å; E30-L32 VanDerWaalsContact C-N 3.34Å; E30-L32 PolarHBondContact O-N 3.23Å
31M43.8Very low43.1Very low182 Ų182135 Ų13590%0.89777%0.773SS**  trans-71.288.4174.2-69.9-106.7-77.900109.2Y29 G33Y29-M31 PolarHBondContact O-N 3.29Å; M31-G33 PolarHBondContact O-N 2.67Å
32L48.6Very low43.1Very low166 Ų166140.9 Ų140.987%0.86978%0.777SS**  trans-76.177.4169.6-72.2170.2000109.9E30E30-L32 VanDerWaalsContact C-N 3.34Å; E30-L32 PolarHBondContact O-N 3.23Å
33G46.1Very low42.9Very low64 Ų64140 Ų14066%0.6677%0.774SS**  trans-157.4109.8172.600000110.8M31 C35M31-G33 PolarHBondContact O-N 2.67Å; G33-C35 PolarHBondContact O-N 3.28Å
34T49.7Very low42.9Very low140 Ų140138.5 Ų138.586%0.85978%0.775SS**  trans-80.5109.2169.446.60000108.2R36T34-R36 PolarHBondContact O-N 3.29Å
35C43Very low42.8Very low139 Ų139136.9 Ų136.994%0.93977%0.772SS**  trans-68102.1165.9-90.70000108.2G33G33-C35 PolarHBondContact O-N 3.28Å
36R43.9Very low42.4Very low224 Ų224136 Ų13685%0.84578%0.777SS**  trans-95.8113.4172.7-148.4179.6-171.3-174.22.6108.3T34 V38T34-R36 PolarHBondContact O-N 3.29Å; R36-V38 PolarHBondContact O-N 2.85Å; R36-V38 VanDerWaalsContact O-N 3.14Å
37M47.3Very low42.2Very low165 Ų165138 Ų13881%0.81378%0.779SS**  trans-63.6110.7167.9-72.7-74.3-76.400108.3C39M37-C39 PolarHBondContact O-N 3.2Å
38V44.7Very low42Very low116 Ų116139 Ų13970%0.70379%0.792SS**  trans-84.990.7165.2-177.70000106.1R36 D40R36-V38 PolarHBondContact O-N 2.85Å; R36-V38 VanDerWaalsContact O-N 3.14Å; V38-D40 PolarHBondContact O-N 3.43Å
39C45.3Very low42Very low102 Ų102135.4 Ų135.469%0.68979%0.793SS**  trans-79.1100.5162.4-64.70000106.9M37 P41M37-C39 PolarHBondContact O-N 3.2Å; C39-P41 WeakPolarHBondContact O-CD 3.4Å
40D43.8Very low41.8Very low132 Ų132133.1 Ų133.171%0.70680%0.8SS**  trans-64.3123163.4-77.2-28.3000108.1V38 F42V38-D40 PolarHBondContact O-N 3.43Å; D40-F42 PolarHBondContact O-N 2.92Å
41P42.7Very low41.3Very low118 Ų118129.9 Ų129.977%0.76680%0.803SS**  trans-72.5113.5171.127.5-28.8000108.4C39C39-P41 WeakPolarHBondContact O-CD 3.4Å
42F38.7Very low40.8Very low200 Ų200129 Ų12988%0.87780%0.801SS**  trans-55.4128.8168.1-85.9-88.3000109.7D40 S44D40-F42 PolarHBondContact O-N 2.92Å; F42-S44 PolarHBondContact O-N 3.4Å; F42-S44 VanDerWaalsContact O-N 3.15Å
43P40.7Very low40Very low119 Ų119129 Ų12977%0.77380%0.796SS**  trans-69.9113.1172.826.1-29.8000109.2T45P43-T45 PolarHBondContact O-N 2.86Å
44S41.7Very low39.3Very low117 Ų117132 Ų13282%0.81880%0.801SS**PPolyproline II helixtrans-65.9118.9167.547.90000109F42 G46F42-S44 PolarHBondContact O-N 3.4Å; F42-S44 VanDerWaalsContact O-N 3.15Å; S44-G46 PolarHBondContact O-N 2.84Å
45T42.8Very low38.3Very low141 Ų141132.2 Ų132.287%0.86580%0.797SS**PPolyproline II helixtrans-69.5117.2168.933.30000108.2P43P43-T45 PolarHBondContact O-N 2.86Å
46G33.9Very low37.7Very low74 Ų74132.4 Ų132.476%0.76379%0.794SS**PPolyproline II helixtrans-65.2138.4-178.500000112.6S44S44-G46 PolarHBondContact O-N 2.84Å
47T36.5Very low37.2Very low145 Ų145126.4 Ų126.489%0.8979%0.787SS**  trans-123.4119.3144.9-610000106.6
48A34.1Very low36.5Very low104 Ų104124.4 Ų124.486%0.8678%0.784SS**  trans-67.4146.5-175.900000112.2
49G32.4Very low36Very low65 Ų65124.4 Ų124.467%0.6779%0.789SS**  trans173.879.9169.400000114.4
50T36.4Very low35.4Very low145 Ų145123.1 Ų123.189%0.8979%0.793SS**  trans58.2103153.258.70000118.7
51G31Very low34.7Very low69 Ų69126.4 Ų126.471%0.71180%0.801SS**  trans-81.7149.816500000113.3
52I34.2Very low34.4Very low165 Ų165128.8 Ų128.885%0.84681%0.807SS**  trans-133.4108.2144-65.8-178000105.1
53H32Very low34.2Very low165 Ų165124.8 Ų124.876%0.76480%0.799SS**  trans-88.9130.2167.2-95.7-87.2000108.5
54T30.2Very low33.8Very low127 Ų127125.7 Ų125.778%0.77980%0.797SS**  trans-141.591149.550.60000107.4
55D30Very low33.5Very low145 Ų145128.2 Ų128.278%0.77580%0.801SS**PPolyproline II helixtrans-103.6117.9162.8-78.2-37.1000108.1
56T29.4Very low33.2Very low142 Ų142130.3 Ų130.387%0.87180%0.801SS**PPolyproline II helixtrans-89.6121.6170.2-64.20000108.4
57S33.7Very low33.3Very low99 Ų99135.3 Ų135.369%0.69281%0.805SS**PPolyproline II helixtrans-78.8132.5173.847.10000112.8
58T32.9Very low33.1Very low122 Ų122134.6 Ų134.675%0.74880%0.795SS**  46.5124.8128.2-14.50000121.8
59S33.9Very low33.5Very low116 Ų116136.4 Ų136.481%0.81179%0.79SS**  trans65.4134.8138.460.80000122.1
60G31.9Very low33.9Very low75 Ų75139 Ų13977%0.77380%0.797SS**  trans124.6104.8131.600000115.8
61F29.9Very low33.8Very low202 Ų202137.8 Ų137.889%0.88679%0.786SS**  trans-57.7137.8159.3-75.1-99.2000111
62L36.6Very low34.4Very low167 Ų167143.9 Ų143.987%0.87480%0.795SS**  172.5159.8116.2-84.8179.9000110.6
63V33.5Very low34.6Very low117 Ų117140 Ų14071%0.70978%0.783SS**  trans-96.9149.4-152.9178.80000111.9
64D32.5Very low34.9Very low138 Ų138140.5 Ų140.574%0.73879%0.789SS**  trans39.6123.4156.7-57.8-19.5000120.8
65N34.6Very low35.2Very low169 Ų169137.4 Ų137.490%0.90478%0.783SS**  -168131.5115.1-89.3-25.6000110.6
66E36.7Very low36.4Very low186 Ų186137 Ų13787%0.86979%0.788SS**  trans-74.1146.3169.2-68.5174.1119.800111
67E36.8Very low36.6Very low179 Ų179136.1 Ų136.184%0.83679%0.788SS**  157.6128.9121.6-84.4-170.5161.300112.6
68D33.3Very low36.7Very low129 Ų129139.4 Ų139.469%0.6980%0.797SS**  trans77.2109.8142.5-87.62.2000124.8
69L40.8Very low37.6Very low142 Ų142138.9 Ų138.974%0.74380%0.796SS**  81.6126.5119.3-66.2168.5000122
70S42Very low37.7Very low119 Ų119139.3 Ų139.383%0.83279%0.794SS**  trans113.998.313570.10000118.9
71D33Very low38.2Very low120 Ų120146.7 Ų146.764%0.64280%0.799SS**  trans-35.1146.5152-175.411.6000115.6S73D71-S73 PolarHBondContact OD1-OG 3.2Å; D71-S73 VanDerWaalsContact OD1-OG 3.08Å
72H43.9Very low38.7Very low197 Ų197142.5 Ų142.591%0.91280%0.795SS**  trans-160134.9133.3-101.328000112.4
73S38.6Very low39.1Very low85 Ų85140.6 Ų140.659%0.59479%0.791SS**  trans-104.3170.9-160.9-63.60000114.9D71D71-S73 PolarHBondContact OD1-OG 3.2Å; D71-S73 VanDerWaalsContact OD1-OG 3.08Å
74I38.1Very low40Very low174 Ų174142.8 Ų142.889%0.89280%0.798SS**  trans73.4134.8153.3-38.2-166.7000116.6
75G38.1Very low41.5Very low63 Ų63139.5 Ų139.565%0.64980%0.798SS**  cis153.7167.615.900000107.9
76P54.4Low42.9Very low135 Ų135137.9 Ų137.988%0.87780%0.796SS**  trans-100.4168.7-154.238.3-34.7000115.8
77S32.8Very low44.4Very low125 Ų125137.8 Ų137.887%0.87480%0.796SS**  trans-141.5150.1166.554.60000114.9
78L36.4Very low46Very low167 Ų167132.3 Ų132.387%0.87479%0.787SS**  trans-87.8175.1-162.9-112.288.7000115.2
79P52.4Low47.8Very low112 Ų112135.8 Ų135.873%0.72780%0.796SS**  trans-101.2166.3-165.440.3-34.7000115.4
80T35.3Very low49.5Very low125 Ų125135 Ų13577%0.76780%0.8SS**  trans-138.8114178-33.80000113.4
81Y41.8Very low50.9Low229 Ų229132.8 Ų132.890%0.89880%0.795SS**  trans65.1130144.6-79-101.9000125.4
82S41Very low53Low114 Ų114138.6 Ų138.680%0.79781%0.809SS**  trans-100.6151.3170.6-51.30000112.4
83T44Very low54.7Low127 Ų127135.1 Ų135.178%0.77980%0.803SS**  trans-129.4140.8159.5480000110.2
84N53.9Low56.4Low163 Ų163134.4 Ų134.487%0.87281%0.809SS**  trans98.2111.2178.1-57.1-24000116.9
85G63Low58.5Low70 Ų70135.8 Ų135.872%0.72281%0.809SS**PPolyproline II helixtrans-72.3150.3173.500000112.2
86P63.6Low60.6Low134 Ų134138.8 Ų138.887%0.8782%0.817SS**PPolyproline II helixtrans-71.1134.5-169.425.6-32.1000112.8
87Q70Confident61.7Low185 Ų185135.3 Ų135.386%0.86481%0.806SS**PPolyproline II helixtrans-59.4138.2172.5-177.6174.5-18.200111.1
88G69.1Low64.1Low64 Ų64135.2 Ų135.266%0.6680%0.802SS**PPolyproline II helixtrans-57.5141.9179.200000112.6
89K71.6Confident66.4Low202 Ų202133.3 Ų133.388%0.87880%0.8SS**PPolyproline II helixtrans-62.6135.9-173.3-65.4-175.9-179.1-178.60111.1
90P77.1Confident67.6Low125 Ų125130.9 Ų130.981%0.81280%0.795SS**PPolyproline II helixtrans-53.3143172.4-26.134.3000112.1
91G70Confident70Confident72 Ų72130.8 Ų130.874%0.74280%0.797SS**PPolyproline II helixtrans-59.2149.3176.700000111.9
92R78Confident72Confident243 Ų243125.9 Ų125.992%0.91779%0.793SS**PPolyproline II helixtrans-66136.1-177.7-67.8-175.9-177.2-172.20.9110.3
93P80.3Confident73.8Confident123 Ų123123.9 Ų123.980%0.79979%0.791SS**PPolyproline II helixtrans-53.4144.9172.2-2634.5000111.8
94G74.2Confident75.7Confident70 Ų70126.8 Ų126.872%0.72280%0.795SS**PPolyproline II helixtrans-59.7151.8174.400000111.4
95K82.1Confident77.2Confident203 Ų203125 Ų12588%0.88379%0.793SS**PPolyproline II helixtrans-64.3140.9177.8-65.9-177-179.2-179.40109.7
96P82.4Confident77.9Confident126 Ų126124.6 Ų124.682%0.81879%0.788SS**PPolyproline II helixtrans-53.7145.1171.8-25.334.4000111.4
97G76.4Confident79Confident63 Ų63123.9 Ų123.965%0.64978%0.784SS**PPolyproline II helixtrans-63.2158.9174.300000111.8
98P84.3Confident79.7Confident122 Ų122121.2 Ų121.279%0.79278%0.782SS**PPolyproline II helixtrans-62.3146.6176.626.6-33000110.8
99P83.7Confident80.2Confident127 Ų127121.2 Ų121.283%0.82578%0.782SS**PPolyproline II helixtrans-54.8143.2172-24.434000111.6
100G78.7Confident80.8Confident62 Ų62117.9 Ų117.964%0.63978%0.781SS**PPolyproline II helixtrans-63.2159.3173.800000112
101P85.1Confident81.1Confident123 Ų123123.6 Ų123.680%0.79979%0.787SS**PPolyproline II helixtrans-61.2147.5176.726.5-33.4000110.9
102P84.6Confident81Confident126 Ų126122.7 Ų122.782%0.81878%0.777SS**PPolyproline II helixtrans-54.7140.3173-24.434000111.5
103G78.5Confident80.7Confident72 Ų72116.9 Ų116.974%0.74277%0.771SS**PPolyproline II helixtrans-63.7152.717400000111.7
104E84Confident80.6Confident187 Ų187117.1 Ų117.187%0.87477%0.772SS**PPolyproline II helixtrans-62.5143.5178-65.3-173.5162.300111.2G106E104-G106 PolarHBondContact O-N 2.8Å
105P85.3Confident79.9Confident126 Ų126116.7 Ų116.782%0.81877%0.768SS**PPolyproline II helixtrans-55.3138.2173.7-24.534.1000111.6
106G78.1Confident79.2Confident61 Ų61114.4 Ų114.463%0.62977%0.766SS**PPolyproline II helixtrans-61.4154.8175.200000112.1E104E104-G106 PolarHBondContact O-N 2.8Å
107P84.8Confident77.9Confident120 Ų120113.8 Ų113.878%0.77976%0.764SS**PPolyproline II helixtrans-61.5150177.626.3-33.8000111G109P107-G109 PolarHBondContact O-N 3.29Å
108P86.4Confident76.4Confident128 Ų128121.1 Ų121.183%0.83177%0.772SS**PPolyproline II helixtrans-53140173-25.234000111.7
109G78.4Confident74.6Confident64 Ų64122 Ų12266%0.6677%0.77SS**PPolyproline II helixtrans-59.7154.7175.400000112P107P107-G109 PolarHBondContact O-N 3.29Å
110P84Confident72.9Confident132 Ų132124.1 Ų124.186%0.85777%0.773SS**PPolyproline II helixtrans-59.7145.3177.825.4-33.2000110.8G112P110-G112 PolarHBondContact O-N 2.92Å
111R83Confident70.9Confident246 Ų246126.8 Ų126.893%0.92878%0.776SS**PPolyproline II helixtrans-56.5132.8173.7-174177.2179.2174.9-0.1109
112G68.4Low69.3Low52 Ų52132 Ų13254%0.53678%0.78SS.*PPolyproline II helixtrans-55.9157.4175.600000112.2P110P110-G112 PolarHBondContact O-N 2.92Å
113P72.6Confident67Low121 Ų121132.2 Ų132.279%0.78678%0.779SS**PPolyproline II helixtrans-56.2144.3-178.922.5-31.8000111.1G115P113-G115 PolarHBondContact O-N 2.64Å
114P78.5Confident65.2Low128 Ų128132.1 Ų132.183%0.83178%0.779SS**PPolyproline II helixtrans-54.1133.5175.1-24.734.1000111.2
115G59.7Low63.5Low62 Ų62131 Ų13164%0.63978%0.777SS**PPolyproline II helixtrans-63.3136.1173.200000110.8P113 S117P113-G115 PolarHBondContact O-N 2.64Å; G115-S117 PolarHBondContact O-N 3.26Å; G115-S117 VanDerWaalsContact O-N 3.12Å; G115-S117 PolarHBondContact O-OG 3.32Å
116D67.3Low61.4Low155 Ų155133 Ų13383%0.82978%0.78SS**  trans-64.8112.5-175-147.1-2.6000110.1
117S55.2Low59.8Low113 Ų113134.5 Ų134.579%0.7980%0.795SS**  trans-120.487.1-174.9-51.70000109.4G115G115-S117 PolarHBondContact O-N 3.26Å; G115-S117 VanDerWaalsContact O-N 3.12Å; G115-S117 PolarHBondContact O-OG 3.32Å
118R44.8Very low57.7Low217 Ų217133.1 Ų133.182%0.81979%0.794SS**  trans-139125.9165.3-63.4-173.2178.4172.20.5105.7
119D44.7Very low55.7Low140 Ų140133.3 Ų133.375%0.74979%0.792SS**  cis-146.4136.118.1-78.4-49.6000109.6V121D119-V121 HydrophobicContact CB-CG2 4.4Å
120I48.6Very low53.8Low172 Ų172135.1 Ų135.188%0.88280%0.795SS**  trans-92.590160.9-60.6176.7000106.4
121V37.2Very low52Low117 Ų117134.9 Ų134.971%0.70979%0.791SS**  trans-103.3101.5161.3-178.50000108.3D119D119-V121 HydrophobicContact CB-CG2 4.4Å
122R51.1Low50.3Low234 Ų234127.2 Ų127.288%0.88377%0.772SS**  trans-80.7106.5170.1177.5-175.7174.3-162.9-1.3108.6
123T36.9Very low49.3Very low129 Ų129131.3 Ų131.379%0.79179%0.787SS**  trans-152.3125.5156.217.40000108
124G40.6Very low48.2Very low71 Ų71133.3 Ų133.373%0.73278%0.78SS**  trans-90-179.6-165.100000116.2
125I47.3Very low47Very low164 Ų164135 Ų13584%0.84178%0.782SS**  trans80.9119159.1-59.8176.2000115.7
126L42Very low47.3Very low167 Ų167137.3 Ų137.387%0.87478%0.784SS**SBendtrans85.9121.2174.5-56.3174.6000116.8A128L126-A128 PolarHBondContact O-N 2.89Å
127G44.9Very low48.1Very low92 Ų92134.9 Ų134.995%0.94878%0.775SS**  trans-60115.2-170.700000113.1
128A39.6Very low49.8Very low92 Ų92131.7 Ų131.776%0.7675%0.751SS**  trans-114.2128.3159.200000107.3L126 S130L126-A128 PolarHBondContact O-N 2.89Å; A128-S130 PolarHBondContact O-N 2.92Å
129V44.3Very low52.2Low131 Ų131130.8 Ų130.879%0.79475%0.748SS**  trans-46.4125.4175.7175.50000109.5T131V129-T131 PolarHBondContact O-N 3.15Å
130S40.3Very low54.7Low103 Ų103124.4 Ų124.472%0.7271%0.714SS**  trans-58.6100.6168.1-66.70000109.2A128 T132A128-S130 PolarHBondContact O-N 2.92Å; S130-T132 PolarHBondContact O-N 2.86Å
131T46Very low57.1Low126 Ų126117.5 Ų117.577%0.77368%0.683SS**  trans-75.378.2161.450.50000107.7V129 T133V129-T131 PolarHBondContact O-N 3.15Å; T131-T133 PolarHBondContact O-N 3.36Å; T131-T133 VanDerWaalsContact O-N 3.11Å
132T45.7Very low60Low85 Ų85112.3 Ų112.352%0.52165%0.651SS.*  trans-60.5106.1159.824.90000107.7S130 Y134S130-T132 PolarHBondContact O-N 2.86Å; T132-Y134 HydrophobicContact CG2-CE2 4.37Å; T132-Y134 WeakPolarHBondContact O-CD2 3.49Å; T132-Y134 PolarHBondContact O-N 2.98Å; T132-Y134 WeakPolarHBondContact OG1-CE2 3.49Å
133T48.6Very low62.3Low138 Ų138104.5 Ų104.585%0.84762%0.622SS**  trans-69.779.4167-45.30000107.9T131 N135T131-T133 PolarHBondContact O-N 3.36Å; T131-T133 VanDerWaalsContact O-N 3.11Å; T133-N135 PolarHBondContact O-N 2.94Å
134Y48.4Very low65.2Low163 Ų16398.4 Ų98.464%0.63958%0.584SS**  trans-61.7128.4163.8-65.4-76.6000106.6T132 T136T132-Y134 HydrophobicContact CG2-CE2 4.37Å; T132-Y134 WeakPolarHBondContact O-CD2 3.49Å; T132-Y134 PolarHBondContact O-N 2.98Å; T132-Y134 WeakPolarHBondContact OG1-CE2 3.49Å; Y134-T136 PolarHBondContact O-N 2.79Å
135N54.3Low68Low164 Ų16495 Ų9588%0.87755%0.549SS*.  trans-66.482.9166-126.5-4.3000106.7T133 T137T133-N135 PolarHBondContact O-N 2.94Å; N135-T137 VanDerWaalsContact C-N 3.28Å; N135-T137 PolarHBondContact O-N 2.81Å
136T65.9Low70.4Confident111 Ų11187.2 Ų87.268%0.68151%0.509SS*.  trans-84.572.6-173.455.80000109.3Y134 P138Y134-T136 PolarHBondContact O-N 2.79Å; T136-P138 VanDerWaalsContact O-CD 3.22Å; T136-P138 WeakPolarHBondContact O-CD 3.41Å
137T84.9Confident73.1Confident104 Ų10485.2 Ų85.264%0.63849%0.49SS*.  trans-57.4122.1163.5-49.40000107.4N135 R139N135-T137 VanDerWaalsContact C-N 3.28Å; N135-T137 PolarHBondContact O-N 2.81Å; T137-R139 PolarHBondContact O-N 3.22Å
138P88.9Confident75.4Confident46 Ų4685.9 Ų85.930%0.29947%0.472SS..  trans-54.7130.2177.5-32.242.1000111.1T136 I180 I264 A267T136-P138 VanDerWaalsContact O-CD 3.22Å; T136-P138 WeakPolarHBondContact O-CD 3.41Å; P138-I180 HydrophobicContact CB-CD1 3.83Å; P138-I180 HydrophobicContact CB-CG2 4.12Å; P138-I180 HydrophobicContact CG-CD1 4.43Å; P138-I180 HydrophobicContact CG-CG2 4.2Å; P138-I264 HydrophobicContact CB-CD1 4.25Å; P138-A267 HydrophobicContact CB-CB 4.01Å; P138-A267 HydrophobicContact CG-CB 3.6Å
139R95.1Very high78Confident197 Ų19784.4 Ų84.474%0.74345%0.454SS*.  trans-124.2110.5176.1-64.5-176.7-175.4-164.1-0.3108.2T137 I165T137-R139 PolarHBondContact O-N 3.22Å; R139-I165 HydrophobicContact CB-CG2 4.02Å
140V98.2Very high80.4Confident6 Ų679.4 Ų79.44%0.03642%0.423CS..  trans-134122.7176.1-177.50000107.7I165 N168 F176 I180 Y184 F263 I264V140-I165 WeakPolarHBondContact CA-O 3.5Å; V140-N168 HydrophobicContact CG1-CB 3.99Å; V140-F176 HydrophobicContact CG1-CE2 3.78Å; V140-F176 HydrophobicContact CG1-CZ 3.92Å; V140-I180 HydrophobicContact CG2-CD1 4.18Å; V140-Y184 HydrophobicContact CB-CE1 4.14Å; V140-Y184 HydrophobicContact CG1-CE1 3.97Å; V140-F263 VanDerWaalsContact O-CA 3.23Å; V140-F263 WeakPolarHBondContact O-CA 3.26Å; V140-F263 WeakPolarHBondContact O-CB 3.38Å; V140-I264 HydrophobicContact CB-CB 4.13Å; V140-I264 HydrophobicContact CB-CG2 3.94Å; V140-I264 HydrophobicContact CG2-CG2 4.4Å; V140-I264 PolarHBondContact O-N 3.33Å
141A98.6Very high82.5Confident28 Ų2880.1 Ų80.123%0.23141%0.414CS..EExtended strand (participates in β ladder)trans-158.4138.6175.600000110N164 I165 G262 F263A141-N164 CarbonylContact O-C 3.55Å; A141-I165 HydrophobicContact CB-CB 4.49Å; A141-I165 PolarHBondContact N-O 3.16Å; A141-I165 VanDerWaalsContact N-O 3.15Å; A141-I165 PolarHBondContact O-N 3.04Å; A141-G262 CarbonylContact C-O 3.55Å; A141-G262 WeakPolarHBondContact CA-O 3.49Å; A141-F263 HydrophobicContact CB-CB 3.82Å
142F98.9Very high83.6Confident7 Ų774.1 Ų74.13%0.03138%0.378CS..EExtended strand (participates in β ladder)trans-139.3155.417478.2-78.1000112T163 Y169 F176 F186 F260 S261 G262F142-T163 CarbonylContact C-O 3.54Å; F142-T163 WeakPolarHBondContact CA-O 3.35Å; F142-T163 WeakPolarHBondContact CB-O 3.24Å; F142-Y169 HydrophobicContact CB-CG 4.39Å; F142-Y169 AromaticContact CD2-CD1 4Å; F142-Y169 HydrophobicContact CD2-CD1 4Å; F142-Y169 AromaticContact CD2-CD2 3.58Å; F142-Y169 HydrophobicContact CD2-CD2 3.58Å; F142-Y169 HydrophobicContact CD2-CE2 4.24Å; F142-Y169 AromaticContact CD2-CG 3.45Å; F142-Y169 HydrophobicContact CD2-CG 3.45Å; F142-Y169 VanDerWaalsContact CD2-CG 3.45Å; F142-Y169 AromaticContact CE2-CD2 3.51Å; F142-Y169 HydrophobicContact CE2-CD2 3.51Å; F142-Y169 AromaticContact CE2-CE2 3.87Å; F142-Y169 HydrophobicContact CE2-CE2 3.87Å; F142-Y169 AromaticContact CE2-CG 3.9Å; F142-Y169 HydrophobicContact CE2-CG 3.9Å; F142-Y169 HydrophobicContact CG-CD2 4.29Å; F142-Y169 AromaticContact CG-CG 3.99Å; F142-Y169 HydrophobicContact CG-CG 3.99Å; F142-Y169 HydrophobicContact CZ-CD2 4.16Å; F142-F176 AromaticContact CD1-CD2 3.58Å; F142-F176 HydrophobicContact CD1-CD2 3.58Å; F142-F176 AromaticContact CD1-CE2 3.96Å; F142-F176 HydrophobicContact CD1-CE2 3.96Å; F142-F176 HydrophobicContact CE1-CB 4.35Å; F142-F176 AromaticContact CE1-CD2 3.5Å; F142-F176 HydrophobicContact CE1-CD2 3.5Å; F142-F176 HydrophobicContact CE1-CE2 4.09Å; F142-F176 HydrophobicContact CE1-CG 4.16Å; F142-F176 HydrophobicContact CG-CD2 4.48Å; F142-F176 HydrophobicContact CZ-CB 4.44Å; F142-F176 HydrophobicContact CZ-CD2 4.35Å; F142-F186 HydrophobicContact CE1-CD1 4.01Å; F142-F186 AromaticContact CE1-CE1 3.83Å; F142-F186 HydrophobicContact CE1-CE1 3.83Å; F142-F186 HydrophobicContact CZ-CD1 4.15Å; F142-F186 HydrophobicContact CZ-CE1 4.27Å; F142-F260 HydrophobicContact CE2-CB 4.48Å; F142-F260 AromaticContact CE2-CD1 3.57Å; F142-F260 HydrophobicContact CE2-CD1 3.57Å; F142-F260 HydrophobicContact CE2-CD2 4.43Å; F142-F260 AromaticContact CE2-CE1 3.82Å; F142-F260 HydrophobicContact CE2-CE1 3.82Å; F142-F260 AromaticContact CE2-CG 3.89Å; F142-F260 HydrophobicContact CE2-CG 3.89Å; F142-F260 HydrophobicContact CE2-CZ 4.35Å; F142-F260 AromaticContact CZ-CD1 3.8Å; F142-F260 HydrophobicContact CZ-CD1 3.8Å; F142-F260 HydrophobicContact CZ-CD2 4.24Å; F142-F260 AromaticContact CZ-CE1 3.58Å; F142-F260 HydrophobicContact CZ-CE1 3.58Å; F142-F260 HydrophobicContact CZ-CE2 4.04Å; F142-F260 HydrophobicContact CZ-CG 4.12Å; F142-F260 AromaticContact CZ-CZ 3.71Å; F142-F260 HydrophobicContact CZ-CZ 3.71Å; F142-S261 VanDerWaalsContact O-CA 3.26Å; F142-S261 WeakPolarHBondContact O-CA 3.39Å; F142-S261 VanDerWaalsContact O-CB 3.23Å; F142-S261 WeakPolarHBondContact O-CB 3.22Å; F142-G262 WeakPolarHBondContact CD1-O 3.12Å; F142-G262 PolarHBondContact N-O 2.96Å; F142-G262 PolarHBondContact O-N 3.01Å; F142-G262 VanDerWaalsContact O-N 3.15Å
143Y98.9Very high84.9Confident71 Ų7178 Ų7828%0.27838%0.384SS..EExtended strand (participates in β ladder)trans-149.2127.8170.9169.7-119000108.4V162 T163 K256 T259Y143-V162 HydrophobicContact CD1-CB 3.62Å; Y143-V162 HydrophobicContact CD1-CG1 3.95Å; Y143-V162 HydrophobicContact CD1-CG2 3.96Å; Y143-V162 HydrophobicContact CE1-CB 4.1Å; Y143-V162 HydrophobicContact CE1-CG1 4.37Å; Y143-V162 HydrophobicContact CE1-CG2 3.94Å; Y143-V162 PolarHBondContact O-N 2.71Å; Y143-T163 PolarHBondContact N-O 3.43Å; Y143-T163 PolarHBondContact O-N 2.84Å; Y143-T163 VanDerWaalsContact O-N 3.11Å; Y143-K256 HydrophobicContact CE1-CD 4.44Å; Y143-T259 HydrophobicContact CE2-CG2 3.68Å; Y143-T259 WeakPolarHBondContact OH-CG2 3.46Å
144A98.9Very high86.7Confident0 Ų076.9 Ų76.90%037%0.373CS..EExtended strand (participates in β ladder)trans-137.2143179.400000111.3F158 D160 V161 Y169 T259 F260A144-F158 HydrophobicContact CB-CB 3.62Å; A144-F158 WeakPolarHBondContact CB-O 3.39Å; A144-D160 WeakPolarHBondContact CA-O 3.46Å; A144-V161 HydrophobicContact CB-CG2 4.24Å; A144-Y169 HydrophobicContact CB-CD1 4.14Å; A144-Y169 HydrophobicContact CB-CE1 3.55Å; A144-T259 WeakPolarHBondContact O-CA 3.4Å; A144-F260 PolarHBondContact N-O 3.4Å; A144-F260 PolarHBondContact O-N 3.05Å
145G98.8Very high88.9Confident0 Ų071.4 Ų71.40%035%0.354CS..EExtended strand (participates in β ladder)trans-103.2176.7169.300000111.8F158 D159 D160 N255 S258G145-F158 CarbonylContact O-C 3.55Å; G145-F158 WeakPolarHBondContact O-CA 3.29Å; G145-F158 VanDerWaalsContact O-CB 3.31Å; G145-F158 WeakPolarHBondContact O-CB 3.39Å; G145-D159 PolarHBondContact O-N 3.16Å; G145-D160 PolarHBondContact N-O 2.74Å; G145-D160 WeakPolarHBondContact O-CB 3.37Å; G145-D160 PolarHBondContact O-N 3.46Å; G145-N255 CarbonylContact C-O 3.5Å; G145-N255 WeakPolarHBondContact CA-O 3.38Å; G145-S258 WeakPolarHBondContact CA-O 3.37Å
146L98.3Very high90.9Very high0 Ų063.7 Ų63.70%031%0.313CS..  trans-110.1124.2179.5-179.266.7000109.7N148 Q150 L156 R157 F158 A249 G251 N255 S258L146-N148 WeakPolarHBondContact CD1-O 3.38Å; L146-N148 WeakPolarHBondContact CG-O 3.26Å; L146-Q150 HydrophobicContact CD1-CG 4.18Å; L146-Q150 VanDerWaalsContact CD1-NE2 3.33Å; L146-L156 HydrophobicContact CD1-CD1 3.9Å; L146-L156 HydrophobicContact CD2-CD1 4.04Å; L146-R157 VanDerWaalsContact CD1-O 3.29Å; L146-R157 WeakPolarHBondContact CD1-O 3.33Å; L146-F158 HydrophobicContact CB-CD1 4.18Å; L146-A249 HydrophobicContact CD2-CB 3.81Å; L146-G251 WeakPolarHBondContact O-CA 3.07Å; L146-N255 PolarHBondContact N-O 3.32Å; L146-N255 WeakPolarHBondContact O-CA 3.37Å; L146-N255 WeakPolarHBondContact O-CB 3.35Å; L146-S258 PolarHBondContact N-O 3.38Å
147R97.3Very high92.4Very high125 Ų12564.3 Ų64.347%0.47230%0.303SS..SBendtrans-80.6-55.7179.3-62.2-177.8170-174.5-1.3112.5D159 D160R147-D159 VanDerWaalsContact CB-OD1 3.32Å; R147-D159 WeakPolarHBondContact CB-OD1 3.34Å; R147-D159 VanDerWaalsContact CG-OD1 3.29Å; R147-D159 WeakPolarHBondContact CG-OD1 3.23Å; R147-D159 PolarHBondContact N-OD1 3.03Å; R147-D160 HydrophobicContact CG-CB 3.72Å; R147-D160 IonicContact CZ-OD1 2.64Å; R147-D160 IonicContact NE-OD1 3.58Å; R147-D160 PolarHBondContact NE-OD1 3.35Å; R147-D160 VanDerWaalsContact NE-OD1 3.11Å; R147-D160 IonicContact NH2-OD1 2.74Å; R147-D160 PolarHBondContact NH2-OD1 2.87Å
148N94.6Very high93.1Very high106 Ų10659.4 Ų59.457%0.56727%0.272SS*.SBendtrans-110.4143.2-173.7-63.4-63.4000109.9L146 Q150L146-N148 WeakPolarHBondContact CD1-O 3.38Å; L146-N148 WeakPolarHBondContact CG-O 3.26Å; N148-Q150 PolarHBondContact O-N 3.41Å
149P94.1Very high93.5Very high61 Ų6159.5 Ų59.540%0.39627%0.271SS..  trans-56.5136172.8-26.636.2000112.2K248 A249P149-K248 HydrophobicContact CB-CD 4.23Å; P149-K248 HydrophobicContact CB-CG 4.31Å; P149-A249 WeakPolarHBondContact CA-O 3.23Å; P149-A249 WeakPolarHBondContact CB-O 3.32Å
150Q92.9Very high93.7Very high27 Ų2751.1 Ų51.113%0.12624%0.24CC..EExtended strand (participates in β ladder)trans-125.3137.8-178.8-69.7-17735.500110.6L146 N148 L156 R157 K248 A249L146-Q150 HydrophobicContact CD1-CG 4.18Å; L146-Q150 VanDerWaalsContact CD1-NE2 3.33Å; N148-Q150 PolarHBondContact O-N 3.41Å; Q150-L156 HydrophobicContact CB-CD1 3.73Å; Q150-L156 HydrophobicContact CG-CD1 4.31Å; Q150-R157 PolarHBondContact NE2-O 2.82Å; Q150-K248 WeakPolarHBondContact O-CG 3.48Å; Q150-A249 PolarHBondContact N-O 3.04Å; Q150-A249 PolarHBondContact O-N 2.6Å
151E85.5Confident93.7Very high117 Ų11753.5 Ų53.555%0.54726%0.255SS..EExtended strand (participates in β ladder)trans-72.9145.7-179.5-59.5-59.5156.400111.7Y153 K248E151-Y153 PolarHBondContact O-N 2.84Å; E151-Y153 VanDerWaalsContact O-N 3.14Å; E151-K248 WeakPolarHBondContact OE1-CD 3.31Å; E151-K248 WeakPolarHBondContact OE1-CE 3.21Å; E151-K248 IonicContact OE1-NZ 3.11Å; E151-K248 PolarHBondContact OE1-NZ 3.07Å
152G67.8Low93.7Very high0 Ų056 Ų560%027%0.267CS..THydrogen-bonded Turntrans-88.342.8-163.200000116.8L244 D245 G246 G247G152-L244 CarbonylContact C-O 3.52Å; G152-L244 CarbonylContact O-C 3.49Å; G152-D245 CarbonylContact O-C 3.18Å; G152-D245 WeakPolarHBondContact O-CA 3.34Å; G152-D245 PolarHBondContact O-N 2.81Å; G152-G246 PolarHBondContact O-N 3.13Å; G152-G247 WeakPolarHBondContact CA-O 3.08Å; G152-G247 PolarHBondContact N-O 3.24Å
153Y74.8Confident93.7Very high167 Ų16758.2 Ų58.266%0.65528%0.281SS*.THydrogen-bonded Turntrans-124.20.1177.9-61.4-69.3000114.4E151E151-Y153 PolarHBondContact O-N 2.84Å; E151-Y153 VanDerWaalsContact O-N 3.14Å
154D84.6Confident93.7Very high115 Ų11557.6 Ų57.662%0.61528%0.283SS*.SBendtrans-135.2-178.4-176.3-152.4-11.9000110.5L156 L244D154-L156 PolarHBondContact O-N 2.81Å; D154-L244 PolarHBondContact O-N 3.48Å
155I95.6Very high93.6Very high48 Ų4861.8 Ų61.825%0.24630%0.304CS..BIsolated β-bridgetrans-59.2126.9173.8-56.6-179.6000109.6R157 T173 F241I155-R157 PolarHBondContact O-N 3.31Å; I155-T173 WeakPolarHBondContact CG2-O 3.2Å; I155-F241 HydrophobicContact CB-CD2 4.35Å; I155-F241 HydrophobicContact CD1-CD1 4.45Å; I155-F241 HydrophobicContact CD1-CD2 3.95Å; I155-F241 HydrophobicContact CD1-CE1 4.4Å; I155-F241 HydrophobicContact CD1-CE2 3.89Å; I155-F241 HydrophobicContact CD1-CG 4.23Å; I155-F241 HydrophobicContact CD1-CZ 4.12Å; I155-F241 HydrophobicContact CG1-CD2 3.73Å; I155-F241 HydrophobicContact CG1-CE2 3.75Å; I155-F241 HydrophobicContact CG1-CG 4.42Å; I155-F241 HydrophobicContact CG1-CZ 4.45Å; I155-F241 HydrophobicContact CG2-CB 3.94Å; I155-F241 HydrophobicContact CG2-CD2 3.92Å; I155-F241 HydrophobicContact CG2-CG 4.12Å
156L96.9Very high93.5Very high1 Ų163.9 Ų63.91%0.00533%0.326CS..  trans-78.8114.8176.2-175.957.4000110.2L146 Q150 D154 F158 V190 I242 L244 A249L146-L156 HydrophobicContact CD1-CD1 3.9Å; L146-L156 HydrophobicContact CD2-CD1 4.04Å; Q150-L156 HydrophobicContact CB-CD1 3.73Å; Q150-L156 HydrophobicContact CG-CD1 4.31Å; D154-L156 PolarHBondContact O-N 2.81Å; L156-F158 HydrophobicContact CB-CE2 4.11Å; L156-F158 HydrophobicContact CD2-CE1 3.81Å; L156-F158 HydrophobicContact CD2-CE2 3.74Å; L156-F158 HydrophobicContact CD2-CZ 3.29Å; L156-F158 HydrophobicContact CG-CD2 4.28Å; L156-F158 HydrophobicContact CG-CE1 4.35Å; L156-F158 HydrophobicContact CG-CE2 3.79Å; L156-F158 HydrophobicContact CG-CZ 3.85Å; L156-F158 WeakPolarHBondContact O-CD2 3.41Å; L156-F158 PolarHBondContact O-N 3.23Å; L156-V190 HydrophobicContact CD2-CG1 3.9Å; L156-V190 HydrophobicContact CD2-CG2 4.06Å; L156-I242 HydrophobicContact CB-CB 4.42Å; L156-I242 PolarHBondContact N-O 3.16Å; L156-L244 HydrophobicContact CB-CD1 4.32Å; L156-L244 HydrophobicContact CB-CG 4.13Å; L156-L244 HydrophobicContact CD1-CD1 3.98Å; L156-L244 HydrophobicContact CD2-CD1 4.08Å; L156-L244 HydrophobicContact CD2-CD2 4.07Å; L156-L244 HydrophobicContact CD2-CG 4.22Å; L156-L244 HydrophobicContact CG-CD1 4.35Å; L156-A249 HydrophobicContact CD1-CB 3.86Å; L156-A249 HydrophobicContact CD2-CB 3.86Å
157R97.4Very high93.5Very high125 Ų12565.7 Ų65.747%0.47235%0.345SS..  trans-92.697.3-177.3-62.2173-74.3179.1-4.4110.5L146 Q150 I155 D159 S172L146-R157 VanDerWaalsContact CD1-O 3.29Å; L146-R157 WeakPolarHBondContact CD1-O 3.33Å; Q150-R157 PolarHBondContact NE2-O 2.82Å; I155-R157 PolarHBondContact O-N 3.31Å; R157-D159 VanDerWaalsContact C-N 3.34Å; R157-D159 PolarHBondContact O-N 2.82Å; R157-S172 WeakPolarHBondContact CD-O 3.5Å
158F98.3Very high93.5Very high0 Ų060.1 Ų60.10%032%0.324CS..  trans-75.289.4172.1-55.8-97.3000109A144 G145 L146 L156 Y169 V190 I242 T259 F260A144-F158 HydrophobicContact CB-CB 3.62Å; A144-F158 WeakPolarHBondContact CB-O 3.39Å; G145-F158 CarbonylContact O-C 3.55Å; G145-F158 WeakPolarHBondContact O-CA 3.29Å; G145-F158 VanDerWaalsContact O-CB 3.31Å; G145-F158 WeakPolarHBondContact O-CB 3.39Å; L146-F158 HydrophobicContact CB-CD1 4.18Å; L156-F158 HydrophobicContact CB-CE2 4.11Å; L156-F158 HydrophobicContact CD2-CE1 3.81Å; L156-F158 HydrophobicContact CD2-CE2 3.74Å; L156-F158 HydrophobicContact CD2-CZ 3.29Å; L156-F158 HydrophobicContact CG-CD2 4.28Å; L156-F158 HydrophobicContact CG-CE1 4.35Å; L156-F158 HydrophobicContact CG-CE2 3.79Å; L156-F158 HydrophobicContact CG-CZ 3.85Å; L156-F158 WeakPolarHBondContact O-CD2 3.41Å; L156-F158 PolarHBondContact O-N 3.23Å; F158-Y169 WeakPolarHBondContact CB-OH 3.43Å; F158-Y169 PolarHBondContact N-OH 2.88Å; F158-Y169 WeakPolarHBondContact O-CE1 3.47Å; F158-Y169 PolarHBondContact O-OH 2.88Å; F158-V190 HydrophobicContact CZ-CG2 4.18Å; F158-I242 HydrophobicContact CE2-CB 3.99Å; F158-I242 HydrophobicContact CE2-CG1 3.84Å; F158-I242 HydrophobicContact CZ-CB 4.5Å; F158-I242 HydrophobicContact CZ-CG1 4.29Å; F158-T259 VanDerWaalsContact CE1-C 3.48Å; F158-F260 HydrophobicContact CD1-CB 4.17Å; F158-F260 HydrophobicContact CD2-CB 3.59Å; F158-F260 HydrophobicContact CD2-CD1 4.21Å; F158-F260 HydrophobicContact CD2-CG 4.33Å; F158-F260 HydrophobicContact CE1-CB 4.1Å; F158-F260 HydrophobicContact CE2-CB 3.52Å; F158-F260 HydrophobicContact CE2-CD1 4.28Å; F158-F260 HydrophobicContact CE2-CG 4.17Å; F158-F260 HydrophobicContact CG-CB 3.91Å; F158-F260 HydrophobicContact CZ-CB 3.78Å
159D97.8Very high93.7Very high49 Ų4955.2 Ų55.226%0.26230%0.297SS..  trans-87.2-4.9-170.262.1-23.8000114.1G145 R147 R157 V161G145-D159 PolarHBondContact O-N 3.16Å; R147-D159 VanDerWaalsContact CB-OD1 3.32Å; R147-D159 WeakPolarHBondContact CB-OD1 3.34Å; R147-D159 VanDerWaalsContact CG-OD1 3.29Å; R147-D159 WeakPolarHBondContact CG-OD1 3.23Å; R147-D159 PolarHBondContact N-OD1 3.03Å; R157-D159 VanDerWaalsContact C-N 3.34Å; R157-D159 PolarHBondContact O-N 2.82Å; D159-V161 PolarHBondContact O-N 3.46Å
160D98.6Very high94Very high20 Ų2057 Ų5711%0.10730%0.301CS..EExtended strand (participates in β ladder)trans-95.471.3173.1-15738.3000112A144 G145 R147 V162 N255 K256A144-D160 WeakPolarHBondContact CA-O 3.46Å; G145-D160 PolarHBondContact N-O 2.74Å; G145-D160 WeakPolarHBondContact O-CB 3.37Å; G145-D160 PolarHBondContact O-N 3.46Å; R147-D160 HydrophobicContact CG-CB 3.72Å; R147-D160 IonicContact CZ-OD1 2.64Å; R147-D160 IonicContact NE-OD1 3.58Å; R147-D160 PolarHBondContact NE-OD1 3.35Å; R147-D160 VanDerWaalsContact NE-OD1 3.11Å; R147-D160 IonicContact NH2-OD1 2.74Å; R147-D160 PolarHBondContact NH2-OD1 2.87Å; D160-V162 PolarHBondContact O-N 3.04Å; D160-N255 HydrophobicContact CB-CB 4.06Å; D160-N255 WeakPolarHBondContact OD2-CB 2.94Å; D160-N255 PolarHBondContact OD2-ND2 3.3Å; D160-K256 IonicContact OD2-NZ 3.5Å; D160-K256 PolarHBondContact OD2-NZ 3.25Å
161V98.8Very high94.2Very high56 Ų5656.2 Ų56.234%0.33930%0.3SS..EExtended strand (participates in β ladder)trans-72.5118-177.5-174.70000110.8A144 D159 N164 Y169A144-V161 HydrophobicContact CB-CG2 4.24Å; D159-V161 PolarHBondContact O-N 3.46Å; V161-N164 HydrophobicContact CG1-CB 3.81Å; V161-Y169 HydrophobicContact CG2-CD1 3.96Å; V161-Y169 HydrophobicContact CG2-CE1 3.99Å
162V98.7Very high94.7Very high82 Ų8254.3 Ų54.350%0.49730%0.299SS..EExtended strand (participates in β ladder)trans-99.2-43.6179.3175.70000111Y143 D160Y143-V162 HydrophobicContact CD1-CB 3.62Å; Y143-V162 HydrophobicContact CD1-CG1 3.95Å; Y143-V162 HydrophobicContact CD1-CG2 3.96Å; Y143-V162 HydrophobicContact CE1-CB 4.1Å; Y143-V162 HydrophobicContact CE1-CG1 4.37Å; Y143-V162 HydrophobicContact CE1-CG2 3.94Å; Y143-V162 PolarHBondContact O-N 2.71Å; D160-V162 PolarHBondContact O-N 3.04Å
163T98.8Very high96.1Very high52 Ų5257.4 Ų57.432%0.31932%0.318SS..EExtended strand (participates in β ladder)trans-128.1136.4178.9-57.20000108.9F142 Y143 I165F142-T163 CarbonylContact C-O 3.54Å; F142-T163 WeakPolarHBondContact CA-O 3.35Å; F142-T163 WeakPolarHBondContact CB-O 3.24Å; Y143-T163 PolarHBondContact N-O 3.43Å; Y143-T163 PolarHBondContact O-N 2.84Å; Y143-T163 VanDerWaalsContact O-N 3.11Å; T163-I165 HydrophobicContact CG2-CD1 4.25Å; T163-I165 HydrophobicContact CG2-CG1 3.99Å
164N98.5Very high97.2Very high58 Ų5849.4 Ų49.431%0.3129%0.287SS..EExtended strand (participates in β ladder)trans-153.860.7175.6-163.17.3000112.1A141 V161 G166 G167 N168 Y169A141-N164 CarbonylContact O-C 3.55Å; V161-N164 HydrophobicContact CG1-CB 3.81Å; N164-G166 PolarHBondContact O-N 3.23Å; N164-G167 PolarHBondContact O-N 3.42Å; N164-G167 WeakPolarHBondContact OD1-CA 3.35Å; N164-N168 PolarHBondContact OD1-N 3.18Å; N164-Y169 PolarHBondContact ND2-O 2.92Å; N164-Y169 PolarHBondContact OD1-N 3.29Å
165I98.3Very high97.9Very high89 Ų8944.4 Ų44.446%0.45626%0.26SS..EExtended strand (participates in β ladder)trans-70.1126.7176.5-55.9176.8000108.4R139 V140 A141 T163 G167R139-I165 HydrophobicContact CB-CG2 4.02Å; V140-I165 WeakPolarHBondContact CA-O 3.5Å; A141-I165 HydrophobicContact CB-CB 4.49Å; A141-I165 PolarHBondContact N-O 3.16Å; A141-I165 VanDerWaalsContact N-O 3.15Å; A141-I165 PolarHBondContact O-N 3.04Å; T163-I165 HydrophobicContact CG2-CD1 4.25Å; T163-I165 HydrophobicContact CG2-CG1 3.99Å; I165-G167 VanDerWaalsContact C-N 3.28Å
166G96.1Very high98Very high44 Ų4442.1 Ų42.145%0.45425%0.249SC..THydrogen-bonded Turntrans89-14.3-172.800000114.1N164 N168 K179N164-G166 PolarHBondContact O-N 3.23Å; G166-N168 PolarHBondContact O-N 2.98Å; G166-N168 PolarHBondContact O-OD1 2.95Å; G166-N168 VanDerWaalsContact O-OD1 3.09Å; G166-K179 PolarHBondContact O-NZ 2.92Å
167G97.8Very high98.1Very high38 Ų3844.3 Ų44.339%0.39226%0.262SS..SBendtrans60.434.8179.200000112.4N164 I165 K179N164-G167 PolarHBondContact O-N 3.42Å; N164-G167 WeakPolarHBondContact OD1-CA 3.35Å; I165-G167 VanDerWaalsContact C-N 3.28Å; G167-K179 WeakPolarHBondContact O-CE 3.46Å; G167-K179 PolarHBondContact O-NZ 2.98Å
168N98.5Very high98.2Very high7 Ų738.4 Ų38.44%0.03724%0.24CC..  trans-85.8-22-176.6-72.571.6000112.4V140 N164 G166 F176 T177 K179V140-N168 HydrophobicContact CG1-CB 3.99Å; N164-N168 PolarHBondContact OD1-N 3.18Å; G166-N168 PolarHBondContact O-N 2.98Å; G166-N168 PolarHBondContact O-OD1 2.95Å; G166-N168 VanDerWaalsContact O-OD1 3.09Å; N168-F176 HydrophobicContact CB-CD2 3.73Å; N168-F176 HydrophobicContact CB-CE2 3.29Å; N168-F176 HydrophobicContact CB-CZ 3.8Å; N168-F176 CarbonylContact O-C 3.53Å; N168-F176 WeakPolarHBondContact O-CA 3.47Å; N168-T177 WeakPolarHBondContact CB-O 3.16Å; N168-T177 PolarHBondContact ND2-O 2.78Å; N168-T177 PolarHBondContact O-N 3.43Å; N168-K179 WeakPolarHBondContact ND2-CB 2.95Å; N168-K179 WeakPolarHBondContact ND2-CG 3.38Å; N168-K179 PolarHBondContact ND2-N 2.8Å; N168-K179 VanDerWaalsContact ND2-N 3.2Å
169Y98.9Very high98.1Very high3 Ų344 Ų441%0.01226%0.264CS..EExtended strand (participates in β ladder)trans-96.2133.7176.7-172.9-105.6000111.1F142 A144 F158 V161 N164 G174 F176 F260F142-Y169 HydrophobicContact CB-CG 4.39Å; F142-Y169 AromaticContact CD2-CD1 4Å; F142-Y169 HydrophobicContact CD2-CD1 4Å; F142-Y169 AromaticContact CD2-CD2 3.58Å; F142-Y169 HydrophobicContact CD2-CD2 3.58Å; F142-Y169 HydrophobicContact CD2-CE2 4.24Å; F142-Y169 AromaticContact CD2-CG 3.45Å; F142-Y169 HydrophobicContact CD2-CG 3.45Å; F142-Y169 VanDerWaalsContact CD2-CG 3.45Å; F142-Y169 AromaticContact CE2-CD2 3.51Å; F142-Y169 HydrophobicContact CE2-CD2 3.51Å; F142-Y169 AromaticContact CE2-CE2 3.87Å; F142-Y169 HydrophobicContact CE2-CE2 3.87Å; F142-Y169 AromaticContact CE2-CG 3.9Å; F142-Y169 HydrophobicContact CE2-CG 3.9Å; F142-Y169 HydrophobicContact CG-CD2 4.29Å; F142-Y169 AromaticContact CG-CG 3.99Å; F142-Y169 HydrophobicContact CG-CG 3.99Å; F142-Y169 HydrophobicContact CZ-CD2 4.16Å; A144-Y169 HydrophobicContact CB-CD1 4.14Å; A144-Y169 HydrophobicContact CB-CE1 3.55Å; F158-Y169 WeakPolarHBondContact CB-OH 3.43Å; F158-Y169 PolarHBondContact N-OH 2.88Å; F158-Y169 WeakPolarHBondContact O-CE1 3.47Å; F158-Y169 PolarHBondContact O-OH 2.88Å; V161-Y169 HydrophobicContact CG2-CD1 3.96Å; V161-Y169 HydrophobicContact CG2-CE1 3.99Å; N164-Y169 PolarHBondContact ND2-O 2.92Å; N164-Y169 PolarHBondContact OD1-N 3.29Å; Y169-G174 WeakPolarHBondContact CE2-O 3.26Å; Y169-G174 WeakPolarHBondContact OH-CA 3.4Å; Y169-F176 HydrophobicContact CD2-CB 4.2Å; Y169-F260 AromaticContact CE2-CD1 3.82Å; Y169-F260 HydrophobicContact CE2-CD1 3.82Å; Y169-F260 HydrophobicContact CE2-CE1 4.07Å
170E98.6Very high98.1Very high100 Ų10044.3 Ų44.347%0.46727%0.266SS..EExtended strand (participates in β ladder)trans-116107.3176.5179.754.2-113.400109.5S172 T173 G174 T175E170-S172 VanDerWaalsContact CD-OG 3.26Å; E170-S172 VanDerWaalsContact CG-OG 3.31Å; E170-S172 WeakPolarHBondContact CG-OG 3.43Å; E170-S172 PolarHBondContact O-N 2.84Å; E170-S172 WeakPolarHBondContact OE1-CB 3.3Å; E170-S172 PolarHBondContact OE1-N 3.12Å; E170-S172 PolarHBondContact OE1-OG 2.87Å; E170-T173 WeakPolarHBondContact CB-OG1 3.35Å; E170-T173 HydrophobicContact CG-CG2 4.03Å; E170-T173 PolarHBondContact O-N 2.82Å; E170-T173 PolarHBondContact O-OG1 2.85Å; E170-G174 PolarHBondContact O-N 3.38Å; E170-T175 PolarHBondContact N-O 2.8Å; E170-T175 PolarHBondContact O-N 3.35Å
171G97.6Very high98.1Very high10 Ų1045.7 Ų45.710%0.10328%0.275CS..THydrogen-bonded Turntrans-67-24.5-175.500000113.5T173G171-T173 VanDerWaalsContact C-N 3.33Å
172S96.6Very high98.1Very high77 Ų7743 Ų4354%0.53826%0.259SS..THydrogen-bonded Turntrans-71.3-27.6177.161.60000113.2R157 E170R157-S172 WeakPolarHBondContact CD-O 3.5Å; E170-S172 VanDerWaalsContact CD-OG 3.26Å; E170-S172 VanDerWaalsContact CG-OG 3.31Å; E170-S172 WeakPolarHBondContact CG-OG 3.43Å; E170-S172 PolarHBondContact O-N 2.84Å; E170-S172 WeakPolarHBondContact OE1-CB 3.3Å; E170-S172 PolarHBondContact OE1-N 3.12Å; E170-S172 PolarHBondContact OE1-OG 2.87Å
173T97.1Very high98.1Very high64 Ų6440.9 Ų40.939%0.39325%0.247SC..THydrogen-bonded Turntrans-105-21.3178.961.80000113.1I155 E170 G171 T175I155-T173 WeakPolarHBondContact CG2-O 3.2Å; E170-T173 WeakPolarHBondContact CB-OG1 3.35Å; E170-T173 HydrophobicContact CG-CG2 4.03Å; E170-T173 PolarHBondContact O-N 2.82Å; E170-T173 PolarHBondContact O-OG1 2.85Å; G171-T173 VanDerWaalsContact C-N 3.33Å; T173-T175 VanDerWaalsContact C-N 3.26Å; T173-T175 WeakPolarHBondContact OG1-CB 3.15Å; T173-T175 PolarHBondContact OG1-N 3.05Å
174G97.8Very high98.1Very high0 Ų038.4 Ų38.40%023%0.231CC..THydrogen-bonded Turntrans81.46.7-173.900000113.5Y169 E170Y169-G174 WeakPolarHBondContact CE2-O 3.26Å; Y169-G174 WeakPolarHBondContact OH-CA 3.4Å; E170-G174 PolarHBondContact O-N 3.38Å
175T98.6Very high98.1Very high9 Ų938 Ų386%0.05523%0.227CC..EExtended strand (participates in β ladder)trans-106.9134-167-550000111.8E170 T173 E239 F241E170-T175 PolarHBondContact N-O 2.8Å; E170-T175 PolarHBondContact O-N 3.35Å; T173-T175 VanDerWaalsContact C-N 3.26Å; T173-T175 WeakPolarHBondContact OG1-CB 3.15Å; T173-T175 PolarHBondContact OG1-N 3.05Å; T175-E239 HydrophobicContact CG2-CB 3.78Å; T175-E239 HydrophobicContact CG2-CG 3.96Å; T175-F241 HydrophobicContact CG2-CD1 4.28Å
176F98.9Very high98.2Very high0 Ų033.7 Ų33.70%021%0.205CC..EExtended strand (participates in β ladder)trans-89.9123.3161.5176.1-86.4000109.2V140 F142 N168 Y169 C178 Y184 F186 L234 E239 V240V140-F176 HydrophobicContact CG1-CE2 3.78Å; V140-F176 HydrophobicContact CG1-CZ 3.92Å; F142-F176 AromaticContact CD1-CD2 3.58Å; F142-F176 HydrophobicContact CD1-CD2 3.58Å; F142-F176 AromaticContact CD1-CE2 3.96Å; F142-F176 HydrophobicContact CD1-CE2 3.96Å; F142-F176 HydrophobicContact CE1-CB 4.35Å; F142-F176 AromaticContact CE1-CD2 3.5Å; F142-F176 HydrophobicContact CE1-CD2 3.5Å; F142-F176 HydrophobicContact CE1-CE2 4.09Å; F142-F176 HydrophobicContact CE1-CG 4.16Å; F142-F176 HydrophobicContact CG-CD2 4.48Å; F142-F176 HydrophobicContact CZ-CB 4.44Å; F142-F176 HydrophobicContact CZ-CD2 4.35Å; N168-F176 HydrophobicContact CB-CD2 3.73Å; N168-F176 HydrophobicContact CB-CE2 3.29Å; N168-F176 HydrophobicContact CB-CZ 3.8Å; N168-F176 CarbonylContact O-C 3.53Å; N168-F176 WeakPolarHBondContact O-CA 3.47Å; Y169-F176 HydrophobicContact CD2-CB 4.2Å; F176-C178 HydrophobicContact CE1-CB 4.22Å; F176-Y184 HydrophobicContact CE1-CD1 4.38Å; F176-Y184 HydrophobicContact CE1-CE1 4.26Å; F176-Y184 AromaticContact CZ-CD1 3.91Å; F176-Y184 HydrophobicContact CZ-CD1 3.91Å; F176-Y184 AromaticContact CZ-CE1 3.61Å; F176-Y184 HydrophobicContact CZ-CE1 3.61Å; F176-F186 HydrophobicContact CB-CE1 4.43Å; F176-F186 AromaticContact CD1-CE1 3.96Å; F176-F186 HydrophobicContact CD1-CE1 3.96Å; F176-F186 AromaticContact CD1-CZ 3.87Å; F176-F186 HydrophobicContact CD1-CZ 3.87Å; F176-F186 HydrophobicContact CD2-CE1 4.32Å; F176-F186 HydrophobicContact CE1-CE1 4.3Å; F176-F186 AromaticContact CE1-CZ 3.93Å; F176-F186 HydrophobicContact CE1-CZ 3.93Å; F176-F186 AromaticContact CG-CE1 3.98Å; F176-F186 HydrophobicContact CG-CE1 3.98Å; F176-F186 HydrophobicContact CG-CZ 4.36Å; F176-F186 HydrophobicContact CZ-CZ 4.45Å; F176-L234 HydrophobicContact CD1-CD1 4.26Å; F176-L234 HydrophobicContact CE1-CD1 3.77Å; F176-E239 CarbonylContact O-C 3.14Å; F176-E239 WeakPolarHBondContact O-CA 3.06Å; F176-V240 HydrophobicContact CB-CB 4.36Å; F176-V240 WeakPolarHBondContact CB-O 3.17Å; F176-V240 HydrophobicContact CD1-CB 4.38Å; F176-V240 PolarHBondContact N-O 2.89Å; F176-V240 PolarHBondContact O-N 3.14Å
177T98.8Very high98.3Very high47 Ų4734 Ų3429%0.28820%0.196SC..EExtended strand (participates in β ladder)trans-108.2121.2173-51.20000109.6N168 K179 D238N168-T177 WeakPolarHBondContact CB-O 3.16Å; N168-T177 PolarHBondContact ND2-O 2.78Å; N168-T177 PolarHBondContact O-N 3.43Å; T177-K179 PolarHBondContact O-N 3.44Å; T177-D238 WeakPolarHBondContact CA-O 3.35Å
178C98.6Very high98.3Very high2 Ų232.2 Ų32.21%0.01418%0.177CC..  trans-65.2128.4176.6-175.30000110.3F176 I180 L234 D235 G237 D238F176-C178 HydrophobicContact CE1-CB 4.22Å; C178-I180 PolarHBondContact SG-O 2.69Å; C178-L234 HydrophobicContact CB-CB 3.98Å; C178-L234 HydrophobicContact CB-CD1 4.15Å; C178-D235 WeakPolarHBondContact CB-O 3.42Å; C178-D235 PolarHBondContact SG-O 2.97Å; C178-G237 PolarHBondContact O-N 2.68Å; C178-D238 HydrophobicContact CB-CB 4.16Å; C178-D238 WeakPolarHBondContact CB-O 3.07Å; C178-D238 PolarHBondContact N-O 3.43Å
179K98.1Very high98.3Very high117 Ų11734.4 Ų34.451%0.50919%0.189SC..  trans-112.1-19.8174.7-64.4175.5-170.4171.60112.6G166 G167 N168 T177G166-K179 PolarHBondContact O-NZ 2.92Å; G167-K179 WeakPolarHBondContact O-CE 3.46Å; G167-K179 PolarHBondContact O-NZ 2.98Å; N168-K179 WeakPolarHBondContact ND2-CB 2.95Å; N168-K179 WeakPolarHBondContact ND2-CG 3.38Å; N168-K179 PolarHBondContact ND2-N 2.8Å; N168-K179 VanDerWaalsContact ND2-N 3.2Å; T177-K179 PolarHBondContact O-N 3.44Å
180I97.4Very high98.3Very high56 Ų5634.2 Ų34.229%0.28719%0.188SC..SBendtrans-129.9113.8-175.8-57.4179.2000106.4P138 V140 C178 Y184 I264 A267P138-I180 HydrophobicContact CB-CD1 3.83Å; P138-I180 HydrophobicContact CB-CG2 4.12Å; P138-I180 HydrophobicContact CG-CD1 4.43Å; P138-I180 HydrophobicContact CG-CG2 4.2Å; V140-I180 HydrophobicContact CG2-CD1 4.18Å; C178-I180 PolarHBondContact SG-O 2.69Å; I180-Y184 WeakPolarHBondContact O-CE2 3.29Å; I180-Y184 PolarHBondContact O-OH 3.48Å; I180-I264 HydrophobicContact CG2-CD1 4.35Å; I180-A267 HydrophobicContact CG2-CB 4.04Å
181P98.3Very high98.1Very high48 Ų4830.5 Ų30.531%0.31217%0.171SC..  trans-55.6140.5176.5-23.533.8000111.4L234 A236 D268P181-L234 VanDerWaalsContact CA-O 3.26Å; P181-L234 WeakPolarHBondContact CA-O 3.4Å; P181-A236 HydrophobicContact CG-CB 4.08Å; P181-D268 HydrophobicContact CB-CB 4.37Å; P181-D268 WeakPolarHBondContact CB-OD2 3.45Å; P181-D268 PolarHBondContact O-N 3.46Å; P181-D268 VanDerWaalsContact O-N 3.13Å
182G98.3Very high97.9Very high0 Ų030 Ų300%017%0.166CC..EExtended strand (participates in β ladder)trans165-176.2-177.100000114.7Y184 H233 L234 Y266 D268G182-Y184 WeakPolarHBondContact O-CD2 3.39Å; G182-H233 CarbonylContact O-C 3.12Å; G182-H233 WeakPolarHBondContact O-CA 3.34Å; G182-L234 PolarHBondContact N-O 3.22Å; G182-L234 PolarHBondContact O-N 3.38Å; G182-Y266 CarbonylContact C-O 3.46Å; G182-Y266 VanDerWaalsContact CA-O 3.24Å; G182-Y266 WeakPolarHBondContact CA-O 3.09Å; G182-D268 WeakPolarHBondContact CA-OD1 3.47Å; G182-D268 PolarHBondContact N-OD2 3.17Å
183T98.7Very high97.6Very high38 Ų3831 Ų3123%0.23316%0.158CC..EExtended strand (participates in β ladder)trans-95.3127.1174.6-57.20000110.2I231 L232 L265 Y266T183-I231 HydrophobicContact CG2-CG2 3.42Å; T183-I231 VanDerWaalsContact CG2-CG2 3.42Å; T183-L232 WeakPolarHBondContact CA-O 3.14Å; T183-L265 HydrophobicContact CG2-CD1 4.11Å; T183-L265 WeakPolarHBondContact O-CB 3.34Å; T183-L265 PolarHBondContact O-N 2.87Å; T183-Y266 PolarHBondContact N-O 3.07Å; T183-Y266 PolarHBondContact O-N 2.91Å
184Y98.9Very high96.9Very high0 Ų028.4 Ų28.40%014%0.144CC..EExtended strand (participates in β ladder)trans-122.9145.1-175.9-70.7-99.3000111.3V140 F176 I180 G182 F186 I231 L232 L234 F263 I264V140-Y184 HydrophobicContact CB-CE1 4.14Å; V140-Y184 HydrophobicContact CG1-CE1 3.97Å; F176-Y184 HydrophobicContact CE1-CD1 4.38Å; F176-Y184 HydrophobicContact CE1-CE1 4.26Å; F176-Y184 AromaticContact CZ-CD1 3.91Å; F176-Y184 HydrophobicContact CZ-CD1 3.91Å; F176-Y184 AromaticContact CZ-CE1 3.61Å; F176-Y184 HydrophobicContact CZ-CE1 3.61Å; I180-Y184 WeakPolarHBondContact O-CE2 3.29Å; I180-Y184 PolarHBondContact O-OH 3.48Å; G182-Y184 WeakPolarHBondContact O-CD2 3.39Å; Y184-F186 VanDerWaalsContact CB-CE2 3.44Å; Y184-F186 HydrophobicContact CD1-CZ 4.42Å; Y184-F186 HydrophobicContact CG-CE2 4.34Å; Y184-F186 HydrophobicContact CG-CZ 4.29Å; Y184-I231 CarbonylContact O-C 3.56Å; Y184-I231 VanDerWaalsContact O-CA 3.27Å; Y184-I231 WeakPolarHBondContact O-CA 3.43Å; Y184-L232 PolarHBondContact N-O 3.24Å; Y184-L232 PolarHBondContact O-N 3.18Å; Y184-L234 HydrophobicContact CD2-CB 3.95Å; Y184-L234 HydrophobicContact CD2-CD1 3.73Å; Y184-L234 HydrophobicContact CD2-CG 3.88Å; Y184-L234 HydrophobicContact CE2-CB 4.12Å; Y184-L234 HydrophobicContact CE2-CD1 4.24Å; Y184-L234 HydrophobicContact CE2-CG 4.48Å; Y184-L234 HydrophobicContact CG-CD1 3.94Å; Y184-L234 HydrophobicContact CG-CG 4.45Å; Y184-F263 WeakPolarHBondContact CA-O 3.49Å; Y184-I264 HydrophobicContact CD1-CB 3.91Å; Y184-I264 HydrophobicContact CD1-CG1 4.34Å; Y184-I264 HydrophobicContact CE1-CB 3.55Å; Y184-I264 HydrophobicContact CE1-CD1 4.31Å; Y184-I264 HydrophobicContact CE1-CG1 3.94Å; Y184-I264 HydrophobicContact CE2-CD1 4.28Å; Y184-I264 HydrophobicContact CE2-CG1 4.17Å
185F98.9Very high96.1Very high48 Ų4829.8 Ų29.821%0.21116%0.159CC..EExtended strand (participates in β ladder)trans-100.6137.7166.7173.9-95.8000109.7I187 I231 G262 F263 L265F185-I187 HydrophobicContact CE1-CB 3.77Å; F185-I187 HydrophobicContact CE1-CG2 3.65Å; F185-I187 HydrophobicContact CZ-CB 3.84Å; F185-I187 HydrophobicContact CZ-CD1 4.48Å; F185-I187 HydrophobicContact CZ-CG2 4.18Å; F185-I231 HydrophobicContact CD2-CG1 3.98Å; F185-G262 CarbonylContact O-C 3.5Å; F185-G262 WeakPolarHBondContact O-CA 3.3Å; F185-F263 HydrophobicContact CB-CE1 4.2Å; F185-F263 HydrophobicContact CB-CE2 4.27Å; F185-F263 HydrophobicContact CB-CZ 4.01Å; F185-F263 HydrophobicContact CD1-CD1 4.06Å; F185-F263 AromaticContact CD1-CE1 3.36Å; F185-F263 HydrophobicContact CD1-CE1 3.36Å; F185-F263 AromaticContact CD1-CZ 3.78Å; F185-F263 HydrophobicContact CD1-CZ 3.78Å; F185-F263 HydrophobicContact CE1-CE1 4.07Å; F185-F263 HydrophobicContact CG-CE1 4.11Å; F185-F263 HydrophobicContact CG-CZ 4.11Å; F185-F263 PolarHBondContact N-O 3.22Å; F185-F263 PolarHBondContact O-N 3.44Å; F185-L265 HydrophobicContact CB-CD1 4.21Å; F185-L265 HydrophobicContact CB-CG 4.32Å
186F98.9Very high95.1Very high0 Ų034 Ų340%018%0.181CC..EExtended strand (participates in β ladder)trans-130.3143.8172.6-62.5-83.3000110.5F142 F176 Y184 L204 S229 V230 L232 L234 V240 F260 S261F142-F186 HydrophobicContact CE1-CD1 4.01Å; F142-F186 AromaticContact CE1-CE1 3.83Å; F142-F186 HydrophobicContact CE1-CE1 3.83Å; F142-F186 HydrophobicContact CZ-CD1 4.15Å; F142-F186 HydrophobicContact CZ-CE1 4.27Å; F176-F186 HydrophobicContact CB-CE1 4.43Å; F176-F186 AromaticContact CD1-CE1 3.96Å; F176-F186 HydrophobicContact CD1-CE1 3.96Å; F176-F186 AromaticContact CD1-CZ 3.87Å; F176-F186 HydrophobicContact CD1-CZ 3.87Å; F176-F186 HydrophobicContact CD2-CE1 4.32Å; F176-F186 HydrophobicContact CE1-CE1 4.3Å; F176-F186 AromaticContact CE1-CZ 3.93Å; F176-F186 HydrophobicContact CE1-CZ 3.93Å; F176-F186 AromaticContact CG-CE1 3.98Å; F176-F186 HydrophobicContact CG-CE1 3.98Å; F176-F186 HydrophobicContact CG-CZ 4.36Å; F176-F186 HydrophobicContact CZ-CZ 4.45Å; Y184-F186 VanDerWaalsContact CB-CE2 3.44Å; Y184-F186 HydrophobicContact CD1-CZ 4.42Å; Y184-F186 HydrophobicContact CG-CE2 4.34Å; Y184-F186 HydrophobicContact CG-CZ 4.29Å; F186-L204 HydrophobicContact CB-CD1 3.62Å; F186-L204 HydrophobicContact CG-CD1 4.2Å; F186-S229 CarbonylContact O-C 3.51Å; F186-S229 WeakPolarHBondContact O-CA 3.45Å; F186-S229 WeakPolarHBondContact O-CB 3.17Å; F186-V230 HydrophobicContact CB-CG1 4.12Å; F186-V230 HydrophobicContact CD2-CG1 4.47Å; F186-V230 PolarHBondContact N-O 2.98Å; F186-V230 PolarHBondContact O-N 3.18Å; F186-L232 HydrophobicContact CD2-CD1 4.42Å; F186-L234 HydrophobicContact CE2-CD1 3.82Å; F186-L234 HydrophobicContact CZ-CD1 3.66Å; F186-V240 HydrophobicContact CD1-CG1 4.28Å; F186-V240 HydrophobicContact CD2-CG1 4.48Å; F186-V240 HydrophobicContact CE1-CB 4.34Å; F186-V240 HydrophobicContact CE1-CG1 4.19Å; F186-V240 HydrophobicContact CE2-CG1 4.4Å; F186-V240 HydrophobicContact CE2-CG2 4.24Å; F186-V240 HydrophobicContact CG-CG1 4.43Å; F186-V240 HydrophobicContact CZ-CB 4.23Å; F186-V240 HydrophobicContact CZ-CG1 4.27Å; F186-V240 HydrophobicContact CZ-CG2 4.08Å; F186-F260 HydrophobicContact CB-CE2 4.21Å; F186-F260 HydrophobicContact CD1-CE2 4Å; F186-F260 AromaticContact CD1-CZ 3.92Å; F186-F260 HydrophobicContact CD1-CZ 3.92Å; F186-S261 WeakPolarHBondContact CA-O 3.47Å
187I98.9Very high94Very high50 Ų5035.8 Ų35.826%0.25620%0.199SC..EExtended strand (participates in β ladder)trans-143138.1171.6-174.6169.7000109.7F185 F260 S261F185-I187 HydrophobicContact CE1-CB 3.77Å; F185-I187 HydrophobicContact CE1-CG2 3.65Å; F185-I187 HydrophobicContact CZ-CB 3.84Å; F185-I187 HydrophobicContact CZ-CD1 4.48Å; F185-I187 HydrophobicContact CZ-CG2 4.18Å; I187-F260 WeakPolarHBondContact O-CD2 3.4Å; I187-S261 WeakPolarHBondContact CG2-OG 3.3Å; I187-S261 PolarHBondContact N-O 2.95Å; I187-S261 PolarHBondContact O-N 3.38Å
188Y98.8Very high93.3Very high0 Ų036.8 Ų36.80%021%0.205CC..EExtended strand (participates in β ladder)trans-130.6145.7173.361.5-88.5000110.1V190 A202 L204 A212 A214 S227 N228 I242 T259Y188-V190 HydrophobicContact CD2-CG2 4.12Å; Y188-A202 HydrophobicContact CD2-CB 4.22Å; Y188-A202 HydrophobicContact CE2-CB 3.78Å; Y188-A202 PolarHBondContact OH-O 3.32Å; Y188-L204 HydrophobicContact CD1-CB 4.15Å; Y188-L204 HydrophobicContact CD1-CD1 4.16Å; Y188-L204 HydrophobicContact CE1-CB 3.67Å; Y188-L204 HydrophobicContact CE1-CD1 4.32Å; Y188-A212 PolarHBondContact OH-O 3.05Å; Y188-A214 HydrophobicContact CE2-CB 4.15Å; Y188-A214 PolarHBondContact OH-N 2.99Å; Y188-S227 VanDerWaalsContact O-CA 3.28Å; Y188-S227 WeakPolarHBondContact O-CA 3.27Å; Y188-S227 WeakPolarHBondContact O-CB 3.5Å; Y188-N228 WeakPolarHBondContact CD1-O 3.25Å; Y188-N228 HydrophobicContact CE1-CB 3.75Å; Y188-N228 HydrophobicContact CE2-CB 4.14Å; Y188-N228 VanDerWaalsContact CZ-CB 3.44Å; Y188-N228 PolarHBondContact N-O 2.83Å; Y188-N228 PolarHBondContact O-N 2.98Å; Y188-N228 WeakPolarHBondContact OH-CB 3.48Å; Y188-I242 HydrophobicContact CD1-CD1 3.48Å; Y188-I242 VanDerWaalsContact CD1-CD1 3.48Å; Y188-I242 HydrophobicContact CD2-CD1 4.41Å; Y188-I242 HydrophobicContact CE1-CD1 4.08Å; Y188-I242 HydrophobicContact CG-CD1 3.66Å; Y188-I242 HydrophobicContact CG-CG1 4.3Å; Y188-T259 WeakPolarHBondContact CA-O 3.39Å
189N98.6Very high92.8Very high53 Ų5338.1 Ų38.128%0.28322%0.215SC..EExtended strand (participates in β ladder)trans-132.8114169.8-51.5-88.7000106.5Y225 S227 S258 T259N189-Y225 HydrophobicContact CB-CD1 3.99Å; N189-Y225 HydrophobicContact CB-CE1 3.86Å; N189-S227 WeakPolarHBondContact CA-OG 3.43Å; N189-S227 WeakPolarHBondContact OD1-CB 3.4Å; N189-S227 PolarHBondContact OD1-OG 2.91Å; N189-S258 CarbonylContact O-C 3.55Å; N189-S258 VanDerWaalsContact O-CA 3.25Å; N189-S258 WeakPolarHBondContact O-CA 3.31Å; N189-T259 PolarHBondContact N-O 2.78Å; N189-T259 PolarHBondContact O-N 2.8Å
190V97.4Very high92.4Very high0 Ų032.7 Ų32.70%019%0.191CC..EExtended strand (participates in β ladder)trans-114.1116.9-178-1720000109L156 F158 Y188 M192 A202 Y225 A226 I242 L244 A249L156-V190 HydrophobicContact CD2-CG1 3.9Å; L156-V190 HydrophobicContact CD2-CG2 4.06Å; F158-V190 HydrophobicContact CZ-CG2 4.18Å; Y188-V190 HydrophobicContact CD2-CG2 4.12Å; V190-M192 HydrophobicContact CB-CG 4.09Å; V190-M192 HydrophobicContact CB-SD 4.48Å; V190-M192 HydrophobicContact CG1-CG 3.49Å; V190-M192 VanDerWaalsContact CG1-CG 3.49Å; V190-M192 HydrophobicContact CG1-SD 4.15Å; V190-M192 PolarHBondContact O-N 2.69Å; V190-A202 HydrophobicContact CB-CB 4.25Å; V190-A202 HydrophobicContact CG2-CB 3.97Å; V190-Y225 WeakPolarHBondContact O-CA 3.44Å; V190-A226 PolarHBondContact N-O 2.89Å; V190-A226 PolarHBondContact O-N 2.84Å; V190-I242 HydrophobicContact CG2-CG2 4.42Å; V190-L244 HydrophobicContact CG1-CD2 4.02Å; V190-A249 HydrophobicContact CG1-CB 3.57Å
191L96Very high92.3Very high21 Ų2134 Ų3411%0.1119%0.193CC..EExtended strand (participates in β ladder)trans-77.4111.5168.9177.165.9000108Y223 Y225 A249 H250 Y257 S258L191-Y223 HydrophobicContact CD1-CD1 3.99Å; L191-Y223 HydrophobicContact CD1-CG 4.43Å; L191-Y223 HydrophobicContact CD2-CD1 4.21Å; L191-Y223 HydrophobicContact CG-CD1 3.96Å; L191-Y225 HydrophobicContact CB-CE1 4.05Å; L191-Y225 HydrophobicContact CB-CE2 4.25Å; L191-Y225 HydrophobicContact CD1-CD2 4.09Å; L191-Y225 HydrophobicContact CD1-CE2 3.83Å; L191-A249 CarbonylContact O-C 3.48Å; L191-A249 WeakPolarHBondContact O-CA 3.41Å; L191-H250 HydrophobicContact CD2-CB 4.14Å; L191-H250 HydrophobicContact CG-CB 4.34Å; L191-H250 PolarHBondContact O-N 3.16Å; L191-Y257 HydrophobicContact CD2-CD1 3.88Å; L191-Y257 HydrophobicContact CD2-CG 4.02Å; L191-S258 PolarHBondContact N-OG 3.09Å; L191-S258 PolarHBondContact O-OG 3.4Å
192M92.7Very high92.2Very high0 Ų031.8 Ų31.80%018%0.178CC..EExtended strand (participates in β ladder)trans-114.5151.7-175.9-59.5-174.471.500111.4V190 M200 A202 Y223 D224 A226 L244 G246 K248V190-M192 HydrophobicContact CB-CG 4.09Å; V190-M192 HydrophobicContact CB-SD 4.48Å; V190-M192 HydrophobicContact CG1-CG 3.49Å; V190-M192 VanDerWaalsContact CG1-CG 3.49Å; V190-M192 HydrophobicContact CG1-SD 4.15Å; V190-M192 PolarHBondContact O-N 2.69Å; M192-M200 HydrophobicContact CB-CE 4.07Å; M192-M200 HydrophobicContact CB-SD 3.55Å; M192-M200 VanDerWaalsContact CB-SD 3.55Å; M192-M200 HydrophobicContact CE-CB 3.8Å; M192-M200 HydrophobicContact CE-CG 4.44Å; M192-M200 HydrophobicContact CE-SD 4.43Å; M192-M200 HydrophobicContact SD-CB 4.15Å; M192-A202 HydrophobicContact SD-CB 4.24Å; M192-Y223 WeakPolarHBondContact O-CA 3.28Å; M192-D224 PolarHBondContact N-O 3.23Å; M192-D224 PolarHBondContact O-N 3.07Å; M192-A226 HydrophobicContact SD-CB 3.7Å; M192-L244 HydrophobicContact CE-CB 4.4Å; M192-L244 HydrophobicContact CE-CD1 4.44Å; M192-L244 HydrophobicContact CE-CD2 3.83Å; M192-L244 HydrophobicContact CE-CG 4.42Å; M192-L244 HydrophobicContact SD-CD2 4.05Å; M192-G246 WeakPolarHBondContact CE-O 3.27Å; M192-K248 CarbonylContact C-O 3.6Å; M192-K248 VanDerWaalsContact CA-O 3.27Å; M192-K248 WeakPolarHBondContact CA-O 3.49Å
193R90.3Very high92.2Very high97 Ų9733.1 Ų33.137%0.36619%0.185SC..EExtended strand (participates in β ladder)trans-125.9125.6168.3-178.2175.5170.5-169-5.4109.7Q221 Y223 G247 K248R193-Q221 VanDerWaalsContact NH2-OE1 3.09Å; R193-Y223 HydrophobicContact CB-CD1 3.96Å; R193-Y223 HydrophobicContact CB-CE1 3.72Å; R193-Y223 HydrophobicContact CG-CE1 4.4Å; R193-G247 CarbonylContact O-C 3.53Å; R193-G247 VanDerWaalsContact O-CA 3.24Å; R193-G247 WeakPolarHBondContact O-CA 3.24Å; R193-K248 PolarHBondContact N-O 3.12Å; R193-K248 PolarHBondContact O-N 3.26Å
194G82.9Confident92.2Very high10 Ų1031.3 Ų31.310%0.10317%0.174CC..  trans-105.2173.7-175.600000112.6M200G194-M200 WeakPolarHBondContact CA-SD 3.38Å; G194-M200 PolarHBondContact N-SD 2.93Å
195G80.5Confident92.2Very high30 Ų3031.8 Ų31.831%0.30918%0.176SC..  trans-80.3162.7162.300000110.9G197 T198G195-G197 PolarHBondContact O-N 2.81Å; G195-T198 VanDerWaalsContact C-OG1 3.3Å; G195-T198 WeakPolarHBondContact CA-OG1 3.31Å; G195-T198 PolarHBondContact N-OG1 3.31Å; G195-T198 PolarHBondContact O-N 2.81Å; G195-T198 VanDerWaalsContact O-N 3.07Å; G195-T198 PolarHBondContact O-OG1 3.41Å
196D76.9Confident92.2Very high98 Ų9831.3 Ų31.352%0.52417%0.174SC..THydrogen-bonded Turntrans-54.7122.9-177.8-60.5-66.2000111.9T198 Q221D196-T198 PolarHBondContact O-N 3.28Å; D196-T198 VanDerWaalsContact O-N 3.12Å; D196-Q221 HydrophobicContact CB-CG 4.46Å; D196-Q221 WeakPolarHBondContact OD1-CG 3.22Å; D196-Q221 PolarHBondContact OD1-N 2.6Å; D196-Q221 VanDerWaalsContact OD1-N 3.16Å; D196-Q221 WeakPolarHBondContact OD2-CG 3.36Å; D196-Q221 PolarHBondContact OD2-NE2 2.96Å
197G75.6Confident92.1Very high37 Ų3735.3 Ų35.338%0.38120%0.196SC..THydrogen-bonded Turntrans66.28.2178.700000115.7G195 Q217 D218 Q219G195-G197 PolarHBondContact O-N 2.81Å; G197-Q217 PolarHBondContact O-NE2 3.14Å; G197-Q217 VanDerWaalsContact O-NE2 3.07Å; G197-D218 WeakPolarHBondContact CA-O 3.32Å; G197-D218 PolarHBondContact N-O 3.43Å; G197-Q219 PolarHBondContact N-O 3.31Å
198T83.8Confident91.9Very high67 Ų6736 Ų3641%0.41122%0.215SC..  trans-92.2136.3179.561.50000111.7G195 D196G195-T198 VanDerWaalsContact C-OG1 3.3Å; G195-T198 WeakPolarHBondContact CA-OG1 3.31Å; G195-T198 PolarHBondContact N-OG1 3.31Å; G195-T198 PolarHBondContact O-N 2.81Å; G195-T198 VanDerWaalsContact O-N 3.07Å; G195-T198 PolarHBondContact O-OG1 3.41Å; D196-T198 PolarHBondContact O-N 3.28Å; D196-T198 VanDerWaalsContact O-N 3.12Å
199S88.3Confident91.8Very high30 Ų3041.8 Ų41.821%0.2124%0.242CC..EExtended strand (participates in β ladder)trans-72.4147.5171.3-50.80000110.6Q217S199-Q217 PolarHBondContact OG-OE1 3.38Å; S199-Q217 VanDerWaalsContact OG-OE1 3.04Å
200M91.3Very high91.8Very high3 Ų342.9 Ų42.92%0.01525%0.25CS..EExtended strand (participates in β ladder)trans-126143.8174.2-59.9177.5-75.500109.2M192 G194 I215 A216 D245 G246M192-M200 HydrophobicContact CB-CE 4.07Å; M192-M200 HydrophobicContact CB-SD 3.55Å; M192-M200 VanDerWaalsContact CB-SD 3.55Å; M192-M200 HydrophobicContact CE-CB 3.8Å; M192-M200 HydrophobicContact CE-CG 4.44Å; M192-M200 HydrophobicContact CE-SD 4.43Å; M192-M200 HydrophobicContact SD-CB 4.15Å; G194-M200 WeakPolarHBondContact CA-SD 3.38Å; G194-M200 PolarHBondContact N-SD 2.93Å; M200-I215 CarbonylContact O-C 3.6Å; M200-I215 WeakPolarHBondContact O-CA 3.36Å; M200-A216 HydrophobicContact CE-CB 4.18Å; M200-A216 PolarHBondContact N-O 2.91Å; M200-A216 PolarHBondContact O-N 2.82Å; M200-D245 CarbonylContact C-O 3.58Å; M200-G246 WeakPolarHBondContact CB-O 3.19Å; M200-G246 WeakPolarHBondContact CG-O 3.18Å
201W93.7Very high91.9Very high85 Ų8548.6 Ų48.632%0.32227%0.272SS..EExtended strand (participates in β ladder)trans-129.4141.7-178.9-56.4-78000111.3A214 I215 L244 D245W201-A214 VanDerWaalsContact CA-O 3.28Å; W201-A214 WeakPolarHBondContact CA-O 2.82Å; W201-I215 HydrophobicContact CZ2-CD1 4.41Å; W201-I215 VanDerWaalsContact NE1-CD1 3.26Å; W201-I215 VanDerWaalsContact NE1-CG1 3.33Å; W201-L244 WeakPolarHBondContact O-CA 3.47Å; W201-D245 HydrophobicContact CB-CB 4.28Å; W201-D245 HydrophobicContact CE3-CB 3.75Å; W201-D245 PolarHBondContact N-O 2.84Å; W201-D245 PolarHBondContact O-N 3.35Å
202A96.8Very high92Very high0 Ų048.1 Ų48.10%027%0.271CS..EExtended strand (participates in β ladder)trans-120.6118.6161.800000108.2Y188 V190 M192 A214 A226 I242 L244Y188-A202 HydrophobicContact CD2-CB 4.22Å; Y188-A202 HydrophobicContact CE2-CB 3.78Å; Y188-A202 PolarHBondContact OH-O 3.32Å; V190-A202 HydrophobicContact CB-CB 4.25Å; V190-A202 HydrophobicContact CG2-CB 3.97Å; M192-A202 HydrophobicContact SD-CB 4.24Å; A202-A214 PolarHBondContact N-O 2.84Å; A202-A214 PolarHBondContact O-N 3.37Å; A202-A226 HydrophobicContact CB-CB 3.68Å; A202-I242 HydrophobicContact CB-CG2 4.26Å; A202-L244 HydrophobicContact CB-CD2 3.89Å
203D98.1Very high92.2Very high28 Ų2850.6 Ų50.615%0.1529%0.288CS..EExtended strand (participates in β ladder)trans-113.1127.5-176.2-71.6-16000110.4I205 V210 S213 I242 K243D203-I205 HydrophobicContact CB-CD1 3.81Å; D203-V210 HydrophobicContact CB-CG1 4.15Å; D203-V210 HydrophobicContact CB-CG2 4.27Å; D203-S213 WeakPolarHBondContact OD1-CA 3.25Å; D203-S213 WeakPolarHBondContact OD1-CB 3.43Å; D203-S213 PolarHBondContact OD1-OG 2.74Å; D203-I242 CarbonylContact O-C 3.55Å; D203-I242 VanDerWaalsContact O-CA 3.29Å; D203-I242 WeakPolarHBondContact O-CA 3.35Å; D203-K243 PolarHBondContact N-O 2.86Å; D203-K243 PolarHBondContact O-N 2.83Å
204L98.8Very high92.6Very high0 Ų046.5 Ų46.50%028%0.275CS..EExtended strand (participates in β ladder)trans-83.6117.8165.5-175.8152.6000109F186 Y188 R211 A212 V230 L232 V240 I242 F260F186-L204 HydrophobicContact CB-CD1 3.62Å; F186-L204 HydrophobicContact CG-CD1 4.2Å; Y188-L204 HydrophobicContact CD1-CB 4.15Å; Y188-L204 HydrophobicContact CD1-CD1 4.16Å; Y188-L204 HydrophobicContact CE1-CB 3.67Å; Y188-L204 HydrophobicContact CE1-CD1 4.32Å; L204-R211 HydrophobicContact CD2-CB 4.01Å; L204-R211 HydrophobicContact CD2-CG 4.48Å; L204-R211 PolarHBondContact O-N 2.94Å; L204-A212 HydrophobicContact CB-CB 4.4Å; L204-A212 PolarHBondContact N-O 3.38Å; L204-V230 HydrophobicContact CD1-CG1 3.77Å; L204-V230 HydrophobicContact CD2-CG1 3.93Å; L204-V230 HydrophobicContact CG-CG1 4.45Å; L204-L232 HydrophobicContact CD2-CD1 3.85Å; L204-V240 HydrophobicContact CD1-CG1 4.05Å; L204-V240 HydrophobicContact CD2-CG1 3.67Å; L204-V240 HydrophobicContact CG-CG1 3.8Å; L204-I242 HydrophobicContact CB-CD1 3.75Å; L204-I242 HydrophobicContact CD1-CD1 4.1Å; L204-I242 HydrophobicContact CG-CD1 4.03Å; L204-F260 HydrophobicContact CD1-CE2 4.1Å; L204-F260 HydrophobicContact CD1-CZ 4.44Å
205I98.6Very high93.1Very high10 Ų1050.9 Ų50.95%0.05130%0.295CS..EExtended strand (participates in β ladder)trans-103.2133.5-177.4-52.6-56.6000109.3D203 G208 Q209 V210 V240 F241 K243D203-I205 HydrophobicContact CB-CD1 3.81Å; I205-G208 VanDerWaalsContact CG2-CA 3.45Å; I205-Q209 CarbonylContact C-O 3.54Å; I205-Q209 WeakPolarHBondContact CA-O 3.32Å; I205-V210 HydrophobicContact CD1-CB 4.19Å; I205-V210 HydrophobicContact CD1-CG2 3.52Å; I205-V240 VanDerWaalsContact O-CA 3.25Å; I205-V240 WeakPolarHBondContact O-CA 3.38Å; I205-F241 HydrophobicContact CB-CD2 3.95Å; I205-F241 HydrophobicContact CB-CE1 4.3Å; I205-F241 HydrophobicContact CB-CE2 3.58Å; I205-F241 HydrophobicContact CB-CG 4.47Å; I205-F241 HydrophobicContact CB-CZ 3.78Å; I205-F241 HydrophobicContact CG1-CD2 4.14Å; I205-F241 HydrophobicContact CG1-CE2 3.7Å; I205-F241 HydrophobicContact CG1-CZ 4.3Å; I205-F241 HydrophobicContact CG2-CE1 4.1Å; I205-F241 HydrophobicContact CG2-CE2 3.85Å; I205-F241 HydrophobicContact CG2-CZ 3.54Å; I205-F241 PolarHBondContact N-O 3.21Å; I205-F241 PolarHBondContact O-N 3.15Å; I205-F241 VanDerWaalsContact O-N 3.12Å; I205-K243 HydrophobicContact CD1-CB 4.43Å; I205-K243 HydrophobicContact CG1-CB 3.83Å
206K98.6Very high93.6Very high38 Ų3849.7 Ų49.717%0.16528%0.282CS..EExtended strand (participates in β ladder)trans-113.9117.9163.6-180-171.9175.61760108.4G208 Q209 R211 H233 L234 D238 E239 V240K206-G208 PolarHBondContact O-N 2.82Å; K206-G208 VanDerWaalsContact O-N 3.14Å; K206-Q209 PolarHBondContact N-O 3.02Å; K206-Q209 PolarHBondContact O-N 2.88Å; K206-R211 HydrophobicContact CB-CG 3.47Å; K206-R211 VanDerWaalsContact CB-CG 3.47Å; K206-H233 PolarHBondContact NZ-O 3.36Å; K206-L234 HydrophobicContact CD-CD2 3.72Å; K206-L234 HydrophobicContact CG-CD2 4.16Å; K206-D238 VanDerWaalsContact CE-CG 3.46Å; K206-D238 WeakPolarHBondContact CE-OD2 3.33Å; K206-D238 IonicContact NZ-OD2 2.69Å; K206-D238 PolarHBondContact NZ-OD2 3.37Å; K206-E239 VanDerWaalsContact CA-O 3.31Å; K206-E239 WeakPolarHBondContact CA-O 3.36Å; K206-V240 HydrophobicContact CG-CG2 4.48Å
207N96.7Very high94Very high84 Ų8450.2 Ų50.245%0.44928%0.282SS..THydrogen-bonded Turntrans46.144.3177.9-60-14.7000114Q209 D238 E239N207-Q209 VanDerWaalsContact C-N 3.34Å; N207-Q209 PolarHBondContact O-N 2.87Å; N207-D238 PolarHBondContact ND2-OD1 3.36Å; N207-D238 WeakPolarHBondContact OD1-CA 3.29Å; N207-E239 PolarHBondContact N-O 3.32Å; N207-E239 PolarHBondContact OD1-N 3.43Å
208G94.9Very high94.2Very high64 Ų6451.3 Ų51.366%0.6628%0.279SS*.THydrogen-bonded Turntrans82.5-1.8-179.300000116.1I205 K206I205-G208 VanDerWaalsContact CG2-CA 3.45Å; K206-G208 PolarHBondContact O-N 2.82Å; K206-G208 VanDerWaalsContact O-N 3.14Å
209Q98Very high93.7Very high122 Ų12255.8 Ų55.857%0.5730%0.295SS*.EExtended strand (participates in β ladder)trans-104.8132.6174.7-63.5-172.1-5.100112.1I205 K206 N207 R211I205-Q209 CarbonylContact C-O 3.54Å; I205-Q209 WeakPolarHBondContact CA-O 3.32Å; K206-Q209 PolarHBondContact N-O 3.02Å; K206-Q209 PolarHBondContact O-N 2.88Å; N207-Q209 VanDerWaalsContact C-N 3.34Å; N207-Q209 PolarHBondContact O-N 2.87Å; Q209-R211 PolarHBondContact O-N 2.97Å
210V98.3Very high93Very high76 Ų7660.1 Ų60.146%0.46132%0.316SS..EExtended strand (participates in β ladder)trans-65.2124.6170.4-177.30000109.2D203 I205D203-V210 HydrophobicContact CB-CG1 4.15Å; D203-V210 HydrophobicContact CB-CG2 4.27Å; I205-V210 HydrophobicContact CD1-CB 4.19Å; I205-V210 HydrophobicContact CD1-CG2 3.52Å
211R98.7Very high91.8Very high120 Ų12064.1 Ų64.145%0.45334%0.335SS..EExtended strand (participates in β ladder)trans-110.2-26.9177.6-55.3-50.9-59.9177.81.5113L204 K206 Q209 L232L204-R211 HydrophobicContact CD2-CB 4.01Å; L204-R211 HydrophobicContact CD2-CG 4.48Å; L204-R211 PolarHBondContact O-N 2.94Å; K206-R211 HydrophobicContact CB-CG 3.47Å; K206-R211 VanDerWaalsContact CB-CG 3.47Å; Q209-R211 PolarHBondContact O-N 2.97Å; R211-L232 HydrophobicContact CB-CD1 4.08Å; R211-L232 HydrophobicContact CB-CD2 4.12Å; R211-L232 HydrophobicContact CG-CD1 4.08Å; R211-L232 HydrophobicContact CG-CD2 4.29Å
212A98.6Very high91.1Very high11 Ų1162.4 Ų62.49%0.09134%0.336CS..EExtended strand (participates in β ladder)trans-150.7140.8171.500000108.7Y188 L204 N228 V230Y188-A212 PolarHBondContact OH-O 3.05Å; L204-A212 HydrophobicContact CB-CB 4.4Å; L204-A212 PolarHBondContact N-O 3.38Å; A212-N228 HydrophobicContact CB-CB 4.43Å; A212-V230 HydrophobicContact CB-CB 4.12Å; A212-V230 HydrophobicContact CB-CG1 4.47Å
213S98.1Very high90.8Very high52 Ų5267.5 Ų67.536%0.36436%0.355SS..EExtended strand (participates in β ladder)trans-130.8146.6-179.6-177.10000109.4D203 N228D203-S213 WeakPolarHBondContact OD1-CA 3.25Å; D203-S213 WeakPolarHBondContact OD1-CB 3.43Å; D203-S213 PolarHBondContact OD1-OG 2.74Å; S213-N228 PolarHBondContact O-ND2 2.55Å
214A97.5Very high90.6Very high11 Ų1169.4 Ų69.49%0.09137%0.366CS..EExtended strand (participates in β ladder)trans-128.2132.9168.800000109.1Y188 W201 A202 A226 S227 N228Y188-A214 HydrophobicContact CE2-CB 4.15Å; Y188-A214 PolarHBondContact OH-N 2.99Å; W201-A214 VanDerWaalsContact CA-O 3.28Å; W201-A214 WeakPolarHBondContact CA-O 2.82Å; A202-A214 PolarHBondContact N-O 2.84Å; A202-A214 PolarHBondContact O-N 3.37Å; A214-A226 HydrophobicContact CB-CB 3.9Å; A214-S227 VanDerWaalsContact CB-N 3.33Å; A214-N228 HydrophobicContact CB-CB 4.32Å
215I94.5Very high90.4Very high103 Ų10373.9 Ų73.953%0.52838%0.383SS..EExtended strand (participates in β ladder)trans-109.4139.1176-172174.7000109.7M200 W201M200-I215 CarbonylContact O-C 3.6Å; M200-I215 WeakPolarHBondContact O-CA 3.36Å; W201-I215 HydrophobicContact CZ2-CD1 4.41Å; W201-I215 VanDerWaalsContact NE1-CD1 3.26Å; W201-I215 VanDerWaalsContact NE1-CG1 3.33Å
216A89Confident90.3Very high4 Ų473.4 Ų73.43%0.03338%0.381CS..EExtended strand (participates in β ladder)trans-130142.8166.100000109.2M200 D224M200-A216 HydrophobicContact CE-CB 4.18Å; M200-A216 PolarHBondContact N-O 2.91Å; M200-A216 PolarHBondContact O-N 2.82Å; A216-D224 HydrophobicContact CB-CB 3.98Å
217Q87.1Confident90.2Very high110 Ų11073.8 Ų73.851%0.51439%0.388SS..EExtended strand (participates in β ladder)trans-150.4128176.4-177.6176.9-4.100109G197 S199G197-Q217 PolarHBondContact O-NE2 3.14Å; G197-Q217 VanDerWaalsContact O-NE2 3.07Å; S199-Q217 PolarHBondContact OG-OE1 3.38Å; S199-Q217 VanDerWaalsContact OG-OE1 3.04Å
218D79.4Confident90.3Very high60 Ų6072.8 Ų72.832%0.32138%0.383SS..  trans-127.1148.3171.8-157.3-24.5000109G197 D220 S222G197-D218 WeakPolarHBondContact CA-O 3.32Å; G197-D218 PolarHBondContact N-O 3.43Å; D218-D220 PolarHBondContact OD1-N 3.04Å; D218-S222 WeakPolarHBondContact OD2-CB 3.44Å; D218-S222 PolarHBondContact OD2-OG 3.06Å
219Q72.5Confident90.5Very high160 Ų16072.3 Ų72.375%0.74837%0.37SS*.SBendtrans-74.2-36.8179.2-77.7-172.6-13.700111.4G197G197-Q219 PolarHBondContact N-O 3.31Å
220D73.8Confident90.6Very high121 Ų12167.7 Ų67.765%0.64735%0.35SS*.SBendtrans-96.5149.5175.2-59.1-37.2000108.6D218 S222D218-D220 PolarHBondContact OD1-N 3.04Å; D220-S222 PolarHBondContact O-N 2.72Å
221Q65.3Low90.6Very high88 Ų8869 Ų6941%0.41135%0.353SS..SBendtrans-60.567178.3-59.2-151.3-8.400114.6R193 D196R193-Q221 VanDerWaalsContact NH2-OE1 3.09Å; D196-Q221 HydrophobicContact CB-CG 4.46Å; D196-Q221 WeakPolarHBondContact OD1-CG 3.22Å; D196-Q221 PolarHBondContact OD1-N 2.6Å; D196-Q221 VanDerWaalsContact OD1-N 3.16Å; D196-Q221 WeakPolarHBondContact OD2-CG 3.36Å; D196-Q221 PolarHBondContact OD2-NE2 2.96Å
222S79.2Confident90.6Very high49 Ų4964 Ų6434%0.34334%0.335SS..  trans-96.8166-174.5-166.10000110.7D218 D220D218-S222 WeakPolarHBondContact OD2-CB 3.44Å; D218-S222 PolarHBondContact OD2-OG 3.06Å; D220-S222 PolarHBondContact O-N 2.72Å
223Y90.6Very high90.6Very high106 Ų10667.3 Ų67.342%0.41635%0.348SS..EExtended strand (participates in β ladder)trans-92.2129.7171.7-79-85.2000109L191 M192 R193 H250L191-Y223 HydrophobicContact CD1-CD1 3.99Å; L191-Y223 HydrophobicContact CD1-CG 4.43Å; L191-Y223 HydrophobicContact CD2-CD1 4.21Å; L191-Y223 HydrophobicContact CG-CD1 3.96Å; M192-Y223 WeakPolarHBondContact O-CA 3.28Å; R193-Y223 HydrophobicContact CB-CD1 3.96Å; R193-Y223 HydrophobicContact CB-CE1 3.72Å; R193-Y223 HydrophobicContact CG-CE1 4.4Å; Y223-H250 HydrophobicContact CE1-CB 4.27Å; Y223-H250 AromaticContact CE1-CD2 3.56Å; Y223-H250 AromaticContact CE1-CG 3.75Å; Y223-H250 AromaticContact CE1-NE2 3.83Å
224D93.5Very high90.6Very high68 Ų6864.8 Ų64.836%0.36433%0.331SS..EExtended strand (participates in β ladder)trans-142.8163.4175.2-160.14.9000111.1M192 A216M192-D224 PolarHBondContact N-O 3.23Å; M192-D224 PolarHBondContact O-N 3.07Å; A216-D224 HydrophobicContact CB-CB 3.98Å
225Y95.3Very high90.7Very high94 Ų9468.5 Ų68.537%0.36935%0.349SS..EExtended strand (participates in β ladder)trans-100.2123.9-178.1-94.9-83.3000112.2N189 V190 L191 Y257N189-Y225 HydrophobicContact CB-CD1 3.99Å; N189-Y225 HydrophobicContact CB-CE1 3.86Å; V190-Y225 WeakPolarHBondContact O-CA 3.44Å; L191-Y225 HydrophobicContact CB-CE1 4.05Å; L191-Y225 HydrophobicContact CB-CE2 4.25Å; L191-Y225 HydrophobicContact CD1-CD2 4.09Å; L191-Y225 HydrophobicContact CD1-CE2 3.83Å; Y225-Y257 WeakPolarHBondContact CE1-O 3.45Å; Y225-Y257 WeakPolarHBondContact OH-CA 3.34Å; Y225-Y257 PolarHBondContact OH-O 3.06Å
226A95.9Very high90.9Very high0 Ų066.6 Ų66.60%035%0.349CS..EExtended strand (participates in β ladder)trans-98.5103162.200000108.5V190 M192 A202 A214V190-A226 PolarHBondContact N-O 2.89Å; V190-A226 PolarHBondContact O-N 2.84Å; M192-A226 HydrophobicContact SD-CB 3.7Å; A202-A226 HydrophobicContact CB-CB 3.68Å; A214-A226 HydrophobicContact CB-CB 3.9Å
227S98.3Very high91.3Very high46 Ų4668.7 Ų68.732%0.32237%0.371SS..EExtended strand (participates in β ladder)trans-131.3137.4-174.6-49.30000111.8Y188 N189 A214Y188-S227 VanDerWaalsContact O-CA 3.28Å; Y188-S227 WeakPolarHBondContact O-CA 3.27Å; Y188-S227 WeakPolarHBondContact O-CB 3.5Å; N189-S227 WeakPolarHBondContact CA-OG 3.43Å; N189-S227 WeakPolarHBondContact OD1-CB 3.4Å; N189-S227 PolarHBondContact OD1-OG 2.91Å; A214-S227 VanDerWaalsContact CB-N 3.33Å
228N98.8Very high91.9Very high63 Ų6364.2 Ų64.234%0.33735%0.351SS..EExtended strand (participates in β ladder)trans-153.9169.9173.1-148.2-28.4000110.6Y188 A212 S213 A214Y188-N228 WeakPolarHBondContact CD1-O 3.25Å; Y188-N228 HydrophobicContact CE1-CB 3.75Å; Y188-N228 HydrophobicContact CE2-CB 4.14Å; Y188-N228 VanDerWaalsContact CZ-CB 3.44Å; Y188-N228 PolarHBondContact N-O 2.83Å; Y188-N228 PolarHBondContact O-N 2.98Å; Y188-N228 WeakPolarHBondContact OH-CB 3.48Å; A212-N228 HydrophobicContact CB-CB 4.43Å; S213-N228 PolarHBondContact O-ND2 2.55Å; A214-N228 HydrophobicContact CB-CB 4.32Å
229S98.8Very high92.8Very high55 Ų5565.5 Ų65.539%0.38536%0.355SS..EExtended strand (participates in β ladder)trans-138.9155.817466.20000111F186F186-S229 CarbonylContact O-C 3.51Å; F186-S229 WeakPolarHBondContact O-CA 3.45Å; F186-S229 WeakPolarHBondContact O-CB 3.17Å
230V98.8Very high94Very high24 Ų2457.9 Ų57.915%0.14532%0.319CS..EExtended strand (participates in β ladder)trans-152.5147.1-178.967.60000111F186 L204 A212 L232F186-V230 HydrophobicContact CB-CG1 4.12Å; F186-V230 HydrophobicContact CD2-CG1 4.47Å; F186-V230 PolarHBondContact N-O 2.98Å; F186-V230 PolarHBondContact O-N 3.18Å; L204-V230 HydrophobicContact CD1-CG1 3.77Å; L204-V230 HydrophobicContact CD2-CG1 3.93Å; L204-V230 HydrophobicContact CG-CG1 4.45Å; A212-V230 HydrophobicContact CB-CB 4.12Å; A212-V230 HydrophobicContact CB-CG1 4.47Å; V230-L232 HydrophobicContact CG1-CD1 3.92Å; V230-L232 HydrophobicContact CG1-CG 3.95Å; V230-L232 HydrophobicContact CG2-CD1 4.46Å; V230-L232 HydrophobicContact CG2-CD2 3.68Å; V230-L232 HydrophobicContact CG2-CG 3.82Å
231I98.8Very high95.2Very high105 Ų10553.2 Ų53.254%0.53829%0.293SS..EExtended strand (participates in β ladder)trans-105.2124.4166.9-62.1173.9000107.7T183 Y184 F185 L265T183-I231 HydrophobicContact CG2-CG2 3.42Å; T183-I231 VanDerWaalsContact CG2-CG2 3.42Å; Y184-I231 CarbonylContact O-C 3.56Å; Y184-I231 VanDerWaalsContact O-CA 3.27Å; Y184-I231 WeakPolarHBondContact O-CA 3.43Å; F185-I231 HydrophobicContact CD2-CG1 3.98Å; I231-L265 HydrophobicContact CD1-CD1 4.23Å; I231-L265 HydrophobicContact CG1-CD1 4.33Å; I231-L265 HydrophobicContact CG2-CD1 4.04Å
232L98.8Very high96.8Very high14 Ų1449 Ų497%0.07327%0.274CS..EExtended strand (participates in β ladder)trans-129.5138.7-177.9-63.9175.3000110.4T183 Y184 F186 L204 R211 V230 L234T183-L232 WeakPolarHBondContact CA-O 3.14Å; Y184-L232 PolarHBondContact N-O 3.24Å; Y184-L232 PolarHBondContact O-N 3.18Å; F186-L232 HydrophobicContact CD2-CD1 4.42Å; L204-L232 HydrophobicContact CD2-CD1 3.85Å; R211-L232 HydrophobicContact CB-CD1 4.08Å; R211-L232 HydrophobicContact CB-CD2 4.12Å; R211-L232 HydrophobicContact CG-CD1 4.08Å; R211-L232 HydrophobicContact CG-CD2 4.29Å; V230-L232 HydrophobicContact CG1-CD1 3.92Å; V230-L232 HydrophobicContact CG1-CG 3.95Å; V230-L232 HydrophobicContact CG2-CD1 4.46Å; V230-L232 HydrophobicContact CG2-CD2 3.68Å; V230-L232 HydrophobicContact CG2-CG 3.82Å; L232-L234 HydrophobicContact CB-CD2 4.13Å
233H98.7Very high97.6Very high80 Ų8051.1 Ų51.137%0.3728%0.277SS..EExtended strand (participates in β ladder)trans-78.2134.4158.2-179.5-83.5000109.1G182 K206 D235 D268G182-H233 CarbonylContact O-C 3.12Å; G182-H233 WeakPolarHBondContact O-CA 3.34Å; K206-H233 PolarHBondContact NZ-O 3.36Å; H233-D235 IonicContact CE1-OD1 2.97Å; H233-D268 IonicContact CD2-OD1 2.78Å; H233-D268 IonicContact CD2-OD2 3.66Å; H233-D268 IonicContact CE1-OD2 3.35Å; H233-D268 IonicContact NE2-OD1 3.57Å; H233-D268 PolarHBondContact NE2-OD1 3.39Å; H233-D268 IonicContact NE2-OD2 3.79Å; H233-D268 PolarHBondContact NE2-OD2 3.08Å
234L98.8Very high97.8Very high0 Ų046.1 Ų46.10%026%0.257CS..EExtended strand (participates in β ladder)trans-127.9137.3180-59.2-176.7000110.2F176 C178 P181 G182 Y184 F186 K206 L232 D238 V240F176-L234 HydrophobicContact CD1-CD1 4.26Å; F176-L234 HydrophobicContact CE1-CD1 3.77Å; C178-L234 HydrophobicContact CB-CB 3.98Å; C178-L234 HydrophobicContact CB-CD1 4.15Å; P181-L234 VanDerWaalsContact CA-O 3.26Å; P181-L234 WeakPolarHBondContact CA-O 3.4Å; G182-L234 PolarHBondContact N-O 3.22Å; G182-L234 PolarHBondContact O-N 3.38Å; Y184-L234 HydrophobicContact CD2-CB 3.95Å; Y184-L234 HydrophobicContact CD2-CD1 3.73Å; Y184-L234 HydrophobicContact CD2-CG 3.88Å; Y184-L234 HydrophobicContact CE2-CB 4.12Å; Y184-L234 HydrophobicContact CE2-CD1 4.24Å; Y184-L234 HydrophobicContact CE2-CG 4.48Å; Y184-L234 HydrophobicContact CG-CD1 3.94Å; Y184-L234 HydrophobicContact CG-CG 4.45Å; F186-L234 HydrophobicContact CE2-CD1 3.82Å; F186-L234 HydrophobicContact CZ-CD1 3.66Å; K206-L234 HydrophobicContact CD-CD2 3.72Å; K206-L234 HydrophobicContact CG-CD2 4.16Å; L232-L234 HydrophobicContact CB-CD2 4.13Å; L234-D238 WeakPolarHBondContact CA-OD2 3.38Å; L234-D238 HydrophobicContact CB-CB 4.26Å; L234-D238 HydrophobicContact CD2-CB 4.18Å; L234-V240 HydrophobicContact CD1-CG2 3.92Å; L234-V240 HydrophobicContact CD2-CG2 3.82Å
235D98.7Very high97.6Very high88 Ų8846.3 Ų46.347%0.47126%0.258SS..  trans-89.6159.2167.6-68.2-51.5000110.4C178 H233 G237 D238C178-D235 WeakPolarHBondContact CB-O 3.42Å; C178-D235 PolarHBondContact SG-O 2.97Å; H233-D235 IonicContact CE1-OD1 2.97Å; D235-G237 PolarHBondContact O-N 3.49Å; D235-D238 PolarHBondContact N-OD2 3.02Å; D235-D238 VanDerWaalsContact O-CB 3.3Å; D235-D238 WeakPolarHBondContact O-CB 3.12Å; D235-D238 PolarHBondContact O-N 3.45Å
236A98Very high97.1Very high63 Ų6342.3 Ų42.352%0.52125%0.245SC..THydrogen-bonded Turntrans-60.3128.3174.800000110.4P181P181-A236 HydrophobicContact CG-CB 4.08Å
237G98.4Very high96.8Very high48 Ų4843.1 Ų43.150%0.49525%0.254SS..THydrogen-bonded Turntrans95.9-13.2-174.800000114.5C178 D235 E239C178-G237 PolarHBondContact O-N 2.68Å; D235-G237 PolarHBondContact O-N 3.49Å; G237-E239 PolarHBondContact O-N 3.29Å
238D98.8Very high96.5Very high17 Ų1744 Ų449%0.09125%0.252CS..  trans-61.5136.3175.4-77.3-14.5000111.2T177 C178 K206 N207 L234 D235T177-D238 WeakPolarHBondContact CA-O 3.35Å; C178-D238 HydrophobicContact CB-CB 4.16Å; C178-D238 WeakPolarHBondContact CB-O 3.07Å; C178-D238 PolarHBondContact N-O 3.43Å; K206-D238 VanDerWaalsContact CE-CG 3.46Å; K206-D238 WeakPolarHBondContact CE-OD2 3.33Å; K206-D238 IonicContact NZ-OD2 2.69Å; K206-D238 PolarHBondContact NZ-OD2 3.37Å; N207-D238 PolarHBondContact ND2-OD1 3.36Å; N207-D238 WeakPolarHBondContact OD1-CA 3.29Å; L234-D238 WeakPolarHBondContact CA-OD2 3.38Å; L234-D238 HydrophobicContact CB-CB 4.26Å; L234-D238 HydrophobicContact CD2-CB 4.18Å; D235-D238 PolarHBondContact N-OD2 3.02Å; D235-D238 VanDerWaalsContact O-CB 3.3Å; D235-D238 WeakPolarHBondContact O-CB 3.12Å; D235-D238 PolarHBondContact O-N 3.45Å
239E98.8Very high96.3Very high87 Ų8741 Ų4141%0.40724%0.236SC..EExtended strand (participates in β ladder)trans-107.1132.5179.1-66.6-172.9148.600110.8T175 F176 K206 N207 G237T175-E239 HydrophobicContact CG2-CB 3.78Å; T175-E239 HydrophobicContact CG2-CG 3.96Å; F176-E239 CarbonylContact O-C 3.14Å; F176-E239 WeakPolarHBondContact O-CA 3.06Å; K206-E239 VanDerWaalsContact CA-O 3.31Å; K206-E239 WeakPolarHBondContact CA-O 3.36Å; N207-E239 PolarHBondContact N-O 3.32Å; N207-E239 PolarHBondContact OD1-N 3.43Å; G237-E239 PolarHBondContact O-N 3.29Å
240V98.9Very high96.1Very high0 Ų039.8 Ų39.80%022%0.224CC..EExtended strand (participates in β ladder)trans-125.4127.2175.4-175.90000110F176 F186 L204 I205 K206 L234 F260F176-V240 HydrophobicContact CB-CB 4.36Å; F176-V240 WeakPolarHBondContact CB-O 3.17Å; F176-V240 HydrophobicContact CD1-CB 4.38Å; F176-V240 PolarHBondContact N-O 2.89Å; F176-V240 PolarHBondContact O-N 3.14Å; F186-V240 HydrophobicContact CD1-CG1 4.28Å; F186-V240 HydrophobicContact CD2-CG1 4.48Å; F186-V240 HydrophobicContact CE1-CB 4.34Å; F186-V240 HydrophobicContact CE1-CG1 4.19Å; F186-V240 HydrophobicContact CE2-CG1 4.4Å; F186-V240 HydrophobicContact CE2-CG2 4.24Å; F186-V240 HydrophobicContact CG-CG1 4.43Å; F186-V240 HydrophobicContact CZ-CB 4.23Å; F186-V240 HydrophobicContact CZ-CG1 4.27Å; F186-V240 HydrophobicContact CZ-CG2 4.08Å; L204-V240 HydrophobicContact CD1-CG1 4.05Å; L204-V240 HydrophobicContact CD2-CG1 3.67Å; L204-V240 HydrophobicContact CG-CG1 3.8Å; I205-V240 VanDerWaalsContact O-CA 3.25Å; I205-V240 WeakPolarHBondContact O-CA 3.38Å; K206-V240 HydrophobicContact CG-CG2 4.48Å; L234-V240 HydrophobicContact CD1-CG2 3.92Å; L234-V240 HydrophobicContact CD2-CG2 3.82Å; V240-F260 HydrophobicContact CG1-CZ 4.21Å
241F98.7Very high96Very high23 Ų2338.7 Ų38.710%0.10122%0.217CC..EExtended strand (participates in β ladder)trans-151.1166.117955.7-94.7000111.2I155 T175 I205 K243I155-F241 HydrophobicContact CB-CD2 4.35Å; I155-F241 HydrophobicContact CD1-CD1 4.45Å; I155-F241 HydrophobicContact CD1-CD2 3.95Å; I155-F241 HydrophobicContact CD1-CE1 4.4Å; I155-F241 HydrophobicContact CD1-CE2 3.89Å; I155-F241 HydrophobicContact CD1-CG 4.23Å; I155-F241 HydrophobicContact CD1-CZ 4.12Å; I155-F241 HydrophobicContact CG1-CD2 3.73Å; I155-F241 HydrophobicContact CG1-CE2 3.75Å; I155-F241 HydrophobicContact CG1-CG 4.42Å; I155-F241 HydrophobicContact CG1-CZ 4.45Å; I155-F241 HydrophobicContact CG2-CB 3.94Å; I155-F241 HydrophobicContact CG2-CD2 3.92Å; I155-F241 HydrophobicContact CG2-CG 4.12Å; T175-F241 HydrophobicContact CG2-CD1 4.28Å; I205-F241 HydrophobicContact CB-CD2 3.95Å; I205-F241 HydrophobicContact CB-CE1 4.3Å; I205-F241 HydrophobicContact CB-CE2 3.58Å; I205-F241 HydrophobicContact CB-CG 4.47Å; I205-F241 HydrophobicContact CB-CZ 3.78Å; I205-F241 HydrophobicContact CG1-CD2 4.14Å; I205-F241 HydrophobicContact CG1-CE2 3.7Å; I205-F241 HydrophobicContact CG1-CZ 4.3Å; I205-F241 HydrophobicContact CG2-CE1 4.1Å; I205-F241 HydrophobicContact CG2-CE2 3.85Å; I205-F241 HydrophobicContact CG2-CZ 3.54Å; I205-F241 PolarHBondContact N-O 3.21Å; I205-F241 PolarHBondContact O-N 3.15Å; I205-F241 VanDerWaalsContact O-N 3.12Å; F241-K243 HydrophobicContact CE2-CB 4.38Å
242I98.4Very high95.8Very high0 Ų035.4 Ų35.40%021%0.209CC..EExtended strand (participates in β ladder)trans-97.7128.6173.2-52.8-54.3000108.6L156 F158 Y188 V190 A202 D203 L204 L244 F260L156-I242 HydrophobicContact CB-CB 4.42Å; L156-I242 PolarHBondContact N-O 3.16Å; F158-I242 HydrophobicContact CE2-CB 3.99Å; F158-I242 HydrophobicContact CE2-CG1 3.84Å; F158-I242 HydrophobicContact CZ-CB 4.5Å; F158-I242 HydrophobicContact CZ-CG1 4.29Å; Y188-I242 HydrophobicContact CD1-CD1 3.48Å; Y188-I242 VanDerWaalsContact CD1-CD1 3.48Å; Y188-I242 HydrophobicContact CD2-CD1 4.41Å; Y188-I242 HydrophobicContact CE1-CD1 4.08Å; Y188-I242 HydrophobicContact CG-CD1 3.66Å; Y188-I242 HydrophobicContact CG-CG1 4.3Å; V190-I242 HydrophobicContact CG2-CG2 4.42Å; A202-I242 HydrophobicContact CB-CG2 4.26Å; D203-I242 CarbonylContact O-C 3.55Å; D203-I242 VanDerWaalsContact O-CA 3.29Å; D203-I242 WeakPolarHBondContact O-CA 3.35Å; L204-I242 HydrophobicContact CB-CD1 3.75Å; L204-I242 HydrophobicContact CD1-CD1 4.1Å; L204-I242 HydrophobicContact CG-CD1 4.03Å; I242-L244 HydrophobicContact CG2-CD2 4.44Å; I242-F260 HydrophobicContact CD1-CD2 4.11Å; I242-F260 HydrophobicContact CD1-CE2 3.93Å; I242-F260 HydrophobicContact CD1-CZ 4.22Å; I242-F260 HydrophobicContact CG1-CD1 4.2Å; I242-F260 HydrophobicContact CG1-CD2 4.07Å; I242-F260 HydrophobicContact CG1-CE1 4.37Å; I242-F260 HydrophobicContact CG1-CE2 4.25Å; I242-F260 HydrophobicContact CG1-CG 4.06Å; I242-F260 HydrophobicContact CG1-CZ 4.4Å
243K96.6Very high95.7Very high93 Ų9341.6 Ų41.640%0.40424%0.243SC..EExtended strand (participates in β ladder)trans-110.4135.9169.6-173.2-179.8176.6-170.90108.4D203 I205 F241D203-K243 PolarHBondContact N-O 2.86Å; D203-K243 PolarHBondContact O-N 2.83Å; I205-K243 HydrophobicContact CD1-CB 4.43Å; I205-K243 HydrophobicContact CG1-CB 3.83Å; F241-K243 HydrophobicContact CE2-CB 4.38Å
244L93.6Very high95.5Very high1 Ų140.4 Ų40.41%0.00524%0.243CC..EExtended strand (participates in β ladder)trans-94.1150.4172-61.5-179.9000110G152 D154 L156 V190 M192 W201 A202 I242 A249G152-L244 CarbonylContact C-O 3.52Å; G152-L244 CarbonylContact O-C 3.49Å; D154-L244 PolarHBondContact O-N 3.48Å; L156-L244 HydrophobicContact CB-CD1 4.32Å; L156-L244 HydrophobicContact CB-CG 4.13Å; L156-L244 HydrophobicContact CD1-CD1 3.98Å; L156-L244 HydrophobicContact CD2-CD1 4.08Å; L156-L244 HydrophobicContact CD2-CD2 4.07Å; L156-L244 HydrophobicContact CD2-CG 4.22Å; L156-L244 HydrophobicContact CG-CD1 4.35Å; V190-L244 HydrophobicContact CG1-CD2 4.02Å; M192-L244 HydrophobicContact CE-CB 4.4Å; M192-L244 HydrophobicContact CE-CD1 4.44Å; M192-L244 HydrophobicContact CE-CD2 3.83Å; M192-L244 HydrophobicContact CE-CG 4.42Å; M192-L244 HydrophobicContact SD-CD2 4.05Å; W201-L244 WeakPolarHBondContact O-CA 3.47Å; A202-L244 HydrophobicContact CB-CD2 3.89Å; I242-L244 HydrophobicContact CG2-CD2 4.44Å; L244-A249 HydrophobicContact CD1-CB 3.55Å
245D89.9Confident95.5Very high72 Ų7242.3 Ų42.339%0.38525%0.254SS..EExtended strand (participates in β ladder)trans-138.7123.6164.6-172.613.2000109.2G152 M200 W201G152-D245 CarbonylContact O-C 3.18Å; G152-D245 WeakPolarHBondContact O-CA 3.34Å; G152-D245 PolarHBondContact O-N 2.81Å; M200-D245 CarbonylContact C-O 3.58Å; W201-D245 HydrophobicContact CB-CB 4.28Å; W201-D245 HydrophobicContact CE3-CB 3.75Å; W201-D245 PolarHBondContact N-O 2.84Å; W201-D245 PolarHBondContact O-N 3.35Å
246G85.4Confident95.5Very high10 Ų1041.8 Ų41.810%0.10325%0.247CC..SBendtrans74130.5-174.800000113.5G152 M192 M200G152-G246 PolarHBondContact O-N 3.13Å; M192-G246 WeakPolarHBondContact CE-O 3.27Å; M200-G246 WeakPolarHBondContact CB-O 3.19Å; M200-G246 WeakPolarHBondContact CG-O 3.18Å
247G88.3Confident95.4Very high17 Ų1744 Ų4418%0.17524%0.242CC..SBendtrans80-165.2176.600000114.9G152 R193G152-G247 WeakPolarHBondContact CA-O 3.08Å; G152-G247 PolarHBondContact N-O 3.24Å; R193-G247 CarbonylContact O-C 3.53Å; R193-G247 VanDerWaalsContact O-CA 3.24Å; R193-G247 WeakPolarHBondContact O-CA 3.24Å
248K91.9Very high95.4Very high64 Ų6441.7 Ų41.728%0.27822%0.219SC..EExtended strand (participates in β ladder)trans-136.4133.1-172.9-176.8174.3-173.7144.40110.6P149 Q150 E151 M192 R193 H250P149-K248 HydrophobicContact CB-CD 4.23Å; P149-K248 HydrophobicContact CB-CG 4.31Å; Q150-K248 WeakPolarHBondContact O-CG 3.48Å; E151-K248 WeakPolarHBondContact OE1-CD 3.31Å; E151-K248 WeakPolarHBondContact OE1-CE 3.21Å; E151-K248 IonicContact OE1-NZ 3.11Å; E151-K248 PolarHBondContact OE1-NZ 3.07Å; M192-K248 CarbonylContact C-O 3.6Å; M192-K248 VanDerWaalsContact CA-O 3.27Å; M192-K248 WeakPolarHBondContact CA-O 3.49Å; R193-K248 PolarHBondContact N-O 3.12Å; R193-K248 PolarHBondContact O-N 3.26Å; K248-H250 PolarHBondContact O-CD2 3.4Å; K248-H250 VanDerWaalsContact O-CD2 3.24Å
249A94.9Very high95.4Very high0 Ų041.5 Ų41.50%022%0.218CC..EExtended strand (participates in β ladder)trans-85.1148.1175.700000112L146 P149 Q150 L156 V190 L191 L244L146-A249 HydrophobicContact CD2-CB 3.81Å; P149-A249 WeakPolarHBondContact CA-O 3.23Å; P149-A249 WeakPolarHBondContact CB-O 3.32Å; Q150-A249 PolarHBondContact N-O 3.04Å; Q150-A249 PolarHBondContact O-N 2.6Å; L156-A249 HydrophobicContact CD1-CB 3.86Å; L156-A249 HydrophobicContact CD2-CB 3.86Å; V190-A249 HydrophobicContact CG1-CB 3.57Å; L191-A249 CarbonylContact O-C 3.48Å; L191-A249 WeakPolarHBondContact O-CA 3.41Å; L244-A249 HydrophobicContact CD1-CB 3.55Å
250H95.8Very high95.4Very high29 Ų2937.3 Ų37.313%0.13420%0.199CC..  trans-130.3129.1-175.8-72.2-95.5000112.7L191 Y223 K248 S258L191-H250 HydrophobicContact CD2-CB 4.14Å; L191-H250 HydrophobicContact CG-CB 4.34Å; L191-H250 PolarHBondContact O-N 3.16Å; Y223-H250 HydrophobicContact CE1-CB 4.27Å; Y223-H250 AromaticContact CE1-CD2 3.56Å; Y223-H250 AromaticContact CE1-CG 3.75Å; Y223-H250 AromaticContact CE1-NE2 3.83Å; K248-H250 PolarHBondContact O-CD2 3.4Å; K248-H250 VanDerWaalsContact O-CD2 3.24Å; H250-S258 WeakPolarHBondContact O-CB 3.28Å; H250-S258 PolarHBondContact O-N 3.36Å; H250-S258 PolarHBondContact O-OG 3.45Å
251G96.4Very high95.4Very high1 Ų138.5 Ų38.51%0.0121%0.207CC..  trans-77.9-22.3174.900000115.2L146 N255 K256 Y257L146-G251 WeakPolarHBondContact O-CA 3.07Å; G251-N255 CarbonylContact O-C 3.52Å; G251-N255 WeakPolarHBondContact O-CA 2.97Å; G251-N255 PolarHBondContact O-N 3.4Å; G251-K256 PolarHBondContact O-N 3.14Å; G251-Y257 WeakPolarHBondContact O-CD2 3.29Å; G251-Y257 PolarHBondContact O-N 3.3Å; G251-Y257 VanDerWaalsContact O-N 3.16Å
252G94.6Very high95.5Very high36 Ų3637.5 Ų37.537%0.37120%0.203SC..  trans65.7-171.8-166.800000112.5S254G252-S254 VanDerWaalsContact C-N 3.32Å; G252-S254 PolarHBondContact O-N 3.02Å
253N95.2Very high95.5Very high145 Ų14541.6 Ų41.678%0.77522%0.221SC*.THydrogen-bonded Turntrans-70.4-24.5-176.962.4-18.7000114.4
254S95.8Very high95.6Very high55 Ų5538.2 Ų38.239%0.38521%0.207SC..THydrogen-bonded Turntrans-101.1-2.1-177.963.20000113.4G252 K256G252-S254 VanDerWaalsContact C-N 3.32Å; G252-S254 PolarHBondContact O-N 3.02Å; S254-K256 WeakPolarHBondContact O-CG 3.47Å; S254-K256 PolarHBondContact O-N 3.38Å; S254-K256 PolarHBondContact O-NZ 3.17Å; S254-K256 PolarHBondContact OG-N 3.47Å
255N98Very high95.8Very high40 Ų4041.1 Ų41.121%0.21422%0.222CC..SBendtrans64.68.9-171.1-43.7-30.5000114.4G145 L146 D160 G251G145-N255 CarbonylContact C-O 3.5Å; G145-N255 WeakPolarHBondContact CA-O 3.38Å; L146-N255 PolarHBondContact N-O 3.32Å; L146-N255 WeakPolarHBondContact O-CA 3.37Å; L146-N255 WeakPolarHBondContact O-CB 3.35Å; D160-N255 HydrophobicContact CB-CB 4.06Å; D160-N255 WeakPolarHBondContact OD2-CB 2.94Å; D160-N255 PolarHBondContact OD2-ND2 3.3Å; G251-N255 CarbonylContact O-C 3.52Å; G251-N255 WeakPolarHBondContact O-CA 2.97Å; G251-N255 PolarHBondContact O-N 3.4Å
256K98.1Very high96Very high77 Ų7745.6 Ų45.634%0.33524%0.235SC..  trans-107.23.9-171.7-55.3-53.7175.8-75.60115Y143 D160 G251 S254 T259Y143-K256 HydrophobicContact CE1-CD 4.44Å; D160-K256 IonicContact OD2-NZ 3.5Å; D160-K256 PolarHBondContact OD2-NZ 3.25Å; G251-K256 PolarHBondContact O-N 3.14Å; S254-K256 WeakPolarHBondContact O-CG 3.47Å; S254-K256 PolarHBondContact O-N 3.38Å; S254-K256 PolarHBondContact O-NZ 3.17Å; S254-K256 PolarHBondContact OG-N 3.47Å; K256-T259 VanDerWaalsContact O-CG2 3.32Å; K256-T259 WeakPolarHBondContact O-CG2 3.25Å
257Y97.8Very high96.6Very high108 Ų10846.9 Ų46.942%0.42425%0.245SC..SBendtrans-75.1-44176.8-75.3-96.6000111.6L191 Y225 G251L191-Y257 HydrophobicContact CD2-CD1 3.88Å; L191-Y257 HydrophobicContact CD2-CG 4.02Å; Y225-Y257 WeakPolarHBondContact CE1-O 3.45Å; Y225-Y257 WeakPolarHBondContact OH-CA 3.34Å; Y225-Y257 PolarHBondContact OH-O 3.06Å; G251-Y257 WeakPolarHBondContact O-CD2 3.29Å; G251-Y257 PolarHBondContact O-N 3.3Å; G251-Y257 VanDerWaalsContact O-N 3.16Å
258S98.2Very high96.8Very high0 Ų053.2 Ų53.20%028%0.275CS..SBendtrans-99.1123.9171-65.30000110.1G145 L146 N189 L191 H250G145-S258 WeakPolarHBondContact CA-O 3.37Å; L146-S258 PolarHBondContact N-O 3.38Å; N189-S258 CarbonylContact O-C 3.55Å; N189-S258 VanDerWaalsContact O-CA 3.25Å; N189-S258 WeakPolarHBondContact O-CA 3.31Å; L191-S258 PolarHBondContact N-OG 3.09Å; L191-S258 PolarHBondContact O-OG 3.4Å; H250-S258 WeakPolarHBondContact O-CB 3.28Å; H250-S258 PolarHBondContact O-N 3.36Å; H250-S258 PolarHBondContact O-OG 3.45Å
259T98.9Very high97.1Very high13 Ų1352.7 Ų52.78%0.0828%0.275CS..EExtended strand (participates in β ladder)trans-138.8148.9-172.657.30000112.8Y143 A144 F158 Y188 N189 K256Y143-T259 HydrophobicContact CE2-CG2 3.68Å; Y143-T259 WeakPolarHBondContact OH-CG2 3.46Å; A144-T259 WeakPolarHBondContact O-CA 3.4Å; F158-T259 VanDerWaalsContact CE1-C 3.48Å; Y188-T259 WeakPolarHBondContact CA-O 3.39Å; N189-T259 PolarHBondContact N-O 2.78Å; N189-T259 PolarHBondContact O-N 2.8Å; K256-T259 VanDerWaalsContact O-CG2 3.32Å; K256-T259 WeakPolarHBondContact O-CG2 3.25Å
260F98.9Very high97.2Very high0 Ų055.5 Ų55.50%029%0.289CS..EExtended strand (participates in β ladder)trans-136.3134.3170-176.9-145.9000109.8F142 A144 F158 Y169 F186 I187 L204 V240 I242F142-F260 HydrophobicContact CE2-CB 4.48Å; F142-F260 AromaticContact CE2-CD1 3.57Å; F142-F260 HydrophobicContact CE2-CD1 3.57Å; F142-F260 HydrophobicContact CE2-CD2 4.43Å; F142-F260 AromaticContact CE2-CE1 3.82Å; F142-F260 HydrophobicContact CE2-CE1 3.82Å; F142-F260 AromaticContact CE2-CG 3.89Å; F142-F260 HydrophobicContact CE2-CG 3.89Å; F142-F260 HydrophobicContact CE2-CZ 4.35Å; F142-F260 AromaticContact CZ-CD1 3.8Å; F142-F260 HydrophobicContact CZ-CD1 3.8Å; F142-F260 HydrophobicContact CZ-CD2 4.24Å; F142-F260 AromaticContact CZ-CE1 3.58Å; F142-F260 HydrophobicContact CZ-CE1 3.58Å; F142-F260 HydrophobicContact CZ-CE2 4.04Å; F142-F260 HydrophobicContact CZ-CG 4.12Å; F142-F260 AromaticContact CZ-CZ 3.71Å; F142-F260 HydrophobicContact CZ-CZ 3.71Å; A144-F260 PolarHBondContact N-O 3.4Å; A144-F260 PolarHBondContact O-N 3.05Å; F158-F260 HydrophobicContact CD1-CB 4.17Å; F158-F260 HydrophobicContact CD2-CB 3.59Å; F158-F260 HydrophobicContact CD2-CD1 4.21Å; F158-F260 HydrophobicContact CD2-CG 4.33Å; F158-F260 HydrophobicContact CE1-CB 4.1Å; F158-F260 HydrophobicContact CE2-CB 3.52Å; F158-F260 HydrophobicContact CE2-CD1 4.28Å; F158-F260 HydrophobicContact CE2-CG 4.17Å; F158-F260 HydrophobicContact CG-CB 3.91Å; F158-F260 HydrophobicContact CZ-CB 3.78Å; Y169-F260 AromaticContact CE2-CD1 3.82Å; Y169-F260 HydrophobicContact CE2-CD1 3.82Å; Y169-F260 HydrophobicContact CE2-CE1 4.07Å; F186-F260 HydrophobicContact CB-CE2 4.21Å; F186-F260 HydrophobicContact CD1-CE2 4Å; F186-F260 AromaticContact CD1-CZ 3.92Å; F186-F260 HydrophobicContact CD1-CZ 3.92Å; I187-F260 WeakPolarHBondContact O-CD2 3.4Å; L204-F260 HydrophobicContact CD1-CE2 4.1Å; L204-F260 HydrophobicContact CD1-CZ 4.44Å; V240-F260 HydrophobicContact CG1-CZ 4.21Å; I242-F260 HydrophobicContact CD1-CD2 4.11Å; I242-F260 HydrophobicContact CD1-CE2 3.93Å; I242-F260 HydrophobicContact CD1-CZ 4.22Å; I242-F260 HydrophobicContact CG1-CD1 4.2Å; I242-F260 HydrophobicContact CG1-CD2 4.07Å; I242-F260 HydrophobicContact CG1-CE1 4.37Å; I242-F260 HydrophobicContact CG1-CE2 4.25Å; I242-F260 HydrophobicContact CG1-CG 4.06Å; I242-F260 HydrophobicContact CG1-CZ 4.4Å
261S98.9Very high97.3Very high25 Ų2556.9 Ų56.918%0.17530%0.298CS..EExtended strand (participates in β ladder)trans-147.2159.4177.751.10000111.9F142 F186 I187F142-S261 VanDerWaalsContact O-CA 3.26Å; F142-S261 WeakPolarHBondContact O-CA 3.39Å; F142-S261 VanDerWaalsContact O-CB 3.23Å; F142-S261 WeakPolarHBondContact O-CB 3.22Å; F186-S261 WeakPolarHBondContact CA-O 3.47Å; I187-S261 WeakPolarHBondContact CG2-OG 3.3Å; I187-S261 PolarHBondContact N-O 2.95Å; I187-S261 PolarHBondContact O-N 3.38Å
262G98.8Very high97.3Very high1 Ų160.2 Ų60.21%0.0132%0.315CS..EExtended strand (participates in β ladder)trans-171.1163.717200000112A141 F142 F185A141-G262 CarbonylContact C-O 3.55Å; A141-G262 WeakPolarHBondContact CA-O 3.49Å; F142-G262 WeakPolarHBondContact CD1-O 3.12Å; F142-G262 PolarHBondContact N-O 2.96Å; F142-G262 PolarHBondContact O-N 3.01Å; F142-G262 VanDerWaalsContact O-N 3.15Å; F185-G262 CarbonylContact O-C 3.5Å; F185-G262 WeakPolarHBondContact O-CA 3.3Å
263F98.8Very high97.5Very high87 Ų8761.8 Ų61.838%0.38231%0.311SS..EExtended strand (participates in β ladder)trans-155.3156.4-179.556.7-88.6000111.2V140 A141 Y184 F185 L265V140-F263 VanDerWaalsContact O-CA 3.23Å; V140-F263 WeakPolarHBondContact O-CA 3.26Å; V140-F263 WeakPolarHBondContact O-CB 3.38Å; A141-F263 HydrophobicContact CB-CB 3.82Å; Y184-F263 WeakPolarHBondContact CA-O 3.49Å; F185-F263 HydrophobicContact CB-CE1 4.2Å; F185-F263 HydrophobicContact CB-CE2 4.27Å; F185-F263 HydrophobicContact CB-CZ 4.01Å; F185-F263 HydrophobicContact CD1-CD1 4.06Å; F185-F263 AromaticContact CD1-CE1 3.36Å; F185-F263 HydrophobicContact CD1-CE1 3.36Å; F185-F263 AromaticContact CD1-CZ 3.78Å; F185-F263 HydrophobicContact CD1-CZ 3.78Å; F185-F263 HydrophobicContact CE1-CE1 4.07Å; F185-F263 HydrophobicContact CG-CE1 4.11Å; F185-F263 HydrophobicContact CG-CZ 4.11Å; F185-F263 PolarHBondContact N-O 3.22Å; F185-F263 PolarHBondContact O-N 3.44Å; F263-L265 HydrophobicContact CD2-CD2 4.26Å; F263-L265 HydrophobicContact CE2-CD2 3.56Å; F263-L265 HydrophobicContact CE2-CG 4.35Å; F263-L265 HydrophobicContact CZ-CD2 4.41Å
264I98.5Very high97.6Very high22 Ų2256.2 Ų56.211%0.11328%0.28CS..EExtended strand (participates in β ladder)trans-73.7132173.1-165.2171.5000109.8P138 V140 I180 Y184 A267P138-I264 HydrophobicContact CB-CD1 4.25Å; V140-I264 HydrophobicContact CB-CB 4.13Å; V140-I264 HydrophobicContact CB-CG2 3.94Å; V140-I264 HydrophobicContact CG2-CG2 4.4Å; V140-I264 PolarHBondContact O-N 3.33Å; I180-I264 HydrophobicContact CG2-CD1 4.35Å; Y184-I264 HydrophobicContact CD1-CB 3.91Å; Y184-I264 HydrophobicContact CD1-CG1 4.34Å; Y184-I264 HydrophobicContact CE1-CB 3.55Å; Y184-I264 HydrophobicContact CE1-CD1 4.31Å; Y184-I264 HydrophobicContact CE1-CG1 3.94Å; Y184-I264 HydrophobicContact CE2-CD1 4.28Å; Y184-I264 HydrophobicContact CE2-CG1 4.17Å; I264-A267 HydrophobicContact CD1-CB 3.83Å
265L97.9Very high97.8Very high61 Ų6156.3 Ų56.332%0.31927%0.273SS..EExtended strand (participates in β ladder)trans-87.2-54.6170.1-68169.1000109.6T183 F185 I231 F263T183-L265 HydrophobicContact CG2-CD1 4.11Å; T183-L265 WeakPolarHBondContact O-CB 3.34Å; T183-L265 PolarHBondContact O-N 2.87Å; F185-L265 HydrophobicContact CB-CD1 4.21Å; F185-L265 HydrophobicContact CB-CG 4.32Å; I231-L265 HydrophobicContact CD1-CD1 4.23Å; I231-L265 HydrophobicContact CG1-CD1 4.33Å; I231-L265 HydrophobicContact CG2-CD1 4.04Å; F263-L265 HydrophobicContact CD2-CD2 4.26Å; F263-L265 HydrophobicContact CE2-CD2 3.56Å; F263-L265 HydrophobicContact CE2-CG 4.35Å; F263-L265 HydrophobicContact CZ-CD2 4.41Å
266Y95.4Very high97.7Very high166 Ų16657.5 Ų57.565%0.65128%0.277SS*.EExtended strand (participates in β ladder)trans-142.1134.8-178.2-46.3-66.3000109G182 T183G182-Y266 CarbonylContact C-O 3.46Å; G182-Y266 VanDerWaalsContact CA-O 3.24Å; G182-Y266 WeakPolarHBondContact CA-O 3.09Å; T183-Y266 PolarHBondContact N-O 3.07Å; T183-Y266 PolarHBondContact O-N 2.91Å
267A96.4Very high97.7Very high38 Ų3855.9 Ų55.931%0.31427%0.272SS..EExtended strand (participates in β ladder)trans-84.8151.4165.900000109.7P138 I180 I264P138-A267 HydrophobicContact CB-CB 4.01Å; P138-A267 HydrophobicContact CG-CB 3.6Å; I180-A267 HydrophobicContact CG2-CB 4.04Å; I264-A267 HydrophobicContact CD1-CB 3.83Å
268D93.9Very high97.7Very high150 Ų15051.2 Ų51.280%0.80226%0.259SS*.  trans-71.20176-62.7-20.5000113.1P181 G182 H233P181-D268 HydrophobicContact CB-CB 4.37Å; P181-D268 WeakPolarHBondContact CB-OD2 3.45Å; P181-D268 PolarHBondContact O-N 3.46Å; P181-D268 VanDerWaalsContact O-N 3.13Å; G182-D268 WeakPolarHBondContact CA-OD1 3.47Å; G182-D268 PolarHBondContact N-OD2 3.17Å; H233-D268 IonicContact CD2-OD1 2.78Å; H233-D268 IonicContact CD2-OD2 3.66Å; H233-D268 IonicContact CE1-OD2 3.35Å; H233-D268 IonicContact NE2-OD1 3.57Å; H233-D268 PolarHBondContact NE2-OD1 3.39Å; H233-D268 IonicContact NE2-OD2 3.79Å; H233-D268 PolarHBondContact NE2-OD2 3.08Å

Retrieved 268 of 268 residues in 162.6 ms (Link to these results)