A0A087XHD1_POEFO Loading...

Cytochrome c oxidase assembly protein COX11, mitochondrial

Exerts its effect at some terminal stage of cytochrome c oxidase synthesis, probably by being involved in the insertion of the copper B into subunit I.

AlphaFold DB , UniProt , Accession A0A087XHD1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 252 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
1M37.9Very low36.3Very low233 Ų233169.3 Ų169.3100%1.14885%0.851SS**  0118.60-80.6166.9123.500107.8
2L38.9Very low36.4Very low157 Ų157163.5 Ų163.582%0.82284%0.838SS**  trans47.198.8155.3-67137.4000118
3L34.1Very low36.9Very low136 Ų136160.8 Ų160.871%0.71284%0.837SS**  97.8105.581.9-134.987.6000111.1L5L3-L5 HydrophobicContact CD2-CD1 4.07Å
4P46.8Very low36.7Very low129 Ų129160.2 Ų160.284%0.83884%0.835SS**  trans-85.9137.3169.233.8-28000109.7
5L37.8Very low36.4Very low135 Ų135159.9 Ų159.971%0.70783%0.833SS**  trans-144135.3176.3-109.1159.1000108.2L3L3-L5 HydrophobicContact CD2-CD1 4.07Å
6L37.2Very low36.5Very low147 Ų147159.2 Ų159.277%0.7784%0.838SS**  trans83.288159.4-55.6169.6000117.6
7L34.1Very low36.3Very low170 Ų170154.4 Ų154.489%0.8984%0.836SS**  167.3100.9101.6-115.777.7000109.2
8R33.4Very low36.2Very low253 Ų253153.1 Ų153.196%0.95584%0.839SS**  trans-134.794.8164-142.7-179.6-171.6-136.53.1107.2
9Q35.8Very low36.1Very low192 Ų192151.9 Ų151.990%0.89784%0.836SS**  trans-118.9144.2159.6-81.8-174.1-6.500104.6
10S33.3Very low36.2Very low99 Ų99155.9 Ų155.969%0.69284%0.838SS**  cis-165.8133.76.1174.50000104.7
11F29.8Very low36.1Very low211 Ų211152.6 Ų152.693%0.92583%0.833SS**  trans-165.5109155.4-112.7-79.6000109.1
12S37.2Very low35.9Very low100 Ų100150 Ų15070%0.69982%0.823SS**  trans-65.6154.1165.2-62.30000110.1
13P43.1Very low35.7Very low128 Ų128151.9 Ų151.983%0.83183%0.827SS**  -142.61539829.1-10000115
14L33.9Very low35.4Very low153 Ų153148.3 Ų148.380%0.80182%0.823SS**  trans-65.1158.1168.3-92.4124.5000112.4
15L33.3Very low34.6Very low155 Ų155147.9 Ų147.981%0.81282%0.823SS**  trans82.182.5156.1-69.6145.7000117.3
16T37.2Very low34.4Very low149 Ų149147.5 Ų147.591%0.91483%0.831SS**  trans-145.996.1141-31.40000109.4C18T16-C18 PolarHBondContact O-N 2.77Å
17G32.8Very low34.2Very low77 Ų77148.9 Ų148.979%0.79483%0.834SS**  trans-81.1111.6179.900000112.4
18C35Very low34.5Very low132 Ų132152.2 Ų152.289%0.89284%0.835SS**  trans23.7109.9144.6-92.30000120T16T16-C18 PolarHBondContact O-N 2.77Å
19V35.1Very low34.5Very low131 Ų131146 Ų14679%0.79483%0.825SS**  trans-98.5142.4148.5179.50000108.4
20R36.8Very low34.6Very low230 Ų230144.7 Ų144.787%0.86882%0.823SS**  trans129.9105.3153.9-72.7175.4-169.9-177.43.2110.4
21A34.7Very low34.7Very low88 Ų88148 Ų14873%0.72783%0.832SS**  56.6101.972.100000111.9
22L34.6Very low34.8Very low179 Ų179142.6 Ų142.694%0.93782%0.821SS**  trans-141.6112.6153-84.9176.1000110.8
23H32.9Very low34.8Very low195 Ų195147 Ų14790%0.90383%0.83SS**  trans-58.2154.6151.2-112.492.6000110.6
24G28.1Very low34.6Very low61 Ų61144.2 Ų144.263%0.62983%0.825SS**  trans113.4100.7135.300000117.5
25S30.6Very low35.1Very low121 Ų121144.8 Ų144.885%0.84682%0.823SS**  trans54.3113.7135.762.60000119.6
26S32.5Very low35.5Very low126 Ų126144.2 Ų144.288%0.88182%0.816SS**  -163.5131.6121.2-147.10000111.9
27Q34.6Very low35.8Very low177 Ų177143.3 Ų143.383%0.82781%0.805SS**  trans-65145.9176.4-69.8162.4-35.600112.2
28R40.2Very low36.4Very low239 Ų239146.9 Ų146.990%0.90281%0.805SS**  trans-173.194.7141.2-97.3162.5-155.8-151.56.5106.4
29T32.6Very low36.9Very low123 Ų123149.7 Ų149.776%0.75580%0.797SS**  49.999.5100.7-29.50000112.4
30L38.4Very low37.2Very low164 Ų164153.3 Ų153.386%0.85980%0.796SS**  -174.4120.4111.4-97.7163.7000110.4
31L35.2Very low37.6Very low168 Ų168153.8 Ų153.888%0.8880%0.798SS**  trans-53.3142.7162.9-73143.2000110.6
32S32.4Very low38.4Very low98 Ų98155.8 Ų155.869%0.68580%0.804SS**  175.5136.5121.8-1730000111.3
33Q37.4Very low39.3Very low193 Ų193151.8 Ų151.890%0.90280%0.796SS**  trans70134.7164.7-68.3166.615.800117.1
34G37.5Very low40.4Very low69 Ų69147.6 Ų147.671%0.71179%0.789SS**  cis-179.6139.2-0.600000107.9
35E44.1Very low41.3Very low165 Ų165156.7 Ų156.777%0.77181%0.805SS**  trans6129.3158.7-46.7-173.9116.400119
36H43Very low42.5Very low144 Ų144159 Ų15967%0.66781%0.807SS**  165128.897.1-96.2-72.8000113.6
37L43.8Very low43.5Very low129 Ų129158.8 Ų158.868%0.67580%0.802SS**  trans74.7105133.7-61.6164.8000122.1
38L45.7Very low44.7Very low152 Ų152156.8 Ų156.880%0.79680%0.802SS**  48.2126.5119.1-59.3175.2000118.8
39R43.7Very low45.5Very low192 Ų192156.8 Ų156.873%0.72580%0.802SS**  151.7132.891.4-158.1164.7-169.8-164.35.3113.7
40R42.7Very low46.7Very low207 Ų207157.8 Ų157.878%0.78180%0.803SS**  trans79121.1148.2-86169.3-174.7-158.4-1.9121.8
41R45.1Very low47.7Very low239 Ų239157.8 Ų157.890%0.90280%0.798SS**  trans-84.2165.3152.9-70-177.2166.8-174.3-3.5110.7
42P50.8Low48.9Very low130 Ų130154.5 Ų154.584%0.84479%0.789SS**  -144.2165.298.432.3-13.3000116.1
43A53.4Low50.2Low95 Ų95159.4 Ų159.479%0.78579%0.793SS**  trans-83.9174.2171.100000110.5
44S55.9Low51.3Low108 Ų108156.7 Ų156.776%0.75578%0.778SS**  cis-172.7162.217.845.20000108.3
45R46.8Very low52.5Low252 Ų252156.2 Ų156.295%0.95176%0.764SS**  trans-174.1129.1143-102.3177.6-133.2-1346.5110.2
46L57Low53.7Low169 Ų169156.7 Ų156.789%0.88576%0.758SS**  trans-103.8145.8174.6-93.7139.3000110.2
47P53.3Low54.9Low122 Ų122154 Ų15479%0.79275%0.749SS**  trans-118.9140.9150.733.4-20.3000111.7
48T60.8Low56.2Low134 Ų134153.5 Ų153.582%0.82274%0.743SS**  trans-96.4151.9177.739.90000113.1
49R56.9Low57.6Low239 Ų239150.8 Ų150.890%0.90273%0.727SS**  trans89.789.2146.6-164.6171.9155.1167.4-5.8118
50N57.1Low59.2Low145 Ų145147.1 Ų147.178%0.77572%0.718SS**  trans-148.721.7159.6-140.57.8000114.6
51H60Low60.9Low164 Ų164142.2 Ų142.276%0.75970%0.704SS**Hα-helixtrans-79.6-23-164.3-156.6-72.3000115.3
52S59.3Low62.5Low99 Ų99138.5 Ų138.569%0.69269%0.69SS**Hα-helixtrans-76.6-36.7-170.2179.90000113.8
53R59Low64Low200 Ų200139.3 Ų139.376%0.75568%0.676SS**Hα-helixtrans-73.5-39.1-179-153.4173.3-174.8175.71112.3S55 R56R53-S55 PolarHBondContact O-N 3.25Å; R53-R56 PolarHBondContact O-N 2.8Å
54K60.6Low65.5Low137 Ų137139 Ų13960%0.59667%0.665SS**Hα-helixtrans-60.8-31.5177.4-167.4176.3-178.6-178.80113.1Q58K54-Q58 WeakPolarHBondContact O-CB 3.39Å; K54-Q58 VanDerWaalsContact O-CG 3.25Å; K54-Q58 WeakPolarHBondContact O-CG 3.27Å; K54-Q58 PolarHBondContact O-N 3.41Å
55S64.1Low66.9Low59 Ų59141.1 Ų141.141%0.41366%0.656SS.*Hα-helixtrans-69.3-32-179.8-169.30000113.4R53 E59R53-S55 PolarHBondContact O-N 3.25Å; S55-E59 PolarHBondContact O-N 3.12Å
56R68.3Low69Low174 Ų174132.5 Ų132.566%0.65763%0.629SS**Hα-helixtrans-77.8-43.5-178.4-70.6-178.662.3176.5-1.8111.8R53 Q58 E59 E60R53-R56 PolarHBondContact O-N 2.8Å; R56-Q58 VanDerWaalsContact C-N 3.3Å; R56-Q58 PolarHBondContact O-N 3.02Å; R56-E59 PolarHBondContact O-N 2.63Å; R56-E59 VanDerWaalsContact O-N 3.15Å; R56-E60 PolarHBondContact O-N 2.95Å; R56-E60 VanDerWaalsContact O-N 3.09Å
57D69.6Low70.5Confident89 Ų89131.5 Ų131.548%0.47662%0.617SS.*Hα-helixtrans-63.6-38.1177.3-57.6-19.8000111.2E59 E60 E61D57-E59 VanDerWaalsContact C-N 3.33Å; D57-E59 PolarHBondContact O-N 2.93Å; D57-E60 PolarHBondContact O-N 3.32Å; D57-E61 PolarHBondContact O-N 2.99Å; D57-E61 VanDerWaalsContact O-N 3.09Å
58Q70.9Confident72.3Confident117 Ų117128.9 Ų128.955%0.54760%0.599SS.*Hα-helixtrans-64.5-34.5174.6-77.4-173.9-22.400113.2K54 R56 W62K54-Q58 WeakPolarHBondContact O-CB 3.39Å; K54-Q58 VanDerWaalsContact O-CG 3.25Å; K54-Q58 WeakPolarHBondContact O-CG 3.27Å; K54-Q58 PolarHBondContact O-N 3.41Å; R56-Q58 VanDerWaalsContact C-N 3.3Å; R56-Q58 PolarHBondContact O-N 3.02Å; Q58-W62 WeakPolarHBondContact O-CB 3.36Å; Q58-W62 PolarHBondContact O-N 3Å; Q58-W62 VanDerWaalsContact O-N 3.14Å
59E75.2Confident73.9Confident95 Ų95126.3 Ų126.344%0.44458%0.583SS.*Hα-helixtrans-77-33179.4-165.1165.715900112.4S55 R56 D57 W62 R63S55-E59 PolarHBondContact O-N 3.12Å; R56-E59 PolarHBondContact O-N 2.63Å; R56-E59 VanDerWaalsContact O-N 3.15Å; D57-E59 VanDerWaalsContact C-N 3.33Å; D57-E59 PolarHBondContact O-N 2.93Å; E59-W62 PolarHBondContact O-N 3.28Å; E59-R63 WeakPolarHBondContact O-CB 3.06Å; E59-R63 VanDerWaalsContact O-CG 3.25Å; E59-R63 WeakPolarHBondContact O-CG 3.4Å; E59-R63 PolarHBondContact O-N 2.84Å; E59-R63 IonicContact OE1-CZ 3.91Å; E59-R63 IonicContact OE1-NE 3.04Å; E59-R63 IonicContact OE1-NH2 3.53Å; E59-R63 PolarHBondContact OE1-NH2 3.05Å
60E76.9Confident75.7Confident115 Ų115120.8 Ų120.854%0.53757%0.571SS.*Hα-helixtrans-69-40.6174.2-70.4179.7-168.600112.1R56 D57 R63 T64R56-E60 PolarHBondContact O-N 2.95Å; R56-E60 VanDerWaalsContact O-N 3.09Å; D57-E60 PolarHBondContact O-N 3.32Å; E60-R63 PolarHBondContact O-N 3.37Å; E60-T64 WeakPolarHBondContact O-CB 3.23Å; E60-T64 PolarHBondContact O-N 3.09Å; E60-T64 PolarHBondContact O-OG1 2.88Å
61E77.9Confident77.5Confident105 Ų105118.4 Ų118.449%0.49156%0.561SS.*Hα-helixtrans-61.8-44.2171.6-77.5-170.5-172.200112D57 T64 R65D57-E61 PolarHBondContact O-N 2.99Å; D57-E61 VanDerWaalsContact O-N 3.09Å; E61-T64 PolarHBondContact O-N 2.68Å; E61-R65 WeakPolarHBondContact O-CG 3.32Å; E61-R65 PolarHBondContact O-N 2.98Å; E61-R65 IonicContact OE2-CZ 3.66Å; E61-R65 IonicContact OE2-NH2 2.82Å; E61-R65 PolarHBondContact OE2-NH2 3.4Å
62W78.5Confident79.2Confident161 Ų161118.8 Ų118.861%0.6156%0.557SS**Hα-helixtrans-62.8-43.9177.9-178.3-103.6000112.2Q58 E59 T64 R65 N66Q58-W62 WeakPolarHBondContact O-CB 3.36Å; Q58-W62 PolarHBondContact O-N 3Å; Q58-W62 VanDerWaalsContact O-N 3.14Å; E59-W62 PolarHBondContact O-N 3.28Å; W62-T64 VanDerWaalsContact C-N 3.34Å; W62-T64 PolarHBondContact O-N 3.03Å; W62-R65 PolarHBondContact O-N 2.83Å; W62-N66 PolarHBondContact NE1-ND2 2.99Å; W62-N66 WeakPolarHBondContact O-CB 3.02Å; W62-N66 PolarHBondContact O-N 2.75Å; W62-N66 PolarHBondContact O-OD1 3.01Å
63R83.1Confident80.9Confident147 Ų147119.4 Ų119.456%0.55555%0.552SS**Hα-helixtrans-63.3-39.8176.5-74.7174.8-173.8-1533.6112.2E59 E60 K67E59-R63 WeakPolarHBondContact O-CB 3.06Å; E59-R63 VanDerWaalsContact O-CG 3.25Å; E59-R63 WeakPolarHBondContact O-CG 3.4Å; E59-R63 PolarHBondContact O-N 2.84Å; E59-R63 IonicContact OE1-CZ 3.91Å; E59-R63 IonicContact OE1-NE 3.04Å; E59-R63 IonicContact OE1-NH2 3.53Å; E59-R63 PolarHBondContact OE1-NH2 3.05Å; E60-R63 PolarHBondContact O-N 3.37Å; R63-K67 WeakPolarHBondContact O-CB 3.27Å; R63-K67 VanDerWaalsContact O-CG 3.31Å; R63-K67 WeakPolarHBondContact O-CG 3.15Å; R63-K67 PolarHBondContact O-N 2.81Å
64T84.4Confident82.6Confident89 Ų89112.6 Ų112.655%0.54654%0.538SS..Hα-helixtrans-67.4-45.1179.1-54.20000110.9E60 E61 W62 N66 K67 T68E60-T64 WeakPolarHBondContact O-CB 3.23Å; E60-T64 PolarHBondContact O-N 3.09Å; E60-T64 PolarHBondContact O-OG1 2.88Å; E61-T64 PolarHBondContact O-N 2.68Å; W62-T64 VanDerWaalsContact C-N 3.34Å; W62-T64 PolarHBondContact O-N 3.03Å; T64-N66 PolarHBondContact O-N 2.83Å; T64-K67 PolarHBondContact O-N 2.76Å; T64-T68 PolarHBondContact O-N 3.08Å; T64-T68 PolarHBondContact O-OG1 2.81Å; T64-T68 VanDerWaalsContact O-OG1 3.12Å
65R84.8Confident84.3Confident151 Ų151109.1 Ų109.157%0.5754%0.535SS*.Hα-helixtrans-61.5-43.9175.5-69.9178-169.2166.313.8112.2E61 W62 K67 T68 V69E61-R65 WeakPolarHBondContact O-CG 3.32Å; E61-R65 PolarHBondContact O-N 2.98Å; E61-R65 IonicContact OE2-CZ 3.66Å; E61-R65 IonicContact OE2-NH2 2.82Å; E61-R65 PolarHBondContact OE2-NH2 3.4Å; W62-R65 PolarHBondContact O-N 2.83Å; R65-K67 PolarHBondContact O-N 2.92Å; R65-T68 PolarHBondContact O-N 2.88Å; R65-V69 VanDerWaalsContact O-CG2 3.3Å; R65-V69 WeakPolarHBondContact O-CG2 3.12Å; R65-V69 PolarHBondContact O-N 2.79Å
66N90.6Very high85.9Confident71 Ų71109.4 Ų109.438%0.3854%0.541SS..Hα-helixtrans-65.5-38.4178.7-71.3-5.1000112.5W62 T64 V69 L70W62-N66 PolarHBondContact NE1-ND2 2.99Å; W62-N66 WeakPolarHBondContact O-CB 3.02Å; W62-N66 PolarHBondContact O-N 2.75Å; W62-N66 PolarHBondContact O-OD1 3.01Å; T64-N66 PolarHBondContact O-N 2.83Å; N66-V69 PolarHBondContact O-N 3.19Å; N66-L70 VanDerWaalsContact O-CB 3.27Å; N66-L70 WeakPolarHBondContact O-CB 3.37Å; N66-L70 PolarHBondContact O-N 2.95Å
67K90.1Very high87.2Confident149 Ų149102.7 Ų102.765%0.64853%0.526SS*.Hα-helixtrans-60.7-49.2173.1-77.2176.5179.3-1770110.7R63 T64 R65 V69 L70 T71R63-K67 WeakPolarHBondContact O-CB 3.27Å; R63-K67 VanDerWaalsContact O-CG 3.31Å; R63-K67 WeakPolarHBondContact O-CG 3.15Å; R63-K67 PolarHBondContact O-N 2.81Å; T64-K67 PolarHBondContact O-N 2.76Å; R65-K67 PolarHBondContact O-N 2.92Å; K67-V69 PolarHBondContact O-N 3.07Å; K67-L70 PolarHBondContact O-N 2.88Å; K67-T71 PolarHBondContact O-N 3.3Å; K67-T71 PolarHBondContact O-OG1 2.94Å
68T90.9Very high88.5Confident67 Ų67103.5 Ų103.541%0.41153%0.534SS..Hα-helixtrans-58-47.9177.6-60.90000112T64 R65 L70 T71 Y72T64-T68 PolarHBondContact O-N 3.08Å; T64-T68 PolarHBondContact O-OG1 2.81Å; T64-T68 VanDerWaalsContact O-OG1 3.12Å; R65-T68 PolarHBondContact O-N 2.88Å; T68-L70 PolarHBondContact O-N 2.94Å; T68-T71 PolarHBondContact O-N 2.77Å; T68-Y72 HydrophobicContact CG2-CD2 3.79Å; T68-Y72 HydrophobicContact CG2-CE2 3.38Å; T68-Y72 WeakPolarHBondContact O-CD2 3.37Å; T68-Y72 PolarHBondContact O-N 2.76Å; T68-Y72 VanDerWaalsContact O-N 3.12Å
69V93.5Very high89.8Confident80 Ų8099.6 Ų99.649%0.48553%0.525SS..Hα-helixtrans-61.5-43.2177.9171.20000111.4R65 N66 K67 T71 Y72 I73R65-V69 VanDerWaalsContact O-CG2 3.3Å; R65-V69 WeakPolarHBondContact O-CG2 3.12Å; R65-V69 PolarHBondContact O-N 2.79Å; N66-V69 PolarHBondContact O-N 3.19Å; K67-V69 PolarHBondContact O-N 3.07Å; V69-T71 VanDerWaalsContact C-N 3.33Å; V69-T71 PolarHBondContact O-N 2.85Å; V69-Y72 PolarHBondContact O-N 2.97Å; V69-I73 HydrophobicContact CG1-CD1 3.76Å; V69-I73 HydrophobicContact CG1-CG1 4.41Å; V69-I73 WeakPolarHBondContact O-CG1 3.4Å; V69-I73 PolarHBondContact O-N 3.34Å
70L94.2Very high90.8Very high122 Ų122101.5 Ų101.564%0.63954%0.536SS*.Hα-helixtrans-61-42.2177.7-174.569.6000111.5N66 K67 T68 Y72 I73 A74N66-L70 VanDerWaalsContact O-CB 3.27Å; N66-L70 WeakPolarHBondContact O-CB 3.37Å; N66-L70 PolarHBondContact O-N 2.95Å; K67-L70 PolarHBondContact O-N 2.88Å; T68-L70 PolarHBondContact O-N 2.94Å; L70-Y72 PolarHBondContact O-N 2.78Å; L70-I73 PolarHBondContact O-N 2.88Å; L70-A74 WeakPolarHBondContact O-CB 3.49Å; L70-A74 PolarHBondContact O-N 3.16Å
71T94.7Very high91.7Very high95 Ų95101.9 Ų101.958%0.58354%0.54SS*.Hα-helixtrans-63.6-41.3177.8-39.20000111.8K67 T68 V69 A74 A75K67-T71 PolarHBondContact O-N 3.3Å; K67-T71 PolarHBondContact O-OG1 2.94Å; T68-T71 PolarHBondContact O-N 2.77Å; V69-T71 VanDerWaalsContact C-N 3.33Å; V69-T71 PolarHBondContact O-N 2.85Å; T71-A74 PolarHBondContact O-N 2.85Å; T71-A75 WeakPolarHBondContact O-CB 3.44Å; T71-A75 PolarHBondContact O-N 2.87Å
72Y95.8Very high92.6Very high172 Ų17298.9 Ų98.968%0.67554%0.537SS*.Hα-helixtrans-65.3-43.1176.4-77-66000112.5T68 V69 L70 A75 A76T68-Y72 HydrophobicContact CG2-CD2 3.79Å; T68-Y72 HydrophobicContact CG2-CE2 3.38Å; T68-Y72 WeakPolarHBondContact O-CD2 3.37Å; T68-Y72 PolarHBondContact O-N 2.76Å; T68-Y72 VanDerWaalsContact O-N 3.12Å; V69-Y72 PolarHBondContact O-N 2.97Å; L70-Y72 PolarHBondContact O-N 2.78Å; Y72-A75 PolarHBondContact O-N 3.45Å; Y72-A76 WeakPolarHBondContact O-CB 3.18Å; Y72-A76 PolarHBondContact O-N 2.89Å
73I95.9Very high93.4Very high113 Ų11397.4 Ų97.458%0.57954%0.541SS*.Hα-helixtrans-64-43.1177.2-67.5171.1000110.4V69 L70 A76 G77V69-I73 HydrophobicContact CG1-CD1 3.76Å; V69-I73 HydrophobicContact CG1-CG1 4.41Å; V69-I73 WeakPolarHBondContact O-CG1 3.4Å; V69-I73 PolarHBondContact O-N 3.34Å; L70-I73 PolarHBondContact O-N 2.88Å; I73-A76 PolarHBondContact O-N 2.83Å; I73-G77 PolarHBondContact O-N 2.9Å
74A95.4Very high94Very high56 Ų5693.9 Ų93.946%0.46354%0.538SS..Hα-helixtrans-62.4-45.117700000111.8L70 T71 A76 G77 V78L70-A74 WeakPolarHBondContact O-CB 3.49Å; L70-A74 PolarHBondContact O-N 3.16Å; T71-A74 PolarHBondContact O-N 2.85Å; A74-A76 PolarHBondContact O-N 2.78Å; A74-G77 PolarHBondContact O-N 2.78Å; A74-V78 WeakPolarHBondContact O-CG2 3.38Å; A74-V78 PolarHBondContact O-N 3.3Å
75A96.3Very high94.5Very high64 Ų6498.9 Ų98.953%0.52955%0.549SS..Hα-helixtrans-62.4-42.2176.700000112.2T71 Y72 V78 G79T71-A75 WeakPolarHBondContact O-CB 3.44Å; T71-A75 PolarHBondContact O-N 2.87Å; Y72-A75 PolarHBondContact O-N 3.45Å; A75-V78 PolarHBondContact O-N 2.81Å; A75-G79 PolarHBondContact O-N 3.41Å
76A96.4Very high95Very high65 Ų6594 Ų9454%0.53754%0.54SS..Hα-helixtrans-63.4-41175.200000112Y72 I73 A74 G79 M80Y72-A76 WeakPolarHBondContact O-CB 3.18Å; Y72-A76 PolarHBondContact O-N 2.89Å; I73-A76 PolarHBondContact O-N 2.83Å; A74-A76 PolarHBondContact O-N 2.78Å; A76-G79 PolarHBondContact O-N 3.07Å; A76-M80 WeakPolarHBondContact O-CB 3.4Å; A76-M80 PolarHBondContact O-N 3.03Å
77G96.9Very high95.2Very high33 Ų3393.6 Ų93.634%0.3454%0.543SS..Hα-helixtrans-61.9-48.3176.300000112.6I73 A74 G79 M80 I81I73-G77 PolarHBondContact O-N 2.9Å; A74-G77 PolarHBondContact O-N 2.78Å; G77-G79 VanDerWaalsContact C-N 3.33Å; G77-G79 PolarHBondContact O-N 2.94Å; G77-M80 PolarHBondContact O-N 3.01Å; G77-I81 WeakPolarHBondContact O-CG1 3.24Å; G77-I81 PolarHBondContact O-N 3.01Å; G77-I81 VanDerWaalsContact O-N 3.1Å
78V96.7Very high95.2Very high107 Ų10790.1 Ų90.165%0.64853%0.534SS*.Hα-helixtrans-62.8-41.4176.3175.60000111.1A74 A75 M80 I81 G82A74-V78 WeakPolarHBondContact O-CG2 3.38Å; A74-V78 PolarHBondContact O-N 3.3Å; A75-V78 PolarHBondContact O-N 2.81Å; V78-M80 PolarHBondContact O-N 3.09Å; V78-I81 PolarHBondContact O-N 2.91Å; V78-G82 PolarHBondContact O-N 3.32Å
79G96.9Very high95.1Very high35 Ų3590 Ų9036%0.36154%0.535SS..Hα-helixtrans-59.9-43.5175.600000113A75 A76 G77 G82 L83A75-G79 PolarHBondContact O-N 3.41Å; A76-G79 PolarHBondContact O-N 3.07Å; G77-G79 VanDerWaalsContact C-N 3.33Å; G77-G79 PolarHBondContact O-N 2.94Å; G79-G82 PolarHBondContact O-N 2.82Å; G79-L83 WeakPolarHBondContact O-CB 3.38Å; G79-L83 WeakPolarHBondContact O-CG 3.45Å; G79-L83 PolarHBondContact O-N 2.89Å
80M96.8Very high94.9Very high135 Ų13592.1 Ų92.167%0.66554%0.543SS*.Hα-helixtrans-65-40.2178.4-173.7176.2-78.500112.3A76 G77 V78 S84A76-M80 WeakPolarHBondContact O-CB 3.4Å; A76-M80 PolarHBondContact O-N 3.03Å; G77-M80 PolarHBondContact O-N 3.01Å; V78-M80 PolarHBondContact O-N 3.09Å; M80-S84 WeakPolarHBondContact O-CB 3.31Å; M80-S84 PolarHBondContact O-N 3.05Å; M80-S84 PolarHBondContact O-OG 3.14Å
81I96.5Very high94.5Very high123 Ų12393.7 Ų93.763%0.63154%0.541SS*.Hα-helixtrans-66.3-44.9175.6-65.2167.6000110.4G77 V78 L83 S84 Y85G77-I81 WeakPolarHBondContact O-CG1 3.24Å; G77-I81 PolarHBondContact O-N 3.01Å; G77-I81 VanDerWaalsContact O-N 3.1Å; V78-I81 PolarHBondContact O-N 2.91Å; I81-L83 PolarHBondContact O-N 1.98Å; I81-S84 PolarHBondContact O-N 3.03Å; I81-Y85 PolarHBondContact O-N 2.88Å
82G96.3Very high93.9Very high41 Ų4197.1 Ų97.142%0.42354%0.543SS..Hα-helixtrans-60-45.3177.400000112.8V78 G79 S84 Y85 A86V78-G82 PolarHBondContact O-N 3.32Å; G79-G82 PolarHBondContact O-N 2.82Å; G82-S84 VanDerWaalsContact C-N 3.35Å; G82-S84 PolarHBondContact O-N 3.1Å; G82-Y85 PolarHBondContact O-N 2.98Å; G82-A86 WeakPolarHBondContact O-CB 3.41Å; G82-A86 PolarHBondContact O-N 2.82Å
83L95.5Very high93.3Very high131 Ų13194.2 Ų94.269%0.68654%0.539SS*.Hα-helixtrans-64-39.8176.5-73.8172.1000112.2G79 I81 A86 S87G79-L83 WeakPolarHBondContact O-CB 3.38Å; G79-L83 WeakPolarHBondContact O-CG 3.45Å; G79-L83 PolarHBondContact O-N 2.89Å; I81-L83 PolarHBondContact O-N 1.98Å; L83-A86 PolarHBondContact O-N 2.87Å; L83-S87 PolarHBondContact O-N 2.75Å
84S95.6Very high92.7Very high73 Ų7395.5 Ų95.551%0.5154%0.537SS..Hα-helixtrans-62.4-44.8177.1-58.30000111.2M80 I81 G82 S87M80-S84 WeakPolarHBondContact O-CB 3.31Å; M80-S84 PolarHBondContact O-N 3.05Å; M80-S84 PolarHBondContact O-OG 3.14Å; I81-S84 PolarHBondContact O-N 3.03Å; G82-S84 VanDerWaalsContact C-N 3.35Å; G82-S84 PolarHBondContact O-N 3.1Å; S84-S87 PolarHBondContact O-N 2.98Å; S84-S87 PolarHBondContact O-OG 2.93Å
85Y95.2Very high92Very high194 Ų19493.5 Ų93.576%0.76152%0.52SS*.Hα-helixtrans-67.8-38.5177.2-172.5-99.2000112.8I81 G82 S87 P89I81-Y85 PolarHBondContact O-N 2.88Å; G82-Y85 PolarHBondContact O-N 2.98Å; Y85-S87 VanDerWaalsContact C-N 3.32Å; Y85-S87 PolarHBondContact O-N 3.36Å; Y85-P89 WeakPolarHBondContact O-CD 3.37Å
86A95.3Very high91Very high47 Ų4796.3 Ų96.339%0.38852%0.522SS..Hα-helixtrans-72.3-21.7178.400000113.8G82 L83 V88 P89 L90G82-A86 WeakPolarHBondContact O-CB 3.41Å; G82-A86 PolarHBondContact O-N 2.82Å; L83-A86 PolarHBondContact O-N 2.87Å; A86-V88 VanDerWaalsContact C-N 3.32Å; A86-V88 PolarHBondContact O-N 3.25Å; A86-P89 VanDerWaalsContact O-CD 3.27Å; A86-P89 WeakPolarHBondContact O-CD 3.36Å; A86-P89 WeakPolarHBondContact O-CG 3.49Å; A86-L90 WeakPolarHBondContact O-CB 3.47Å; A86-L90 PolarHBondContact O-N 2.94Å
87S94.1Very high90.2Very high64 Ų6497.4 Ų97.445%0.44853%0.531SS..Hα-helixtrans-61-38.2-178.171.10000113.3L83 S84 Y85 L90 Y91L83-S87 PolarHBondContact O-N 2.75Å; S84-S87 PolarHBondContact O-N 2.98Å; S84-S87 PolarHBondContact O-OG 2.93Å; Y85-S87 VanDerWaalsContact C-N 3.32Å; Y85-S87 PolarHBondContact O-N 3.36Å; S87-L90 PolarHBondContact O-N 2.94Å; S87-Y91 WeakPolarHBondContact O-CB 3.19Å; S87-Y91 PolarHBondContact O-N 2.85Å
88V91.1Very high89.2Confident75 Ų7598.1 Ų98.146%0.45553%0.529SS..Hα-helixtrans-64.1-55.5-177.1178.30000112.5A86 L90 Y91 R92A86-V88 VanDerWaalsContact C-N 3.32Å; A86-V88 PolarHBondContact O-N 3.25Å; V88-L90 VanDerWaalsContact C-N 3.31Å; V88-L90 PolarHBondContact O-N 2.96Å; V88-Y91 PolarHBondContact O-N 3.4Å; V88-R92 WeakPolarHBondContact O-CG 3.39Å; V88-R92 PolarHBondContact O-N 3.46Å
89P88Confident87.8Confident65 Ų6594.3 Ų94.342%0.42251%0.511SS..Hα-helixtrans-65.4-34.1177.325.1-34.3000112.4Y85 A86 Y91 R92 L93Y85-P89 WeakPolarHBondContact O-CD 3.37Å; A86-P89 VanDerWaalsContact O-CD 3.27Å; A86-P89 WeakPolarHBondContact O-CD 3.36Å; A86-P89 WeakPolarHBondContact O-CG 3.49Å; P89-Y91 VanDerWaalsContact C-N 3.34Å; P89-Y91 PolarHBondContact O-N 2.88Å; P89-R92 PolarHBondContact O-N 3.38Å; P89-L93 WeakPolarHBondContact O-CG 3.22Å; P89-L93 PolarHBondContact O-N 3.07Å
90L89.1Confident86.2Confident125 Ų12598 Ų9865%0.65452%0.522SS*.Hα-helixtrans-63.8-41176.4-157.2104000111.5A86 S87 V88 L93 Y94A86-L90 WeakPolarHBondContact O-CB 3.47Å; A86-L90 PolarHBondContact O-N 2.94Å; S87-L90 PolarHBondContact O-N 2.94Å; V88-L90 VanDerWaalsContact C-N 3.31Å; V88-L90 PolarHBondContact O-N 2.96Å; L90-L93 PolarHBondContact O-N 2.91Å; L90-Y94 WeakPolarHBondContact O-CB 3.47Å; L90-Y94 PolarHBondContact O-N 3.29Å
91Y85.7Confident84.3Confident154 Ų15494 Ų9460%0.60452%0.516SS*.Hα-helixtrans-64.2-42.5174.2-176.4-103.5000111.6S87 V88 P89 L93 Y94 C95S87-Y91 WeakPolarHBondContact O-CB 3.19Å; S87-Y91 PolarHBondContact O-N 2.85Å; V88-Y91 PolarHBondContact O-N 3.4Å; P89-Y91 VanDerWaalsContact C-N 3.34Å; P89-Y91 PolarHBondContact O-N 2.88Å; Y91-L93 PolarHBondContact O-N 3.3Å; Y91-Y94 PolarHBondContact O-N 2.85Å; Y91-C95 WeakPolarHBondContact CE1-SG 3.3Å; Y91-C95 WeakPolarHBondContact O-CB 3.49Å; Y91-C95 PolarHBondContact O-N 3.34Å; Y91-C95 PolarHBondContact O-SG 2.93Å; Y91-C95 VanDerWaalsContact O-SG 3.36Å
92R81.9Confident82.3Confident168 Ų16890.1 Ų90.163%0.63451%0.506SS*.Hα-helixtrans-60-44.9175.9-71.9179.3-179.6170.5-0.1112.3V88 P89 Y94 C95 Q96V88-R92 WeakPolarHBondContact O-CG 3.39Å; V88-R92 PolarHBondContact O-N 3.46Å; P89-R92 PolarHBondContact O-N 3.38Å; R92-Y94 VanDerWaalsContact C-N 3.33Å; R92-Y94 PolarHBondContact O-N 3.04Å; R92-C95 PolarHBondContact O-N 3.35Å; R92-Q96 WeakPolarHBondContact O-CB 3.46Å; R92-Q96 VanDerWaalsContact O-CG 3.29Å; R92-Q96 WeakPolarHBondContact O-CG 3.23Å; R92-Q96 PolarHBondContact O-N 3.23Å
93L83.6Confident79.9Confident111 Ų11192.2 Ų92.258%0.58151%0.511SS*.Hα-helixtrans-62.8-40.3176.4-74.3167.5000111.8P89 L90 Y91 Q96 A97P89-L93 WeakPolarHBondContact O-CG 3.22Å; P89-L93 PolarHBondContact O-N 3.07Å; L90-L93 PolarHBondContact O-N 2.91Å; Y91-L93 PolarHBondContact O-N 3.3Å; L93-Q96 PolarHBondContact O-N 3.13Å; L93-A97 WeakPolarHBondContact O-CB 3.43Å; L93-A97 PolarHBondContact O-N 3.21Å
94Y84.1Confident77.6Confident139 Ų13990.7 Ų90.755%0.54552%0.517SS..Hα-helixtrans-64.5-45.9175.1-179.5-92.5000112L90 Y91 R92 Q96 A97 T98L90-Y94 WeakPolarHBondContact O-CB 3.47Å; L90-Y94 PolarHBondContact O-N 3.29Å; Y91-Y94 PolarHBondContact O-N 2.85Å; R92-Y94 VanDerWaalsContact C-N 3.33Å; R92-Y94 PolarHBondContact O-N 3.04Å; Y94-Q96 VanDerWaalsContact C-N 3.32Å; Y94-Q96 PolarHBondContact O-N 3.28Å; Y94-A97 PolarHBondContact O-N 2.76Å; Y94-T98 HydrophobicContact CD1-CG2 4.43Å; Y94-T98 HydrophobicContact CD2-CG2 4.23Å; Y94-T98 HydrophobicContact CE1-CG2 4.04Å; Y94-T98 HydrophobicContact CE2-CG2 3.83Å; Y94-T98 WeakPolarHBondContact O-CB 3.47Å; Y94-T98 WeakPolarHBondContact O-CG2 3Å; Y94-T98 PolarHBondContact O-N 2.85Å; Y94-T98 PolarHBondContact O-OG1 3.41Å
95C79.7Confident75.3Confident15 Ų1593.1 Ų93.110%0.10153%0.529CS..Hα-helixtrans-62.8-37.8176.9-73.30000112.3Y91 R92 G99 L100Y91-C95 WeakPolarHBondContact CE1-SG 3.3Å; Y91-C95 WeakPolarHBondContact O-CB 3.49Å; Y91-C95 PolarHBondContact O-N 3.34Å; Y91-C95 PolarHBondContact O-SG 2.93Å; Y91-C95 VanDerWaalsContact O-SG 3.36Å; R92-C95 PolarHBondContact O-N 3.35Å; C95-G99 WeakPolarHBondContact O-CA 3.09Å; C95-G99 PolarHBondContact O-N 3.49Å; C95-L100 WeakPolarHBondContact CB-O 3.25Å; C95-L100 PolarHBondContact O-N 3.39Å; C95-L100 PolarHBondContact SG-O 3.4Å
96Q75.9Confident72.8Confident122 Ų12289.2 Ų89.257%0.5754%0.536SS*.Hα-helixtrans-66-44.6173.8-76.6176.3-27.200112.1R92 L93 Y94 T98 T103R92-Q96 WeakPolarHBondContact O-CB 3.46Å; R92-Q96 VanDerWaalsContact O-CG 3.29Å; R92-Q96 WeakPolarHBondContact O-CG 3.23Å; R92-Q96 PolarHBondContact O-N 3.23Å; L93-Q96 PolarHBondContact O-N 3.13Å; Y94-Q96 VanDerWaalsContact C-N 3.32Å; Y94-Q96 PolarHBondContact O-N 3.28Å; Q96-T98 VanDerWaalsContact C-N 3.35Å; Q96-T98 PolarHBondContact O-N 3.34Å; Q96-T103 HydrophobicContact CG-CG2 3.61Å
97A78.4Confident70.3Confident88 Ų8888.8 Ų88.873%0.72754%0.537SS*.Hα-helixtrans-70.9-29.7-179.100000113.4L93 Y94L93-A97 WeakPolarHBondContact O-CB 3.43Å; L93-A97 PolarHBondContact O-N 3.21Å; Y94-A97 PolarHBondContact O-N 2.76Å
98T77.6Confident68Low48 Ų4893.6 Ų93.629%0.29455%0.552SS.*Hα-helixtrans-101.6-9.7-176.858.70000114.1Y94 Q96 L100Y94-T98 HydrophobicContact CD1-CG2 4.43Å; Y94-T98 HydrophobicContact CD2-CG2 4.23Å; Y94-T98 HydrophobicContact CE1-CG2 4.04Å; Y94-T98 HydrophobicContact CE2-CG2 3.83Å; Y94-T98 WeakPolarHBondContact O-CB 3.47Å; Y94-T98 WeakPolarHBondContact O-CG2 3Å; Y94-T98 PolarHBondContact O-N 2.85Å; Y94-T98 PolarHBondContact O-OG1 3.41Å; Q96-T98 VanDerWaalsContact C-N 3.35Å; Q96-T98 PolarHBondContact O-N 3.34Å; T98-L100 PolarHBondContact O-N 3.35Å
99G65.9Low66Low27 Ų2793.9 Ų93.928%0.27855%0.551SS.*  trans69.92.1-176.300000114.5C95 G101C95-G99 WeakPolarHBondContact O-CA 3.09Å; C95-G99 PolarHBondContact O-N 3.49Å; G99-G101 VanDerWaalsContact C-N 3.33Å; G99-G101 PolarHBondContact O-N 3.47Å
100L63.9Low64.3Low113 Ų11394.7 Ų94.759%0.59256%0.555SS**THydrogen-bonded Turntrans-78.379.8176.2-83.3138000109.5C95 T98C95-L100 WeakPolarHBondContact CB-O 3.25Å; C95-L100 PolarHBondContact O-N 3.39Å; C95-L100 PolarHBondContact SG-O 3.4Å; T98-L100 PolarHBondContact O-N 3.35Å
101G57.6Low62.4Low51 Ų5194.8 Ų94.853%0.52656%0.556SS.*THydrogen-bonded Turntrans160.7-3.117300000117.1G99G99-G101 VanDerWaalsContact C-N 3.33Å; G99-G101 PolarHBondContact O-N 3.47Å
102G54.9Low60.7Low41 Ų4192.2 Ų92.242%0.42355%0.549SS..  trans5377.2179.400000110.5A104G102-A104 PolarHBondContact O-N 2.97Å
103T45.7Very low59.4Low85 Ų8586.4 Ų86.452%0.52153%0.532SS..  trans-54.1113.8177.241.50000109.3Q96 V105Q96-T103 HydrophobicContact CG-CG2 3.61Å; T103-V105 PolarHBondContact O-N 3.29Å
104A46.3Very low58Low99 Ų9990 Ų9082%0.81855%0.546SS*.  trans-59.594.516200000107G102 A106G102-A104 PolarHBondContact O-N 2.97Å; A104-A106 PolarHBondContact O-N 2.86Å
105V47.1Very low56.5Low125 Ų12589 Ų8976%0.75856%0.555SS**  trans-58.8111.4157.6-135.40000103.9T103 G107T103-V105 PolarHBondContact O-N 3.29Å; V105-G107 PolarHBondContact O-N 3.37Å
106A42.9Very low55.2Low111 Ų11190.1 Ų90.192%0.91756%0.559SS**SBendtrans-66.587171.300000106.8A104A104-A106 PolarHBondContact O-N 2.86Å
107G43.4Very low54.2Low39 Ų3993 Ų9340%0.40257%0.569SS.*  trans165.690.5-17400000109.5V105 D109V105-G107 PolarHBondContact O-N 3.37Å; G107-D109 PolarHBondContact O-N 2.86Å
108H44.5Very low53.2Low164 Ų16491.6 Ų91.676%0.75955%0.553SS**  trans-64.878.9152.5-86.6-85.1000106.8T110H108-T110 VanDerWaalsContact C-N 3.27Å; H108-T110 PolarHBondContact O-N 2.82Å
109D48.7Very low52.4Low81 Ų8191.4 Ų91.443%0.43355%0.552SS.*  trans-7883.9177.1-87.4-17000108.8G107 D111 Q112G107-D109 PolarHBondContact O-N 2.86Å; D109-D111 PolarHBondContact O-N 2.88Å; D109-Q112 HydrophobicContact CB-CG 4.02Å; D109-Q112 PolarHBondContact OD2-NE2 2.66Å
110T53.2Low52.2Low83 Ų8398.1 Ų98.151%0.50957%0.573SS.*G310 helixtrans-62-19.1167.646.90000112.3H108 I189H108-T110 VanDerWaalsContact C-N 3.27Å; H108-T110 PolarHBondContact O-N 2.82Å; T110-I189 HydrophobicContact CG2-CG2 4.5Å
111D48.8Very low52.6Low127 Ų127101.5 Ų101.568%0.67959%0.586SS**G310 helixtrans-81.9-19.3-174.1-60.6-14.2000113.2D109 V113D109-D111 PolarHBondContact O-N 2.88Å; D111-V113 VanDerWaalsContact C-N 3.26Å; D111-V113 PolarHBondContact O-N 3.37Å
112Q50.7Low53.8Low100 Ų100100.5 Ų100.547%0.46757%0.566SS.*G310 helixtrans-75.5-15.2178.1-69.5-1706200113.1D109 E114 T115 M116D109-Q112 HydrophobicContact CB-CG 4.02Å; D109-Q112 PolarHBondContact OD2-NE2 2.66Å; Q112-E114 VanDerWaalsContact C-N 3.29Å; Q112-E114 PolarHBondContact O-N 3.07Å; Q112-T115 PolarHBondContact O-N 3.03Å; Q112-M116 HydrophobicContact CB-CE 4.14Å; Q112-M116 WeakPolarHBondContact O-CG 2.99Å
113V55.2Low55.5Low45 Ų45103.6 Ų103.627%0.27357%0.572SS.*G310 helixtrans-66.3-30.2-178.7-177.30000112.1D111 T115 T154 I189 Y212D111-V113 VanDerWaalsContact C-N 3.26Å; D111-V113 PolarHBondContact O-N 3.37Å; V113-T115 VanDerWaalsContact C-N 3.31Å; V113-T115 PolarHBondContact O-N 3.27Å; V113-T154 HydrophobicContact CG1-CG2 3.64Å; V113-I189 HydrophobicContact CG2-CD1 4.09Å; V113-Y212 HydrophobicContact CG2-CE1 4.05Å
114E53.9Low57.8Low187 Ų18799.5 Ų99.587%0.87455%0.547SS*.G310 helixtrans-76.6-15.8-176.8-62.9-162156.100114Q112Q112-E114 VanDerWaalsContact C-N 3.29Å; Q112-E114 PolarHBondContact O-N 3.07Å
115T51.9Low60.1Low118 Ų11897.7 Ų97.772%0.72452%0.52SS*.THydrogen-bonded Turntrans-110.6-5.9-171.8-21.60000114Q112 V113 K117Q112-T115 PolarHBondContact O-N 3.03Å; V113-T115 VanDerWaalsContact C-N 3.31Å; V113-T115 PolarHBondContact O-N 3.27Å; T115-K117 PolarHBondContact O-N 3.04Å
116M53.1Low62.5Low38 Ų3891.7 Ų91.719%0.18748%0.484CS..PPolyproline II helixtrans-71.6128.2-178.8-73.2178.8-177.200111.1Q112 Y212 P215Q112-M116 HydrophobicContact CB-CE 4.14Å; Q112-M116 WeakPolarHBondContact O-CG 2.99Å; M116-Y212 HydrophobicContact CE-CE2 3.88Å; M116-Y212 HydrophobicContact SD-CD2 4.23Å; M116-Y212 HydrophobicContact SD-CE2 3.96Å; M116-P215 HydrophobicContact CG-CG 4.14Å; M116-P215 VanDerWaalsContact SD-CD 3.55Å; M116-P215 HydrophobicContact SD-CG 4.1Å
117K55.5Low65Low183 Ų18387.9 Ų87.980%0.79645%0.449SS*.PPolyproline II helixtrans-90.9117.1169.3-73.6-178.8179.71750108.1T115 V119T115-K117 PolarHBondContact O-N 3.04Å; K117-V119 PolarHBondContact O-N 3.42Å
118P55.7Low67.5Low59 Ų5986.3 Ų86.338%0.38343%0.432SS..PPolyproline II helixtrans-64.5129.5179.624.3-32.2000110.1K120P118-K120 VanDerWaalsContact C-N 3.31Å; P118-K120 PolarHBondContact O-N 3.25Å
119V61.7Low69.9Low44 Ų4481.5 Ų81.527%0.26741%0.411SS..  trans-80.983.7172.9-176.70000107.5K117 E121 R122 V150 P151K117-V119 PolarHBondContact O-N 3.42Å; V119-E121 PolarHBondContact O-N 2.87Å; V119-R122 PolarHBondContact O-N 2.92Å; V119-V150 WeakPolarHBondContact O-CG1 2.93Å; V119-P151 PolarHBondContact N-O 3.21Å
120K60.7Low72.1Confident167 Ų16778.4 Ų78.473%0.72640%0.397SS*.THydrogen-bonded Turntrans-56.6-9.8-169-67.5-174.1179.7-177.50116.2P118P118-K120 VanDerWaalsContact C-N 3.31Å; P118-K120 PolarHBondContact O-N 3.25Å
121E72.8Confident74Confident184 Ų18478 Ų7886%0.8639%0.392SS*.THydrogen-bonded Turntrans-91.4-11.8-168.2-71.7145.6-15400113.4V119V119-E121 PolarHBondContact O-N 2.87Å
122R83.3Confident76.1Confident31 Ų3174.9 Ų74.912%0.11738%0.377CS..  trans-120.8108.4-177.5-167.5165.5-174.6-172.9-6.8113.2V119 I124 P151 D218 M223 A224 V226V119-R122 PolarHBondContact O-N 2.92Å; R122-I124 HydrophobicContact CG-CD1 3.97Å; R122-P151 WeakPolarHBondContact O-CD 3.36Å; R122-D218 WeakPolarHBondContact CD-OD1 3.27Å; R122-D218 IonicContact CZ-OD1 3.01Å; R122-D218 IonicContact NE-OD1 3.89Å; R122-D218 IonicContact NH1-OD1 3.32Å; R122-D218 PolarHBondContact NH1-OD1 3.43Å; R122-M223 PolarHBondContact NH2-O 2.83Å; R122-A224 VanDerWaalsContact NH2-C 3.34Å; R122-A224 PolarHBondContact NH2-O 3.03Å; R122-V226 PolarHBondContact NH2-O 2.94Å
123I90.6Very high78Confident105 Ų10574.3 Ų74.354%0.53838%0.375SS..  trans-91.9122178.2-56.6174.1000109Y148I123-Y148 HydrophobicContact CG2-CD1 3.85Å; I123-Y148 HydrophobicContact CG2-CG 4.25Å
124I93.4Very high79.4Confident0 Ų076.9 Ų76.90%040%0.4CS..EExtended strand (participates in β ladder)trans-104.8131175.7-54.2-59.1000109.3R122 V149 P151 I213 F217 I229R122-I124 HydrophobicContact CG-CD1 3.97Å; I124-V149 PolarHBondContact N-O 2.93Å; I124-V149 PolarHBondContact O-N 2.89Å; I124-P151 HydrophobicContact CG1-CG 4.19Å; I124-I213 HydrophobicContact CB-CD1 3.96Å; I124-I213 HydrophobicContact CG1-CD1 4.32Å; I124-I213 HydrophobicContact CG2-CD1 3.9Å; I124-F217 HydrophobicContact CD1-CD1 4.39Å; I124-F217 HydrophobicContact CD1-CE1 3.63Å; I124-F217 HydrophobicContact CD1-CZ 4.3Å; I124-F217 HydrophobicContact CG1-CE1 4.17Å; I124-I229 HydrophobicContact CG2-CD1 3.88Å; I124-I229 HydrophobicContact CG2-CG1 3.93Å
125K95.8Very high80.9Confident60 Ų6069.9 Ų69.926%0.26137%0.372SS..EExtended strand (participates in β ladder)trans-84.9117173.5-173.4175.669.5166.60110E146 Y148 D227 T228 I229K125-E146 HydrophobicContact CG-CB 4.38Å; K125-E146 IonicContact NZ-OE2 3.41Å; K125-Y148 HydrophobicContact CB-CD1 4.15Å; K125-Y148 HydrophobicContact CB-CE1 3.91Å; K125-Y148 HydrophobicContact CD-CE1 3.92Å; K125-Y148 HydrophobicContact CG-CD1 4.33Å; K125-Y148 HydrophobicContact CG-CE1 3.83Å; K125-D227 PolarHBondContact N-O 3.47Å; K125-T228 WeakPolarHBondContact CE-OG1 3.47Å; K125-T228 CarbonylContact O-C 3.51Å; K125-T228 VanDerWaalsContact O-CA 3.24Å; K125-T228 WeakPolarHBondContact O-CA 3.41Å; K125-I229 PolarHBondContact O-N 2.8Å
126V95.8Very high82.7Confident0 Ų064.6 Ų64.60%034%0.339CS..EExtended strand (participates in β ladder)trans-100.1117.5173.1-1780000108.9F128 E146 I147 V149 F186 F211 I213 I229V126-F128 HydrophobicContact CB-CZ 4.36Å; V126-F128 HydrophobicContact CG1-CD1 4.46Å; V126-F128 HydrophobicContact CG1-CE1 3.79Å; V126-F128 HydrophobicContact CG1-CE2 4.33Å; V126-F128 HydrophobicContact CG1-CZ 3.71Å; V126-E146 CarbonylContact O-C 3.57Å; V126-E146 WeakPolarHBondContact O-CA 3.23Å; V126-I147 HydrophobicContact CB-CG1 4.12Å; V126-I147 PolarHBondContact N-O 3.29Å; V126-I147 PolarHBondContact O-N 3.49Å; V126-V149 HydrophobicContact CG2-CG2 3.62Å; V126-F186 HydrophobicContact CG1-CE2 4.38Å; V126-F211 HydrophobicContact CB-CZ 4.37Å; V126-F211 HydrophobicContact CG1-CE2 4.31Å; V126-F211 HydrophobicContact CG1-CZ 3.96Å; V126-F211 HydrophobicContact CG2-CE2 4.17Å; V126-F211 HydrophobicContact CG2-CZ 4.37Å; V126-I213 HydrophobicContact CG2-CD1 4.18Å; V126-I229 CarbonylContact C-O 3.54Å; V126-I229 VanDerWaalsContact CA-O 3.27Å; V126-I229 WeakPolarHBondContact CA-O 3.3Å
127T96.4Very high84.5Confident30 Ų3069.1 Ų69.118%0.18436%0.36CS..EExtended strand (participates in β ladder)trans-99.4136.2176.6-530000109.7T145 I229 T230 L231T127-T145 CarbonylContact C-O 3.56Å; T127-T145 WeakPolarHBondContact CA-O 3.25Å; T127-I229 PolarHBondContact N-O 3.06Å; T127-T230 CarbonylContact O-C 3.54Å; T127-T230 VanDerWaalsContact O-CA 3.3Å; T127-T230 WeakPolarHBondContact O-CA 3.14Å; T127-L231 PolarHBondContact O-N 3.32Å
128F95.6Very high86.3Confident6 Ų660.9 Ų60.93%0.02632%0.324CS..EExtended strand (participates in β ladder)trans-108123.4-179.6-58.9-74.6000110.3V126 P142 Q144 T145 I147 A157 Y159 F211 L231V126-F128 HydrophobicContact CB-CZ 4.36Å; V126-F128 HydrophobicContact CG1-CD1 4.46Å; V126-F128 HydrophobicContact CG1-CE1 3.79Å; V126-F128 HydrophobicContact CG1-CE2 4.33Å; V126-F128 HydrophobicContact CG1-CZ 3.71Å; F128-P142 HydrophobicContact CB-CB 3.9Å; F128-Q144 HydrophobicContact CD2-CG 4.26Å; F128-Q144 VanDerWaalsContact CD2-O 3.22Å; F128-Q144 WeakPolarHBondContact CD2-O 3.41Å; F128-Q144 HydrophobicContact CE2-CG 4.26Å; F128-T145 PolarHBondContact N-O 2.69Å; F128-I147 HydrophobicContact CE2-CB 4.27Å; F128-I147 HydrophobicContact CE2-CD1 3.95Å; F128-I147 HydrophobicContact CE2-CG1 3.66Å; F128-I147 HydrophobicContact CE2-CG2 3.99Å; F128-I147 HydrophobicContact CZ-CD1 3.73Å; F128-I147 HydrophobicContact CZ-CG1 3.82Å; F128-A157 HydrophobicContact CD1-CB 4.23Å; F128-A157 HydrophobicContact CE1-CB 3.58Å; F128-A157 HydrophobicContact CE2-CB 3.91Å; F128-A157 HydrophobicContact CZ-CB 3.39Å; F128-Y159 HydrophobicContact CB-CE1 4.41Å; F128-Y159 WeakPolarHBondContact CB-OH 3.38Å; F128-Y159 HydrophobicContact CD1-CE2 4.29Å; F128-Y159 WeakPolarHBondContact CD1-OH 3.5Å; F128-F211 AromaticContact CE1-CE1 3.82Å; F128-F211 HydrophobicContact CE1-CE1 3.82Å; F128-F211 HydrophobicContact CE1-CZ 4.11Å; F128-F211 AromaticContact CZ-CE1 3.75Å; F128-F211 HydrophobicContact CZ-CE1 3.75Å; F128-F211 AromaticContact CZ-CZ 3.81Å; F128-F211 HydrophobicContact CZ-CZ 3.81Å; F128-L231 WeakPolarHBondContact CA-O 3.45Å; F128-L231 HydrophobicContact CD1-CB 4.14Å; F128-L231 HydrophobicContact CD1-CD2 4.07Å; F128-L231 HydrophobicContact CE1-CB 4.43Å; F128-L231 HydrophobicContact CE1-CD2 3.98Å
129N95.1Very high88.1Confident63 Ų6362.1 Ų62.134%0.33733%0.328SS..EExtended strand (participates in β ladder)trans-115147.7173-176.634.6000110.4D131 T230 L231 S232 Y233N129-D131 PolarHBondContact ND2-OD2 2.81Å; N129-T230 HydrophobicContact CB-CG2 4.37Å; N129-L231 PolarHBondContact N-O 3.27Å; N129-S232 WeakPolarHBondContact CB-OG 3.45Å; N129-Y233 PolarHBondContact O-N 3.41Å; N129-Y233 VanDerWaalsContact O-N 3.07Å
130A93.9Very high89.7Confident16 Ų1660.8 Ų60.813%0.13232%0.318CS..EExtended strand (participates in β ladder)trans-138.6119.1-177.600000109.5F140 Y159A130-F140 HydrophobicContact CB-CD1 3.49Å; A130-F140 VanDerWaalsContact CB-CD1 3.49Å; A130-F140 HydrophobicContact CB-CE1 3.41Å; A130-F140 VanDerWaalsContact CB-CE1 3.41Å; A130-F140 HydrophobicContact CB-CG 4.24Å; A130-F140 HydrophobicContact CB-CZ 4.13Å; A130-Y159 HydrophobicContact CB-CD1 4.07Å; A130-Y159 HydrophobicContact CB-CE1 4.01Å
131D93.8Very high91.3Very high76 Ų7658.7 Ų58.741%0.40631%0.306SS..EExtended strand (participates in β ladder)trans-124.3154.4179.1-70.2-65.2000110.4N129 Y233 T234 F235N129-D131 PolarHBondContact ND2-OD2 2.81Å; D131-Y233 PolarHBondContact N-O 2.93Å; D131-T234 HydrophobicContact CB-CG2 4.22Å; D131-T234 VanDerWaalsContact O-CA 3.3Å; D131-T234 WeakPolarHBondContact O-CA 3.47Å; D131-F235 PolarHBondContact O-N 3.12Å
132T92.2Very high92.4Very high60 Ų6051.3 Ų51.337%0.36827%0.274SS..EExtended strand (participates in β ladder)trans-128.2132.6174.254.30000109.4I136 F140T132-I136 HydrophobicContact CG2-CG2 4.45Å; T132-F140 HydrophobicContact CG2-CB 3.56Å; T132-F140 HydrophobicContact CG2-CD1 4.48Å; T132-F140 HydrophobicContact CG2-CG 4.49Å
133H91.4Very high92.9Very high89 Ų8953.7 Ų53.741%0.41229%0.286SS..  trans-70.4151.6173.8-171.8-101.1000111S135 I136 F235 F236H133-S135 PolarHBondContact ND1-N 3.01Å; H133-S135 PolarHBondContact ND1-OG 2.99Å; H133-S135 PolarHBondContact O-N 3.41Å; H133-I136 WeakPolarHBondContact O-CG2 3.47Å; H133-I136 PolarHBondContact O-N 2.76Å; H133-F235 VanDerWaalsContact CB-O 3.23Å; H133-F235 WeakPolarHBondContact CB-O 3.49Å; H133-F235 PolarHBondContact N-O 3.35Å; H133-F236 HydrophobicContact CB-CD1 3.48Å; H133-F236 VanDerWaalsContact CB-CD1 3.48Å; H133-F236 HydrophobicContact CB-CE1 3.72Å; H133-F236 HydrophobicContact CB-CG 4.22Å; H133-F236 AromaticContact CD2-CE1 3.71Å; H133-F236 AromaticContact CG-CD1 3.59Å; H133-F236 AromaticContact CG-CE1 3.72Å
134A85.8Confident93.1Very high98 Ų9851.5 Ų51.581%0.8127%0.274SS*.THydrogen-bonded Turntrans-59.7-16.2-177.900000114.6
135S84.8Confident93.1Very high41 Ų4156 Ų5629%0.28730%0.301SS..THydrogen-bonded Turntrans-76-20.7175.2550000113.7H133 E237H133-S135 PolarHBondContact ND1-N 3.01Å; H133-S135 PolarHBondContact ND1-OG 2.99Å; H133-S135 PolarHBondContact O-N 3.41Å; S135-E237 VanDerWaalsContact O-OE2 3.09Å
136I89.6Confident93.1Very high6 Ų657.1 Ų57.13%0.03131%0.307CS..  trans-114.4128.9-178.5-161.8168.5000110.4T132 H133 W138 I169 F235 E237T132-I136 HydrophobicContact CG2-CG2 4.45Å; H133-I136 WeakPolarHBondContact O-CG2 3.47Å; H133-I136 PolarHBondContact O-N 2.76Å; I136-W138 VanDerWaalsContact C-N 3.29Å; I136-W138 HydrophobicContact CD1-CD2 3.4Å; I136-W138 VanDerWaalsContact CD1-CD2 3.4Å; I136-W138 HydrophobicContact CD1-CE3 3.72Å; I136-W138 HydrophobicContact CD1-CG 3.79Å; I136-W138 HydrophobicContact CD1-CH2 4.26Å; I136-W138 HydrophobicContact CD1-CZ2 3.97Å; I136-W138 HydrophobicContact CD1-CZ3 4.15Å; I136-W138 HydrophobicContact CG1-CB 4.26Å; I136-W138 HydrophobicContact CG1-CD2 3.89Å; I136-W138 HydrophobicContact CG1-CG 3.7Å; I136-W138 PolarHBondContact O-N 2.99Å; I136-I169 HydrophobicContact CD1-CG2 4.14Å; I136-I169 HydrophobicContact CG1-CG2 3.91Å; I136-F235 HydrophobicContact CD1-CB 4.35Å; I136-F235 HydrophobicContact CG2-CB 4.14Å; I136-F235 WeakPolarHBondContact CG2-O 3.31Å; I136-E237 HydrophobicContact CB-CB 4.11Å
137Q90Very high93.1Very high133 Ų13358.5 Ų58.562%0.62132%0.315SS*.  trans-95.630.5-177.1-64.7-177.74.500112.5P164 T165Q137-P164 WeakPolarHBondContact O-CD 3.24Å; Q137-P164 WeakPolarHBondContact O-CG 3.4Å; Q137-T165 HydrophobicContact CB-CG2 3.95Å
138W93.1Very high93Very high10 Ų1063.6 Ų63.64%0.03833%0.332CS..  trans-78.8147.4179-702000111.4I136 A161 K162 I169 Q197 L199 F235I136-W138 VanDerWaalsContact C-N 3.29Å; I136-W138 HydrophobicContact CD1-CD2 3.4Å; I136-W138 VanDerWaalsContact CD1-CD2 3.4Å; I136-W138 HydrophobicContact CD1-CE3 3.72Å; I136-W138 HydrophobicContact CD1-CG 3.79Å; I136-W138 HydrophobicContact CD1-CH2 4.26Å; I136-W138 HydrophobicContact CD1-CZ2 3.97Å; I136-W138 HydrophobicContact CD1-CZ3 4.15Å; I136-W138 HydrophobicContact CG1-CB 4.26Å; I136-W138 HydrophobicContact CG1-CD2 3.89Å; I136-W138 HydrophobicContact CG1-CG 3.7Å; I136-W138 PolarHBondContact O-N 2.99Å; W138-A161 HydrophobicContact CE3-CB 4.25Å; W138-K162 CarbonylContact C-O 3.53Å; W138-K162 VanDerWaalsContact CA-O 3.31Å; W138-K162 WeakPolarHBondContact CA-O 3.27Å; W138-I169 HydrophobicContact CZ2-CB 4.45Å; W138-I169 HydrophobicContact CZ2-CG2 4.23Å; W138-I169 WeakPolarHBondContact CZ2-O 3.48Å; W138-Q197 HydrophobicContact CH2-CB 4.05Å; W138-Q197 WeakPolarHBondContact CH2-O 3.31Å; W138-L199 HydrophobicContact CD2-CD1 3.78Å; W138-L199 HydrophobicContact CE3-CD1 3.81Å; W138-L199 HydrophobicContact CH2-CB 4.41Å; W138-L199 HydrophobicContact CH2-CD1 3.68Å; W138-L199 HydrophobicContact CH2-CG 3.98Å; W138-L199 HydrophobicContact CZ2-CB 3.82Å; W138-L199 HydrophobicContact CZ2-CD1 3.65Å; W138-L199 HydrophobicContact CZ2-CG 3.88Å; W138-L199 HydrophobicContact CZ3-CD1 3.75Å; W138-L199 HydrophobicContact CZ3-CG 4.49Å; W138-F235 HydrophobicContact CE3-CD1 4Å; W138-F235 HydrophobicContact CE3-CE1 4.26Å; W138-F235 HydrophobicContact CE3-CG 4.27Å; W138-F235 HydrophobicContact CH2-CE1 4.46Å; W138-F235 AromaticContact CZ3-CD1 3.63Å; W138-F235 HydrophobicContact CZ3-CD1 3.63Å; W138-F235 AromaticContact CZ3-CE1 3.56Å; W138-F235 HydrophobicContact CZ3-CE1 3.56Å; W138-F235 HydrophobicContact CZ3-CG 4.33Å; W138-F235 HydrophobicContact CZ3-CZ 4.21Å
139N94Very high92.9Very high86 Ų8663.7 Ų63.746%0.4633%0.333SS..EExtended strand (participates in β ladder)trans-91.8102.3162.1-175.8-11.5000107.6A161 K162N139-A161 WeakPolarHBondContact O-CA 3.22Å; N139-K162 HydrophobicContact CB-CB 4.34Å; N139-K162 PolarHBondContact N-O 3.18Å; N139-K162 PolarHBondContact O-N 3.18Å
140F94.6Very high92.8Very high15 Ų1561.7 Ų61.77%0.06632%0.322CS..EExtended strand (participates in β ladder)trans-115.2125.6-178.3178-121.7000109.8A130 T132 Y159 R160 A161 F192 M207 F235A130-F140 HydrophobicContact CB-CD1 3.49Å; A130-F140 VanDerWaalsContact CB-CD1 3.49Å; A130-F140 HydrophobicContact CB-CE1 3.41Å; A130-F140 VanDerWaalsContact CB-CE1 3.41Å; A130-F140 HydrophobicContact CB-CG 4.24Å; A130-F140 HydrophobicContact CB-CZ 4.13Å; T132-F140 HydrophobicContact CG2-CB 3.56Å; T132-F140 HydrophobicContact CG2-CD1 4.48Å; T132-F140 HydrophobicContact CG2-CG 4.49Å; F140-Y159 HydrophobicContact CE1-CD1 4.05Å; F140-Y159 HydrophobicContact CE1-CE1 4.41Å; F140-Y159 AromaticContact CE2-CD1 3.69Å; F140-Y159 HydrophobicContact CE2-CD1 3.69Å; F140-Y159 AromaticContact CE2-CG 3.82Å; F140-Y159 HydrophobicContact CE2-CG 3.82Å; F140-Y159 AromaticContact CZ-CD1 3.28Å; F140-Y159 HydrophobicContact CZ-CD1 3.28Å; F140-Y159 AromaticContact CZ-CE1 3.94Å; F140-Y159 HydrophobicContact CZ-CE1 3.94Å; F140-Y159 AromaticContact CZ-CG 3.71Å; F140-Y159 HydrophobicContact CZ-CG 3.71Å; F140-R160 WeakPolarHBondContact CA-O 3.43Å; F140-A161 HydrophobicContact CD2-CB 4.1Å; F140-F192 HydrophobicContact CZ-CZ 4.22Å; F140-M207 HydrophobicContact CD2-CE 3.84Å; F140-M207 HydrophobicContact CE2-CE 3.41Å; F140-M207 VanDerWaalsContact CE2-CE 3.41Å; F140-M207 HydrophobicContact CZ-CE 4.44Å; F140-F235 AromaticContact CD1-CD2 3.61Å; F140-F235 HydrophobicContact CD1-CD2 3.61Å; F140-F235 HydrophobicContact CD1-CE2 4.05Å; F140-F235 HydrophobicContact CD2-CD2 4.01Å; F140-F235 AromaticContact CD2-CE2 3.77Å; F140-F235 HydrophobicContact CD2-CE2 3.77Å; F140-F235 AromaticContact CE1-CD2 3.69Å; F140-F235 HydrophobicContact CE1-CD2 3.69Å; F140-F235 AromaticContact CE1-CE2 3.81Å; F140-F235 HydrophobicContact CE1-CE2 3.81Å; F140-F235 HydrophobicContact CE2-CD2 4.05Å; F140-F235 AromaticContact CE2-CE2 3.47Å; F140-F235 HydrophobicContact CE2-CE2 3.47Å; F140-F235 VanDerWaalsContact CE2-CE2 3.47Å; F140-F235 HydrophobicContact CE2-CZ 4.5Å; F140-F235 AromaticContact CG-CD2 3.8Å; F140-F235 HydrophobicContact CG-CD2 3.8Å; F140-F235 HydrophobicContact CG-CE2 4.05Å; F140-F235 AromaticContact CZ-CD2 3.92Å; F140-F235 HydrophobicContact CZ-CD2 3.92Å; F140-F235 AromaticContact CZ-CE2 3.52Å; F140-F235 HydrophobicContact CZ-CE2 3.52Å
141R95.4Very high92.6Very high123 Ų12360.9 Ų60.946%0.46432%0.316SS..EExtended strand (participates in β ladder)trans-151147.6-176.860-176.1-178.6152.51111.7R160R141-R160 HydrophobicContact CG-CB 4.32Å; R141-R160 PolarHBondContact N-O 3.36Å; R141-R160 PolarHBondContact O-N 2.84Å
142P95.6Very high92.3Very high29 Ų2958 Ų5819%0.18830%0.304CS..EExtended strand (participates in β ladder)trans-68144.817033-35.8000109.6F128 Q144 Y159F128-P142 HydrophobicContact CB-CB 3.9Å; P142-Q144 VanDerWaalsContact C-N 3.33Å; P142-Q144 WeakPolarHBondContact CB-O 3.43Å; P142-Y159 HydrophobicContact CB-CD1 4.02Å; P142-Y159 HydrophobicContact CB-CE1 3.94Å
143Q94.5Very high92Very high81 Ų8159.6 Ų59.638%0.37931%0.307SS..SBendtrans-73.2-31.6168.3-71.5-62-76.100111.4F158 R160Q143-F158 HydrophobicContact CB-CB 4.12Å; Q143-F158 WeakPolarHBondContact CB-O 3.11Å; Q143-F158 HydrophobicContact CG-CB 3.96Å; Q143-F158 PolarHBondContact N-O 3.46Å; Q143-R160 HydrophobicContact CG-CB 4.43Å
144Q93.9Very high91.9Very high59 Ų5958 Ų5828%0.27630%0.304SS..  trans-129.2124.7179.557.3-156.932.900109.5F128 P142 I147 L156 A157F128-Q144 HydrophobicContact CD2-CG 4.26Å; F128-Q144 VanDerWaalsContact CD2-O 3.22Å; F128-Q144 WeakPolarHBondContact CD2-O 3.41Å; F128-Q144 HydrophobicContact CE2-CG 4.26Å; P142-Q144 VanDerWaalsContact C-N 3.33Å; P142-Q144 WeakPolarHBondContact CB-O 3.43Å; Q144-I147 HydrophobicContact CG-CG2 4.1Å; Q144-L156 PolarHBondContact NE2-O 2.91Å; Q144-A157 VanDerWaalsContact NE2-CA 3.29Å
145T94Very high92.2Very high95 Ų9554 Ų5458%0.58327%0.27SS*.SBendtrans-76.2-31.1-176-48.40000112.3T127 F128T127-T145 CarbonylContact C-O 3.56Å; T127-T145 WeakPolarHBondContact CA-O 3.25Å; F128-T145 PolarHBondContact N-O 2.69Å
146E95.6Very high92.6Very high83 Ų8355.7 Ų55.739%0.38828%0.276SS..EExtended strand (participates in β ladder)trans-147.6151.2177.159178.4-136.300111.6K125 V126 Y148K125-E146 HydrophobicContact CG-CB 4.38Å; K125-E146 IonicContact NZ-OE2 3.41Å; V126-E146 CarbonylContact O-C 3.57Å; V126-E146 WeakPolarHBondContact O-CA 3.23Å; E146-Y148 PolarHBondContact OE1-OH 2.93Å
147I95.4Very high92.7Very high30 Ų3055.5 Ų55.515%0.15428%0.275CS..EExtended strand (participates in β ladder)trans-136.3159.9166.667.9177.6000110.1V126 F128 Q144 V149 A155 F211V126-I147 HydrophobicContact CB-CG1 4.12Å; V126-I147 PolarHBondContact N-O 3.29Å; V126-I147 PolarHBondContact O-N 3.49Å; F128-I147 HydrophobicContact CE2-CB 4.27Å; F128-I147 HydrophobicContact CE2-CD1 3.95Å; F128-I147 HydrophobicContact CE2-CG1 3.66Å; F128-I147 HydrophobicContact CE2-CG2 3.99Å; F128-I147 HydrophobicContact CZ-CD1 3.73Å; F128-I147 HydrophobicContact CZ-CG1 3.82Å; Q144-I147 HydrophobicContact CG-CG2 4.1Å; I147-V149 HydrophobicContact CD1-CG1 3.77Å; I147-V149 HydrophobicContact CG1-CG1 3.98Å; I147-A155 HydrophobicContact CD1-CB 3.9Å; I147-F211 HydrophobicContact CD1-CE1 4.25Å; I147-F211 HydrophobicContact CD1-CZ 3.8Å
148Y94.9Very high92.8Very high137 Ų13752.8 Ų52.854%0.53726%0.261SS..EExtended strand (participates in β ladder)trans-112.1124.1177.4-64.2-89.9000108.3I123 K125 E146I123-Y148 HydrophobicContact CG2-CD1 3.85Å; I123-Y148 HydrophobicContact CG2-CG 4.25Å; K125-Y148 HydrophobicContact CB-CD1 4.15Å; K125-Y148 HydrophobicContact CB-CE1 3.91Å; K125-Y148 HydrophobicContact CD-CE1 3.92Å; K125-Y148 HydrophobicContact CG-CD1 4.33Å; K125-Y148 HydrophobicContact CG-CE1 3.83Å; E146-Y148 PolarHBondContact OE1-OH 2.93Å
149V93.2Very high92.8Very high8 Ų852.3 Ų52.35%0.04826%0.26CS..EExtended strand (participates in β ladder)trans-135.6154.8-175.4-63.60000110I124 V126 I147 A155 I213I124-V149 PolarHBondContact N-O 2.93Å; I124-V149 PolarHBondContact O-N 2.89Å; V126-V149 HydrophobicContact CG2-CG2 3.62Å; I147-V149 HydrophobicContact CD1-CG1 3.77Å; I147-V149 HydrophobicContact CG1-CG1 3.98Å; V149-A155 HydrophobicContact CG1-CB 3.54Å; V149-I213 HydrophobicContact CG2-CD1 3.67Å; V149-I213 HydrophobicContact CG2-CG1 4.48Å
150V92.3Very high92.8Very high20 Ų2050.8 Ų50.812%0.12125%0.247CC..  trans-103142.9175.9179.20000110V119 G152 E153V119-V150 WeakPolarHBondContact O-CG1 2.93Å; V150-G152 PolarHBondContact O-N 2.94Å; V150-E153 HydrophobicContact CB-CB 4.32Å; V150-E153 PolarHBondContact N-OE2 3.47Å; V150-E153 WeakPolarHBondContact O-CB 3.28Å; V150-E153 PolarHBondContact O-N 3.45Å
151P90.9Very high92.8Very high0 Ų050 Ų500%024%0.244CC..THydrogen-bonded Turntrans-53.6131.7169.5-25.835.3000112.4V119 R122 I124 E153 I213 F217V119-P151 PolarHBondContact N-O 3.21Å; R122-P151 WeakPolarHBondContact O-CD 3.36Å; I124-P151 HydrophobicContact CG1-CG 4.19Å; P151-E153 VanDerWaalsContact C-N 3.33Å; P151-I213 HydrophobicContact CB-CG2 4.35Å; P151-I213 HydrophobicContact CG-CG2 4.43Å; P151-F217 HydrophobicContact CG-CD1 4.31Å
152G86.5Confident92.8Very high14 Ų1447.6 Ų47.614%0.14424%0.237CC..THydrogen-bonded Turntrans85.3-5-171.600000114.9V150 I213V150-G152 PolarHBondContact O-N 2.94Å; G152-I213 PolarHBondContact N-O 2.99Å
153E87.1Confident92.8Very high94 Ų9446.2 Ų46.244%0.43923%0.228SC..  trans-91137.9172.1-168.6179.7-177.800110.7V150 P151 Y212V150-E153 HydrophobicContact CB-CB 4.32Å; V150-E153 PolarHBondContact N-OE2 3.47Å; V150-E153 WeakPolarHBondContact O-CB 3.28Å; V150-E153 PolarHBondContact O-N 3.45Å; P151-E153 VanDerWaalsContact C-N 3.33Å; E153-Y212 WeakPolarHBondContact O-CB 2.88Å
154T89.6Confident92.9Very high57 Ų5745.4 Ų45.435%0.3523%0.23SC..EExtended strand (participates in β ladder)trans-88.2140172.254.40000110.4V113 F210V113-T154 HydrophobicContact CG1-CG2 3.64Å; T154-F210 VanDerWaalsContact CB-CZ 3.49Å; T154-F210 HydrophobicContact CG2-CE1 4.45Å; T154-F210 HydrophobicContact CG2-CE2 4.48Å; T154-F210 HydrophobicContact CG2-CZ 3.84Å
155A91.8Very high92.9Very high12 Ų1243.5 Ų43.510%0.09922%0.222CC..EExtended strand (participates in β ladder)trans-134.3151-178.300000111.8I147 V149 F210 F211I147-A155 HydrophobicContact CD1-CB 3.9Å; V149-A155 HydrophobicContact CG1-CB 3.54Å; A155-F210 VanDerWaalsContact O-CD2 3.27Å; A155-F210 WeakPolarHBondContact O-CD2 3.24Å; A155-F211 HydrophobicContact CB-CE1 4.23Å; A155-F211 HydrophobicContact CB-CE2 4.2Å; A155-F211 HydrophobicContact CB-CZ 3.97Å; A155-F211 PolarHBondContact N-O 2.9Å; A155-F211 PolarHBondContact O-N 3.49Å
156L91.8Very high93Very high78 Ų7845.5 Ų45.541%0.40823%0.229SC..EExtended strand (participates in β ladder)trans-119.3129.9178.1-17268.4000109.7Q144 F158 P208 F210Q144-L156 PolarHBondContact NE2-O 2.91Å; L156-F158 HydrophobicContact CD2-CE1 4.29Å; L156-F158 HydrophobicContact CD2-CE2 3.7Å; L156-F158 HydrophobicContact CD2-CZ 3.39Å; L156-F158 HydrophobicContact CG-CE2 3.96Å; L156-F158 HydrophobicContact CG-CZ 3.95Å; L156-P208 HydrophobicContact CD1-CB 4Å; L156-F210 HydrophobicContact CB-CD2 4.36Å; L156-F210 HydrophobicContact CD1-CB 4.04Å; L156-F210 HydrophobicContact CD1-CD2 4.12Å
157A92.6Very high92.8Very high1 Ų147 Ų471%0.00823%0.234CC..EExtended strand (participates in β ladder)trans-125.5150.1172.500000111.7F128 Q144 P208 V209 F211F128-A157 HydrophobicContact CD1-CB 4.23Å; F128-A157 HydrophobicContact CE1-CB 3.58Å; F128-A157 HydrophobicContact CE2-CB 3.91Å; F128-A157 HydrophobicContact CZ-CB 3.39Å; Q144-A157 VanDerWaalsContact NE2-CA 3.29Å; A157-P208 CarbonylContact O-C 3.52Å; A157-P208 WeakPolarHBondContact O-CA 3.37Å; A157-V209 PolarHBondContact N-O 3.34Å; A157-V209 PolarHBondContact O-N 3.48Å; A157-F211 HydrophobicContact CB-CE1 4.21Å
158F92.7Very high92.6Very high77 Ų7748.4 Ų48.434%0.33825%0.245SC..EExtended strand (participates in β ladder)trans-118136-178.6-65.4-85000110.9Q143 L156 P208Q143-F158 HydrophobicContact CB-CB 4.12Å; Q143-F158 WeakPolarHBondContact CB-O 3.11Å; Q143-F158 HydrophobicContact CG-CB 3.96Å; Q143-F158 PolarHBondContact N-O 3.46Å; L156-F158 HydrophobicContact CD2-CE1 4.29Å; L156-F158 HydrophobicContact CD2-CE2 3.7Å; L156-F158 HydrophobicContact CD2-CZ 3.39Å; L156-F158 HydrophobicContact CG-CE2 3.96Å; L156-F158 HydrophobicContact CG-CZ 3.95Å; F158-P208 HydrophobicContact CD1-CB 4.02Å; F158-P208 HydrophobicContact CE1-CB 3.81Å
159Y93.1Very high92.4Very high0 Ų042.2 Ų42.20%022%0.221CC..EExtended strand (participates in β ladder)trans-113.9144.8166.6-68.7-100.6000110F128 A130 F140 P142 F192 D206 M207 V209 L231 Y233F128-Y159 HydrophobicContact CB-CE1 4.41Å; F128-Y159 WeakPolarHBondContact CB-OH 3.38Å; F128-Y159 HydrophobicContact CD1-CE2 4.29Å; F128-Y159 WeakPolarHBondContact CD1-OH 3.5Å; A130-Y159 HydrophobicContact CB-CD1 4.07Å; A130-Y159 HydrophobicContact CB-CE1 4.01Å; F140-Y159 HydrophobicContact CE1-CD1 4.05Å; F140-Y159 HydrophobicContact CE1-CE1 4.41Å; F140-Y159 AromaticContact CE2-CD1 3.69Å; F140-Y159 HydrophobicContact CE2-CD1 3.69Å; F140-Y159 AromaticContact CE2-CG 3.82Å; F140-Y159 HydrophobicContact CE2-CG 3.82Å; F140-Y159 AromaticContact CZ-CD1 3.28Å; F140-Y159 HydrophobicContact CZ-CD1 3.28Å; F140-Y159 AromaticContact CZ-CE1 3.94Å; F140-Y159 HydrophobicContact CZ-CE1 3.94Å; F140-Y159 AromaticContact CZ-CG 3.71Å; F140-Y159 HydrophobicContact CZ-CG 3.71Å; P142-Y159 HydrophobicContact CB-CD1 4.02Å; P142-Y159 HydrophobicContact CB-CE1 3.94Å; Y159-F192 HydrophobicContact CD2-CE1 4.44Å; Y159-D206 CarbonylContact O-C 3.58Å; Y159-D206 WeakPolarHBondContact O-CA 3.42Å; Y159-M207 PolarHBondContact N-O 3.46Å; Y159-M207 PolarHBondContact O-N 2.98Å; Y159-V209 HydrophobicContact CD2-CG2 3.92Å; Y159-V209 HydrophobicContact CE2-CG2 3.96Å; Y159-L231 PolarHBondContact OH-O 3Å; Y159-Y233 HydrophobicContact CE1-CD2 4.32Å; Y159-Y233 AromaticContact CE2-CD2 3.95Å; Y159-Y233 HydrophobicContact CE2-CD2 3.95Å; Y159-Y233 HydrophobicContact CE2-CE2 4.19Å; Y159-Y233 AromaticContact CZ-CD2 3.69Å; Y159-Y233 WeakPolarHBondContact OH-CD2 3.27Å
160R94.1Very high92.3Very high53 Ų5343.9 Ų43.920%0.223%0.229CC..EExtended strand (participates in β ladder)trans-106126.9175.3179.9102.360.397.13.2109F140 R141 Q143 E204 D206F140-R160 WeakPolarHBondContact CA-O 3.43Å; R141-R160 HydrophobicContact CG-CB 4.32Å; R141-R160 PolarHBondContact N-O 3.36Å; R141-R160 PolarHBondContact O-N 2.84Å; Q143-R160 HydrophobicContact CG-CB 4.43Å; R160-E204 WeakPolarHBondContact CD-OE1 3.29Å; R160-E204 HydrophobicContact CG-CG 4.12Å; R160-E204 IonicContact CZ-OE1 3.57Å; R160-E204 IonicContact NE-OE1 3.82Å; R160-E204 IonicContact NH1-OE1 2.63Å; R160-E204 PolarHBondContact NH1-OE1 3.22Å; R160-D206 WeakPolarHBondContact CD-OD1 3.45Å; R160-D206 IonicContact NE-OD1 3.05Å; R160-D206 PolarHBondContact NE-OD1 3.45Å
161A94.2Very high92.1Very high0 Ų042.9 Ų42.90%022%0.224CC..EExtended strand (participates in β ladder)trans-116.4137169.600000110.1W138 N139 F140 L199 E204 V205 M207W138-A161 HydrophobicContact CE3-CB 4.25Å; N139-A161 WeakPolarHBondContact O-CA 3.22Å; F140-A161 HydrophobicContact CD2-CB 4.1Å; A161-L199 HydrophobicContact CB-CD1 3.82Å; A161-E204 WeakPolarHBondContact O-CA 3.45Å; A161-V205 PolarHBondContact N-O 3.26Å; A161-V205 PolarHBondContact O-N 2.9Å; A161-M207 HydrophobicContact CB-CE 3.55Å; A161-M207 HydrophobicContact CB-SD 4.4Å
162K95.4Very high92Very high72 Ų7244.5 Ų44.531%0.31323%0.232SC..EExtended strand (participates in β ladder)trans-131.5135.2173.9-175-177.2-160.31350110.6W138 N139 P164 E203 E204W138-K162 CarbonylContact C-O 3.53Å; W138-K162 VanDerWaalsContact CA-O 3.31Å; W138-K162 WeakPolarHBondContact CA-O 3.27Å; N139-K162 HydrophobicContact CB-CB 4.34Å; N139-K162 PolarHBondContact N-O 3.18Å; N139-K162 PolarHBondContact O-N 3.18Å; K162-P164 VanDerWaalsContact O-CD 3.27Å; K162-P164 WeakPolarHBondContact O-CD 3.29Å; K162-E203 WeakPolarHBondContact CA-O 3.41Å; K162-E204 HydrophobicContact CB-CB 4.34Å; K162-E204 HydrophobicContact CB-CG 4.09Å; K162-E204 VanDerWaalsContact CD-OE2 3.27Å; K162-E204 WeakPolarHBondContact CD-OE2 2.94Å; K162-E204 WeakPolarHBondContact CE-OE2 3.16Å; K162-E204 HydrophobicContact CG-CB 4.16Å; K162-E204 HydrophobicContact CG-CG 4.31Å; K162-E204 IonicContact NZ-OE2 2.77Å; K162-E204 PolarHBondContact NZ-OE2 3.28Å
163N96.1Very high92.1Very high0 Ų043.9 Ų43.90%023%0.225CC..  trans-94.6104.4167.4179.37000110T165 K167 L199 N200 H202 E203N163-T165 PolarHBondContact O-N 3.05Å; N163-T165 WeakPolarHBondContact OD1-CB 3.33Å; N163-T165 PolarHBondContact OD1-N 3.33Å; N163-T165 PolarHBondContact OD1-OG1 2.89Å; N163-K167 PolarHBondContact ND2-O 3.48Å; N163-L199 HydrophobicContact CB-CB 3.8Å; N163-L199 PolarHBondContact ND2-O 3.02Å; N163-N200 WeakPolarHBondContact CB-O 3.24Å; N163-N200 PolarHBondContact ND2-O 3.5Å; N163-H202 WeakPolarHBondContact O-CA 3.41Å; N163-H202 PolarHBondContact O-N 2.91Å; N163-E203 PolarHBondContact N-O 3.46Å
164P95Very high92.2Very high64 Ų6442.8 Ų42.842%0.41623%0.225SC..  trans-79.8-0.2178.935.3-37.2000113.9Q137 K162 H202Q137-P164 WeakPolarHBondContact O-CD 3.24Å; Q137-P164 WeakPolarHBondContact O-CG 3.4Å; K162-P164 VanDerWaalsContact O-CD 3.27Å; K162-P164 WeakPolarHBondContact O-CD 3.29Å; P164-H202 PolarHBondContact O-CE1 3.45Å; P164-H202 VanDerWaalsContact O-CE1 3.25Å
165T94.6Very high92.1Very high18 Ų1844.6 Ų44.611%0.1123%0.226CC..SBendtrans-92.9164-174.575.70000112.1Q137 N163 K167 I169 P201Q137-T165 HydrophobicContact CB-CG2 3.95Å; N163-T165 PolarHBondContact O-N 3.05Å; N163-T165 WeakPolarHBondContact OD1-CB 3.33Å; N163-T165 PolarHBondContact OD1-N 3.33Å; N163-T165 PolarHBondContact OD1-OG1 2.89Å; T165-K167 VanDerWaalsContact C-N 3.27Å; T165-K167 PolarHBondContact O-N 2.98Å; T165-K167 PolarHBondContact OG1-O 3.26Å; T165-K167 VanDerWaalsContact OG1-O 3.09Å; T165-I169 HydrophobicContact CG2-CD1 3.99Å; T165-I169 WeakPolarHBondContact OG1-CD1 2.87Å; T165-P201 VanDerWaalsContact O-CA 3.23Å; T165-P201 WeakPolarHBondContact O-CA 3.39Å; T165-P201 WeakPolarHBondContact O-CB 3.08Å
166D95.4Very high92.1Very high137 Ų13747.4 Ų47.473%0.73324%0.239SC*.SBendtrans-85.16.7178.6-58.7-50.5000114P201 H202D166-P201 VanDerWaalsContact C-CG 3.49Å; D166-P201 VanDerWaalsContact O-CG 3.32Å; D166-P201 WeakPolarHBondContact O-CG 3.35Å; D166-H202 IonicContact OD1-CD2 3.8Å; D166-H202 IonicContact OD1-CE1 3.7Å; D166-H202 IonicContact OD1-NE2 2.8Å; D166-H202 PolarHBondContact OD1-NE2 3.3Å
167K92.2Very high92.1Very high116 Ų11644.5 Ų44.550%0.50423%0.225SC..SBendtrans-124147.9179.262.4175.9-176.4167.40111.1N163 T165 I169N163-K167 PolarHBondContact ND2-O 3.48Å; T165-K167 VanDerWaalsContact C-N 3.27Å; T165-K167 PolarHBondContact O-N 2.98Å; T165-K167 PolarHBondContact OG1-O 3.26Å; T165-K167 VanDerWaalsContact OG1-O 3.09Å; K167-I169 HydrophobicContact CG-CG1 4.33Å
168P91.4Very high92.1Very high58 Ų5848 Ų4838%0.37725%0.246SC..  trans-64139.5170.328.3-33.9000109.7L199P168-L199 WeakPolarHBondContact CA-O 3.27Å
169I90.9Very high92.1Very high8 Ų846.2 Ų46.24%0.04124%0.242CC..EExtended strand (participates in β ladder)trans-126.3138.5177-63.5176.5000107.6I136 W138 T165 K167 L199 E237I136-I169 HydrophobicContact CD1-CG2 4.14Å; I136-I169 HydrophobicContact CG1-CG2 3.91Å; W138-I169 HydrophobicContact CZ2-CB 4.45Å; W138-I169 HydrophobicContact CZ2-CG2 4.23Å; W138-I169 WeakPolarHBondContact CZ2-O 3.48Å; T165-I169 HydrophobicContact CG2-CD1 3.99Å; T165-I169 WeakPolarHBondContact OG1-CD1 2.87Å; K167-I169 HydrophobicContact CG-CG1 4.33Å; I169-L199 PolarHBondContact N-O 3.36Å; I169-L199 VanDerWaalsContact N-O 3.08Å; I169-L199 PolarHBondContact O-N 3.1Å; I169-E237 HydrophobicContact CG2-CG 4.34Å
170I90.5Very high91.9Very high42 Ų4253 Ų5322%0.21527%0.272CS..EExtended strand (participates in β ladder)trans-104.8127174.1-55.1176.2000107.5E196 Q197 R198 A238I170-E196 HydrophobicContact CG2-CB 3.74Å; I170-E196 HydrophobicContact CG2-CG 4.21Å; I170-Q197 CarbonylContact C-O 3.54Å; I170-Q197 WeakPolarHBondContact CA-O 3.37Å; I170-R198 HydrophobicContact CG1-CB 4.15Å; I170-R198 HydrophobicContact CG1-CG 4.14Å; I170-A238 HydrophobicContact CB-CB 4.38Å; I170-A238 HydrophobicContact CG2-CB 3.94Å; I170-A238 PolarHBondContact O-N 3.44Å
171G89.3Confident91.6Very high0 Ų054.4 Ų54.40%028%0.283CS..EExtended strand (participates in β ladder)trans-120.4141.9179.500000111.3Q197 F236G171-Q197 PolarHBondContact N-O 2.76Å; G171-Q197 PolarHBondContact O-N 3.48Å; G171-F236 CarbonylContact C-O 3.56Å; G171-F236 VanDerWaalsContact CA-O 3.25Å; G171-F236 WeakPolarHBondContact CA-O 3.25Å
172I88.6Confident91.4Very high34 Ų3454.4 Ų54.417%0.17428%0.283CS..EExtended strand (participates in β ladder)trans-116145.4164.4-169.3168.3000107.8F236 A238 L244I172-F236 HydrophobicContact CG2-CB 4.27Å; I172-F236 PolarHBondContact N-O 3.47Å; I172-F236 PolarHBondContact O-N 3.14Å; I172-A238 HydrophobicContact CG2-CB 4.48Å; I172-L244 HydrophobicContact CD1-CD1 4.06Å; I172-L244 HydrophobicContact CG2-CD1 4.32Å
173S88Confident91.1Very high1 Ų152.2 Ų52.21%0.00728%0.281CS..EExtended strand (participates in β ladder)trans-114.7156.8177.663.40000111.8F192 C193 T234S173-F192 WeakPolarHBondContact OG-CD2 3.39Å; S173-F192 WeakPolarHBondContact OG-CE2 3.45Å; S173-C193 CarbonylContact O-C 3.55Å; S173-C193 VanDerWaalsContact OG-CA 3.25Å; S173-C193 WeakPolarHBondContact OG-CA 3.45Å; S173-C193 WeakPolarHBondContact OG-CB 3.46Å; S173-T234 CarbonylContact C-O 3.55Å; S173-T234 VanDerWaalsContact CA-O 3.23Å; S173-T234 WeakPolarHBondContact CA-O 3.48Å
174T88.4Confident90.7Very high70 Ų7055.6 Ų55.643%0.42930%0.297SS..EExtended strand (participates in β ladder)trans-123161.6164.563.50000109Y233 T234 F236T174-Y233 WeakPolarHBondContact O-CA 3.3Å; T174-Y233 WeakPolarHBondContact O-CD1 3.41Å; T174-T234 PolarHBondContact N-O 3.45Å; T174-T234 PolarHBondContact O-N 3.04Å; T174-F236 HydrophobicContact CG2-CE2 4.28Å; T174-F236 WeakPolarHBondContact OG1-CE2 3.44Å
175Y89Confident90.5Very high96 Ų9653.7 Ų53.738%0.37628%0.282SS..EExtended strand (participates in β ladder)trans-132.9154.2-178.778.7-78.9000111.7V177 K188 F194 L231 S232 Y233Y175-V177 HydrophobicContact CD2-CG2 4.24Å; Y175-V177 HydrophobicContact CE2-CG2 4.23Å; Y175-K188 VanDerWaalsContact CD2-NZ 3.3Å; Y175-F194 HydrophobicContact CD1-CZ 4.45Å; Y175-F194 HydrophobicContact CE1-CE2 4.17Å; Y175-F194 AromaticContact CE1-CZ 3.94Å; Y175-F194 HydrophobicContact CE1-CZ 3.94Å; Y175-L231 HydrophobicContact CD2-CD1 4.06Å; Y175-S232 CarbonylContact C-O 3.49Å; Y175-S232 VanDerWaalsContact CA-O 3.24Å; Y175-S232 WeakPolarHBondContact CA-O 3.08Å; Y175-Y233 HydrophobicContact CG-CE1 4.29Å
176N90.7Very high90.3Very high70 Ų7053.4 Ų53.437%0.37428%0.279SS..EExtended strand (participates in β ladder)trans-139.3146.717160.9-66.8000110.7S232N176-S232 PolarHBondContact N-O 3.01Å; N176-S232 PolarHBondContact O-N 3.46Å; N176-S232 WeakPolarHBondContact OD1-CB 3.33Å; N176-S232 PolarHBondContact OD1-O 3.02Å
177V92.3Very high89.9Confident18 Ų1849.3 Ų49.311%0.10926%0.257CS..EExtended strand (participates in β ladder)trans-113.9129.5176.2-1770000108.3Y175 F186 I229 T230 L231Y175-V177 HydrophobicContact CD2-CG2 4.24Å; Y175-V177 HydrophobicContact CE2-CG2 4.23Å; V177-F186 HydrophobicContact CG1-CB 4.13Å; V177-F186 HydrophobicContact CG1-CG 4.24Å; V177-F186 HydrophobicContact CG2-CB 4.39Å; V177-F186 HydrophobicContact CG2-CD1 3.95Å; V177-F186 HydrophobicContact CG2-CG 4.19Å; V177-I229 HydrophobicContact CG1-CG2 3.49Å; V177-I229 VanDerWaalsContact CG1-CG2 3.49Å; V177-T230 WeakPolarHBondContact CA-O 3.37Å; V177-L231 HydrophobicContact CG2-CD1 4Å
178V92.3Very high89.5Confident74 Ų7445 Ų4545%0.44824%0.238SC..EExtended strand (participates in β ladder)trans-127.3133.4-179.9179.40000109.2I229 T230V178-I229 CarbonylContact O-C 3.57Å; V178-I229 WeakPolarHBondContact O-CA 3.38Å; V178-T230 PolarHBondContact N-O 3.43Å; V178-T230 PolarHBondContact O-N 3.28Å
179P93.3Very high88.6Confident40 Ų4044.4 Ų44.426%0.2623%0.231SC..SBendcis-68.2153.2-1.428.8-34.1000112.8D181 A182 V226 T228P179-D181 PolarHBondContact O-N 3.47Å; P179-A182 HydrophobicContact CG-CB 4.02Å; P179-A182 WeakPolarHBondContact O-CB 3.46Å; P179-A182 PolarHBondContact O-N 3.37Å; P179-A182 VanDerWaalsContact O-N 3.07Å; P179-V226 HydrophobicContact CG-CG1 3.61Å; P179-V226 HydrophobicContact CG-CG2 4.02Å; P179-T228 WeakPolarHBondContact CD-O 3.37Å
180F88.3Confident87.1Confident143 Ų14350.1 Ų50.163%0.62726%0.258SS*.G310 helixtrans-60.5-36.2-175.8-178.2-100.2000112.5A182 G183F180-A182 PolarHBondContact O-N 3.46Å; F180-G183 PolarHBondContact O-N 3.38Å
181D88.2Confident85.9Confident81 Ų8149.7 Ų49.743%0.43326%0.259SS..G310 helixtrans-61.5-28.8177.9-59.9-40.1000112.7P179 G183 Q184 M223P179-D181 PolarHBondContact O-N 3.47Å; D181-G183 VanDerWaalsContact C-N 3.32Å; D181-Q184 WeakPolarHBondContact O-CG 3.48Å; D181-M223 HydrophobicContact CB-CE 3.3Å; D181-M223 HydrophobicContact CB-SD 4.33Å
182A89.8Confident84.5Confident0 Ų050.3 Ų50.30%026%0.261CS..G310 helixtrans-79.2-17.8174.800000112.7P179 F180 Q184 Y185 F186 F217 M223 V226 I229P179-A182 HydrophobicContact CG-CB 4.02Å; P179-A182 WeakPolarHBondContact O-CB 3.46Å; P179-A182 PolarHBondContact O-N 3.37Å; P179-A182 VanDerWaalsContact O-N 3.07Å; F180-A182 PolarHBondContact O-N 3.46Å; A182-Q184 PolarHBondContact O-N 2.98Å; A182-Y185 PolarHBondContact O-N 3.43Å; A182-Y185 VanDerWaalsContact O-N 3.13Å; A182-F186 PolarHBondContact O-N 2.68Å; A182-F217 HydrophobicContact CB-CE2 3.86Å; A182-M223 HydrophobicContact CB-SD 4.03Å; A182-V226 HydrophobicContact CB-CG1 4.31Å; A182-I229 HydrophobicContact CB-CD1 3.98Å; A182-I229 HydrophobicContact CB-CG1 4.06Å
183G88.8Confident83.1Confident26 Ų2648.7 Ų48.727%0.26825%0.253SS..G310 helixtrans-61.8-27.5-177.300000113.8F180 D181 Y185 F186F180-G183 PolarHBondContact O-N 3.38Å; D181-G183 VanDerWaalsContact C-N 3.32Å; G183-Y185 VanDerWaalsContact C-N 3.31Å; G183-Y185 PolarHBondContact O-N 2.92Å; G183-F186 PolarHBondContact O-N 3Å
184Q88.6Confident81.8Confident71 Ų7155.8 Ų55.833%0.33228%0.284SS..G310 helixtrans-71.5-25.4177.770.2-177.21.400113.6D181 A182D181-Q184 WeakPolarHBondContact O-CG 3.48Å; A182-Q184 PolarHBondContact O-N 2.98Å
185Y90.3Very high81.1Confident24 Ų2458.3 Ų58.39%0.09429%0.291CS..THydrogen-bonded Turntrans-94.4-10.9177.8-57.6-74.1000112.2A182 G183 N187 I213 D214 E216 F217 D220 M223A182-Y185 PolarHBondContact O-N 3.43Å; A182-Y185 VanDerWaalsContact O-N 3.13Å; G183-Y185 VanDerWaalsContact C-N 3.31Å; G183-Y185 PolarHBondContact O-N 2.92Å; Y185-N187 PolarHBondContact O-N 3.36Å; Y185-I213 WeakPolarHBondContact O-CA 3.33Å; Y185-D214 HydrophobicContact CD1-CB 4.16Å; Y185-D214 PolarHBondContact O-N 3.38Å; Y185-E216 HydrophobicContact CD1-CB 4.21Å; Y185-E216 HydrophobicContact CE1-CB 3.89Å; Y185-F217 HydrophobicContact CD1-CB 4.24Å; Y185-F217 HydrophobicContact CD2-CB 4.41Å; Y185-F217 AromaticContact CD2-CD2 3.68Å; Y185-F217 HydrophobicContact CD2-CD2 3.68Å; Y185-F217 HydrophobicContact CD2-CE2 4.49Å; Y185-F217 HydrophobicContact CD2-CG 4.49Å; Y185-F217 HydrophobicContact CE2-CD2 4.47Å; Y185-F217 HydrophobicContact CG-CB 3.99Å; Y185-F217 AromaticContact CG-CD2 3.92Å; Y185-F217 HydrophobicContact CG-CD2 3.92Å; Y185-F217 HydrophobicContact CG-CG 4.47Å; Y185-D220 HydrophobicContact CE2-CB 4.44Å; Y185-D220 WeakPolarHBondContact OH-CB 3.43Å; Y185-D220 PolarHBondContact OH-OD2 3.28Å; Y185-M223 HydrophobicContact CD2-CG 4.09Å; Y185-M223 HydrophobicContact CD2-SD 4.41Å; Y185-M223 HydrophobicContact CE2-CG 3.68Å; Y185-M223 HydrophobicContact CE2-SD 4.34Å
186F90.2Very high80.9Confident13 Ų1360.3 Ų60.36%0.05730%0.304CS..EExtended strand (participates in β ladder)trans-87.999.9-178.5-166.8-83000110.1V126 V177 A182 G183 F211 I213 I229 L231V126-F186 HydrophobicContact CG1-CE2 4.38Å; V177-F186 HydrophobicContact CG1-CB 4.13Å; V177-F186 HydrophobicContact CG1-CG 4.24Å; V177-F186 HydrophobicContact CG2-CB 4.39Å; V177-F186 HydrophobicContact CG2-CD1 3.95Å; V177-F186 HydrophobicContact CG2-CG 4.19Å; A182-F186 PolarHBondContact O-N 2.68Å; G183-F186 PolarHBondContact O-N 3Å; F186-F211 HydrophobicContact CD2-CD2 4.39Å; F186-F211 HydrophobicContact CE1-CB 3.93Å; F186-F211 HydrophobicContact CE1-CD2 4.09Å; F186-F211 HydrophobicContact CE1-CG 4.06Å; F186-F211 AromaticContact CE2-CD2 3.41Å; F186-F211 HydrophobicContact CE2-CD2 3.41Å; F186-F211 VanDerWaalsContact CE2-CD2 3.41Å; F186-F211 AromaticContact CE2-CE2 3.56Å; F186-F211 HydrophobicContact CE2-CE2 3.56Å; F186-F211 HydrophobicContact CE2-CG 4.16Å; F186-F211 HydrophobicContact CE2-CZ 4.39Å; F186-F211 HydrophobicContact CZ-CB 3.88Å; F186-F211 HydrophobicContact CZ-CD1 4.12Å; F186-F211 AromaticContact CZ-CD2 3.22Å; F186-F211 HydrophobicContact CZ-CD2 3.22Å; F186-F211 HydrophobicContact CZ-CE1 4.46Å; F186-F211 AromaticContact CZ-CE2 3.65Å; F186-F211 HydrophobicContact CZ-CE2 3.65Å; F186-F211 AromaticContact CZ-CG 3.48Å; F186-F211 HydrophobicContact CZ-CG 3.48Å; F186-F211 VanDerWaalsContact CZ-CG 3.48Å; F186-F211 HydrophobicContact CZ-CZ 4.23Å; F186-I213 HydrophobicContact CD2-CG1 4.25Å; F186-I229 HydrophobicContact CD2-CG2 4.11Å; F186-I229 HydrophobicContact CE2-CG2 4.45Å; F186-L231 HydrophobicContact CE1-CD1 4.14Å; F186-L231 HydrophobicContact CE1-CD2 4.21Å; F186-L231 HydrophobicContact CZ-CD1 4.48Å; F186-L231 HydrophobicContact CZ-CD2 4.01Å
187N87.5Confident80.7Confident51 Ų5159.6 Ų59.627%0.27330%0.298SS..EExtended strand (participates in β ladder)trans-99.5116.2-176.8-74-62.2000110.7Y185 F211 Y212Y185-N187 PolarHBondContact O-N 3.36Å; N187-F211 CarbonylContact O-C 3.55Å; N187-F211 VanDerWaalsContact O-CA 3.24Å; N187-F211 WeakPolarHBondContact O-CA 3.34Å; N187-F211 WeakPolarHBondContact O-CB 3.5Å; N187-Y212 HydrophobicContact CB-CD1 3.86Å; N187-Y212 HydrophobicContact CB-CD2 4.22Å; N187-Y212 HydrophobicContact CB-CE1 3.38Å; N187-Y212 HydrophobicContact CB-CE2 3.74Å; N187-Y212 HydrophobicContact CB-CG 4.27Å; N187-Y212 PolarHBondContact N-O 2.91Å; N187-Y212 PolarHBondContact O-N 3.46Å
188K83.4Confident80.6Confident25 Ų2565.7 Ų65.711%0.10932%0.319CS..EExtended strand (participates in β ladder)trans-100.5111.4177.2-177.7173.258.8-168.90109.7Y175 C191 V209 Y233Y175-K188 VanDerWaalsContact CD2-NZ 3.3Å; K188-C191 HydrophobicContact CD-CB 3.83Å; K188-C191 WeakPolarHBondContact CD-SG 3.29Å; K188-C191 WeakPolarHBondContact CE-SG 3.12Å; K188-C191 HydrophobicContact CG-CB 4.3Å; K188-C191 PolarHBondContact NZ-SG 3.49Å; K188-V209 HydrophobicContact CD-CG1 4.02Å; K188-V209 HydrophobicContact CG-CG1 4.19Å; K188-Y233 VanDerWaalsContact CD-OH 3.22Å; K188-Y233 WeakPolarHBondContact CD-OH 3.42Å; K188-Y233 PolarHBondContact NZ-OH 2.96Å
189I73.1Confident80.6Confident45 Ų4562.6 Ų62.623%0.23130%0.3CS..EExtended strand (participates in β ladder)trans-77.4-38.6-174.8-59.4172.6000110.4T110 V113 F210 Y212T110-I189 HydrophobicContact CG2-CG2 4.5Å; V113-I189 HydrophobicContact CG2-CD1 4.09Å; I189-F210 HydrophobicContact CB-CD1 3.77Å; I189-F210 HydrophobicContact CB-CE1 4.41Å; I189-F210 HydrophobicContact CD1-CD1 3.65Å; I189-F210 HydrophobicContact CD1-CE1 3.44Å; I189-F210 VanDerWaalsContact CD1-CE1 3.44Å; I189-F210 HydrophobicContact CD1-CZ 4.35Å; I189-F210 HydrophobicContact CG1-CD1 4.25Å; I189-F210 HydrophobicContact CG1-CE1 4.49Å; I189-F210 HydrophobicContact CG2-CD1 3.99Å; I189-F210 HydrophobicContact CG2-CE1 4.46Å; I189-F210 PolarHBondContact N-O 3.38Å; I189-Y212 HydrophobicContact CD1-CD1 3.49Å; I189-Y212 VanDerWaalsContact CD1-CD1 3.49Å; I189-Y212 HydrophobicContact CD1-CE1 3.71Å; I189-Y212 HydrophobicContact CG1-CD1 3.74Å; I189-Y212 HydrophobicContact CG1-CE1 3.69Å
190Q58.8Low80.7Confident128 Ų12864 Ų6460%0.59831%0.305SS*.EExtended strand (participates in β ladder)trans-134.7133.5-179.6-64.2-177.1-46.600111.3F210Q190-F210 HydrophobicContact CB-CB 4.32Å; Q190-F210 PolarHBondContact N-O 2.93Å
191C64.4Low81Confident34 Ų3459.7 Ų59.723%0.2329%0.291CS..  trans-144.8131.6-175-1480000113.5K188 C193 Y233K188-C191 HydrophobicContact CD-CB 3.83Å; K188-C191 WeakPolarHBondContact CD-SG 3.29Å; K188-C191 WeakPolarHBondContact CE-SG 3.12Å; K188-C191 HydrophobicContact CG-CB 4.3Å; K188-C191 PolarHBondContact NZ-SG 3.49Å; C191-C193 HydrophobicContact CB-CB 4.05Å; C191-C193 WeakPolarHBondContact CB-SG 3.29Å; C191-C193 PolarHBondContact O-N 3.27Å; C191-C193 WeakPolarHBondContact SG-CB 3.49Å; C191-C193 CovalentContact SG-SG 1.98Å; C191-C193 PolarHBondContact SG-SG 3.03Å; C191-Y233 PolarHBondContact SG-OH 3.47Å
192F61.5Low81.4Confident12 Ų1260.9 Ų60.95%0.05329%0.294CS..SBendtrans-69.59.3166.660.2-95.3000114.6F140 Y159 S173 Q197 M207 V209 Y233 F235F140-F192 HydrophobicContact CZ-CZ 4.22Å; Y159-F192 HydrophobicContact CD2-CE1 4.44Å; S173-F192 WeakPolarHBondContact OG-CD2 3.39Å; S173-F192 WeakPolarHBondContact OG-CE2 3.45Å; F192-Q197 HydrophobicContact CB-CG 4.48Å; F192-M207 HydrophobicContact CB-SD 4.44Å; F192-M207 HydrophobicContact CD1-CB 4.14Å; F192-M207 HydrophobicContact CD2-SD 4.3Å; F192-M207 HydrophobicContact CG-SD 4.25Å; F192-V209 HydrophobicContact CD1-CG2 3.96Å; F192-V209 HydrophobicContact CE1-CG2 3.43Å; F192-V209 VanDerWaalsContact CE1-CG2 3.43Å; F192-Y233 HydrophobicContact CE1-CD1 4.37Å; F192-Y233 HydrophobicContact CE1-CE1 4.06Å; F192-Y233 HydrophobicContact CE1-CE2 4.23Å; F192-Y233 AromaticContact CE1-CZ 3.96Å; F192-Y233 AromaticContact CE2-CD1 3.6Å; F192-Y233 HydrophobicContact CE2-CD1 3.6Å; F192-Y233 AromaticContact CE2-CE1 3.75Å; F192-Y233 HydrophobicContact CE2-CE1 3.75Å; F192-Y233 HydrophobicContact CE2-CG 4.23Å; F192-Y233 AromaticContact CZ-CD1 3.36Å; F192-Y233 HydrophobicContact CZ-CD1 3.36Å; F192-Y233 AromaticContact CZ-CD2 3.97Å; F192-Y233 HydrophobicContact CZ-CD2 3.97Å; F192-Y233 AromaticContact CZ-CE1 3.42Å; F192-Y233 HydrophobicContact CZ-CE1 3.42Å; F192-Y233 VanDerWaalsContact CZ-CE1 3.42Å; F192-Y233 HydrophobicContact CZ-CE2 4Å; F192-Y233 AromaticContact CZ-CG 3.63Å; F192-Y233 HydrophobicContact CZ-CG 3.63Å; F192-Y233 AromaticContact CZ-CZ 3.73Å; F192-F235 HydrophobicContact CD2-CE1 4.31Å; F192-F235 HydrophobicContact CD2-CE2 4.13Å; F192-F235 AromaticContact CD2-CZ 3.5Å; F192-F235 HydrophobicContact CD2-CZ 3.5Å; F192-F235 HydrophobicContact CE2-CE1 4.38Å; F192-F235 AromaticContact CE2-CE2 3.48Å; F192-F235 HydrophobicContact CE2-CE2 3.48Å; F192-F235 VanDerWaalsContact CE2-CE2 3.48Å; F192-F235 AromaticContact CE2-CZ 3.35Å; F192-F235 HydrophobicContact CE2-CZ 3.35Å; F192-F235 HydrophobicContact CZ-CE2 4.23Å; F192-F235 HydrophobicContact CZ-CZ 4.4Å
193C59.3Low81.6Confident0 Ų064 Ų640%031%0.309CS..SBendtrans-108.15.2-146.6-28.90000114S173 C191 Y233S173-C193 CarbonylContact O-C 3.55Å; S173-C193 VanDerWaalsContact OG-CA 3.25Å; S173-C193 WeakPolarHBondContact OG-CA 3.45Å; S173-C193 WeakPolarHBondContact OG-CB 3.46Å; C191-C193 HydrophobicContact CB-CB 4.05Å; C191-C193 WeakPolarHBondContact CB-SG 3.29Å; C191-C193 PolarHBondContact O-N 3.27Å; C191-C193 WeakPolarHBondContact SG-CB 3.49Å; C191-C193 CovalentContact SG-SG 1.98Å; C191-C193 PolarHBondContact SG-SG 3.03Å; C193-Y233 HydrophobicContact CB-CE1 3.76Å; C193-Y233 WeakPolarHBondContact SG-CE1 3.33Å; C193-Y233 PolarHBondContact SG-OH 2.8Å
194F59.9Low81.9Confident151 Ų15166.9 Ų66.966%0.66232%0.315SS*.SBendtrans-132.710.3168.3-59.4-64.8000110.8Y175Y175-F194 HydrophobicContact CD1-CZ 4.45Å; Y175-F194 HydrophobicContact CE1-CE2 4.17Å; Y175-F194 AromaticContact CE1-CZ 3.94Å; Y175-F194 HydrophobicContact CE1-CZ 3.94Å
195E74.4Confident82.1Confident123 Ų12366.2 Ų66.258%0.57532%0.316SS*.SBendtrans-112.7136.2179.1-66.8-178178.500109Q197E195-Q197 PolarHBondContact O-N 2.92Å; E195-Q197 VanDerWaalsContact O-N 3.16Å
196E83.6Confident82.2Confident138 Ų13869 Ų6965%0.64533%0.333SS*.  trans-66.2112172.8-69.6-178.2178.300109.3I170I170-E196 HydrophobicContact CG2-CB 3.74Å; I170-E196 HydrophobicContact CG2-CG 4.21Å
197Q87.1Confident82.3Confident54 Ų5469 Ų6925%0.25233%0.333SS..EExtended strand (participates in β ladder)trans-92.4120.4175.3-61.2-55-45.800108.6W138 I170 G171 F192 E195W138-Q197 HydrophobicContact CH2-CB 4.05Å; W138-Q197 WeakPolarHBondContact CH2-O 3.31Å; I170-Q197 CarbonylContact C-O 3.54Å; I170-Q197 WeakPolarHBondContact CA-O 3.37Å; G171-Q197 PolarHBondContact N-O 2.76Å; G171-Q197 PolarHBondContact O-N 3.48Å; F192-Q197 HydrophobicContact CB-CG 4.48Å; E195-Q197 PolarHBondContact O-N 2.92Å; E195-Q197 VanDerWaalsContact O-N 3.16Å
198R90.1Very high82.4Confident147 Ų14769.9 Ų69.956%0.55534%0.341SS*.EExtended strand (participates in β ladder)trans-102.2119.1174.7178.6178.2166.8138-2.9109.6I170I170-R198 HydrophobicContact CG1-CB 4.15Å; I170-R198 HydrophobicContact CG1-CG 4.14Å
199L92.5Very high82.7Confident9 Ų968.7 Ų68.75%0.04734%0.336CS..EExtended strand (participates in β ladder)trans-107.8123171.2-74170.3000110W138 A161 N163 P168 I169 E203 V205W138-L199 HydrophobicContact CD2-CD1 3.78Å; W138-L199 HydrophobicContact CE3-CD1 3.81Å; W138-L199 HydrophobicContact CH2-CB 4.41Å; W138-L199 HydrophobicContact CH2-CD1 3.68Å; W138-L199 HydrophobicContact CH2-CG 3.98Å; W138-L199 HydrophobicContact CZ2-CB 3.82Å; W138-L199 HydrophobicContact CZ2-CD1 3.65Å; W138-L199 HydrophobicContact CZ2-CG 3.88Å; W138-L199 HydrophobicContact CZ3-CD1 3.75Å; W138-L199 HydrophobicContact CZ3-CG 4.49Å; A161-L199 HydrophobicContact CB-CD1 3.82Å; N163-L199 HydrophobicContact CB-CB 3.8Å; N163-L199 PolarHBondContact ND2-O 3.02Å; P168-L199 WeakPolarHBondContact CA-O 3.27Å; I169-L199 PolarHBondContact N-O 3.36Å; I169-L199 VanDerWaalsContact N-O 3.08Å; I169-L199 PolarHBondContact O-N 3.1Å; L199-E203 HydrophobicContact CD2-CB 4.25Å; L199-E203 HydrophobicContact CD2-CG 3.98Å; L199-V205 HydrophobicContact CD2-CB 4.05Å; L199-V205 HydrophobicContact CD2-CG2 3.56Å
200N94.5Very high83.6Confident69 Ų6969 Ų6937%0.36934%0.336SS..  trans-68.2167.4173.5-63.2-61.5000111N163 H202 E203N163-N200 WeakPolarHBondContact CB-O 3.24Å; N163-N200 PolarHBondContact ND2-O 3.5Å; N200-H202 PolarHBondContact O-N 3.35Å; N200-E203 HydrophobicContact CB-CB 4.15Å; N200-E203 WeakPolarHBondContact CB-OE2 3.39Å; N200-E203 PolarHBondContact N-OE2 3.37Å; N200-E203 PolarHBondContact ND2-OE2 2.93Å; N200-E203 VanDerWaalsContact O-CB 3.24Å; N200-E203 WeakPolarHBondContact O-CB 3.37Å; N200-E203 PolarHBondContact O-N 2.93Å; N200-E203 VanDerWaalsContact O-N 3.12Å
201P96Very high85.2Confident52 Ų5263 Ų6334%0.33831%0.308SS..THydrogen-bonded Turntrans-53130.9175.9-28.237.1000112.3T165 D166 E203T165-P201 VanDerWaalsContact O-CA 3.23Å; T165-P201 WeakPolarHBondContact O-CA 3.39Å; T165-P201 WeakPolarHBondContact O-CB 3.08Å; D166-P201 VanDerWaalsContact C-CG 3.49Å; D166-P201 VanDerWaalsContact O-CG 3.32Å; D166-P201 WeakPolarHBondContact O-CG 3.35Å; P201-E203 PolarHBondContact O-N 3.47Å
202H95.6Very high86.5Confident106 Ų10662.3 Ų62.349%0.49130%0.301SS..THydrogen-bonded Turntrans58.911.1-180-55.9-68.5000115.4N163 P164 D166 N200N163-H202 WeakPolarHBondContact O-CA 3.41Å; N163-H202 PolarHBondContact O-N 2.91Å; P164-H202 PolarHBondContact O-CE1 3.45Å; P164-H202 VanDerWaalsContact O-CE1 3.25Å; D166-H202 IonicContact OD1-CD2 3.8Å; D166-H202 IonicContact OD1-CE1 3.7Å; D166-H202 IonicContact OD1-NE2 2.8Å; D166-H202 PolarHBondContact OD1-NE2 3.3Å; N200-H202 PolarHBondContact O-N 3.35Å
203E94.9Very high88Confident67 Ų6761.8 Ų61.831%0.31330%0.298SS..  trans-74.2141.8177.7-170172.3-166.200110.8K162 N163 L199 N200 P201 V205K162-E203 WeakPolarHBondContact CA-O 3.41Å; N163-E203 PolarHBondContact N-O 3.46Å; L199-E203 HydrophobicContact CD2-CB 4.25Å; L199-E203 HydrophobicContact CD2-CG 3.98Å; N200-E203 HydrophobicContact CB-CB 4.15Å; N200-E203 WeakPolarHBondContact CB-OE2 3.39Å; N200-E203 PolarHBondContact N-OE2 3.37Å; N200-E203 PolarHBondContact ND2-OE2 2.93Å; N200-E203 VanDerWaalsContact O-CB 3.24Å; N200-E203 WeakPolarHBondContact O-CB 3.37Å; N200-E203 PolarHBondContact O-N 2.93Å; N200-E203 VanDerWaalsContact O-N 3.12Å; P201-E203 PolarHBondContact O-N 3.47Å; E203-V205 HydrophobicContact CG-CG2 4.05Å
204E95.2Very high89.5Confident85 Ų8563.1 Ų63.140%0.39731%0.305SS..EExtended strand (participates in β ladder)trans-134.2124.2-178.8-171.4172.4130.600108.6R160 A161 K162R160-E204 WeakPolarHBondContact CD-OE1 3.29Å; R160-E204 HydrophobicContact CG-CG 4.12Å; R160-E204 IonicContact CZ-OE1 3.57Å; R160-E204 IonicContact NE-OE1 3.82Å; R160-E204 IonicContact NH1-OE1 2.63Å; R160-E204 PolarHBondContact NH1-OE1 3.22Å; A161-E204 WeakPolarHBondContact O-CA 3.45Å; K162-E204 HydrophobicContact CB-CB 4.34Å; K162-E204 HydrophobicContact CB-CG 4.09Å; K162-E204 VanDerWaalsContact CD-OE2 3.27Å; K162-E204 WeakPolarHBondContact CD-OE2 2.94Å; K162-E204 WeakPolarHBondContact CE-OE2 3.16Å; K162-E204 HydrophobicContact CG-CB 4.16Å; K162-E204 HydrophobicContact CG-CG 4.31Å; K162-E204 IonicContact NZ-OE2 2.77Å; K162-E204 PolarHBondContact NZ-OE2 3.28Å
205V92.6Very high90.9Very high57 Ų5757.1 Ų57.135%0.34528%0.281SS..EExtended strand (participates in β ladder)trans-133.3140.3-174.51790000109.9A161 L199 E203 M207A161-V205 PolarHBondContact N-O 3.26Å; A161-V205 PolarHBondContact O-N 2.9Å; L199-V205 HydrophobicContact CD2-CB 4.05Å; L199-V205 HydrophobicContact CD2-CG2 3.56Å; E203-V205 HydrophobicContact CG-CG2 4.05Å; V205-M207 HydrophobicContact CG1-CG 4.48Å
206D92.3Very high91.6Very high84 Ų8457 Ų5745%0.44928%0.281SS..EExtended strand (participates in β ladder)trans-91.9121.6168.4-70.4-47.7000109.7Y159 R160 P208Y159-D206 CarbonylContact O-C 3.58Å; Y159-D206 WeakPolarHBondContact O-CA 3.42Å; R160-D206 WeakPolarHBondContact CD-OD1 3.45Å; R160-D206 IonicContact NE-OD1 3.05Å; R160-D206 PolarHBondContact NE-OD1 3.45Å; D206-P208 WeakPolarHBondContact O-CD 3.46Å
207M90.7Very high91.8Very high13 Ų1350.4 Ų50.46%0.06425%0.25CC..EExtended strand (participates in β ladder)trans-103.7110.3-178.7-64.4-178.6-61.200109.5F140 Y159 A161 F192 V205 F235F140-M207 HydrophobicContact CD2-CE 3.84Å; F140-M207 HydrophobicContact CE2-CE 3.41Å; F140-M207 VanDerWaalsContact CE2-CE 3.41Å; F140-M207 HydrophobicContact CZ-CE 4.44Å; Y159-M207 PolarHBondContact N-O 3.46Å; Y159-M207 PolarHBondContact O-N 2.98Å; A161-M207 HydrophobicContact CB-CE 3.55Å; A161-M207 HydrophobicContact CB-SD 4.4Å; F192-M207 HydrophobicContact CB-SD 4.44Å; F192-M207 HydrophobicContact CD1-CB 4.14Å; F192-M207 HydrophobicContact CD2-SD 4.3Å; F192-M207 HydrophobicContact CG-SD 4.25Å; V205-M207 HydrophobicContact CG1-CG 4.48Å; M207-F235 HydrophobicContact CE-CE2 3.72Å; M207-F235 HydrophobicContact CE-CZ 3.58Å; M207-F235 HydrophobicContact SD-CZ 3.91Å
208P91.1Very high91.9Very high68 Ų6850.5 Ų50.544%0.44225%0.252SS..EExtended strand (participates in β ladder)trans-75.5146.317729-32.3000111.9L156 A157 F158 D206L156-P208 HydrophobicContact CD1-CB 4Å; A157-P208 CarbonylContact O-C 3.52Å; A157-P208 WeakPolarHBondContact O-CA 3.37Å; F158-P208 HydrophobicContact CD1-CB 4.02Å; F158-P208 HydrophobicContact CE1-CB 3.81Å; D206-P208 WeakPolarHBondContact O-CD 3.46Å
209V89.7Confident91.8Very high0 Ų049.9 Ų49.90%026%0.26CS..EExtended strand (participates in β ladder)trans-126.8116.4169.7-177.90000108.2A157 Y159 K188 F192 F211 L231 Y233A157-V209 PolarHBondContact N-O 3.34Å; A157-V209 PolarHBondContact O-N 3.48Å; Y159-V209 HydrophobicContact CD2-CG2 3.92Å; Y159-V209 HydrophobicContact CE2-CG2 3.96Å; K188-V209 HydrophobicContact CD-CG1 4.02Å; K188-V209 HydrophobicContact CG-CG1 4.19Å; F192-V209 HydrophobicContact CD1-CG2 3.96Å; F192-V209 HydrophobicContact CE1-CG2 3.43Å; F192-V209 VanDerWaalsContact CE1-CG2 3.43Å; V209-F211 HydrophobicContact CG1-CD1 4.34Å; V209-L231 HydrophobicContact CG1-CD2 4.3Å; V209-Y233 HydrophobicContact CG2-CE2 4.3Å
210F91.1Very high91.6Very high53 Ų5350.5 Ų50.523%0.23226%0.263CS..EExtended strand (participates in β ladder)trans-104.5124.9177.7-169.8-125.8000110T154 A155 L156 I189 Q190T154-F210 VanDerWaalsContact CB-CZ 3.49Å; T154-F210 HydrophobicContact CG2-CE1 4.45Å; T154-F210 HydrophobicContact CG2-CE2 4.48Å; T154-F210 HydrophobicContact CG2-CZ 3.84Å; A155-F210 VanDerWaalsContact O-CD2 3.27Å; A155-F210 WeakPolarHBondContact O-CD2 3.24Å; L156-F210 HydrophobicContact CB-CD2 4.36Å; L156-F210 HydrophobicContact CD1-CB 4.04Å; L156-F210 HydrophobicContact CD1-CD2 4.12Å; I189-F210 HydrophobicContact CB-CD1 3.77Å; I189-F210 HydrophobicContact CB-CE1 4.41Å; I189-F210 HydrophobicContact CD1-CD1 3.65Å; I189-F210 HydrophobicContact CD1-CE1 3.44Å; I189-F210 VanDerWaalsContact CD1-CE1 3.44Å; I189-F210 HydrophobicContact CD1-CZ 4.35Å; I189-F210 HydrophobicContact CG1-CD1 4.25Å; I189-F210 HydrophobicContact CG1-CE1 4.49Å; I189-F210 HydrophobicContact CG2-CD1 3.99Å; I189-F210 HydrophobicContact CG2-CE1 4.46Å; I189-F210 PolarHBondContact N-O 3.38Å; Q190-F210 HydrophobicContact CB-CB 4.32Å; Q190-F210 PolarHBondContact N-O 2.93Å
211F92.6Very high91.3Very high0 Ų052.6 Ų52.60%028%0.281CS..EExtended strand (participates in β ladder)trans-149.4166.4-174.371.4-89.8000111.9V126 F128 I147 A155 A157 F186 N187 V209V126-F211 HydrophobicContact CB-CZ 4.37Å; V126-F211 HydrophobicContact CG1-CE2 4.31Å; V126-F211 HydrophobicContact CG1-CZ 3.96Å; V126-F211 HydrophobicContact CG2-CE2 4.17Å; V126-F211 HydrophobicContact CG2-CZ 4.37Å; F128-F211 AromaticContact CE1-CE1 3.82Å; F128-F211 HydrophobicContact CE1-CE1 3.82Å; F128-F211 HydrophobicContact CE1-CZ 4.11Å; F128-F211 AromaticContact CZ-CE1 3.75Å; F128-F211 HydrophobicContact CZ-CE1 3.75Å; F128-F211 AromaticContact CZ-CZ 3.81Å; F128-F211 HydrophobicContact CZ-CZ 3.81Å; I147-F211 HydrophobicContact CD1-CE1 4.25Å; I147-F211 HydrophobicContact CD1-CZ 3.8Å; A155-F211 HydrophobicContact CB-CE1 4.23Å; A155-F211 HydrophobicContact CB-CE2 4.2Å; A155-F211 HydrophobicContact CB-CZ 3.97Å; A155-F211 PolarHBondContact N-O 2.9Å; A155-F211 PolarHBondContact O-N 3.49Å; A157-F211 HydrophobicContact CB-CE1 4.21Å; F186-F211 HydrophobicContact CD2-CD2 4.39Å; F186-F211 HydrophobicContact CE1-CB 3.93Å; F186-F211 HydrophobicContact CE1-CD2 4.09Å; F186-F211 HydrophobicContact CE1-CG 4.06Å; F186-F211 AromaticContact CE2-CD2 3.41Å; F186-F211 HydrophobicContact CE2-CD2 3.41Å; F186-F211 VanDerWaalsContact CE2-CD2 3.41Å; F186-F211 AromaticContact CE2-CE2 3.56Å; F186-F211 HydrophobicContact CE2-CE2 3.56Å; F186-F211 HydrophobicContact CE2-CG 4.16Å; F186-F211 HydrophobicContact CE2-CZ 4.39Å; F186-F211 HydrophobicContact CZ-CB 3.88Å; F186-F211 HydrophobicContact CZ-CD1 4.12Å; F186-F211 AromaticContact CZ-CD2 3.22Å; F186-F211 HydrophobicContact CZ-CD2 3.22Å; F186-F211 HydrophobicContact CZ-CE1 4.46Å; F186-F211 AromaticContact CZ-CE2 3.65Å; F186-F211 HydrophobicContact CZ-CE2 3.65Å; F186-F211 AromaticContact CZ-CG 3.48Å; F186-F211 HydrophobicContact CZ-CG 3.48Å; F186-F211 VanDerWaalsContact CZ-CG 3.48Å; F186-F211 HydrophobicContact CZ-CZ 4.23Å; N187-F211 CarbonylContact O-C 3.55Å; N187-F211 VanDerWaalsContact O-CA 3.24Å; N187-F211 WeakPolarHBondContact O-CA 3.34Å; N187-F211 WeakPolarHBondContact O-CB 3.5Å; V209-F211 HydrophobicContact CG1-CD1 4.34Å
212Y91.9Very high90.9Very high21 Ų2155.6 Ų55.68%0.08229%0.285CS..EExtended strand (participates in β ladder)trans-144.7162.5167.866.6-82.3000109.9V113 M116 E153 N187 I189V113-Y212 HydrophobicContact CG2-CE1 4.05Å; M116-Y212 HydrophobicContact CE-CE2 3.88Å; M116-Y212 HydrophobicContact SD-CD2 4.23Å; M116-Y212 HydrophobicContact SD-CE2 3.96Å; E153-Y212 WeakPolarHBondContact O-CB 2.88Å; N187-Y212 HydrophobicContact CB-CD1 3.86Å; N187-Y212 HydrophobicContact CB-CD2 4.22Å; N187-Y212 HydrophobicContact CB-CE1 3.38Å; N187-Y212 HydrophobicContact CB-CE2 3.74Å; N187-Y212 HydrophobicContact CB-CG 4.27Å; N187-Y212 PolarHBondContact N-O 2.91Å; N187-Y212 PolarHBondContact O-N 3.46Å; I189-Y212 HydrophobicContact CD1-CD1 3.49Å; I189-Y212 VanDerWaalsContact CD1-CD1 3.49Å; I189-Y212 HydrophobicContact CD1-CE1 3.71Å; I189-Y212 HydrophobicContact CG1-CD1 3.74Å; I189-Y212 HydrophobicContact CG1-CE1 3.69Å
213I92.4Very high90.7Very high1 Ų150.6 Ų50.61%0.00526%0.262CS..EExtended strand (participates in β ladder)trans-102.6128.6169.9-58.1171.8000106.8I124 V126 V149 P151 G152 Y185 F186 F217 I229I124-I213 HydrophobicContact CB-CD1 3.96Å; I124-I213 HydrophobicContact CG1-CD1 4.32Å; I124-I213 HydrophobicContact CG2-CD1 3.9Å; V126-I213 HydrophobicContact CG2-CD1 4.18Å; V149-I213 HydrophobicContact CG2-CD1 3.67Å; V149-I213 HydrophobicContact CG2-CG1 4.48Å; P151-I213 HydrophobicContact CB-CG2 4.35Å; P151-I213 HydrophobicContact CG-CG2 4.43Å; G152-I213 PolarHBondContact N-O 2.99Å; Y185-I213 WeakPolarHBondContact O-CA 3.33Å; F186-I213 HydrophobicContact CD2-CG1 4.25Å; I213-F217 HydrophobicContact CG2-CB 3.87Å; I213-F217 HydrophobicContact CG2-CD2 4.2Å; I213-F217 HydrophobicContact CG2-CG 3.97Å; I213-I229 HydrophobicContact CD1-CD1 3.91Å; I213-I229 HydrophobicContact CG1-CD1 4.47Å
214D91.4Very high90.3Very high27 Ų2750.1 Ų50.114%0.14427%0.27CS..  trans-60.4133.8177.7-164.5-51.2000111Y185 E216 F217Y185-D214 HydrophobicContact CD1-CB 4.16Å; Y185-D214 PolarHBondContact O-N 3.38Å; D214-E216 PolarHBondContact O-N 3.4Å; D214-E216 WeakPolarHBondContact OD1-CB 3.27Å; D214-E216 WeakPolarHBondContact OD1-CG 3.44Å; D214-E216 PolarHBondContact OD1-N 2.93Å; D214-F217 WeakPolarHBondContact O-CB 3.35Å; D214-F217 PolarHBondContact O-N 3.12Å
215P89.3Confident89.9Confident25 Ų2557 Ų5716%0.16229%0.292CS..THydrogen-bonded Turntrans-56.4-27174.824.4-35.7000114.2M116 F217 D218M116-P215 HydrophobicContact CG-CG 4.14Å; M116-P215 VanDerWaalsContact SD-CD 3.55Å; M116-P215 HydrophobicContact SD-CG 4.1Å; P215-F217 PolarHBondContact O-N 3.47Å; P215-D218 PolarHBondContact O-N 3.27Å
216E88.3Confident89.9Confident120 Ų12055.3 Ų55.356%0.56128%0.282SS*.Hα-helixtrans-60.2-15.2174.7-68.3-172.4174.200113Y185 D214 D218 D219 D220Y185-E216 HydrophobicContact CD1-CB 4.21Å; Y185-E216 HydrophobicContact CE1-CB 3.89Å; D214-E216 PolarHBondContact O-N 3.4Å; D214-E216 WeakPolarHBondContact OD1-CB 3.27Å; D214-E216 WeakPolarHBondContact OD1-CG 3.44Å; D214-E216 PolarHBondContact OD1-N 2.93Å; E216-D218 PolarHBondContact O-N 2.9Å; E216-D219 PolarHBondContact O-N 3.49Å; E216-D220 PolarHBondContact O-N 3.28Å
217F89.6Confident89.9Confident0 Ų055.6 Ų55.60%028%0.283CS..Hα-helixtrans-55.8-33.7171.5-177.5-88.7000112.6I124 P151 A182 Y185 I213 D214 P215 M223 V226 I229I124-F217 HydrophobicContact CD1-CD1 4.39Å; I124-F217 HydrophobicContact CD1-CE1 3.63Å; I124-F217 HydrophobicContact CD1-CZ 4.3Å; I124-F217 HydrophobicContact CG1-CE1 4.17Å; P151-F217 HydrophobicContact CG-CD1 4.31Å; A182-F217 HydrophobicContact CB-CE2 3.86Å; Y185-F217 HydrophobicContact CD1-CB 4.24Å; Y185-F217 HydrophobicContact CD2-CB 4.41Å; Y185-F217 AromaticContact CD2-CD2 3.68Å; Y185-F217 HydrophobicContact CD2-CD2 3.68Å; Y185-F217 HydrophobicContact CD2-CE2 4.49Å; Y185-F217 HydrophobicContact CD2-CG 4.49Å; Y185-F217 HydrophobicContact CE2-CD2 4.47Å; Y185-F217 HydrophobicContact CG-CB 3.99Å; Y185-F217 AromaticContact CG-CD2 3.92Å; Y185-F217 HydrophobicContact CG-CD2 3.92Å; Y185-F217 HydrophobicContact CG-CG 4.47Å; I213-F217 HydrophobicContact CG2-CB 3.87Å; I213-F217 HydrophobicContact CG2-CD2 4.2Å; I213-F217 HydrophobicContact CG2-CG 3.97Å; D214-F217 WeakPolarHBondContact O-CB 3.35Å; D214-F217 PolarHBondContact O-N 3.12Å; P215-F217 PolarHBondContact O-N 3.47Å; F217-M223 HydrophobicContact CD1-CB 4.33Å; F217-M223 HydrophobicContact CD2-CB 4.12Å; F217-M223 HydrophobicContact CD2-CG 3.81Å; F217-M223 HydrophobicContact CD2-SD 4.07Å; F217-M223 HydrophobicContact CE1-CB 4.11Å; F217-M223 HydrophobicContact CE2-CB 3.9Å; F217-M223 HydrophobicContact CE2-CG 3.7Å; F217-M223 HydrophobicContact CE2-SD 3.48Å; F217-M223 WeakPolarHBondContact CE2-SD 3.34Å; F217-M223 HydrophobicContact CG-CB 4.34Å; F217-M223 HydrophobicContact CG-CG 4.42Å; F217-M223 HydrophobicContact CZ-CB 3.9Å; F217-M223 HydrophobicContact CZ-CG 4.22Å; F217-M223 HydrophobicContact CZ-SD 4.11Å; F217-M223 VanDerWaalsContact O-CB 3.29Å; F217-M223 WeakPolarHBondContact O-CB 3.46Å; F217-V226 HydrophobicContact CE2-CG1 4.37Å; F217-V226 HydrophobicContact CZ-CB 3.86Å; F217-V226 HydrophobicContact CZ-CG1 3.87Å; F217-V226 WeakPolarHBondContact CZ-O 3.38Å; F217-I229 HydrophobicContact CE2-CD1 4.21Å; F217-I229 HydrophobicContact CZ-CD1 4.48Å
218D88.3Confident90.1Very high57 Ų5757.7 Ų57.731%0.30530%0.297SS..Hα-helixtrans-77.9-28.3-178.7-160.544.4000112.8R122 P215 E216R122-D218 WeakPolarHBondContact CD-OD1 3.27Å; R122-D218 IonicContact CZ-OD1 3.01Å; R122-D218 IonicContact NE-OD1 3.89Å; R122-D218 IonicContact NH1-OD1 3.32Å; R122-D218 PolarHBondContact NH1-OD1 3.43Å; P215-D218 PolarHBondContact O-N 3.27Å; E216-D218 PolarHBondContact O-N 2.9Å
219D87.8Confident90.3Very high134 Ų13454.5 Ų54.572%0.71728%0.276SS*.Hα-helixtrans-78.4-20.6-178.7-66.9-38.8000112.9E216 P221E216-D219 PolarHBondContact O-N 3.49Å; D219-P221 VanDerWaalsContact O-CD 3.31Å; D219-P221 WeakPolarHBondContact O-CD 3.37Å
220D88.1Confident90.5Very high21 Ų2156.4 Ų56.411%0.11229%0.288CS..  trans-79.3116.7179.3-171.9-16.1000111.9Y185 E216 R222 M223 A224Y185-D220 HydrophobicContact CE2-CB 4.44Å; Y185-D220 WeakPolarHBondContact OH-CB 3.43Å; Y185-D220 PolarHBondContact OH-OD2 3.28Å; E216-D220 PolarHBondContact O-N 3.28Å; D220-R222 PolarHBondContact O-N 3.46Å; D220-R222 VanDerWaalsContact O-N 3.12Å; D220-R222 VanDerWaalsContact OD1-CB 3.27Å; D220-R222 WeakPolarHBondContact OD1-CB 3.35Å; D220-R222 WeakPolarHBondContact OD1-CG 3.32Å; D220-R222 PolarHBondContact OD1-N 2.83Å; D220-R222 IonicContact OD1-NE 2.76Å; D220-R222 PolarHBondContact OD1-NE 3.48Å; D220-R222 IonicContact OD2-CZ 2.8Å; D220-R222 VanDerWaalsContact OD2-CZ 3.32Å; D220-R222 IonicContact OD2-NE 3.69Å; D220-R222 PolarHBondContact OD2-NE 3.01Å; D220-R222 IonicContact OD2-NH2 3.58Å; D220-R222 PolarHBondContact OD2-NH2 3.46Å; D220-M223 HydrophobicContact CB-CB 4.25Å; D220-M223 HydrophobicContact CB-CG 4.06Å; D220-M223 PolarHBondContact O-N 2.9Å; D220-A224 PolarHBondContact O-N 3.12Å
221P88.2Confident90.6Very high113 Ų11353.9 Ų53.973%0.73428%0.277SS*.THydrogen-bonded Turntrans-59.1-26.5176.9-23.434.4000114.2D219 M223 A224D219-P221 VanDerWaalsContact O-CD 3.31Å; D219-P221 WeakPolarHBondContact O-CD 3.37Å; P221-M223 VanDerWaalsContact C-N 3.27Å; P221-A224 VanDerWaalsContact O-CB 3.29Å; P221-A224 WeakPolarHBondContact O-CB 3.47Å; P221-A224 PolarHBondContact O-N 2.95Å
222R87.7Confident90.6Very high116 Ų11654.4 Ų54.444%0.43828%0.28SS..THydrogen-bonded Turntrans-67.5-33.4176-59.7-179.4-61.31566.5110.9D220 A224D220-R222 PolarHBondContact O-N 3.46Å; D220-R222 VanDerWaalsContact O-N 3.12Å; D220-R222 VanDerWaalsContact OD1-CB 3.27Å; D220-R222 WeakPolarHBondContact OD1-CB 3.35Å; D220-R222 WeakPolarHBondContact OD1-CG 3.32Å; D220-R222 PolarHBondContact OD1-N 2.83Å; D220-R222 IonicContact OD1-NE 2.76Å; D220-R222 PolarHBondContact OD1-NE 3.48Å; D220-R222 IonicContact OD2-CZ 2.8Å; D220-R222 VanDerWaalsContact OD2-CZ 3.32Å; D220-R222 IonicContact OD2-NE 3.69Å; D220-R222 PolarHBondContact OD2-NE 3.01Å; D220-R222 IonicContact OD2-NH2 3.58Å; D220-R222 PolarHBondContact OD2-NH2 3.46Å; R222-A224 VanDerWaalsContact C-N 3.34Å
223M90.9Very high90.6Very high1 Ų153.4 Ų53.41%0.00528%0.276CS..G310 helixtrans-82.1-13-179.2-66.7-57.293.300112.4R122 D181 A182 Y185 F217 D220 P221 R225 V226R122-M223 PolarHBondContact NH2-O 2.83Å; D181-M223 HydrophobicContact CB-CE 3.3Å; D181-M223 HydrophobicContact CB-SD 4.33Å; A182-M223 HydrophobicContact CB-SD 4.03Å; Y185-M223 HydrophobicContact CD2-CG 4.09Å; Y185-M223 HydrophobicContact CD2-SD 4.41Å; Y185-M223 HydrophobicContact CE2-CG 3.68Å; Y185-M223 HydrophobicContact CE2-SD 4.34Å; F217-M223 HydrophobicContact CD1-CB 4.33Å; F217-M223 HydrophobicContact CD2-CB 4.12Å; F217-M223 HydrophobicContact CD2-CG 3.81Å; F217-M223 HydrophobicContact CD2-SD 4.07Å; F217-M223 HydrophobicContact CE1-CB 4.11Å; F217-M223 HydrophobicContact CE2-CB 3.9Å; F217-M223 HydrophobicContact CE2-CG 3.7Å; F217-M223 HydrophobicContact CE2-SD 3.48Å; F217-M223 WeakPolarHBondContact CE2-SD 3.34Å; F217-M223 HydrophobicContact CG-CB 4.34Å; F217-M223 HydrophobicContact CG-CG 4.42Å; F217-M223 HydrophobicContact CZ-CB 3.9Å; F217-M223 HydrophobicContact CZ-CG 4.22Å; F217-M223 HydrophobicContact CZ-SD 4.11Å; F217-M223 VanDerWaalsContact O-CB 3.29Å; F217-M223 WeakPolarHBondContact O-CB 3.46Å; D220-M223 HydrophobicContact CB-CB 4.25Å; D220-M223 HydrophobicContact CB-CG 4.06Å; D220-M223 PolarHBondContact O-N 2.9Å; P221-M223 VanDerWaalsContact C-N 3.27Å; M223-R225 PolarHBondContact O-N 3.33Å; M223-V226 HydrophobicContact CE-CG2 4.02Å; M223-V226 PolarHBondContact O-N 3.48Å; M223-V226 HydrophobicContact SD-CB 4.34Å; M223-V226 HydrophobicContact SD-CG2 4.03Å
224A87Confident90.5Very high57 Ų5754.8 Ų54.847%0.47129%0.285SS..G310 helixtrans-51.3-21.1-178.600000116.2R122 D220 P221 R222R122-A224 VanDerWaalsContact NH2-C 3.34Å; R122-A224 PolarHBondContact NH2-O 3.03Å; D220-A224 PolarHBondContact O-N 3.12Å; P221-A224 VanDerWaalsContact O-CB 3.29Å; P221-A224 WeakPolarHBondContact O-CB 3.47Å; P221-A224 PolarHBondContact O-N 2.95Å; R222-A224 VanDerWaalsContact C-N 3.34Å
225R87.6Confident90.5Very high230 Ų23053.5 Ų53.587%0.86828%0.278SS*.G310 helixtrans-111.45.6178.1-57.1-173.772.7173.63.5114.1M223M223-R225 PolarHBondContact O-N 3.33Å
226V91.6Very high90.5Very high21 Ų2155.5 Ų55.513%0.12728%0.284CS..  trans-95.8102178.9-178.70000108R122 P179 A182 F217 M223 I229R122-V226 PolarHBondContact NH2-O 2.94Å; P179-V226 HydrophobicContact CG-CG1 3.61Å; P179-V226 HydrophobicContact CG-CG2 4.02Å; A182-V226 HydrophobicContact CB-CG1 4.31Å; F217-V226 HydrophobicContact CE2-CG1 4.37Å; F217-V226 HydrophobicContact CZ-CB 3.86Å; F217-V226 HydrophobicContact CZ-CG1 3.87Å; F217-V226 WeakPolarHBondContact CZ-O 3.38Å; M223-V226 HydrophobicContact CE-CG2 4.02Å; M223-V226 PolarHBondContact O-N 3.48Å; M223-V226 HydrophobicContact SD-CB 4.34Å; M223-V226 HydrophobicContact SD-CG2 4.03Å; V226-I229 HydrophobicContact CG1-CG1 4.37Å
227D92.8Very high90.5Very high90 Ų9051.7 Ų51.748%0.48127%0.267SS..  trans-108.3-6.7177.6-54-47.9000112.1K125K125-D227 PolarHBondContact N-O 3.47Å
228T94.3Very high90.2Very high57 Ų5752.9 Ų52.935%0.3528%0.276SS..EExtended strand (participates in β ladder)trans-133.9127.7-178.6-59.10000110.5K125 P179K125-T228 WeakPolarHBondContact CE-OG1 3.47Å; K125-T228 CarbonylContact O-C 3.51Å; K125-T228 VanDerWaalsContact O-CA 3.24Å; K125-T228 WeakPolarHBondContact O-CA 3.41Å; P179-T228 WeakPolarHBondContact CD-O 3.37Å
229I95Very high89.7Confident1 Ų155.3 Ų55.31%0.00528%0.284CS..EExtended strand (participates in β ladder)trans-117.9133.5174.3-60.6176.3000107.6I124 K125 V126 T127 V177 V178 A182 F186 I213 F217 V226I124-I229 HydrophobicContact CG2-CD1 3.88Å; I124-I229 HydrophobicContact CG2-CG1 3.93Å; K125-I229 PolarHBondContact O-N 2.8Å; V126-I229 CarbonylContact C-O 3.54Å; V126-I229 VanDerWaalsContact CA-O 3.27Å; V126-I229 WeakPolarHBondContact CA-O 3.3Å; T127-I229 PolarHBondContact N-O 3.06Å; V177-I229 HydrophobicContact CG1-CG2 3.49Å; V177-I229 VanDerWaalsContact CG1-CG2 3.49Å; V178-I229 CarbonylContact O-C 3.57Å; V178-I229 WeakPolarHBondContact O-CA 3.38Å; A182-I229 HydrophobicContact CB-CD1 3.98Å; A182-I229 HydrophobicContact CB-CG1 4.06Å; F186-I229 HydrophobicContact CD2-CG2 4.11Å; F186-I229 HydrophobicContact CE2-CG2 4.45Å; I213-I229 HydrophobicContact CD1-CD1 3.91Å; I213-I229 HydrophobicContact CG1-CD1 4.47Å; F217-I229 HydrophobicContact CE2-CD1 4.21Å; F217-I229 HydrophobicContact CZ-CD1 4.48Å; V226-I229 HydrophobicContact CG1-CG1 4.37Å
230T95.4Very high88.6Confident39 Ų3958.2 Ų58.224%0.23929%0.293CS..EExtended strand (participates in β ladder)trans-109.6119.1175.3-53.90000109.5T127 N129 V177 V178T127-T230 CarbonylContact O-C 3.54Å; T127-T230 VanDerWaalsContact O-CA 3.3Å; T127-T230 WeakPolarHBondContact O-CA 3.14Å; N129-T230 HydrophobicContact CB-CG2 4.37Å; V177-T230 WeakPolarHBondContact CA-O 3.37Å; V178-T230 PolarHBondContact N-O 3.43Å; V178-T230 PolarHBondContact O-N 3.28Å
231L93.4Very high87.2Confident0 Ų061 Ų610%033%0.327CS..EExtended strand (participates in β ladder)trans-95.6109.6169.9-179.563.8000108.5T127 F128 N129 Y159 Y175 V177 F186 V209 Y233T127-L231 PolarHBondContact O-N 3.32Å; F128-L231 WeakPolarHBondContact CA-O 3.45Å; F128-L231 HydrophobicContact CD1-CB 4.14Å; F128-L231 HydrophobicContact CD1-CD2 4.07Å; F128-L231 HydrophobicContact CE1-CB 4.43Å; F128-L231 HydrophobicContact CE1-CD2 3.98Å; N129-L231 PolarHBondContact N-O 3.27Å; Y159-L231 PolarHBondContact OH-O 3Å; Y175-L231 HydrophobicContact CD2-CD1 4.06Å; V177-L231 HydrophobicContact CG2-CD1 4Å; F186-L231 HydrophobicContact CE1-CD1 4.14Å; F186-L231 HydrophobicContact CE1-CD2 4.21Å; F186-L231 HydrophobicContact CZ-CD1 4.48Å; F186-L231 HydrophobicContact CZ-CD2 4.01Å; V209-L231 HydrophobicContact CG1-CD2 4.3Å; L231-Y233 HydrophobicContact CD1-CE2 4.05Å; L231-Y233 HydrophobicContact CD2-CD2 4.48Å; L231-Y233 HydrophobicContact CD2-CE2 3.8Å; L231-Y233 HydrophobicContact CG-CD2 4.18Å; L231-Y233 HydrophobicContact CG-CE2 3.82Å
232S91.8Very high85.6Confident11 Ų1161.6 Ų61.68%0.07732%0.32CS..EExtended strand (participates in β ladder)trans-108.7135.6179.6-60.30000110.1N129 Y175 N176N129-S232 WeakPolarHBondContact CB-OG 3.45Å; Y175-S232 CarbonylContact C-O 3.49Å; Y175-S232 VanDerWaalsContact CA-O 3.24Å; Y175-S232 WeakPolarHBondContact CA-O 3.08Å; N176-S232 PolarHBondContact N-O 3.01Å; N176-S232 PolarHBondContact O-N 3.46Å; N176-S232 WeakPolarHBondContact OD1-CB 3.33Å; N176-S232 PolarHBondContact OD1-O 3.02Å
233Y91.1Very high83.9Confident0 Ų064 Ų640%034%0.336CS..EExtended strand (participates in β ladder)trans-120.1137.4176-89.4-77.4000111.1N129 D131 Y159 T174 Y175 K188 C191 F192 C193 V209 L231N129-Y233 PolarHBondContact O-N 3.41Å; N129-Y233 VanDerWaalsContact O-N 3.07Å; D131-Y233 PolarHBondContact N-O 2.93Å; Y159-Y233 HydrophobicContact CE1-CD2 4.32Å; Y159-Y233 AromaticContact CE2-CD2 3.95Å; Y159-Y233 HydrophobicContact CE2-CD2 3.95Å; Y159-Y233 HydrophobicContact CE2-CE2 4.19Å; Y159-Y233 AromaticContact CZ-CD2 3.69Å; Y159-Y233 WeakPolarHBondContact OH-CD2 3.27Å; T174-Y233 WeakPolarHBondContact O-CA 3.3Å; T174-Y233 WeakPolarHBondContact O-CD1 3.41Å; Y175-Y233 HydrophobicContact CG-CE1 4.29Å; K188-Y233 VanDerWaalsContact CD-OH 3.22Å; K188-Y233 WeakPolarHBondContact CD-OH 3.42Å; K188-Y233 PolarHBondContact NZ-OH 2.96Å; C191-Y233 PolarHBondContact SG-OH 3.47Å; F192-Y233 HydrophobicContact CE1-CD1 4.37Å; F192-Y233 HydrophobicContact CE1-CE1 4.06Å; F192-Y233 HydrophobicContact CE1-CE2 4.23Å; F192-Y233 AromaticContact CE1-CZ 3.96Å; F192-Y233 AromaticContact CE2-CD1 3.6Å; F192-Y233 HydrophobicContact CE2-CD1 3.6Å; F192-Y233 AromaticContact CE2-CE1 3.75Å; F192-Y233 HydrophobicContact CE2-CE1 3.75Å; F192-Y233 HydrophobicContact CE2-CG 4.23Å; F192-Y233 AromaticContact CZ-CD1 3.36Å; F192-Y233 HydrophobicContact CZ-CD1 3.36Å; F192-Y233 AromaticContact CZ-CD2 3.97Å; F192-Y233 HydrophobicContact CZ-CD2 3.97Å; F192-Y233 AromaticContact CZ-CE1 3.42Å; F192-Y233 HydrophobicContact CZ-CE1 3.42Å; F192-Y233 VanDerWaalsContact CZ-CE1 3.42Å; F192-Y233 HydrophobicContact CZ-CE2 4Å; F192-Y233 AromaticContact CZ-CG 3.63Å; F192-Y233 HydrophobicContact CZ-CG 3.63Å; F192-Y233 AromaticContact CZ-CZ 3.73Å; C193-Y233 HydrophobicContact CB-CE1 3.76Å; C193-Y233 WeakPolarHBondContact SG-CE1 3.33Å; C193-Y233 PolarHBondContact SG-OH 2.8Å; V209-Y233 HydrophobicContact CG2-CE2 4.3Å; L231-Y233 HydrophobicContact CD1-CE2 4.05Å; L231-Y233 HydrophobicContact CD2-CD2 4.48Å; L231-Y233 HydrophobicContact CD2-CE2 3.8Å; L231-Y233 HydrophobicContact CG-CD2 4.18Å; L231-Y233 HydrophobicContact CG-CE2 3.82Å
234T91.4Very high82.4Confident30 Ų3069 Ų6918%0.18436%0.362CS..EExtended strand (participates in β ladder)trans-127.8124.8175.2-52.80000110.6D131 S173 T174 F236D131-T234 HydrophobicContact CB-CG2 4.22Å; D131-T234 VanDerWaalsContact O-CA 3.3Å; D131-T234 WeakPolarHBondContact O-CA 3.47Å; S173-T234 CarbonylContact C-O 3.55Å; S173-T234 VanDerWaalsContact CA-O 3.23Å; S173-T234 WeakPolarHBondContact CA-O 3.48Å; T174-T234 PolarHBondContact N-O 3.45Å; T174-T234 PolarHBondContact O-N 3.04Å; T234-F236 HydrophobicContact CG2-CE1 4.35Å; T234-F236 HydrophobicContact CG2-CE2 3.71Å; T234-F236 HydrophobicContact CG2-CZ 3.62Å; T234-F236 WeakPolarHBondContact O-CE2 3.25Å
235F90.4Very high80.9Confident0 Ų072.1 Ų72.10%038%0.378CS..EExtended strand (participates in β ladder)trans-91.6143.2174.7-88.2-87000113.1D131 H133 I136 W138 F140 F192 M207D131-F235 PolarHBondContact O-N 3.12Å; H133-F235 VanDerWaalsContact CB-O 3.23Å; H133-F235 WeakPolarHBondContact CB-O 3.49Å; H133-F235 PolarHBondContact N-O 3.35Å; I136-F235 HydrophobicContact CD1-CB 4.35Å; I136-F235 HydrophobicContact CG2-CB 4.14Å; I136-F235 WeakPolarHBondContact CG2-O 3.31Å; W138-F235 HydrophobicContact CE3-CD1 4Å; W138-F235 HydrophobicContact CE3-CE1 4.26Å; W138-F235 HydrophobicContact CE3-CG 4.27Å; W138-F235 HydrophobicContact CH2-CE1 4.46Å; W138-F235 AromaticContact CZ3-CD1 3.63Å; W138-F235 HydrophobicContact CZ3-CD1 3.63Å; W138-F235 AromaticContact CZ3-CE1 3.56Å; W138-F235 HydrophobicContact CZ3-CE1 3.56Å; W138-F235 HydrophobicContact CZ3-CG 4.33Å; W138-F235 HydrophobicContact CZ3-CZ 4.21Å; F140-F235 AromaticContact CD1-CD2 3.61Å; F140-F235 HydrophobicContact CD1-CD2 3.61Å; F140-F235 HydrophobicContact CD1-CE2 4.05Å; F140-F235 HydrophobicContact CD2-CD2 4.01Å; F140-F235 AromaticContact CD2-CE2 3.77Å; F140-F235 HydrophobicContact CD2-CE2 3.77Å; F140-F235 AromaticContact CE1-CD2 3.69Å; F140-F235 HydrophobicContact CE1-CD2 3.69Å; F140-F235 AromaticContact CE1-CE2 3.81Å; F140-F235 HydrophobicContact CE1-CE2 3.81Å; F140-F235 HydrophobicContact CE2-CD2 4.05Å; F140-F235 AromaticContact CE2-CE2 3.47Å; F140-F235 HydrophobicContact CE2-CE2 3.47Å; F140-F235 VanDerWaalsContact CE2-CE2 3.47Å; F140-F235 HydrophobicContact CE2-CZ 4.5Å; F140-F235 AromaticContact CG-CD2 3.8Å; F140-F235 HydrophobicContact CG-CD2 3.8Å; F140-F235 HydrophobicContact CG-CE2 4.05Å; F140-F235 AromaticContact CZ-CD2 3.92Å; F140-F235 HydrophobicContact CZ-CD2 3.92Å; F140-F235 AromaticContact CZ-CE2 3.52Å; F140-F235 HydrophobicContact CZ-CE2 3.52Å; F192-F235 HydrophobicContact CD2-CE1 4.31Å; F192-F235 HydrophobicContact CD2-CE2 4.13Å; F192-F235 AromaticContact CD2-CZ 3.5Å; F192-F235 HydrophobicContact CD2-CZ 3.5Å; F192-F235 HydrophobicContact CE2-CE1 4.38Å; F192-F235 AromaticContact CE2-CE2 3.48Å; F192-F235 HydrophobicContact CE2-CE2 3.48Å; F192-F235 VanDerWaalsContact CE2-CE2 3.48Å; F192-F235 AromaticContact CE2-CZ 3.35Å; F192-F235 HydrophobicContact CE2-CZ 3.35Å; F192-F235 HydrophobicContact CZ-CE2 4.23Å; F192-F235 HydrophobicContact CZ-CZ 4.4Å; M207-F235 HydrophobicContact CE-CE2 3.72Å; M207-F235 HydrophobicContact CE-CZ 3.58Å; M207-F235 HydrophobicContact SD-CZ 3.91Å
236F89.8Confident79.4Confident67 Ų6766.4 Ų66.429%0.29436%0.364SS..EExtended strand (participates in β ladder)trans-128.5141.3176.2-58.9-91.2000109.6H133 G171 I172 T174 T234 A238H133-F236 HydrophobicContact CB-CD1 3.48Å; H133-F236 VanDerWaalsContact CB-CD1 3.48Å; H133-F236 HydrophobicContact CB-CE1 3.72Å; H133-F236 HydrophobicContact CB-CG 4.22Å; H133-F236 AromaticContact CD2-CE1 3.71Å; H133-F236 AromaticContact CG-CD1 3.59Å; H133-F236 AromaticContact CG-CE1 3.72Å; G171-F236 CarbonylContact C-O 3.56Å; G171-F236 VanDerWaalsContact CA-O 3.25Å; G171-F236 WeakPolarHBondContact CA-O 3.25Å; I172-F236 HydrophobicContact CG2-CB 4.27Å; I172-F236 PolarHBondContact N-O 3.47Å; I172-F236 PolarHBondContact O-N 3.14Å; T174-F236 HydrophobicContact CG2-CE2 4.28Å; T174-F236 WeakPolarHBondContact OG1-CE2 3.44Å; T234-F236 HydrophobicContact CG2-CE1 4.35Å; T234-F236 HydrophobicContact CG2-CE2 3.71Å; T234-F236 HydrophobicContact CG2-CZ 3.62Å; T234-F236 WeakPolarHBondContact O-CE2 3.25Å; F236-A238 PolarHBondContact O-N 3.09Å
237E88.9Confident77.5Confident41 Ų4171.9 Ų71.919%0.19240%0.4CS..EExtended strand (participates in β ladder)trans-67.1122.1171.3-174-176.1-14900109.7S135 I136 I169 K239S135-E237 VanDerWaalsContact O-OE2 3.09Å; I136-E237 HydrophobicContact CB-CB 4.11Å; I169-E237 HydrophobicContact CG2-CG 4.34Å; E237-K239 HydrophobicContact CG-CG 4.33Å; E237-K239 PolarHBondContact O-N 3.43Å; E237-K239 WeakPolarHBondContact OE2-CE 3.43Å; E237-K239 IonicContact OE2-NZ 3.86Å
238A83.3Confident75.7Confident24 Ų2471.1 Ų71.120%0.19841%0.413CS..  trans-83107.8170.300000108.3I170 I172 F236I170-A238 HydrophobicContact CB-CB 4.38Å; I170-A238 HydrophobicContact CG2-CB 3.94Å; I170-A238 PolarHBondContact O-N 3.44Å; I172-A238 HydrophobicContact CG2-CB 4.48Å; F236-A238 PolarHBondContact O-N 3.09Å
239K76.3Confident73.3Confident109 Ų10977.3 Ų77.347%0.47443%0.432SS..  trans-91.2134.3172.8-67.2-177179.6179.70109.4E237 G241 Q242E237-K239 HydrophobicContact CG-CG 4.33Å; E237-K239 PolarHBondContact O-N 3.43Å; E237-K239 WeakPolarHBondContact OE2-CE 3.43Å; E237-K239 IonicContact OE2-NZ 3.86Å; K239-G241 PolarHBondContact O-N 3.15Å; K239-G241 VanDerWaalsContact O-N 3.14Å; K239-Q242 HydrophobicContact CB-CG 4.26Å; K239-Q242 PolarHBondContact O-N 3.35Å; K239-Q242 VanDerWaalsContact O-N 3.1Å
240E65.1Low70.6Confident195 Ų19582.6 Ų82.691%0.91147%0.469SS*.THydrogen-bonded Turntrans-53.2121.1169-69.6179.7176.600109.5
241G59.4Low68.4Low80 Ų8088.9 Ų88.983%0.82549%0.489SS*.THydrogen-bonded Turntrans95-0.8179.500000116.6K239 Q243K239-G241 PolarHBondContact O-N 3.15Å; K239-G241 VanDerWaalsContact O-N 3.14Å; G241-Q243 PolarHBondContact O-N 3.42Å
242Q55.4Low65.9Low125 Ų12599.6 Ų99.658%0.58455%0.547SS*.  trans-85.493.9166.3-78.6-170.9-1200110.2K239 L244K239-Q242 HydrophobicContact CB-CG 4.26Å; K239-Q242 PolarHBondContact O-N 3.35Å; K239-Q242 VanDerWaalsContact O-N 3.1Å; Q242-L244 PolarHBondContact O-N 3.25Å
243Q51.6Low64.6Low167 Ų167104.1 Ų104.178%0.7857%0.57SS**  trans-65.4103.4170.3-142.2115.417.500108.4G241 P245G241-Q243 PolarHBondContact O-N 3.42Å; Q243-P245 WeakPolarHBondContact O-CD 3.49Å
244L58.3Low63.2Low105 Ų105109.5 Ų109.555%0.5560%0.6SS.*  trans-67.2122.8170.2-68171.1000107.5I172 Q242 L246I172-L244 HydrophobicContact CD1-CD1 4.06Å; I172-L244 HydrophobicContact CG2-CD1 4.32Å; Q242-L244 PolarHBondContact O-N 3.25Å; L244-L246 PolarHBondContact O-N 2.82Å
245P56.1Low61.7Low122 Ų122113.9 Ų113.979%0.79262%0.623SS**  trans-66.2101.4172.926-30.4000107.5Q243Q243-P245 WeakPolarHBondContact O-CD 3.49Å
246L55.7Low60Low111 Ų111120.6 Ų120.658%0.58166%0.66SS**  trans-61.4125.9168.9-66.7173.2000107.4L244 G248L244-L246 PolarHBondContact O-N 2.82Å; L246-G248 PolarHBondContact O-N 3.09Å
247P52.2Low58.1Low136 Ų136124 Ų12488%0.88368%0.683SS**THydrogen-bonded Turntrans-62.4107.9176.824-31.1000108.9
248G54.6Low56.1Low74 Ų74129.5 Ų129.576%0.76372%0.716SS**THydrogen-bonded Turntrans116.81.7169.300000117.9L246L246-G248 PolarHBondContact O-N 3.09Å
249Y43.7Very low54.1Low186 Ų186137.1 Ų137.173%0.72975%0.753SS**  trans-117.6105.1173.4-99.2-98.6000111.9Y251Y249-Y251 PolarHBondContact O-N 3.26Å
250S39.2Very low52.4Low112 Ų112139.2 Ų139.278%0.78377%0.774SS**  trans-75.6105164.5-176.90000107.7N252S250-N252 PolarHBondContact O-N 3.24Å
251Y48.7Very low51.3Low171 Ų171134.6 Ų134.667%0.67176%0.763SS**  trans-70.1114166.3-71.1-86.3000107.7Y249Y249-Y251 PolarHBondContact O-N 3.26Å
252N41.3Very low50.6Low226 Ų226139.5 Ų139.5100%1.20976%0.757SS**  trans-90.20171-150.925.6000108.9S250S250-N252 PolarHBondContact O-N 3.24Å

Retrieved 252 of 252 residues in 674.4 ms (Link to these results)