A0A087X8Z1_POEFO Loading...

Platelet-derived growth factor receptor-like protein

AlphaFold DB (A0A3B3U3W9), UniProt , Accession A0A087X8Z1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 366 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
1M47Very low47.6Very low239 Ų239126.8 Ų126.8100%1.17767%0.666SS**  0119.40-59.6-175.1-47.700107.5
2K43.2Very low47.1Very low180 Ų180126.1 Ų126.178%0.78366%0.662SS**  trans-82.3129.4-167.9-73.5175.3173.7177.40110.4W4 A5K2-W4 PolarHBondContact O-N 3.43Å; K2-W4 VanDerWaalsContact O-N 3.09Å; K2-A5 PolarHBondContact O-N 3.48Å
3P46.4Very low46.3Very low114 Ų114122.8 Ų122.874%0.7466%0.655SS**THydrogen-bonded Turntrans-65.8-14.4-174.125.5-33.8000114A5P3-A5 PolarHBondContact O-N 3.08Å
4W43Very low45.4Very low208 Ų208124.4 Ų124.479%0.78866%0.662SS**Hα-helixtrans-71-29.6-179.7-154.42.8000113.7K2 V6 F7 C8K2-W4 PolarHBondContact O-N 3.43Å; K2-W4 VanDerWaalsContact O-N 3.09Å; W4-V6 VanDerWaalsContact C-N 3.33Å; W4-V6 PolarHBondContact O-N 2.97Å; W4-F7 PolarHBondContact O-N 3.42Å; W4-C8 PolarHBondContact O-N 3.27Å
5A49.7Very low44.6Very low61 Ų61127.4 Ų127.450%0.50467%0.671SS.*Hα-helixtrans-70.2-30.5179.700000112.7K2 P3 L9K2-A5 PolarHBondContact O-N 3.48Å; P3-A5 PolarHBondContact O-N 3.08Å; A5-L9 PolarHBondContact O-N 3.41Å
6V57.4Low43.9Very low108 Ų108128.6 Ų128.666%0.65568%0.677SS**Hα-helixtrans-73.6-33177.8-1770000110.8W4 L9 A10W4-V6 VanDerWaalsContact C-N 3.33Å; W4-V6 PolarHBondContact O-N 2.97Å; V6-L9 PolarHBondContact O-N 3.21Å; V6-A10 PolarHBondContact O-N 3.32Å; V6-A10 VanDerWaalsContact O-N 3.09Å
7F49Very low43.2Very low140 Ų140131.1 Ų131.161%0.61468%0.684SS**Hα-helixtrans-71.8-35.6178.3-147.9-96.9000112.4W4 A10 L11W4-F7 PolarHBondContact O-N 3.42Å; F7-A10 PolarHBondContact O-N 3.05Å; F7-L11 HydrophobicContact CD1-CD1 3.97Å; F7-L11 HydrophobicContact CE1-CD1 4.14Å; F7-L11 PolarHBondContact O-N 3.47Å
8C48.9Very low42.7Very low68 Ų68133.6 Ų133.646%0.45970%0.698SS.*Hα-helixtrans-69.4-34.6173.6-700000113.1W4 L12W4-C8 PolarHBondContact O-N 3.27Å; C8-L12 PolarHBondContact O-N 2.8Å
9L48.1Very low41.8Very low118 Ų118130.3 Ų130.362%0.61870%0.7SS**Hα-helixtrans-69.4-34.9174.2-94149.9000112.4A5 V6 L12 C13A5-L9 PolarHBondContact O-N 3.41Å; V6-L9 PolarHBondContact O-N 3.21Å; L9-L12 PolarHBondContact O-N 2.96Å; L9-C13 PolarHBondContact O-N 2.96Å
10A46.2Very low41.1Very low52 Ų52129.6 Ų129.643%0.4371%0.706SS.*Hα-helixtrans-68.7-35.6175.900000112.8V6 F7 C13V6-A10 PolarHBondContact O-N 3.32Å; V6-A10 VanDerWaalsContact O-N 3.09Å; F7-A10 PolarHBondContact O-N 3.05Å; A10-C13 PolarHBondContact O-N 2.98Å
11L44.6Very low40.4Very low107 Ų107128.3 Ų128.356%0.5671%0.706SS**Hα-helixtrans-71.2-31.7176.5-76.9163.3000112.8F7F7-L11 HydrophobicContact CD1-CD1 3.97Å; F7-L11 HydrophobicContact CE1-CD1 4.14Å; F7-L11 PolarHBondContact O-N 3.47Å
12L42.2Very low39.6Very low118 Ų118124.4 Ų124.462%0.61868%0.684SS**Hα-helixtrans-71.3-27.8173.9-88154.7000113.2C8 L9C8-L12 PolarHBondContact O-N 2.8Å; L9-L12 PolarHBondContact O-N 2.96Å
13C36.8Very low38.8Very low84 Ų84119.1 Ų119.157%0.56867%0.674SS**Hα-helixtrans-75.9-23.3176.6-80.10000113.9L9 A10L9-C13 PolarHBondContact O-N 2.96Å; A10-C13 PolarHBondContact O-N 2.98Å
14L33.4Very low38Very low144 Ų144120.6 Ų120.675%0.75468%0.675SS**Hα-helixtrans-76.7-24.5178.4-102.389.7000113.6L16L14-L16 VanDerWaalsContact C-N 3.34Å
15E32.5Very low37.1Very low170 Ų170120.6 Ų120.679%0.79468%0.68SS**THydrogen-bonded Turntrans-83.1-6.5-179.3-72.4-69.3162.800113.9
16L33.3Very low36Very low147 Ų147129.1 Ų129.177%0.7770%0.699SS**THydrogen-bonded Turntrans-99.90.8-172.7-88.3161.1000115.4L14L14-L16 VanDerWaalsContact C-N 3.34Å
17Q33.2Very low34.5Very low170 Ų170133 Ų13379%0.79471%0.707SS**  trans-1034.4-168.7-91.1-170.1-19.400118.3
18N33.2Very low33.4Very low176 Ų176136 Ų13694%0.94172%0.72SS**  trans-114.781.2175.7-85-13.3000113.2
19G26.2Very low32.3Very low72 Ų72139.1 Ų139.174%0.74273%0.732SS**  trans-129.690.9162.500000110.2C21G19-C21 PolarHBondContact O-N 3.09Å
20S28.4Very low31.2Very low115 Ų115138.3 Ų138.380%0.80474%0.742SS**  trans-72.8116.8169.6-177.50000109.1
21C24.7Very low30.2Very low104 Ų104142.6 Ų142.670%0.70376%0.763SS**  trans-95.4106.9178.3-148.30000108.4G19G19-C21 PolarHBondContact O-N 3.09Å
22Q30.2Very low29.3Very low156 Ų156146.6 Ų146.673%0.72978%0.779SS**  trans-93.9106171.5-73.9-172-14.900110
23A27.4Very low28.3Very low70 Ų70145.7 Ų145.758%0.57978%0.782SS**  trans-94.3109.4170.500000110
24I29.8Very low27.7Very low145 Ų145147.4 Ų147.474%0.74480%0.795SS**  trans-96104.9171.2-62.4173.8000108.4R26I24-R26 PolarHBondContact O-N 2.85Å
25K24.9Very low27.3Very low208 Ų208145.3 Ų145.390%0.90480%0.799SS**  trans-77.9107169.6-78.8-176.2177177.60109.7
26R26.3Very low27.1Very low239 Ų239146.1 Ų146.190%0.90280%0.802SS**  trans-89.6113.6161.8-91.1-177.2173.5176.4-0.6109.3I24I24-R26 PolarHBondContact O-N 2.85Å
27K25.5Very low27.2Very low190 Ų190145.1 Ų145.183%0.82680%0.804SS**  trans-79.2123.5169.6-130-178.8179.9-171.60108.3
28K25.1Very low26.7Very low202 Ų202140.8 Ų140.888%0.87881%0.805SS**  trans-106.1108.8171.1-177.1177.6-179-178.60106.5
29D25.9Very low26.4Very low135 Ų135136.4 Ų136.472%0.72280%0.802SS**PPolyproline II helixtrans-76.8134.9178-68.9-39.6000110.5
30A25.6Very low26.4Very low100 Ų100142.5 Ų142.583%0.82681%0.808SS**PPolyproline II helixtrans-84.2137.8174.800000110.2
31V24.7Very low26.4Very low142 Ų142148.7 Ų148.786%0.86181%0.814SS**PPolyproline II helixtrans-80.2124.4171.9169.60000108.4
32E25.2Very low26.4Very low192 Ų192148.7 Ų148.790%0.89782%0.821SS**  trans-151.8143.2150.8-139.8160.5-162.500111.8
33S22.7Very low26.2Very low99 Ų99153.6 Ų153.669%0.69283%0.833SS**  trans-103.8153.2-159.138.90000113.9
34S24.3Very low26.2Very low120 Ų120154.8 Ų154.884%0.83984%0.843SS**  trans89.8110.5151.977.40000119.5
35A25Very low26Very low100 Ų100159.7 Ų159.783%0.82685%0.852SS**  158.8121.7117.400000111.6
36H27.7Very low26.1Very low187 Ų187158.7 Ų158.787%0.86685%0.851SS**  trans-88.2169.1167-9760.9000109.6
37P34.8Very low26.1Very low126 Ų126153 Ų15382%0.81885%0.845SS**  cis-147.7164.231.436.7-14.2000119
38G23.3Very low26.1Very low79 Ų79148.4 Ų148.481%0.81484%0.842SS**  trans113.2105.4136.100000118.4
39G26.5Very low26.2Very low84 Ų84147.1 Ų147.187%0.86684%0.843SS**  trans170.996.7166.700000116.9
40K27.2Very low26.2Very low199 Ų199146.5 Ų146.587%0.86585%0.845SS**  trans-24.7135.1173.3-65.1170.9179.6174.80120.8
41R26.9Very low26.3Very low246 Ų246146.9 Ų146.993%0.92884%0.842SS**  trans60.4117.7139-73.3-177.9176178.9-1.3121.1
42A25.6Very low26.5Very low104 Ų104151.6 Ų151.686%0.8684%0.844SS**  -170.5128110.600000110.7
43R27Very low26.9Very low258 Ų258152.1 Ų152.197%0.97484%0.843SS**  trans-93.5103.3-176.8-156.4-178.2-160.1-156.44.9108.8
44A26.8Very low27.4Very low95 Ų95150.4 Ų150.479%0.78584%0.841SS**PPolyproline II helixtrans-90.3116.6171.100000109.9Q46A44-Q46 PolarHBondContact O-N 3.09Å
45R25.3Very low28.1Very low248 Ų248154.1 Ų154.194%0.93684%0.842SS**PPolyproline II helixtrans-63.7121.3170.9-94.8173.7167.1171.9-3.9109.4
46Q27Very low29.5Very low188 Ų188153.6 Ų153.688%0.87983%0.832SS**PPolyproline II helixtrans-80.8128.3160.1-73.2-175.7-18.600109A44 A48A44-Q46 PolarHBondContact O-N 3.09Å; Q46-A48 PolarHBondContact O-N 3.09Å
47P25.6Very low31.3Very low120 Ų120150.2 Ų150.278%0.77982%0.817SS**PPolyproline II helixtrans-76122.2168.610.32.6000109.2L49P47-L49 PolarHBondContact O-N 3.41Å
48A25.2Very low33Very low92 Ų92146 Ų14676%0.7679%0.79SS**  trans-63.4114170.800000109.8Q46 T50Q46-A48 PolarHBondContact O-N 3.09Å; A48-T50 PolarHBondContact O-N 2.96Å; A48-T50 VanDerWaalsContact O-N 3.08Å
49L27.5Very low36Very low175 Ų175143.8 Ų143.892%0.91676%0.759SS**  trans-73.596.4164.9-98.8117.9000108.4P47 S51P47-L49 PolarHBondContact O-N 3.41Å; L49-S51 PolarHBondContact O-N 2.77Å
50T26.3Very low39.2Very low123 Ų123139.8 Ų139.876%0.75572%0.719SS**  trans-57.5119.3165.749.70000109.5A48 R52A48-T50 PolarHBondContact O-N 2.96Å; A48-T50 VanDerWaalsContact O-N 3.08Å; T50-R52 PolarHBondContact O-N 3.23Å
51S27.6Very low42.4Very low108 Ų108131.3 Ų131.376%0.75568%0.683SS**  trans-66.496.1172.753.50000110L49 K53L49-S51 PolarHBondContact O-N 2.77Å; S51-K53 VanDerWaalsContact C-N 3.33Å; S51-K53 PolarHBondContact O-N 2.86Å
52R28.8Very low45.7Very low241 Ų241120.8 Ų120.891%0.90965%0.645SS**  trans-66.596.7161.9-99.5-178170.4-179.6-1.8107.6T50 G54T50-R52 PolarHBondContact O-N 3.23Å; R52-G54 PolarHBondContact O-N 3.5Å
53K33.5Very low48.9Very low203 Ų203116.9 Ų116.988%0.88361%0.61SS**  trans-63.178.2159.4-80.1-176.7174.3179.30108.9S51S51-K53 VanDerWaalsContact C-N 3.33Å; S51-K53 PolarHBondContact O-N 2.86Å
54G33.1Very low51.9Low63 Ų63107.8 Ų107.865%0.64958%0.58SS**  trans-72.9120.8163.600000108R52 S56R52-G54 PolarHBondContact O-N 3.5Å; G54-S56 PolarHBondContact O-N 2.84Å
55K40Very low54.6Low197 Ų197109.7 Ų109.786%0.85758%0.577SS**  trans-52.3109.7170-68.6175.3176.5178.80107.9Q57K55-Q57 PolarHBondContact O-N 2.8Å
56S53.5Low57.1Low89 Ų89107.3 Ų107.362%0.62257%0.574SS**  trans-58.4107.9174.9176.30000107.7G54 Y153G54-S56 PolarHBondContact O-N 2.84Å; S56-Y153 PolarHBondContact OG-OH 3.41Å; S56-Y153 VanDerWaalsContact OG-OH 3.09Å
57Q65.4Low59.5Low117 Ų117100.7 Ų100.755%0.54756%0.557SS.*  trans-82.1128.3177.9-62.2-169.4-1.200107.8K55 L59 Y153K55-Q57 PolarHBondContact O-N 2.8Å; Q57-L59 PolarHBondContact O-N 3.42Å; Q57-Y153 PolarHBondContact O-OH 3.3Å
58S72.1Confident62.6Low36 Ų36102.4 Ų102.425%0.25255%0.547SS..  trans-53123.8176.4-176.90000110.8L60S58-L60 VanDerWaalsContact C-N 3.33Å; S58-L60 PolarHBondContact OG-O 2.85Å
59L84.8Confident65.7Low33 Ų33103.1 Ų103.117%0.17353%0.534CS..  trans-81.7-16.8177.4-58.9178.9000112Q57 C88 K89 V137 Y153Q57-L59 PolarHBondContact O-N 3.42Å; L59-C88 VanDerWaalsContact O-CA 3.3Å; L59-C88 WeakPolarHBondContact O-CA 3.21Å; L59-K89 HydrophobicContact CB-CB 4.33Å; L59-K89 HydrophobicContact CD2-CB 4.07Å; L59-K89 HydrophobicContact CD2-CD 4.34Å; L59-K89 PolarHBondContact O-N 3.41Å; L59-K89 VanDerWaalsContact O-N 3.09Å; L59-V137 HydrophobicContact CD1-CG2 4.36Å; L59-Y153 HydrophobicContact CB-CD2 3.68Å; L59-Y153 HydrophobicContact CB-CE2 3.66Å; L59-Y153 HydrophobicContact CB-CG 4.32Å; L59-Y153 HydrophobicContact CD1-CD2 3.94Å; L59-Y153 HydrophobicContact CD1-CE2 3.25Å; L59-Y153 HydrophobicContact CG-CD2 3.85Å; L59-Y153 HydrophobicContact CG-CE2 3.24Å
60L94.4Very high68.8Low1 Ų198.6 Ų98.61%0.00551%0.51CS..EExtended strand (participates in β ladder)trans-89.4120.5-179.1-176.660.9000110.9S58 L72 L86 W95S58-L60 VanDerWaalsContact C-N 3.33Å; S58-L60 PolarHBondContact OG-O 2.85Å; L60-L72 HydrophobicContact CD2-CD1 4.28Å; L60-L72 HydrophobicContact CG-CD1 4.18Å; L60-L72 PolarHBondContact O-N 2.68Å; L60-L86 HydrophobicContact CD1-CB 4.3Å; L60-W95 HydrophobicContact CD1-CH2 3.65Å; L60-W95 HydrophobicContact CD1-CZ3 3.63Å
61T95Very high71.9Confident21 Ų2199.6 Ų99.613%0.12950%0.5CS..EExtended strand (participates in β ladder)trans-133.4146.3-176.653.20000111L70 R71 L86 R87T61-L70 CarbonylContact C-O 3.31Å; T61-L70 WeakPolarHBondContact CA-O 2.99Å; T61-L70 WeakPolarHBondContact CB-O 3.37Å; T61-R71 HydrophobicContact CG2-CG 3.98Å; T61-L86 CarbonylContact O-C 3.51Å; T61-L86 WeakPolarHBondContact O-CA 3.32Å; T61-R87 PolarHBondContact N-O 3.43Å; T61-R87 PolarHBondContact O-N 2.79Å; T61-R87 PolarHBondContact OG1-O 3.49Å
62Q94.7Very high75Confident24 Ų2494.9 Ų94.911%0.11247%0.466CS..EExtended strand (participates in β ladder)trans-89.4135.1164.6-178.3-172.913.100109.3L64 F69 L70 L72 E85 L86Q62-L64 HydrophobicContact CG-CD2 4.15Å; Q62-F69 WeakPolarHBondContact O-CA 3.14Å; Q62-L70 HydrophobicContact CB-CB 4.44Å; Q62-L70 PolarHBondContact N-O 2.69Å; Q62-L70 PolarHBondContact O-N 2.97Å; Q62-L72 HydrophobicContact CB-CD2 3.91Å; Q62-L72 HydrophobicContact CB-CG 4.41Å; Q62-E85 WeakPolarHBondContact CA-O 3.32Å; Q62-L86 HydrophobicContact CB-CD2 4.11Å; Q62-L86 HydrophobicContact CG-CD2 4.39Å
63V93.2Very high78Confident23 Ų2385.1 Ų85.114%0.13944%0.441CS..EExtended strand (participates in β ladder)trans-88.8125173.2-172.70000108.5F69 E85 R87V63-F69 HydrophobicContact CB-CE1 4.45Å; V63-F69 HydrophobicContact CG1-CE1 4.16Å; V63-F69 HydrophobicContact CG2-CD1 3.87Å; V63-F69 HydrophobicContact CG2-CE1 3.7Å; V63-E85 HydrophobicContact CB-CB 3.96Å; V63-E85 HydrophobicContact CB-CG 3.75Å; V63-E85 HydrophobicContact CG2-CB 4.38Å; V63-E85 HydrophobicContact CG2-CG 3.69Å; V63-E85 VanDerWaalsContact CG2-OE1 3.28Å; V63-E85 WeakPolarHBondContact CG2-OE1 3.24Å; V63-E85 PolarHBondContact N-O 2.81Å; V63-R87 HydrophobicContact CG2-CB 3.9Å
64L90.8Very high80.9Confident66 Ų6681 Ų8135%0.34643%0.434SS..EExtended strand (participates in β ladder)trans-107167.9-179.1-59.1178.5000110.7Q62 G67 R68 L70Q62-L64 HydrophobicContact CG-CD2 4.15Å; L64-G67 PolarHBondContact O-N 2.87Å; L64-R68 HydrophobicContact CB-CB 4.18Å; L64-R68 PolarHBondContact N-O 3.48Å; L64-L70 HydrophobicContact CD1-CB 3.95Å; L64-L70 HydrophobicContact CG-CB 4.27Å
65D82.5Confident83.8Confident135 Ų13581.5 Ų81.572%0.72243%0.428SS*.THydrogen-bonded Turntrans-52.3142.1174.7-61.6-33.9000112.4G67 R68D65-G67 VanDerWaalsContact C-N 3.33Å; D65-R68 PolarHBondContact O-NE 3.26Å
66K78.3Confident86.4Confident198 Ų19873.2 Ų73.286%0.86139%0.394SS*.THydrogen-bonded Turntrans6728.2-179.3-48178.6178.5-177.40113.8R68K66-R68 VanDerWaalsContact C-N 3.33Å; K66-R68 PolarHBondContact O-N 2.85Å
67G77.9Confident88.4Confident50 Ų5072.5 Ų72.552%0.51539%0.386SS..THydrogen-bonded Turntrans72.723.3172.600000114.3L64 D65 F69L64-G67 PolarHBondContact O-N 2.87Å; D65-G67 VanDerWaalsContact C-N 3.33Å; G67-F69 WeakPolarHBondContact O-CE2 3.3Å
68R89.2Confident89.7Confident155 Ų15567.6 Ų67.659%0.58536%0.363SS*.EExtended strand (participates in β ladder)trans-85.9150.6174.3-71.7-178.2-74.3174.7-1.9110L64 D65 K66L64-R68 HydrophobicContact CB-CB 4.18Å; L64-R68 PolarHBondContact N-O 3.48Å; D65-R68 PolarHBondContact O-NE 3.26Å; K66-R68 VanDerWaalsContact C-N 3.33Å; K66-R68 PolarHBondContact O-N 2.85Å
69F91.3Very high90.6Very high108 Ų10870.3 Ų70.347%0.47438%0.378SS..EExtended strand (participates in β ladder)trans-121.7128.8-179.4-59.3-87.7000110.1Q62 V63 G67Q62-F69 WeakPolarHBondContact O-CA 3.14Å; V63-F69 HydrophobicContact CB-CE1 4.45Å; V63-F69 HydrophobicContact CG1-CE1 4.16Å; V63-F69 HydrophobicContact CG2-CD1 3.87Å; V63-F69 HydrophobicContact CG2-CE1 3.7Å; G67-F69 WeakPolarHBondContact O-CE2 3.3Å
70L92.4Very high91Very high79 Ų7970.4 Ų70.441%0.41438%0.381SS..EExtended strand (participates in β ladder)trans-106125.7172.9-179.465.1000109.2T61 Q62 L64 L72T61-L70 CarbonylContact C-O 3.31Å; T61-L70 WeakPolarHBondContact CA-O 2.99Å; T61-L70 WeakPolarHBondContact CB-O 3.37Å; Q62-L70 HydrophobicContact CB-CB 4.44Å; Q62-L70 PolarHBondContact N-O 2.69Å; Q62-L70 PolarHBondContact O-N 2.97Å; L64-L70 HydrophobicContact CD1-CB 3.95Å; L64-L70 HydrophobicContact CG-CB 4.27Å; L70-L72 PolarHBondContact O-N 3.1Å
71R91.6Very high90.9Very high144 Ų14472.8 Ų72.854%0.54341%0.406SS..EExtended strand (participates in β ladder)trans-74.1128.3173.4-69.2178-178.9-173-5.6109.2T61T61-R71 HydrophobicContact CG2-CG 3.98Å
72L93.5Very high90.6Very high10 Ų1079.1 Ų79.15%0.05243%0.431CS..  trans-79134.3176.6-63.2-170.3000110.2L60 Q62 L70 T76 L86L60-L72 HydrophobicContact CD2-CD1 4.28Å; L60-L72 HydrophobicContact CG-CD1 4.18Å; L60-L72 PolarHBondContact O-N 2.68Å; Q62-L72 HydrophobicContact CB-CD2 3.91Å; Q62-L72 HydrophobicContact CB-CG 4.41Å; L70-L72 PolarHBondContact O-N 3.1Å; L72-T76 HydrophobicContact CD1-CG2 4.31Å; L72-T76 HydrophobicContact CD2-CG2 3.92Å; L72-L86 HydrophobicContact CD1-CD2 3.75Å
73G91.8Very high90.5Very high36 Ų3681.6 Ų81.637%0.37145%0.451SS..  trans-81.6-165.9169.700000111.8S75 S155G73-S75 PolarHBondContact O-N 2.98Å; G73-S155 VanDerWaalsContact O-CB 3.28Å; G73-S155 WeakPolarHBondContact O-CB 3.28Å; G73-S155 PolarHBondContact O-OG 3.28Å; G73-S155 VanDerWaalsContact O-OG 3.14Å
74P92.8Very high90.6Very high116 Ų11681 Ų8175%0.75345%0.448SS*.SBendtrans-61.3-32.4175.3-22.633.8000113.1Y156P74-Y156 PolarHBondContact O-N 2.98Å
75S94.9Very high90.8Very high73 Ų7380.1 Ų80.151%0.5144%0.442SS..EExtended strand (participates in β ladder)trans-139149.1173.755.40000111.1G73 Y156G73-S75 PolarHBondContact O-N 2.98Å; S75-Y156 CarbonylContact C-O 3.54Å; S75-Y156 VanDerWaalsContact CA-O 3.22Å; S75-Y156 WeakPolarHBondContact CA-O 3.46Å
76T94.7Very high91.4Very high24 Ų2473.9 Ų73.915%0.14741%0.409CS..EExtended strand (participates in β ladder)trans-145.3149.9177.2-1680000110.6L72 L78 Y156 V157 Y158L72-T76 HydrophobicContact CD1-CG2 4.31Å; L72-T76 HydrophobicContact CD2-CG2 3.92Å; T76-L78 HydrophobicContact CG2-CG 4.38Å; T76-Y156 PolarHBondContact N-O 3.42Å; T76-V157 HydrophobicContact CG2-CB 4.2Å; T76-V157 HydrophobicContact CG2-CG1 4.13Å; T76-V157 HydrophobicContact CG2-CG2 3.76Å; T76-V157 WeakPolarHBondContact O-CA 3.43Å; T76-Y158 PolarHBondContact O-N 3.47Å
77T95.1Very high92.3Very high73 Ų7366.7 Ų66.745%0.44838%0.376SS..EExtended strand (participates in β ladder)trans-111.8125.4177.7-610000109.7Y158 T160T77-Y158 WeakPolarHBondContact CA-O 3.19Å; T77-T160 HydrophobicContact CG2-CG2 3.42Å; T77-T160 VanDerWaalsContact CG2-CG2 3.42Å
78L93.8Very high93.1Very high15 Ų1564.3 Ų64.38%0.07935%0.352CS..EExtended strand (participates in β ladder)trans-123.5154.7-179.9-59.4-174.9000110.6T76 V84 V157 Y158 F159 T160T76-L78 HydrophobicContact CG2-CG 4.38Å; L78-V84 HydrophobicContact CD1-CB 4.41Å; L78-V84 HydrophobicContact CD1-CG1 3.71Å; L78-V84 HydrophobicContact CD1-CG2 3.75Å; L78-V157 HydrophobicContact CB-CG1 4.3Å; L78-V157 HydrophobicContact CD1-CG1 3.53Å; L78-V157 HydrophobicContact CG-CG1 3.85Å; L78-Y158 PolarHBondContact N-O 2.7Å; L78-F159 HydrophobicContact CB-CD1 4.04Å; L78-F159 HydrophobicContact CB-CE1 3.85Å; L78-F159 HydrophobicContact CD1-CE1 4.26Å; L78-F159 HydrophobicContact CD1-CZ 4.32Å; L78-F159 WeakPolarHBondContact O-CA 3.19Å; L78-T160 PolarHBondContact O-N 2.03Å
79T90.8Very high93.2Very high92 Ų9263.9 Ų63.956%0.56435%0.354SS*.  trans-85.2133.4178.4-46.10000110.4
80P93.3Very high93.1Very high36 Ų3659.7 Ų59.723%0.23434%0.341CS..THydrogen-bonded Turntrans-64.7165.417227.6-34.3000112K82 P125 T160P80-K82 PolarHBondContact O-N 2.84Å; P80-P125 CarbonylContact C-O 3.54Å; P80-P125 WeakPolarHBondContact CA-O 3.37Å; P80-P125 WeakPolarHBondContact CB-O 3.41Å; P80-T160 WeakPolarHBondContact CD-O 3.27Å; P80-T160 WeakPolarHBondContact CG-O 3.44Å
81G90.9Very high92.8Very high51 Ų5160.7 Ų60.753%0.52635%0.35SS..THydrogen-bonded Turntrans77.6-27.6178.200000115P125G81-P125 PolarHBondContact N-O 2.74Å
82K89.4Confident92.8Very high153 Ų15357 Ų5767%0.66534%0.342SS*.SBendtrans-89.7130.1177.4-65.5-171.8179.2-1770110.9P80 V84 P125P80-K82 PolarHBondContact O-N 2.84Å; K82-V84 PolarHBondContact O-N 2.95Å; K82-P125 WeakPolarHBondContact O-CD 3.4Å; K82-P125 WeakPolarHBondContact O-CG 3.36Å
83S93.2Very high92.8Very high76 Ų7656.7 Ų56.753%0.53134%0.34SS..  trans-55.3134.1176.9-59.30000111.5L122S83-L122 CarbonylContact C-O 3.51Å; S83-L122 VanDerWaalsContact CA-O 3.31Å; S83-L122 WeakPolarHBondContact CA-O 3.19Å
84V94.4Very high92.9Very high11 Ų1155.5 Ų55.57%0.06733%0.327CS..EExtended strand (participates in β ladder)trans-108.4130.4177.3175.20000109L78 K82 L86 V121 L122 P125 F159L78-V84 HydrophobicContact CD1-CB 4.41Å; L78-V84 HydrophobicContact CD1-CG1 3.71Å; L78-V84 HydrophobicContact CD1-CG2 3.75Å; K82-V84 PolarHBondContact O-N 2.95Å; V84-L86 HydrophobicContact CG1-CD2 3.84Å; V84-L86 HydrophobicContact CG1-CG 4.06Å; V84-V121 WeakPolarHBondContact O-CA 3.16Å; V84-L122 PolarHBondContact N-O 3.25Å; V84-L122 PolarHBondContact O-N 3.13Å; V84-P125 HydrophobicContact CG2-CG 4.24Å; V84-F159 HydrophobicContact CG2-CE1 3.78Å; V84-F159 HydrophobicContact CG2-CZ 4.1Å
85E95.3Very high93Very high48 Ų4851.3 Ų51.322%0.22430%0.297CS..EExtended strand (participates in β ladder)trans-112.1117.5171.1178.4-176.9159.800109.2Q62 V63 R87 Q119 L120 V121Q62-E85 WeakPolarHBondContact CA-O 3.32Å; V63-E85 HydrophobicContact CB-CB 3.96Å; V63-E85 HydrophobicContact CB-CG 3.75Å; V63-E85 HydrophobicContact CG2-CB 4.38Å; V63-E85 HydrophobicContact CG2-CG 3.69Å; V63-E85 VanDerWaalsContact CG2-OE1 3.28Å; V63-E85 WeakPolarHBondContact CG2-OE1 3.24Å; V63-E85 PolarHBondContact N-O 2.81Å; E85-R87 IonicContact OE1-CZ 3.75Å; E85-R87 IonicContact OE1-NE 3.82Å; E85-R87 IonicContact OE1-NH2 2.85Å; E85-R87 PolarHBondContact OE1-NH2 3.23Å; E85-Q119 HydrophobicContact CG-CG 3.74Å; E85-Q119 VanDerWaalsContact CG-NE2 3.34Å; E85-Q119 PolarHBondContact OE1-NE2 3.03Å; E85-Q119 PolarHBondContact OE2-NE2 3.12Å; E85-L120 WeakPolarHBondContact CA-O 3.47Å; E85-V121 HydrophobicContact CG-CG2 4.28Å
86L95.8Very high93Very high3 Ų350.2 Ų50.22%0.01629%0.289CS..EExtended strand (participates in β ladder)trans-104.8141170.7-57.6-174.3000109.6L60 T61 Q62 L72 V84 W95 Q119 L120 Y133L60-L86 HydrophobicContact CD1-CB 4.3Å; T61-L86 CarbonylContact O-C 3.51Å; T61-L86 WeakPolarHBondContact O-CA 3.32Å; Q62-L86 HydrophobicContact CB-CD2 4.11Å; Q62-L86 HydrophobicContact CG-CD2 4.39Å; L72-L86 HydrophobicContact CD1-CD2 3.75Å; V84-L86 HydrophobicContact CG1-CD2 3.84Å; V84-L86 HydrophobicContact CG1-CG 4.06Å; L86-W95 HydrophobicContact CB-CH2 4.06Å; L86-W95 HydrophobicContact CB-CZ3 4.32Å; L86-Q119 CarbonylContact O-C 3.59Å; L86-Q119 WeakPolarHBondContact O-CA 3.48Å; L86-L120 HydrophobicContact CB-CB 4.39Å; L86-L120 PolarHBondContact N-O 2.75Å; L86-L120 PolarHBondContact O-N 2.81Å; L86-Y133 HydrophobicContact CD1-CD1 3.86Å; L86-Y133 HydrophobicContact CD1-CG 4.08Å
87R95.4Very high93Very high47 Ų4750.8 Ų50.818%0.17729%0.289CS..EExtended strand (participates in β ladder)trans-131.2127.2-179.7-173.7174.2-62.5-169.52.3110.1T61 V63 E85 Y117 S118T61-R87 PolarHBondContact N-O 3.43Å; T61-R87 PolarHBondContact O-N 2.79Å; T61-R87 PolarHBondContact OG1-O 3.49Å; V63-R87 HydrophobicContact CG2-CB 3.9Å; E85-R87 IonicContact OE1-CZ 3.75Å; E85-R87 IonicContact OE1-NE 3.82Å; E85-R87 IonicContact OE1-NH2 2.85Å; E85-R87 PolarHBondContact OE1-NH2 3.23Å; R87-Y117 HydrophobicContact CG-CD2 3.53Å; R87-Y117 HydrophobicContact CG-CE2 4.29Å; R87-Y117 HydrophobicContact CG-CG 3.75Å; R87-S118 WeakPolarHBondContact CA-O 3.16Å
88C95Very high92.9Very high1 Ų148.1 Ų48.11%0.00727%0.272CS..EExtended strand (participates in β ladder)trans-112.8122.1175.1-166.60000110L59 G90 I93 W95 Y117 S118 C135L59-C88 VanDerWaalsContact O-CA 3.3Å; L59-C88 WeakPolarHBondContact O-CA 3.21Å; C88-G90 PolarHBondContact O-N 3.14Å; C88-I93 HydrophobicContact CB-CG2 4.01Å; C88-W95 HydrophobicContact CB-CH2 3.68Å; C88-W95 HydrophobicContact CB-CZ2 3.52Å; C88-Y117 CarbonylContact O-C 3.56Å; C88-Y117 VanDerWaalsContact O-CA 3.24Å; C88-Y117 WeakPolarHBondContact O-CA 3.31Å; C88-Y117 WeakPolarHBondContact O-CB 3.35Å; C88-S118 PolarHBondContact N-O 3.2Å; C88-S118 PolarHBondContact O-N 3.38Å; C88-C135 HydrophobicContact CB-CB 3.51Å; C88-C135 WeakPolarHBondContact CB-SG 3.32Å; C88-C135 WeakPolarHBondContact SG-CB 2.99Å; C88-C135 CovalentContact SG-SG 2.03Å; C88-C135 PolarHBondContact SG-SG 3.03Å
89K91.8Very high92.5Very high146 Ų14652.7 Ų52.764%0.63530%0.301SS*.EExtended strand (participates in β ladder)trans-74.7124.3-176.7-177.9-178.7-179.6-177.50111.4L59L59-K89 HydrophobicContact CB-CB 4.33Å; L59-K89 HydrophobicContact CD2-CB 4.07Å; L59-K89 HydrophobicContact CD2-CD 4.34Å; L59-K89 PolarHBondContact O-N 3.41Å; L59-K89 VanDerWaalsContact O-N 3.09Å
90G89.6Confident92.1Very high19 Ų1952 Ų5220%0.19629%0.289CS..SBendtrans149.1166.7177.900000112.4C88 K116 Y117C88-G90 PolarHBondContact O-N 3.14Å; G90-K116 PolarHBondContact N-O 2.9Å; G90-K116 CarbonylContact O-C 3.59Å; G90-K116 VanDerWaalsContact O-C 3.31Å; G90-Y117 CarbonylContact O-C 3.43Å; G90-Y117 WeakPolarHBondContact O-CA 3.12Å; G90-Y117 PolarHBondContact O-N 2.81Å; G90-Y117 VanDerWaalsContact O-N 3.09Å
91T85.6Confident91.7Very high100 Ų10050.4 Ų50.461%0.61328%0.278SS*.SBendtrans-84.1-55.4-177.544.20000111.9D115T91-D115 WeakPolarHBondContact CG2-O 3.39Å
92N91.1Very high91.3Very high67 Ų6751.9 Ų51.936%0.35827%0.274SS..SBendtrans-109.4101.5-179.8-1664.1000109.1V137 I138N92-V137 WeakPolarHBondContact O-CA 3.01Å; N92-I138 HydrophobicContact CB-CB 4.39Å; N92-I138 PolarHBondContact O-N 3.4Å
93I94.7Very high90.4Very high4 Ų448.9 Ų48.92%0.02127%0.269CS..EExtended strand (participates in β ladder)trans-121.9128.5-172-63-61.2000109.8C88 H113 C135 W136 V137C88-I93 HydrophobicContact CB-CG2 4.01Å; I93-H113 PolarHBondContact O-CE1 3.35Å; I93-H113 VanDerWaalsContact O-CE1 3.31Å; I93-C135 HydrophobicContact CG2-CB 3.92Å; I93-W136 CarbonylContact C-O 3.6Å; I93-W136 VanDerWaalsContact CA-O 3.29Å; I93-W136 WeakPolarHBondContact CA-O 3.36Å; I93-V137 HydrophobicContact CD1-CG2 3.86Å
94G94.2Very high89Confident10 Ų1054 Ų5410%0.10328%0.282CS..EExtended strand (participates in β ladder)trans-92151.4164.600000111.2C135 W136G94-C135 CarbonylContact O-C 3.54Å; G94-C135 WeakPolarHBondContact O-CA 3.48Å; G94-W136 PolarHBondContact N-O 3.27Å; G94-W136 PolarHBondContact O-N 3.44Å
95W95Very high87.7Confident28 Ų2860.6 Ų60.611%0.10632%0.317CS..EExtended strand (participates in β ladder)trans-124.7148.2178-73.797.4000111.2L60 L86 C88 Y97 I111 S118 L120 S134 C135 W136L60-W95 HydrophobicContact CD1-CH2 3.65Å; L60-W95 HydrophobicContact CD1-CZ3 3.63Å; L86-W95 HydrophobicContact CB-CH2 4.06Å; L86-W95 HydrophobicContact CB-CZ3 4.32Å; C88-W95 HydrophobicContact CB-CH2 3.68Å; C88-W95 HydrophobicContact CB-CZ2 3.52Å; W95-Y97 HydrophobicContact CB-CD1 4.16Å; W95-Y97 HydrophobicContact CB-CE1 4.12Å; W95-I111 HydrophobicContact CB-CD1 4.17Å; W95-I111 HydrophobicContact CG-CD1 4.31Å; W95-S118 PolarHBondContact NE1-OG 2.84Å; W95-L120 HydrophobicContact CD2-CB 4.24Å; W95-L120 HydrophobicContact CD2-CD1 4.06Å; W95-L120 HydrophobicContact CE3-CB 4.25Å; W95-L120 HydrophobicContact CE3-CD1 3.78Å; W95-L120 HydrophobicContact CG-CD1 4.44Å; W95-L120 HydrophobicContact CH2-CB 4.07Å; W95-L120 HydrophobicContact CZ2-CB 4.05Å; W95-L120 HydrophobicContact CZ3-CB 4.17Å; W95-L120 HydrophobicContact CZ3-CD1 4.26Å; W95-S134 CarbonylContact C-O 3.53Å; W95-S134 WeakPolarHBondContact CA-O 3.5Å; W95-C135 HydrophobicContact CD2-CB 4Å; W95-C135 HydrophobicContact CE3-CB 3.77Å; W95-C135 HydrophobicContact CH2-CB 4.12Å; W95-C135 HydrophobicContact CZ2-CB 4.32Å; W95-C135 HydrophobicContact CZ3-CB 3.84Å; W95-W136 WeakPolarHBondContact O-CH2 3.5Å
96S94.8Very high86.8Confident50 Ų5060.3 Ų60.335%0.3532%0.317SS..EExtended strand (participates in β ladder)trans-137.2139.9163.9159.40000108.6Y133 S134S96-Y133 CarbonylContact O-C 3.53Å; S96-Y133 WeakPolarHBondContact O-CA 3.4Å; S96-S134 WeakPolarHBondContact CB-OG 3.45Å; S96-S134 PolarHBondContact N-O 2.87Å; S96-S134 PolarHBondContact O-N 2.99Å
97Y94.4Very high86.3Confident37 Ų3765.8 Ų65.815%0.14536%0.356CS..  trans-150.6175.6-174.943.6-97000107.1W95 T99 L101 D102 L109 I111 L120 S132W95-Y97 HydrophobicContact CB-CD1 4.16Å; W95-Y97 HydrophobicContact CB-CE1 4.12Å; Y97-T99 PolarHBondContact O-N 3.02Å; Y97-L101 HydrophobicContact CD2-CB 4.09Å; Y97-L101 HydrophobicContact CD2-CD1 4.04Å; Y97-L101 HydrophobicContact CE2-CB 4.16Å; Y97-D102 WeakPolarHBondContact CE2-OD1 3.29Å; Y97-D102 PolarHBondContact OH-OD1 2.82Å; Y97-L109 HydrophobicContact CD1-CD2 4.43Å; Y97-L109 HydrophobicContact CD2-CD2 3.8Å; Y97-L109 HydrophobicContact CE1-CD2 4.04Å; Y97-L109 HydrophobicContact CE2-CD2 3.33Å; Y97-L109 HydrophobicContact CG-CD2 4.33Å; Y97-L109 VanDerWaalsContact CZ-CD2 3.47Å; Y97-I111 HydrophobicContact CD1-CD1 4.42Å; Y97-I111 HydrophobicContact CE1-CD1 3.58Å; Y97-L120 HydrophobicContact CD1-CD1 3.68Å; Y97-L120 HydrophobicContact CE1-CD1 4.34Å; Y97-L120 HydrophobicContact CG-CD1 4.33Å; Y97-S132 WeakPolarHBondContact CA-O 3.35Å
98P91.8Very high86.1Confident16 Ų1665.9 Ų65.910%0.10436%0.356CS..  trans-53.7123.3178.2-28.837.4000112.5Y100 L101 Y133P98-Y100 HydrophobicContact CB-CD1 3.77Å; P98-Y100 HydrophobicContact CB-CE1 3.63Å; P98-Y100 PolarHBondContact O-N 2.05Å; P98-Y100 VanDerWaalsContact O-N 3.14Å; P98-L101 WeakPolarHBondContact O-CB 3.12Å; P98-L101 PolarHBondContact O-N 2.89Å; P98-L101 VanDerWaalsContact O-N 3.16Å; P98-Y133 HydrophobicContact CG-CE2 4.2Å
99T85.8Confident86.1Confident112 Ų11267.1 Ų67.169%0.68736%0.362SS*.G310 helixtrans-62.5-24.2-169.248.80000114.5Y97 L101 D102Y97-T99 PolarHBondContact O-N 3.02Å; T99-L101 PolarHBondContact O-N 3.31Å; T99-D102 WeakPolarHBondContact O-CB 3.48Å; T99-D102 PolarHBondContact O-N 3.28Å
100Y82.3Confident86.1Confident77 Ų7762.4 Ų62.430%0.30235%0.348SS..G310 helixtrans-65-20.8179.881.8-90.4000112.9P98 D102 T103 A128 D129P98-Y100 HydrophobicContact CB-CD1 3.77Å; P98-Y100 HydrophobicContact CB-CE1 3.63Å; P98-Y100 PolarHBondContact O-N 2.05Å; P98-Y100 VanDerWaalsContact O-N 3.14Å; Y100-D102 PolarHBondContact O-N 3.1Å; Y100-T103 WeakPolarHBondContact CA-OG1 3.29Å; Y100-T103 PolarHBondContact O-N 2.78Å; Y100-T103 PolarHBondContact O-OG1 3.32Å; Y100-A128 WeakPolarHBondContact CE1-O 3.44Å; Y100-A128 PolarHBondContact OH-O 2.86Å; Y100-D129 WeakPolarHBondContact OH-CA 3.28Å; Y100-D129 WeakPolarHBondContact OH-CB 3.48Å; Y100-D129 PolarHBondContact OH-N 2.89Å; Y100-D129 PolarHBondContact OH-OD1 2.89Å
101L86.2Confident86.4Confident2 Ų264.1 Ų64.11%0.0135%0.352CS..G310 helixtrans-66.3-24.6173.9-70.8170.9000112.2Y97 P98 T99 D106 R108 L109 L122 D129Y97-L101 HydrophobicContact CD2-CB 4.09Å; Y97-L101 HydrophobicContact CD2-CD1 4.04Å; Y97-L101 HydrophobicContact CE2-CB 4.16Å; P98-L101 WeakPolarHBondContact O-CB 3.12Å; P98-L101 PolarHBondContact O-N 2.89Å; P98-L101 VanDerWaalsContact O-N 3.16Å; T99-L101 PolarHBondContact O-N 3.31Å; L101-D106 HydrophobicContact CD2-CB 4.34Å; L101-D106 WeakPolarHBondContact O-CB 3.1Å; L101-D106 PolarHBondContact O-N 2.79Å; L101-R108 VanDerWaalsContact CD2-NH2 3.32Å; L101-L109 HydrophobicContact CB-CD2 4.1Å; L101-L109 HydrophobicContact CD1-CD2 4.42Å; L101-L122 HydrophobicContact CD1-CD1 4.43Å; L101-L122 HydrophobicContact CD2-CD1 4.11Å; L101-D129 WeakPolarHBondContact CD2-OD1 3.26Å
102D82.2Confident86.7Confident82 Ų8265.4 Ų65.444%0.43935%0.349SS..THydrogen-bonded Turntrans-82.3-26.7176.4-63.9-44.5000112.4Y97 T99 Y100 F104 N105Y97-D102 WeakPolarHBondContact CE2-OD1 3.29Å; Y97-D102 PolarHBondContact OH-OD1 2.82Å; T99-D102 WeakPolarHBondContact O-CB 3.48Å; T99-D102 PolarHBondContact O-N 3.28Å; Y100-D102 PolarHBondContact O-N 3.1Å; D102-F104 PolarHBondContact O-N 2.85Å; D102-N105 PolarHBondContact O-N 3.4Å
103T70.9Confident86.9Confident91 Ų9167.8 Ų67.856%0.55836%0.358SS*.THydrogen-bonded Turntrans-59.9-20.1-167.3-49.40000114Y100Y100-T103 WeakPolarHBondContact CA-OG1 3.29Å; Y100-T103 PolarHBondContact O-N 2.78Å; Y100-T103 PolarHBondContact O-OG1 3.32Å
104F63.7Low86.7Confident182 Ų18270 Ų7080%0.79837%0.373SS*.THydrogen-bonded Turntrans-138.120.5-178.7-61-71.7000114.9D102 D106D102-F104 PolarHBondContact O-N 2.85Å; F104-D106 VanDerWaalsContact C-N 3.31Å; F104-D106 PolarHBondContact O-N 3.4Å
105N67.1Low86.3Confident151 Ų15176.2 Ų76.281%0.80740%0.404SS*.THydrogen-bonded Turntrans46.458.1-168-83.7-9.6000110.4D102 S107D102-N105 PolarHBondContact O-N 3.4Å; N105-S107 PolarHBondContact O-N 2.86Å
106D76.5Confident86.1Confident42 Ų4282.8 Ų82.823%0.22543%0.434CS..  trans-54.4115.3-175.6-170.2-25.8000109.6L101 F104 R108 L109L101-D106 HydrophobicContact CD2-CB 4.34Å; L101-D106 WeakPolarHBondContact O-CB 3.1Å; L101-D106 PolarHBondContact O-N 2.79Å; F104-D106 VanDerWaalsContact C-N 3.31Å; F104-D106 PolarHBondContact O-N 3.4Å; D106-R108 PolarHBondContact O-N 2.84Å; D106-R108 WeakPolarHBondContact OD1-CB 3.3Å; D106-R108 WeakPolarHBondContact OD1-CG 3.49Å; D106-R108 PolarHBondContact OD1-N 2.77Å; D106-R108 IonicContact OD1-NE 3.6Å; D106-R108 PolarHBondContact OD1-NE 3.01Å; D106-R108 IonicContact OD2-CZ 3.11Å; D106-R108 VanDerWaalsContact OD2-CZ 3.29Å; D106-R108 IonicContact OD2-NE 3.57Å; D106-R108 PolarHBondContact OD2-NE 2.9Å; D106-R108 IonicContact OD2-NH2 3.07Å; D106-R108 PolarHBondContact OD2-NH2 2.91Å; D106-L109 PolarHBondContact O-N 2.94Å
107S84.9Confident86Confident118 Ų11883.5 Ų83.583%0.82543%0.429SS*.THydrogen-bonded Turntrans-63.7-12.3-176.861.90000112.8N105N105-S107 PolarHBondContact O-N 2.86Å
108R91.6Very high86Confident48 Ų4881.8 Ų81.818%0.18142%0.422CS..THydrogen-bonded Turntrans-73.2-27.9174.5-61.5-178.4-53.8129.27.1113.3L101 D106 L122 T123 S124 D129L101-R108 VanDerWaalsContact CD2-NH2 3.32Å; D106-R108 PolarHBondContact O-N 2.84Å; D106-R108 WeakPolarHBondContact OD1-CB 3.3Å; D106-R108 WeakPolarHBondContact OD1-CG 3.49Å; D106-R108 PolarHBondContact OD1-N 2.77Å; D106-R108 IonicContact OD1-NE 3.6Å; D106-R108 PolarHBondContact OD1-NE 3.01Å; D106-R108 IonicContact OD2-CZ 3.11Å; D106-R108 VanDerWaalsContact OD2-CZ 3.29Å; D106-R108 IonicContact OD2-NE 3.57Å; D106-R108 PolarHBondContact OD2-NE 2.9Å; D106-R108 IonicContact OD2-NH2 3.07Å; D106-R108 PolarHBondContact OD2-NH2 2.91Å; R108-L122 HydrophobicContact CB-CD1 4.11Å; R108-L122 WeakPolarHBondContact O-CA 3.42Å; R108-T123 VanDerWaalsContact CA-OG1 3.25Å; R108-T123 WeakPolarHBondContact CA-OG1 3.25Å; R108-T123 WeakPolarHBondContact CB-O 3.48Å; R108-T123 WeakPolarHBondContact CB-OG1 3.42Å; R108-T123 WeakPolarHBondContact CD-O 3.47Å; R108-T123 PolarHBondContact O-N 2.99Å; R108-T123 PolarHBondContact O-OG1 2.87Å; R108-S124 PolarHBondContact NH1-O 3.17Å; R108-D129 IonicContact CZ-OD1 2.96Å; R108-D129 IonicContact CZ-OD2 2.68Å; R108-D129 IonicContact NH1-OD1 2.63Å; R108-D129 PolarHBondContact NH1-OD1 2.99Å; R108-D129 IonicContact NH1-OD2 3.72Å; R108-D129 PolarHBondContact NH1-OD2 3.29Å; R108-D129 IonicContact NH2-OD1 3.71Å; R108-D129 PolarHBondContact NH2-OD1 3.21Å; R108-D129 IonicContact NH2-OD2 3.43Å
109L93.2Very high86.2Confident27 Ų2782.4 Ų82.414%0.14142%0.424CS..EExtended strand (participates in β ladder)trans-94.6127-178.3-17569.2000110.4Y97 L101 D106 L120 V121 L122Y97-L109 HydrophobicContact CD1-CD2 4.43Å; Y97-L109 HydrophobicContact CD2-CD2 3.8Å; Y97-L109 HydrophobicContact CE1-CD2 4.04Å; Y97-L109 HydrophobicContact CE2-CD2 3.33Å; Y97-L109 HydrophobicContact CG-CD2 4.33Å; Y97-L109 VanDerWaalsContact CZ-CD2 3.47Å; L101-L109 HydrophobicContact CB-CD2 4.1Å; L101-L109 HydrophobicContact CD1-CD2 4.42Å; D106-L109 PolarHBondContact O-N 2.94Å; L109-L120 HydrophobicContact CD1-CD1 4.13Å; L109-L120 HydrophobicContact CD1-CD2 3.69Å; L109-L120 HydrophobicContact CD1-CG 3.75Å; L109-V121 CarbonylContact C-O 3.55Å; L109-V121 WeakPolarHBondContact CA-O 3.22Å; L109-L122 HydrophobicContact CB-CD1 4.41Å; L109-L122 HydrophobicContact CD1-CD1 4.37Å
110S93.4Very high86.7Confident47 Ų4777.1 Ų77.133%0.32939%0.392SS..EExtended strand (participates in β ladder)trans-135.1127.6175.5-176.40000110.6L120 V121S110-L120 CarbonylContact O-C 3.43Å; S110-L120 WeakPolarHBondContact O-CA 3.19Å; S110-V121 PolarHBondContact N-O 3.38Å; S110-V121 PolarHBondContact O-N 3.04Å
111I94.5Very high87.3Confident56 Ų5674.9 Ų74.929%0.28739%0.386SS..EExtended strand (participates in β ladder)trans-113.1127.4175-59175.5000108.8W95 Y97 Q119 L120W95-I111 HydrophobicContact CB-CD1 4.17Å; W95-I111 HydrophobicContact CG-CD1 4.31Å; Y97-I111 HydrophobicContact CD1-CD1 4.42Å; Y97-I111 HydrophobicContact CE1-CD1 3.58Å; I111-Q119 CarbonylContact C-O 3.5Å; I111-Q119 VanDerWaalsContact CA-O 3.29Å; I111-Q119 WeakPolarHBondContact CA-O 3.47Å; I111-L120 HydrophobicContact CD1-CD1 4.34Å; I111-L120 HydrophobicContact CG1-CB 4.37Å; I111-L120 HydrophobicContact CG1-CD1 4.39Å; I111-L120 HydrophobicContact CG1-CG 4.18Å
112K93.5Very high87.7Confident127 Ų12774.9 Ų74.955%0.55239%0.386SS*.EExtended strand (participates in β ladder)trans-125.6125.8179.6-62.9-176.9-177.5178.30109.8S118 Q119K112-S118 WeakPolarHBondContact O-CA 3.11Å; K112-S118 PolarHBondContact O-OG 2.86Å; K112-Q119 PolarHBondContact N-O 2.72Å; K112-Q119 PolarHBondContact O-N 3.39Å
113H93.8Very high88.3Confident117 Ų11773.4 Ų73.454%0.54238%0.38SS..EExtended strand (participates in β ladder)trans-97.1140176.7-60.4-88.2000110.3I93 S118I93-H113 PolarHBondContact O-CE1 3.35Å; I93-H113 VanDerWaalsContact O-CE1 3.31Å; H113-S118 PolarHBondContact CE1-OG 2.91Å; H113-S118 VanDerWaalsContact CE1-OG 3.28Å; H113-S118 PolarHBondContact ND1-OG 2.86Å; H113-S118 VanDerWaalsContact ND1-OG 3.1Å
114S90.7Very high89.4Confident50 Ų5072.6 Ų72.635%0.3538%0.378SS..  trans-134163.5174.8-177.70000108.9K116 Y117S114-K116 PolarHBondContact O-N 2.84Å; S114-Y117 CarbonylContact C-O 3.54Å; S114-Y117 WeakPolarHBondContact CA-O 3.31Å; S114-Y117 VanDerWaalsContact CB-O 3.27Å; S114-Y117 WeakPolarHBondContact CB-O 3.43Å; S114-Y117 PolarHBondContact N-O 2.91Å; S114-Y117 PolarHBondContact O-N 2.85Å
115D86.7Confident90.8Very high141 Ų14164 Ų6475%0.75434%0.34SS*.SBendtrans-62.1-18.2-177.3-56.9-28.2000113.9T91T91-D115 WeakPolarHBondContact CG2-O 3.39Å
116K89.8Confident92.1Very high165 Ų16559 Ų5972%0.71732%0.317SS*.SBendtrans-116.6-18.6-177.1-63.3-176.8-175.9175.50113.7G90 S114G90-K116 PolarHBondContact N-O 2.9Å; G90-K116 CarbonylContact O-C 3.59Å; G90-K116 VanDerWaalsContact O-C 3.31Å; S114-K116 PolarHBondContact O-N 2.84Å
117Y92.9Very high92.9Very high66 Ų6657.1 Ų57.126%0.25931%0.307SS..EExtended strand (participates in β ladder)trans-160159.1-17764-93.3000111R87 C88 G90 S114 Q119R87-Y117 HydrophobicContact CG-CD2 3.53Å; R87-Y117 HydrophobicContact CG-CE2 4.29Å; R87-Y117 HydrophobicContact CG-CG 3.75Å; C88-Y117 CarbonylContact O-C 3.56Å; C88-Y117 VanDerWaalsContact O-CA 3.24Å; C88-Y117 WeakPolarHBondContact O-CA 3.31Å; C88-Y117 WeakPolarHBondContact O-CB 3.35Å; G90-Y117 CarbonylContact O-C 3.43Å; G90-Y117 WeakPolarHBondContact O-CA 3.12Å; G90-Y117 PolarHBondContact O-N 2.81Å; G90-Y117 VanDerWaalsContact O-N 3.09Å; S114-Y117 CarbonylContact C-O 3.54Å; S114-Y117 WeakPolarHBondContact CA-O 3.31Å; S114-Y117 VanDerWaalsContact CB-O 3.27Å; S114-Y117 WeakPolarHBondContact CB-O 3.43Å; S114-Y117 PolarHBondContact N-O 2.91Å; S114-Y117 PolarHBondContact O-N 2.85Å; Y117-Q119 HydrophobicContact CD2-CB 4.18Å; Y117-Q119 HydrophobicContact CE2-CB 4Å
118S95.6Very high93.3Very high0 Ų052.6 Ų52.60%028%0.277CS..EExtended strand (participates in β ladder)trans-108.7145.5162-176.20000109.7R87 C88 W95 K112 H113R87-S118 WeakPolarHBondContact CA-O 3.16Å; C88-S118 PolarHBondContact N-O 3.2Å; C88-S118 PolarHBondContact O-N 3.38Å; W95-S118 PolarHBondContact NE1-OG 2.84Å; K112-S118 WeakPolarHBondContact O-CA 3.11Å; K112-S118 PolarHBondContact O-OG 2.86Å; H113-S118 PolarHBondContact CE1-OG 2.91Å; H113-S118 VanDerWaalsContact CE1-OG 3.28Å; H113-S118 PolarHBondContact ND1-OG 2.86Å; H113-S118 VanDerWaalsContact ND1-OG 3.1Å
119Q95.1Very high93.4Very high30 Ų3050.3 Ų50.314%0.1427%0.268CS..EExtended strand (participates in β ladder)trans-123.6129.1-174.9179.9-178-13.100109.4E85 L86 I111 K112 Y117 V121E85-Q119 HydrophobicContact CG-CG 3.74Å; E85-Q119 VanDerWaalsContact CG-NE2 3.34Å; E85-Q119 PolarHBondContact OE1-NE2 3.03Å; E85-Q119 PolarHBondContact OE2-NE2 3.12Å; L86-Q119 CarbonylContact O-C 3.59Å; L86-Q119 WeakPolarHBondContact O-CA 3.48Å; I111-Q119 CarbonylContact C-O 3.5Å; I111-Q119 VanDerWaalsContact CA-O 3.29Å; I111-Q119 WeakPolarHBondContact CA-O 3.47Å; K112-Q119 PolarHBondContact N-O 2.72Å; K112-Q119 PolarHBondContact O-N 3.39Å; Y117-Q119 HydrophobicContact CD2-CB 4.18Å; Y117-Q119 HydrophobicContact CE2-CB 4Å; Q119-V121 HydrophobicContact CG-CG2 3.95Å; Q119-V121 VanDerWaalsContact NE2-CG2 3.29Å
120L95.7Very high93.6Very high1 Ų149 Ų491%0.00526%0.262CS..EExtended strand (participates in β ladder)trans-110.6123.5171.1-178.7158.9000107.9E85 L86 W95 Y97 L109 S110 I111 L122 Y133E85-L120 WeakPolarHBondContact CA-O 3.47Å; L86-L120 HydrophobicContact CB-CB 4.39Å; L86-L120 PolarHBondContact N-O 2.75Å; L86-L120 PolarHBondContact O-N 2.81Å; W95-L120 HydrophobicContact CD2-CB 4.24Å; W95-L120 HydrophobicContact CD2-CD1 4.06Å; W95-L120 HydrophobicContact CE3-CB 4.25Å; W95-L120 HydrophobicContact CE3-CD1 3.78Å; W95-L120 HydrophobicContact CG-CD1 4.44Å; W95-L120 HydrophobicContact CH2-CB 4.07Å; W95-L120 HydrophobicContact CZ2-CB 4.05Å; W95-L120 HydrophobicContact CZ3-CB 4.17Å; W95-L120 HydrophobicContact CZ3-CD1 4.26Å; Y97-L120 HydrophobicContact CD1-CD1 3.68Å; Y97-L120 HydrophobicContact CE1-CD1 4.34Å; Y97-L120 HydrophobicContact CG-CD1 4.33Å; L109-L120 HydrophobicContact CD1-CD1 4.13Å; L109-L120 HydrophobicContact CD1-CD2 3.69Å; L109-L120 HydrophobicContact CD1-CG 3.75Å; S110-L120 CarbonylContact O-C 3.43Å; S110-L120 WeakPolarHBondContact O-CA 3.19Å; I111-L120 HydrophobicContact CD1-CD1 4.34Å; I111-L120 HydrophobicContact CG1-CB 4.37Å; I111-L120 HydrophobicContact CG1-CD1 4.39Å; I111-L120 HydrophobicContact CG1-CG 4.18Å; L120-L122 HydrophobicContact CD2-CB 4.48Å; L120-Y133 HydrophobicContact CD2-CE1 4.49Å
121V95.1Very high93.7Very high29 Ų2946.8 Ų46.818%0.17625%0.246CC..EExtended strand (participates in β ladder)trans-115.5127.3176.4-177.60000108.3V84 E85 L109 S110 Q119 T123V84-V121 WeakPolarHBondContact O-CA 3.16Å; E85-V121 HydrophobicContact CG-CG2 4.28Å; L109-V121 CarbonylContact C-O 3.55Å; L109-V121 WeakPolarHBondContact CA-O 3.22Å; S110-V121 PolarHBondContact N-O 3.38Å; S110-V121 PolarHBondContact O-N 3.04Å; Q119-V121 HydrophobicContact CG-CG2 3.95Å; Q119-V121 VanDerWaalsContact NE2-CG2 3.29Å; V121-T123 HydrophobicContact CG1-CG2 4.27Å
122L95.4Very high93.8Very high2 Ų247 Ų471%0.0125%0.252CS..EExtended strand (participates in β ladder)trans-118.8113.3172.6-17962.9000108.6S83 V84 L101 R108 L109 L120 P125 D129 F159S83-L122 CarbonylContact C-O 3.51Å; S83-L122 VanDerWaalsContact CA-O 3.31Å; S83-L122 WeakPolarHBondContact CA-O 3.19Å; V84-L122 PolarHBondContact N-O 3.25Å; V84-L122 PolarHBondContact O-N 3.13Å; L101-L122 HydrophobicContact CD1-CD1 4.43Å; L101-L122 HydrophobicContact CD2-CD1 4.11Å; R108-L122 HydrophobicContact CB-CD1 4.11Å; R108-L122 WeakPolarHBondContact O-CA 3.42Å; L109-L122 HydrophobicContact CB-CD1 4.41Å; L109-L122 HydrophobicContact CD1-CD1 4.37Å; L120-L122 HydrophobicContact CD2-CB 4.48Å; L122-P125 HydrophobicContact CD2-CB 3.91Å; L122-P125 HydrophobicContact CG-CB 4.25Å; L122-D129 HydrophobicContact CD2-CB 3.82Å; L122-F159 HydrophobicContact CD2-CZ 4.33Å
123T94.4Very high93.9Very high52 Ų5241 Ų4132%0.31923%0.227SC..SBendtrans-87.5143.3178.163.70000111R108 V121R108-T123 VanDerWaalsContact CA-OG1 3.25Å; R108-T123 WeakPolarHBondContact CA-OG1 3.25Å; R108-T123 WeakPolarHBondContact CB-O 3.48Å; R108-T123 WeakPolarHBondContact CB-OG1 3.42Å; R108-T123 WeakPolarHBondContact CD-O 3.47Å; R108-T123 PolarHBondContact O-N 2.99Å; R108-T123 PolarHBondContact O-OG1 2.87Å; V121-T123 HydrophobicContact CG1-CG2 4.27Å
124S93.3Very high94Very high73 Ų7336 Ų3651%0.5120%0.204SC..SBendtrans45.659.2178.7-57.60000114.1R108R108-S124 PolarHBondContact NH1-O 3.17Å
125P94.3Very high94.2Very high3 Ų333.6 Ų33.62%0.01919%0.187CC..  trans-67.6156.1177.729.6-35000111.7P80 G81 K82 V84 L122 D129 F159P80-P125 CarbonylContact C-O 3.54Å; P80-P125 WeakPolarHBondContact CA-O 3.37Å; P80-P125 WeakPolarHBondContact CB-O 3.41Å; G81-P125 PolarHBondContact N-O 2.74Å; K82-P125 WeakPolarHBondContact O-CD 3.4Å; K82-P125 WeakPolarHBondContact O-CG 3.36Å; V84-P125 HydrophobicContact CG2-CG 4.24Å; L122-P125 HydrophobicContact CD2-CB 3.91Å; L122-P125 HydrophobicContact CG-CB 4.25Å; P125-D129 WeakPolarHBondContact CA-OD2 3.15Å; P125-D129 HydrophobicContact CB-CB 4.3Å; P125-F159 HydrophobicContact CB-CD1 3.7Å; P125-F159 HydrophobicContact CB-CE1 3.35Å; P125-F159 HydrophobicContact CB-CE2 4.27Å; P125-F159 HydrophobicContact CB-CG 4.29Å; P125-F159 HydrophobicContact CB-CZ 3.66Å; P125-F159 HydrophobicContact CG-CD1 3.91Å; P125-F159 HydrophobicContact CG-CE1 3.45Å; P125-F159 VanDerWaalsContact CG-CE1 3.45Å; P125-F159 HydrophobicContact CG-CZ 4.14Å
126S94.1Very high94.6Very high45 Ų4528.7 Ų28.732%0.31516%0.158SC..  trans-134.6175.9-175.468.70000110.1A128 D129 F159S126-A128 PolarHBondContact O-N 2.64Å; S126-A128 PolarHBondContact OG-N 3.01Å; S126-D129 PolarHBondContact N-OD2 3.34Å; S126-D129 WeakPolarHBondContact O-CB 3.42Å; S126-D129 PolarHBondContact O-N 3.45Å; S126-D129 PolarHBondContact OG-OD2 3.45Å; S126-F159 VanDerWaalsContact O-CB 3.29Å; S126-F159 WeakPolarHBondContact O-CB 3.39Å
127A94.1Very high94.7Very high2 Ų221.4 Ų21.42%0.01713%0.128CC..G310 helixtrans-50.1-37.3171.800000113.4D129 T130 D161 N164 P168 T191A127-D129 PolarHBondContact O-N 2.98Å; A127-T130 VanDerWaalsContact O-CB 3.26Å; A127-T130 WeakPolarHBondContact O-CB 3.25Å; A127-T130 PolarHBondContact O-N 3.1Å; A127-T130 PolarHBondContact O-OG1 3.26Å; A127-D161 HydrophobicContact CB-CB 3.95Å; A127-N164 HydrophobicContact CB-CB 3.53Å; A127-P168 HydrophobicContact CB-CG 4.39Å; A127-T191 HydrophobicContact CB-CG2 3.79Å
128A92.7Very high94.7Very high23 Ų2320.3 Ų20.319%0.1913%0.126CC..G310 helixtrans-62.2-29.7179.300000112.6Y100 S126 T130 P168Y100-A128 WeakPolarHBondContact CE1-O 3.44Å; Y100-A128 PolarHBondContact OH-O 2.86Å; S126-A128 PolarHBondContact O-N 2.64Å; S126-A128 PolarHBondContact OG-N 3.01Å; A128-T130 PolarHBondContact O-N 3.25Å; A128-T130 VanDerWaalsContact O-N 3.13Å; A128-P168 HydrophobicContact CB-CG 4.38Å
129D94.1Very high94.5Very high0 Ų023.6 Ų23.60%015%0.146CC..G310 helixtrans-77.31.6-176.2-56.4-76.7000112.2Y100 L101 R108 L122 P125 S126 A127 Y133 F159Y100-D129 WeakPolarHBondContact OH-CA 3.28Å; Y100-D129 WeakPolarHBondContact OH-CB 3.48Å; Y100-D129 PolarHBondContact OH-N 2.89Å; Y100-D129 PolarHBondContact OH-OD1 2.89Å; L101-D129 WeakPolarHBondContact CD2-OD1 3.26Å; R108-D129 IonicContact CZ-OD1 2.96Å; R108-D129 IonicContact CZ-OD2 2.68Å; R108-D129 IonicContact NH1-OD1 2.63Å; R108-D129 PolarHBondContact NH1-OD1 2.99Å; R108-D129 IonicContact NH1-OD2 3.72Å; R108-D129 PolarHBondContact NH1-OD2 3.29Å; R108-D129 IonicContact NH2-OD1 3.71Å; R108-D129 PolarHBondContact NH2-OD1 3.21Å; R108-D129 IonicContact NH2-OD2 3.43Å; L122-D129 HydrophobicContact CD2-CB 3.82Å; P125-D129 WeakPolarHBondContact CA-OD2 3.15Å; P125-D129 HydrophobicContact CB-CB 4.3Å; S126-D129 PolarHBondContact N-OD2 3.34Å; S126-D129 WeakPolarHBondContact O-CB 3.42Å; S126-D129 PolarHBondContact O-N 3.45Å; S126-D129 PolarHBondContact OG-OD2 3.45Å; A127-D129 PolarHBondContact O-N 2.98Å; D129-Y133 WeakPolarHBondContact O-CE2 3.41Å; D129-Y133 PolarHBondContact O-OH 2.94Å; D129-F159 VanDerWaalsContact C-CD2 3.49Å; D129-F159 HydrophobicContact CB-CD2 3.86Å; D129-F159 HydrophobicContact CB-CE2 3.87Å; D129-F159 WeakPolarHBondContact O-CD2 3.4Å; D129-F159 WeakPolarHBondContact O-CE2 3.17Å
130T96.1Very high94.2Very high0 Ų024.9 Ų24.90%016%0.157CC..  trans-68.3126175.2-64.40000111.5A127 A128 Y156 V157 Y158 F159 V167 R189A127-T130 VanDerWaalsContact O-CB 3.26Å; A127-T130 WeakPolarHBondContact O-CB 3.25Å; A127-T130 PolarHBondContact O-N 3.1Å; A127-T130 PolarHBondContact O-OG1 3.26Å; A128-T130 PolarHBondContact O-N 3.25Å; A128-T130 VanDerWaalsContact O-N 3.13Å; T130-Y156 HydrophobicContact CG2-CE1 3.73Å; T130-V157 WeakPolarHBondContact CA-O 3.33Å; T130-V157 WeakPolarHBondContact CG2-O 3.26Å; T130-Y158 HydrophobicContact CG2-CD1 4.16Å; T130-F159 PolarHBondContact OG1-N 3.31Å; T130-V167 HydrophobicContact CG2-CG2 3.65Å; T130-R189 PolarHBondContact O-NH1 3.16Å
131G95.7Very high93.8Very high1 Ų131.9 Ų31.91%0.0120%0.195CC..EExtended strand (participates in β ladder)trans167.4-166.4178.800000114.1Y133 Y156 V157G131-Y133 WeakPolarHBondContact O-CD2 3.41Å; G131-Y156 WeakPolarHBondContact O-CA 3.5Å; G131-V157 PolarHBondContact N-O 2.8Å; G131-V157 VanDerWaalsContact N-O 3.12Å; G131-V157 PolarHBondContact O-N 2.89Å
132S95.9Very high93.4Very high59 Ų5933.9 Ų33.941%0.41322%0.222SC..EExtended strand (participates in β ladder)trans-81.3127.8177.9-166.70000110.8Y97Y97-S132 WeakPolarHBondContact CA-O 3.35Å
133Y96.3Very high92.9Very high3 Ų340.6 Ų40.61%0.01226%0.263CS..EExtended strand (participates in β ladder)trans-114.4122.7169.5-69-103.4000107.6L86 S96 P98 L120 D129 G131 A154 S155 V157 F159L86-Y133 HydrophobicContact CD1-CD1 3.86Å; L86-Y133 HydrophobicContact CD1-CG 4.08Å; S96-Y133 CarbonylContact O-C 3.53Å; S96-Y133 WeakPolarHBondContact O-CA 3.4Å; P98-Y133 HydrophobicContact CG-CE2 4.2Å; L120-Y133 HydrophobicContact CD2-CE1 4.49Å; D129-Y133 WeakPolarHBondContact O-CE2 3.41Å; D129-Y133 PolarHBondContact O-OH 2.94Å; G131-Y133 WeakPolarHBondContact O-CD2 3.41Å; Y133-A154 CarbonylContact O-C 3.57Å; Y133-A154 WeakPolarHBondContact O-CA 3.39Å; Y133-S155 PolarHBondContact N-O 3.36Å; Y133-S155 PolarHBondContact O-N 3.01Å; Y133-V157 HydrophobicContact CD2-CB 3.66Å; Y133-V157 HydrophobicContact CD2-CG2 3.44Å; Y133-V157 VanDerWaalsContact CD2-CG2 3.44Å; Y133-V157 HydrophobicContact CE2-CB 3.79Å; Y133-V157 HydrophobicContact CE2-CG2 4.05Å; Y133-V157 HydrophobicContact CG-CG2 4.03Å; Y133-F159 HydrophobicContact CE2-CE2 4.35Å
134S95.4Very high92.5Very high10 Ų1044.7 Ų44.77%0.0728%0.278CS..EExtended strand (participates in β ladder)trans-135.5149.8-178.366.20000112.2W95 S96 Y153W95-S134 CarbonylContact C-O 3.53Å; W95-S134 WeakPolarHBondContact CA-O 3.5Å; S96-S134 WeakPolarHBondContact CB-OG 3.45Å; S96-S134 PolarHBondContact N-O 2.87Å; S96-S134 PolarHBondContact O-N 2.99Å; S134-Y153 CarbonylContact C-O 3.54Å; S134-Y153 WeakPolarHBondContact CA-O 3.15Å; S134-Y153 VanDerWaalsContact CB-O 3.31Å; S134-Y153 WeakPolarHBondContact CB-O 3.43Å
135C95.5Very high92.3Very high0 Ų044.6 Ų44.60%028%0.277CS..EExtended strand (participates in β ladder)trans-135.7151.3172.169.70000110.5C88 I93 G94 W95 Y153C88-C135 HydrophobicContact CB-CB 3.51Å; C88-C135 WeakPolarHBondContact CB-SG 3.32Å; C88-C135 WeakPolarHBondContact SG-CB 2.99Å; C88-C135 CovalentContact SG-SG 2.03Å; C88-C135 PolarHBondContact SG-SG 3.03Å; I93-C135 HydrophobicContact CG2-CB 3.92Å; G94-C135 CarbonylContact O-C 3.54Å; G94-C135 WeakPolarHBondContact O-CA 3.48Å; W95-C135 HydrophobicContact CD2-CB 4Å; W95-C135 HydrophobicContact CE3-CB 3.77Å; W95-C135 HydrophobicContact CH2-CB 4.12Å; W95-C135 HydrophobicContact CZ2-CB 4.32Å; W95-C135 HydrophobicContact CZ3-CB 3.84Å; C135-Y153 PolarHBondContact N-O 2.92Å; C135-Y153 PolarHBondContact O-N 3.16Å
136W94.8Very high92Very high38 Ų3851 Ų5114%0.14431%0.307CS..EExtended strand (participates in β ladder)trans-146.6152.517857.792.3000111.5I93 G94 W95 R147 R151 T152I93-W136 CarbonylContact C-O 3.6Å; I93-W136 VanDerWaalsContact CA-O 3.29Å; I93-W136 WeakPolarHBondContact CA-O 3.36Å; G94-W136 PolarHBondContact N-O 3.27Å; G94-W136 PolarHBondContact O-N 3.44Å; W95-W136 WeakPolarHBondContact O-CH2 3.5Å; W136-R147 HydrophobicContact CB-CG 3.97Å; W136-R147 VanDerWaalsContact CD1-CG 3.49Å; W136-R147 HydrophobicContact CD2-CG 4.36Å; W136-R147 HydrophobicContact CG-CB 4.37Å; W136-R147 HydrophobicContact CG-CG 3.66Å; W136-R151 VanDerWaalsContact CA-O 3.32Å; W136-R151 WeakPolarHBondContact CA-O 3.45Å; W136-T152 HydrophobicContact CB-CG2 4.23Å; W136-T152 VanDerWaalsContact CB-OG1 3.3Å; W136-T152 WeakPolarHBondContact CB-OG1 3.36Å
137V93.2Very high91.8Very high12 Ų1254.5 Ų54.57%0.07331%0.313CS..EExtended strand (participates in β ladder)trans-73.9135170-177.70000109.5L59 N92 I93 V139 D148 R151L59-V137 HydrophobicContact CD1-CG2 4.36Å; N92-V137 WeakPolarHBondContact O-CA 3.01Å; I93-V137 HydrophobicContact CD1-CG2 3.86Å; V137-V139 HydrophobicContact CG1-CG2 4.29Å; V137-D148 HydrophobicContact CB-CB 4.21Å; V137-D148 VanDerWaalsContact O-CB 3.25Å; V137-D148 WeakPolarHBondContact O-CB 3.37Å; V137-D148 PolarHBondContact O-N 2.76Å; V137-R151 HydrophobicContact CB-CB 4.07Å; V137-R151 HydrophobicContact CG2-CB 3.79Å; V137-R151 PolarHBondContact N-O 2.87Å
138I92.1Very high91.6Very high43 Ų4356 Ų5622%0.22132%0.321CS..EExtended strand (participates in β ladder)trans-98.2123.7172-60.7167.3000107.6N92 C145N92-I138 HydrophobicContact CB-CB 4.39Å; N92-I138 PolarHBondContact O-N 3.4Å; I138-C145 HydrophobicContact CG2-CB 3.82Å
139V90.7Very high91.3Very high69 Ų6962.9 Ų62.942%0.41835%0.349SS..EExtended strand (participates in β ladder)trans-110.6128176.4-178.20000107.8V137 C145 Q146 D148 R151V137-V139 HydrophobicContact CG1-CG2 4.29Å; V139-C145 WeakPolarHBondContact O-CA 3.36Å; V139-Q146 PolarHBondContact N-O 3.16Å; V139-Q146 PolarHBondContact O-N 3.38Å; V139-D148 HydrophobicContact CG2-CB 4.14Å; V139-R151 VanDerWaalsContact CG2-NH2 3.26Å
140C90Very high91Very high57 Ų5769.8 Ų69.839%0.38539%0.386SS..EExtended strand (participates in β ladder)trans-111.6130178-54.60000109.7E144 C145C140-E144 CarbonylContact C-O 3.58Å; C140-E144 VanDerWaalsContact CA-O 3.26Å; C140-E144 WeakPolarHBondContact CA-O 3.38Å; C140-C145 HydrophobicContact CB-CB 4.13Å; C140-C145 WeakPolarHBondContact CB-SG 3.44Å; C140-C145 WeakPolarHBondContact SG-CB 3.29Å; C140-C145 CovalentContact SG-SG 2.05Å; C140-C145 PolarHBondContact SG-SG 2.68Å
141D86.9Confident90.7Very high148 Ų14874.5 Ų74.579%0.79140%0.404SS*.EExtended strand (participates in β ladder)trans-110.397.4168.9-169.99.7000108.1T143 E144D141-T143 PolarHBondContact O-N 3.18Å; D141-E144 PolarHBondContact N-O 3.4Å; D141-E144 PolarHBondContact O-N 3.02Å
142G86.7Confident90.6Very high72 Ų7276.6 Ų76.674%0.74242%0.417SS*.THydrogen-bonded Turntrans63.9-115.2-168.800000112
143T84.6Confident90.4Very high143 Ų14375.4 Ų75.488%0.87740%0.403SS*.THydrogen-bonded Turntrans-90.7-15.6-179.351.90000113.8D141D141-T143 PolarHBondContact O-N 3.18Å
144E85.4Confident90.3Very high137 Ų13778 Ų7864%0.6443%0.426SS*.EExtended strand (participates in β ladder)trans-92.9121-178.5-66.9-167.3176.100110.4C140 D141C140-E144 CarbonylContact C-O 3.58Å; C140-E144 VanDerWaalsContact CA-O 3.26Å; C140-E144 WeakPolarHBondContact CA-O 3.38Å; D141-E144 PolarHBondContact N-O 3.4Å; D141-E144 PolarHBondContact O-N 3.02Å
145C89.3Confident90.4Very high72 Ų7277.6 Ų77.649%0.48642%0.423SS..EExtended strand (participates in β ladder)trans-109.8131.4176-62.50000110.1I138 V139 C140I138-C145 HydrophobicContact CG2-CB 3.82Å; V139-C145 WeakPolarHBondContact O-CA 3.36Å; C140-C145 HydrophobicContact CB-CB 4.13Å; C140-C145 WeakPolarHBondContact CB-SG 3.44Å; C140-C145 WeakPolarHBondContact SG-CB 3.29Å; C140-C145 CovalentContact SG-SG 2.05Å; C140-C145 PolarHBondContact SG-SG 2.68Å
146Q88.9Confident90.4Very high136 Ų13678.8 Ų78.864%0.63643%0.427SS*.EExtended strand (participates in β ladder)trans-126.2152.3-177.5-68.2-77.7-24.800110.7V139V139-Q146 PolarHBondContact N-O 3.16Å; V139-Q146 PolarHBondContact O-N 3.38Å
147R90.3Very high90.6Very high119 Ų11977 Ų7745%0.44942%0.421SS..EExtended strand (participates in β ladder)trans-71.4127.4170.2167.5-176.9-81.1178.2-3.9109W136 Q149W136-R147 HydrophobicContact CB-CG 3.97Å; W136-R147 VanDerWaalsContact CD1-CG 3.49Å; W136-R147 HydrophobicContact CD2-CG 4.36Å; W136-R147 HydrophobicContact CG-CB 4.37Å; W136-R147 HydrophobicContact CG-CG 3.66Å; R147-Q149 PolarHBondContact O-N 2.66Å
148D89.3Confident90.7Very high33 Ų3376.9 Ų76.918%0.17642%0.419CS..EExtended strand (participates in β ladder)trans-76.6109.5168.4-169.7-37000110.5V137 V139 D150 R151 T152V137-D148 HydrophobicContact CB-CB 4.21Å; V137-D148 VanDerWaalsContact O-CB 3.25Å; V137-D148 WeakPolarHBondContact O-CB 3.37Å; V137-D148 PolarHBondContact O-N 2.76Å; V139-D148 HydrophobicContact CG2-CB 4.14Å; D148-D150 PolarHBondContact OD1-N 3.14Å; D148-R151 HydrophobicContact CB-CB 4.27Å; D148-R151 CarbonylContact O-C 3.53Å; D148-R151 PolarHBondContact O-N 2.99Å; D148-R151 PolarHBondContact OD1-N 2.85Å; D148-R151 VanDerWaalsContact OD1-N 3.1Å; D148-R151 IonicContact OD2-CZ 3.1Å; D148-R151 IonicContact OD2-NE 2.69Å; D148-R151 PolarHBondContact OD2-NE 2.56Å; D148-R151 IonicContact OD2-NH2 2.68Å; D148-R151 PolarHBondContact OD2-NH2 3.26Å; D148-T152 PolarHBondContact O-N 3.21Å; D148-T152 PolarHBondContact O-OG1 3.18Å
149Q86.4Confident90.9Very high168 Ų16874.9 Ų74.979%0.78541%0.409SS*.EExtended strand (participates in β ladder)trans-68.2-33.8-178.1-63.7-173.13.900112.6R147 R151 T152R147-Q149 PolarHBondContact O-N 2.66Å; Q149-R151 VanDerWaalsContact C-N 3.27Å; Q149-R151 PolarHBondContact O-N 2.92Å; Q149-T152 PolarHBondContact O-N 2.92Å
150D87.9Confident91.1Very high145 Ų14573.3 Ų73.378%0.77540%0.399SS*.EExtended strand (participates in β ladder)trans-73.7-23.6-179.5-68.7-29.6000112D148D148-D150 PolarHBondContact OD1-N 3.14Å
151R89.8Confident91Very high99 Ų9972.4 Ų72.437%0.37439%0.391SS..EExtended strand (participates in β ladder)trans-111.636.6177.8-62.7-174.9-69.9173.6-1.4112.6W136 V137 V139 D148 Q149 Y153W136-R151 VanDerWaalsContact CA-O 3.32Å; W136-R151 WeakPolarHBondContact CA-O 3.45Å; V137-R151 HydrophobicContact CB-CB 4.07Å; V137-R151 HydrophobicContact CG2-CB 3.79Å; V137-R151 PolarHBondContact N-O 2.87Å; V139-R151 VanDerWaalsContact CG2-NH2 3.26Å; D148-R151 HydrophobicContact CB-CB 4.27Å; D148-R151 CarbonylContact O-C 3.53Å; D148-R151 PolarHBondContact O-N 2.99Å; D148-R151 PolarHBondContact OD1-N 2.85Å; D148-R151 VanDerWaalsContact OD1-N 3.1Å; D148-R151 IonicContact OD2-CZ 3.1Å; D148-R151 IonicContact OD2-NE 2.69Å; D148-R151 PolarHBondContact OD2-NE 2.56Å; D148-R151 IonicContact OD2-NH2 2.68Å; D148-R151 PolarHBondContact OD2-NH2 3.26Å; Q149-R151 VanDerWaalsContact C-N 3.27Å; Q149-R151 PolarHBondContact O-N 2.92Å; R151-Y153 HydrophobicContact CB-CE2 4.36Å
152T92.4Very high91Very high46 Ų4672.9 Ų72.928%0.28239%0.386SS..EExtended strand (participates in β ladder)trans-101.5128.7170.5-63.80000110.4W136 D148 Q149W136-T152 HydrophobicContact CB-CG2 4.23Å; W136-T152 VanDerWaalsContact CB-OG1 3.3Å; W136-T152 WeakPolarHBondContact CB-OG1 3.36Å; D148-T152 PolarHBondContact O-N 3.21Å; D148-T152 PolarHBondContact O-OG1 3.18Å; Q149-T152 PolarHBondContact O-N 2.92Å
153Y93.3Very high91.1Very high34 Ų3476.8 Ų76.813%0.13339%0.385CS..EExtended strand (participates in β ladder)trans-127.9134.8-179-59.7-87000109.6S56 Q57 L59 S134 C135 R151S56-Y153 PolarHBondContact OG-OH 3.41Å; S56-Y153 VanDerWaalsContact OG-OH 3.09Å; Q57-Y153 PolarHBondContact O-OH 3.3Å; L59-Y153 HydrophobicContact CB-CD2 3.68Å; L59-Y153 HydrophobicContact CB-CE2 3.66Å; L59-Y153 HydrophobicContact CB-CG 4.32Å; L59-Y153 HydrophobicContact CD1-CD2 3.94Å; L59-Y153 HydrophobicContact CD1-CE2 3.25Å; L59-Y153 HydrophobicContact CG-CD2 3.85Å; L59-Y153 HydrophobicContact CG-CE2 3.24Å; S134-Y153 CarbonylContact C-O 3.54Å; S134-Y153 WeakPolarHBondContact CA-O 3.15Å; S134-Y153 VanDerWaalsContact CB-O 3.31Å; S134-Y153 WeakPolarHBondContact CB-O 3.43Å; C135-Y153 PolarHBondContact N-O 2.92Å; C135-Y153 PolarHBondContact O-N 3.16Å; R151-Y153 HydrophobicContact CB-CE2 4.36Å
154A94.5Very high91.4Very high58 Ų5872.9 Ų72.948%0.47936%0.358SS..EExtended strand (participates in β ladder)trans-136.1144.1179.400000110.5Y133Y133-A154 CarbonylContact O-C 3.57Å; Y133-A154 WeakPolarHBondContact O-CA 3.39Å
155S96.1Very high91.8Very high1 Ų166.5 Ų66.51%0.00733%0.329CS..EExtended strand (participates in β ladder)trans-135.3133.1170.6176.90000108.3G73 Y133G73-S155 VanDerWaalsContact O-CB 3.28Å; G73-S155 WeakPolarHBondContact O-CB 3.28Å; G73-S155 PolarHBondContact O-OG 3.28Å; G73-S155 VanDerWaalsContact O-OG 3.14Å; Y133-S155 PolarHBondContact N-O 3.36Å; Y133-S155 PolarHBondContact O-N 3.01Å
156Y97Very high92.1Very high24 Ų2463.8 Ų63.89%0.09431%0.309CS..EExtended strand (participates in β ladder)trans-81.4118167.6-162.1-83.4000109.1P74 S75 T76 T130 G131 Y158 R189 T220P74-Y156 PolarHBondContact O-N 2.98Å; S75-Y156 CarbonylContact C-O 3.54Å; S75-Y156 VanDerWaalsContact CA-O 3.22Å; S75-Y156 WeakPolarHBondContact CA-O 3.46Å; T76-Y156 PolarHBondContact N-O 3.42Å; T130-Y156 HydrophobicContact CG2-CE1 3.73Å; G131-Y156 WeakPolarHBondContact O-CA 3.5Å; Y156-Y158 HydrophobicContact CD1-CD1 4.17Å; Y156-Y158 AromaticContact CD1-CD2 3.92Å; Y156-Y158 HydrophobicContact CD1-CD2 3.92Å; Y156-Y158 AromaticContact CD1-CE1 3.83Å; Y156-Y158 HydrophobicContact CD1-CE1 3.83Å; Y156-Y158 AromaticContact CD1-CE2 3.55Å; Y156-Y158 HydrophobicContact CD1-CE2 3.55Å; Y156-Y158 HydrophobicContact CD1-CG 4.22Å; Y156-Y158 AromaticContact CD1-CZ 3.49Å; Y156-Y158 VanDerWaalsContact CD1-CZ 3.49Å; Y156-Y158 AromaticContact CE1-CD1 3.84Å; Y156-Y158 HydrophobicContact CE1-CD1 3.84Å; Y156-Y158 HydrophobicContact CE1-CD2 4.43Å; Y156-Y158 AromaticContact CE1-CE1 3.48Å; Y156-Y158 HydrophobicContact CE1-CE1 3.48Å; Y156-Y158 VanDerWaalsContact CE1-CE1 3.48Å; Y156-Y158 HydrophobicContact CE1-CE2 4.11Å; Y156-Y158 HydrophobicContact CE1-CG 4.3Å; Y156-Y158 AromaticContact CE1-CZ 3.62Å; Y156-R189 PolarHBondContact OH-NH1 2.81Å; Y156-T220 HydrophobicContact CD1-CG2 3.85Å; Y156-T220 HydrophobicContact CD2-CG2 3.73Å; Y156-T220 HydrophobicContact CE1-CG2 4.05Å; Y156-T220 HydrophobicContact CE2-CG2 3.96Å; Y156-T220 HydrophobicContact CG-CG2 3.67Å; Y156-T220 PolarHBondContact OH-O 3.06Å
157V97.1Very high92.3Very high1 Ų158 Ų581%0.00628%0.283CS..EExtended strand (participates in β ladder)trans-102.5119-176.9-177.90000108.6T76 L78 T130 G131 Y133 F159T76-V157 HydrophobicContact CG2-CB 4.2Å; T76-V157 HydrophobicContact CG2-CG1 4.13Å; T76-V157 HydrophobicContact CG2-CG2 3.76Å; T76-V157 WeakPolarHBondContact O-CA 3.43Å; L78-V157 HydrophobicContact CB-CG1 4.3Å; L78-V157 HydrophobicContact CD1-CG1 3.53Å; L78-V157 HydrophobicContact CG-CG1 3.85Å; T130-V157 WeakPolarHBondContact CA-O 3.33Å; T130-V157 WeakPolarHBondContact CG2-O 3.26Å; G131-V157 PolarHBondContact N-O 2.8Å; G131-V157 VanDerWaalsContact N-O 3.12Å; G131-V157 PolarHBondContact O-N 2.89Å; Y133-V157 HydrophobicContact CD2-CB 3.66Å; Y133-V157 HydrophobicContact CD2-CG2 3.44Å; Y133-V157 VanDerWaalsContact CD2-CG2 3.44Å; Y133-V157 HydrophobicContact CE2-CB 3.79Å; Y133-V157 HydrophobicContact CE2-CG2 4.05Å; Y133-V157 HydrophobicContact CG-CG2 4.03Å; V157-F159 HydrophobicContact CB-CE2 4.42Å; V157-F159 HydrophobicContact CG1-CD2 4.14Å; V157-F159 HydrophobicContact CG1-CE1 4.47Å; V157-F159 HydrophobicContact CG1-CE2 3.64Å; V157-F159 HydrophobicContact CG1-CZ 3.84Å
158Y96.8Very high92.3Very high9 Ų955.5 Ų55.54%0.03528%0.281CS..EExtended strand (participates in β ladder)trans-92.6118.9173.4-68.1-82.7000109.9T76 T77 L78 T130 Y156 T191 P193 T220T76-Y158 PolarHBondContact O-N 3.47Å; T77-Y158 WeakPolarHBondContact CA-O 3.19Å; L78-Y158 PolarHBondContact N-O 2.7Å; T130-Y158 HydrophobicContact CG2-CD1 4.16Å; Y156-Y158 HydrophobicContact CD1-CD1 4.17Å; Y156-Y158 AromaticContact CD1-CD2 3.92Å; Y156-Y158 HydrophobicContact CD1-CD2 3.92Å; Y156-Y158 AromaticContact CD1-CE1 3.83Å; Y156-Y158 HydrophobicContact CD1-CE1 3.83Å; Y156-Y158 AromaticContact CD1-CE2 3.55Å; Y156-Y158 HydrophobicContact CD1-CE2 3.55Å; Y156-Y158 HydrophobicContact CD1-CG 4.22Å; Y156-Y158 AromaticContact CD1-CZ 3.49Å; Y156-Y158 VanDerWaalsContact CD1-CZ 3.49Å; Y156-Y158 AromaticContact CE1-CD1 3.84Å; Y156-Y158 HydrophobicContact CE1-CD1 3.84Å; Y156-Y158 HydrophobicContact CE1-CD2 4.43Å; Y156-Y158 AromaticContact CE1-CE1 3.48Å; Y156-Y158 HydrophobicContact CE1-CE1 3.48Å; Y156-Y158 VanDerWaalsContact CE1-CE1 3.48Å; Y156-Y158 HydrophobicContact CE1-CE2 4.11Å; Y156-Y158 HydrophobicContact CE1-CG 4.3Å; Y156-Y158 AromaticContact CE1-CZ 3.62Å; Y158-T191 WeakPolarHBondContact CB-O 3.46Å; Y158-P193 HydrophobicContact CD2-CB 4.39Å; Y158-P193 HydrophobicContact CD2-CG 4.24Å; Y158-P193 HydrophobicContact CE1-CB 4.17Å; Y158-P193 HydrophobicContact CE2-CB 3.92Å; Y158-P193 HydrophobicContact CE2-CG 4.25Å; Y158-P193 HydrophobicContact CG-CG 4.48Å; Y158-T220 WeakPolarHBondContact OH-CG2 3.34Å
159F96.3Very high92Very high2 Ų256.3 Ų56.31%0.00929%0.29CS..EExtended strand (participates in β ladder)trans-96.487.9167.6-70.6-79.4000108.8L78 V84 L122 P125 S126 D129 T130 Y133 V157 D161L78-F159 HydrophobicContact CB-CD1 4.04Å; L78-F159 HydrophobicContact CB-CE1 3.85Å; L78-F159 HydrophobicContact CD1-CE1 4.26Å; L78-F159 HydrophobicContact CD1-CZ 4.32Å; L78-F159 WeakPolarHBondContact O-CA 3.19Å; V84-F159 HydrophobicContact CG2-CE1 3.78Å; V84-F159 HydrophobicContact CG2-CZ 4.1Å; L122-F159 HydrophobicContact CD2-CZ 4.33Å; P125-F159 HydrophobicContact CB-CD1 3.7Å; P125-F159 HydrophobicContact CB-CE1 3.35Å; P125-F159 HydrophobicContact CB-CE2 4.27Å; P125-F159 HydrophobicContact CB-CG 4.29Å; P125-F159 HydrophobicContact CB-CZ 3.66Å; P125-F159 HydrophobicContact CG-CD1 3.91Å; P125-F159 HydrophobicContact CG-CE1 3.45Å; P125-F159 VanDerWaalsContact CG-CE1 3.45Å; P125-F159 HydrophobicContact CG-CZ 4.14Å; S126-F159 VanDerWaalsContact O-CB 3.29Å; S126-F159 WeakPolarHBondContact O-CB 3.39Å; D129-F159 VanDerWaalsContact C-CD2 3.49Å; D129-F159 HydrophobicContact CB-CD2 3.86Å; D129-F159 HydrophobicContact CB-CE2 3.87Å; D129-F159 WeakPolarHBondContact O-CD2 3.4Å; D129-F159 WeakPolarHBondContact O-CE2 3.17Å; T130-F159 PolarHBondContact OG1-N 3.31Å; Y133-F159 HydrophobicContact CE2-CE2 4.35Å; V157-F159 HydrophobicContact CB-CE2 4.42Å; V157-F159 HydrophobicContact CG1-CD2 4.14Å; V157-F159 HydrophobicContact CG1-CE1 4.47Å; V157-F159 HydrophobicContact CG1-CE2 3.64Å; V157-F159 HydrophobicContact CG1-CZ 3.84Å; F159-D161 PolarHBondContact O-N 2.91Å
160T93.6Very high91.4Very high36 Ų3653.2 Ų53.222%0.22129%0.293CS..  trans-66.7119.4-173.349.60000111.1T77 L78 P80 T191 E192T77-T160 HydrophobicContact CG2-CG2 3.42Å; T77-T160 VanDerWaalsContact CG2-CG2 3.42Å; L78-T160 PolarHBondContact O-N 2.03Å; P80-T160 WeakPolarHBondContact CD-O 3.27Å; P80-T160 WeakPolarHBondContact CG-O 3.44Å; T160-T191 WeakPolarHBondContact CA-O 3.17Å; T160-T191 WeakPolarHBondContact CG2-O 3.41Å; T160-E192 HydrophobicContact CG2-CB 4.04Å; T160-E192 HydrophobicContact CG2-CG 4.27Å
161D89Confident90.7Very high38 Ų3850.9 Ų50.920%0.20328%0.279CS..  trans-129.4125.2177.6-173.8-6.9000109.1A127 F159 E163 N164A127-D161 HydrophobicContact CB-CB 3.95Å; F159-D161 PolarHBondContact O-N 2.91Å; D161-E163 VanDerWaalsContact C-N 3.26Å; D161-E163 PolarHBondContact O-N 2.73Å; D161-E163 PolarHBondContact OD1-N 2.97Å; D161-N164 HydrophobicContact CB-CB 4.14Å; D161-N164 CarbonylContact O-C 3.53Å; D161-N164 VanDerWaalsContact O-C 3.27Å; D161-N164 PolarHBondContact O-N 2.94Å; D161-N164 VanDerWaalsContact O-O 3.04Å; D161-N164 PolarHBondContact OD2-ND2 3.24Å
162K86.3Confident89.8Confident158 Ų15853.4 Ų53.469%0.68730%0.295SS*.SBendtrans-72.7-24.2-178.3-65.3177.6-175164.50112.3N164 Q247K162-N164 VanDerWaalsContact C-N 3.35Å; K162-Q247 PolarHBondContact O-NE2 3.05Å
163E88.1Confident89Confident154 Ų15457.7 Ų57.772%0.7231%0.31SS*.SBendtrans-83.4-19.8177.5-65.3176.6-168.100111.1D161 Q247D161-E163 VanDerWaalsContact C-N 3.26Å; D161-E163 PolarHBondContact O-N 2.73Å; D161-E163 PolarHBondContact OD1-N 2.97Å; E163-Q247 VanDerWaalsContact C-NE2 3.3Å; E163-Q247 PolarHBondContact O-NE2 2.88Å; E163-Q247 PolarHBondContact O-OE1 3.26Å
164N91.8Very high88.6Confident61 Ų6158.9 Ų58.933%0.32632%0.317SS..  trans-132.586.2-177.5-62.9-75.6000110.6A127 D161 K162 F166 T191A127-N164 HydrophobicContact CB-CB 3.53Å; D161-N164 HydrophobicContact CB-CB 4.14Å; D161-N164 CarbonylContact O-C 3.53Å; D161-N164 VanDerWaalsContact O-C 3.27Å; D161-N164 PolarHBondContact O-N 2.94Å; D161-N164 VanDerWaalsContact O-O 3.04Å; D161-N164 PolarHBondContact OD2-ND2 3.24Å; K162-N164 VanDerWaalsContact C-N 3.35Å; N164-F166 VanDerWaalsContact C-N 3.29Å; N164-F166 PolarHBondContact O-N 2.84Å; N164-T191 VanDerWaalsContact O-CG2 3.23Å; N164-T191 WeakPolarHBondContact O-CG2 3.32Å; N164-T191 PolarHBondContact O-OG1 3.33Å
165L94Very high88.4Confident3 Ų360.3 Ų60.32%0.01632%0.316CS..SBendtrans-72-24.8179.2-62.3-177000113.2V190 T191 V195 A240 Q247L165-V190 CarbonylContact O-C 3.6Å; L165-V190 VanDerWaalsContact O-CA 3.27Å; L165-V190 WeakPolarHBondContact O-CA 3.33Å; L165-V190 WeakPolarHBondContact O-CB 3.47Å; L165-T191 PolarHBondContact O-N 3.36Å; L165-T191 PolarHBondContact O-OG1 3.23Å; L165-V195 HydrophobicContact CD1-CG2 4.47Å; L165-A240 HydrophobicContact CD1-CB 4.33Å; L165-Q247 HydrophobicContact CD1-CB 4.18Å; L165-Q247 HydrophobicContact CD1-CG 4.04Å; L165-Q247 HydrophobicContact CG-CB 4.49Å; L165-Q247 HydrophobicContact CG-CG 4.24Å
166F95.1Very high88.2Confident15 Ų1560.9 Ų60.97%0.06632%0.319CS..BIsolated β-bridgetrans-105.3147.9174.3-63.5-75.5000110.3N164 P168 C188 R189 V190 C238 A240N164-F166 VanDerWaalsContact C-N 3.29Å; N164-F166 PolarHBondContact O-N 2.84Å; F166-P168 VanDerWaalsContact O-CD 3.24Å; F166-P168 WeakPolarHBondContact O-CD 3.18Å; F166-C188 HydrophobicContact CD1-CB 4.12Å; F166-C188 HydrophobicContact CE1-CB 4.21Å; F166-R189 CarbonylContact C-O 3.58Å; F166-R189 WeakPolarHBondContact CA-O 3.45Å; F166-V190 HydrophobicContact CD1-CG1 3.89Å; F166-V190 HydrophobicContact CE1-CG1 3.85Å; F166-C238 HydrophobicContact CE1-CB 3.68Å; F166-C238 HydrophobicContact CZ-CB 3.73Å; F166-A240 HydrophobicContact CE1-CB 4.2Å; F166-A240 HydrophobicContact CE2-CB 3.83Å; F166-A240 HydrophobicContact CZ-CB 3.45Å; F166-A240 VanDerWaalsContact CZ-CB 3.45Å
167V94.4Very high87.9Confident15 Ų1566 Ų669%0.09134%0.339CS..  trans-67.1119.6171.8-174.30000108.2T130 R189 T191T130-V167 HydrophobicContact CG2-CG2 3.65Å; V167-R189 HydrophobicContact CB-CB 4.29Å; V167-R189 HydrophobicContact CG2-CB 3.85Å; V167-R189 PolarHBondContact N-O 3.49Å; V167-T191 HydrophobicContact CG2-CG2 4.09Å
168P90.1Very high87.6Confident65 Ų6565.9 Ų65.942%0.42234%0.338SS..  trans-57.9140.9179.8-26.134.7000112.3A127 A128 F166A127-P168 HydrophobicContact CB-CG 4.39Å; A128-P168 HydrophobicContact CB-CG 4.38Å; F166-P168 VanDerWaalsContact O-CD 3.24Å; F166-P168 WeakPolarHBondContact O-CD 3.18Å
169S81.9Confident87.2Confident50 Ų5067 Ų6735%0.3534%0.343SS..  trans-105.9137.3170.2-175.20000109.5I171S169-I171 PolarHBondContact O-N 2.77Å; S169-I171 PolarHBondContact OG-N 3.45Å; S169-I171 PolarHBondContact OG-O 3.35Å
170A73.2Confident86.6Confident103 Ų10369.8 Ų69.885%0.85136%0.361SS*.SBendtrans-68.9-16.8170.400000112
171I74Confident86.1Confident97 Ų9772.5 Ų72.550%0.49737%0.374SS..  trans-98.2116.8-176.9-54.1176.5000108.6S169 F173S169-I171 PolarHBondContact O-N 2.77Å; S169-I171 PolarHBondContact OG-N 3.45Å; S169-I171 PolarHBondContact OG-O 3.35Å; I171-F173 VanDerWaalsContact C-N 3.28Å; I171-F173 VanDerWaalsContact CG2-O 3.27Å; I171-F173 WeakPolarHBondContact CG2-O 3.43Å; I171-F173 PolarHBondContact O-N 2.83Å
172H70.2Confident85.9Confident151 Ų15176.6 Ų76.670%0.69939%0.386SS*.SBendtrans-68.2-24.3179.7-98.466.8000113.8T250H172-T250 PolarHBondContact O-OG1 3.07Å
173F75.7Confident86.2Confident137 Ų13773 Ų7360%0.60138%0.379SS*.EExtended strand (participates in β ladder)trans-141103.4177.8-66.1-79.9000109.8I171 K251I171-F173 VanDerWaalsContact C-N 3.28Å; I171-F173 VanDerWaalsContact CG2-O 3.27Å; I171-F173 WeakPolarHBondContact CG2-O 3.43Å; I171-F173 PolarHBondContact O-N 2.83Å; F173-K251 HydrophobicContact CD1-CB 4.36Å; F173-K251 HydrophobicContact CE1-CB 4.35Å; F173-K251 HydrophobicContact CE1-CD 4.4Å
174E86.2Confident86.4Confident59 Ų5966 Ų6628%0.27635%0.348SS..EExtended strand (participates in β ladder)trans-96.5133179.4-176.2169.8-175.300110.3P187 Y252 Q253E174-P187 VanDerWaalsContact CD-CG 3.44Å; E174-P187 HydrophobicContact CG-CG 4.4Å; E174-P187 WeakPolarHBondContact OE1-CG 3.32Å; E174-P187 WeakPolarHBondContact OE2-CG 3.39Å; E174-Y252 HydrophobicContact CB-CD1 3.92Å; E174-Y252 HydrophobicContact CB-CE1 4.22Å; E174-Y252 HydrophobicContact CG-CD1 4.43Å; E174-Y252 CarbonylContact O-C 3.56Å; E174-Y252 WeakPolarHBondContact O-CA 3.14Å; E174-Q253 PolarHBondContact O-N 3.49Å
175I90.2Very high86.6Confident88 Ų8865.8 Ų65.845%0.45135%0.349SS..EExtended strand (participates in β ladder)trans-94.4127.8-177.3-61.5174.8000109.2Y177 Q253 L255I175-Y177 HydrophobicContact CG2-CD2 4.47Å; I175-Y177 HydrophobicContact CG2-CE1 4.19Å; I175-Y177 HydrophobicContact CG2-CE2 4.08Å; I175-Q253 WeakPolarHBondContact CA-O 3Å; I175-Q253 HydrophobicContact CG1-CB 4.47Å; I175-L255 HydrophobicContact CG2-CD1 3.68Å; I175-L255 HydrophobicContact CG2-CG 4.11Å
176V91.8Very high86.7Confident12 Ų1265.6 Ų65.67%0.07335%0.348CS..EExtended strand (participates in β ladder)trans-113.5115.8175-178.60000108.9L178 A184 V185 Q253 L254 L255V176-L178 HydrophobicContact CG1-CD2 4.34Å; V176-A184 HydrophobicContact CG1-CB 4.14Å; V176-V185 WeakPolarHBondContact CG1-O 3.48Å; V176-Q253 PolarHBondContact N-O 3.34Å; V176-L254 HydrophobicContact CB-CD1 3.91Å; V176-L254 HydrophobicContact CB-CG 4.08Å; V176-L254 HydrophobicContact CG1-CG 4.4Å; V176-L254 HydrophobicContact CG2-CD1 4.18Å; V176-L254 WeakPolarHBondContact O-CA 3.26Å; V176-L255 PolarHBondContact O-N 2.95Å
177Y91.1Very high86.7Confident131 Ų13166.5 Ų66.551%0.51436%0.355SS..EExtended strand (participates in β ladder)trans-81.3120.6175.6-65.9-75.2000110.7I175 L255 V257I175-Y177 HydrophobicContact CG2-CD2 4.47Å; I175-Y177 HydrophobicContact CG2-CE1 4.19Å; I175-Y177 HydrophobicContact CG2-CE2 4.08Å; Y177-L255 WeakPolarHBondContact CA-O 3.11Å; Y177-L255 HydrophobicContact CD1-CB 4.29Å; Y177-L255 HydrophobicContact CE1-CD1 4.23Å; Y177-V257 HydrophobicContact CD1-CG2 3.67Å; Y177-V257 HydrophobicContact CE1-CG2 4.27Å
178L90.9Very high86.7Confident0 Ų065.8 Ų65.80%035%0.351CS..EExtended strand (participates in β ladder)trans-90.1127.1171.6-54-175.6000108.6V176 A184 L225 P228 L232 L254 L255 Y256 V257V176-L178 HydrophobicContact CG1-CD2 4.34Å; L178-A184 HydrophobicContact CD2-CB 3.53Å; L178-L225 HydrophobicContact CD2-CD1 3.81Å; L178-P228 HydrophobicContact CB-CB 4.01Å; L178-P228 HydrophobicContact CB-CG 4.47Å; L178-P228 HydrophobicContact CD1-CB 4.45Å; L178-P228 HydrophobicContact CD2-CB 3.86Å; L178-P228 HydrophobicContact CG-CB 4.32Å; L178-L232 HydrophobicContact CD1-CB 3.73Å; L178-L254 HydrophobicContact CD1-CB 4.02Å; L178-L254 HydrophobicContact CD1-CD2 4.2Å; L178-L254 HydrophobicContact CD1-CG 4.39Å; L178-L254 HydrophobicContact CD2-CB 4.43Å; L178-L254 HydrophobicContact CD2-CD2 3.95Å; L178-L254 HydrophobicContact CD2-CG 4.01Å; L178-L254 HydrophobicContact CG-CB 4.17Å; L178-L254 HydrophobicContact CG-CD2 4.45Å; L178-L254 HydrophobicContact CG-CG 4.31Å; L178-L255 PolarHBondContact N-O 3.43Å; L178-Y256 HydrophobicContact CB-CD2 4.04Å; L178-V257 PolarHBondContact O-N 3.3Å
179R87.5Confident86.9Confident32 Ų3266 Ų6612%0.12134%0.343CS..BIsolated β-bridgetrans-132.9140.2174.4-72.2171.744.7152.99.7109.6D181 R182 P228 V257 V259R179-D181 WeakPolarHBondContact CB-OD1 3.23Å; R179-D181 IonicContact CZ-OD1 3.09Å; R179-D181 IonicContact CZ-OD2 2.81Å; R179-D181 IonicContact NE-OD1 3.26Å; R179-D181 PolarHBondContact NE-OD1 2.81Å; R179-D181 IonicContact NE-OD2 3.43Å; R179-D181 IonicContact NH2-OD1 3.88Å; R179-D181 PolarHBondContact NH2-OD1 2.91Å; R179-D181 IonicContact NH2-OD2 2.75Å; R179-D181 PolarHBondContact NH2-OD2 2.82Å; R179-D181 PolarHBondContact O-N 2.8Å; R179-R182 HydrophobicContact CB-CG 4.08Å; R179-R182 PolarHBondContact O-N 3.03Å; R179-P228 WeakPolarHBondContact O-CG 3.39Å; R179-V257 HydrophobicContact CG-CB 4.46Å; R179-V259 HydrophobicContact CB-CG2 3.85Å; R179-V259 HydrophobicContact CG-CG2 3.57Å; R179-V259 VanDerWaalsContact CZ-CG2 3.4Å
180P83.8Confident87.6Confident61 Ų6163.7 Ų63.740%0.39633%0.327SS..THydrogen-bonded Turntrans-68.1-19.9-176.128.2-35.7000113.5
181D81.9Confident88.6Confident92 Ų9258.8 Ų58.849%0.49229%0.286SS..THydrogen-bonded Turntrans-90.2-8.9-174.967.6-38000114.1R179R179-D181 WeakPolarHBondContact CB-OD1 3.23Å; R179-D181 IonicContact CZ-OD1 3.09Å; R179-D181 IonicContact CZ-OD2 2.81Å; R179-D181 IonicContact NE-OD1 3.26Å; R179-D181 PolarHBondContact NE-OD1 2.81Å; R179-D181 IonicContact NE-OD2 3.43Å; R179-D181 IonicContact NH2-OD1 3.88Å; R179-D181 PolarHBondContact NH2-OD1 2.91Å; R179-D181 IonicContact NH2-OD2 2.75Å; R179-D181 PolarHBondContact NH2-OD2 2.82Å; R179-D181 PolarHBondContact O-N 2.8Å
182R86.8Confident89.5Confident124 Ų12457.5 Ų57.547%0.46828%0.278SS..BIsolated β-bridgetrans-149.9152.7-176.665.7-178.5-172.5-169.8-0.3113.3R179R179-R182 HydrophobicContact CB-CG 4.08Å; R179-R182 PolarHBondContact O-N 3.03Å
183P91.9Very high90.6Very high82 Ų8252 Ų5253%0.53226%0.256SS..  trans-64.2147.8174.728-35.9000111.5I224 L225P183-I224 HydrophobicContact CB-CG2 4.3Å; P183-L225 CarbonylContact C-O 3.6Å; P183-L225 WeakPolarHBondContact CA-O 3.24Å; P183-L225 WeakPolarHBondContact CB-O 3.49Å
184A93Very high91.2Very high7 Ų753.5 Ų53.56%0.05827%0.265CS..EExtended strand (participates in β ladder)trans-109.4152.217100000110.5V176 L178 L225 P228V176-A184 HydrophobicContact CG1-CB 4.14Å; L178-A184 HydrophobicContact CD2-CB 3.53Å; A184-L225 HydrophobicContact CB-CB 4.31Å; A184-L225 HydrophobicContact CB-CD1 4.36Å; A184-L225 PolarHBondContact N-O 2.87Å; A184-L225 PolarHBondContact O-N 2.01Å; A184-P228 HydrophobicContact CB-CB 4.42Å; A184-P228 HydrophobicContact CB-CG 4.33Å
185V95.1Very high91.5Very high57 Ų5751.2 Ų51.235%0.34526%0.255SS..EExtended strand (participates in β ladder)trans-123.8125.7178.8-176.20000109.3V176 P187 K221 F223 I224V176-V185 WeakPolarHBondContact CG1-O 3.48Å; V185-P187 WeakPolarHBondContact O-CD 3.27Å; V185-K221 HydrophobicContact CG1-CB 4.23Å; V185-F223 CarbonylContact C-O 3.59Å; V185-F223 VanDerWaalsContact CA-O 3.32Å; V185-F223 WeakPolarHBondContact CA-O 3.4Å; V185-I224 HydrophobicContact CG2-CG1 4.22Å
186V95.4Very high91.5Very high0 Ų055.2 Ų55.20%027%0.271CS..EExtended strand (participates in β ladder)trans-88108167-176.80000107.4C188 L199 G222 F223 L225 Y252 L254V186-C188 PolarHBondContact O-N 3.02Å; V186-L199 HydrophobicContact CB-CD1 4.46Å; V186-L199 HydrophobicContact CG1-CD1 4.06Å; V186-L199 HydrophobicContact CG2-CD1 4.4Å; V186-L199 HydrophobicContact CG2-CD2 4.4Å; V186-G222 WeakPolarHBondContact O-CA 3.42Å; V186-F223 HydrophobicContact CB-CB 4.25Å; V186-F223 PolarHBondContact N-O 2.86Å; V186-F223 PolarHBondContact O-N 2.88Å; V186-L225 HydrophobicContact CG2-CD1 4.24Å; V186-Y252 HydrophobicContact CG1-CD1 4.3Å; V186-Y252 HydrophobicContact CG1-CD2 3.39Å; V186-Y252 HydrophobicContact CG1-CE2 3.8Å; V186-Y252 HydrophobicContact CG1-CG 3.68Å; V186-L254 HydrophobicContact CG2-CD1 4.19Å; V186-L254 HydrophobicContact CG2-CD2 4.26Å
187P94.9Very high91.6Very high33 Ų3355.7 Ų55.721%0.21428%0.277CS..  trans-81.938.7-16032.6-35.2000115.1E174 V185 R189 K221 Y252E174-P187 VanDerWaalsContact CD-CG 3.44Å; E174-P187 HydrophobicContact CG-CG 4.4Å; E174-P187 WeakPolarHBondContact OE1-CG 3.32Å; E174-P187 WeakPolarHBondContact OE2-CG 3.39Å; V185-P187 WeakPolarHBondContact O-CD 3.27Å; P187-R189 PolarHBondContact O-N 2.85Å; P187-K221 WeakPolarHBondContact CA-O 3.35Å; P187-Y252 HydrophobicContact CG-CD1 4.15Å; P187-Y252 HydrophobicContact CG-CE1 3.73Å
188C94.9Very high91.7Very high1 Ų150.5 Ų50.51%0.00726%0.26CS..  trans-8068.6177.262.50000112.3F166 V186 F223 C238 Y252F166-C188 HydrophobicContact CD1-CB 4.12Å; F166-C188 HydrophobicContact CE1-CB 4.21Å; V186-C188 PolarHBondContact O-N 3.02Å; C188-F223 VanDerWaalsContact SG-CD2 3.58Å; C188-C238 HydrophobicContact CB-CB 3.46Å; C188-C238 VanDerWaalsContact CB-CB 3.46Å; C188-C238 WeakPolarHBondContact CB-SG 3.42Å; C188-C238 WeakPolarHBondContact SG-CB 3.46Å; C188-C238 CovalentContact SG-SG 2.01Å; C188-C238 PolarHBondContact SG-SG 3.04Å; C188-Y252 WeakPolarHBondContact CA-OH 3.48Å; C188-Y252 HydrophobicContact CB-CE2 3.87Å; C188-Y252 WeakPolarHBondContact CB-OH 3.36Å
189R95.3Very high91.9Very high70 Ų7050.6 Ų50.626%0.26426%0.26SS..  trans-63.1145.6176.4-58.8-179.6-66.5134.1-0.9110.5T130 Y156 F166 V167 P187 T220T130-R189 PolarHBondContact O-NH1 3.16Å; Y156-R189 PolarHBondContact OH-NH1 2.81Å; F166-R189 CarbonylContact C-O 3.58Å; F166-R189 WeakPolarHBondContact CA-O 3.45Å; V167-R189 HydrophobicContact CB-CB 4.29Å; V167-R189 HydrophobicContact CG2-CB 3.85Å; V167-R189 PolarHBondContact N-O 3.49Å; P187-R189 PolarHBondContact O-N 2.85Å; R189-T220 WeakPolarHBondContact CD-O 3.43Å; R189-T220 WeakPolarHBondContact CG-O 3.48Å
190V95.6Very high92.3Very high0 Ų050.1 Ų50.10%026%0.259CS..BIsolated β-bridgetrans-104.5152.7-179.8-65.40000111.7L165 F166 E192 V195 F217 P219L165-V190 CarbonylContact O-C 3.6Å; L165-V190 VanDerWaalsContact O-CA 3.27Å; L165-V190 WeakPolarHBondContact O-CA 3.33Å; L165-V190 WeakPolarHBondContact O-CB 3.47Å; F166-V190 HydrophobicContact CD1-CG1 3.89Å; F166-V190 HydrophobicContact CE1-CG1 3.85Å; V190-E192 WeakPolarHBondContact CG2-O 3.35Å; V190-V195 HydrophobicContact CB-CG1 3.64Å; V190-V195 HydrophobicContact CG1-CG1 3.55Å; V190-V195 HydrophobicContact CG2-CG1 3.9Å; V190-F217 HydrophobicContact CG1-CZ 3.86Å; V190-F217 HydrophobicContact CG2-CZ 4.15Å; V190-P219 HydrophobicContact CG2-CB 3.62Å; V190-P219 PolarHBondContact N-O 3.19Å
191T95.3Very high92.8Very high0 Ų048.8 Ų48.80%025%0.246CC..SBendtrans-87.4-13.6176.559.40000112.7A127 Y158 T160 N164 L165 V167A127-T191 HydrophobicContact CB-CG2 3.79Å; Y158-T191 WeakPolarHBondContact CB-O 3.46Å; T160-T191 WeakPolarHBondContact CA-O 3.17Å; T160-T191 WeakPolarHBondContact CG2-O 3.41Å; N164-T191 VanDerWaalsContact O-CG2 3.23Å; N164-T191 WeakPolarHBondContact O-CG2 3.32Å; N164-T191 PolarHBondContact O-OG1 3.33Å; L165-T191 PolarHBondContact O-N 3.36Å; L165-T191 PolarHBondContact O-OG1 3.23Å; V167-T191 HydrophobicContact CG2-CG2 4.09Å
192E92.7Very high93.4Very high71 Ų7147.8 Ų47.833%0.33224%0.239SC..SBendtrans-126121.3177.7-177.6155.6-121.600110.6T160 V190 Q194 V195T160-E192 HydrophobicContact CG2-CB 4.04Å; T160-E192 HydrophobicContact CG2-CG 4.27Å; V190-E192 WeakPolarHBondContact CG2-O 3.35Å; E192-Q194 VanDerWaalsContact C-N 3.26Å; E192-Q194 PolarHBondContact O-N 2.83Å; E192-V195 HydrophobicContact CB-CB 4.43Å; E192-V195 VanDerWaalsContact O-CG1 3.26Å; E192-V195 WeakPolarHBondContact O-CG1 3.02Å; E192-V195 PolarHBondContact O-N 3.49Å
193P92.3Very high93.6Very high35 Ų3547.2 Ų47.223%0.22725%0.249CC..THydrogen-bonded Turntrans-69.7-19-171.125.3-34.5000114.7Y158Y158-P193 HydrophobicContact CD2-CB 4.39Å; Y158-P193 HydrophobicContact CD2-CG 4.24Å; Y158-P193 HydrophobicContact CE1-CB 4.17Å; Y158-P193 HydrophobicContact CE2-CB 3.92Å; Y158-P193 HydrophobicContact CE2-CG 4.25Å; Y158-P193 HydrophobicContact CG-CG 4.48Å
194Q89.9Confident93.6Very high168 Ų16846.8 Ų46.879%0.78525%0.246SC*.THydrogen-bonded Turntrans-98.54-177.9-58.4-58.1-66.200112.6E192E192-Q194 VanDerWaalsContact C-N 3.26Å; E192-Q194 PolarHBondContact O-N 2.83Å
195V91Very high93.7Very high11 Ų1151.8 Ų51.87%0.06728%0.278CS..  trans-74.2133.8179.279.40000110L165 V190 E192 A240 A241L165-V195 HydrophobicContact CD1-CG2 4.47Å; V190-V195 HydrophobicContact CB-CG1 3.64Å; V190-V195 HydrophobicContact CG1-CG1 3.55Å; V190-V195 HydrophobicContact CG2-CG1 3.9Å; E192-V195 HydrophobicContact CB-CB 4.43Å; E192-V195 VanDerWaalsContact O-CG1 3.26Å; E192-V195 WeakPolarHBondContact O-CG1 3.02Å; E192-V195 PolarHBondContact O-N 3.49Å; V195-A240 HydrophobicContact CG1-CB 4.49Å; V195-A240 HydrophobicContact CG2-CB 3.98Å; V195-A241 WeakPolarHBondContact CG2-O 3.4Å
196E90.1Very high93.5Very high172 Ų17253.6 Ų53.680%0.80428%0.282SS*.  trans-80.2126.6171.3-66.9-176.5172.100109.3A240E196-A240 WeakPolarHBondContact O-CA 3.49Å
197A93.4Very high93.4Very high22 Ų2258.3 Ų58.318%0.18231%0.305CS..EExtended strand (participates in β ladder)trans-120.1152.3177.200000110.2F217 F223 K239 A240A197-F217 HydrophobicContact CB-CD1 4.48Å; A197-F217 HydrophobicContact CB-CD2 4.31Å; A197-F217 HydrophobicContact CB-CE1 3.94Å; A197-F217 HydrophobicContact CB-CE2 3.77Å; A197-F217 HydrophobicContact CB-CZ 3.56Å; A197-F223 HydrophobicContact CB-CE2 4.13Å; A197-F223 HydrophobicContact CB-CZ 4.12Å; A197-F223 WeakPolarHBondContact O-CZ 3.19Å; A197-K239 CarbonylContact C-O 3.58Å; A197-K239 WeakPolarHBondContact CA-O 2.93Å; A197-A240 HydrophobicContact CB-CB 4.26Å
198S94.4Very high93.2Very high23 Ų2357.5 Ų57.516%0.16130%0.298CS..EExtended strand (participates in β ladder)trans-132.4151.3174.548.30000109.9H200 E207 F223 C238 K239S198-H200 WeakPolarHBondContact CB-NE2 3.35Å; S198-H200 PolarHBondContact OG-CD2 3.33Å; S198-H200 PolarHBondContact OG-NE2 3.35Å; S198-E207 WeakPolarHBondContact CB-OE1 3.46Å; S198-F223 VanDerWaalsContact C-CZ 3.45Å; S198-C238 CarbonylContact O-C 3.48Å; S198-C238 VanDerWaalsContact O-CA 3.32Å; S198-C238 WeakPolarHBondContact O-CA 3.41Å; S198-K239 PolarHBondContact N-O 2.65Å; S198-K239 PolarHBondContact O-N 3.02Å; S198-K239 PolarHBondContact OG-O 3.11Å
199L95.3Very high92.6Very high2 Ų261.2 Ų61.21%0.0132%0.321CS..EExtended strand (participates in β ladder)trans-103127.9177.7-178.864.8000109.3V186 I208 L215 F223 L225 F236V186-L199 HydrophobicContact CB-CD1 4.46Å; V186-L199 HydrophobicContact CG1-CD1 4.06Å; V186-L199 HydrophobicContact CG2-CD1 4.4Å; V186-L199 HydrophobicContact CG2-CD2 4.4Å; L199-I208 HydrophobicContact CB-CB 4.43Å; L199-I208 HydrophobicContact CD2-CB 4.32Å; L199-I208 HydrophobicContact CD2-CG1 4.4Å; L199-I208 HydrophobicContact CG-CB 4.4Å; L199-I208 HydrophobicContact CG-CG1 4.33Å; L199-I208 PolarHBondContact O-N 2.94Å; L199-L215 HydrophobicContact CB-CD2 4.34Å; L199-L215 HydrophobicContact CD2-CD1 3.93Å; L199-F223 HydrophobicContact CB-CD1 4.18Å; L199-F223 HydrophobicContact CB-CD2 3.85Å; L199-F223 HydrophobicContact CB-CE1 4.24Å; L199-F223 HydrophobicContact CB-CE2 3.95Å; L199-F223 HydrophobicContact CB-CG 3.97Å; L199-F223 HydrophobicContact CB-CZ 4.15Å; L199-F223 HydrophobicContact CD1-CD2 4.25Å; L199-F223 HydrophobicContact CD2-CB 4.22Å; L199-F223 HydrophobicContact CD2-CG 4.38Å; L199-F223 HydrophobicContact CG-CD2 4.5Å; L199-L225 HydrophobicContact CD2-CD2 4.45Å; L199-F236 HydrophobicContact CD1-CB 4.14Å; L199-F236 HydrophobicContact CD1-CD1 4.32Å; L199-F236 HydrophobicContact CD2-CD1 4.42Å; L199-F236 HydrophobicContact CG-CD1 4.19Å
200H95.1Very high91.3Very high21 Ų2160.4 Ų60.410%0.09733%0.33CS..EExtended strand (participates in β ladder)trans-123.4143.8-176.6-67.4-97.4000110.7S198 E206 E207 F236 Y237S198-H200 WeakPolarHBondContact CB-NE2 3.35Å; S198-H200 PolarHBondContact OG-CD2 3.33Å; S198-H200 PolarHBondContact OG-NE2 3.35Å; H200-E206 CarbonylContact C-O 3.55Å; H200-E206 WeakPolarHBondContact CA-O 3.33Å; H200-E207 IonicContact CE1-OE2 3.21Å; H200-E207 PolarHBondContact CE1-OE2 2.79Å; H200-E207 IonicContact NE2-OE2 2.99Å; H200-F236 CarbonylContact O-C 3.59Å; H200-F236 WeakPolarHBondContact O-CA 3.32Å; H200-F236 WeakPolarHBondContact O-CB 3.39Å; H200-F236 WeakPolarHBondContact O-CD1 3.28Å; H200-Y237 HydrophobicContact CB-CD1 4.31Å; H200-Y237 HydrophobicContact CB-CD2 4.07Å; H200-Y237 HydrophobicContact CB-CE1 3.83Å; H200-Y237 HydrophobicContact CB-CE2 3.57Å; H200-Y237 HydrophobicContact CB-CG 4.42Å; H200-Y237 VanDerWaalsContact CB-CZ 3.42Å; H200-Y237 PolarHBondContact N-O 2.88Å; H200-Y237 PolarHBondContact O-N 2.88Å
201R94.6Very high89.7Confident34 Ų3467.6 Ų67.613%0.12837%0.368CS..EExtended strand (participates in β ladder)trans-94.4141170.1-178.2166.559.2-174-3.3109.6V203 P204 P205 E206 I208 D231 F236R201-V203 WeakPolarHBondContact CD-O 3.42Å; R201-V203 WeakPolarHBondContact CG-O 3.39Å; R201-P204 WeakPolarHBondContact CG-O 3.24Å; R201-P204 PolarHBondContact NE-O 2.89Å; R201-P205 WeakPolarHBondContact O-CA 3.2Å; R201-E206 IonicContact CZ-OE2 3.97Å; R201-E206 PolarHBondContact N-O 2.89Å; R201-E206 IonicContact NH2-OE2 2.68Å; R201-E206 PolarHBondContact NH2-OE2 2.85Å; R201-E206 PolarHBondContact O-N 3.02Å; R201-I208 HydrophobicContact CB-CD1 4.27Å; R201-D231 PolarHBondContact NH1-O 2.83Å; R201-F236 HydrophobicContact CB-CD1 4.03Å; R201-F236 HydrophobicContact CB-CE1 3.7Å; R201-F236 HydrophobicContact CB-CZ 4.16Å; R201-F236 HydrophobicContact CG-CE1 4.11Å; R201-F236 HydrophobicContact CG-CE2 4.46Å; R201-F236 HydrophobicContact CG-CZ 4.04Å
202E94.3Very high87.8Confident70 Ų7075.2 Ų75.233%0.32740%0.404SS..THydrogen-bonded Turntrans-78.9-40.5177.5-170.7169.3178.300112P205 V235 Y237 K251E202-P205 WeakPolarHBondContact O-CG 3.45Å; E202-V235 HydrophobicContact CB-CB 4.14Å; E202-V235 HydrophobicContact CB-CG1 4.4Å; E202-V235 PolarHBondContact N-O 3.32Å; E202-V235 VanDerWaalsContact OE2-CG1 3.27Å; E202-V235 WeakPolarHBondContact OE2-CG1 3.22Å; E202-Y237 HydrophobicContact CB-CE1 4.46Å; E202-K251 IonicContact OE1-NZ 3.96Å; E202-K251 PolarHBondContact OE1-NZ 2.96Å; E202-K251 WeakPolarHBondContact OE2-CD 3.47Å; E202-K251 WeakPolarHBondContact OE2-CE 3.15Å; E202-K251 IonicContact OE2-NZ 2.66Å; E202-K251 PolarHBondContact OE2-NZ 3.32Å
203V92.1Very high86.3Confident112 Ų11272 Ų7268%0.67939%0.389SS*.THydrogen-bonded Turntrans-141.1120.8-177.7-172.70000111.1R201R201-V203 WeakPolarHBondContact CD-O 3.42Å; R201-V203 WeakPolarHBondContact CG-O 3.39Å
204P92.1Very high85.6Confident74 Ų7475.6 Ų75.648%0.48141%0.405SS..THydrogen-bonded Turncis-63148.6-18.929-34.9000111R201 E206R201-P204 WeakPolarHBondContact CG-O 3.24Å; R201-P204 PolarHBondContact NE-O 2.89Å; P204-E206 PolarHBondContact O-N 2.77Å; P204-E206 VanDerWaalsContact O-N 3.12Å
205P93.8Very high85.6Confident112 Ų11268.8 Ų68.873%0.72737%0.374SS*.THydrogen-bonded Turntrans-59.7114.3178.3-22.632.2000111.5R201 E202R201-P205 WeakPolarHBondContact O-CA 3.2Å; E202-P205 WeakPolarHBondContact O-CG 3.45Å
206E92.3Very high85.7Confident94 Ų9470.6 Ų70.644%0.43939%0.385SS..EExtended strand (participates in β ladder)trans-156.7143-177.6-173.1176.5177.100111.1H200 R201 P204H200-E206 CarbonylContact C-O 3.55Å; H200-E206 WeakPolarHBondContact CA-O 3.33Å; R201-E206 IonicContact CZ-OE2 3.97Å; R201-E206 PolarHBondContact N-O 2.89Å; R201-E206 IonicContact NH2-OE2 2.68Å; R201-E206 PolarHBondContact NH2-OE2 2.85Å; R201-E206 PolarHBondContact O-N 3.02Å; P204-E206 PolarHBondContact O-N 2.77Å; P204-E206 VanDerWaalsContact O-N 3.12Å
207E92.4Very high85.8Confident100 Ų10065.1 Ų65.147%0.46736%0.359SS..EExtended strand (participates in β ladder)trans-83.8124.5167.8-173.9171.2160.200110.1S198 H200 T209S198-E207 WeakPolarHBondContact CB-OE1 3.46Å; H200-E207 IonicContact CE1-OE2 3.21Å; H200-E207 PolarHBondContact CE1-OE2 2.79Å; H200-E207 IonicContact NE2-OE2 2.99Å; E207-T209 PolarHBondContact O-N 3.05Å
208I90.6Very high85.9Confident16 Ų1666 Ų668%0.08236%0.36CS..EExtended strand (participates in β ladder)trans-80.6115.3179.5-51.5-54.7000108.9L199 R201 L215 L232 F236L199-I208 HydrophobicContact CB-CB 4.43Å; L199-I208 HydrophobicContact CD2-CB 4.32Å; L199-I208 HydrophobicContact CD2-CG1 4.4Å; L199-I208 HydrophobicContact CG-CB 4.4Å; L199-I208 HydrophobicContact CG-CG1 4.33Å; L199-I208 PolarHBondContact O-N 2.94Å; R201-I208 HydrophobicContact CB-CD1 4.27Å; I208-L215 HydrophobicContact CB-CD2 4.46Å; I208-L215 HydrophobicContact CG2-CD2 4.25Å; I208-L215 WeakPolarHBondContact O-CD2 3.33Å; I208-L232 HydrophobicContact CD1-CD2 4.4Å; I208-L232 HydrophobicContact CG2-CD2 4.42Å; I208-F236 HydrophobicContact CD1-CE1 3.92Å; I208-F236 HydrophobicContact CG1-CD1 4.17Å; I208-F236 HydrophobicContact CG1-CE1 3.71Å
209T82Confident85.9Confident78 Ų7866.3 Ų66.348%0.47936%0.362SS..  trans-103.7161.818061.70000111.9E207 N211E207-T209 PolarHBondContact O-N 3.05Å; T209-N211 PolarHBondContact O-N 3.41Å
210A67.5Low85.9Confident54 Ų5468 Ų6845%0.44637%0.373SS..Hα-helixtrans-63.9-11-171.400000115.7Q212A210-Q212 PolarHBondContact O-N 3.48Å
211N61.7Low85.9Confident151 Ų15172.4 Ų72.481%0.80739%0.392SS*.Hα-helixtrans-74.7-17.4-166-67.5-16000114.8T209T209-N211 PolarHBondContact O-N 3.41Å
212Q57.3Low85.9Confident160 Ų16070.8 Ų70.875%0.74839%0.386SS*.Hα-helixtrans-118.3-28.1-176.8-64.71795.400114.1A210A210-Q212 PolarHBondContact O-N 3.48Å
213T60.9Low86Confident3 Ų367.9 Ų67.92%0.01837%0.372CS..Hα-helixtrans-119.64.2-16852.50000114.1L215 L232T213-L215 PolarHBondContact O-N 2.75Å; T213-L232 HydrophobicContact CG2-CD1 3.39Å; T213-L232 HydrophobicContact CG2-CD2 4.08Å; T213-L232 HydrophobicContact CG2-CG 3.99Å
214L77.6Confident86.1Confident110 Ų11064.1 Ų64.158%0.57635%0.348SS*.  trans48.742.9-172.9-63.9172000111.6T216 R226L214-T216 PolarHBondContact O-N 2.88Å; L214-T216 PolarHBondContact O-OG1 3.22Å; L214-R226 HydrophobicContact CB-CB 4.03Å; L214-R226 HydrophobicContact CB-CG 4.43Å
215L89.5Confident86.2Confident25 Ų2560.6 Ų60.613%0.13133%0.325CS..  trans-58.6124.8-178.5-173.370.7000110.5L199 I208 T213 F223 L225L199-L215 HydrophobicContact CB-CD2 4.34Å; L199-L215 HydrophobicContact CD2-CD1 3.93Å; I208-L215 HydrophobicContact CB-CD2 4.46Å; I208-L215 HydrophobicContact CG2-CD2 4.25Å; I208-L215 WeakPolarHBondContact O-CD2 3.33Å; T213-L215 PolarHBondContact O-N 2.75Å; L215-F223 HydrophobicContact CD1-CB 3.92Å; L215-F223 HydrophobicContact CD1-CD1 3.69Å; L215-F223 HydrophobicContact CD1-CG 4.17Å; L215-F223 HydrophobicContact CD2-CD1 3.87Å; L215-F223 HydrophobicContact CD2-CE1 4.07Å; L215-F223 HydrophobicContact CG-CD1 3.74Å; L215-F223 HydrophobicContact CG-CE1 4.34Å; L215-L225 HydrophobicContact CD1-CD2 3.54Å; L215-L225 HydrophobicContact CD1-CG 4.45Å
216T92.3Very high86Confident49 Ų4962.6 Ų62.630%0.30132%0.318SS..EExtended strand (participates in β ladder)trans-123.3137.9173.1-48.20000109.4L214 I224 R226L214-T216 PolarHBondContact O-N 2.88Å; L214-T216 PolarHBondContact O-OG1 3.22Å; T216-I224 PolarHBondContact N-O 2.91Å; T216-I224 PolarHBondContact O-N 3.28Å; T216-R226 PolarHBondContact OG1-NE 2.85Å; T216-R226 PolarHBondContact OG1-NH2 2.83Å
217F93.3Very high85.8Confident57 Ų5762.6 Ų62.625%0.2532%0.321CS..EExtended strand (participates in β ladder)trans-99.2128.3173.4-178.3-117.8000110.9V190 A197 P219 F223V190-F217 HydrophobicContact CG1-CZ 3.86Å; V190-F217 HydrophobicContact CG2-CZ 4.15Å; A197-F217 HydrophobicContact CB-CD1 4.48Å; A197-F217 HydrophobicContact CB-CD2 4.31Å; A197-F217 HydrophobicContact CB-CE1 3.94Å; A197-F217 HydrophobicContact CB-CE2 3.77Å; A197-F217 HydrophobicContact CB-CZ 3.56Å; F217-P219 HydrophobicContact CD1-CG 4.41Å; F217-P219 HydrophobicContact CE1-CB 4.43Å; F217-P219 HydrophobicContact CE1-CG 3.95Å; F217-F223 HydrophobicContact CB-CD1 4.02Å; F217-F223 HydrophobicContact CB-CE1 3.73Å; F217-F223 HydrophobicContact CB-CZ 4.27Å; F217-F223 HydrophobicContact CD2-CD1 4.04Å; F217-F223 AromaticContact CD2-CD2 3.95Å; F217-F223 HydrophobicContact CD2-CD2 3.95Å; F217-F223 AromaticContact CD2-CE1 3.86Å; F217-F223 HydrophobicContact CD2-CE1 3.86Å; F217-F223 AromaticContact CD2-CE2 3.74Å; F217-F223 HydrophobicContact CD2-CE2 3.74Å; F217-F223 HydrophobicContact CD2-CG 4.09Å; F217-F223 AromaticContact CD2-CZ 3.68Å; F217-F223 HydrophobicContact CD2-CZ 3.68Å; F217-F223 HydrophobicContact CE2-CD2 4.39Å; F217-F223 HydrophobicContact CE2-CE2 4.08Å; F217-F223 HydrophobicContact CE2-CZ 4.34Å; F217-F223 HydrophobicContact CG-CD1 4.48Å; F217-F223 HydrophobicContact CG-CE1 4.08Å; F217-F223 HydrophobicContact CG-CZ 4.13Å
218D94.9Very high85.6Confident40 Ų4058 Ų5821%0.21430%0.299CS..EExtended strand (participates in β ladder)trans-119.6113.6171.2178.9-20.7000108.2T220 K221 G222 I224D218-T220 PolarHBondContact O-N 3.35Å; D218-T220 WeakPolarHBondContact OD1-CB 3.35Å; D218-T220 PolarHBondContact OD1-N 3.43Å; D218-T220 PolarHBondContact OD1-OG1 3.4Å; D218-T220 PolarHBondContact OD2-OG1 3.01Å; D218-K221 HydrophobicContact CB-CB 4.15Å; D218-K221 PolarHBondContact O-N 3.45Å; D218-K221 WeakPolarHBondContact OD2-CD 3.2Å; D218-G222 PolarHBondContact N-O 2.9Å; D218-G222 WeakPolarHBondContact O-CA 3.31Å; D218-G222 PolarHBondContact O-N 2.93Å; D218-I224 HydrophobicContact CB-CD1 3.91Å
219P94.9Very high85.5Confident31 Ų3158.9 Ų58.920%0.20131%0.307CS..THydrogen-bonded Turntrans-54.5-26-178.6-28.535.7000114.7V190 F217V190-P219 HydrophobicContact CG2-CB 3.62Å; V190-P219 PolarHBondContact N-O 3.19Å; F217-P219 HydrophobicContact CD1-CG 4.41Å; F217-P219 HydrophobicContact CE1-CB 4.43Å; F217-P219 HydrophobicContact CE1-CG 3.95Å
220T95.5Very high85.8Confident38 Ų3857.7 Ų57.723%0.23331%0.305CS..THydrogen-bonded Turntrans-86.5-17.4-179.169.20000113.8Y156 Y158 R189 D218Y156-T220 HydrophobicContact CD1-CG2 3.85Å; Y156-T220 HydrophobicContact CD2-CG2 3.73Å; Y156-T220 HydrophobicContact CE1-CG2 4.05Å; Y156-T220 HydrophobicContact CE2-CG2 3.96Å; Y156-T220 HydrophobicContact CG-CG2 3.67Å; Y156-T220 PolarHBondContact OH-O 3.06Å; Y158-T220 WeakPolarHBondContact OH-CG2 3.34Å; R189-T220 WeakPolarHBondContact CD-O 3.43Å; R189-T220 WeakPolarHBondContact CG-O 3.48Å; D218-T220 PolarHBondContact O-N 3.35Å; D218-T220 WeakPolarHBondContact OD1-CB 3.35Å; D218-T220 PolarHBondContact OD1-N 3.43Å; D218-T220 PolarHBondContact OD1-OG1 3.4Å; D218-T220 PolarHBondContact OD2-OG1 3.01Å
221K94.9Very high86.9Confident113 Ų11359.2 Ų59.249%0.49131%0.306SS..THydrogen-bonded Turntrans-122.5-35.1-175.3-60.4-177.5-172.9174.90113.7V185 P187 D218 I224V185-K221 HydrophobicContact CG1-CB 4.23Å; P187-K221 WeakPolarHBondContact CA-O 3.35Å; D218-K221 HydrophobicContact CB-CB 4.15Å; D218-K221 PolarHBondContact O-N 3.45Å; D218-K221 WeakPolarHBondContact OD2-CD 3.2Å; K221-I224 HydrophobicContact CD-CD1 4.48Å
222G95.3Very high88.2Confident0 Ų052.2 Ų52.20%027%0.268CS..EExtended strand (participates in β ladder)trans109.7-150-170.900000112V186 D218V186-G222 WeakPolarHBondContact O-CA 3.42Å; D218-G222 PolarHBondContact N-O 2.9Å; D218-G222 WeakPolarHBondContact O-CA 3.31Å; D218-G222 PolarHBondContact O-N 2.93Å
223F95.2Very high89.9Confident9 Ų949.8 Ų49.84%0.03926%0.257CS..EExtended strand (participates in β ladder)trans-87.6126.8179.7-77.8-81.6000111.8V185 V186 C188 A197 S198 L199 L215 F217 C238V185-F223 CarbonylContact C-O 3.59Å; V185-F223 VanDerWaalsContact CA-O 3.32Å; V185-F223 WeakPolarHBondContact CA-O 3.4Å; V186-F223 HydrophobicContact CB-CB 4.25Å; V186-F223 PolarHBondContact N-O 2.86Å; V186-F223 PolarHBondContact O-N 2.88Å; C188-F223 VanDerWaalsContact SG-CD2 3.58Å; A197-F223 HydrophobicContact CB-CE2 4.13Å; A197-F223 HydrophobicContact CB-CZ 4.12Å; A197-F223 WeakPolarHBondContact O-CZ 3.19Å; S198-F223 VanDerWaalsContact C-CZ 3.45Å; L199-F223 HydrophobicContact CB-CD1 4.18Å; L199-F223 HydrophobicContact CB-CD2 3.85Å; L199-F223 HydrophobicContact CB-CE1 4.24Å; L199-F223 HydrophobicContact CB-CE2 3.95Å; L199-F223 HydrophobicContact CB-CG 3.97Å; L199-F223 HydrophobicContact CB-CZ 4.15Å; L199-F223 HydrophobicContact CD1-CD2 4.25Å; L199-F223 HydrophobicContact CD2-CB 4.22Å; L199-F223 HydrophobicContact CD2-CG 4.38Å; L199-F223 HydrophobicContact CG-CD2 4.5Å; L215-F223 HydrophobicContact CD1-CB 3.92Å; L215-F223 HydrophobicContact CD1-CD1 3.69Å; L215-F223 HydrophobicContact CD1-CG 4.17Å; L215-F223 HydrophobicContact CD2-CD1 3.87Å; L215-F223 HydrophobicContact CD2-CE1 4.07Å; L215-F223 HydrophobicContact CG-CD1 3.74Å; L215-F223 HydrophobicContact CG-CE1 4.34Å; F217-F223 HydrophobicContact CB-CD1 4.02Å; F217-F223 HydrophobicContact CB-CE1 3.73Å; F217-F223 HydrophobicContact CB-CZ 4.27Å; F217-F223 HydrophobicContact CD2-CD1 4.04Å; F217-F223 AromaticContact CD2-CD2 3.95Å; F217-F223 HydrophobicContact CD2-CD2 3.95Å; F217-F223 AromaticContact CD2-CE1 3.86Å; F217-F223 HydrophobicContact CD2-CE1 3.86Å; F217-F223 AromaticContact CD2-CE2 3.74Å; F217-F223 HydrophobicContact CD2-CE2 3.74Å; F217-F223 HydrophobicContact CD2-CG 4.09Å; F217-F223 AromaticContact CD2-CZ 3.68Å; F217-F223 HydrophobicContact CD2-CZ 3.68Å; F217-F223 HydrophobicContact CE2-CD2 4.39Å; F217-F223 HydrophobicContact CE2-CE2 4.08Å; F217-F223 HydrophobicContact CE2-CZ 4.34Å; F217-F223 HydrophobicContact CG-CD1 4.48Å; F217-F223 HydrophobicContact CG-CE1 4.08Å; F217-F223 HydrophobicContact CG-CZ 4.13Å; F223-C238 HydrophobicContact CE2-CB 4.31Å
224I94.8Very high91.5Very high33 Ų3350.4 Ų50.417%0.16926%0.264CS..EExtended strand (participates in β ladder)trans-102.5114.7179.6-55.1166.8000108.3P183 V185 T216 D218 K221 R226P183-I224 HydrophobicContact CB-CG2 4.3Å; V185-I224 HydrophobicContact CG2-CG1 4.22Å; T216-I224 PolarHBondContact N-O 2.91Å; T216-I224 PolarHBondContact O-N 3.28Å; D218-I224 HydrophobicContact CB-CD1 3.91Å; K221-I224 HydrophobicContact CD-CD1 4.48Å; I224-R226 HydrophobicContact CG2-CG 4.46Å
225L93.1Very high92.4Very high0 Ų047 Ų470%025%0.248CC..EExtended strand (participates in β ladder)trans-90.5101.1173.1-60.6169.5000107.8L178 P183 A184 V186 L199 L215 P228 L232 L254L178-L225 HydrophobicContact CD2-CD1 3.81Å; P183-L225 CarbonylContact C-O 3.6Å; P183-L225 WeakPolarHBondContact CA-O 3.24Å; P183-L225 WeakPolarHBondContact CB-O 3.49Å; A184-L225 HydrophobicContact CB-CB 4.31Å; A184-L225 HydrophobicContact CB-CD1 4.36Å; A184-L225 PolarHBondContact N-O 2.87Å; A184-L225 PolarHBondContact O-N 2.01Å; V186-L225 HydrophobicContact CG2-CD1 4.24Å; L199-L225 HydrophobicContact CD2-CD2 4.45Å; L215-L225 HydrophobicContact CD1-CD2 3.54Å; L215-L225 HydrophobicContact CD1-CG 4.45Å; L225-P228 HydrophobicContact CB-CB 4.21Å; L225-L232 HydrophobicContact CD1-CD1 4.21Å; L225-L232 HydrophobicContact CD2-CD1 3.98Å; L225-L254 HydrophobicContact CD1-CD2 3.82Å
226R90.4Very high92.6Very high153 Ų15345.8 Ų45.858%0.57724%0.241SC*.SBendtrans-71.3-38-174-67.4-172.8-175.3-170.51.7113.2L214 T216 I224L214-R226 HydrophobicContact CB-CB 4.03Å; L214-R226 HydrophobicContact CB-CG 4.43Å; T216-R226 PolarHBondContact OG1-NE 2.85Å; T216-R226 PolarHBondContact OG1-NH2 2.83Å; I224-R226 HydrophobicContact CG2-CG 4.46Å
227N87.1Confident92.8Very high94 Ų9446 Ų4650%0.50324%0.237SC..SBendtrans-12980.2178.3-172.340.5000108.6
228P88.8Confident92.9Very high3 Ų343.3 Ų43.32%0.01923%0.225CC..  trans-76.3138-176.433.4-35.2000110.6L178 R179 A184 L225L178-P228 HydrophobicContact CB-CB 4.01Å; L178-P228 HydrophobicContact CB-CG 4.47Å; L178-P228 HydrophobicContact CD1-CB 4.45Å; L178-P228 HydrophobicContact CD2-CB 3.86Å; L178-P228 HydrophobicContact CG-CB 4.32Å; R179-P228 WeakPolarHBondContact O-CG 3.39Å; A184-P228 HydrophobicContact CB-CB 4.42Å; A184-P228 HydrophobicContact CB-CG 4.33Å; L225-P228 HydrophobicContact CB-CB 4.21Å
229S87.6Confident92.9Very high35 Ų3545.5 Ų45.525%0.24523%0.233CC..  trans-123.9164.4-175.348.40000111.1D231 L232S229-D231 WeakPolarHBondContact CB-OD1 3.47Å; S229-D231 PolarHBondContact O-N 3.43Å; S229-D231 PolarHBondContact OG-OD1 2.88Å; S229-L232 WeakPolarHBondContact O-CB 3.39Å; S229-L232 PolarHBondContact O-N 3.35Å; S229-L232 VanDerWaalsContact O-N 3.16Å
230A90.2Very high92.9Very high53 Ų5344.1 Ų44.144%0.43822%0.224SC..G310 helixtrans-65.5-24.8-173.500000113.9L232 Q233 Y256A230-L232 PolarHBondContact O-N 3.37Å; A230-Q233 VanDerWaalsContact O-CB 3.27Å; A230-Q233 WeakPolarHBondContact O-CB 3.4Å; A230-Q233 PolarHBondContact O-N 2.66Å; A230-Q233 VanDerWaalsContact O-N 3.11Å; A230-Y256 HydrophobicContact CB-CD1 3.82Å; A230-Y256 HydrophobicContact CB-CD2 4.15Å; A230-Y256 HydrophobicContact CB-CE1 4.06Å; A230-Y256 HydrophobicContact CB-CE2 4.4Å; A230-Y256 HydrophobicContact CB-CG 3.85Å
231D89.3Confident92.6Very high86 Ų8644.8 Ų44.846%0.4623%0.233SC..G310 helixtrans-66.9-16.8175.659.4-66.3000113.8R201 S229 Q233R201-D231 PolarHBondContact NH1-O 2.83Å; S229-D231 WeakPolarHBondContact CB-OD1 3.47Å; S229-D231 PolarHBondContact O-N 3.43Å; S229-D231 PolarHBondContact OG-OD1 2.88Å; D231-Q233 VanDerWaalsContact C-N 3.27Å
232L90.2Very high92Very high4 Ų440.7 Ų40.72%0.02122%0.219CC..G310 helixtrans-85.97.4172.7-67.5176.9000113.4L178 I208 T213 L225 S229 A230 G234 F236 L254L178-L232 HydrophobicContact CD1-CB 3.73Å; I208-L232 HydrophobicContact CD1-CD2 4.4Å; I208-L232 HydrophobicContact CG2-CD2 4.42Å; T213-L232 HydrophobicContact CG2-CD1 3.39Å; T213-L232 HydrophobicContact CG2-CD2 4.08Å; T213-L232 HydrophobicContact CG2-CG 3.99Å; L225-L232 HydrophobicContact CD1-CD1 4.21Å; L225-L232 HydrophobicContact CD2-CD1 3.98Å; S229-L232 WeakPolarHBondContact O-CB 3.39Å; S229-L232 PolarHBondContact O-N 3.35Å; S229-L232 VanDerWaalsContact O-N 3.16Å; A230-L232 PolarHBondContact O-N 3.37Å; L232-G234 PolarHBondContact O-N 2.74Å; L232-F236 HydrophobicContact CB-CZ 4.44Å; L232-F236 HydrophobicContact CD2-CE1 4.37Å; L232-F236 HydrophobicContact CD2-CZ 4.21Å; L232-F236 WeakPolarHBondContact O-CE2 3.19Å; L232-F236 WeakPolarHBondContact O-CZ 3.48Å; L232-L254 WeakPolarHBondContact O-CB 3.38Å
233Q92.6Very high91.1Very high109 Ų10949.5 Ų49.551%0.50926%0.257SS..  trans-68.7129.4171.6-175.7174.2-10.300110.3A230 D231A230-Q233 VanDerWaalsContact O-CB 3.27Å; A230-Q233 WeakPolarHBondContact O-CB 3.4Å; A230-Q233 PolarHBondContact O-N 2.66Å; A230-Q233 VanDerWaalsContact O-N 3.11Å; D231-Q233 VanDerWaalsContact C-N 3.27Å
234G94.1Very high90Very high16 Ų1652.3 Ų52.317%0.16529%0.289CS..EExtended strand (participates in β ladder)trans150.9-167.5-179.200000113.6L232 F236 Q253 L254L232-G234 PolarHBondContact O-N 2.74Å; G234-F236 WeakPolarHBondContact O-CD2 3.41Å; G234-Q253 PolarHBondContact O-NE2 2.77Å; G234-Q253 VanDerWaalsContact O-NE2 3.14Å; G234-L254 PolarHBondContact N-O 2.95Å; G234-L254 PolarHBondContact O-N 2.9Å
235V95.6Very high89.4Confident38 Ų3855.2 Ų55.223%0.2331%0.308CS..EExtended strand (participates in β ladder)trans-99.9129.5179-173.20000109.7E202 K251 Y252E202-V235 HydrophobicContact CB-CB 4.14Å; E202-V235 HydrophobicContact CB-CG1 4.4Å; E202-V235 PolarHBondContact N-O 3.32Å; E202-V235 VanDerWaalsContact OE2-CG1 3.27Å; E202-V235 WeakPolarHBondContact OE2-CG1 3.22Å; V235-K251 HydrophobicContact CG1-CB 3.88Å; V235-K251 HydrophobicContact CG1-CD 4Å; V235-K251 HydrophobicContact CG1-CG 4.23Å; V235-Y252 CarbonylContact C-O 3.27Å; V235-Y252 WeakPolarHBondContact CA-O 3.39Å
236F95.5Very high89.3Confident0 Ų058.9 Ų58.90%033%0.332CS..EExtended strand (participates in β ladder)trans-126.6156.8-176.9-67.9-103000111.2L199 H200 R201 I208 L232 G234 K251 Y252 L254L199-F236 HydrophobicContact CD1-CB 4.14Å; L199-F236 HydrophobicContact CD1-CD1 4.32Å; L199-F236 HydrophobicContact CD2-CD1 4.42Å; L199-F236 HydrophobicContact CG-CD1 4.19Å; H200-F236 CarbonylContact O-C 3.59Å; H200-F236 WeakPolarHBondContact O-CA 3.32Å; H200-F236 WeakPolarHBondContact O-CB 3.39Å; H200-F236 WeakPolarHBondContact O-CD1 3.28Å; R201-F236 HydrophobicContact CB-CD1 4.03Å; R201-F236 HydrophobicContact CB-CE1 3.7Å; R201-F236 HydrophobicContact CB-CZ 4.16Å; R201-F236 HydrophobicContact CG-CE1 4.11Å; R201-F236 HydrophobicContact CG-CE2 4.46Å; R201-F236 HydrophobicContact CG-CZ 4.04Å; I208-F236 HydrophobicContact CD1-CE1 3.92Å; I208-F236 HydrophobicContact CG1-CD1 4.17Å; I208-F236 HydrophobicContact CG1-CE1 3.71Å; L232-F236 HydrophobicContact CB-CZ 4.44Å; L232-F236 HydrophobicContact CD2-CE1 4.37Å; L232-F236 HydrophobicContact CD2-CZ 4.21Å; L232-F236 WeakPolarHBondContact O-CE2 3.19Å; L232-F236 WeakPolarHBondContact O-CZ 3.48Å; G234-F236 WeakPolarHBondContact O-CD2 3.41Å; F236-K251 CarbonylContact O-C 3.55Å; F236-K251 WeakPolarHBondContact O-CA 3.43Å; F236-Y252 PolarHBondContact N-O 2.88Å; F236-Y252 PolarHBondContact O-N 2.93Å; F236-L254 HydrophobicContact CB-CD1 4.28Å; F236-L254 HydrophobicContact CD2-CB 4.08Å; F236-L254 HydrophobicContact CD2-CD1 3.84Å; F236-L254 HydrophobicContact CD2-CD2 3.75Å; F236-L254 HydrophobicContact CD2-CG 4.09Å; F236-L254 HydrophobicContact CE2-CB 4.08Å; F236-L254 HydrophobicContact CE2-CD2 3.84Å; F236-L254 HydrophobicContact CE2-CG 4.38Å; F236-L254 HydrophobicContact CG-CD1 4.28Å; F236-L254 HydrophobicContact CG-CD2 4.2Å; F236-L254 HydrophobicContact CZ-CD2 4.31Å
237Y95.6Very high89.5Confident55 Ų5553.7 Ų53.722%0.21631%0.314CS..EExtended strand (participates in β ladder)trans-147.1152.8171.960-84.2000109.4H200 E202 I248H200-Y237 HydrophobicContact CB-CD1 4.31Å; H200-Y237 HydrophobicContact CB-CD2 4.07Å; H200-Y237 HydrophobicContact CB-CE1 3.83Å; H200-Y237 HydrophobicContact CB-CE2 3.57Å; H200-Y237 HydrophobicContact CB-CG 4.42Å; H200-Y237 VanDerWaalsContact CB-CZ 3.42Å; H200-Y237 PolarHBondContact N-O 2.88Å; H200-Y237 PolarHBondContact O-N 2.88Å; E202-Y237 HydrophobicContact CB-CE1 4.46Å; Y237-I248 HydrophobicContact CD2-CB 4.13Å; Y237-I248 HydrophobicContact CD2-CG2 3.9Å; Y237-I248 HydrophobicContact CE2-CG2 4.03Å
238C95.6Very high89.8Confident0 Ų054.6 Ų54.60%032%0.318CS..EExtended strand (participates in β ladder)trans-95.6144.4174.3-570000109.5F166 C188 S198 F223 I248 S249F166-C238 HydrophobicContact CE1-CB 3.68Å; F166-C238 HydrophobicContact CZ-CB 3.73Å; C188-C238 HydrophobicContact CB-CB 3.46Å; C188-C238 VanDerWaalsContact CB-CB 3.46Å; C188-C238 WeakPolarHBondContact CB-SG 3.42Å; C188-C238 WeakPolarHBondContact SG-CB 3.46Å; C188-C238 CovalentContact SG-SG 2.01Å; C188-C238 PolarHBondContact SG-SG 3.04Å; S198-C238 CarbonylContact O-C 3.48Å; S198-C238 VanDerWaalsContact O-CA 3.32Å; S198-C238 WeakPolarHBondContact O-CA 3.41Å; F223-C238 HydrophobicContact CE2-CB 4.31Å; C238-I248 CarbonylContact O-C 3.56Å; C238-I248 VanDerWaalsContact O-CA 3.28Å; C238-I248 WeakPolarHBondContact O-CA 3.48Å; C238-S249 PolarHBondContact N-OG 2.91Å; C238-S249 PolarHBondContact O-N 2.82Å
239K95.3Very high90Very high86 Ų8655 Ų5537%0.37432%0.321SS..EExtended strand (participates in β ladder)trans-124128.2177.3-176.5-177.5178.4-176.70108.9A197 S198 Q247A197-K239 CarbonylContact C-O 3.58Å; A197-K239 WeakPolarHBondContact CA-O 2.93Å; S198-K239 PolarHBondContact N-O 2.65Å; S198-K239 PolarHBondContact O-N 3.02Å; S198-K239 PolarHBondContact OG-O 3.11Å; K239-Q247 WeakPolarHBondContact CA-O 3.46Å
240A94.4Very high90.3Very high2 Ų255.2 Ų55.22%0.01732%0.321CS..EExtended strand (participates in β ladder)trans-132.3156.4175.700000109.3L165 F166 V195 E196 A197 P246 Q247L165-A240 HydrophobicContact CD1-CB 4.33Å; F166-A240 HydrophobicContact CE1-CB 4.2Å; F166-A240 HydrophobicContact CE2-CB 3.83Å; F166-A240 HydrophobicContact CZ-CB 3.45Å; F166-A240 VanDerWaalsContact CZ-CB 3.45Å; V195-A240 HydrophobicContact CG1-CB 4.49Å; V195-A240 HydrophobicContact CG2-CB 3.98Å; E196-A240 WeakPolarHBondContact O-CA 3.49Å; A197-A240 HydrophobicContact CB-CB 4.26Å; A240-P246 CarbonylContact O-C 3.54Å; A240-P246 WeakPolarHBondContact O-CA 3.43Å; A240-Q247 PolarHBondContact N-O 2.82Å; A240-Q247 PolarHBondContact O-N 3.07Å
241A89.7Confident90.4Very high51 Ų5156.1 Ų56.142%0.42132%0.315SS..EExtended strand (participates in β ladder)trans-133.2134.7175.900000110.4V195 T245V195-A241 WeakPolarHBondContact CG2-O 3.4Å; A241-T245 WeakPolarHBondContact CA-O 3.27Å
242S82.9Confident90.7Very high27 Ų2752.4 Ų52.419%0.18929%0.294CS..EExtended strand (participates in β ladder)trans-120.9123.8168.6-171.50000108.1G244 T245S242-G244 PolarHBondContact O-N 2.99Å; S242-G244 VanDerWaalsContact O-N 3.1Å; S242-T245 PolarHBondContact N-O 2.86Å; S242-T245 PolarHBondContact O-N 2.79Å
243K75.1Confident90.9Very high186 Ų18655 Ų5581%0.80931%0.306SS*.THydrogen-bonded Turntrans52.732.6179.8-57-175.5177.5-169.50114.8
244G72.4Confident91Very high68 Ų6849.8 Ų49.870%0.70128%0.282SS*.THydrogen-bonded Turntrans92.7-5.8174.100000116S242 P246S242-G244 PolarHBondContact O-N 2.99Å; S242-G244 VanDerWaalsContact O-N 3.1Å; G244-P246 WeakPolarHBondContact O-CD 3.46Å
245T83.1Confident90.9Very high94 Ų9451.5 Ų51.558%0.57729%0.287SS*.EExtended strand (participates in β ladder)trans-94.1112.4173.2-53.70000110A241 S242A241-T245 WeakPolarHBondContact CA-O 3.27Å; S242-T245 PolarHBondContact N-O 2.86Å; S242-T245 PolarHBondContact O-N 2.79Å
246P90.8Very high90.6Very high77 Ų7752.6 Ų52.650%0.529%0.287SS..EExtended strand (participates in β ladder)trans-76.3137.617630.7-33000110.7A240 G244A240-P246 CarbonylContact O-C 3.54Å; A240-P246 WeakPolarHBondContact O-CA 3.43Å; G244-P246 WeakPolarHBondContact O-CD 3.46Å
247Q93.4Very high90.1Very high44 Ų4455.5 Ų55.521%0.20631%0.305CS..EExtended strand (participates in β ladder)trans-122.1151.8168.8-62.7-166.9-1.700110K162 E163 L165 K239 A240K162-Q247 PolarHBondContact O-NE2 3.05Å; E163-Q247 VanDerWaalsContact C-NE2 3.3Å; E163-Q247 PolarHBondContact O-NE2 2.88Å; E163-Q247 PolarHBondContact O-OE1 3.26Å; L165-Q247 HydrophobicContact CD1-CB 4.18Å; L165-Q247 HydrophobicContact CD1-CG 4.04Å; L165-Q247 HydrophobicContact CG-CB 4.49Å; L165-Q247 HydrophobicContact CG-CG 4.24Å; K239-Q247 WeakPolarHBondContact CA-O 3.46Å; A240-Q247 PolarHBondContact N-O 2.82Å; A240-Q247 PolarHBondContact O-N 3.07Å
248I93.8Very high89.1Confident112 Ų11260.1 Ų60.157%0.57433%0.329SS*.EExtended strand (participates in β ladder)trans-113.6145.9174.163.7174.5000109.8Y237 C238Y237-I248 HydrophobicContact CD2-CB 4.13Å; Y237-I248 HydrophobicContact CD2-CG2 3.9Å; Y237-I248 HydrophobicContact CE2-CG2 4.03Å; C238-I248 CarbonylContact O-C 3.56Å; C238-I248 VanDerWaalsContact O-CA 3.28Å; C238-I248 WeakPolarHBondContact O-CA 3.48Å
249S93.9Very high87.6Confident12 Ų1261.6 Ų61.68%0.08434%0.338CS..EExtended strand (participates in β ladder)trans-73.4178.6170.968.90000111.5C238 Y252C238-S249 PolarHBondContact N-OG 2.91Å; C238-S249 PolarHBondContact O-N 2.82Å; S249-Y252 WeakPolarHBondContact OG-CE2 3.32Å
250T92.4Very high85.9Confident40 Ų4063.7 Ų63.725%0.24536%0.36CS..EExtended strand (participates in β ladder)trans-57.9165.5158.8-162.90000111.4H172 Y252H172-T250 PolarHBondContact O-OG1 3.07Å; T250-Y252 HydrophobicContact CG2-CE1 3.85Å; T250-Y252 HydrophobicContact CG2-CE2 4.35Å; T250-Y252 WeakPolarHBondContact O-CE2 3.41Å
251K94.1Very high84.6Confident72 Ų7267.7 Ų67.731%0.31339%0.388SS..EExtended strand (participates in β ladder)trans-89.8144179.4-67-179.5177.1-170.20111.3F173 E202 V235 F236F173-K251 HydrophobicContact CD1-CB 4.36Å; F173-K251 HydrophobicContact CE1-CB 4.35Å; F173-K251 HydrophobicContact CE1-CD 4.4Å; E202-K251 IonicContact OE1-NZ 3.96Å; E202-K251 PolarHBondContact OE1-NZ 2.96Å; E202-K251 WeakPolarHBondContact OE2-CD 3.47Å; E202-K251 WeakPolarHBondContact OE2-CE 3.15Å; E202-K251 IonicContact OE2-NZ 2.66Å; E202-K251 PolarHBondContact OE2-NZ 3.32Å; V235-K251 HydrophobicContact CG1-CB 3.88Å; V235-K251 HydrophobicContact CG1-CD 4Å; V235-K251 HydrophobicContact CG1-CG 4.23Å; F236-K251 CarbonylContact O-C 3.55Å; F236-K251 WeakPolarHBondContact O-CA 3.43Å
252Y95Very high83.9Confident7 Ų766.9 Ų66.93%0.02738%0.384CS..EExtended strand (participates in β ladder)trans-119.6127.6-180-53.7-80.6000109.9E174 V186 P187 C188 V235 F236 S249 T250E174-Y252 HydrophobicContact CB-CD1 3.92Å; E174-Y252 HydrophobicContact CB-CE1 4.22Å; E174-Y252 HydrophobicContact CG-CD1 4.43Å; E174-Y252 CarbonylContact O-C 3.56Å; E174-Y252 WeakPolarHBondContact O-CA 3.14Å; V186-Y252 HydrophobicContact CG1-CD1 4.3Å; V186-Y252 HydrophobicContact CG1-CD2 3.39Å; V186-Y252 HydrophobicContact CG1-CE2 3.8Å; V186-Y252 HydrophobicContact CG1-CG 3.68Å; P187-Y252 HydrophobicContact CG-CD1 4.15Å; P187-Y252 HydrophobicContact CG-CE1 3.73Å; C188-Y252 WeakPolarHBondContact CA-OH 3.48Å; C188-Y252 HydrophobicContact CB-CE2 3.87Å; C188-Y252 WeakPolarHBondContact CB-OH 3.36Å; V235-Y252 CarbonylContact C-O 3.27Å; V235-Y252 WeakPolarHBondContact CA-O 3.39Å; F236-Y252 PolarHBondContact N-O 2.88Å; F236-Y252 PolarHBondContact O-N 2.93Å; S249-Y252 WeakPolarHBondContact OG-CE2 3.32Å; T250-Y252 HydrophobicContact CG2-CE1 3.85Å; T250-Y252 HydrophobicContact CG2-CE2 4.35Å; T250-Y252 WeakPolarHBondContact O-CE2 3.41Å
253Q94.9Very high83.9Confident59 Ų5967.7 Ų67.728%0.27639%0.393SS..EExtended strand (participates in β ladder)trans-92109.4173.6177.862.86400108.9E174 I175 V176 G234 L255E174-Q253 PolarHBondContact O-N 3.49Å; I175-Q253 WeakPolarHBondContact CA-O 3Å; I175-Q253 HydrophobicContact CG1-CB 4.47Å; V176-Q253 PolarHBondContact N-O 3.34Å; G234-Q253 PolarHBondContact O-NE2 2.77Å; G234-Q253 VanDerWaalsContact O-NE2 3.14Å; Q253-L255 HydrophobicContact CG-CD2 3.81Å; Q253-L255 HydrophobicContact CG-CG 4.04Å
254L94.1Very high84.5Confident0 Ų059.2 Ų59.20%036%0.357CS..EExtended strand (participates in β ladder)trans-86.8126.1174.6-85.260.5000108.9V176 L178 V186 L225 L232 G234 F236V176-L254 HydrophobicContact CB-CD1 3.91Å; V176-L254 HydrophobicContact CB-CG 4.08Å; V176-L254 HydrophobicContact CG1-CG 4.4Å; V176-L254 HydrophobicContact CG2-CD1 4.18Å; V176-L254 WeakPolarHBondContact O-CA 3.26Å; L178-L254 HydrophobicContact CD1-CB 4.02Å; L178-L254 HydrophobicContact CD1-CD2 4.2Å; L178-L254 HydrophobicContact CD1-CG 4.39Å; L178-L254 HydrophobicContact CD2-CB 4.43Å; L178-L254 HydrophobicContact CD2-CD2 3.95Å; L178-L254 HydrophobicContact CD2-CG 4.01Å; L178-L254 HydrophobicContact CG-CB 4.17Å; L178-L254 HydrophobicContact CG-CD2 4.45Å; L178-L254 HydrophobicContact CG-CG 4.31Å; V186-L254 HydrophobicContact CG2-CD1 4.19Å; V186-L254 HydrophobicContact CG2-CD2 4.26Å; L225-L254 HydrophobicContact CD1-CD2 3.82Å; L232-L254 WeakPolarHBondContact O-CB 3.38Å; G234-L254 PolarHBondContact N-O 2.95Å; G234-L254 PolarHBondContact O-N 2.9Å; F236-L254 HydrophobicContact CB-CD1 4.28Å; F236-L254 HydrophobicContact CD2-CB 4.08Å; F236-L254 HydrophobicContact CD2-CD1 3.84Å; F236-L254 HydrophobicContact CD2-CD2 3.75Å; F236-L254 HydrophobicContact CD2-CG 4.09Å; F236-L254 HydrophobicContact CE2-CB 4.08Å; F236-L254 HydrophobicContact CE2-CD2 3.84Å; F236-L254 HydrophobicContact CE2-CG 4.38Å; F236-L254 HydrophobicContact CG-CD1 4.28Å; F236-L254 HydrophobicContact CG-CD2 4.2Å; F236-L254 HydrophobicContact CZ-CD2 4.31Å
255L92.6Very high85.3Confident51 Ų5163.1 Ų63.127%0.26736%0.355SS..EExtended strand (participates in β ladder)trans-122.2120179.8-62.7-178.4000109.9I175 V176 Y177 L178 Q253I175-L255 HydrophobicContact CG2-CD1 3.68Å; I175-L255 HydrophobicContact CG2-CG 4.11Å; V176-L255 PolarHBondContact O-N 2.95Å; Y177-L255 WeakPolarHBondContact CA-O 3.11Å; Y177-L255 HydrophobicContact CD1-CB 4.29Å; Y177-L255 HydrophobicContact CE1-CD1 4.23Å; L178-L255 PolarHBondContact N-O 3.43Å; Q253-L255 HydrophobicContact CG-CD2 3.81Å; Q253-L255 HydrophobicContact CG-CG 4.04Å
256Y89.3Confident85.8Confident61 Ų6159.3 Ų59.324%0.23933%0.331CS..EExtended strand (participates in β ladder)trans-79.3125.9173.8-172.9-97.6000110.7L178 A230 E258L178-Y256 HydrophobicContact CB-CD2 4.04Å; A230-Y256 HydrophobicContact CB-CD1 3.82Å; A230-Y256 HydrophobicContact CB-CD2 4.15Å; A230-Y256 HydrophobicContact CB-CE1 4.06Å; A230-Y256 HydrophobicContact CB-CE2 4.4Å; A230-Y256 HydrophobicContact CB-CG 3.85Å; Y256-E258 HydrophobicContact CD1-CG 4.28Å; Y256-E258 HydrophobicContact CE1-CG 3.56Å
257V84.6Confident86Confident61 Ų6158.5 Ų58.537%0.3733%0.327SS..  trans-120.6114.7176.4-179.60000107.4Y177 L178 R179 V259Y177-V257 HydrophobicContact CD1-CG2 3.67Å; Y177-V257 HydrophobicContact CE1-CG2 4.27Å; L178-V257 PolarHBondContact O-N 3.3Å; R179-V257 HydrophobicContact CG-CB 4.46Å; V257-V259 PolarHBondContact O-N 2.88Å
258E73.6Confident86.1Confident152 Ų15258.2 Ų58.271%0.7133%0.327SS*.  trans-64.3120.3164.8-70.1-173.7168.200108.1Y256 P260Y256-E258 HydrophobicContact CD1-CG 4.28Å; Y256-E258 HydrophobicContact CE1-CG 3.56Å; E258-P260 WeakPolarHBondContact O-CD 3.27Å
259V64.6Low86.2Confident32 Ų3254.6 Ų54.619%0.19432%0.318CS..  trans-81.7119.3170.1-174.30000105.6R179 V257 S261R179-V259 HydrophobicContact CB-CG2 3.85Å; R179-V259 HydrophobicContact CG-CG2 3.57Å; R179-V259 VanDerWaalsContact CZ-CG2 3.4Å; V257-V259 PolarHBondContact O-N 2.88Å; V259-S261 PolarHBondContact O-N 3.27Å
260P60.1Low86.2Confident130 Ų13055.1 Ų55.184%0.84432%0.323SS*.  trans-64.491.8169.1-10.525.2000107.5E258E258-P260 WeakPolarHBondContact O-CD 3.27Å
261S67.3Low86.3Confident85 Ų8557 Ų5759%0.59434%0.337SS*.  trans-84.6124.8169.472.50000107.2V259V259-S261 PolarHBondContact O-N 3.27Å
262G73.8Confident86.1Confident34 Ų3456 Ų5635%0.35134%0.339SS..  trans-166.8172.8-175.700000111.7N352 N354G262-N352 PolarHBondContact O-ND2 3.3Å; G262-N354 WeakPolarHBondContact O-CB 3.45Å
263A83.7Confident85.5Confident45 Ų4564.6 Ų64.637%0.37238%0.379SS..SBendtrans-56.3146.4172.100000110.3T357A263-T357 VanDerWaalsContact CB-OG1 3.24Å; A263-T357 WeakPolarHBondContact CB-OG1 3.45Å
264P88.1Confident85.1Confident8 Ų866.5 Ų66.55%0.05240%0.395CS..PPolyproline II helixtrans-60.3144.7-173.322.7-31.9000111.6V266 V287 A350 T357P264-V266 HydrophobicContact CB-CG2 4.43Å; P264-V266 HydrophobicContact CG-CG2 4.32Å; P264-V266 WeakPolarHBondContact O-CG2 3.38Å; P264-V266 PolarHBondContact O-N 3.08Å; P264-V287 HydrophobicContact CB-CG1 3.53Å; P264-A350 HydrophobicContact CG-CB 3.94Å; P264-A350 WeakPolarHBondContact CG-O 3.44Å; P264-T357 VanDerWaalsContact O-CB 3.24Å; P264-T357 WeakPolarHBondContact O-CB 3.48Å; P264-T357 PolarHBondContact O-OG1 2.91Å
265F88.1Confident84.9Confident149 Ų14966.6 Ų66.665%0.65440%0.396SS*.EExtended strand (participates in β ladder)trans-77.5117.6169.2-174.9-95.1000109.4V287 L288F265-V287 WeakPolarHBondContact O-CA 3.05Å; F265-L288 PolarHBondContact O-N 3.02Å
266V93.8Very high84.7Confident14 Ų1472.2 Ų72.29%0.08541%0.413CS..EExtended strand (participates in β ladder)trans-117.2131.7-173-1650000110.4P264 C285 T286 V287 A350 T357 V359P264-V266 HydrophobicContact CB-CG2 4.43Å; P264-V266 HydrophobicContact CG-CG2 4.32Å; P264-V266 WeakPolarHBondContact O-CG2 3.38Å; P264-V266 PolarHBondContact O-N 3.08Å; V266-C285 WeakPolarHBondContact CG1-SG 3.48Å; V266-T286 WeakPolarHBondContact CA-O 3.33Å; V266-V287 HydrophobicContact CB-CG2 4.38Å; V266-V287 HydrophobicContact CG1-CG2 4.05Å; V266-V287 HydrophobicContact CG2-CG2 3.98Å; V266-A350 HydrophobicContact CG1-CB 4.46Å; V266-A350 HydrophobicContact CG2-CB 3.64Å; V266-T357 HydrophobicContact CB-CG2 4.06Å; V266-T357 HydrophobicContact CG2-CG2 3.53Å; V266-V359 HydrophobicContact CB-CG1 4.06Å; V266-V359 HydrophobicContact CB-CG2 4.09Å; V266-V359 HydrophobicContact CG1-CG1 4.4Å; V266-V359 HydrophobicContact CG1-CG2 3.52Å
267S94.9Very high84.8Confident60 Ų6071.9 Ų71.942%0.4243%0.429SS..EExtended strand (participates in β ladder)trans-113.1145.3164.662.90000110.7C285 T286S267-C285 CarbonylContact O-C 3.58Å; S267-C285 WeakPolarHBondContact O-CA 3.27Å; S267-T286 PolarHBondContact N-O 3.45Å; S267-T286 PolarHBondContact O-N 3.04Å
268L96.1Very high85Confident38 Ų3870.8 Ų70.820%0.19943%0.429CS..EExtended strand (participates in β ladder)trans-129.3129.1-178.5-168.365.7000109.3V283 T284 C285 W299 C348 V359 T361L268-V283 HydrophobicContact CD1-CG1 3.84Å; L268-V283 HydrophobicContact CG-CG1 4.26Å; L268-T284 WeakPolarHBondContact CA-O 3.37Å; L268-C285 HydrophobicContact CD1-CB 3.76Å; L268-W299 HydrophobicContact CD1-CH2 3.59Å; L268-W299 HydrophobicContact CD1-CZ3 3.9Å; L268-C348 HydrophobicContact CD1-CB 3.84Å; L268-V359 HydrophobicContact CB-CB 4.27Å; L268-V359 HydrophobicContact CB-CG2 3.8Å; L268-V359 HydrophobicContact CD2-CB 4.41Å; L268-V359 HydrophobicContact CD2-CG2 4.05Å; L268-V359 HydrophobicContact CG-CG2 4.36Å; L268-T361 HydrophobicContact CD2-CG2 3.62Å; L268-T361 HydrophobicContact CG-CG2 3.94Å
269G95Very high85.9Confident37 Ų3766.3 Ų66.338%0.38141%0.41SS..EExtended strand (participates in β ladder)trans-138.8145.8177.400000111.6V283 T284G269-V283 CarbonylContact O-C 3.57Å; G269-V283 WeakPolarHBondContact O-CA 3.4Å; G269-T284 PolarHBondContact N-O 3.03Å; G269-T284 PolarHBondContact O-N 3.13Å
270A94.4Very high87.3Confident23 Ų2369.4 Ų69.419%0.1943%0.426CS..EExtended strand (participates in β ladder)trans-110140.6172.900000109.6N282 V283 I363A270-N282 CarbonylContact C-O 3.6Å; A270-N282 WeakPolarHBondContact CA-O 3.35Å; A270-V283 HydrophobicContact CB-CG2 4.49Å; A270-I363 HydrophobicContact CB-CD1 4.02Å; A270-I363 HydrophobicContact CB-CG1 4.33Å
271S93.9Very high89Confident78 Ų7863.2 Ų63.255%0.54539%0.385SS..EExtended strand (participates in β ladder)trans-134.6124.9176.8-1740000109.6N282S271-N282 PolarHBondContact N-O 2.87Å; S271-N282 PolarHBondContact O-N 2.88Å
272P90.2Very high90.4Very high53 Ų5362.4 Ų62.434%0.34438%0.375SS..SBendcis-67.7158.9-5.229.6-34.9000113.2T274 V275P272-T274 VanDerWaalsContact C-N 3.34Å; P272-V275 HydrophobicContact CG-CG2 4.43Å
273E83.3Confident91.4Very high186 Ų18660.8 Ų60.887%0.86936%0.358SS*.SBendtrans-69.6-31.6178.9-71.3-176.7174.100112.7
274T85.5Confident92.1Very high100 Ų10060.4 Ų60.461%0.61335%0.351SS*.SBendtrans-108.1127.3174.5-51.90000108.6P272P272-T274 VanDerWaalsContact C-N 3.34Å
275V89.4Confident92.5Very high2 Ų260 Ų601%0.01235%0.348CS..BIsolated β-bridgetrans-124.8135.8-171.3-179.70000110.3P272 D279 V281 M338 F343 I363 S366P272-V275 HydrophobicContact CG-CG2 4.43Å; V275-D279 HydrophobicContact CG1-CB 4.19Å; V275-V281 HydrophobicContact CB-CG2 4.21Å; V275-V281 HydrophobicContact CG1-CG2 3.49Å; V275-V281 VanDerWaalsContact CG1-CG2 3.49Å; V275-V281 HydrophobicContact CG2-CG1 4.33Å; V275-V281 HydrophobicContact CG2-CG2 3.59Å; V275-M338 HydrophobicContact CG1-CB 4.22Å; V275-M338 HydrophobicContact CG1-CE 4.01Å; V275-M338 HydrophobicContact CG1-CG 3.86Å; V275-F343 HydrophobicContact CB-CE1 4.32Å; V275-F343 HydrophobicContact CG1-CE1 3.9Å; V275-F343 HydrophobicContact CG1-CZ 4.41Å; V275-I363 HydrophobicContact CB-CG2 3.85Å; V275-I363 HydrophobicContact CG1-CG2 4.25Å; V275-I363 HydrophobicContact CG2-CG2 3.67Å; V275-S366 PolarHBondContact O-N 2.93Å; V275-S366 PolarHBondContact O-OG 3.03Å
276R90.1Very high92.9Very high168 Ų16854 Ų5463%0.63432%0.324SS*.  trans-112.6162.5171.1-67.4178-179.1-176.32.2110.5G278 D279 S366R276-G278 PolarHBondContact O-N 2.96Å; R276-D279 PolarHBondContact N-OD2 3.12Å; R276-D279 WeakPolarHBondContact O-CB 3.37Å; R276-D279 PolarHBondContact O-N 2.83Å; R276-S366 WeakPolarHBondContact CG-OG 3.47Å
277G89.9Confident93Very high55 Ų5553.4 Ų53.457%0.56732%0.32SS*.THydrogen-bonded Turntrans-57.9131.7168.600000110.2M338G277-M338 CarbonylContact C-O 3.56Å; G277-M338 WeakPolarHBondContact CA-O 3.33Å
278G89.9Confident92.7Very high37 Ų3753.5 Ų53.538%0.38132%0.316SS..THydrogen-bonded Turntrans96.2-13.7-176.300000115.6R276 N337 M338R276-G278 PolarHBondContact O-N 2.96Å; G278-N337 WeakPolarHBondContact CA-OD1 3.04Å; G278-M338 PolarHBondContact N-O 2.8Å
279D92.4Very high92Very high58 Ų5852.8 Ų52.831%0.3132%0.318SS..  trans-73.2155.5-179.5-69-14.6000112.2V275 R276 N337 M338V275-D279 HydrophobicContact CG1-CB 4.19Å; R276-D279 PolarHBondContact N-OD2 3.12Å; R276-D279 WeakPolarHBondContact O-CB 3.37Å; R276-D279 PolarHBondContact O-N 2.83Å; D279-N337 PolarHBondContact O-N 3.23Å; D279-M338 WeakPolarHBondContact O-CB 3.4Å; D279-M338 VanDerWaalsContact O-CG 3.29Å; D279-M338 WeakPolarHBondContact O-CG 3.33Å; D279-M338 PolarHBondContact O-N 2.94Å
280N94.1Very high91.2Very high97 Ų9755.2 Ų55.252%0.51932%0.319SS..  trans-98.2128.3169.1-64-13.5000109V335 D336 N337N280-V335 WeakPolarHBondContact CA-O 3.15Å; N280-D336 WeakPolarHBondContact OD1-CA 3.18Å; N280-N337 PolarHBondContact OD1-N 3.18Å
281V94.4Very high90.5Very high0 Ų056 Ų560%032%0.323CS..EExtended strand (participates in β ladder)trans-124.7133.6-172.8-176.30000111V275 V283 S334 V335 M338 I363V275-V281 HydrophobicContact CB-CG2 4.21Å; V275-V281 HydrophobicContact CG1-CG2 3.49Å; V275-V281 VanDerWaalsContact CG1-CG2 3.49Å; V275-V281 HydrophobicContact CG2-CG1 4.33Å; V275-V281 HydrophobicContact CG2-CG2 3.59Å; V281-V283 HydrophobicContact CG1-CG2 4.39Å; V281-S334 WeakPolarHBondContact O-CA 3.45Å; V281-V335 PolarHBondContact N-O 2.74Å; V281-V335 PolarHBondContact O-N 2.67Å; V281-M338 HydrophobicContact CB-CG 4.34Å; V281-M338 HydrophobicContact CG2-CG 3.59Å; V281-M338 HydrophobicContact CG2-SD 4.26Å; V281-I363 HydrophobicContact CG1-CD1 3.84Å
282N96.6Very high89.7Confident69 Ų6961.4 Ų61.437%0.36934%0.339SS..EExtended strand (participates in β ladder)trans-110.6120172.7-71.1-24.9000110.3A270 S271 I332 L333 S334A270-N282 CarbonylContact C-O 3.6Å; A270-N282 WeakPolarHBondContact CA-O 3.35Å; S271-N282 PolarHBondContact N-O 2.87Å; S271-N282 PolarHBondContact O-N 2.88Å; N282-I332 HydrophobicContact CB-CG2 4.17Å; N282-L333 CarbonylContact C-O 3.51Å; N282-L333 WeakPolarHBondContact CA-O 3.47Å; N282-S334 VanDerWaalsContact OD1-CB 3.22Å; N282-S334 WeakPolarHBondContact OD1-CB 3.33Å; N282-S334 PolarHBondContact OD1-OG 3.39Å
283V96.5Very high89.3Confident0 Ų061 Ų610%033%0.333CS..EExtended strand (participates in β ladder)trans-100.9112171.3-166.70000108.5L268 G269 A270 V281 W299 I332 L333 Y346 T361 I363L268-V283 HydrophobicContact CD1-CG1 3.84Å; L268-V283 HydrophobicContact CG-CG1 4.26Å; G269-V283 CarbonylContact O-C 3.57Å; G269-V283 WeakPolarHBondContact O-CA 3.4Å; A270-V283 HydrophobicContact CB-CG2 4.49Å; V281-V283 HydrophobicContact CG1-CG2 4.39Å; V283-W299 HydrophobicContact CB-CH2 4.13Å; V283-W299 HydrophobicContact CB-CZ3 4.27Å; V283-W299 HydrophobicContact CG1-CH2 3.75Å; V283-W299 HydrophobicContact CG1-CZ3 3.77Å; V283-I332 WeakPolarHBondContact O-CA 3.45Å; V283-L333 PolarHBondContact N-O 2.93Å; V283-L333 PolarHBondContact O-N 2.98Å; V283-Y346 HydrophobicContact CG2-CD1 3.78Å; V283-Y346 HydrophobicContact CG2-CE1 4.15Å; V283-Y346 HydrophobicContact CG2-CG 4.12Å; V283-T361 HydrophobicContact CG1-CG2 3.94Å; V283-I363 HydrophobicContact CG2-CD1 3.81Å
284T97.7Very high89.4Confident36 Ų3657.7 Ų57.722%0.22132%0.321CS..EExtended strand (participates in β ladder)trans-105.4117.8-176-57.20000110.3L268 G269 I332L268-T284 WeakPolarHBondContact CA-O 3.37Å; G269-T284 PolarHBondContact N-O 3.03Å; G269-T284 PolarHBondContact O-N 3.13Å; T284-I332 HydrophobicContact CG2-CG1 4.08Å
285C97.2Very high89.7Confident0 Ų054 Ų540%030%0.299CS..EExtended strand (participates in β ladder)trans-98.8117.7171.2-171.50000109V266 S267 L268 F297 W299 Q330 S331 C348V266-C285 WeakPolarHBondContact CG1-SG 3.48Å; S267-C285 CarbonylContact O-C 3.58Å; S267-C285 WeakPolarHBondContact O-CA 3.27Å; L268-C285 HydrophobicContact CD1-CB 3.76Å; C285-F297 HydrophobicContact CB-CD1 4.42Å; C285-F297 HydrophobicContact CB-CE1 4.33Å; C285-W299 HydrophobicContact CB-CH2 3.68Å; C285-W299 HydrophobicContact CB-CZ2 3.51Å; C285-Q330 CarbonylContact O-C 3.58Å; C285-Q330 VanDerWaalsContact O-CA 3.27Å; C285-Q330 WeakPolarHBondContact O-CA 3.36Å; C285-S331 PolarHBondContact N-O 2.81Å; C285-S331 PolarHBondContact O-N 3.47Å; C285-C348 HydrophobicContact CB-CB 3.67Å; C285-C348 WeakPolarHBondContact CB-SG 3.2Å; C285-C348 WeakPolarHBondContact SG-CB 3.4Å; C285-C348 CovalentContact SG-SG 2.03Å; C285-C348 PolarHBondContact SG-SG 2.92Å
286T96.4Very high89.9Confident24 Ų2457 Ų5715%0.14732%0.319CS..EExtended strand (participates in β ladder)trans-115.4133.8-177.1-56.80000110.3V266 S267 V328 Q330V266-T286 WeakPolarHBondContact CA-O 3.33Å; S267-T286 PolarHBondContact N-O 3.45Å; S267-T286 PolarHBondContact O-N 3.04Å; T286-V328 HydrophobicContact CG2-CG1 3.84Å; T286-Q330 HydrophobicContact CG2-CG 3.93Å; T286-Q330 PolarHBondContact OG1-NE2 3.36Å
287V94.6Very high90.2Very high1 Ų150.4 Ų50.41%0.00630%0.295CS..EExtended strand (participates in β ladder)trans-124.1131.6179.2177.40000109.8P264 F265 V266 V295 F297 V328 S329 A350P264-V287 HydrophobicContact CB-CG1 3.53Å; F265-V287 WeakPolarHBondContact O-CA 3.05Å; V266-V287 HydrophobicContact CB-CG2 4.38Å; V266-V287 HydrophobicContact CG1-CG2 4.05Å; V266-V287 HydrophobicContact CG2-CG2 3.98Å; V287-V295 HydrophobicContact CB-CG1 4.43Å; V287-V295 HydrophobicContact CG1-CG1 4.19Å; V287-V295 HydrophobicContact CG1-CG2 3.87Å; V287-V295 HydrophobicContact CG2-CG1 4.22Å; V287-F297 HydrophobicContact CB-CE1 4.5Å; V287-F297 HydrophobicContact CB-CZ 4.13Å; V287-F297 HydrophobicContact CG2-CE1 3.58Å; V287-F297 HydrophobicContact CG2-CZ 3.68Å; V287-V328 WeakPolarHBondContact O-CA 3.48Å; V287-S329 PolarHBondContact N-O 2.03Å; V287-S329 PolarHBondContact O-N 2.82Å; V287-A350 HydrophobicContact CG2-CB 3.75Å
288L89.2Confident90.5Very high61 Ų6156.3 Ų56.332%0.31930%0.3SS..EExtended strand (participates in β ladder)trans-99.7129.7169.3-57.7179.1000108.4F265 T326 V328F265-L288 PolarHBondContact O-N 3.02Å; L288-T326 HydrophobicContact CB-CG2 4.37Å; L288-V328 HydrophobicContact CD2-CB 4.39Å; L288-V328 HydrophobicContact CD2-CG1 4.24Å; L288-V328 HydrophobicContact CD2-CG2 3.71Å
289G80.2Confident90.8Very high24 Ų2455.8 Ų55.825%0.24729%0.287CS..EExtended strand (participates in β ladder)trans-154.7-178.4-179.200000113.5T326 R327G289-T326 WeakPolarHBondContact O-CG2 3.31Å; G289-R327 PolarHBondContact N-O 2.99Å; G289-R327 PolarHBondContact O-N 2.78Å
290E79.7Confident91Very high87 Ų8755.6 Ų55.641%0.40729%0.29SS..  trans-67.3149.8177.7-68-65.3129.300111.5E292 E293 R327E290-E292 VanDerWaalsContact C-N 3.26Å; E290-E292 PolarHBondContact O-N 3.5Å; E290-E293 HydrophobicContact CB-CB 4.19Å; E290-E293 HydrophobicContact CB-CG 4.03Å; E290-E293 PolarHBondContact O-N 2.68Å; E290-R327 WeakPolarHBondContact O-CB 3.43Å
291P80Confident91.1Very high41 Ų4152.5 Ų52.527%0.26627%0.271SS..THydrogen-bonded Turntrans-52.3-40.4-179.3-30.337.6000114.8L317 T325P291-L317 HydrophobicContact CB-CD2 3.91Å; P291-T325 WeakPolarHBondContact CD-O 3.47Å; P291-T325 HydrophobicContact CG-CG2 4.16Å; P291-T325 WeakPolarHBondContact CG-O 3.22Å
292E76.3Confident91Very high190 Ų19053.7 Ų53.789%0.88828%0.279SS*.THydrogen-bonded Turntrans-93.9-9.7-172.6-61.9-179.6-175.300113.1E290E290-E292 VanDerWaalsContact C-N 3.26Å; E290-E292 PolarHBondContact O-N 3.5Å
293E81.2Confident90.6Very high46 Ų4651 Ų5122%0.21527%0.268CS..  trans-88.7125179.6-73.1-168.8-173.300111.8E290 N352 N354E290-E293 HydrophobicContact CB-CB 4.19Å; E290-E293 HydrophobicContact CB-CG 4.03Å; E290-E293 PolarHBondContact O-N 2.68Å; E293-N352 PolarHBondContact OE2-ND2 3.27Å; E293-N354 PolarHBondContact OE1-ND2 3.43Å
294D85.9Confident90.2Very high115 Ų11554.6 Ų54.662%0.61528%0.284SS*.  trans-85.7148.3170.9-78.8-28.4000111.6R327D294-R327 IonicContact OD1-CZ 3.29Å; D294-R327 IonicContact OD1-NH1 2.79Å; D294-R327 PolarHBondContact OD1-NH1 2.96Å; D294-R327 IonicContact OD1-NH2 2.76Å; D294-R327 PolarHBondContact OD1-NH2 3.49Å
295V91.8Very high89.6Confident24 Ų2460.2 Ų60.215%0.14531%0.313CS..  trans-121.6131.6179.1-179.30000109.6V287 F297 A350V287-V295 HydrophobicContact CB-CG1 4.43Å; V287-V295 HydrophobicContact CG1-CG1 4.19Å; V287-V295 HydrophobicContact CG1-CG2 3.87Å; V287-V295 HydrophobicContact CG2-CG1 4.22Å; V295-F297 HydrophobicContact CB-CE2 4.25Å; V295-F297 HydrophobicContact CG1-CE2 4.01Å; V295-F297 HydrophobicContact CG1-CZ 4.02Å; V295-A350 HydrophobicContact CG1-CB 3.99Å
296S94.2Very high89.2Confident63 Ų6369.9 Ų69.944%0.44135%0.35SS..EExtended strand (participates in β ladder)trans-97.8136.8174.464.10000111.2A350 K351S296-A350 CarbonylContact O-C 3.53Å; S296-A350 WeakPolarHBondContact O-CA 3.27Å; S296-K351 PolarHBondContact N-O 2.87Å; S296-K351 PolarHBondContact O-N 2.91Å; S296-K351 WeakPolarHBondContact OG-CB 3.46Å; S296-K351 PolarHBondContact OG-O 3.33Å; S296-K351 VanDerWaalsContact OG-O 3.06Å
297F96.1Very high88.7Confident30 Ų3070.7 Ų70.713%0.13235%0.35CS..EExtended strand (participates in β ladder)trans-113.3138.4-179.3-66.3-90.1000111.1C285 V287 V295 M313 K349 A350C285-F297 HydrophobicContact CB-CD1 4.42Å; C285-F297 HydrophobicContact CB-CE1 4.33Å; V287-F297 HydrophobicContact CB-CE1 4.5Å; V287-F297 HydrophobicContact CB-CZ 4.13Å; V287-F297 HydrophobicContact CG2-CE1 3.58Å; V287-F297 HydrophobicContact CG2-CZ 3.68Å; V295-F297 HydrophobicContact CB-CE2 4.25Å; V295-F297 HydrophobicContact CG1-CE2 4.01Å; V295-F297 HydrophobicContact CG1-CZ 4.02Å; F297-M313 HydrophobicContact CD2-SD 4.36Å; F297-K349 CarbonylContact C-O 3.58Å; F297-K349 WeakPolarHBondContact CA-O 3.36Å; F297-A350 HydrophobicContact CD1-CB 4.24Å; F297-A350 HydrophobicContact CE1-CB 4.17Å
298R96.4Very high88.4Confident179 Ų17976.3 Ų76.368%0.67539%0.386SS*.EExtended strand (participates in β ladder)trans-134139.9169.8-64.6175.864.5-172.82.2109.9K349R298-K349 HydrophobicContact CB-CB 4.26Å; R298-K349 PolarHBondContact N-O 3.23Å; R298-K349 PolarHBondContact O-N 2.88Å
299W96.4Very high88.5Confident27 Ų2775.2 Ų75.210%0.10238%0.382CS..EExtended strand (participates in β ladder)trans-112.1146.4-179.7-71.396.2000111.7L268 V283 C285 Y301 I311 S331 L333 I347 C348L268-W299 HydrophobicContact CD1-CH2 3.59Å; L268-W299 HydrophobicContact CD1-CZ3 3.9Å; V283-W299 HydrophobicContact CB-CH2 4.13Å; V283-W299 HydrophobicContact CB-CZ3 4.27Å; V283-W299 HydrophobicContact CG1-CH2 3.75Å; V283-W299 HydrophobicContact CG1-CZ3 3.77Å; C285-W299 HydrophobicContact CB-CH2 3.68Å; C285-W299 HydrophobicContact CB-CZ2 3.51Å; W299-Y301 HydrophobicContact CB-CD1 4.13Å; W299-Y301 HydrophobicContact CB-CE1 4.49Å; W299-I311 HydrophobicContact CG-CD1 4.47Å; W299-S331 WeakPolarHBondContact CZ2-O 3.14Å; W299-S331 PolarHBondContact NE1-OG 2.78Å; W299-L333 HydrophobicContact CB-CD1 3.87Å; W299-L333 HydrophobicContact CD2-CB 4.13Å; W299-L333 HydrophobicContact CD2-CD1 3.76Å; W299-L333 HydrophobicContact CE3-CB 4.41Å; W299-L333 HydrophobicContact CE3-CD1 3.93Å; W299-L333 HydrophobicContact CG-CD1 3.75Å; W299-L333 HydrophobicContact CH2-CB 4.34Å; W299-L333 HydrophobicContact CZ2-CB 4.09Å; W299-I347 WeakPolarHBondContact CA-O 2.98Å; W299-C348 HydrophobicContact CD2-CB 4.45Å; W299-C348 HydrophobicContact CE3-CB 4.08Å; W299-C348 HydrophobicContact CH2-CB 3.88Å; W299-C348 HydrophobicContact CZ2-CB 4.22Å; W299-C348 HydrophobicContact CZ3-CB 3.78Å
300S96.3Very high89.2Confident53 Ų5379.4 Ų79.437%0.37140%0.395SS..EExtended strand (participates in β ladder)trans-131.7126162.5177.80000107.6I347S300-I347 PolarHBondContact N-O 2.93Å; S300-I347 PolarHBondContact O-N 3.45Å
301Y95.1Very high90Very high33 Ų3378.9 Ų78.913%0.12939%0.394CS..  trans-145.9161.7-173.756.6-85.4000111.7W299 Q304 V309 L333W299-Y301 HydrophobicContact CB-CD1 4.13Å; W299-Y301 HydrophobicContact CB-CE1 4.49Å; Y301-Q304 HydrophobicContact CD2-CB 4.37Å; Y301-Q304 HydrophobicContact CE1-CB 4.45Å; Y301-Q304 HydrophobicContact CE1-CG 4.1Å; Y301-Q304 HydrophobicContact CE2-CB 4.03Å; Y301-Q304 HydrophobicContact CE2-CG 4.38Å; Y301-Q304 WeakPolarHBondContact O-CB 3.34Å; Y301-V309 HydrophobicContact CD2-CG1 4.14Å; Y301-V309 HydrophobicContact CE1-CG2 4.02Å; Y301-V309 HydrophobicContact CE2-CB 4.45Å; Y301-V309 HydrophobicContact CE2-CG1 3.53Å; Y301-V309 HydrophobicContact CE2-CG2 4.04Å; Y301-V309 VanDerWaalsContact OH-CG2 3.24Å; Y301-V309 WeakPolarHBondContact OH-CG2 3.29Å; Y301-L333 HydrophobicContact CD1-CD1 3.55Å; Y301-L333 HydrophobicContact CE1-CD1 3.96Å; Y301-L333 HydrophobicContact CG-CD1 4.01Å
302P93.6Very high90.7Very high24 Ų2480.4 Ų80.416%0.15640%0.398CS..THydrogen-bonded Turntrans-64.6144.7176.9-18.934.3000111.2Q304 I341 N345 Y346P302-Q304 PolarHBondContact O-N 2.83Å; P302-I341 CarbonylContact C-O 3.59Å; P302-I341 WeakPolarHBondContact CB-O 3.4Å; P302-N345 WeakPolarHBondContact CD-O 3.48Å; P302-Y346 HydrophobicContact CG-CD2 4.49Å; P302-Y346 HydrophobicContact CG-CE2 4.05Å
303G86.9Confident91.5Very high14 Ų1477.7 Ų77.714%0.14439%0.387CS..THydrogen-bonded Turntrans72.712.7179.800000115.1D305 R306 R307 I341G303-D305 PolarHBondContact O-N 2.85Å; G303-R306 WeakPolarHBondContact O-CA 3.43Å; G303-R306 WeakPolarHBondContact O-CB 3.39Å; G303-R306 PolarHBondContact O-N 2.79Å; G303-R307 PolarHBondContact O-N 3.16Å; G303-I341 PolarHBondContact N-O 3.11Å
304Q88.3Confident92.2Very high74 Ų7477.1 Ų77.135%0.34639%0.385SS..THydrogen-bonded Turntrans-53.8138.1175.1-169.6147.8-9.800111.6Y301 P302 R306Y301-Q304 HydrophobicContact CD2-CB 4.37Å; Y301-Q304 HydrophobicContact CE1-CB 4.45Å; Y301-Q304 HydrophobicContact CE1-CG 4.1Å; Y301-Q304 HydrophobicContact CE2-CB 4.03Å; Y301-Q304 HydrophobicContact CE2-CG 4.38Å; Y301-Q304 WeakPolarHBondContact O-CB 3.34Å; P302-Q304 PolarHBondContact O-N 2.83Å; Q304-R306 PolarHBondContact O-N 3.28Å
305D86.6Confident92.5Very high155 Ų15578.5 Ų78.583%0.82938%0.382SS*.THydrogen-bonded Turntrans64.4-1.6-173-49.5-42.8000115.7G303G303-D305 PolarHBondContact O-N 2.85Å
306R87.6Confident92.4Very high202 Ų20284 Ų8476%0.76240%0.4SS*.THydrogen-bonded Turntrans-112-24.4178.2-60.7179.6176.3-171.9-0.7113G303 Q304 I341G303-R306 WeakPolarHBondContact O-CA 3.43Å; G303-R306 WeakPolarHBondContact O-CB 3.39Å; G303-R306 PolarHBondContact O-N 2.79Å; Q304-R306 PolarHBondContact O-N 3.28Å; R306-I341 HydrophobicContact CB-CD1 4.3Å
307R87.3Confident92.2Very high42 Ų4285.3 Ų85.316%0.15840%0.402CS..SBendtrans-128.3133.2-178.2-66.3-88.5-74.6161.85.7109.4G303 D336 N337 Q339 I341 D342G303-R307 PolarHBondContact O-N 3.16Å; R307-D336 PolarHBondContact NH2-O 2.49Å; R307-N337 PolarHBondContact NH2-O 3.28Å; R307-Q339 VanDerWaalsContact CZ-CD 3.49Å; R307-I341 HydrophobicContact CG-CG2 3.85Å; R307-D342 WeakPolarHBondContact CG-OD1 3.42Å; R307-D342 IonicContact CZ-OD1 3.73Å; R307-D342 IonicContact CZ-OD2 3.81Å; R307-D342 VanDerWaalsContact CZ-OD2 3.26Å; R307-D342 IonicContact NE-OD1 3.26Å; R307-D342 PolarHBondContact NE-OD1 3.46Å; R307-D342 VanDerWaalsContact NE-OD1 3.07Å; R307-D342 IonicContact NE-OD2 2.87Å; R307-D342 PolarHBondContact NE-OD2 2.85Å; R307-D342 VanDerWaalsContact NE-OD2 3.11Å; R307-D342 IonicContact NH2-OD1 3.52Å; R307-D342 IonicContact NH2-OD2 2.92Å; R307-D342 PolarHBondContact NH2-OD2 3.31Å
308P87.4Confident91.6Very high118 Ų11885.4 Ų85.477%0.76641%0.405SS*.  trans-70.8138.6173.929.8-32.9000110.2
309V92.3Very high90.9Very high38 Ų3883 Ų8323%0.2341%0.405CS..  trans-128.8152.3171.8-59.40000109.5Y301 I311 L333 V335Y301-V309 HydrophobicContact CD2-CG1 4.14Å; Y301-V309 HydrophobicContact CE1-CG2 4.02Å; Y301-V309 HydrophobicContact CE2-CB 4.45Å; Y301-V309 HydrophobicContact CE2-CG1 3.53Å; Y301-V309 HydrophobicContact CE2-CG2 4.04Å; Y301-V309 VanDerWaalsContact OH-CG2 3.24Å; Y301-V309 WeakPolarHBondContact OH-CG2 3.29Å; V309-I311 HydrophobicContact CG2-CD1 4.27Å; V309-I311 HydrophobicContact CG2-CG1 4.16Å; V309-L333 HydrophobicContact CB-CD2 4.46Å; V309-L333 HydrophobicContact CB-CG 4.45Å; V309-L333 HydrophobicContact CG1-CD2 4.43Å; V309-L333 HydrophobicContact CG2-CG 4.47Å; V309-V335 HydrophobicContact CG1-CG2 4.01Å
310H94.1Very high89.8Confident112 Ų11288.7 Ų88.752%0.51943%0.426SS..EExtended strand (participates in β ladder)trans-99.7127.8171.8-171.167.6000109.9L333 S334H310-L333 CarbonylContact O-C 3.59Å; H310-L333 WeakPolarHBondContact O-CA 3.45Å; H310-S334 PolarHBondContact N-O 3.19Å; H310-S334 PolarHBondContact O-N 3.12Å
311I95.4Very high88Confident76 Ų7688.4 Ų88.439%0.3943%0.432SS..EExtended strand (participates in β ladder)trans-118.7119.3176.6-58.2173.8000108.7W299 V309 I332 L333W299-I311 HydrophobicContact CG-CD1 4.47Å; V309-I311 HydrophobicContact CG2-CD1 4.27Å; V309-I311 HydrophobicContact CG2-CG1 4.16Å; I311-I332 CarbonylContact C-O 3.56Å; I311-I332 WeakPolarHBondContact CA-O 3.46Å; I311-L333 HydrophobicContact CD1-CD1 4.38Å; I311-L333 HydrophobicContact CG1-CB 4.44Å; I311-L333 HydrophobicContact CG1-CD1 4.4Å; I311-L333 HydrophobicContact CG1-CG 4.24Å
312Q95.4Very high86.1Confident74 Ų7496 Ų9635%0.34647%0.471SS..EExtended strand (participates in β ladder)trans-112.6141.8176-170.61753.600110.2L314 S331 I332Q312-L314 HydrophobicContact CG-CD1 4.26Å; Q312-L314 HydrophobicContact CG-CG 4.24Å; Q312-S331 CarbonylContact O-C 3.48Å; Q312-S331 VanDerWaalsContact O-CA 3.31Å; Q312-S331 WeakPolarHBondContact O-CA 3.47Å; Q312-I332 PolarHBondContact N-O 3.42Å; Q312-I332 PolarHBondContact O-N 2.63Å
313M94.3Very high84.3Confident132 Ų13298.7 Ų98.765%0.6550%0.502SS*.EExtended strand (participates in β ladder)trans-118.5134172.3-66.5-177.2-7200109.7F297 Q330F297-M313 HydrophobicContact CD2-SD 4.36Å; M313-Q330 CarbonylContact C-O 3.56Å; M313-Q330 WeakPolarHBondContact CA-O 3.43Å
314L94.1Very high83.2Confident34 Ų34104.4 Ų104.418%0.17853%0.525CS..EExtended strand (participates in β ladder)trans-136.8150.1-178.1-69.3151.2000108.5Q312 Q330 I332Q312-L314 HydrophobicContact CG-CD1 4.26Å; Q312-L314 HydrophobicContact CG-CG 4.24Å; L314-Q330 PolarHBondContact N-O 3.41Å; L314-Q330 PolarHBondContact O-N 2.84Å; L314-I332 HydrophobicContact CD1-CD1 3.87Å
315W92.7Very high82.7Confident145 Ų145103 Ų10355%0.54952%0.522SS..EExtended strand (participates in β ladder)trans-146.4156.4169.367.4-87.6000110.6L317 R327 V328W315-L317 HydrophobicContact CZ3-CD1 4.44Å; W315-L317 HydrophobicContact CZ3-CG 3.98Å; W315-R327 HydrophobicContact CE3-CG 4.39Å; W315-V328 CarbonylContact C-O 3.59Å; W315-V328 WeakPolarHBondContact CA-O 3.47Å
316R91Very high82.5Confident140 Ų14096.7 Ų96.753%0.52849%0.489SS..EExtended strand (participates in β ladder)trans-149.4151.4173.962.9-176.1-176.9107.70.8111V318 V328R316-V318 HydrophobicContact CG-CG2 4.05Å; R316-V328 HydrophobicContact CG-CB 4.1Å; R316-V328 PolarHBondContact N-O 3.36Å; R316-V328 PolarHBondContact O-N 2.86Å
317L88.8Confident82.6Confident90 Ų9088.4 Ų88.447%0.47146%0.457SS..EExtended strand (participates in β ladder)trans-88.9136.6167.5-65.4173.3000109.3P291 W315 T325 R327P291-L317 HydrophobicContact CB-CD2 3.91Å; W315-L317 HydrophobicContact CZ3-CD1 4.44Å; W315-L317 HydrophobicContact CZ3-CG 3.98Å; L317-T325 HydrophobicContact CB-CG2 3.73Å; L317-T325 HydrophobicContact CD1-CG2 4.37Å; L317-T325 HydrophobicContact CD2-CG2 3.95Å; L317-T325 HydrophobicContact CG-CG2 4.19Å; L317-R327 HydrophobicContact CD2-CB 4Å; L317-R327 HydrophobicContact CD2-CG 4.31Å
318V84.4Confident82.8Confident32 Ų3286.9 Ų86.919%0.19445%0.453CS..EExtended strand (participates in β ladder)trans-125116.7180-173.60000108.4R316 T326 V328R316-V318 HydrophobicContact CG-CG2 4.05Å; V318-T326 PolarHBondContact N-O 3.21Å; V318-T326 PolarHBondContact O-N 3.4Å; V318-V328 HydrophobicContact CB-CG2 4.38Å; V318-V328 HydrophobicContact CG2-CB 4.42Å; V318-V328 HydrophobicContact CG2-CG2 3.57Å
319N80.9Confident83.2Confident127 Ų12781.5 Ų81.568%0.67942%0.418SS*.EExtended strand (participates in β ladder)trans-74.8122.5171.5-74.5-25.6000109T325N319-T325 PolarHBondContact OD1-OG1 2.78Å; N319-T325 VanDerWaalsContact OD1-OG1 3.05Å
320R74.2Confident83.4Confident147 Ų14782.5 Ų82.556%0.55542%0.42SS*.  trans-103.313.2179-71.2-166.3168.8150.5-4.9113.9H324 T326R320-H324 PolarHBondContact N-O 2.87Å; R320-T326 PolarHBondContact NH1-OG1 2.66Å
321G56.9Low83.5Confident47 Ų4777.2 Ų77.249%0.48540%0.396SS..SBendtrans85.8167.1-17400000112.7G323 H324G321-G323 PolarHBondContact O-N 2.89Å; G321-G323 VanDerWaalsContact O-N 3.12Å; G321-H324 PolarHBondContact O-N 2.91Å; G321-H324 VanDerWaalsContact O-N 3.08Å
322M55.1Low83.6Confident194 Ų19475 Ų7596%0.95639%0.385SS*.THydrogen-bonded Turntrans53.328-177.1-62.5-177.5-176.200115.3H324M322-H324 PolarHBondContact O-N 3.08Å
323G57.1Low83.7Confident79 Ų7971.5 Ų71.581%0.81437%0.368SS*.THydrogen-bonded Turntrans73.55.8-178.700000114.9G321G321-G323 PolarHBondContact O-N 2.89Å; G321-G323 VanDerWaalsContact O-N 3.12Å
324H64.6Low83.8Confident135 Ų13566.1 Ų66.163%0.62534%0.344SS*.  trans-84.3117.5173.5-78.6-87.5000110.9R320 G321 M322R320-H324 PolarHBondContact N-O 2.87Å; G321-H324 PolarHBondContact O-N 2.91Å; G321-H324 VanDerWaalsContact O-N 3.08Å; M322-H324 PolarHBondContact O-N 3.08Å
325T77.4Confident83.8Confident44 Ų4464.6 Ų64.627%0.2734%0.336SS..EExtended strand (participates in β ladder)trans-103.7133.8171.4-52.20000108.4P291 L317 N319P291-T325 WeakPolarHBondContact CD-O 3.47Å; P291-T325 HydrophobicContact CG-CG2 4.16Å; P291-T325 WeakPolarHBondContact CG-O 3.22Å; L317-T325 HydrophobicContact CB-CG2 3.73Å; L317-T325 HydrophobicContact CD1-CG2 4.37Å; L317-T325 HydrophobicContact CD2-CG2 3.95Å; L317-T325 HydrophobicContact CG-CG2 4.19Å; N319-T325 PolarHBondContact OD1-OG1 2.78Å; N319-T325 VanDerWaalsContact OD1-OG1 3.05Å
326T82.4Confident83.9Confident23 Ų2362.3 Ų62.314%0.14133%0.334CS..EExtended strand (participates in β ladder)trans-117137.1173.6-56.80000109.3L288 G289 V318 R320L288-T326 HydrophobicContact CB-CG2 4.37Å; G289-T326 WeakPolarHBondContact O-CG2 3.31Å; V318-T326 PolarHBondContact N-O 3.21Å; V318-T326 PolarHBondContact O-N 3.4Å; R320-T326 PolarHBondContact NH1-OG1 2.66Å
327R88.3Confident83.9Confident27 Ų2759.8 Ų59.810%0.10233%0.331CS..EExtended strand (participates in β ladder)trans-84.4128.3169.4-171.2172.3178.7157.7-10.4110G289 E290 D294 W315 L317 S329G289-R327 PolarHBondContact N-O 2.99Å; G289-R327 PolarHBondContact O-N 2.78Å; E290-R327 WeakPolarHBondContact O-CB 3.43Å; D294-R327 IonicContact OD1-CZ 3.29Å; D294-R327 IonicContact OD1-NH1 2.79Å; D294-R327 PolarHBondContact OD1-NH1 2.96Å; D294-R327 IonicContact OD1-NH2 2.76Å; D294-R327 PolarHBondContact OD1-NH2 3.49Å; W315-R327 HydrophobicContact CE3-CG 4.39Å; L317-R327 HydrophobicContact CD2-CB 4Å; L317-R327 HydrophobicContact CD2-CG 4.31Å; R327-S329 PolarHBondContact NE-OG 2.86Å
328V92.6Very high84.1Confident10 Ų1055.6 Ų55.66%0.06131%0.309CS..EExtended strand (participates in β ladder)trans-107.6110.7171.1-175.40000107.4T286 V287 L288 W315 R316 V318 Q330T286-V328 HydrophobicContact CG2-CG1 3.84Å; V287-V328 WeakPolarHBondContact O-CA 3.48Å; L288-V328 HydrophobicContact CD2-CB 4.39Å; L288-V328 HydrophobicContact CD2-CG1 4.24Å; L288-V328 HydrophobicContact CD2-CG2 3.71Å; W315-V328 CarbonylContact C-O 3.59Å; W315-V328 WeakPolarHBondContact CA-O 3.47Å; R316-V328 HydrophobicContact CG-CB 4.1Å; R316-V328 PolarHBondContact N-O 3.36Å; R316-V328 PolarHBondContact O-N 2.86Å; V318-V328 HydrophobicContact CB-CG2 4.38Å; V318-V328 HydrophobicContact CG2-CB 4.42Å; V318-V328 HydrophobicContact CG2-CG2 3.57Å; V328-Q330 HydrophobicContact CG1-CG 4.36Å
329S95.2Very high84.4Confident6 Ų658.2 Ų58.24%0.04232%0.319CS..EExtended strand (participates in β ladder)trans-107.9133.3177.9-62.30000109.6V287 R327V287-S329 PolarHBondContact N-O 2.03Å; V287-S329 PolarHBondContact O-N 2.82Å; R327-S329 PolarHBondContact NE-OG 2.86Å
330Q95.9Very high84.9Confident59 Ų5958.5 Ų58.528%0.27633%0.326SS..EExtended strand (participates in β ladder)trans-128.8138.2-177.2-65-175.2-62.600110.8C285 T286 M313 L314 V328C285-Q330 CarbonylContact O-C 3.58Å; C285-Q330 VanDerWaalsContact O-CA 3.27Å; C285-Q330 WeakPolarHBondContact O-CA 3.36Å; T286-Q330 HydrophobicContact CG2-CG 3.93Å; T286-Q330 PolarHBondContact OG1-NE2 3.36Å; M313-Q330 CarbonylContact C-O 3.56Å; M313-Q330 WeakPolarHBondContact CA-O 3.43Å; L314-Q330 PolarHBondContact N-O 3.41Å; L314-Q330 PolarHBondContact O-N 2.84Å; V328-Q330 HydrophobicContact CG1-CG 4.36Å
331S97.4Very high85.7Confident1 Ų154.6 Ų54.61%0.00732%0.315CS..EExtended strand (participates in β ladder)trans-118.5125.5164-1750000108.8C285 W299 Q312C285-S331 PolarHBondContact N-O 2.81Å; C285-S331 PolarHBondContact O-N 3.47Å; W299-S331 WeakPolarHBondContact CZ2-O 3.14Å; W299-S331 PolarHBondContact NE1-OG 2.78Å; Q312-S331 CarbonylContact O-C 3.48Å; Q312-S331 VanDerWaalsContact O-CA 3.31Å; Q312-S331 WeakPolarHBondContact O-CA 3.47Å
332I97.5Very high87.4Confident29 Ų2952.4 Ų52.415%0.14929%0.293CS..EExtended strand (participates in β ladder)trans-113119.2-178.2-54172.5000107.2N282 V283 T284 I311 Q312 L314N282-I332 HydrophobicContact CB-CG2 4.17Å; V283-I332 WeakPolarHBondContact O-CA 3.45Å; T284-I332 HydrophobicContact CG2-CG1 4.08Å; I311-I332 CarbonylContact C-O 3.56Å; I311-I332 WeakPolarHBondContact CA-O 3.46Å; Q312-I332 PolarHBondContact N-O 3.42Å; Q312-I332 PolarHBondContact O-N 2.63Å; L314-I332 HydrophobicContact CD1-CD1 3.87Å
333L96.8Very high89.3Confident0 Ų045.1 Ų45.10%026%0.256CS..EExtended strand (participates in β ladder)trans-100.9118.1171.4-177.1156.1000108.4N282 V283 W299 Y301 V309 H310 I311 V335 Y346N282-L333 CarbonylContact C-O 3.51Å; N282-L333 WeakPolarHBondContact CA-O 3.47Å; V283-L333 PolarHBondContact N-O 2.93Å; V283-L333 PolarHBondContact O-N 2.98Å; W299-L333 HydrophobicContact CB-CD1 3.87Å; W299-L333 HydrophobicContact CD2-CB 4.13Å; W299-L333 HydrophobicContact CD2-CD1 3.76Å; W299-L333 HydrophobicContact CE3-CB 4.41Å; W299-L333 HydrophobicContact CE3-CD1 3.93Å; W299-L333 HydrophobicContact CG-CD1 3.75Å; W299-L333 HydrophobicContact CH2-CB 4.34Å; W299-L333 HydrophobicContact CZ2-CB 4.09Å; Y301-L333 HydrophobicContact CD1-CD1 3.55Å; Y301-L333 HydrophobicContact CE1-CD1 3.96Å; Y301-L333 HydrophobicContact CG-CD1 4.01Å; V309-L333 HydrophobicContact CB-CD2 4.46Å; V309-L333 HydrophobicContact CB-CG 4.45Å; V309-L333 HydrophobicContact CG1-CD2 4.43Å; V309-L333 HydrophobicContact CG2-CG 4.47Å; H310-L333 CarbonylContact O-C 3.59Å; H310-L333 WeakPolarHBondContact O-CA 3.45Å; I311-L333 HydrophobicContact CD1-CD1 4.38Å; I311-L333 HydrophobicContact CG1-CB 4.44Å; I311-L333 HydrophobicContact CG1-CD1 4.4Å; I311-L333 HydrophobicContact CG1-CG 4.24Å; L333-V335 HydrophobicContact CD2-CG2 3.41Å; L333-V335 VanDerWaalsContact CD2-CG2 3.41Å; L333-Y346 HydrophobicContact CD2-CD1 4.17Å; L333-Y346 HydrophobicContact CD2-CE1 3.93Å
334S96.3Very high91Very high19 Ų1942.2 Ų42.213%0.13323%0.226CC..EExtended strand (participates in β ladder)trans-106.3125.2179-57.50000110.2V281 N282 H310V281-S334 WeakPolarHBondContact O-CA 3.45Å; N282-S334 VanDerWaalsContact OD1-CB 3.22Å; N282-S334 WeakPolarHBondContact OD1-CB 3.33Å; N282-S334 PolarHBondContact OD1-OG 3.39Å; H310-S334 PolarHBondContact N-O 3.19Å; H310-S334 PolarHBondContact O-N 3.12Å
335V94.7Very high92.5Very high2 Ų240 Ų401%0.01222%0.218CC..EExtended strand (participates in β ladder)trans-113.8116.9172.6-170.30000108N280 V281 V309 L333 M338 D342 Y346N280-V335 WeakPolarHBondContact CA-O 3.15Å; V281-V335 PolarHBondContact N-O 2.74Å; V281-V335 PolarHBondContact O-N 2.67Å; V309-V335 HydrophobicContact CG1-CG2 4.01Å; L333-V335 HydrophobicContact CD2-CG2 3.41Å; L333-V335 VanDerWaalsContact CD2-CG2 3.41Å; V335-M338 HydrophobicContact CB-SD 3.97Å; V335-M338 HydrophobicContact CG1-SD 3.64Å; V335-D342 HydrophobicContact CG1-CB 4.3Å; V335-Y346 HydrophobicContact CG2-CE1 4Å
336D93.6Very high93.4Very high97 Ų9737.9 Ų37.952%0.51921%0.205SC..  trans-92.4144177.7-63.4-42.7000110.8N280 R307N280-D336 WeakPolarHBondContact OD1-CA 3.18Å; R307-D336 PolarHBondContact NH2-O 2.49Å
337N92.3Very high94.1Very high88 Ų8838.6 Ų38.647%0.47121%0.208SC..SBendtrans51.466.4175.6-178.420.4000112.1G278 D279 N280 R307 Q339G278-N337 WeakPolarHBondContact CA-OD1 3.04Å; D279-N337 PolarHBondContact O-N 3.23Å; N280-N337 PolarHBondContact OD1-N 3.18Å; R307-N337 PolarHBondContact NH2-O 3.28Å; N337-Q339 PolarHBondContact O-N 3.14Å
338M91.9Very high94.5Very high2 Ų237.3 Ų37.31%0.0120%0.203CC..  trans-50.8129.4-175.5-81-71.3-82.400112.8V275 G277 G278 D279 V281 V335 D342 F343 I363V275-M338 HydrophobicContact CG1-CB 4.22Å; V275-M338 HydrophobicContact CG1-CE 4.01Å; V275-M338 HydrophobicContact CG1-CG 3.86Å; G277-M338 CarbonylContact C-O 3.56Å; G277-M338 WeakPolarHBondContact CA-O 3.33Å; G278-M338 PolarHBondContact N-O 2.8Å; D279-M338 WeakPolarHBondContact O-CB 3.4Å; D279-M338 VanDerWaalsContact O-CG 3.29Å; D279-M338 WeakPolarHBondContact O-CG 3.33Å; D279-M338 PolarHBondContact O-N 2.94Å; V281-M338 HydrophobicContact CB-CG 4.34Å; V281-M338 HydrophobicContact CG2-CG 3.59Å; V281-M338 HydrophobicContact CG2-SD 4.26Å; V335-M338 HydrophobicContact CB-SD 3.97Å; V335-M338 HydrophobicContact CG1-SD 3.64Å; M338-D342 HydrophobicContact CE-CB 3.85Å; M338-D342 HydrophobicContact SD-CB 3.47Å; M338-D342 WeakPolarHBondContact SD-CB 2.99Å; M338-F343 HydrophobicContact CB-CZ 4.49Å; M338-F343 HydrophobicContact CE-CD1 3.95Å; M338-F343 HydrophobicContact CE-CE1 3.93Å; M338-F343 HydrophobicContact CE-CG 4.45Å; M338-F343 HydrophobicContact CE-CZ 4.42Å; M338-I363 HydrophobicContact CE-CG2 3.98Å
339Q91.6Very high94.8Very high86 Ų8640.4 Ų40.440%0.40222%0.216SC..  trans-116.7170177.4-69.6-174.51.300111.5R307 N337 I341 D342 F343R307-Q339 VanDerWaalsContact CZ-CD 3.49Å; N337-Q339 PolarHBondContact O-N 3.14Å; Q339-I341 HydrophobicContact CB-CG2 4.22Å; Q339-I341 PolarHBondContact O-N 2.68Å; Q339-I341 VanDerWaalsContact O-N 3.08Å; Q339-D342 PolarHBondContact N-OD2 2.79Å; Q339-D342 WeakPolarHBondContact O-CB 3.44Å; Q339-D342 PolarHBondContact O-N 3.36Å; Q339-F343 WeakPolarHBondContact O-CD2 3.43Å; Q339-F343 WeakPolarHBondContact O-CE2 3.44Å
340T90.8Very high94.8Very high134 Ų13440.1 Ų40.182%0.82221%0.214SC*.G310 helixtrans-55.4-31.5-179.3-23.20000113D342T340-D342 VanDerWaalsContact C-N 3.33Å
341I92.3Very high94.7Very high64 Ų6442.6 Ų42.633%0.32822%0.224SC..G310 helixtrans-74.1-20.2178.4-166.9168.7000113.7P302 G303 R306 R307 Q339P302-I341 CarbonylContact C-O 3.59Å; P302-I341 WeakPolarHBondContact CB-O 3.4Å; G303-I341 PolarHBondContact N-O 3.11Å; R306-I341 HydrophobicContact CB-CD1 4.3Å; R307-I341 HydrophobicContact CG-CG2 3.85Å; Q339-I341 HydrophobicContact CB-CG2 4.22Å; Q339-I341 PolarHBondContact O-N 2.68Å; Q339-I341 VanDerWaalsContact O-N 3.08Å
342D92.8Very high94.3Very high2 Ų243.4 Ų43.41%0.01123%0.228CC..G310 helixtrans-89.4-12.7-175.3-52.9-41.6000112.3R307 V335 M338 Q339 T340 Y346R307-D342 WeakPolarHBondContact CG-OD1 3.42Å; R307-D342 IonicContact CZ-OD1 3.73Å; R307-D342 IonicContact CZ-OD2 3.81Å; R307-D342 VanDerWaalsContact CZ-OD2 3.26Å; R307-D342 IonicContact NE-OD1 3.26Å; R307-D342 PolarHBondContact NE-OD1 3.46Å; R307-D342 VanDerWaalsContact NE-OD1 3.07Å; R307-D342 IonicContact NE-OD2 2.87Å; R307-D342 PolarHBondContact NE-OD2 2.85Å; R307-D342 VanDerWaalsContact NE-OD2 3.11Å; R307-D342 IonicContact NH2-OD1 3.52Å; R307-D342 IonicContact NH2-OD2 2.92Å; R307-D342 PolarHBondContact NH2-OD2 3.31Å; V335-D342 HydrophobicContact CG1-CB 4.3Å; M338-D342 HydrophobicContact CE-CB 3.85Å; M338-D342 HydrophobicContact SD-CB 3.47Å; M338-D342 WeakPolarHBondContact SD-CB 2.99Å; Q339-D342 PolarHBondContact N-OD2 2.79Å; Q339-D342 WeakPolarHBondContact O-CB 3.44Å; Q339-D342 PolarHBondContact O-N 3.36Å; T340-D342 VanDerWaalsContact C-N 3.33Å; D342-Y346 VanDerWaalsContact O-CE2 3.31Å; D342-Y346 WeakPolarHBondContact O-CE2 3.38Å; D342-Y346 PolarHBondContact O-OH 3.09Å
343F93.5Very high93.7Very high41 Ų4148.7 Ų48.718%0.1826%0.255CS..  trans-76.1136.3175.7-64.4-76.2000111.2V275 M338 Q339 I363 A364 S365V275-F343 HydrophobicContact CB-CE1 4.32Å; V275-F343 HydrophobicContact CG1-CE1 3.9Å; V275-F343 HydrophobicContact CG1-CZ 4.41Å; M338-F343 HydrophobicContact CB-CZ 4.49Å; M338-F343 HydrophobicContact CE-CD1 3.95Å; M338-F343 HydrophobicContact CE-CE1 3.93Å; M338-F343 HydrophobicContact CE-CG 4.45Å; M338-F343 HydrophobicContact CE-CZ 4.42Å; Q339-F343 WeakPolarHBondContact O-CD2 3.43Å; Q339-F343 WeakPolarHBondContact O-CE2 3.44Å; F343-I363 HydrophobicContact CD1-CG2 4.2Å; F343-I363 HydrophobicContact CE1-CG2 4.49Å; F343-A364 VanDerWaalsContact CD1-C 3.47Å; F343-S365 VanDerWaalsContact CD1-N 3.26Å; F343-S365 VanDerWaalsContact CE1-CA 3.45Å
344G93.6Very high93.2Very high18 Ų1851.8 Ų51.819%0.18627%0.272CS..EExtended strand (participates in β ladder)trans146.5-153.2-178.200000113.2K362 I363G344-K362 WeakPolarHBondContact O-CA 3.24Å; G344-I363 PolarHBondContact N-O 3.09Å; G344-I363 PolarHBondContact O-N 3.49Å
345N95.9Very high92.9Very high87 Ų8752 Ų5247%0.46528%0.277SS..EExtended strand (participates in β ladder)trans-91.2122.9-174.6-66.7-22.9000111P302 T360 T361 K362P302-N345 WeakPolarHBondContact CD-O 3.48Å; N345-T360 HydrophobicContact CB-CG2 3.86Å; N345-T361 WeakPolarHBondContact CA-O 3.38Å; N345-K362 WeakPolarHBondContact OD1-CG 3.07Å
346Y96Very high92.8Very high0 Ų057 Ų570%030%0.301CS..EExtended strand (participates in β ladder)trans-101.4119.4171.6-70.8-105.6000108.2V283 P302 L333 V335 D342 T360 T361 I363V283-Y346 HydrophobicContact CG2-CD1 3.78Å; V283-Y346 HydrophobicContact CG2-CE1 4.15Å; V283-Y346 HydrophobicContact CG2-CG 4.12Å; P302-Y346 HydrophobicContact CG-CD2 4.49Å; P302-Y346 HydrophobicContact CG-CE2 4.05Å; L333-Y346 HydrophobicContact CD2-CD1 4.17Å; L333-Y346 HydrophobicContact CD2-CE1 3.93Å; V335-Y346 HydrophobicContact CG2-CE1 4Å; D342-Y346 VanDerWaalsContact O-CE2 3.31Å; D342-Y346 WeakPolarHBondContact O-CE2 3.38Å; D342-Y346 PolarHBondContact O-OH 3.09Å; Y346-T360 WeakPolarHBondContact O-CA 3.24Å; Y346-T361 PolarHBondContact N-O 3.35Å; Y346-T361 PolarHBondContact O-N 3.46Å; Y346-I363 HydrophobicContact CD2-CB 4.29Å; Y346-I363 HydrophobicContact CD2-CD1 3.7Å; Y346-I363 HydrophobicContact CD2-CG1 3.78Å; Y346-I363 HydrophobicContact CE2-CB 4.01Å; Y346-I363 HydrophobicContact CE2-CD1 3.58Å; Y346-I363 HydrophobicContact CE2-CG1 3.87Å; Y346-I363 HydrophobicContact CG-CD1 4.32Å
347I97.5Very high92.9Very high39 Ų3954.1 Ų54.120%0.229%0.286CS..EExtended strand (participates in β ladder)trans-115.1120.3-174-51.6175.6000108.2W299 S300 K349 I358 V359 T360W299-I347 WeakPolarHBondContact CA-O 2.98Å; S300-I347 PolarHBondContact N-O 2.93Å; S300-I347 PolarHBondContact O-N 3.45Å; I347-K349 HydrophobicContact CG2-CG 4.37Å; I347-I358 HydrophobicContact CG2-CG2 3.45Å; I347-I358 VanDerWaalsContact CG2-CG2 3.45Å; I347-V359 WeakPolarHBondContact CA-O 3.42Å; I347-T360 HydrophobicContact CG1-CG2 3.95Å
348C97.6Very high93.1Very high0 Ų053.8 Ų53.80%028%0.284CS..EExtended strand (participates in β ladder)trans-101.3125.7168.7179.40000109.3L268 C285 W299 V359L268-C348 HydrophobicContact CD1-CB 3.84Å; C285-C348 HydrophobicContact CB-CB 3.67Å; C285-C348 WeakPolarHBondContact CB-SG 3.2Å; C285-C348 WeakPolarHBondContact SG-CB 3.4Å; C285-C348 CovalentContact SG-SG 2.03Å; C285-C348 PolarHBondContact SG-SG 2.92Å; W299-C348 HydrophobicContact CD2-CB 4.45Å; W299-C348 HydrophobicContact CE3-CB 4.08Å; W299-C348 HydrophobicContact CH2-CB 3.88Å; W299-C348 HydrophobicContact CZ2-CB 4.22Å; W299-C348 HydrophobicContact CZ3-CB 3.78Å; C348-V359 HydrophobicContact CB-CG2 3.98Å; C348-V359 PolarHBondContact N-O 3.3Å; C348-V359 PolarHBondContact O-N 3.47Å
349K97.1Very high93.3Very high75 Ų7555.2 Ų55.233%0.32629%0.292SS..EExtended strand (participates in β ladder)trans-107116.3169.2-51.4-168.3176-171.50108.3F297 R298 I347 I358F297-K349 CarbonylContact C-O 3.58Å; F297-K349 WeakPolarHBondContact CA-O 3.36Å; R298-K349 HydrophobicContact CB-CB 4.26Å; R298-K349 PolarHBondContact N-O 3.23Å; R298-K349 PolarHBondContact O-N 2.88Å; I347-K349 HydrophobicContact CG2-CG 4.37Å; K349-I358 HydrophobicContact CB-CG1 4.34Å; K349-I358 HydrophobicContact CD-CD1 4Å; K349-I358 HydrophobicContact CD-CG1 4.18Å; K349-I358 HydrophobicContact CG-CD1 4.28Å; K349-I358 HydrophobicContact CG-CG1 3.93Å; K349-I358 HydrophobicContact CG-CG2 4.15Å
350A95.8Very high93.5Very high0 Ų054.8 Ų54.80%030%0.296CS..EExtended strand (participates in β ladder)trans-109.5132.1174.300000109.7P264 V266 V287 V295 S296 F297 E356 T357P264-A350 HydrophobicContact CG-CB 3.94Å; P264-A350 WeakPolarHBondContact CG-O 3.44Å; V266-A350 HydrophobicContact CG1-CB 4.46Å; V266-A350 HydrophobicContact CG2-CB 3.64Å; V287-A350 HydrophobicContact CG2-CB 3.75Å; V295-A350 HydrophobicContact CG1-CB 3.99Å; S296-A350 CarbonylContact O-C 3.53Å; S296-A350 WeakPolarHBondContact O-CA 3.27Å; F297-A350 HydrophobicContact CD1-CB 4.24Å; F297-A350 HydrophobicContact CE1-CB 4.17Å; A350-E356 CarbonylContact O-C 3.58Å; A350-E356 WeakPolarHBondContact O-CA 3.36Å; A350-T357 PolarHBondContact N-O 3.21Å; A350-T357 PolarHBondContact O-N 3.45Å
351K93.3Very high93.8Very high111 Ų11150 Ų5048%0.48327%0.267SS..EExtended strand (participates in β ladder)trans-132.3128.8-176.7177.4178.2-175.61750111.4S296 G355 E356S296-K351 PolarHBondContact N-O 2.87Å; S296-K351 PolarHBondContact O-N 2.91Å; S296-K351 WeakPolarHBondContact OG-CB 3.46Å; S296-K351 PolarHBondContact OG-O 3.33Å; S296-K351 VanDerWaalsContact OG-O 3.06Å; K351-G355 WeakPolarHBondContact CA-O 3.43Å; K351-G355 WeakPolarHBondContact CG-O 3.37Å; K351-E356 HydrophobicContact CB-CB 4.01Å; K351-E356 HydrophobicContact CG-CB 4.2Å
352N89.7Confident93.8Very high17 Ų1754.2 Ų54.29%0.09128%0.282CS..  trans-110.9-171168.470-5.4000110G262 E293 N354 G355G262-N352 PolarHBondContact O-ND2 3.3Å; E293-N352 PolarHBondContact OE2-ND2 3.27Å; N352-N354 PolarHBondContact O-N 2.95Å; N352-N354 PolarHBondContact OD1-N 3.29Å; N352-G355 PolarHBondContact N-O 2.91Å; N352-G355 PolarHBondContact OD1-N 2.77Å; N352-G355 PolarHBondContact OD1-O 2.8Å; N352-G355 VanDerWaalsContact OD1-O 3.13Å
353I85.8Confident93.8Very high141 Ų14154.5 Ų54.572%0.72328%0.284SS*.SBendtrans-65.7-22.717857.6166.3000113.3
354N85.7Confident93.6Very high64 Ų6455.5 Ų55.534%0.34230%0.3SS..SBendtrans-98-15.9-171.7-60.3-47000113G262 E293 N352G262-N354 WeakPolarHBondContact O-CB 3.45Å; E293-N354 PolarHBondContact OE1-ND2 3.43Å; N352-N354 PolarHBondContact O-N 2.95Å; N352-N354 PolarHBondContact OD1-N 3.29Å
355G89Confident93Very high25 Ų2558.1 Ų58.126%0.25832%0.316SS..  trans164.7-168.8178.600000114.4K351 N352K351-G355 WeakPolarHBondContact CA-O 3.43Å; K351-G355 WeakPolarHBondContact CG-O 3.37Å; N352-G355 PolarHBondContact N-O 2.91Å; N352-G355 PolarHBondContact OD1-N 2.77Å; N352-G355 PolarHBondContact OD1-O 2.8Å; N352-G355 VanDerWaalsContact OD1-O 3.13Å
356E93.4Very high91.9Very high107 Ų10758.9 Ų58.950%0.533%0.327SS..EExtended strand (participates in β ladder)trans-130141.6176.564.5178.2-141.300111.8A350 K351A350-E356 CarbonylContact O-C 3.58Å; A350-E356 WeakPolarHBondContact O-CA 3.36Å; K351-E356 HydrophobicContact CB-CB 4.01Å; K351-E356 HydrophobicContact CG-CB 4.2Å
357T94.8Very high91.7Very high35 Ų3561.8 Ų61.822%0.21534%0.344CS..EExtended strand (participates in β ladder)trans-120.3132.6174.4-61.30000108.6A263 P264 V266 A350 V359A263-T357 VanDerWaalsContact CB-OG1 3.24Å; A263-T357 WeakPolarHBondContact CB-OG1 3.45Å; P264-T357 VanDerWaalsContact O-CB 3.24Å; P264-T357 WeakPolarHBondContact O-CB 3.48Å; P264-T357 PolarHBondContact O-OG1 2.91Å; V266-T357 HydrophobicContact CB-CG2 4.06Å; V266-T357 HydrophobicContact CG2-CG2 3.53Å; A350-T357 PolarHBondContact N-O 3.21Å; A350-T357 PolarHBondContact O-N 3.45Å; T357-V359 HydrophobicContact CG2-CG1 4.3Å
358I96.6Very high91.4Very high81 Ų8163 Ų6342%0.41535%0.351SS..EExtended strand (participates in β ladder)trans-116.8121.9-178.7-55179.2000108.1I347 K349I347-I358 HydrophobicContact CG2-CG2 3.45Å; I347-I358 VanDerWaalsContact CG2-CG2 3.45Å; K349-I358 HydrophobicContact CB-CG1 4.34Å; K349-I358 HydrophobicContact CD-CD1 4Å; K349-I358 HydrophobicContact CD-CG1 4.18Å; K349-I358 HydrophobicContact CG-CD1 4.28Å; K349-I358 HydrophobicContact CG-CG1 3.93Å; K349-I358 HydrophobicContact CG-CG2 4.15Å
359V96.6Very high91Very high32 Ų3266.5 Ų66.519%0.19437%0.371CS..EExtended strand (participates in β ladder)trans-122.9144.1176.9-700000109.8V266 L268 I347 C348 T357V266-V359 HydrophobicContact CB-CG1 4.06Å; V266-V359 HydrophobicContact CB-CG2 4.09Å; V266-V359 HydrophobicContact CG1-CG1 4.4Å; V266-V359 HydrophobicContact CG1-CG2 3.52Å; L268-V359 HydrophobicContact CB-CB 4.27Å; L268-V359 HydrophobicContact CB-CG2 3.8Å; L268-V359 HydrophobicContact CD2-CB 4.41Å; L268-V359 HydrophobicContact CD2-CG2 4.05Å; L268-V359 HydrophobicContact CG-CG2 4.36Å; I347-V359 WeakPolarHBondContact CA-O 3.42Å; C348-V359 HydrophobicContact CB-CG2 3.98Å; C348-V359 PolarHBondContact N-O 3.3Å; C348-V359 PolarHBondContact O-N 3.47Å; T357-V359 HydrophobicContact CG2-CG1 4.3Å
360T96.8Very high90.7Very high78 Ų7866 Ų6648%0.47937%0.373SS..EExtended strand (participates in β ladder)trans-127.6135.4-177.1-56.60000109.8N345 Y346 I347N345-T360 HydrophobicContact CB-CG2 3.86Å; Y346-T360 WeakPolarHBondContact O-CA 3.24Å; I347-T360 HydrophobicContact CG1-CG2 3.95Å
361T95.2Very high90.4Very high34 Ų3470.1 Ų70.121%0.20940%0.397CS..EExtended strand (participates in β ladder)trans-123.4147.3167.5-1690000109.2L268 V283 N345 Y346L268-T361 HydrophobicContact CD2-CG2 3.62Å; L268-T361 HydrophobicContact CG-CG2 3.94Å; V283-T361 HydrophobicContact CG1-CG2 3.94Å; N345-T361 WeakPolarHBondContact CA-O 3.38Å; Y346-T361 PolarHBondContact N-O 3.35Å; Y346-T361 PolarHBondContact O-N 3.46Å
362K93.9Very high90.2Very high151 Ų15167.4 Ų67.466%0.65739%0.391SS*.EExtended strand (participates in β ladder)trans-110.8125.7-180-175.2177.4-179.6-177.10109.4G344 N345G344-K362 WeakPolarHBondContact O-CA 3.24Å; N345-K362 WeakPolarHBondContact OD1-CG 3.07Å
363I92.9Very high90.2Very high8 Ų871 Ų714%0.04141%0.412CS..EExtended strand (participates in β ladder)trans-104.6114.4172.7-53.2-175.4000107.3A270 V275 V281 V283 M338 F343 G344 Y346A270-I363 HydrophobicContact CB-CD1 4.02Å; A270-I363 HydrophobicContact CB-CG1 4.33Å; V275-I363 HydrophobicContact CB-CG2 3.85Å; V275-I363 HydrophobicContact CG1-CG2 4.25Å; V275-I363 HydrophobicContact CG2-CG2 3.67Å; V281-I363 HydrophobicContact CG1-CD1 3.84Å; V283-I363 HydrophobicContact CG2-CD1 3.81Å; M338-I363 HydrophobicContact CE-CG2 3.98Å; F343-I363 HydrophobicContact CD1-CG2 4.2Å; F343-I363 HydrophobicContact CE1-CG2 4.49Å; G344-I363 PolarHBondContact N-O 3.09Å; G344-I363 PolarHBondContact O-N 3.49Å; Y346-I363 HydrophobicContact CD2-CB 4.29Å; Y346-I363 HydrophobicContact CD2-CD1 3.7Å; Y346-I363 HydrophobicContact CD2-CG1 3.78Å; Y346-I363 HydrophobicContact CE2-CB 4.01Å; Y346-I363 HydrophobicContact CE2-CD1 3.58Å; Y346-I363 HydrophobicContact CE2-CG1 3.87Å; Y346-I363 HydrophobicContact CG-CD1 4.32Å
364A87.9Confident90.5Very high62 Ų6265.6 Ų65.651%0.51239%0.389SS..  trans-102.6150.3176.100000110F343 S366F343-A364 VanDerWaalsContact CD1-C 3.47Å; A364-S366 PolarHBondContact O-N 3.42Å
365S81.3Confident91Very high74 Ų7465.8 Ų65.852%0.51739%0.392SS..BIsolated β-bridgetrans-66.8129.1167.4-1740000108.3F343F343-S365 VanDerWaalsContact CD1-N 3.26Å; F343-S365 VanDerWaalsContact CE1-CA 3.45Å
366S73.2Confident91.1Very high102 Ų10269.5 Ų69.571%0.71341%0.405SS*.  trans-73.5016454.90000112.8V275 R276 A364V275-S366 PolarHBondContact O-N 2.93Å; V275-S366 PolarHBondContact O-OG 3.03Å; R276-S366 WeakPolarHBondContact CG-OG 3.47Å; A364-S366 PolarHBondContact O-N 3.42Å

Retrieved 366 of 366 residues in 386.6 ms (Link to these results)