A0A060YNF9_ONCMY Loading...

Transmembrane protein 106C

AlphaFold DB , UniProt , Accession A0A060YNF9, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 266 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
1M42.2Very low31.5Very low250 Ų250147.8 Ų147.8100%1.23278%0.775SS**  080.70-71.4167.1152.100105.7
2G35.5Very low31.1Very low63 Ų63144.9 Ų144.965%0.64978%0.777SS**  91.587.678.600000107
3T29.2Very low31.2Very low136 Ų136142.2 Ų142.283%0.83478%0.775SS**  49.2121.593.661.90000111.3
4Q30.3Very low30.9Very low170 Ų170144 Ų14479%0.79478%0.783SS**  179.3130.172-148.8171-23.300105.6
5W29.5Very low30.6Very low231 Ų231145.3 Ų145.388%0.87579%0.788SS**  49.912674.9-8751.4000111.1
6S29.6Very low30.3Very low79 Ų79146.1 Ų146.155%0.55279%0.79SS**  cis-175.8164.643.2-50.80000112.2
7R31.7Very low30.4Very low217 Ų217144.2 Ų144.282%0.81979%0.785SS**  trans69.2143.3133.1-91.1174.8160.3140.9-3.8119.3
8S29.5Very low30.3Very low83 Ų83143.2 Ų143.258%0.5879%0.786SS**  cis-153.2131.223.3-107.40000109
9E31.5Very low30.2Very low144 Ų144144.8 Ų144.867%0.67379%0.787SS**  89.9112.6105.3-85.1165.588.800113.3
10S30Very low30.1Very low101 Ų101144.7 Ų144.771%0.70679%0.791SS**  72.5132.278.3-50.70000110.2
11D27.9Very low29.9Very low152 Ų152140.5 Ų140.581%0.81378%0.782SS**  -170.617251.6-139.9-15.6000114.1
12S26.4Very low29.2Very low113 Ų113135.5 Ų135.579%0.7977%0.765SS**  trans98.680.6162.9-61.80000117.6
13S32.7Very low28.7Very low109 Ų109135.9 Ų135.976%0.76277%0.769SS**  trans-106.6131.7140.939.40000107.9
14L26.8Very low28.7Very low168 Ų168141.5 Ų141.588%0.8878%0.775SS**  trans-149105.9156.9-91.7-179.4000109.8
15L26.5Very low28.6Very low164 Ų164142 Ų14286%0.85978%0.777SS**  trans-77.4131.6151.4-87.2163.6000107.9
16L26.2Very low28.6Very low158 Ų158137.5 Ų137.583%0.82778%0.776SS**  trans-152118.3151.4-94.7171.1000108.5
17V30.7Very low28.6Very low114 Ų114136.5 Ų136.569%0.69178%0.778SS**  trans-87.3149.6159.4173.70000107.1E19V17-E19 HydrophobicContact CG1-CB 4.4Å
18P30.2Very low28.6Very low125 Ų125133.3 Ų133.381%0.81278%0.777SS**  -131.7138.7118.920.3-2.2000112.5
19E27.7Very low29Very low174 Ų174135.9 Ų135.981%0.81379%0.785SS**  trans-95.9133.2166.7-154.9-166141.700107.8V17V17-E19 HydrophobicContact CG1-CB 4.4Å
20V27.9Very low29.5Very low143 Ų143136.1 Ų136.187%0.86779%0.791SS**  trans-149.297.7157.4177.10000104.9
21G26.2Very low30.1Very low57 Ų57138.1 Ų138.159%0.58879%0.794SS**  97.3131.394.200000108.7
22T27Very low31Very low144 Ų144138.4 Ų138.488%0.88380%0.795SS**  cis-170.4136.431.2-37.80000105.6
23G25.8Very low31.9Very low71 Ų71136.6 Ų136.673%0.73278%0.782SS**  101.2108.5105.100000113.5
24W29.7Very low32.6Very low254 Ų254139.1 Ų139.196%0.96279%0.787SS**  trans-73.8134163.4-71.973.3000109.7
25Q28Very low33.6Very low180 Ų180137 Ų13784%0.84178%0.776SS**  trans167.4123.7130.8-95.4173.418.300114.7
26T29.6Very low34.7Very low137 Ų137132.5 Ų132.584%0.8477%0.769SS**  trans68.9131.8132.6-20.70000122.4
27G29.8Very low35.8Very low59 Ų59131.1 Ų131.161%0.60876%0.762SS**  trans124.492.5165.500000111.2
28D31.3Very low36.7Very low149 Ų149133.8 Ų133.880%0.79777%0.772SS**  76.912091.5-74.4-14.7000112.7
29D38Very low37.7Very low138 Ų138138.8 Ų138.874%0.73878%0.775SS**  trans55.9124.9148.5-59.2-31.4000117.6
30D41.2Very low38.8Very low148 Ų148136.9 Ų136.979%0.79177%0.766SS**  -172.7143.254.2-82.3-57.1000110.6
31D43.8Very low39.9Very low144 Ų144138.8 Ų138.877%0.7777%0.765SS**  trans43.687.1140.8-151.228.2000120.2S33D31-S33 PolarHBondContact O-N 2.86Å
32D46.3Very low41.2Very low157 Ų157143.7 Ų143.784%0.8478%0.778SS**  trans-73.573.2161.2-80.7-47.7000110.8L34D32-L34 PolarHBondContact O-N 3.47Å; D32-L34 VanDerWaalsContact O-N 3.12Å
33S44.3Very low42.7Very low76 Ų76142.5 Ų142.553%0.53177%0.765SS.*  trans-73.693.1162-177.80000109.1D31 D35D31-S33 PolarHBondContact O-N 2.86Å; S33-D35 PolarHBondContact O-N 3.46Å
34L48.8Very low44.2Very low162 Ų162142.2 Ų142.285%0.84876%0.756SS**  trans-76.357.2166.2-69.8171.4000110.5D32 G36D32-L34 PolarHBondContact O-N 3.47Å; D32-L34 VanDerWaalsContact O-N 3.12Å; L34-G36 PolarHBondContact O-N 3.01Å
35D46.1Very low45.4Very low124 Ų124141.7 Ų141.766%0.66375%0.754SS**  trans-74.282.9160.4-90.6-17.8000107.8S33 L37S33-D35 PolarHBondContact O-N 3.46Å; D35-L37 HydrophobicContact CB-CG 4.48Å; D35-L37 PolarHBondContact O-N 3.18Å
36G49.9Very low46.4Very low68 Ų68141.5 Ų141.570%0.70175%0.75SS**  trans-68.451.8171.600000112.9L34 D38L34-G36 PolarHBondContact O-N 3.01Å; G36-D38 VanDerWaalsContact C-N 3.28Å; G36-D38 PolarHBondContact O-N 2.72Å
37L49.8Very low47.5Very low130 Ų130140 Ų14068%0.68174%0.743SS**G310 helixtrans-77.1-9.3178.1-75178000113.7D35D35-L37 HydrophobicContact CB-CG 4.48Å; D35-L37 PolarHBondContact O-N 3.18Å
38D50.6Low48.6Very low169 Ų169145.6 Ų145.690%0.90475%0.747SS**G310 helixtrans-95.817.2-175.9-79.4-25.8000115.4G36G36-D38 VanDerWaalsContact C-N 3.28Å; G36-D38 PolarHBondContact O-N 2.72Å
39R51.1Low49.9Very low230 Ų230143.5 Ų143.587%0.86874%0.739SS**G310 helixtrans-12211.9173.3-95.8178.562.5131.6-0115.2E41R39-E41 VanDerWaalsContact C-N 3.32Å; R39-E41 PolarHBondContact O-N 2.97Å
40Q49.7Very low50.9Low134 Ų134142.9 Ų142.963%0.62673%0.732SS**G310 helixtrans-82.4-6.7-175.9-167.556.852.700113.9
41E52.1Low51.5Low184 Ų184144.8 Ų144.886%0.8673%0.734SS**G310 helixtrans-90-9.5-168.8-57.3-162160.400115.5R39R39-E41 VanDerWaalsContact C-N 3.32Å; R39-E41 PolarHBondContact O-N 2.97Å
42D51.9Low52.1Low159 Ų159143.3 Ų143.385%0.8573%0.73SS**G310 helixtrans-106.414.3-176.4-81-16000115.5A44D42-A44 PolarHBondContact O-N 2.84Å
43I59Low52.5Low120 Ų120137.9 Ų137.962%0.61571%0.711SS**  trans-82.5101.9172-68.7167.5000109R45I43-R45 PolarHBondContact O-N 2.95Å
44A57.9Low53Low65 Ų65146.3 Ų146.354%0.53773%0.731SS.*  trans-50.5107.9167.900000109.8D42 F46D42-A44 PolarHBondContact O-N 2.84Å; A44-F46 HydrophobicContact CB-CD2 4.28Å; A44-F46 HydrophobicContact CB-CE2 3.69Å; A44-F46 HydrophobicContact CB-CZ 4.11Å; A44-F46 WeakPolarHBondContact O-CD2 3.46Å; A44-F46 PolarHBondContact O-N 2.82Å
45R54.5Low53.3Low243 Ų243146.1 Ų146.192%0.91773%0.731SS**  trans-81.485.3-177.7-155.7156.2-170.6161.30.4108.8I43I43-R45 PolarHBondContact O-N 2.95Å
46F48.4Very low54Low175 Ų175143.6 Ų143.677%0.76872%0.723SS**PPolyproline II helixtrans-67.5127.3170.5-65.7-78.7000108.7A44 Y48A44-F46 HydrophobicContact CB-CD2 4.28Å; A44-F46 HydrophobicContact CB-CE2 3.69Å; A44-F46 HydrophobicContact CB-CZ 4.11Å; A44-F46 WeakPolarHBondContact O-CD2 3.46Å; A44-F46 PolarHBondContact O-N 2.82Å; F46-Y48 PolarHBondContact O-N 3.49Å
47P52.8Low54.6Low107 Ų107148 Ų14870%0.69573%0.729SS**PPolyproline II helixtrans-61.5125.6175.123.9-30.1000108.4V49P47-V49 WeakPolarHBondContact O-CG2 3.3Å; P47-V49 PolarHBondContact O-N 3.14Å
48Y52.3Low55.2Low175 Ų175146.3 Ų146.369%0.68672%0.724SS**PPolyproline II helixtrans-62.6124.7169.5178.5-107.1000108.2F46 E50F46-Y48 PolarHBondContact O-N 3.49Å; Y48-E50 HydrophobicContact CD1-CG 4.02Å; Y48-E50 HydrophobicContact CE1-CG 3.25Å; Y48-E50 WeakPolarHBondContact CE1-OE1 3.48Å
49V58.6Low55.4Low105 Ų105141 Ų14164%0.63670%0.7SS**  trans-119.2114.8178.5-127.10000108P47 F51P47-V49 WeakPolarHBondContact O-CG2 3.3Å; P47-V49 PolarHBondContact O-N 3.14Å; V49-F51 PolarHBondContact O-N 3.39Å
50E60Low55.9Low126 Ų126135.6 Ų135.659%0.58969%0.694SS**  trans-76.6103172.7-67.2179.7175.300109.1Y48 T52Y48-E50 HydrophobicContact CD1-CG 4.02Å; Y48-E50 HydrophobicContact CE1-CG 3.25Å; Y48-E50 WeakPolarHBondContact CE1-OE1 3.48Å; E50-T52 VanDerWaalsContact C-N 3.33Å; E50-T52 PolarHBondContact O-N 3.12Å; E50-T52 VanDerWaalsContact O-N 3.12Å
51F53.6Low56.5Low187 Ų187132.2 Ų132.282%0.8268%0.683SS**  trans-79.682.7167-92.8-92.5000109.1V49 G53V49-F51 PolarHBondContact O-N 3.39Å; F51-G53 PolarHBondContact O-N 3.23Å
52T57.2Low57Low114 Ų114124.8 Ų124.870%0.69965%0.651SS**  trans-75.179.9167.458.70000109.1E50E50-T52 VanDerWaalsContact C-N 3.33Å; E50-T52 PolarHBondContact O-N 3.12Å; E50-T52 VanDerWaalsContact O-N 3.12Å
53G53.5Low57.6Low42 Ų42124.4 Ų124.443%0.43364%0.644SS.*  trans-65.8145.3167.900000110.3F51 D55 S56F51-G53 PolarHBondContact O-N 3.23Å; G53-D55 PolarHBondContact O-N 3.3Å; G53-S56 PolarHBondContact O-N 2.84Å; G53-S56 PolarHBondContact O-OG 2.99Å
54R55Low58Low254 Ų254120.6 Ų120.696%0.95863%0.634SS**THydrogen-bonded Turntrans-56.4-7.8-173.8-93.5-179.9-174.9164.32.2116.4
55D55.7Low58.4Low157 Ų157121.9 Ų121.984%0.8464%0.635SS**THydrogen-bonded Turntrans-129.726.9177.2-61.1-47.3000113.1G53 I57G53-D55 PolarHBondContact O-N 3.3Å; D55-I57 PolarHBondContact O-N 2.91Å; D55-I57 VanDerWaalsContact O-N 3.15Å
56S61.1Low58.8Low71 Ų71112.9 Ų112.950%0.49762%0.619SS.*  trans-74.5106.5177.164.80000110.7G53 T58G53-S56 PolarHBondContact O-N 2.84Å; G53-S56 PolarHBondContact O-OG 2.99Å; S56-T58 PolarHBondContact O-N 3.15Å
57I61.8Low59.4Low162 Ų162112.1 Ų112.183%0.83162%0.617SS**PPolyproline II helixtrans-66.6116.7170-60.8165000107.5D55 C59D55-I57 PolarHBondContact O-N 2.91Å; D55-I57 VanDerWaalsContact O-N 3.15Å; I57-C59 PolarHBondContact O-N 3.38Å
58T61.4Low59.9Low94 Ų94110.3 Ų110.358%0.57760%0.601SS**PPolyproline II helixtrans-63.7128.5177.348.30000109.8S56 P60S56-T58 PolarHBondContact O-N 3.15Å; T58-P60 WeakPolarHBondContact O-CD 3.49Å
59C55Low60.4Low58 Ų58105.6 Ų105.639%0.39259%0.592SS.*PPolyproline II helixtrans-58.1121.8174.8176.80000109.2I57 T61 C62 Q63I57-C59 PolarHBondContact O-N 3.38Å; C59-T61 PolarHBondContact O-N 3.5Å; C59-T61 VanDerWaalsContact O-N 3.14Å; C59-C62 PolarHBondContact O-N 3.39Å; C59-Q63 WeakPolarHBondContact O-CA 3.18Å; C59-Q63 PolarHBondContact O-N 3.29Å
60P63.2Low60.4Low116 Ų116105.6 Ų105.675%0.75360%0.596SS**THydrogen-bonded Turntrans-64.5-22-175.925.1-33.5000112.6T58T58-P60 WeakPolarHBondContact O-CD 3.49Å
61T61Low60.3Low62 Ų62108.7 Ų108.738%0.3861%0.611SS.*THydrogen-bonded Turntrans-78.8-41.2-175.3-46.50000113.4C59 I68 L76C59-T61 PolarHBondContact O-N 3.5Å; C59-T61 VanDerWaalsContact O-N 3.14Å; T61-I68 HydrophobicContact CG2-CD1 4.26Å; T61-L76 HydrophobicContact CG2-CD2 3.36Å
62C62.2Low60.3Low28 Ų28104 Ų10419%0.18959%0.592CS.*THydrogen-bonded Turntrans-114.21.3-179.762.70000112.7C59 G64 T65 I68C59-C62 PolarHBondContact O-N 3.39Å; C62-G64 PolarHBondContact O-N 3.06Å; C62-T65 PolarHBondContact O-N 3.05Å; C62-T65 PolarHBondContact O-OG1 3.24Å; C62-I68 HydrophobicContact CB-CG1 4.46Å
63Q65Low60.1Low151 Ų151101.1 Ų101.171%0.70657%0.573SS**THydrogen-bonded Turntrans4926.2-176.6-58.9-177.314.500113.8C59C59-Q63 WeakPolarHBondContact O-CA 3.18Å; C59-Q63 PolarHBondContact O-N 3.29Å
64G67.1Low60Low40 Ų40106.1 Ų106.141%0.41259%0.59SS.*THydrogen-bonded Turntrans82.31.9-176.900000115.7C62C62-G64 PolarHBondContact O-N 3.06Å
65T66.8Low59.8Low92 Ų92101.5 Ų101.556%0.56458%0.579SS**SBendtrans-88.6-6.3-176.664.90000114.5C62 H67C62-T65 PolarHBondContact O-N 3.05Å; C62-T65 PolarHBondContact O-OG1 3.24Å; T65-H67 PolarHBondContact O-N 3.33Å; T65-H67 PolarHBondContact OG1-O 3.22Å
66G62.7Low59.6Low55 Ų5597.3 Ų97.357%0.56756%0.557SS**SBendtrans69.1-8-179.600000115.5
67H62.3Low59Low158 Ų15898.6 Ų98.673%0.73156%0.561SS**  trans-122.8136.8178.8-73.4-67.6000111T65T65-H67 PolarHBondContact O-N 3.33Å; T65-H67 PolarHBondContact OG1-O 3.22Å
68I62.7Low58.8Low69 Ų6995.9 Ų95.935%0.35456%0.563SS.*  trans-100.5119.7176.7-59.2167.8000107T61 C62 S70 V73T61-I68 HydrophobicContact CG2-CD1 4.26Å; C62-I68 HydrophobicContact CB-CG1 4.46Å; I68-S70 PolarHBondContact O-N 2.88Å; I68-V73 HydrophobicContact CG2-CG2 4.05Å
69P63.4Low58.4Low77 Ų7797.2 Ų97.250%0.557%0.566SS.*  trans-62.6134.4-17823.3-31.3000110.8E71 Q72 V73P69-E71 PolarHBondContact O-N 3.2Å; P69-Q72 PolarHBondContact O-N 2.84Å; P69-V73 WeakPolarHBondContact O-CG2 3.39Å
70S57.1Low58.3Low104 Ų10498.7 Ų98.773%0.72757%0.573SS**Hα-helixtrans-54.9-24.2-172.2-45.90000115I68 Q72 V73I68-S70 PolarHBondContact O-N 2.88Å; S70-Q72 VanDerWaalsContact C-N 3.3Å; S70-Q72 PolarHBondContact O-N 3.11Å; S70-V73 VanDerWaalsContact CA-CG2 3.49Å; S70-V73 PolarHBondContact O-N 2.91Å
71E58.5Low57.3Low191 Ų19196.4 Ų96.489%0.89356%0.558SS**Hα-helixtrans-70.3-21173.9-79.6-161.4148.100113.9P69P69-E71 PolarHBondContact O-N 3.2Å
72Q54.2Low56.6Low90 Ų90105.2 Ų105.242%0.42159%0.586SS.*Hα-helixtrans-103.9-4.8176.7-74.5179.2-7.600113.4P69 S70 N74 E75 L76P69-Q72 PolarHBondContact O-N 2.84Å; S70-Q72 VanDerWaalsContact C-N 3.3Å; S70-Q72 PolarHBondContact O-N 3.11Å; Q72-N74 VanDerWaalsContact C-N 3.26Å; Q72-N74 PolarHBondContact O-N 3.39Å; Q72-E75 PolarHBondContact O-N 2.71Å; Q72-L76 HydrophobicContact CB-CD1 4.14Å; Q72-L76 VanDerWaalsContact O-CD1 3.3Å; Q72-L76 WeakPolarHBondContact O-CD1 3.37Å; Q72-L76 PolarHBondContact O-N 3.16Å
73V52.8Low56Low52 Ų52110.3 Ų110.332%0.31561%0.612SS.*Hα-helixtrans-71.1-26.6-178.6-168.70000111.3I68 P69 S70 E75 L76 V77I68-V73 HydrophobicContact CG2-CG2 4.05Å; P69-V73 WeakPolarHBondContact O-CG2 3.39Å; S70-V73 VanDerWaalsContact CA-CG2 3.49Å; S70-V73 PolarHBondContact O-N 2.91Å; V73-E75 PolarHBondContact O-N 3.22Å; V73-L76 PolarHBondContact O-N 2.83Å; V73-V77 HydrophobicContact CG1-CG2 4.1Å
74N50Low55.5Low147 Ų147106 Ų10679%0.78659%0.593SS**THydrogen-bonded Turntrans-70.3-12.4171.9-70.2-19.1000113.4Q72Q72-N74 VanDerWaalsContact C-N 3.26Å; Q72-N74 PolarHBondContact O-N 3.39Å
75E51.3Low54.8Low157 Ų157112.1 Ų112.173%0.73461%0.611SS**THydrogen-bonded Turntrans-107.6-17.6176.2-168.7172.4-178.900112.2Q72 V73Q72-E75 PolarHBondContact O-N 2.71Å; V73-E75 PolarHBondContact O-N 3.22Å
76L52.3Low54Low70 Ų70119 Ų11937%0.36663%0.627SS.*SBendtrans-122.763.6-178.4-71.9102.9000113.3T61 Q72 V73T61-L76 HydrophobicContact CG2-CD2 3.36Å; Q72-L76 HydrophobicContact CB-CD1 4.14Å; Q72-L76 VanDerWaalsContact O-CD1 3.3Å; Q72-L76 WeakPolarHBondContact O-CD1 3.37Å; Q72-L76 PolarHBondContact O-N 3.16Å; V73-L76 PolarHBondContact O-N 2.83Å
77V47.3Very low53.4Low97 Ų97121.8 Ų121.859%0.58863%0.628SS**SBendtrans-140.594.6158.9176.60000107.4V73 L79V73-V77 HydrophobicContact CG1-CG2 4.1Å; V77-L79 PolarHBondContact O-N 2.91Å
78A58.9Low52.9Low105 Ų105121.4 Ų121.487%0.86862%0.62SS**  trans29.845.8167.800000116V80A78-V80 PolarHBondContact O-N 3.27Å; A78-V80 VanDerWaalsContact O-N 3.16Å
79L53.1Low52.9Low123 Ų123120.7 Ų120.764%0.64462%0.621SS**  trans-81.999.4168.1-69.6176.1000104.4V77 P81V77-L79 PolarHBondContact O-N 2.91Å; L79-P81 VanDerWaalsContact C-N 3.34Å; L79-P81 WeakPolarHBondContact O-CD 3.2Å
80V51.8Low52.9Low88 Ų88123.2 Ų123.253%0.53363%0.626SS.*  trans-47.2111.9148.1174.80000104.3A78 Y82 D84 L87A78-V80 PolarHBondContact O-N 3.27Å; A78-V80 VanDerWaalsContact O-N 3.16Å; V80-Y82 PolarHBondContact O-N 3.39Å; V80-D84 HydrophobicContact CG1-CB 4.17Å; V80-L87 HydrophobicContact CG1-CD1 3.67Å; V80-L87 HydrophobicContact CG1-CD2 3.82Å; V80-L87 HydrophobicContact CG1-CG 4.37Å
81P43.2Very low53.6Low69 Ų69126.9 Ų126.945%0.44862%0.623SS.*  trans-53.9135.1-170.114-24.8000108.3L79 N83 D84L79-P81 VanDerWaalsContact C-N 3.34Å; L79-P81 WeakPolarHBondContact O-CD 3.2Å; P81-N83 PolarHBondContact O-N 3.42Å; P81-D84 HydrophobicContact CG-CB 3.8Å; P81-D84 WeakPolarHBondContact O-CB 2.99Å; P81-D84 PolarHBondContact O-N 2.94Å
82Y46.1Very low54.6Low247 Ų247121.4 Ų121.497%0.96960%0.603SS**THydrogen-bonded Turntrans-54.3-18.9179.6-170.9-94.5000112.1V80V80-Y82 PolarHBondContact O-N 3.39Å
83N50.3Low55.8Low135 Ų135124 Ų12472%0.72261%0.613SS**THydrogen-bonded Turntrans-112.930178.5-151.624.1000114P81 Q85P81-N83 PolarHBondContact O-N 3.42Å; N83-Q85 PolarHBondContact O-N 3Å
84D54Low57.4Low59 Ų59126.6 Ų126.632%0.31663%0.625SS.*  trans-66.3115.4178-141.4-14.1000110.8V80 P81 R86 L87 R88V80-D84 HydrophobicContact CG1-CB 4.17Å; P81-D84 HydrophobicContact CG-CB 3.8Å; P81-D84 WeakPolarHBondContact O-CB 2.99Å; P81-D84 PolarHBondContact O-N 2.94Å; D84-R86 PolarHBondContact O-N 3.43Å; D84-R86 VanDerWaalsContact O-N 3.11Å; D84-L87 HydrophobicContact CB-CB 4.4Å; D84-L87 HydrophobicContact CB-CD1 4.2Å; D84-L87 PolarHBondContact O-N 2.96Å; D84-R88 PolarHBondContact O-N 3.39Å
85Q51.2Low59.3Low170 Ų170126.5 Ų126.579%0.79461%0.614SS**THydrogen-bonded Turntrans-68.5-14-173-154.3152.8-3000112.6N83N83-Q85 PolarHBondContact O-N 3Å
86R50.1Low61.2Low235 Ų235123.5 Ų123.589%0.88761%0.606SS**THydrogen-bonded Turntrans-76.3-29.1167.8-75.2-169.686.6-161.27.6113.7D84D84-R86 PolarHBondContact O-N 3.43Å; D84-R86 VanDerWaalsContact O-N 3.11Å
87L51.6Low63.1Low115 Ų115124.5 Ų124.560%0.60262%0.615SS**THydrogen-bonded Turntrans-84.9-10.6176.9-94.979.8000112.9V80 D84 P89V80-L87 HydrophobicContact CG1-CD1 3.67Å; V80-L87 HydrophobicContact CG1-CD2 3.82Å; V80-L87 HydrophobicContact CG1-CG 4.37Å; D84-L87 HydrophobicContact CB-CB 4.4Å; D84-L87 HydrophobicContact CB-CD1 4.2Å; D84-L87 PolarHBondContact O-N 2.96Å; L87-P89 WeakPolarHBondContact O-CD 3.34Å; L87-P89 WeakPolarHBondContact O-CG 3.36Å; L87-P89 VanDerWaalsContact O-N 3.12Å
88R51.6Low65.4Low149 Ų149124.2 Ų124.256%0.56261%0.61SS**  trans-75.298.1178.2-150.5175.6-168.5-1704.7109.2D84 Q90D84-R88 PolarHBondContact O-N 3.39Å; R88-Q90 HydrophobicContact CG-CG 4.2Å; R88-Q90 PolarHBondContact O-N 3.49Å
89P61.8Low67.1Low55 Ų55122.5 Ų122.536%0.35759%0.591SS.*  trans-86.562.6-169.617.43.2000107.8L87 R91 T92 K93L87-P89 WeakPolarHBondContact O-CD 3.34Å; L87-P89 WeakPolarHBondContact O-CG 3.36Å; L87-P89 VanDerWaalsContact O-N 3.12Å; P89-R91 VanDerWaalsContact C-N 3.25Å; P89-R91 PolarHBondContact O-N 3.49Å; P89-T92 WeakPolarHBondContact CA-OG1 3.42Å; P89-T92 WeakPolarHBondContact CB-OG1 2.93Å; P89-T92 PolarHBondContact O-N 2.94Å; P89-K93 WeakPolarHBondContact O-CG 3.37Å; P89-K93 PolarHBondContact O-N 3.33Å
90Q62.8Low69.2Low130 Ų130118.9 Ų118.961%0.60758%0.58SS**Hα-helixtrans-62.5-39.2-177.8-70.2-171-12.800110.7R88 L94R88-Q90 HydrophobicContact CG-CG 4.2Å; R88-Q90 PolarHBondContact O-N 3.49Å; Q90-L94 PolarHBondContact O-N 2.82Å
91R72.6Confident71.3Confident180 Ų180118 Ų11868%0.67957%0.574SS**Hα-helixtrans-70.5-41.3174.4-62.3-72.1-178.4172.9-1.2111.6P89 K93 L94 Y95P89-R91 VanDerWaalsContact C-N 3.25Å; P89-R91 PolarHBondContact O-N 3.49Å; R91-K93 PolarHBondContact O-N 3.18Å; R91-L94 WeakPolarHBondContact O-CB 3.24Å; R91-L94 PolarHBondContact O-N 3.21Å; R91-Y95 VanDerWaalsContact C-CD2 3.5Å; R91-Y95 HydrophobicContact CB-CD2 4.31Å; R91-Y95 HydrophobicContact CB-CE2 3.86Å; R91-Y95 WeakPolarHBondContact O-CD2 3.49Å; R91-Y95 PolarHBondContact O-N 2.98Å
92T79Confident73.9Confident77 Ų77119.6 Ų119.647%0.47258%0.578SS.*Hα-helixtrans-67.5-36.5-178.8-12.10000112.5P89 Y95 V96P89-T92 WeakPolarHBondContact CA-OG1 3.42Å; P89-T92 WeakPolarHBondContact CB-OG1 2.93Å; P89-T92 PolarHBondContact O-N 2.94Å; T92-Y95 PolarHBondContact O-N 2.92Å; T92-V96 WeakPolarHBondContact O-CB 3.29Å; T92-V96 VanDerWaalsContact O-CG2 3.24Å; T92-V96 WeakPolarHBondContact O-CG2 3.49Å; T92-V96 PolarHBondContact O-N 3.5Å
93K80.7Confident76.3Confident144 Ų144111.8 Ų111.863%0.62656%0.559SS**Hα-helixtrans-60.3-44.4170-71.8-179-178-170.70111.8P89 R91 V96 V97P89-K93 WeakPolarHBondContact O-CG 3.37Å; P89-K93 PolarHBondContact O-N 3.33Å; R91-K93 PolarHBondContact O-N 3.18Å; K93-V96 PolarHBondContact O-N 3.47Å; K93-V97 WeakPolarHBondContact O-CB 3.41Å; K93-V97 VanDerWaalsContact O-CG2 3.29Å; K93-V97 WeakPolarHBondContact O-CG2 2.94Å; K93-V97 PolarHBondContact O-N 2.87Å
94L85.8Confident78.5Confident106 Ų106111 Ų11156%0.55555%0.554SS**Hα-helixtrans-62-44.9175.4-179.770.2000111.6Q90 R91 V96 V97 L98Q90-L94 PolarHBondContact O-N 2.82Å; R91-L94 WeakPolarHBondContact O-CB 3.24Å; R91-L94 PolarHBondContact O-N 3.21Å; L94-V96 PolarHBondContact O-N 2.91Å; L94-V97 PolarHBondContact O-N 3.25Å; L94-L98 WeakPolarHBondContact O-CB 3.35Å; L94-L98 PolarHBondContact O-N 3.4Å
95Y88.9Confident80.6Confident146 Ų146112.6 Ų112.657%0.57356%0.562SS**Hα-helixtrans-63.3-40.4178.1-69.1-60.5000112.7R91 T92 L98 S99R91-Y95 VanDerWaalsContact C-CD2 3.5Å; R91-Y95 HydrophobicContact CB-CD2 4.31Å; R91-Y95 HydrophobicContact CB-CE2 3.86Å; R91-Y95 WeakPolarHBondContact O-CD2 3.49Å; R91-Y95 PolarHBondContact O-N 2.98Å; T92-Y95 PolarHBondContact O-N 2.92Å; Y95-L98 PolarHBondContact O-N 3.39Å; Y95-S99 WeakPolarHBondContact O-CB 3.3Å; Y95-S99 PolarHBondContact O-N 2.88Å; Y95-S99 PolarHBondContact O-OG 3.47Å
96V91.8Very high82.8Confident93 Ų93107 Ų10756%0.56455%0.545SS*.Hα-helixtrans-67.9-41.1177172.60000111.4T92 K93 L94 S99 A100T92-V96 WeakPolarHBondContact O-CB 3.29Å; T92-V96 VanDerWaalsContact O-CG2 3.24Å; T92-V96 WeakPolarHBondContact O-CG2 3.49Å; T92-V96 PolarHBondContact O-N 3.5Å; K93-V96 PolarHBondContact O-N 3.47Å; L94-V96 PolarHBondContact O-N 2.91Å; V96-S99 WeakPolarHBondContact CA-OG 3.19Å; V96-S99 PolarHBondContact O-OG 3.44Å; V96-A100 WeakPolarHBondContact O-CB 3.49Å; V96-A100 PolarHBondContact O-N 2.9Å
97V92.7Very high85Confident91 Ų9198.6 Ų98.655%0.55252%0.522SS*.Hα-helixtrans-67-43.6175.4171.60000110.6K93 L94 S99 A100 V101K93-V97 WeakPolarHBondContact O-CB 3.41Å; K93-V97 VanDerWaalsContact O-CG2 3.29Å; K93-V97 WeakPolarHBondContact O-CG2 2.94Å; K93-V97 PolarHBondContact O-N 2.87Å; L94-V97 PolarHBondContact O-N 3.25Å; V97-S99 VanDerWaalsContact C-N 3.34Å; V97-S99 PolarHBondContact O-N 3.3Å; V97-A100 PolarHBondContact O-N 2.87Å; V97-V101 HydrophobicContact CG1-CG2 4.36Å; V97-V101 VanDerWaalsContact O-CG2 3.3Å; V97-V101 WeakPolarHBondContact O-CG2 3.29Å; V97-V101 PolarHBondContact O-N 3.12Å
98L94.5Very high87.1Confident92 Ų9296 Ų9648%0.48251%0.514SS..Hα-helixtrans-61.8-43177.7-17569.3000111.3L94 Y95 V101 L102L94-L98 WeakPolarHBondContact O-CB 3.35Å; L94-L98 PolarHBondContact O-N 3.4Å; Y95-L98 PolarHBondContact O-N 3.39Å; L98-V101 PolarHBondContact O-N 2.79Å; L98-L102 HydrophobicContact CG-CD1 4.12Å; L98-L102 WeakPolarHBondContact O-CB 3.49Å; L98-L102 VanDerWaalsContact O-CG 3.29Å; L98-L102 WeakPolarHBondContact O-CG 3.3Å; L98-L102 PolarHBondContact O-N 3.29Å
99S95.3Very high89.2Confident68 Ų6893.2 Ų93.248%0.47651%0.51SS..Hα-helixtrans-65.7-40.817768.30000111.8Y95 V96 V97 L102 C103Y95-S99 WeakPolarHBondContact O-CB 3.3Å; Y95-S99 PolarHBondContact O-N 2.88Å; Y95-S99 PolarHBondContact O-OG 3.47Å; V96-S99 WeakPolarHBondContact CA-OG 3.19Å; V96-S99 PolarHBondContact O-OG 3.44Å; V97-S99 VanDerWaalsContact C-N 3.34Å; V97-S99 PolarHBondContact O-N 3.3Å; S99-L102 PolarHBondContact O-N 2.73Å; S99-C103 WeakPolarHBondContact O-CB 3.34Å; S99-C103 PolarHBondContact O-N 3.26Å
100A96.7Very high90.7Very high48 Ų4894.7 Ų94.740%0.39752%0.517SS..Hα-helixtrans-61.4-46.3174.200000111.7V96 V97 C103 L104V96-A100 WeakPolarHBondContact O-CB 3.49Å; V96-A100 PolarHBondContact O-N 2.9Å; V97-A100 PolarHBondContact O-N 2.87Å; A100-C103 PolarHBondContact O-N 3.24Å; A100-L104 WeakPolarHBondContact O-CG 3.25Å; A100-L104 PolarHBondContact O-N 2.99Å
101V96.9Very high92.1Very high68 Ų6892.7 Ų92.741%0.41251%0.514SS..Hα-helixtrans-62.3-45.9177.3170.70000111.2V97 L98 C103 L104 L105V97-V101 HydrophobicContact CG1-CG2 4.36Å; V97-V101 VanDerWaalsContact O-CG2 3.3Å; V97-V101 WeakPolarHBondContact O-CG2 3.29Å; V97-V101 PolarHBondContact O-N 3.12Å; L98-V101 PolarHBondContact O-N 2.79Å; V101-C103 VanDerWaalsContact C-N 3.3Å; V101-C103 PolarHBondContact O-N 2.95Å; V101-L104 PolarHBondContact O-N 3.49Å; V101-L105 HydrophobicContact CG1-CD1 3.96Å; V101-L105 HydrophobicContact CG1-CG 4.34Å; V101-L105 WeakPolarHBondContact O-CB 3.41Å; V101-L105 VanDerWaalsContact O-CG 3.3Å; V101-L105 WeakPolarHBondContact O-CG 3.34Å; V101-L105 PolarHBondContact O-N 2.92Å
102L97.1Very high93Very high103 Ų10389.3 Ų89.354%0.53950%0.504SS..Hα-helixtrans-61.1-39.5177-74.7170.1000112L98 S99 L105 A106L98-L102 HydrophobicContact CG-CD1 4.12Å; L98-L102 WeakPolarHBondContact O-CB 3.49Å; L98-L102 VanDerWaalsContact O-CG 3.29Å; L98-L102 WeakPolarHBondContact O-CG 3.3Å; L98-L102 PolarHBondContact O-N 3.29Å; S99-L102 PolarHBondContact O-N 2.73Å; L102-L105 PolarHBondContact O-N 3.46Å; L102-A106 WeakPolarHBondContact O-CB 3.36Å; L102-A106 PolarHBondContact O-N 3.43Å
103C97Very high93.6Very high84 Ų8490 Ų9057%0.56850%0.501SS*.Hα-helixtrans-65.6-43.4175.7-173.10000112S99 A100 V101 L105 A106 S107S99-C103 WeakPolarHBondContact O-CB 3.34Å; S99-C103 PolarHBondContact O-N 3.26Å; A100-C103 PolarHBondContact O-N 3.24Å; V101-C103 VanDerWaalsContact C-N 3.3Å; V101-C103 PolarHBondContact O-N 2.95Å; C103-L105 PolarHBondContact O-N 2.89Å; C103-A106 PolarHBondContact O-N 2.87Å; C103-S107 WeakPolarHBondContact O-CB 3.39Å; C103-S107 PolarHBondContact O-N 2.95Å; C103-S107 PolarHBondContact O-OG 2.94Å
104L97.1Very high94Very high118 Ų11887.1 Ų87.162%0.61849%0.492SS*.Hα-helixtrans-62.5-42.1175-71.1175.5000111.7A100 V101 S107 S108A100-L104 WeakPolarHBondContact O-CG 3.25Å; A100-L104 PolarHBondContact O-N 2.99Å; V101-L104 PolarHBondContact O-N 3.49Å; L104-S107 WeakPolarHBondContact CA-OG 3.36Å; L104-S107 PolarHBondContact O-OG 3.41Å; L104-S108 VanDerWaalsContact O-CB 3.25Å; L104-S108 WeakPolarHBondContact O-CB 3.39Å; L104-S108 PolarHBondContact O-N 3.29Å; L104-S108 PolarHBondContact O-OG 2.86Å
105L97.2Very high94.2Very high93 Ų9389 Ų8949%0.48750%0.496SS..Hα-helixtrans-63.1-48.8175.3-70.8173.4000111.1V101 L102 C103 S107 S108 L109V101-L105 HydrophobicContact CG1-CD1 3.96Å; V101-L105 HydrophobicContact CG1-CG 4.34Å; V101-L105 WeakPolarHBondContact O-CB 3.41Å; V101-L105 VanDerWaalsContact O-CG 3.3Å; V101-L105 WeakPolarHBondContact O-CG 3.34Å; V101-L105 PolarHBondContact O-N 2.92Å; L102-L105 PolarHBondContact O-N 3.46Å; C103-L105 PolarHBondContact O-N 2.89Å; L105-S107 PolarHBondContact O-N 3.37Å; L105-S108 PolarHBondContact O-N 2.89Å; L105-S108 PolarHBondContact O-OG 2.96Å; L105-L109 WeakPolarHBondContact O-CG 3.33Å; L105-L109 PolarHBondContact O-N 3.5Å
106A96.9Very high94.2Very high53 Ų5383.9 Ų83.944%0.43848%0.48SS..Hα-helixtrans-59.9-46.8178.400000112.2L102 C103 L109 V110L102-A106 WeakPolarHBondContact O-CB 3.36Å; L102-A106 PolarHBondContact O-N 3.43Å; C103-A106 PolarHBondContact O-N 2.87Å; A106-L109 PolarHBondContact O-N 2.95Å; A106-V110 WeakPolarHBondContact O-CG2 3.34Å; A106-V110 PolarHBondContact O-N 2.83Å
107S97.1Very high94.1Very high57 Ų5784 Ų8440%0.39947%0.471SS..Hα-helixtrans-64.1-40.917755.30000112.3C103 L104 L105 L109 V110 V111C103-S107 WeakPolarHBondContact O-CB 3.39Å; C103-S107 PolarHBondContact O-N 2.95Å; C103-S107 PolarHBondContact O-OG 2.94Å; L104-S107 WeakPolarHBondContact CA-OG 3.36Å; L104-S107 PolarHBondContact O-OG 3.41Å; L105-S107 PolarHBondContact O-N 3.37Å; S107-L109 VanDerWaalsContact C-N 3.33Å; S107-L109 PolarHBondContact O-N 3.31Å; S107-V110 PolarHBondContact O-N 3.41Å; S107-V111 WeakPolarHBondContact O-CG2 3.07Å; S107-V111 PolarHBondContact O-N 3.43Å
108S95.7Very high93.8Very high61 Ų6183.3 Ų83.343%0.42747%0.47SS..Hα-helixtrans-62.5-38.9175.674.60000112.5L104 L105 V111 F112L104-S108 VanDerWaalsContact O-CB 3.25Å; L104-S108 WeakPolarHBondContact O-CB 3.39Å; L104-S108 PolarHBondContact O-N 3.29Å; L104-S108 PolarHBondContact O-OG 2.86Å; L105-S108 PolarHBondContact O-N 2.89Å; L105-S108 PolarHBondContact O-OG 2.96Å; S108-V111 PolarHBondContact O-N 2.94Å; S108-F112 VanDerWaalsContact O-CB 3.31Å; S108-F112 WeakPolarHBondContact O-CB 3.34Å; S108-F112 PolarHBondContact O-N 2.95Å
109L95.1Very high93.7Very high91 Ų9179.3 Ų79.348%0.47645%0.449SS..Hα-helixtrans-64.7-46.4175.5-74164.4000110.8L105 A106 S107 V111 F112 F113L105-L109 WeakPolarHBondContact O-CG 3.33Å; L105-L109 PolarHBondContact O-N 3.5Å; A106-L109 PolarHBondContact O-N 2.95Å; S107-L109 VanDerWaalsContact C-N 3.33Å; S107-L109 PolarHBondContact O-N 3.31Å; L109-V111 VanDerWaalsContact C-N 3.32Å; L109-V111 PolarHBondContact O-N 3.19Å; L109-F112 PolarHBondContact O-N 3.29Å; L109-F113 HydrophobicContact CB-CD2 4.43Å; L109-F113 HydrophobicContact CB-CE2 4.34Å; L109-F113 HydrophobicContact CD2-CE2 4Å; L109-F113 WeakPolarHBondContact O-CD2 3.31Å; L109-F113 PolarHBondContact O-N 3.01Å
110V93.8Very high93.6Very high85 Ų8581.7 Ų81.752%0.51545%0.454SS..Hα-helixtrans-57.7-46.7176.7172.20000110.6A106 S107 L114A106-V110 WeakPolarHBondContact O-CG2 3.34Å; A106-V110 PolarHBondContact O-N 2.83Å; S107-V110 PolarHBondContact O-N 3.41Å; V110-L114 HydrophobicContact CG1-CD1 3.77Å; V110-L114 HydrophobicContact CG1-CG 4.45Å; V110-L114 VanDerWaalsContact O-CB 3.3Å; V110-L114 WeakPolarHBondContact O-CB 3.35Å; V110-L114 WeakPolarHBondContact O-CG 3.47Å; V110-L114 PolarHBondContact O-N 3.31Å
111V92.1Very high93.5Very high89 Ų8980.4 Ų80.454%0.53944%0.442SS..Hα-helixtrans-62.5-47.8175.9174.70000110.5S107 S108 L109 F113 L114 F115S107-V111 WeakPolarHBondContact O-CG2 3.07Å; S107-V111 PolarHBondContact O-N 3.43Å; S108-V111 PolarHBondContact O-N 2.94Å; L109-V111 VanDerWaalsContact C-N 3.32Å; L109-V111 PolarHBondContact O-N 3.19Å; V111-F113 VanDerWaalsContact C-N 3.33Å; V111-F113 PolarHBondContact O-N 3.44Å; V111-L114 PolarHBondContact O-N 3.44Å; V111-F115 HydrophobicContact CG1-CB 4.47Å; V111-F115 WeakPolarHBondContact O-CA 3.43Å; V111-F115 WeakPolarHBondContact O-CB 3.48Å; V111-F115 PolarHBondContact O-N 3Å
112F91.9Very high93.3Very high109 Ų10982.9 Ų82.948%0.47845%0.449SS..Hα-helixtrans-58.5-40.5-179177.6-97000113.6S108 L109 F155S108-F112 VanDerWaalsContact O-CB 3.31Å; S108-F112 WeakPolarHBondContact O-CB 3.34Å; S108-F112 PolarHBondContact O-N 2.95Å; L109-F112 PolarHBondContact O-N 3.29Å; F112-F155 AromaticContact CE1-CE2 3.98Å; F112-F155 HydrophobicContact CE1-CE2 3.98Å; F112-F155 HydrophobicContact CE1-CZ 4.12Å; F112-F155 HydrophobicContact CZ-CE2 4.5Å
113F91.3Very high93.1Very high91 Ų9179.8 Ų79.840%0.39943%0.433SS..Hα-helixtrans-78.3-34.2179.8-72.3-63.6000113.5L109 V111 F155L109-F113 HydrophobicContact CB-CD2 4.43Å; L109-F113 HydrophobicContact CB-CE2 4.34Å; L109-F113 HydrophobicContact CD2-CE2 4Å; L109-F113 WeakPolarHBondContact O-CD2 3.31Å; L109-F113 PolarHBondContact O-N 3.01Å; V111-F113 VanDerWaalsContact C-N 3.33Å; V111-F113 PolarHBondContact O-N 3.44Å; F113-F155 HydrophobicContact CD1-CB 4.3Å; F113-F155 HydrophobicContact CD1-CD1 4.11Å; F113-F155 AromaticContact CD1-CD2 3.81Å; F113-F155 HydrophobicContact CD1-CD2 3.81Å; F113-F155 HydrophobicContact CD1-CE1 4.38Å; F113-F155 HydrophobicContact CD1-CE2 4.1Å; F113-F155 AromaticContact CD1-CG 3.82Å; F113-F155 HydrophobicContact CD1-CG 3.82Å; F113-F155 HydrophobicContact CD1-CZ 4.38Å; F113-F155 HydrophobicContact CE1-CD1 4.27Å; F113-F155 HydrophobicContact CE1-CE1 4.22Å; F113-F155 HydrophobicContact CE1-CE2 4.49Å; F113-F155 HydrophobicContact CE1-CG 4.43Å; F113-F155 HydrophobicContact CE1-CZ 4.33Å
114L89.1Confident92.8Very high84 Ų8479.1 Ų79.144%0.4442%0.424SS..Hα-helixtrans-95.8-12.8-176.2-60.7-176.8000113.7V110 V111 P116 M235V110-L114 HydrophobicContact CG1-CD1 3.77Å; V110-L114 HydrophobicContact CG1-CG 4.45Å; V110-L114 VanDerWaalsContact O-CB 3.3Å; V110-L114 WeakPolarHBondContact O-CB 3.35Å; V110-L114 WeakPolarHBondContact O-CG 3.47Å; V110-L114 PolarHBondContact O-N 3.31Å; V111-L114 PolarHBondContact O-N 3.44Å; L114-P116 WeakPolarHBondContact O-CD 3.5Å; L114-M235 HydrophobicContact CD2-CE 3.94Å
115F89.8Confident92.4Very high144 Ų14473.7 Ų73.763%0.63240%0.396SS*.SBendtrans-67.2118178.7-165-94.7000109.4V111 R117V111-F115 HydrophobicContact CG1-CB 4.47Å; V111-F115 WeakPolarHBondContact O-CA 3.43Å; V111-F115 WeakPolarHBondContact O-CB 3.48Å; V111-F115 PolarHBondContact O-N 3Å; F115-R117 PolarHBondContact O-N 2.83Å
116P88.2Confident92.1Very high39 Ų3969.9 Ų69.925%0.25338%0.376SS..PPolyproline II helixtrans-72.5123.9-169.928.4-34000110.7L114 F156 Y234L114-P116 WeakPolarHBondContact O-CD 3.5Å; P116-F156 HydrophobicContact CB-CZ 4.11Å; P116-Y234 HydrophobicContact CB-CD2 4.22Å; P116-Y234 HydrophobicContact CB-CE2 3.4Å; P116-Y234 VanDerWaalsContact CB-CE2 3.4Å; P116-Y234 HydrophobicContact CG-CE2 4.14Å
117R89.8Confident91.8Very high96 Ų9671.5 Ų71.536%0.36237%0.371SS..PPolyproline II helixtrans-88.7144.7168-60.5179.3-178.8179.1-2.3109.1F115 V119 S153 N154F115-R117 PolarHBondContact O-N 2.83Å; R117-V119 PolarHBondContact O-N 3.01Å; R117-S153 WeakPolarHBondContact CB-OG 3.45Å; R117-S153 WeakPolarHBondContact CD-O 3.3Å; R117-S153 PolarHBondContact NH1-O 3.33Å; R117-N154 WeakPolarHBondContact CA-OD1 3.07Å; R117-N154 WeakPolarHBondContact CB-OD1 3.34Å; R117-N154 PolarHBondContact N-OD1 3.3Å; R117-N154 PolarHBondContact O-ND2 2.75Å; R117-N154 PolarHBondContact O-OD1 2.77Å
118S87.2Confident91.5Very high76 Ų7670.5 Ų70.553%0.53136%0.364SS..PPolyproline II helixtrans-63.2131.9176.855.10000110.7M120S118-M120 PolarHBondContact O-N 2.96Å
119V91.9Very high91.4Very high8 Ų867.7 Ų67.75%0.04834%0.344CS..PPolyproline II helixtrans-73.9124.8169.5-1800000108.2R117 V158 I185 N241R117-V119 PolarHBondContact O-N 3.01Å; V119-V158 HydrophobicContact CG2-CB 4.36Å; V119-V158 HydrophobicContact CG2-CG1 4.05Å; V119-V158 HydrophobicContact CG2-CG2 3.98Å; V119-I185 HydrophobicContact CG1-CD1 4.35Å; V119-N241 PolarHBondContact O-ND2 3.02Å
120M93.3Very high91.3Very high118 Ų11866 Ų6658%0.58134%0.337SS*.EExtended strand (participates in β ladder)trans-83126.8176.9-66.4-63.2-177.200109S118 T151S118-M120 PolarHBondContact O-N 2.96Å; M120-T151 PolarHBondContact N-O 3.28Å; M120-T151 VanDerWaalsContact N-O 3.09Å; M120-T151 PolarHBondContact O-N 2.82Å
121V94.6Very high91.2Very high22 Ų2262 Ų6213%0.13331%0.313CS..EExtended strand (participates in β ladder)trans-116.6123.9175.6-173.10000106.8L148 F150 V230 N241 L243V121-L148 HydrophobicContact CG1-CD1 4.4Å; V121-L148 HydrophobicContact CG1-CD2 4.44Å; V121-F150 HydrophobicContact CB-CD1 4.42Å; V121-F150 HydrophobicContact CB-CE1 4.32Å; V121-F150 HydrophobicContact CG1-CD1 4.1Å; V121-F150 HydrophobicContact CG1-CE1 3.64Å; V121-F150 HydrophobicContact CG1-CZ 4.29Å; V121-F150 HydrophobicContact CG2-CD1 3.82Å; V121-F150 HydrophobicContact CG2-CE1 3.79Å; V121-V230 HydrophobicContact CG1-CG2 4.11Å; V121-N241 HydrophobicContact CG2-CB 4.28Å; V121-L243 HydrophobicContact CB-CD1 4.07Å; V121-L243 HydrophobicContact CG1-CD1 3.6Å; V121-L243 WeakPolarHBondContact O-CD2 3.38Å
122E93.9Very high91.2Very high119 Ų11962.6 Ų62.656%0.55631%0.31SS*.EExtended strand (participates in β ladder)trans-125.8140-179.8-171177.4-178.200109.7D124 L148 N149E122-D124 PolarHBondContact O-N 3.49Å; E122-L148 WeakPolarHBondContact O-CA 3.12Å; E122-N149 HydrophobicContact CB-CB 4.45Å; E122-N149 PolarHBondContact N-O 2.93Å; E122-N149 PolarHBondContact O-N 3.25Å
123D92.7Very high91.2Very high38 Ų3859.8 Ų59.820%0.20330%0.298CS..EExtended strand (participates in β ladder)trans-83.6108.9174.5-178.514.6000109.9G125 L148 A245 R247D123-G125 PolarHBondContact O-N 3.3Å; D123-G125 WeakPolarHBondContact OD1-CA 3.45Å; D123-G125 PolarHBondContact OD1-N 3.43Å; D123-L148 HydrophobicContact CB-CD2 4.33Å; D123-A245 WeakPolarHBondContact OD2-CB 3.45Å; D123-R247 IonicContact OD1-NH2 3.6Å; D123-R247 PolarHBondContact OD1-NH2 2.96Å; D123-R247 IonicContact OD2-CZ 2.68Å; D123-R247 IonicContact OD2-NE 3.49Å; D123-R247 IonicContact OD2-NH2 3.7Å; D123-R247 PolarHBondContact OD2-NH2 2.95Å
124D90.3Very high91.2Very high71 Ų7157.4 Ų57.438%0.3829%0.289SS..EExtended strand (participates in β ladder)trans-84.91177.2-166.454.4000112E122 R127 S147 N149 Q192E122-D124 PolarHBondContact O-N 3.49Å; D124-R127 IonicContact OD2-CZ 3.63Å; D124-R127 IonicContact OD2-NE 3.92Å; D124-R127 IonicContact OD2-NH2 2.65Å; D124-R127 PolarHBondContact OD2-NH2 3.09Å; D124-S147 PolarHBondContact N-O 2.93Å; D124-N149 HydrophobicContact CB-CB 4.45Å; D124-Q192 PolarHBondContact OD2-NE2 3.01Å
125G89.7Confident91.2Very high4 Ų459.5 Ų59.54%0.04130%0.297CS..EExtended strand (participates in β ladder)trans84.9-173.2167.700000116.8D123 S146 S147D123-G125 PolarHBondContact O-N 3.3Å; D123-G125 WeakPolarHBondContact OD1-CA 3.45Å; D123-G125 PolarHBondContact OD1-N 3.43Å; G125-S146 WeakPolarHBondContact O-CA 3.2Å; G125-S146 PolarHBondContact O-OG 2.97Å; G125-S146 VanDerWaalsContact O-OG 3.06Å; G125-S147 PolarHBondContact O-N 2.88Å
126I90.2Very high91.2Very high13 Ų1360 Ų607%0.06730%0.304CS..EExtended strand (participates in β ladder)trans-74.7128.1-171.7-61.3171.1000109.5V129 M144 R247 H258I126-V129 HydrophobicContact CG2-CG2 3.61Å; I126-M144 HydrophobicContact CD1-CE 3.41Å; I126-M144 VanDerWaalsContact CD1-CE 3.41Å; I126-M144 HydrophobicContact CD1-CG 4.38Å; I126-M144 HydrophobicContact CD1-SD 3.59Å; I126-M144 VanDerWaalsContact CD1-SD 3.59Å; I126-M144 HydrophobicContact CG1-CE 4.17Å; I126-M144 HydrophobicContact CG1-CG 4.17Å; I126-M144 HydrophobicContact CG1-SD 3.69Å; I126-M144 HydrophobicContact CG2-CG 4.05Å; I126-R247 HydrophobicContact CD1-CB 3.68Å; I126-R247 HydrophobicContact CD1-CG 3.72Å; I126-R247 HydrophobicContact CG1-CG 4.29Å; I126-H258 WeakPolarHBondContact O-CB 3.4Å
127R90.7Very high91.2Very high86 Ų8662.1 Ų62.133%0.32531%0.313SS..EExtended strand (participates in β ladder)trans-92-41.4174.4-64.9-61.8-177.4144.8-4.7112D124 T145D124-R127 IonicContact OD2-CZ 3.63Å; D124-R127 IonicContact OD2-NE 3.92Å; D124-R127 IonicContact OD2-NH2 2.65Å; D124-R127 PolarHBondContact OD2-NH2 3.09Å; R127-T145 HydrophobicContact CB-CG2 4.42Å; R127-T145 PolarHBondContact N-O 2.84Å
128S91.3Very high91.3Very high36 Ų3660.8 Ų60.825%0.25232%0.316SS..EExtended strand (participates in β ladder)trans-154.414717961.20000111.2T145S128-T145 PolarHBondContact N-O 2.88Å; S128-T145 PolarHBondContact O-N 3.35Å; S128-T145 WeakPolarHBondContact OG-CB 3.33Å; S128-T145 PolarHBondContact OG-OG1 2.83Å
129V92.4Very high91.5Very high3 Ų359.8 Ų59.82%0.01830%0.302CS..EExtended strand (participates in β ladder)trans-125133.6165.5-170.10000108.6I126 V131 I142 N143 M144 I249 S255 T256I126-V129 HydrophobicContact CG2-CG2 3.61Å; V129-V131 HydrophobicContact CG1-CG2 4.3Å; V129-I142 HydrophobicContact CG1-CG2 3.33Å; V129-N143 CarbonylContact C-O 3.56Å; V129-N143 WeakPolarHBondContact CA-O 3.24Å; V129-M144 HydrophobicContact CG2-CE 4.21Å; V129-M144 HydrophobicContact CG2-CG 4.29Å; V129-I249 HydrophobicContact CB-CG2 4.45Å; V129-I249 HydrophobicContact CG1-CG2 3.72Å; V129-I249 HydrophobicContact CG2-CG2 4.35Å; V129-S255 VanDerWaalsContact O-CA 3.29Å; V129-S255 WeakPolarHBondContact O-CA 3.21Å; V129-T256 WeakPolarHBondContact CB-OG1 3.5Å; V129-T256 PolarHBondContact N-O 3.44Å; V129-T256 PolarHBondContact O-N 2.79Å
130T92.6Very high91.5Very high54 Ų5459.4 Ų59.433%0.33130%0.3SS..EExtended strand (participates in β ladder)trans-118.8129.4172.4-55.20000108.7I142 N143 N254T130-I142 CarbonylContact O-C 3.58Å; T130-I142 WeakPolarHBondContact O-CA 3.34Å; T130-N143 PolarHBondContact N-O 2.7Å; T130-N143 PolarHBondContact O-N 3.11Å; T130-N254 WeakPolarHBondContact CA-O 3.15Å
131V92.6Very high91.5Very high2 Ų256.5 Ų56.51%0.01229%0.286CS..EExtended strand (participates in β ladder)trans-113137.2-179.5-1730000109.6V129 F133 V140 L141 I142 C251 S253 N254V129-V131 HydrophobicContact CG1-CG2 4.3Å; V131-F133 HydrophobicContact CG1-CE1 4.14Å; V131-F133 HydrophobicContact CG1-CE2 4.32Å; V131-F133 HydrophobicContact CG1-CZ 3.97Å; V131-V140 HydrophobicContact CG1-CG1 3.72Å; V131-L141 CarbonylContact C-O 3.58Å; V131-L141 WeakPolarHBondContact CA-O 3.44Å; V131-I142 HydrophobicContact CG1-CG1 4.29Å; V131-I142 HydrophobicContact CG2-CG1 4.38Å; V131-I142 HydrophobicContact CG2-CG2 4.45Å; V131-C251 WeakPolarHBondContact CG1-O 3.49Å; V131-S253 WeakPolarHBondContact CG2-O 3.31Å; V131-N254 PolarHBondContact N-O 3.43Å; V131-N254 PolarHBondContact O-OD1 2.91Å
132Q92.1Very high91.5Very high102 Ų10255.4 Ų55.448%0.47728%0.28SS..EExtended strand (participates in β ladder)trans-133.6135.8177.5-66.1177.9-7.500109.5L141Q132-L141 HydrophobicContact CB-CB 4.21Å; Q132-L141 PolarHBondContact N-O 3.19Å; Q132-L141 PolarHBondContact O-N 2.88Å
133F91.6Very high91.5Very high49 Ų4952.3 Ų52.322%0.21527%0.267CS..EExtended strand (participates in β ladder)trans-105.4126.2179.7-60.7-71.2000110.5V131 V140 Y209 C212 T213 C251V131-F133 HydrophobicContact CG1-CE1 4.14Å; V131-F133 HydrophobicContact CG1-CE2 4.32Å; V131-F133 HydrophobicContact CG1-CZ 3.97Å; F133-V140 HydrophobicContact CD1-CG1 4.24Å; F133-V140 HydrophobicContact CD1-CG2 4.11Å; F133-V140 HydrophobicContact CE1-CG1 4.04Å; F133-V140 HydrophobicContact CE1-CG2 4.14Å; F133-Y209 HydrophobicContact CB-CE2 4.31Å; F133-Y209 HydrophobicContact CD1-CD2 4.32Å; F133-Y209 HydrophobicContact CD1-CE2 4.3Å; F133-C212 HydrophobicContact CE1-CB 3.71Å; F133-C212 HydrophobicContact CZ-CB 4.18Å; F133-T213 HydrophobicContact CD1-CG2 3.78Å; F133-T213 HydrophobicContact CE1-CG2 3.82Å; F133-T213 HydrophobicContact CG-CG2 4.23Å; F133-T213 HydrophobicContact CZ-CG2 4.28Å; F133-C251 WeakPolarHBondContact CZ-O 3.34Å
134D91.1Very high91.5Very high41 Ų4150.6 Ų50.622%0.21926%0.258CS..EExtended strand (participates in β ladder)trans-97.297.2166.4-179.6-7.5000108.2I136 N137 T138 K139 L141D134-I136 PolarHBondContact O-N 2.87Å; D134-I136 WeakPolarHBondContact OD1-CB 3.46Å; D134-I136 PolarHBondContact OD1-N 2.98Å; D134-N137 PolarHBondContact OD1-N 2.93Å; D134-N137 VanDerWaalsContact OD1-N 3.1Å; D134-N137 WeakPolarHBondContact OD2-CB 3.25Å; D134-N137 PolarHBondContact OD2-ND2 2.98Å; D134-T138 VanDerWaalsContact O-CA 3.31Å; D134-T138 WeakPolarHBondContact O-CA 3.43Å; D134-T138 PolarHBondContact O-N 2.88Å; D134-K139 HydrophobicContact CB-CB 4.17Å; D134-K139 PolarHBondContact N-O 2.7Å; D134-K139 PolarHBondContact O-N 2.84Å; D134-L141 HydrophobicContact CB-CD1 4.02Å
135H89.9Confident91.7Very high129 Ų12948.5 Ų48.560%0.59725%0.248SC*.THydrogen-bonded Turntrans-67.9-22.2-179.8-60.3-65.4000113.2Y209H135-Y209 WeakPolarHBondContact CA-OH 3.41Å; H135-Y209 AromaticContact ND1-CZ 3.89Å; H135-Y209 PolarHBondContact ND1-OH 2.96Å
136I89.1Confident91.8Very high154 Ų15448.4 Ų48.479%0.7925%0.246SC*.THydrogen-bonded Turntrans-77.5-48.7-177.3-58.7173.4000109.3D134D134-I136 PolarHBondContact O-N 2.87Å; D134-I136 WeakPolarHBondContact OD1-CB 3.46Å; D134-I136 PolarHBondContact OD1-N 2.98Å
137N89.2Confident92Very high83 Ų8347.8 Ų47.844%0.44424%0.243SC..THydrogen-bonded Turntrans-95.92.9-177.4-59.8-65.8000113.3D134 K139D134-N137 PolarHBondContact OD1-N 2.93Å; D134-N137 VanDerWaalsContact OD1-N 3.1Å; D134-N137 WeakPolarHBondContact OD2-CB 3.25Å; D134-N137 PolarHBondContact OD2-ND2 2.98Å; N137-K139 VanDerWaalsContact C-N 3.35Å; N137-K139 HydrophobicContact CB-CD 3.81Å; N137-K139 HydrophobicContact CB-CG 3.88Å; N137-K139 WeakPolarHBondContact O-CG 3.5Å; N137-K139 PolarHBondContact O-N 2.9Å
138T90Very high92.2Very high68 Ų6843.7 Ų43.742%0.41723%0.228SC..THydrogen-bonded Turntrans53.647.8-175.5590000112.6D134 Y209D134-T138 VanDerWaalsContact O-CA 3.31Å; D134-T138 WeakPolarHBondContact O-CA 3.43Å; D134-T138 PolarHBondContact O-N 2.88Å; T138-Y209 HydrophobicContact CG2-CD1 4.2Å; T138-Y209 HydrophobicContact CG2-CE1 4.05Å; T138-Y209 WeakPolarHBondContact O-CB 3.39Å
139K91.8Very high92.4Very high56 Ų5643.2 Ų43.224%0.24322%0.222CC..EExtended strand (participates in β ladder)trans-115.3148.2-177.8-57.4176.4179.1162.30110.9D134 N137 L141D134-K139 HydrophobicContact CB-CB 4.17Å; D134-K139 PolarHBondContact N-O 2.7Å; D134-K139 PolarHBondContact O-N 2.84Å; N137-K139 VanDerWaalsContact C-N 3.35Å; N137-K139 HydrophobicContact CB-CD 3.81Å; N137-K139 HydrophobicContact CB-CG 3.88Å; N137-K139 WeakPolarHBondContact O-CG 3.5Å; N137-K139 PolarHBondContact O-N 2.9Å; K139-L141 HydrophobicContact CB-CD1 4.26Å
140V92.6Very high92.5Very high0 Ų043 Ų430%022%0.221CC..EExtended strand (participates in β ladder)trans-109.7122.7170-169.80000107.8V131 F133 I142 I201 Y209 C212V131-V140 HydrophobicContact CG1-CG1 3.72Å; F133-V140 HydrophobicContact CD1-CG1 4.24Å; F133-V140 HydrophobicContact CD1-CG2 4.11Å; F133-V140 HydrophobicContact CE1-CG1 4.04Å; F133-V140 HydrophobicContact CE1-CG2 4.14Å; V140-I142 HydrophobicContact CG1-CD1 4.11Å; V140-I142 HydrophobicContact CG1-CG1 3.84Å; V140-I201 HydrophobicContact CB-CB 4.46Å; V140-I201 PolarHBondContact N-O 2.84Å; V140-I201 PolarHBondContact O-N 3.29Å; V140-Y209 HydrophobicContact CG2-CD2 4Å; V140-Y209 HydrophobicContact CG2-CG 4.41Å; V140-C212 HydrophobicContact CG2-CB 4.41Å
141L93.5Very high92.7Very high56 Ų5642.7 Ų42.729%0.29322%0.219SC..EExtended strand (participates in β ladder)trans-105.8125.9174.8-67.284.2000107.9V131 Q132 D134 K139 V199V131-L141 CarbonylContact C-O 3.58Å; V131-L141 WeakPolarHBondContact CA-O 3.44Å; Q132-L141 HydrophobicContact CB-CB 4.21Å; Q132-L141 PolarHBondContact N-O 3.19Å; Q132-L141 PolarHBondContact O-N 2.88Å; D134-L141 HydrophobicContact CB-CD1 4.02Å; K139-L141 HydrophobicContact CB-CD1 4.26Å; L141-V199 WeakPolarHBondContact CA-O 3.36Å
142I93.4Very high92.8Very high0 Ų042.7 Ų42.70%022%0.219CC..EExtended strand (participates in β ladder)trans-126.4121-177-53.9176.4000107.9V129 T130 V131 V140 V199 I201 I222 I249 C251V129-I142 HydrophobicContact CG1-CG2 3.33Å; T130-I142 CarbonylContact O-C 3.58Å; T130-I142 WeakPolarHBondContact O-CA 3.34Å; V131-I142 HydrophobicContact CG1-CG1 4.29Å; V131-I142 HydrophobicContact CG2-CG1 4.38Å; V131-I142 HydrophobicContact CG2-CG2 4.45Å; V140-I142 HydrophobicContact CG1-CD1 4.11Å; V140-I142 HydrophobicContact CG1-CG1 3.84Å; I142-V199 HydrophobicContact CB-CB 4.12Å; I142-V199 HydrophobicContact CB-CG1 4.44Å; I142-V199 PolarHBondContact N-O 3.07Å; I142-V199 WeakPolarHBondContact O-CB 3.29Å; I142-V199 PolarHBondContact O-N 3.48Å; I142-I201 HydrophobicContact CD1-CD1 4.11Å; I142-I222 HydrophobicContact CD1-CD1 3.89Å; I142-I249 HydrophobicContact CG2-CG2 4.44Å; I142-C251 HydrophobicContact CD1-CB 4.4Å
143N94.4Very high92.9Very high54 Ų5439.8 Ų39.829%0.28921%0.21SC..EExtended strand (participates in β ladder)trans-103.1113.6171.3-72.7-24.4000108.5V129 T130 T196 S198V129-N143 CarbonylContact C-O 3.56Å; V129-N143 WeakPolarHBondContact CA-O 3.24Å; T130-N143 PolarHBondContact N-O 2.7Å; T130-N143 PolarHBondContact O-N 3.11Å; N143-T196 HydrophobicContact CB-CG2 4.35Å; N143-S198 WeakPolarHBondContact OD1-CA 3.5Å; N143-S198 WeakPolarHBondContact OD1-CB 3.12Å; N143-S198 PolarHBondContact OD1-OG 3.13Å
144M93Very high93Very high1 Ų137.6 Ų37.61%0.00520%0.201CC..EExtended strand (participates in β ladder)trans-110.4123.8179.4176.3-175.2-68.500109.9I126 V129 T196 V197 V224 M226 I249I126-M144 HydrophobicContact CD1-CE 3.41Å; I126-M144 VanDerWaalsContact CD1-CE 3.41Å; I126-M144 HydrophobicContact CD1-CG 4.38Å; I126-M144 HydrophobicContact CD1-SD 3.59Å; I126-M144 VanDerWaalsContact CD1-SD 3.59Å; I126-M144 HydrophobicContact CG1-CE 4.17Å; I126-M144 HydrophobicContact CG1-CG 4.17Å; I126-M144 HydrophobicContact CG1-SD 3.69Å; I126-M144 HydrophobicContact CG2-CG 4.05Å; V129-M144 HydrophobicContact CG2-CE 4.21Å; V129-M144 HydrophobicContact CG2-CG 4.29Å; M144-T196 CarbonylContact O-C 3.59Å; M144-T196 VanDerWaalsContact O-CA 3.26Å; M144-T196 WeakPolarHBondContact O-CA 3.37Å; M144-V197 PolarHBondContact N-O 2.9Å; M144-V197 PolarHBondContact O-N 2.77Å; M144-V224 HydrophobicContact CE-CG2 4.37Å; M144-M226 HydrophobicContact SD-CE 3.67Å; M144-M226 HydrophobicContact SD-SD 3.36Å; M144-I249 HydrophobicContact CE-CD1 3.12Å; M144-I249 HydrophobicContact CE-CG1 3.4Å
145T93.8Very high93.1Very high28 Ų2839.3 Ų39.317%0.17221%0.206CC..EExtended strand (participates in β ladder)trans-98.7121.4169.9-53.20000109.1R127 S128 N194 F195 T196R127-T145 HydrophobicContact CB-CG2 4.42Å; R127-T145 PolarHBondContact N-O 2.84Å; S128-T145 PolarHBondContact N-O 2.88Å; S128-T145 PolarHBondContact O-N 3.35Å; S128-T145 WeakPolarHBondContact OG-CB 3.33Å; S128-T145 PolarHBondContact OG-OG1 2.83Å; T145-N194 HydrophobicContact CG2-CB 4.34Å; T145-F195 CarbonylContact C-O 3.57Å; T145-F195 WeakPolarHBondContact CA-O 3.44Å; T145-T196 PolarHBondContact OG1-OG1 2.94Å
146S93.4Very high93.2Very high1 Ų134.5 Ų34.51%0.00718%0.184CC..EExtended strand (participates in β ladder)trans-118.6165.9174.7-161.50000110.7G125 N194 F195G125-S146 WeakPolarHBondContact O-CA 3.2Å; G125-S146 PolarHBondContact O-OG 2.97Å; G125-S146 VanDerWaalsContact O-OG 3.06Å; S146-N194 WeakPolarHBondContact O-CA 3.45Å; S146-F195 PolarHBondContact N-O 2.68Å; S146-F195 WeakPolarHBondContact O-CD1 3.23Å; S146-F195 PolarHBondContact O-N 3.01Å
147S93.8Very high93.4Very high0 Ų030.9 Ų30.90%017%0.169CC..EExtended strand (participates in β ladder)trans-127.6132.8-177.9-161.70000111.9D124 G125 Q192 V193 N194D124-S147 PolarHBondContact N-O 2.93Å; G125-S147 PolarHBondContact O-N 2.88Å; S147-Q192 WeakPolarHBondContact OG-CG 3.5Å; S147-Q192 PolarHBondContact OG-NE2 2.92Å; S147-V193 WeakPolarHBondContact CA-O 3.48Å; S147-V193 PolarHBondContact OG-O 3.49Å; S147-N194 VanDerWaalsContact CB-OD1 3.24Å; S147-N194 WeakPolarHBondContact CB-OD1 3.36Å; S147-N194 PolarHBondContact OG-OD1 2.91Å
148L94.9Very high93.7Very high1 Ų127 Ų271%0.00515%0.148CC..EExtended strand (participates in β ladder)trans-106.9140.4169.6-66.6176.5000110V121 E122 D123 F150 L163 Q192 V193 F195 T228 V230V121-L148 HydrophobicContact CG1-CD1 4.4Å; V121-L148 HydrophobicContact CG1-CD2 4.44Å; E122-L148 WeakPolarHBondContact O-CA 3.12Å; D123-L148 HydrophobicContact CB-CD2 4.33Å; L148-F150 HydrophobicContact CB-CD2 4.39Å; L148-F150 HydrophobicContact CB-CE2 3.66Å; L148-F150 HydrophobicContact CB-CZ 3.84Å; L148-F150 HydrophobicContact CD1-CE2 4.34Å; L148-F150 HydrophobicContact CD1-CZ 3.78Å; L148-F150 HydrophobicContact CG-CZ 4.48Å; L148-L163 HydrophobicContact CD1-CD1 3.55Å; L148-L163 HydrophobicContact CD1-CG 4.19Å; L148-Q192 WeakPolarHBondContact O-CA 3.35Å; L148-V193 PolarHBondContact N-O 3.47Å; L148-V193 PolarHBondContact O-N 2.89Å; L148-F195 HydrophobicContact CD1-CE1 4.15Å; L148-F195 HydrophobicContact CD2-CE1 4.36Å; L148-F195 HydrophobicContact CG-CD1 4.36Å; L148-F195 HydrophobicContact CG-CE1 3.7Å; L148-F195 HydrophobicContact CG-CZ 4.45Å; L148-T228 HydrophobicContact CD1-CG2 3.82Å; L148-T228 HydrophobicContact CD2-CG2 4.46Å; L148-V230 HydrophobicContact CD1-CG2 3.79Å
149N95.1Very high93.9Very high25 Ų2527.5 Ų27.513%0.13415%0.147CC..EExtended strand (participates in β ladder)trans-107.7120.4174.4-168.2-6.4000109.6E122 D124 Q190E122-N149 HydrophobicContact CB-CB 4.45Å; E122-N149 PolarHBondContact N-O 2.93Å; E122-N149 PolarHBondContact O-N 3.25Å; D124-N149 HydrophobicContact CB-CB 4.45Å; N149-Q190 PolarHBondContact ND2-NE2 2.86Å; N149-Q190 WeakPolarHBondContact OD1-CG 3.36Å; N149-Q190 PolarHBondContact OD1-NE2 3.3Å
150F95.2Very high94.1Very high0 Ų024.8 Ų24.80%014%0.135CC..EExtended strand (participates in β ladder)trans-106.9125.8-179-64.7-80.8000110V121 L148 I183 I185 Q190 T191 V193 V230V121-F150 HydrophobicContact CB-CD1 4.42Å; V121-F150 HydrophobicContact CB-CE1 4.32Å; V121-F150 HydrophobicContact CG1-CD1 4.1Å; V121-F150 HydrophobicContact CG1-CE1 3.64Å; V121-F150 HydrophobicContact CG1-CZ 4.29Å; V121-F150 HydrophobicContact CG2-CD1 3.82Å; V121-F150 HydrophobicContact CG2-CE1 3.79Å; L148-F150 HydrophobicContact CB-CD2 4.39Å; L148-F150 HydrophobicContact CB-CE2 3.66Å; L148-F150 HydrophobicContact CB-CZ 3.84Å; L148-F150 HydrophobicContact CD1-CE2 4.34Å; L148-F150 HydrophobicContact CD1-CZ 3.78Å; L148-F150 HydrophobicContact CG-CZ 4.48Å; F150-I183 HydrophobicContact CD2-CD1 4.21Å; F150-I185 HydrophobicContact CB-CD1 3.64Å; F150-I185 HydrophobicContact CB-CG1 4.42Å; F150-I185 HydrophobicContact CD1-CD1 4.24Å; F150-I185 HydrophobicContact CG-CD1 4.05Å; F150-Q190 CarbonylContact O-C 3.48Å; F150-Q190 VanDerWaalsContact O-CA 3.25Å; F150-Q190 WeakPolarHBondContact O-CA 3.46Å; F150-Q190 WeakPolarHBondContact O-CG 3.36Å; F150-T191 PolarHBondContact N-O 3.45Å; F150-T191 PolarHBondContact O-N 2.78Å; F150-V193 HydrophobicContact CD2-CB 4.48Å; F150-V193 HydrophobicContact CD2-CG2 3.97Å; F150-V193 HydrophobicContact CE2-CB 3.97Å; F150-V193 HydrophobicContact CE2-CG2 3.79Å; F150-V230 HydrophobicContact CE1-CB 4.44Å; F150-V230 HydrophobicContact CE1-CG1 3.73Å; F150-V230 HydrophobicContact CE1-CG2 4.11Å; F150-V230 HydrophobicContact CZ-CG1 4.17Å; F150-V230 HydrophobicContact CZ-CG2 4.18Å
151T95.2Very high94.2Very high47 Ų4726.4 Ų26.429%0.28814%0.144SC..EExtended strand (participates in β ladder)trans-118.8113.2176.1-53.50000110M120 Q190M120-T151 PolarHBondContact N-O 3.28Å; M120-T151 VanDerWaalsContact N-O 3.09Å; M120-T151 PolarHBondContact O-N 2.82Å; T151-Q190 PolarHBondContact OG1-NE2 2.82Å
152N95.3Very high94.3Very high2 Ų224.9 Ų24.91%0.01114%0.137CC..  trans-96.6109.1176.8-17720000110.5N154 F156 I185 Q186 L188 S189N152-N154 WeakPolarHBondContact OD1-CB 3.04Å; N152-N154 PolarHBondContact OD1-N 2.68Å; N152-N154 PolarHBondContact OD1-ND2 2.65Å; N152-F156 PolarHBondContact ND2-O 2.85Å; N152-I185 HydrophobicContact CB-CB 4.26Å; N152-I185 HydrophobicContact CB-CG2 3.49Å; N152-I185 VanDerWaalsContact CB-CG2 3.49Å; N152-Q186 PolarHBondContact ND2-O 2.69Å; N152-L188 CarbonylContact O-C 3.51Å; N152-L188 WeakPolarHBondContact O-CA 3.28Å; N152-L188 PolarHBondContact O-N 3.06Å; N152-S189 PolarHBondContact N-O 2.8Å; N152-S189 PolarHBondContact O-N 3.09Å
153S94.1Very high94.5Very high41 Ų4124.9 Ų24.929%0.28714%0.137SC..  trans-92.24.6176.263.80000113.8R117R117-S153 WeakPolarHBondContact CB-OG 3.45Å; R117-S153 WeakPolarHBondContact CD-O 3.3Å; R117-S153 PolarHBondContact NH1-O 3.33Å
154N93.8Very high94.6Very high2 Ų224 Ų241%0.01114%0.136CC..SBendtrans-83159178-63.6-79.5000112.1R117 N152 F156 P187 L188R117-N154 WeakPolarHBondContact CA-OD1 3.07Å; R117-N154 WeakPolarHBondContact CB-OD1 3.34Å; R117-N154 PolarHBondContact N-OD1 3.3Å; R117-N154 PolarHBondContact O-ND2 2.75Å; R117-N154 PolarHBondContact O-OD1 2.77Å; N152-N154 WeakPolarHBondContact OD1-CB 3.04Å; N152-N154 PolarHBondContact OD1-N 2.68Å; N152-N154 PolarHBondContact OD1-ND2 2.65Å; N154-F156 VanDerWaalsContact C-N 3.27Å; N154-F156 HydrophobicContact CB-CD1 4.11Å; N154-F156 HydrophobicContact CB-CD2 4.08Å; N154-F156 HydrophobicContact CB-CE1 3.89Å; N154-F156 HydrophobicContact CB-CE2 3.85Å; N154-F156 HydrophobicContact CB-CG 4.2Å; N154-F156 HydrophobicContact CB-CZ 3.76Å; N154-F156 VanDerWaalsContact OD1-CZ 3.24Å; N154-F156 WeakPolarHBondContact OD1-CZ 3.39Å; N154-P187 WeakPolarHBondContact O-CA 3.24Å; N154-L188 PolarHBondContact O-N 3.45Å
155F93.7Very high94.8Very high78 Ų7824 Ų2434%0.34214%0.136SC..SBendtrans-86.75.2172.8-61.7-82.2000113.3F112 F113 L188F112-F155 AromaticContact CE1-CE2 3.98Å; F112-F155 HydrophobicContact CE1-CE2 3.98Å; F112-F155 HydrophobicContact CE1-CZ 4.12Å; F112-F155 HydrophobicContact CZ-CE2 4.5Å; F113-F155 HydrophobicContact CD1-CB 4.3Å; F113-F155 HydrophobicContact CD1-CD1 4.11Å; F113-F155 AromaticContact CD1-CD2 3.81Å; F113-F155 HydrophobicContact CD1-CD2 3.81Å; F113-F155 HydrophobicContact CD1-CE1 4.38Å; F113-F155 HydrophobicContact CD1-CE2 4.1Å; F113-F155 AromaticContact CD1-CG 3.82Å; F113-F155 HydrophobicContact CD1-CG 3.82Å; F113-F155 HydrophobicContact CD1-CZ 4.38Å; F113-F155 HydrophobicContact CE1-CD1 4.27Å; F113-F155 HydrophobicContact CE1-CE1 4.22Å; F113-F155 HydrophobicContact CE1-CE2 4.49Å; F113-F155 HydrophobicContact CE1-CG 4.43Å; F113-F155 HydrophobicContact CE1-CZ 4.33Å; F155-L188 HydrophobicContact CD1-CD1 3.92Å; F155-L188 HydrophobicContact CD1-CD2 4.4Å; F155-L188 HydrophobicContact CD1-CG 4.31Å; F155-L188 HydrophobicContact CE1-CD1 3.84Å; F155-L188 HydrophobicContact CE1-CD2 4.28Å; F155-L188 HydrophobicContact CE1-CG 4.46Å
156F92.6Very high94.9Very high27 Ų2726.8 Ų26.812%0.11815%0.147CC..SBendtrans-127.8163.1177.452.8-99.2000111.1P116 N152 N154 V158 Y234P116-F156 HydrophobicContact CB-CZ 4.11Å; N152-F156 PolarHBondContact ND2-O 2.85Å; N154-F156 VanDerWaalsContact C-N 3.27Å; N154-F156 HydrophobicContact CB-CD1 4.11Å; N154-F156 HydrophobicContact CB-CD2 4.08Å; N154-F156 HydrophobicContact CB-CE1 3.89Å; N154-F156 HydrophobicContact CB-CE2 3.85Å; N154-F156 HydrophobicContact CB-CG 4.2Å; N154-F156 HydrophobicContact CB-CZ 3.76Å; N154-F156 VanDerWaalsContact OD1-CZ 3.24Å; N154-F156 WeakPolarHBondContact OD1-CZ 3.39Å; F156-V158 HydrophobicContact CD2-CG2 4.29Å; F156-V158 HydrophobicContact CE2-CG2 4.13Å; F156-Y234 AromaticContact CE2-CD2 3.81Å; F156-Y234 HydrophobicContact CE2-CD2 3.81Å; F156-Y234 AromaticContact CE2-CG 3.89Å; F156-Y234 HydrophobicContact CE2-CG 3.89Å; F156-Y234 HydrophobicContact CZ-CD2 4.1Å
157T93.6Very high95Very high78 Ų7826.7 Ų26.748%0.47915%0.146SC..  trans-73.5141.5178.648.40000111.1I185 P187T157-I185 WeakPolarHBondContact CA-O 3.35Å; T157-P187 HydrophobicContact CG2-CG 4.27Å
158V94.7Very high95.1Very high1 Ų127.6 Ų27.61%0.00615%0.151CC..EExtended strand (participates in β ladder)trans-119.3137.1175.6-179.10000108.9V119 F156 I185 T232 Y234V119-V158 HydrophobicContact CG2-CB 4.36Å; V119-V158 HydrophobicContact CG2-CG1 4.05Å; V119-V158 HydrophobicContact CG2-CG2 3.98Å; F156-V158 HydrophobicContact CD2-CG2 4.29Å; F156-V158 HydrophobicContact CE2-CG2 4.13Å; V158-I185 PolarHBondContact N-O 2.91Å; V158-I185 VanDerWaalsContact N-O 3.09Å; V158-I185 PolarHBondContact O-N 3.09Å; V158-T232 HydrophobicContact CG1-CG2 4.35Å; V158-Y234 HydrophobicContact CG1-CD1 4.14Å; V158-Y234 HydrophobicContact CG2-CD1 4.46Å
159M94.6Very high95.1Very high79 Ų7928.5 Ų28.539%0.38915%0.154SC..EExtended strand (participates in β ladder)trans-100.1135.9175.3-176.4176.4-73.100109.9T184 T232 S233M159-T184 HydrophobicContact CB-CG2 4.39Å; M159-T184 HydrophobicContact CE-CG2 3.96Å; M159-T184 HydrophobicContact CG-CG2 4.25Å; M159-T232 CarbonylContact O-C 3.54Å; M159-T232 WeakPolarHBondContact O-CA 3.48Å; M159-S233 PolarHBondContact N-O 3.09Å; M159-S233 PolarHBondContact O-N 2.85Å
160V95.6Very high94.8Very high0 Ų034 Ų340%018%0.181CC..EExtended strand (participates in β ladder)trans-91.897.4170-176.80000107.6V182 I183 I185 V230 K231 T232V160-V182 HydrophobicContact CB-CB 4.11Å; V160-V182 HydrophobicContact CG1-CB 3.86Å; V160-V182 HydrophobicContact CG1-CG2 3.92Å; V160-V182 PolarHBondContact O-N 2.83Å; V160-I183 HydrophobicContact CB-CG1 4.11Å; V160-I183 HydrophobicContact CG2-CD1 4.38Å; V160-I183 HydrophobicContact CG2-CG1 3.76Å; V160-I183 PolarHBondContact N-O 2.85Å; V160-I185 HydrophobicContact CG2-CD1 3.78Å; V160-I185 HydrophobicContact CG2-CG1 4.24Å; V160-V230 HydrophobicContact CG1-CG1 3.74Å; V160-K231 CarbonylContact C-O 3.55Å; V160-T232 HydrophobicContact CG2-CG2 4.24Å
161D94.6Very high94.5Very high34 Ų3442.7 Ų42.718%0.18222%0.219CC..EExtended strand (participates in β ladder)trans-68.3-47.1-174.4-59.6-33.2000111.5D180 N181 K231 S233D161-D180 CarbonylContact O-C 3.58Å; D161-D180 VanDerWaalsContact O-CA 3.31Å; D161-D180 WeakPolarHBondContact O-CA 3.33Å; D161-N181 PolarHBondContact O-N 2.59Å; D161-K231 HydrophobicContact CB-CB 4.49Å; D161-K231 HydrophobicContact CB-CD 4.47Å; D161-K231 HydrophobicContact CB-CG 4.37Å; D161-K231 PolarHBondContact N-O 3.27Å; D161-S233 VanDerWaalsContact CG-OG 3.32Å; D161-S233 WeakPolarHBondContact OD1-CB 3.39Å; D161-S233 PolarHBondContact OD1-OG 2.84Å; D161-S233 WeakPolarHBondContact OD2-CB 3.43Å; D161-S233 PolarHBondContact OD2-N 3.28Å; D161-S233 PolarHBondContact OD2-OG 2.81Å
162S95.9Very high94.3Very high23 Ų2343.6 Ų43.616%0.16122%0.224CC..EExtended strand (participates in β ladder)trans-148.3143.3-18069.90000112.2L179 D180 V230 K231S162-L179 CarbonylContact C-O 3.49Å; S162-L179 VanDerWaalsContact CA-O 3.26Å; S162-L179 WeakPolarHBondContact CA-O 3.34Å; S162-D180 WeakPolarHBondContact CB-OD1 3.47Å; S162-V230 WeakPolarHBondContact O-CA 3.44Å; S162-K231 PolarHBondContact N-O 3.04Å; S162-K231 PolarHBondContact O-N 3.3Å; S162-K231 WeakPolarHBondContact OG-CB 3.38Å
163L96.4Very high94.3Very high0 Ų046.9 Ų46.90%024%0.244CC..EExtended strand (participates in β ladder)trans-121.9116.8170.6-176.1159.5000106.3L148 M177 Q178 L179 V182 F195L148-L163 HydrophobicContact CD1-CD1 3.55Å; L148-L163 HydrophobicContact CD1-CG 4.19Å; L163-M177 HydrophobicContact CD2-CE 3.43Å; L163-M177 VanDerWaalsContact CD2-CE 3.43Å; L163-M177 HydrophobicContact CD2-SD 4.09Å; L163-M177 WeakPolarHBondContact O-CE 3.42Å; L163-Q178 CarbonylContact O-C 3.59Å; L163-Q178 WeakPolarHBondContact O-CA 3.48Å; L163-L179 HydrophobicContact CB-CB 4.48Å; L163-L179 PolarHBondContact N-O 2.84Å; L163-L179 PolarHBondContact O-N 2.85Å; L163-V182 HydrophobicContact CB-CG2 3.82Å; L163-F195 HydrophobicContact CD1-CD1 4.27Å; L163-F195 HydrophobicContact CD1-CG 4.48Å; L163-F195 HydrophobicContact CD2-CB 4.26Å; L163-F195 HydrophobicContact CD2-CD1 4.33Å; L163-F195 HydrophobicContact CD2-CD2 3.92Å; L163-F195 HydrophobicContact CD2-CE2 4.34Å; L163-F195 HydrophobicContact CD2-CG 3.89Å
164S96.7Very high94.3Very high36 Ų3645.6 Ų45.625%0.25223%0.234SC..EExtended strand (participates in β ladder)trans-118.3136.4175.857.30000109.1M177 T228 S229S164-M177 CarbonylContact C-O 3.5Å; S164-M177 VanDerWaalsContact CA-O 3.29Å; S164-M177 WeakPolarHBondContact CA-O 3.39Å; S164-T228 CarbonylContact O-C 3.54Å; S164-T228 WeakPolarHBondContact O-CA 3.03Å; S164-S229 PolarHBondContact N-O 2.77Å; S164-S229 PolarHBondContact O-N 2.83Å; S164-S229 WeakPolarHBondContact OG-CB 3.1Å; S164-S229 PolarHBondContact OG-O 3.43Å; S164-S229 VanDerWaalsContact OG-O 3.12Å
165C96.8Very high94.4Very high1 Ų146 Ų461%0.00724%0.238CC..EExtended strand (participates in β ladder)trans-132.5130.1176.8-171.10000109.3T176 M177 F195 V197 Q227 T228C165-T176 CarbonylContact O-C 3.6Å; C165-T176 WeakPolarHBondContact O-CA 3.37Å; C165-M177 PolarHBondContact N-O 2.85Å; C165-M177 PolarHBondContact O-N 2.87Å; C165-F195 HydrophobicContact CB-CD2 4.36Å; C165-F195 HydrophobicContact CB-CE2 3.79Å; C165-V197 HydrophobicContact CB-CG2 3.89Å; C165-Q227 CarbonylContact C-O 3.54Å; C165-Q227 WeakPolarHBondContact CA-O 3.45Å; C165-T228 PolarHBondContact SG-OG1 2.94Å; C165-T228 VanDerWaalsContact SG-OG1 3.32Å
166Q97Very high94.5Very high86 Ų8646.7 Ų46.740%0.40225%0.249SC..EExtended strand (participates in β ladder)trans-114.5132.4172.3-59-173.9-3.900108.4L168 G175 T176 Q227Q166-L168 HydrophobicContact CB-CD1 4.12Å; Q166-G175 WeakPolarHBondContact CA-O 3.34Å; Q166-T176 HydrophobicContact CG-CG2 4.21Å; Q166-Q227 PolarHBondContact N-O 3.24Å; Q166-Q227 PolarHBondContact O-N 3.33Å
167V96.4Very high94.7Very high0 Ų046.5 Ų46.50%025%0.249CC..EExtended strand (participates in β ladder)trans-108.6123.5175.9-177.40000107.9I174 G175 V197 V199 V224 I225 M226V167-I174 HydrophobicContact CB-CG1 4.44Å; V167-I174 HydrophobicContact CG1-CD1 4.23Å; V167-I174 HydrophobicContact CG1-CG1 4.08Å; V167-I174 VanDerWaalsContact O-CG1 3.31Å; V167-I174 WeakPolarHBondContact O-CG1 3.13Å; V167-I174 PolarHBondContact O-N 2.9Å; V167-G175 PolarHBondContact N-O 2.9Å; V167-G175 PolarHBondContact O-N 3.32Å; V167-V197 HydrophobicContact CG2-CB 4.23Å; V167-V197 HydrophobicContact CG2-CG1 3.69Å; V167-V199 HydrophobicContact CB-CG2 3.86Å; V167-V199 HydrophobicContact CG1-CG2 3.87Å; V167-V199 HydrophobicContact CG2-CG2 4Å; V167-V224 HydrophobicContact CG1-CB 3.82Å; V167-V224 HydrophobicContact CG1-CG1 4.22Å; V167-V224 HydrophobicContact CG1-CG2 4.03Å; V167-I225 CarbonylContact C-O 3.6Å; V167-I225 WeakPolarHBondContact CA-O 3.44Å; V167-M226 HydrophobicContact CG2-CE 4.42Å; V167-M226 HydrophobicContact CG2-CG 4.34Å
168L95.5Very high94.8Very high18 Ų1848.8 Ų48.89%0.09425%0.254CS..EExtended strand (participates in β ladder)trans-114.3140.9-177.9-5983000110.2Q166 T172 V173 V224 I225 Q227Q166-L168 HydrophobicContact CB-CD1 4.12Å; L168-T172 CarbonylContact C-O 3.57Å; L168-T172 VanDerWaalsContact CA-O 3.23Å; L168-T172 WeakPolarHBondContact CA-O 3.36Å; L168-V173 HydrophobicContact CD2-CG2 4.35Å; L168-V173 HydrophobicContact CG-CG2 4.13Å; L168-V224 CarbonylContact O-C 3.52Å; L168-V224 WeakPolarHBondContact O-CA 3.48Å; L168-I225 HydrophobicContact CB-CB 4.31Å; L168-I225 PolarHBondContact N-O 3.47Å; L168-I225 PolarHBondContact O-N 2.97Å; L168-Q227 HydrophobicContact CD1-CB 4.21Å; L168-Q227 HydrophobicContact CD1-CG 3.93Å
169Y94.2Very high94.8Very high20 Ų2052 Ų528%0.07827%0.271CS..EExtended strand (participates in β ladder)trans-124.5123.1168.6175.8-98.9000108.8K171 T172 I174 T205 Y207 V208 I222 L223Y169-K171 PolarHBondContact O-N 2.82Å; Y169-K171 VanDerWaalsContact O-N 3.13Å; Y169-T172 PolarHBondContact N-O 2.87Å; Y169-T172 WeakPolarHBondContact O-CB 3.18Å; Y169-T172 PolarHBondContact O-N 3.31Å; Y169-I174 VanDerWaalsContact CB-CD1 3.48Å; Y169-I174 HydrophobicContact CG-CD1 4.48Å; Y169-T205 HydrophobicContact CD1-CG2 4.03Å; Y169-T205 HydrophobicContact CE1-CG2 4.31Å; Y169-Y207 WeakPolarHBondContact CE1-OH 3.33Å; Y169-V208 HydrophobicContact CE1-CG2 3.78Å; Y169-I222 HydrophobicContact CE2-CB 4.12Å; Y169-I222 HydrophobicContact CE2-CG2 4.45Å; Y169-L223 WeakPolarHBondContact CD2-O 3.4Å
170M89.6Confident94.8Very high140 Ų14052.8 Ų52.869%0.6928%0.277SS*.THydrogen-bonded Turntrans48.240.3-173.7-61-64.5-176.400112.8T172M170-T172 PolarHBondContact O-N 2.77Å
171K87.7Confident94.5Very high184 Ų18458.8 Ų58.880%0.831%0.309SS*.THydrogen-bonded Turntrans68.83.3-175.4-51178.9177.9177.70116.5Y169Y169-K171 PolarHBondContact O-N 2.82Å; Y169-K171 VanDerWaalsContact O-N 3.13Å
172T92.6Very high94.3Very high66 Ų6658.5 Ų58.541%0.40531%0.308SS..EExtended strand (participates in β ladder)trans-92129.5171.3-58.40000109.6L168 Y169 M170 I174L168-T172 CarbonylContact C-O 3.57Å; L168-T172 VanDerWaalsContact CA-O 3.23Å; L168-T172 WeakPolarHBondContact CA-O 3.36Å; Y169-T172 PolarHBondContact N-O 2.87Å; Y169-T172 WeakPolarHBondContact O-CB 3.18Å; Y169-T172 PolarHBondContact O-N 3.31Å; M170-T172 PolarHBondContact O-N 2.77Å; T172-I174 PolarHBondContact O-N 2.86Å
173V94.6Very high94.2Very high71 Ų7159.7 Ų59.743%0.4331%0.312SS..EExtended strand (participates in β ladder)trans-70.2118.9175.8-177.50000108.9L168 T176L168-V173 HydrophobicContact CD2-CG2 4.35Å; L168-V173 HydrophobicContact CG-CG2 4.13Å; V173-T176 HydrophobicContact CG1-CG2 3.58Å
174I94.6Very high94.1Very high14 Ų1463.4 Ų63.47%0.07234%0.335CS..EExtended strand (participates in β ladder)trans-112.7-7.5-178.655.6168.5000112.7V167 Y169 T172 V199 Q200 I201 V224V167-I174 HydrophobicContact CB-CG1 4.44Å; V167-I174 HydrophobicContact CG1-CD1 4.23Å; V167-I174 HydrophobicContact CG1-CG1 4.08Å; V167-I174 VanDerWaalsContact O-CG1 3.31Å; V167-I174 WeakPolarHBondContact O-CG1 3.13Å; V167-I174 PolarHBondContact O-N 2.9Å; Y169-I174 VanDerWaalsContact CB-CD1 3.48Å; Y169-I174 HydrophobicContact CG-CD1 4.48Å; T172-I174 PolarHBondContact O-N 2.86Å; I174-V199 HydrophobicContact CB-CG1 4.03Å; I174-V199 HydrophobicContact CD1-CG1 3.39Å; I174-V199 HydrophobicContact CG1-CG1 3.66Å; I174-V199 WeakPolarHBondContact O-CA 3.37Å; I174-Q200 PolarHBondContact O-N 3.32Å; I174-I201 HydrophobicContact CB-CG1 4.49Å; I174-I201 HydrophobicContact CD1-CD1 4.09Å; I174-I201 HydrophobicContact CD1-CG1 3.97Å; I174-V224 HydrophobicContact CD1-CG1 4.24Å
175G94.8Very high94Very high9 Ų961.7 Ų61.79%0.09332%0.323CS..EExtended strand (participates in β ladder)trans-162.5145.6174.500000111.1Q166 V167 S198Q166-G175 WeakPolarHBondContact CA-O 3.34Å; V167-G175 PolarHBondContact N-O 2.9Å; V167-G175 PolarHBondContact O-N 3.32Å; G175-S198 WeakPolarHBondContact CA-O 3.29Å
176T96.4Very high94Very high94 Ų9466.8 Ų66.858%0.57735%0.347SS*.EExtended strand (participates in β ladder)trans-137.4143.2175.857.80000109.4C165 Q166 V173C165-T176 CarbonylContact O-C 3.6Å; C165-T176 WeakPolarHBondContact O-CA 3.37Å; Q166-T176 HydrophobicContact CG-CG2 4.21Å; V173-T176 HydrophobicContact CG1-CG2 3.58Å
177M95.9Very high93.8Very high22 Ų2265.1 Ų65.111%0.10834%0.343CS..EExtended strand (participates in β ladder)trans-140.7140.2176.7-178.2-117.486.200108.6L163 S164 C165 L179 F195 T196 V197L163-M177 HydrophobicContact CD2-CE 3.43Å; L163-M177 VanDerWaalsContact CD2-CE 3.43Å; L163-M177 HydrophobicContact CD2-SD 4.09Å; L163-M177 WeakPolarHBondContact O-CE 3.42Å; S164-M177 CarbonylContact C-O 3.5Å; S164-M177 VanDerWaalsContact CA-O 3.29Å; S164-M177 WeakPolarHBondContact CA-O 3.39Å; C165-M177 PolarHBondContact N-O 2.85Å; C165-M177 PolarHBondContact O-N 2.87Å; M177-L179 HydrophobicContact CE-CB 3.89Å; M177-L179 HydrophobicContact CE-CD1 3.27Å; M177-L179 HydrophobicContact CE-CG 4.15Å; M177-L179 HydrophobicContact CG-CD1 4.08Å; M177-L179 HydrophobicContact SD-CD1 3.54Å; M177-L179 VanDerWaalsContact SD-CD1 3.54Å; M177-F195 HydrophobicContact SD-CB 3.93Å; M177-F195 HydrophobicContact SD-CD2 3.66Å; M177-F195 HydrophobicContact SD-CG 4.23Å; M177-T196 WeakPolarHBondContact CG-O 3.37Å; M177-V197 HydrophobicContact CB-CB 4.25Å; M177-V197 HydrophobicContact CB-CG1 3.98Å; M177-V197 HydrophobicContact CB-CG2 3.84Å; M177-V197 HydrophobicContact CG-CG2 4.32Å; M177-V197 HydrophobicContact SD-CG2 4.25Å
178Q95.6Very high93.7Very high126 Ų12670.2 Ų70.259%0.58937%0.37SS*.EExtended strand (participates in β ladder)trans-137.1129.4171.4-175.7174.7-5.400109.9L163 D180L163-Q178 CarbonylContact O-C 3.59Å; L163-Q178 WeakPolarHBondContact O-CA 3.48Å; Q178-D180 PolarHBondContact NE2-OD1 3.35Å
179L95.2Very high93.7Very high68 Ų6870.9 Ų70.936%0.35638%0.376SS..EExtended strand (participates in β ladder)trans-119.3131.8171.9-98.276.9000107S162 L163 M177 V182S162-L179 CarbonylContact C-O 3.49Å; S162-L179 VanDerWaalsContact CA-O 3.26Å; S162-L179 WeakPolarHBondContact CA-O 3.34Å; L163-L179 HydrophobicContact CB-CB 4.48Å; L163-L179 PolarHBondContact N-O 2.84Å; L163-L179 PolarHBondContact O-N 2.85Å; M177-L179 HydrophobicContact CE-CB 3.89Å; M177-L179 HydrophobicContact CE-CD1 3.27Å; M177-L179 HydrophobicContact CE-CG 4.15Å; M177-L179 HydrophobicContact CG-CD1 4.08Å; M177-L179 HydrophobicContact SD-CD1 3.54Å; M177-L179 VanDerWaalsContact SD-CD1 3.54Å; L179-V182 HydrophobicContact CB-CG2 4.03Å
180D94.3Very high93.7Very high96 Ų9675.5 Ų75.551%0.51340%0.398SS..EExtended strand (participates in β ladder)trans-112152.5175.2-56.8-45.7000109.8D161 S162 Q178D161-D180 CarbonylContact O-C 3.58Å; D161-D180 VanDerWaalsContact O-CA 3.31Å; D161-D180 WeakPolarHBondContact O-CA 3.33Å; S162-D180 WeakPolarHBondContact CB-OD1 3.47Å; Q178-D180 PolarHBondContact NE2-OD1 3.35Å
181N90.4Very high93.9Very high127 Ų12770.9 Ų70.968%0.67938%0.378SS*.EExtended strand (participates in β ladder)trans51.255.7-176.4-57.8-72.3000112.4D161D161-N181 PolarHBondContact O-N 2.59Å
182V90.1Very high94.2Very high27 Ų2766.5 Ų66.516%0.16436%0.36CS..EExtended strand (participates in β ladder)trans-68.7-61.2-166.1-170.50000111.2V160 L163 L179 V193V160-V182 HydrophobicContact CB-CB 4.11Å; V160-V182 HydrophobicContact CG1-CB 3.86Å; V160-V182 HydrophobicContact CG1-CG2 3.92Å; V160-V182 PolarHBondContact O-N 2.83Å; L163-V182 HydrophobicContact CB-CG2 3.82Å; L179-V182 HydrophobicContact CB-CG2 4.03Å; V182-V193 HydrophobicContact CG1-CG1 3.79Å
183I94.1Very high94.3Very high48 Ų4864.1 Ų64.125%0.24635%0.346CS..EExtended strand (participates in β ladder)trans-155.6162.2-179.757.8158.5000111.4F150 V160 I185 T191 V193F150-I183 HydrophobicContact CD2-CD1 4.21Å; V160-I183 HydrophobicContact CB-CG1 4.11Å; V160-I183 HydrophobicContact CG2-CD1 4.38Å; V160-I183 HydrophobicContact CG2-CG1 3.76Å; V160-I183 PolarHBondContact N-O 2.85Å; I183-I185 HydrophobicContact CD1-CD1 4.47Å; I183-I185 HydrophobicContact CD1-CG1 3.78Å; I183-I185 HydrophobicContact CG1-CG1 4.35Å; I183-T191 WeakPolarHBondContact CD1-OG1 3.35Å; I183-V193 HydrophobicContact CD1-CG2 3.41Å; I183-V193 VanDerWaalsContact CD1-CG2 3.41Å; I183-V193 HydrophobicContact CG1-CG2 3.87Å; I183-V193 HydrophobicContact CG2-CG2 3.88Å
184T94Very high94.3Very high79 Ų7965.2 Ų65.249%0.48535%0.349SS..EExtended strand (participates in β ladder)trans-108130163.6540000109.8M159M159-T184 HydrophobicContact CB-CG2 4.39Å; M159-T184 HydrophobicContact CE-CG2 3.96Å; M159-T184 HydrophobicContact CG-CG2 4.25Å
185I94.9Very high94.3Very high0 Ų064.8 Ų64.80%035%0.347CS..EExtended strand (participates in β ladder)trans-100.5125.5-177.6-49.1162.4000108.2V119 F150 N152 T157 V158 V160 I183 S189 T191V119-I185 HydrophobicContact CG1-CD1 4.35Å; F150-I185 HydrophobicContact CB-CD1 3.64Å; F150-I185 HydrophobicContact CB-CG1 4.42Å; F150-I185 HydrophobicContact CD1-CD1 4.24Å; F150-I185 HydrophobicContact CG-CD1 4.05Å; N152-I185 HydrophobicContact CB-CB 4.26Å; N152-I185 HydrophobicContact CB-CG2 3.49Å; N152-I185 VanDerWaalsContact CB-CG2 3.49Å; T157-I185 WeakPolarHBondContact CA-O 3.35Å; V158-I185 PolarHBondContact N-O 2.91Å; V158-I185 VanDerWaalsContact N-O 3.09Å; V158-I185 PolarHBondContact O-N 3.09Å; V160-I185 HydrophobicContact CG2-CD1 3.78Å; V160-I185 HydrophobicContact CG2-CG1 4.24Å; I183-I185 HydrophobicContact CD1-CD1 4.47Å; I183-I185 HydrophobicContact CD1-CG1 3.78Å; I183-I185 HydrophobicContact CG1-CG1 4.35Å; I185-S189 WeakPolarHBondContact CG2-OG 3.48Å; I185-T191 HydrophobicContact CG2-CG2 4.44Å
186Q95.2Very high94.3Very high108 Ų10867.5 Ų67.551%0.50536%0.362SS..PPolyproline II helixtrans-69.3159.3179.9-64.2-59.9-33.900111.4N152 S189N152-Q186 PolarHBondContact ND2-O 2.69Å; Q186-S189 VanDerWaalsContact C-OG 3.29Å; Q186-S189 WeakPolarHBondContact CA-OG 3.4Å; Q186-S189 WeakPolarHBondContact CB-OG 3.4Å; Q186-S189 PolarHBondContact N-OG 2.96Å; Q186-S189 PolarHBondContact O-N 2.99Å; Q186-S189 PolarHBondContact O-OG 3.37Å
187P94.3Very high94.3Very high50 Ų5063 Ų6333%0.32534%0.335SS..THydrogen-bonded Turntrans-56.4141174-22.934.3000111.4N154 T157 S189N154-P187 WeakPolarHBondContact O-CA 3.24Å; T157-P187 HydrophobicContact CG2-CG 4.27Å; P187-S189 PolarHBondContact O-N 2.89Å
188L93.8Very high94.3Very high108 Ų10865.5 Ų65.557%0.56535%0.354SS*.THydrogen-bonded Turntrans5132.9175.9-55.5175.4000114N152 N154 F155N152-L188 CarbonylContact O-C 3.51Å; N152-L188 WeakPolarHBondContact O-CA 3.28Å; N152-L188 PolarHBondContact O-N 3.06Å; N154-L188 PolarHBondContact O-N 3.45Å; F155-L188 HydrophobicContact CD1-CD1 3.92Å; F155-L188 HydrophobicContact CD1-CD2 4.4Å; F155-L188 HydrophobicContact CD1-CG 4.31Å; F155-L188 HydrophobicContact CE1-CD1 3.84Å; F155-L188 HydrophobicContact CE1-CD2 4.28Å; F155-L188 HydrophobicContact CE1-CG 4.46Å
189S95.4Very high94.3Very high31 Ų3159.8 Ų59.822%0.21733%0.327CS..  trans-122.2161.6-174.577.10000112.8N152 I185 Q186 P187N152-S189 PolarHBondContact N-O 2.8Å; N152-S189 PolarHBondContact O-N 3.09Å; I185-S189 WeakPolarHBondContact CG2-OG 3.48Å; Q186-S189 VanDerWaalsContact C-OG 3.29Å; Q186-S189 WeakPolarHBondContact CA-OG 3.4Å; Q186-S189 WeakPolarHBondContact CB-OG 3.4Å; Q186-S189 PolarHBondContact N-OG 2.96Å; Q186-S189 PolarHBondContact O-N 2.99Å; Q186-S189 PolarHBondContact O-OG 3.37Å; P187-S189 PolarHBondContact O-N 2.89Å
190Q94.9Very high94.2Very high117 Ų11761.1 Ų61.155%0.54733%0.332SS..EExtended strand (participates in β ladder)trans-122.8133.6176.2-174.2171.620.100109.5N149 F150 T151N149-Q190 PolarHBondContact ND2-NE2 2.86Å; N149-Q190 WeakPolarHBondContact OD1-CG 3.36Å; N149-Q190 PolarHBondContact OD1-NE2 3.3Å; F150-Q190 CarbonylContact O-C 3.48Å; F150-Q190 VanDerWaalsContact O-CA 3.25Å; F150-Q190 WeakPolarHBondContact O-CA 3.46Å; F150-Q190 WeakPolarHBondContact O-CG 3.36Å; T151-Q190 PolarHBondContact OG1-NE2 2.82Å
191T93.7Very high94.1Very high43 Ų4356.6 Ų56.626%0.26431%0.308SS..EExtended strand (participates in β ladder)trans-137.8144.2-17955.80000111F150 I183 I185F150-T191 PolarHBondContact N-O 3.45Å; F150-T191 PolarHBondContact O-N 2.78Å; I183-T191 WeakPolarHBondContact CD1-OG1 3.35Å; I185-T191 HydrophobicContact CG2-CG2 4.44Å
192Q94.3Very high94Very high92 Ų9252.6 Ų52.643%0.4329%0.29SS..EExtended strand (participates in β ladder)trans-110.9135.8179.1176.4160.46200110.2D124 S147 L148D124-Q192 PolarHBondContact OD2-NE2 3.01Å; S147-Q192 WeakPolarHBondContact OG-CG 3.5Å; S147-Q192 PolarHBondContact OG-NE2 2.92Å; L148-Q192 WeakPolarHBondContact O-CA 3.35Å
193V93.9Very high93.8Very high17 Ų1754 Ų5410%0.10331%0.31CS..EExtended strand (participates in β ladder)trans-125.5130177.7-178.50000109.7S147 L148 F150 V182 I183S147-V193 WeakPolarHBondContact CA-O 3.48Å; S147-V193 PolarHBondContact OG-O 3.49Å; L148-V193 PolarHBondContact N-O 3.47Å; L148-V193 PolarHBondContact O-N 2.89Å; F150-V193 HydrophobicContact CD2-CB 4.48Å; F150-V193 HydrophobicContact CD2-CG2 3.97Å; F150-V193 HydrophobicContact CE2-CB 3.97Å; F150-V193 HydrophobicContact CE2-CG2 3.79Å; V182-V193 HydrophobicContact CG1-CG1 3.79Å; I183-V193 HydrophobicContact CD1-CG2 3.41Å; I183-V193 VanDerWaalsContact CD1-CG2 3.41Å; I183-V193 HydrophobicContact CG1-CG2 3.87Å; I183-V193 HydrophobicContact CG2-CG2 3.88Å
194N95Very high93.4Very high94 Ų9456.6 Ų56.650%0.50333%0.332SS..EExtended strand (participates in β ladder)trans-98.4138173.4-60.2-24.9000109.6T145 S146 S147T145-N194 HydrophobicContact CG2-CB 4.34Å; S146-N194 WeakPolarHBondContact O-CA 3.45Å; S147-N194 VanDerWaalsContact CB-OD1 3.24Å; S147-N194 WeakPolarHBondContact CB-OD1 3.36Å; S147-N194 PolarHBondContact OG-OD1 2.91Å
195F94.5Very high93.1Very high5 Ų553.3 Ų53.32%0.02231%0.312CS..EExtended strand (participates in β ladder)trans-138.6146.7177.265.6-77.9000109.6T145 S146 L148 L163 C165 M177 V197 M226T145-F195 CarbonylContact C-O 3.57Å; T145-F195 WeakPolarHBondContact CA-O 3.44Å; S146-F195 PolarHBondContact N-O 2.68Å; S146-F195 WeakPolarHBondContact O-CD1 3.23Å; S146-F195 PolarHBondContact O-N 3.01Å; L148-F195 HydrophobicContact CD1-CE1 4.15Å; L148-F195 HydrophobicContact CD2-CE1 4.36Å; L148-F195 HydrophobicContact CG-CD1 4.36Å; L148-F195 HydrophobicContact CG-CE1 3.7Å; L148-F195 HydrophobicContact CG-CZ 4.45Å; L163-F195 HydrophobicContact CD1-CD1 4.27Å; L163-F195 HydrophobicContact CD1-CG 4.48Å; L163-F195 HydrophobicContact CD2-CB 4.26Å; L163-F195 HydrophobicContact CD2-CD1 4.33Å; L163-F195 HydrophobicContact CD2-CD2 3.92Å; L163-F195 HydrophobicContact CD2-CE2 4.34Å; L163-F195 HydrophobicContact CD2-CG 3.89Å; C165-F195 HydrophobicContact CB-CD2 4.36Å; C165-F195 HydrophobicContact CB-CE2 3.79Å; M177-F195 HydrophobicContact SD-CB 3.93Å; M177-F195 HydrophobicContact SD-CD2 3.66Å; M177-F195 HydrophobicContact SD-CG 4.23Å; F195-V197 HydrophobicContact CD2-CG2 3.85Å; F195-V197 HydrophobicContact CE2-CG2 3.83Å; F195-M226 HydrophobicContact CE2-CE 4.36Å; F195-M226 HydrophobicContact CZ-CE 4.5Å
196T95.1Very high92.7Very high66 Ų6655.8 Ų55.841%0.40533%0.329SS..EExtended strand (participates in β ladder)trans-115.8127.2-178-56.60000109.8N143 M144 T145 M177N143-T196 HydrophobicContact CB-CG2 4.35Å; M144-T196 CarbonylContact O-C 3.59Å; M144-T196 VanDerWaalsContact O-CA 3.26Å; M144-T196 WeakPolarHBondContact O-CA 3.37Å; T145-T196 PolarHBondContact OG1-OG1 2.94Å; M177-T196 WeakPolarHBondContact CG-O 3.37Å
197V96.3Very high92.4Very high0 Ų056.5 Ų56.50%033%0.328CS..EExtended strand (participates in β ladder)trans-108.5125175.8-1710000109.1M144 C165 V167 M177 F195 V199M144-V197 PolarHBondContact N-O 2.9Å; M144-V197 PolarHBondContact O-N 2.77Å; C165-V197 HydrophobicContact CB-CG2 3.89Å; V167-V197 HydrophobicContact CG2-CB 4.23Å; V167-V197 HydrophobicContact CG2-CG1 3.69Å; M177-V197 HydrophobicContact CB-CB 4.25Å; M177-V197 HydrophobicContact CB-CG1 3.98Å; M177-V197 HydrophobicContact CB-CG2 3.84Å; M177-V197 HydrophobicContact CG-CG2 4.32Å; M177-V197 HydrophobicContact SD-CG2 4.25Å; F195-V197 HydrophobicContact CD2-CG2 3.85Å; F195-V197 HydrophobicContact CE2-CG2 3.83Å; V197-V199 HydrophobicContact CG1-CG2 4.4Å
198S95.3Very high92.3Very high74 Ų7454.1 Ų54.152%0.51731%0.313SS..EExtended strand (participates in β ladder)trans-89126.7171.7-64.90000110N143 G175N143-S198 WeakPolarHBondContact OD1-CA 3.5Å; N143-S198 WeakPolarHBondContact OD1-CB 3.12Å; N143-S198 PolarHBondContact OD1-OG 3.13Å; G175-S198 WeakPolarHBondContact CA-O 3.29Å
199V94.6Very high92.2Very high5 Ų550.7 Ų50.73%0.0329%0.292CS..EExtended strand (participates in β ladder)trans-117.2132.6-176.5169.80000108.2L141 I142 V167 I174 V197 I201L141-V199 WeakPolarHBondContact CA-O 3.36Å; I142-V199 HydrophobicContact CB-CB 4.12Å; I142-V199 HydrophobicContact CB-CG1 4.44Å; I142-V199 PolarHBondContact N-O 3.07Å; I142-V199 WeakPolarHBondContact O-CB 3.29Å; I142-V199 PolarHBondContact O-N 3.48Å; V167-V199 HydrophobicContact CB-CG2 3.86Å; V167-V199 HydrophobicContact CG1-CG2 3.87Å; V167-V199 HydrophobicContact CG2-CG2 4Å; I174-V199 HydrophobicContact CB-CG1 4.03Å; I174-V199 HydrophobicContact CD1-CG1 3.39Å; I174-V199 HydrophobicContact CG1-CG1 3.66Å; I174-V199 WeakPolarHBondContact O-CA 3.37Å; V197-V199 HydrophobicContact CG1-CG2 4.4Å; V199-I201 HydrophobicContact CG1-CG1 4.07Å
200Q93.6Very high92Very high97 Ų9751.8 Ų51.845%0.45330%0.303SS..EExtended strand (participates in β ladder)trans-125.4113.4177.2-175.4176.943.200109.5I174I174-Q200 PolarHBondContact O-N 3.32Å
201I92.4Very high91.9Very high1 Ų149.3 Ų49.31%0.00529%0.291CS..EExtended strand (participates in β ladder)trans-97.5113.4177-53.9-177.9000107.9V140 I142 I174 V199 T205 V208 I222V140-I201 HydrophobicContact CB-CB 4.46Å; V140-I201 PolarHBondContact N-O 2.84Å; V140-I201 PolarHBondContact O-N 3.29Å; I142-I201 HydrophobicContact CD1-CD1 4.11Å; I174-I201 HydrophobicContact CB-CG1 4.49Å; I174-I201 HydrophobicContact CD1-CD1 4.09Å; I174-I201 HydrophobicContact CD1-CG1 3.97Å; V199-I201 HydrophobicContact CG1-CG1 4.07Å; I201-T205 WeakPolarHBondContact CG2-O 3.1Å; I201-T205 WeakPolarHBondContact CG2-OG1 3.26Å; I201-V208 HydrophobicContact CD1-CG1 3.94Å; I201-V208 HydrophobicContact CG2-CB 3.81Å; I201-V208 HydrophobicContact CG2-CG1 4.16Å; I201-V208 HydrophobicContact CG2-CG2 4.03Å; I201-I222 HydrophobicContact CD1-CD1 3.84Å
202S88.4Confident91.8Very high43 Ų4347.4 Ų47.430%0.30128%0.279SS..  trans-153.9175.4-177.571.10000112.2S204 T205S202-S204 PolarHBondContact O-N 2.8Å; S202-T205 PolarHBondContact O-N 2.84Å; S202-T205 PolarHBondContact O-OG1 3.12Å
203G87.1Confident91.6Very high56 Ų5645.8 Ų45.858%0.57728%0.276SS*.G310 helixtrans66.9-119.3175.100000112.9T205 S206G203-T205 PolarHBondContact O-N 2.83Å; G203-S206 VanDerWaalsContact O-CB 3.23Å; G203-S206 WeakPolarHBondContact O-CB 3.26Å; G203-S206 PolarHBondContact O-N 2.81Å; G203-S206 VanDerWaalsContact O-N 3.1Å; G203-S206 PolarHBondContact O-OG 2.85Å
204S84.9Confident91.5Very high102 Ų10248.5 Ų48.571%0.71329%0.288SS*.G310 helixtrans-63.2-21.3-178.454.90000113.8S202S202-S204 PolarHBondContact O-N 2.8Å
205T86.8Confident91.1Very high10 Ų1048.9 Ų48.96%0.06130%0.304CS..G310 helixtrans-105.318.1177.157.60000112.9Y169 I201 S202 G203 Y207 V208Y169-T205 HydrophobicContact CD1-CG2 4.03Å; Y169-T205 HydrophobicContact CE1-CG2 4.31Å; I201-T205 WeakPolarHBondContact CG2-O 3.1Å; I201-T205 WeakPolarHBondContact CG2-OG1 3.26Å; S202-T205 PolarHBondContact O-N 2.84Å; S202-T205 PolarHBondContact O-OG1 3.12Å; G203-T205 PolarHBondContact O-N 2.83Å; T205-Y207 PolarHBondContact O-N 2.82Å; T205-V208 WeakPolarHBondContact O-CB 3.44Å; T205-V208 VanDerWaalsContact O-CG2 3.31Å; T205-V208 WeakPolarHBondContact O-CG2 3.29Å; T205-V208 PolarHBondContact O-N 2.95Å; T205-V208 VanDerWaalsContact O-N 3.12Å
206S86.7Confident90.7Very high52 Ų5253.3 Ų53.336%0.36434%0.336SS..THydrogen-bonded Turntrans-59.4-24.9178.750.50000114G203 V208 Y209G203-S206 VanDerWaalsContact O-CB 3.23Å; G203-S206 WeakPolarHBondContact O-CB 3.26Å; G203-S206 PolarHBondContact O-N 2.81Å; G203-S206 VanDerWaalsContact O-N 3.1Å; G203-S206 PolarHBondContact O-OG 2.85Å; S206-V208 PolarHBondContact O-N 3.16Å; S206-V208 VanDerWaalsContact O-N 3.09Å; S206-Y209 VanDerWaalsContact O-CB 3.3Å; S206-Y209 WeakPolarHBondContact O-CB 3.31Å; S206-Y209 PolarHBondContact O-N 2.84Å
207Y89.6Confident90.2Very high123 Ų12353 Ų5348%0.48233%0.331SS..Hα-helixtrans-57.6-24.5174.766.6-94.6000113.3Y169 T205 Y209 A210 F211Y169-Y207 WeakPolarHBondContact CE1-OH 3.33Å; T205-Y207 PolarHBondContact O-N 2.82Å; Y207-Y209 VanDerWaalsContact C-N 3.25Å; Y207-Y209 PolarHBondContact O-N 2.81Å; Y207-A210 PolarHBondContact O-N 3.04Å; Y207-F211 PolarHBondContact O-N 2.94Å
208V91.6Very high89.6Confident1 Ų162.7 Ų62.71%0.00637%0.373CS..Hα-helixtrans-63-33.8175.6178.20000110.9Y169 I201 T205 S206 A210 F211 C212 I222Y169-V208 HydrophobicContact CE1-CG2 3.78Å; I201-V208 HydrophobicContact CD1-CG1 3.94Å; I201-V208 HydrophobicContact CG2-CB 3.81Å; I201-V208 HydrophobicContact CG2-CG1 4.16Å; I201-V208 HydrophobicContact CG2-CG2 4.03Å; T205-V208 WeakPolarHBondContact O-CB 3.44Å; T205-V208 VanDerWaalsContact O-CG2 3.31Å; T205-V208 WeakPolarHBondContact O-CG2 3.29Å; T205-V208 PolarHBondContact O-N 2.95Å; T205-V208 VanDerWaalsContact O-N 3.12Å; S206-V208 PolarHBondContact O-N 3.16Å; S206-V208 VanDerWaalsContact O-N 3.09Å; V208-A210 VanDerWaalsContact C-N 3.34Å; V208-A210 PolarHBondContact O-N 2.86Å; V208-F211 WeakPolarHBondContact O-CB 3.46Å; V208-F211 PolarHBondContact O-N 2.71Å; V208-C212 VanDerWaalsContact CG1-SG 3.57Å; V208-C212 WeakPolarHBondContact O-CB 3.42Å; V208-C212 PolarHBondContact O-N 3.3Å; V208-C212 PolarHBondContact O-SG 3.32Å; V208-I222 HydrophobicContact CG1-CG2 4.27Å
209Y92.3Very high89.2Confident36 Ų3663.3 Ų63.314%0.14137%0.373CS..Hα-helixtrans-60-45.6174.3171.9-89.6000111.5F133 H135 T138 V140 S206 Y207 F211 C212 T213F133-Y209 HydrophobicContact CB-CE2 4.31Å; F133-Y209 HydrophobicContact CD1-CD2 4.32Å; F133-Y209 HydrophobicContact CD1-CE2 4.3Å; H135-Y209 WeakPolarHBondContact CA-OH 3.41Å; H135-Y209 AromaticContact ND1-CZ 3.89Å; H135-Y209 PolarHBondContact ND1-OH 2.96Å; T138-Y209 HydrophobicContact CG2-CD1 4.2Å; T138-Y209 HydrophobicContact CG2-CE1 4.05Å; T138-Y209 WeakPolarHBondContact O-CB 3.39Å; V140-Y209 HydrophobicContact CG2-CD2 4Å; V140-Y209 HydrophobicContact CG2-CG 4.41Å; S206-Y209 VanDerWaalsContact O-CB 3.3Å; S206-Y209 WeakPolarHBondContact O-CB 3.31Å; S206-Y209 PolarHBondContact O-N 2.84Å; Y207-Y209 VanDerWaalsContact C-N 3.25Å; Y207-Y209 PolarHBondContact O-N 2.81Å; Y209-F211 VanDerWaalsContact C-N 3.3Å; Y209-F211 PolarHBondContact O-N 2.94Å; Y209-C212 PolarHBondContact O-N 2.84Å; Y209-T213 HydrophobicContact CD2-CG2 4.32Å; Y209-T213 HydrophobicContact CE1-CG2 4.4Å; Y209-T213 HydrophobicContact CE2-CG2 3.97Å; Y209-T213 WeakPolarHBondContact O-CB 3.35Å; Y209-T213 WeakPolarHBondContact O-CG2 3.33Å; Y209-T213 PolarHBondContact O-N 3.38Å; Y209-T213 PolarHBondContact O-OG1 2.8Å
210A91.3Very high88.9Confident53 Ų5364 Ų6444%0.43838%0.376SS..Hα-helixtrans-63.9-38.3176.700000111.4Y207 V208 M214Y207-A210 PolarHBondContact O-N 3.04Å; V208-A210 VanDerWaalsContact C-N 3.34Å; V208-A210 PolarHBondContact O-N 2.86Å; A210-M214 WeakPolarHBondContact O-CB 3.31Å; A210-M214 PolarHBondContact O-N 2.79Å
211F92.1Very high88.8Confident66 Ų6663.3 Ų63.329%0.28938%0.376SS..Hα-helixtrans-61.2-55.8173.3178.8-104.6000111.5Y207 V208 Y209 T213 M214 I217 H220 I222Y207-F211 PolarHBondContact O-N 2.94Å; V208-F211 WeakPolarHBondContact O-CB 3.46Å; V208-F211 PolarHBondContact O-N 2.71Å; Y209-F211 VanDerWaalsContact C-N 3.3Å; Y209-F211 PolarHBondContact O-N 2.94Å; F211-T213 VanDerWaalsContact C-N 3.25Å; F211-T213 PolarHBondContact O-N 2.82Å; F211-M214 WeakPolarHBondContact O-CB 3.33Å; F211-M214 PolarHBondContact O-N 3.29Å; F211-M214 VanDerWaalsContact O-N 3.14Å; F211-I217 HydrophobicContact CD2-CD1 3.96Å; F211-I217 HydrophobicContact CE2-CD1 3.81Å; F211-H220 HydrophobicContact CE1-CB 4.14Å; F211-H220 PolarHBondContact O-CD2 2.88Å; F211-H220 PolarHBondContact O-NE2 2.86Å; F211-I222 HydrophobicContact CD1-CG2 4.3Å; F211-I222 HydrophobicContact CE1-CG2 4.2Å
212C91.2Very high88.8Confident3 Ų363.6 Ų63.62%0.0238%0.377CS..Hα-helixtrans-64.5-25-175.4-59.20000114.2F133 V140 V208 Y209 C251F133-C212 HydrophobicContact CE1-CB 3.71Å; F133-C212 HydrophobicContact CZ-CB 4.18Å; V140-C212 HydrophobicContact CG2-CB 4.41Å; V208-C212 VanDerWaalsContact CG1-SG 3.57Å; V208-C212 WeakPolarHBondContact O-CB 3.42Å; V208-C212 PolarHBondContact O-N 3.3Å; V208-C212 PolarHBondContact O-SG 3.32Å; Y209-C212 PolarHBondContact O-N 2.84Å; C212-C251 VanDerWaalsContact CA-SG 3.58Å; C212-C251 HydrophobicContact CB-CB 3.88Å; C212-C251 WeakPolarHBondContact CB-SG 3.23Å; C212-C251 WeakPolarHBondContact SG-CB 3.31Å; C212-C251 CovalentContact SG-SG 2.02Å; C212-C251 PolarHBondContact SG-SG 3.32Å
213T91.2Very high89Confident58 Ų5864.7 Ų64.736%0.35638%0.379SS..THydrogen-bonded Turntrans-97.7-2.4178.9570000113.4F133 Y209 F211 A215F133-T213 HydrophobicContact CD1-CG2 3.78Å; F133-T213 HydrophobicContact CE1-CG2 3.82Å; F133-T213 HydrophobicContact CG-CG2 4.23Å; F133-T213 HydrophobicContact CZ-CG2 4.28Å; Y209-T213 HydrophobicContact CD2-CG2 4.32Å; Y209-T213 HydrophobicContact CE1-CG2 4.4Å; Y209-T213 HydrophobicContact CE2-CG2 3.97Å; Y209-T213 WeakPolarHBondContact O-CB 3.35Å; Y209-T213 WeakPolarHBondContact O-CG2 3.33Å; Y209-T213 PolarHBondContact O-N 3.38Å; Y209-T213 PolarHBondContact O-OG1 2.8Å; F211-T213 VanDerWaalsContact C-N 3.25Å; F211-T213 PolarHBondContact O-N 2.82Å; T213-A215 PolarHBondContact O-N 3.36Å
214M90.8Very high89.4Confident74 Ų7462 Ų6237%0.36535%0.352SS..  trans-72.6114-174-144.8-179.2-49.700111.8A210 F211 S216 I217 H220A210-M214 WeakPolarHBondContact O-CB 3.31Å; A210-M214 PolarHBondContact O-N 2.79Å; F211-M214 WeakPolarHBondContact O-CB 3.33Å; F211-M214 PolarHBondContact O-N 3.29Å; F211-M214 VanDerWaalsContact O-N 3.14Å; M214-S216 VanDerWaalsContact C-N 3.27Å; M214-S216 WeakPolarHBondContact CG-OG 3.39Å; M214-S216 PolarHBondContact O-N 2.93Å; M214-S216 PolarHBondContact SD-OG 3.14Å; M214-I217 HydrophobicContact CE-CD1 4.1Å; M214-I217 PolarHBondContact O-N 3.23Å; M214-I217 VanDerWaalsContact O-O 3.09Å; M214-I217 HydrophobicContact SD-CD1 3.96Å; M214-I217 HydrophobicContact SD-CG1 4.28Å; M214-H220 PolarHBondContact O-NE2 3.39Å
215A86.6Confident89.9Confident102 Ų10258.7 Ų58.784%0.84333%0.326SS*.THydrogen-bonded Turntrans-70-19.5179.800000114.4T213 I217T213-A215 PolarHBondContact O-N 3.36Å; A215-I217 VanDerWaalsContact C-N 3.26Å; A215-I217 PolarHBondContact O-N 3.45Å
216S86.9Confident90.3Very high98 Ų9858.3 Ų58.369%0.68532%0.324SS*.THydrogen-bonded Turntrans-71.1-23.8177.555.50000112.7M214M214-S216 VanDerWaalsContact C-N 3.27Å; M214-S216 WeakPolarHBondContact CG-OG 3.39Å; M214-S216 PolarHBondContact O-N 2.93Å; M214-S216 PolarHBondContact SD-OG 3.14Å
217I84.3Confident90.7Very high59 Ų5959.4 Ų59.430%0.30332%0.323SS..  trans-103.8126.1179.5-58.7176.8000107.5F211 M214 A215 V219 H220F211-I217 HydrophobicContact CD2-CD1 3.96Å; F211-I217 HydrophobicContact CE2-CD1 3.81Å; M214-I217 HydrophobicContact CE-CD1 4.1Å; M214-I217 PolarHBondContact O-N 3.23Å; M214-I217 VanDerWaalsContact O-O 3.09Å; M214-I217 HydrophobicContact SD-CD1 3.96Å; M214-I217 HydrophobicContact SD-CG1 4.28Å; A215-I217 VanDerWaalsContact C-N 3.26Å; A215-I217 PolarHBondContact O-N 3.45Å; I217-V219 WeakPolarHBondContact CG2-O 3.32Å; I217-H220 PolarHBondContact O-CE1 3.19Å; I217-H220 PolarHBondContact O-NE2 3.08Å
218K82.9Confident91Very high203 Ų20354 Ų5488%0.88330%0.302SS*.SBendtrans-85.7-14.6179-67.3-173.9179-178.70113.9
219V86.7Confident91.2Very high87 Ų8754.8 Ų54.853%0.52731%0.308SS..  trans-130.5116.7-173.4-177.20000109.5I217 N221I217-V219 WeakPolarHBondContact CG2-O 3.32Å; V219-N221 HydrophobicContact CG1-CB 4.4Å; V219-N221 VanDerWaalsContact CG1-ND2 3.28Å; V219-N221 WeakPolarHBondContact CG1-ND2 2.99Å
220H89.8Confident91.4Very high20 Ų2053.1 Ų53.19%0.09330%0.302CS..  trans-113.753.9-173.6-5599.5000111.6F211 M214 I217 C251F211-H220 HydrophobicContact CE1-CB 4.14Å; F211-H220 PolarHBondContact O-CD2 2.88Å; F211-H220 PolarHBondContact O-NE2 2.86Å; M214-H220 PolarHBondContact O-NE2 3.39Å; I217-H220 PolarHBondContact O-CE1 3.19Å; I217-H220 PolarHBondContact O-NE2 3.08Å; H220-C251 PolarHBondContact O-N 2.02Å; H220-C251 PolarHBondContact O-SG 2.83Å
221N90.9Very high91.6Very high83 Ų8354.5 Ų54.544%0.44430%0.298SS..EExtended strand (participates in β ladder)trans-82122.1-177.8-69.3-25.6000111.9V219 I249 D250V219-N221 HydrophobicContact CG1-CB 4.4Å; V219-N221 VanDerWaalsContact CG1-ND2 3.28Å; V219-N221 WeakPolarHBondContact CG1-ND2 2.99Å; N221-I249 CarbonylContact C-O 3.53Å; N221-I249 VanDerWaalsContact CA-O 3.29Å; N221-I249 WeakPolarHBondContact CA-O 3.44Å; N221-D250 WeakPolarHBondContact OD1-CA 3.44Å
222I92.3Very high91.7Very high6 Ų651.4 Ų51.43%0.03128%0.284CS..EExtended strand (participates in β ladder)trans-107.8142.3170.362.6171.5000110.1I142 Y169 I201 V208 F211 V224 Y248 I249 C251I142-I222 HydrophobicContact CD1-CD1 3.89Å; Y169-I222 HydrophobicContact CE2-CB 4.12Å; Y169-I222 HydrophobicContact CE2-CG2 4.45Å; I201-I222 HydrophobicContact CD1-CD1 3.84Å; V208-I222 HydrophobicContact CG1-CG2 4.27Å; F211-I222 HydrophobicContact CD1-CG2 4.3Å; F211-I222 HydrophobicContact CE1-CG2 4.2Å; I222-V224 HydrophobicContact CD1-CG1 4.31Å; I222-V224 HydrophobicContact CG1-CG1 4.5Å; I222-Y248 CarbonylContact O-C 3.45Å; I222-Y248 WeakPolarHBondContact O-CA 3.41Å; I222-I249 HydrophobicContact CG1-CB 3.99Å; I222-I249 PolarHBondContact N-O 3.46Å; I222-I249 PolarHBondContact O-N 2.84Å; I222-C251 HydrophobicContact CD1-CB 4.34Å; I222-C251 HydrophobicContact CG1-CB 4.5Å
223L93.1Very high91.8Very high66 Ų6652.7 Ų52.735%0.34629%0.293SS..EExtended strand (participates in β ladder)trans-92.7123.4173178.364.6000109.4Y169 Y248Y169-L223 WeakPolarHBondContact CD2-O 3.4Å; L223-Y248 HydrophobicContact CB-CD1 4.16Å; L223-Y248 HydrophobicContact CB-CE1 3.94Å; L223-Y248 HydrophobicContact CD1-CD1 4.19Å; L223-Y248 HydrophobicContact CD1-CD2 4.34Å; L223-Y248 HydrophobicContact CD1-CE1 3.98Å; L223-Y248 HydrophobicContact CD1-CE2 4.13Å; L223-Y248 HydrophobicContact CD1-CG 4.38Å; L223-Y248 HydrophobicContact CG-CE1 4.39Å
224V94.7Very high91.8Very high1 Ų151.6 Ų51.61%0.00628%0.283CS..EExtended strand (participates in β ladder)trans-116.2153.4170.4-55.40000110.7M144 V167 L168 I174 I222 M226 R247 I249M144-V224 HydrophobicContact CE-CG2 4.37Å; V167-V224 HydrophobicContact CG1-CB 3.82Å; V167-V224 HydrophobicContact CG1-CG1 4.22Å; V167-V224 HydrophobicContact CG1-CG2 4.03Å; L168-V224 CarbonylContact O-C 3.52Å; L168-V224 WeakPolarHBondContact O-CA 3.48Å; I174-V224 HydrophobicContact CD1-CG1 4.24Å; I222-V224 HydrophobicContact CD1-CG1 4.31Å; I222-V224 HydrophobicContact CG1-CG1 4.5Å; V224-M226 HydrophobicContact CG2-CG 4.46Å; V224-R247 HydrophobicContact CG2-CB 4.02Å; V224-R247 PolarHBondContact N-O 3.35Å; V224-R247 PolarHBondContact O-N 3.04Å; V224-I249 HydrophobicContact CB-CD1 4.3Å; V224-I249 HydrophobicContact CG1-CD1 3.72Å; V224-I249 HydrophobicContact CG2-CD1 3.56Å; V224-I249 HydrophobicContact CG2-CG1 4.11Å
225I95.6Very high91.5Very high31 Ų3154.9 Ų54.916%0.15930%0.299CS..EExtended strand (participates in β ladder)trans-109.3119.9174-53173.4000106.9V167 L168 Q227 E244 Y246V167-I225 CarbonylContact C-O 3.6Å; V167-I225 WeakPolarHBondContact CA-O 3.44Å; L168-I225 HydrophobicContact CB-CB 4.31Å; L168-I225 PolarHBondContact N-O 3.47Å; L168-I225 PolarHBondContact O-N 2.97Å; I225-Q227 HydrophobicContact CG2-CG 4.3Å; I225-E244 HydrophobicContact CG2-CG 3.61Å; I225-E244 WeakPolarHBondContact CG2-OE1 3.47Å; I225-Y246 HydrophobicContact CD1-CD1 4.5Å; I225-Y246 HydrophobicContact CD1-CE1 3.87Å; I225-Y246 HydrophobicContact CG1-CD1 3.94Å; I225-Y246 HydrophobicContact CG1-CE1 3.79Å; I225-Y246 HydrophobicContact CG2-CE1 4.5Å
226M95.1Very high91.3Very high3 Ų359.1 Ų59.12%0.01530%0.304CS..EExtended strand (participates in β ladder)trans-97.8117.3174.2-59.8-1747400108.8M144 V167 F195 V224 E244 A245 R247M144-M226 HydrophobicContact SD-CE 3.67Å; M144-M226 HydrophobicContact SD-SD 3.36Å; V167-M226 HydrophobicContact CG2-CE 4.42Å; V167-M226 HydrophobicContact CG2-CG 4.34Å; F195-M226 HydrophobicContact CE2-CE 4.36Å; F195-M226 HydrophobicContact CZ-CE 4.5Å; V224-M226 HydrophobicContact CG2-CG 4.46Å; M226-E244 CarbonylContact O-C 3.59Å; M226-E244 WeakPolarHBondContact O-CA 3.44Å; M226-A245 PolarHBondContact N-O 3.34Å; M226-A245 PolarHBondContact O-N 3.22Å; M226-R247 HydrophobicContact CG-CG 4.3Å; M226-R247 HydrophobicContact SD-CG 3.91Å
227Q96.4Very high91.3Very high74 Ų7462.6 Ų62.635%0.34630%0.302SS..EExtended strand (participates in β ladder)trans-105.7107.4173.1-71.1-176.5-1600108.6C165 Q166 L168 I225 L243 E244C165-Q227 CarbonylContact C-O 3.54Å; C165-Q227 WeakPolarHBondContact CA-O 3.45Å; Q166-Q227 PolarHBondContact N-O 3.24Å; Q166-Q227 PolarHBondContact O-N 3.33Å; L168-Q227 HydrophobicContact CD1-CB 4.21Å; L168-Q227 HydrophobicContact CD1-CG 3.93Å; I225-Q227 HydrophobicContact CG2-CG 4.3Å; Q227-L243 WeakPolarHBondContact CA-O 3.35Å; Q227-E244 HydrophobicContact CG-CG 4.16Å
228T96Very high91.6Very high9 Ų964.3 Ų64.36%0.05532%0.315CS..EExtended strand (participates in β ladder)trans-110.6123.2-176.1-57.50000109.2L148 S164 C165 V230 T242 L243L148-T228 HydrophobicContact CD1-CG2 3.82Å; L148-T228 HydrophobicContact CD2-CG2 4.46Å; S164-T228 CarbonylContact O-C 3.54Å; S164-T228 WeakPolarHBondContact O-CA 3.03Å; C165-T228 PolarHBondContact SG-OG1 2.94Å; C165-T228 VanDerWaalsContact SG-OG1 3.32Å; T228-V230 HydrophobicContact CG2-CG2 4.39Å; T228-T242 CarbonylContact O-C 3.52Å; T228-T242 WeakPolarHBondContact O-CA 3.34Å; T228-L243 PolarHBondContact N-O 3.39Å; T228-L243 PolarHBondContact O-N 3.22Å
229S95.9Very high92Very high19 Ų1956.1 Ų56.113%0.13329%0.285CS..EExtended strand (participates in β ladder)trans-116120.8176.1175.30000109.6S164 Q240 N241S164-S229 PolarHBondContact N-O 2.77Å; S164-S229 PolarHBondContact O-N 2.83Å; S164-S229 WeakPolarHBondContact OG-CB 3.1Å; S164-S229 PolarHBondContact OG-O 3.43Å; S164-S229 VanDerWaalsContact OG-O 3.12Å; S229-Q240 PolarHBondContact OG-NE2 2.86Å; S229-N241 WeakPolarHBondContact CA-O 3.2Å
230V96Very high92.3Very high0 Ų057.9 Ų57.90%029%0.288CS..EExtended strand (participates in β ladder)trans-107.7126.4176.2-176.20000108.8V121 L148 F150 V160 S162 T228 T232 Q240 N241V121-V230 HydrophobicContact CG1-CG2 4.11Å; L148-V230 HydrophobicContact CD1-CG2 3.79Å; F150-V230 HydrophobicContact CE1-CB 4.44Å; F150-V230 HydrophobicContact CE1-CG1 3.73Å; F150-V230 HydrophobicContact CE1-CG2 4.11Å; F150-V230 HydrophobicContact CZ-CG1 4.17Å; F150-V230 HydrophobicContact CZ-CG2 4.18Å; V160-V230 HydrophobicContact CG1-CG1 3.74Å; S162-V230 WeakPolarHBondContact O-CA 3.44Å; T228-V230 HydrophobicContact CG2-CG2 4.39Å; V230-T232 HydrophobicContact CG1-CG2 4Å; V230-Q240 CarbonylContact O-C 3.6Å; V230-Q240 WeakPolarHBondContact O-CA 3.3Å; V230-N241 PolarHBondContact N-O 3.14Å; V230-N241 PolarHBondContact O-N 3.1Å
231K95.6Very high92.5Very high82 Ų8259.6 Ų59.636%0.35730%0.298SS..EExtended strand (participates in β ladder)trans-103.3126.8169.4-170.7178.4176.5-179.30109.4V160 D161 S162 A239V160-K231 CarbonylContact C-O 3.55Å; D161-K231 HydrophobicContact CB-CB 4.49Å; D161-K231 HydrophobicContact CB-CD 4.47Å; D161-K231 HydrophobicContact CB-CG 4.37Å; D161-K231 PolarHBondContact N-O 3.27Å; S162-K231 PolarHBondContact N-O 3.04Å; S162-K231 PolarHBondContact O-N 3.3Å; S162-K231 WeakPolarHBondContact OG-CB 3.38Å; K231-A239 WeakPolarHBondContact CA-O 3.37Å
232T94.5Very high92.6Very high1 Ų160.8 Ų60.81%0.00631%0.308CS..EExtended strand (participates in β ladder)trans-120138.6176.257.40000110.1V158 M159 V160 V230 T238 A239V158-T232 HydrophobicContact CG1-CG2 4.35Å; M159-T232 CarbonylContact O-C 3.54Å; M159-T232 WeakPolarHBondContact O-CA 3.48Å; V160-T232 HydrophobicContact CG2-CG2 4.24Å; V230-T232 HydrophobicContact CG1-CG2 4Å; T232-T238 CarbonylContact O-C 3.58Å; T232-T238 WeakPolarHBondContact O-CA 3.44Å; T232-A239 PolarHBondContact N-O 3.19Å; T232-A239 PolarHBondContact O-N 3.05Å; T232-A239 PolarHBondContact OG1-O 2.96Å
233S93.4Very high92.8Very high30 Ų3062.6 Ų62.621%0.2132%0.318CS..EExtended strand (participates in β ladder)trans-113145.3169.663.40000111.1M159 D161 R237M159-S233 PolarHBondContact N-O 3.09Å; M159-S233 PolarHBondContact O-N 2.85Å; D161-S233 VanDerWaalsContact CG-OG 3.32Å; D161-S233 WeakPolarHBondContact OD1-CB 3.39Å; D161-S233 PolarHBondContact OD1-OG 2.84Å; D161-S233 WeakPolarHBondContact OD2-CB 3.43Å; D161-S233 PolarHBondContact OD2-N 3.28Å; D161-S233 PolarHBondContact OD2-OG 2.81Å; S233-R237 WeakPolarHBondContact CA-O 3.44Å
234Y90.1Very high92.9Very high36 Ų3664.2 Ų64.214%0.14132%0.324CS..EExtended strand (participates in β ladder)trans-151.7135.9170.150.8-90.8000109P116 F156 V158 M236 R237 A239P116-Y234 HydrophobicContact CB-CD2 4.22Å; P116-Y234 HydrophobicContact CB-CE2 3.4Å; P116-Y234 VanDerWaalsContact CB-CE2 3.4Å; P116-Y234 HydrophobicContact CG-CE2 4.14Å; F156-Y234 AromaticContact CE2-CD2 3.81Å; F156-Y234 HydrophobicContact CE2-CD2 3.81Å; F156-Y234 AromaticContact CE2-CG 3.89Å; F156-Y234 HydrophobicContact CE2-CG 3.89Å; F156-Y234 HydrophobicContact CZ-CD2 4.1Å; V158-Y234 HydrophobicContact CG1-CD1 4.14Å; V158-Y234 HydrophobicContact CG2-CD1 4.46Å; Y234-M236 PolarHBondContact O-N 3.12Å; Y234-R237 HydrophobicContact CD2-CB 4.41Å; Y234-R237 HydrophobicContact CE2-CB 3.9Å; Y234-R237 PolarHBondContact N-O 3.39Å; Y234-R237 PolarHBondContact O-N 3.2Å; Y234-R237 VanDerWaalsContact O-O 3.09Å; Y234-A239 HydrophobicContact CE1-CB 4.06Å
235M84.1Confident92.8Very high142 Ų14264.9 Ų64.970%0.733%0.329SS*.THydrogen-bonded Turntrans52.4-107-175-51.3179.2107.800111.3L114L114-M235 HydrophobicContact CD2-CE 3.94Å
236M82.9Confident92.7Very high191 Ų19170.2 Ų70.294%0.94135%0.348SS*.THydrogen-bonded Turntrans-118.57.3178.6-160.8-178.7179.500112.7Y234Y234-M236 PolarHBondContact O-N 3.12Å
237R86.9Confident92.6Very high172 Ų17273 Ų7365%0.64936%0.358SS*.EExtended strand (participates in β ladder)trans-109.4146.4-179.7-69-174.3-176.8-129.61.4110.2S233 Y234S233-R237 WeakPolarHBondContact CA-O 3.44Å; Y234-R237 HydrophobicContact CD2-CB 4.41Å; Y234-R237 HydrophobicContact CE2-CB 3.9Å; Y234-R237 PolarHBondContact N-O 3.39Å; Y234-R237 PolarHBondContact O-N 3.2Å; Y234-R237 VanDerWaalsContact O-O 3.09Å
238T91.3Very high92.4Very high94 Ų9477.3 Ų77.358%0.57737%0.373SS*.EExtended strand (participates in β ladder)trans-114.3141.6167.9550000108.1T232T232-T238 CarbonylContact O-C 3.58Å; T232-T238 WeakPolarHBondContact O-CA 3.44Å
239A91.3Very high92.1Very high31 Ų3177 Ų7726%0.25637%0.371SS..EExtended strand (participates in β ladder)trans-126.3147.817400000108.3K231 T232 Y234K231-A239 WeakPolarHBondContact CA-O 3.37Å; T232-A239 PolarHBondContact N-O 3.19Å; T232-A239 PolarHBondContact O-N 3.05Å; T232-A239 PolarHBondContact OG1-O 2.96Å; Y234-A239 HydrophobicContact CE1-CB 4.06Å
240Q93.4Very high91.9Very high124 Ų12478 Ų7858%0.57938%0.375SS*.EExtended strand (participates in β ladder)trans-130.8128.2178.7-175.8174.8-18.600109.2S229 V230S229-Q240 PolarHBondContact OG-NE2 2.86Å; V230-Q240 CarbonylContact O-C 3.6Å; V230-Q240 WeakPolarHBondContact O-CA 3.3Å
241N92.7Very high91.6Very high56 Ų5678 Ų7830%0.29938%0.375SS..EExtended strand (participates in β ladder)trans-117.7127.9177.2-71.8-39000108.9V119 V121 S229 V230V119-N241 PolarHBondContact O-ND2 3.02Å; V121-N241 HydrophobicContact CG2-CB 4.28Å; S229-N241 WeakPolarHBondContact CA-O 3.2Å; V230-N241 PolarHBondContact N-O 3.14Å; V230-N241 PolarHBondContact O-N 3.1Å
242T94.4Very high91.3Very high108 Ų10875.4 Ų75.466%0.66337%0.371SS*.EExtended strand (participates in β ladder)trans-112.9127.2177.454.60000109.9T228T228-T242 CarbonylContact O-C 3.52Å; T228-T242 WeakPolarHBondContact O-CA 3.34Å
243L94.7Very high90.5Very high45 Ų4577.2 Ų77.224%0.23638%0.384CS..EExtended strand (participates in β ladder)trans-116144.1176.7-60.3106.8000109.8V121 Q227 T228V121-L243 HydrophobicContact CB-CD1 4.07Å; V121-L243 HydrophobicContact CG1-CD1 3.6Å; V121-L243 WeakPolarHBondContact O-CD2 3.38Å; Q227-L243 WeakPolarHBondContact CA-O 3.35Å; T228-L243 PolarHBondContact N-O 3.39Å; T228-L243 PolarHBondContact O-N 3.22Å
244E95.1Very high89.5Confident100 Ų10081.1 Ų81.147%0.46740%0.403SS..EExtended strand (participates in β ladder)trans-125.2126.4174-171.1177158.400109.3I225 M226 Q227 Y246I225-E244 HydrophobicContact CG2-CG 3.61Å; I225-E244 WeakPolarHBondContact CG2-OE1 3.47Å; M226-E244 CarbonylContact O-C 3.59Å; M226-E244 WeakPolarHBondContact O-CA 3.44Å; Q227-E244 HydrophobicContact CG-CG 4.16Å; E244-Y246 HydrophobicContact CG-CE2 4.28Å; E244-Y246 PolarHBondContact OE1-OH 2.73Å
245A93.4Very high88.5Confident15 Ų1583.5 Ų83.512%0.12442%0.424CS..EExtended strand (participates in β ladder)trans-130.1135.7-179.300000111.5D123 M226D123-A245 WeakPolarHBondContact OD2-CB 3.45Å; M226-A245 PolarHBondContact N-O 3.34Å; M226-A245 PolarHBondContact O-N 3.22Å
246Y94.2Very high87.7Confident143 Ų14378.5 Ų78.556%0.56140%0.402SS*.EExtended strand (participates in β ladder)trans-97.2121.4177.6-66.8-95.1000109I225 E244I225-Y246 HydrophobicContact CD1-CD1 4.5Å; I225-Y246 HydrophobicContact CD1-CE1 3.87Å; I225-Y246 HydrophobicContact CG1-CD1 3.94Å; I225-Y246 HydrophobicContact CG1-CE1 3.79Å; I225-Y246 HydrophobicContact CG2-CE1 4.5Å; E244-Y246 HydrophobicContact CG-CE2 4.28Å; E244-Y246 PolarHBondContact OE1-OH 2.73Å
247R91.8Very high86.7Confident60 Ų6074.5 Ų74.523%0.22639%0.388CS..EExtended strand (participates in β ladder)trans-129.6128.5-173.2-61-64.3-177.4172.3-8.8111.3D123 I126 V224 M226D123-R247 IonicContact OD1-NH2 3.6Å; D123-R247 PolarHBondContact OD1-NH2 2.96Å; D123-R247 IonicContact OD2-CZ 2.68Å; D123-R247 IonicContact OD2-NE 3.49Å; D123-R247 IonicContact OD2-NH2 3.7Å; D123-R247 PolarHBondContact OD2-NH2 2.95Å; I126-R247 HydrophobicContact CD1-CB 3.68Å; I126-R247 HydrophobicContact CD1-CG 3.72Å; I126-R247 HydrophobicContact CG1-CG 4.29Å; V224-R247 HydrophobicContact CG2-CB 4.02Å; V224-R247 PolarHBondContact N-O 3.35Å; V224-R247 PolarHBondContact O-N 3.04Å; M226-R247 HydrophobicContact CG-CG 4.3Å; M226-R247 HydrophobicContact SD-CG 3.91Å
248Y91.7Very high85.4Confident165 Ų16571.3 Ų71.365%0.64738%0.38SS*.EExtended strand (participates in β ladder)trans-87.4129.1168.5-68.4-81.3000109.4I222 L223I222-Y248 CarbonylContact O-C 3.45Å; I222-Y248 WeakPolarHBondContact O-CA 3.41Å; L223-Y248 HydrophobicContact CB-CD1 4.16Å; L223-Y248 HydrophobicContact CB-CE1 3.94Å; L223-Y248 HydrophobicContact CD1-CD1 4.19Å; L223-Y248 HydrophobicContact CD1-CD2 4.34Å; L223-Y248 HydrophobicContact CD1-CE1 3.98Å; L223-Y248 HydrophobicContact CD1-CE2 4.13Å; L223-Y248 HydrophobicContact CD1-CG 4.38Å; L223-Y248 HydrophobicContact CG-CE1 4.39Å
249I91.1Very high83.5Confident2 Ų274.6 Ų74.61%0.0139%0.389CS..EExtended strand (participates in β ladder)trans-120.6128.3178.6-54.5170.5000108.2V129 I142 M144 N221 I222 V224 C251V129-I249 HydrophobicContact CB-CG2 4.45Å; V129-I249 HydrophobicContact CG1-CG2 3.72Å; V129-I249 HydrophobicContact CG2-CG2 4.35Å; I142-I249 HydrophobicContact CG2-CG2 4.44Å; M144-I249 HydrophobicContact CE-CD1 3.12Å; M144-I249 HydrophobicContact CE-CG1 3.4Å; N221-I249 CarbonylContact C-O 3.53Å; N221-I249 VanDerWaalsContact CA-O 3.29Å; N221-I249 WeakPolarHBondContact CA-O 3.44Å; I222-I249 HydrophobicContact CG1-CB 3.99Å; I222-I249 PolarHBondContact N-O 3.46Å; I222-I249 PolarHBondContact O-N 2.84Å; V224-I249 HydrophobicContact CB-CD1 4.3Å; V224-I249 HydrophobicContact CG1-CD1 3.72Å; V224-I249 HydrophobicContact CG2-CD1 3.56Å; V224-I249 HydrophobicContact CG2-CG1 4.11Å; I249-C251 PolarHBondContact O-N 2.83Å
250D91.1Very high81.6Confident41 Ų4177.1 Ų77.122%0.21940%0.403CS..EExtended strand (participates in β ladder)trans-76.8113.1164.8179.515.6000109.2N221 G252 S253 T256N221-D250 WeakPolarHBondContact OD1-CA 3.44Å; D250-G252 PolarHBondContact OD1-N 2.91Å; D250-S253 PolarHBondContact OD2-OG 2.73Å; D250-T256 HydrophobicContact CB-CG2 4.01Å
251C90.9Very high79.3Confident0 Ų076.8 Ų76.80%041%0.411CS..  trans-91.7-1.2178.268.20000113.5V131 F133 I142 C212 H220 I222 I249V131-C251 WeakPolarHBondContact CG1-O 3.49Å; F133-C251 WeakPolarHBondContact CZ-O 3.34Å; I142-C251 HydrophobicContact CD1-CB 4.4Å; C212-C251 VanDerWaalsContact CA-SG 3.58Å; C212-C251 HydrophobicContact CB-CB 3.88Å; C212-C251 WeakPolarHBondContact CB-SG 3.23Å; C212-C251 WeakPolarHBondContact SG-CB 3.31Å; C212-C251 CovalentContact SG-SG 2.02Å; C212-C251 PolarHBondContact SG-SG 3.32Å; H220-C251 PolarHBondContact O-N 2.02Å; H220-C251 PolarHBondContact O-SG 2.83Å; I222-C251 HydrophobicContact CD1-CB 4.34Å; I222-C251 HydrophobicContact CG1-CB 4.5Å; I249-C251 PolarHBondContact O-N 2.83Å
252G87.4Confident76.7Confident28 Ų2885.4 Ų85.429%0.28944%0.439SS..SBendtrans-90.4-19.7-17700000114.3D250D250-G252 PolarHBondContact OD1-N 2.91Å
253S78.6Confident74.5Confident38 Ų3889.3 Ų89.327%0.26644%0.442SS..SBendtrans-111.1142.2-175.961.40000112.6V131 D250 S255 T256V131-S253 WeakPolarHBondContact CG2-O 3.31Å; D250-S253 PolarHBondContact OD2-OG 2.73Å; S253-S255 VanDerWaalsContact C-N 3.31Å; S253-S255 PolarHBondContact O-N 2.78Å; S253-T256 WeakPolarHBondContact OG-CG2 3.44Å
254N72.4Confident71.9Confident113 Ų11395 Ų9560%0.60447%0.472SS*.SBendtrans-63-32-173.1-90.9-21.9000113.9T130 V131T130-N254 WeakPolarHBondContact CA-O 3.15Å; V131-N254 PolarHBondContact N-O 3.43Å; V131-N254 PolarHBondContact O-OD1 2.91Å
255S69.1Low69.7Low85 Ų85100.1 Ų100.159%0.59449%0.487SS*.EExtended strand (participates in β ladder)trans-148.7125.8175.658.40000112.1V129 S253V129-S255 VanDerWaalsContact O-CA 3.29Å; V129-S255 WeakPolarHBondContact O-CA 3.21Å; S253-S255 VanDerWaalsContact C-N 3.31Å; S253-S255 PolarHBondContact O-N 2.78Å
256T67.1Low67Low37 Ų37111.9 Ų111.923%0.22754%0.539CS..EExtended strand (participates in β ladder)trans-111.9106166.662.40000108.4V129 D250 S253 H258V129-T256 WeakPolarHBondContact CB-OG1 3.5Å; V129-T256 PolarHBondContact N-O 3.44Å; V129-T256 PolarHBondContact O-N 2.79Å; D250-T256 HydrophobicContact CB-CG2 4.01Å; S253-T256 WeakPolarHBondContact OG-CG2 3.44Å; T256-H258 PolarHBondContact O-N 3.05Å
257V61.9Low65.7Low107 Ų107110.3 Ų110.365%0.64854%0.538SS*.EExtended strand (participates in β ladder)trans-80.4107.3165.1179.40000106.3Q259V257-Q259 PolarHBondContact O-N 2.96Å; V257-Q259 VanDerWaalsContact O-N 3.09Å
258H59.1Low64.3Low105 Ų105112.9 Ų112.949%0.48656%0.555SS.*  trans-73.5106.8174.9-149.8-53.1000107.1I126 T256 P260I126-H258 WeakPolarHBondContact O-CB 3.4Å; T256-H258 PolarHBondContact O-N 3.05Å; H258-P260 WeakPolarHBondContact O-CD 3.44Å
259Q51.5Low62.8Low163 Ų163110.1 Ų110.176%0.76255%0.55SS*.PPolyproline II helixtrans-71.7123.6168.9-76.1-179.3-1600107.4V257V257-Q259 PolarHBondContact O-N 2.96Å; V257-Q259 VanDerWaalsContact O-N 3.09Å
260P52.1Low61.1Low85 Ų85116.4 Ų116.455%0.55258%0.581SS**PPolyproline II helixtrans-61.6144.6170.124.5-30.5000108.4H258 R262H258-P260 WeakPolarHBondContact O-CD 3.44Å; P260-R262 PolarHBondContact O-N 2.8Å; P260-R262 VanDerWaalsContact O-N 3.11Å
261P44.3Very low59.2Low116 Ų116121.1 Ų121.175%0.75360%0.604SS**PPolyproline II helixtrans-56.6123.4173.922.4-30.1000108.2R263P261-R263 PolarHBondContact O-N 3.37Å
262R39.6Very low57.1Low237 Ų237129.2 Ų129.289%0.89464%0.644SS**  trans-53.7112.4171.2-87-177.2171.3-176.4-2.5106.9P260 L264P260-R262 PolarHBondContact O-N 2.8Å; P260-R262 VanDerWaalsContact O-N 3.11Å; R262-L264 VanDerWaalsContact C-N 3.26Å; R262-L264 PolarHBondContact O-N 3Å
263R47Very low55Low191 Ų191136.4 Ų136.472%0.72167%0.67SS**  trans-61.296.4166.1-71.1-167.6-175.2-161.14.9106.8P261 W265P261-R263 PolarHBondContact O-N 3.37Å; R263-W265 PolarHBondContact O-N 2.76Å
264L40.3Very low53.1Low164 Ų164144 Ų14486%0.85970%0.701SS**  trans-66.590.9162.5-94.2146.5000106R262 Q266R262-L264 VanDerWaalsContact C-N 3.26Å; R262-L264 PolarHBondContact O-N 3Å; L264-Q266 PolarHBondContact O-N 3.1Å
265W49.8Very low51.5Low208 Ų208146.6 Ų146.679%0.78871%0.709SS**  trans-74.7113.1163.1-68.496.2000107R263R263-W265 PolarHBondContact O-N 2.76Å
266Q36.8Very low49.9Very low261 Ų261152.2 Ų152.2100%1.2272%0.719SS**  trans-830158.6-89.4175.6-48.800109.3L264L264-Q266 PolarHBondContact O-N 3.1Å

Retrieved 266 of 266 residues in 185.1 ms (Link to these results)