A0A087WUK2_HUMAN Loading...

Heterogeneous nuclear ribonucleoprotein D-like

Acts as a transcriptional regulator. Promotes transcription repression. Promotes transcription activation in differentiated myotubes. Binds to double- and single-stranded DNA sequences. Binds to the transcription suppressor CATR sequence of the COX5B promoter. Binds with high affinity to RNA molecules that contain AU-rich elements (AREs) found within the 3'-UTR of many proto-oncogenes and cytokine mRNAs. Binds both to nuclear and cytoplasmic poly(A) mRNAs. Binds to poly(G) and poly(A), but not to poly(U) or poly(C) RNA homopolymers. Binds to the 5'-ACUAGC-3' RNA consensus sequence.

AlphaFold DB , UniProt , Accession A0A087WUK2, Species HUMAN (Homo sapiens, Human), Gene HNRNPDL, Length 363 aa.

Structure Viewer
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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
1M50Low57.9Low240 Ų240159.2 Ų159.2100%1.18285%0.853SS**  0101.60-75.5-178.5176.700106.7
2E47.6Very low58.8Low198 Ų198155.5 Ų155.593%0.92584%0.844SS**  trans-158.8125.7160-123.9172.9128.700108.8
3V63.1Low58.6Low133 Ų133152.5 Ų152.581%0.80684%0.838SS**PPolyproline II helixtrans-95.8132.9-172179.90000107.3
4P66.3Low58.3Low113 Ų113154 Ų15473%0.73484%0.842SS**PPolyproline II helixtrans-74.6143.5174.929.3-33000111.5
5P64.6Low58.2Low131 Ų131156.9 Ų156.985%0.85184%0.844SS**PPolyproline II helixtrans-77.3154.8178.729.7-32.1000113.5
6R52.8Low58Low241 Ų241155 Ų15591%0.90984%0.843SS**PPolyproline II helixtrans-71.4148.2-160.9-68.5161.3173.6-114-0.9114.9
7L48.8Very low57.2Low162 Ų162152.2 Ų152.285%0.84884%0.837SS**PPolyproline II helixtrans-53.6130.7163.1-79.489000111.7H9L7-H9 PolarHBondContact O-N 2.76Å
8S53.8Low57Low117 Ų117149.2 Ų149.282%0.81884%0.835SS**  trans-80.7103.3161.2440000109.5
9H61.8Low56.9Low182 Ų182148.1 Ų148.184%0.84384%0.835SS**PPolyproline II helixtrans-84116.8174.2-143.240.4000108.8L7L7-H9 PolarHBondContact O-N 2.76Å
10V61.3Low56.3Low124 Ų124144.8 Ų144.875%0.75283%0.828SS**PPolyproline II helixtrans-81.3128.2175.2178.70000108.8
11P67.4Low55.8Low110 Ų110143.8 Ų143.871%0.71483%0.825SS**PPolyproline II helixtrans-80.8144.3176.931.2-33.1000112.2
12P68.4Low55.4Low115 Ų115140 Ų14075%0.74781%0.808SS**PPolyproline II helixtrans-79.9154.4173.232-33.7000112.6
13P55.9Low54.9Low117 Ų117135.2 Ų135.276%0.7680%0.802SS**PPolyproline II helixtrans-75.5142.1-177.129.6-33.7000113.4
14L54.2Low54Low173 Ų173134.1 Ų134.191%0.90680%0.801SS**PPolyproline II helixtrans-69.9126.6178.2-66.3158.8000111.5
15F57Low52.8Low198 Ų198140.5 Ų140.587%0.86881%0.81SS**PPolyproline II helixtrans-89.8135.4162.7-79.5-84.8000109.9
16P54.6Low51.6Low126 Ų126139.3 Ų139.382%0.81881%0.805SS**PPolyproline II helixtrans-76.8131.5175.228.3-30.9000112.2
17S45.2Very low51.1Low108 Ų108135.4 Ų135.476%0.75580%0.801SS**PPolyproline II helixtrans-58.3140.8174.249.50000114.4
18A52.5Low50.6Low97 Ų97131.5 Ų131.580%0.80279%0.787SS**PPolyproline II helixtrans-64.3151.1158.800000111.5
19P56.3Low50.4Low128 Ų128134.3 Ų134.383%0.83179%0.787SS**  trans-109.8124.3155.732.7-25.2000111.5
20A44.8Very low49.2Very low83 Ų83137.4 Ų137.469%0.68679%0.792SS**  trans-97.2133.8154.400000108
21T46Very low48.4Very low124 Ų124143.3 Ų143.376%0.76180%0.8SS**  156.4140.4117.442.40000114.7
22L40.4Very low47.6Very low161 Ų161143.8 Ų143.884%0.84380%0.803SS**  trans57.8124149.2-8396.6000120.8
23A37.9Very low46.6Very low96 Ų96149.1 Ų149.179%0.79381%0.809SS**  176.4147.69200000112.7
24S43.9Very low46.7Very low111 Ų111148.9 Ų148.978%0.77681%0.807SS**  trans-50.8145.3176.454.90000116.3
25R40.8Very low46.8Very low247 Ų247147 Ų14793%0.93281%0.805SS**  trans-156.6121.1140.1-117.2166.7151.3-141.6-7112.6
26S39.8Very low46.2Very low105 Ų105148.6 Ų148.673%0.73481%0.806SS**  trans-51.1141.9165.3173.90000112.1
27L41.7Very low45.5Very low160 Ų160151.8 Ų151.884%0.83881%0.809SS**  trans-166112.3132.4-121.188.1000110.6
28S39.4Very low45.4Very low80 Ų80154.7 Ų154.756%0.55982%0.816SS**  trans42.5118.4134.250.30000121.5
29H49.3Very low45.3Very low176 Ų176154.3 Ų154.382%0.81581%0.813SS**  trans56.7117.4135.1-69.971.7000118
30W35.6Very low45.3Very low247 Ų247154.4 Ų154.494%0.93681%0.813SS**  178.3114.3121.8-101.650.4000109.3
31R44.8Very low45.1Very low247 Ų247158.1 Ų158.193%0.93282%0.821SS**PPolyproline II helixtrans-89.4132.9165-88.1179.5169.3-115.23.2108.6
32P51.3Low44.9Very low120 Ų120159.5 Ų159.578%0.77982%0.823SS**PPolyproline II helixtrans-101.5138.3151.6-0.721.2000110.8
33R47.6Very low45.5Very low227 Ų227157.2 Ų157.286%0.85782%0.817SS**PPolyproline II helixtrans-72.6159.4-178.2-70.3173.3167.7-171.1-4.4112.6
34P57.5Low45.8Very low113 Ų113157.7 Ų157.773%0.73482%0.815SS**PPolyproline II helixtrans-71150.6169.730.8-35000111.7R36P34-R36 PolarHBondContact O-N 3.31Å
35P56.7Low45.5Very low133 Ų133160.7 Ų160.786%0.86482%0.822SS**PPolyproline II helixtrans-70.3132.2174.127.1-30.9000111.4
36R43.7Very low45.5Very low232 Ų232153 Ų15388%0.87581%0.811SS**PPolyproline II helixtrans-64.7143.8178.8-82.7171.4150.4-173.7-8.1112.2P34P34-R36 PolarHBondContact O-N 3.31Å
37Q40Very low46.2Very low192 Ų192153.8 Ų153.890%0.89781%0.814SS**PPolyproline II helixtrans-54.6141157.8-64.9-174.5-3.700111.4
38L44.5Very low45.9Very low169 Ų169151 Ų15189%0.88581%0.807SS**  trans-125.8110.3161.4-89.1162.1000107.8
39A48.7Very low45.8Very low90 Ų90152 Ų15274%0.74482%0.815SS**  trans-79.7156.4160.900000109.8
40P56.6Low45.1Very low129 Ų129147.7 Ų147.784%0.83881%0.809SS**  trans-112.6133.6147.732.2-23.9000112.3
41L40.2Very low45.2Very low161 Ų161146 Ų14684%0.84380%0.802SS**  trans-71.9127.2166-79.1164.5000109.4
42L42.4Very low44.8Very low154 Ų154142.2 Ų142.281%0.80680%0.795SS**  146.3170.3101-91153.5000108.6
43P52.8Low43.9Very low112 Ų112139.9 Ų139.973%0.72779%0.793SS**  cis-129.3169-20.728.5-7.9000114.1
44S44.1Very low43.4Very low107 Ų107133.6 Ų133.675%0.74879%0.79SS**  trans-73.5146.1168.567.10000112.8
45L37.1Very low42.6Very low174 Ų174139.9 Ų139.991%0.91180%0.799SS**  trans-171.7108.5142.1-101.9138.7000110.7
46A40.9Very low41.6Very low86 Ų86143.9 Ų143.971%0.71180%0.797SS**  trans-99.8171146.400000106.6
47P55.9Low41.3Very low121 Ų121137.9 Ų137.979%0.78680%0.797SS**  cis-145.5-173.82038.7-16000116.3
48S35.4Very low41.2Very low101 Ų101134.6 Ų134.671%0.70678%0.782SS**  trans118.1113.5138.2-152.30000119.3
49S35.9Very low40.9Very low102 Ų102138.2 Ų138.271%0.71378%0.784SS**  trans60.5125.5130.774.90000122.4
50A35.5Very low40.3Very low85 Ų85141 Ų14170%0.70278%0.781SS**  121117.3117.600000117.8
51R36.8Very low39.3Very low210 Ų210140.3 Ų140.379%0.79277%0.774SS**  72.4121.8129.8-78.9-174.5-177.3-132.61.1122
52Q36.1Very low39Very low168 Ų168138.9 Ų138.979%0.78577%0.772SS**  89.6135.6122.7-78178.74.500121.2
53G32.9Very low38.9Very low71 Ų71135.5 Ų135.573%0.73277%0.766SS**  trans126.873.4154.700000113.6
54A36.5Very low37.9Very low96 Ų96139.2 Ų139.279%0.79377%0.774SS**  63.2113.983.300000115.8
55R41.3Very low37.6Very low245 Ų245142.6 Ų142.693%0.92578%0.778SS**  trans165.598.8141.1-90.8165.9-166.6-100.83.5106.7
56R36.5Very low38.9Very low216 Ų216139.9 Ų139.982%0.81577%0.771SS**  55.1100.666.6-157.4-179.7-171.7-145.50.9113.7
57A38Very low38.6Very low106 Ų106141.8 Ų141.888%0.87678%0.779SS**  trans-150110135.900000108.9
58Q36.4Very low37.6Very low123 Ų123147.1 Ų147.158%0.57578%0.783SS**  trans-85.8153.4168-69.2167.8-58.600109.6
59R38.1Very low37.5Very low245 Ų245150.3 Ų150.393%0.92579%0.792SS**  trans178.895.5135.9-98.4165.9176.8-125.4-1.6107.6
60H36Very low37.3Very low149 Ų149149.7 Ų149.769%0.6979%0.793SS**  66.1114.289.1-86.3-83.3000116.7
61V35.4Very low37Very low114 Ų114149.7 Ų149.769%0.69180%0.801SS**  trans71.5126.8131.1-167.90000115.2
62T34.4Very low36.7Very low131 Ų131143.6 Ų143.680%0.80480%0.803SS**  -172.8153.769.4-37.10000111.1
63A41.4Very low36.6Very low83 Ų83140.2 Ų140.269%0.68680%0.804SS**  trans-69.1156.1173.100000114.6
64Q31.6Very low36.6Very low191 Ų191141.2 Ų141.289%0.89381%0.806SS**  171.9135.1129.2-96.8172.438.100112
65Q37.3Very low36.8Very low178 Ų178143.7 Ų143.783%0.83280%0.804SS**  trans-94.7-170.2153.9-64.5-172.9300109.1
66P63.8Low36.6Very low116 Ų116141.8 Ų141.875%0.75380%0.802SS**  -119.7167.3-82.835.8-18.6000111.4
67S35.8Very low36.3Very low127 Ų127135.3 Ų135.389%0.88880%0.803SS**  trans-142.7141.7168.458.40000114
68R34Very low36.1Very low232 Ų232134.2 Ų134.288%0.87580%0.802SS**  trans-72.9179.5-174.1-65.7173.6164.2-168.3-4.1114.4
69L33.2Very low36.2Very low168 Ų168140 Ų14088%0.8882%0.819SS**  trans94.7147.2154.4-59.5160.8000114.4
70A32.1Very low36.4Very low90 Ų90139.9 Ų139.974%0.74482%0.818SS**  cis175.4152.4-18.400000105.3
71G29.4Very low36.5Very low84 Ų84144.7 Ų144.787%0.86683%0.83SS**  trans91.5134163.500000115
72G30.4Very low36.8Very low82 Ų82149.8 Ų149.885%0.84584%0.837SS**  cis118.6101.211.400000111
73A33.3Very low37.5Very low97 Ų97148.8 Ų148.880%0.80283%0.833SS**  trans168.3112155.100000108.1
74A33.7Very low37.3Very low92 Ų92151.4 Ų151.476%0.7684%0.835SS**  47130.184.300000112.5
75I41Very low37.7Very low149 Ų149149.6 Ų149.676%0.76483%0.831SS**  -170.7157.153.3-19.2178.8000112.2
76K36.3Very low37.8Very low204 Ų204148.5 Ų148.589%0.88782%0.824SS**  trans71133.3156-65.7174.1-177.5178.10117.8
77G31.2Very low36.6Very low81 Ų81154.4 Ų154.484%0.83583%0.831SS**  cis153.3131.78.200000108.1
78G32.8Very low37Very low82 Ų82158.4 Ų158.485%0.84583%0.827SS**  trans178.583.9178.900000114.1
79R39.8Very low37.3Very low246 Ų246155.1 Ų155.193%0.92882%0.821SS**  trans-70.9137.6171.8-64.3175.4178.5-170.3-1.3111.1
80R40.8Very low37.3Very low241 Ų241157.1 Ų157.191%0.90982%0.823SS**  trans-159104.6131.1-66.6-156.6-177-163.80.3108.4
81R39.8Very low37.6Very low250 Ų250161.4 Ų161.494%0.94383%0.825SS**  75.3107.5103.9-71.9-163.1-179.4-165.51.6115.6
82R41.9Very low37.9Very low221 Ų221162.9 Ų162.983%0.83482%0.822SS**  trans-51.2174.6162.7-100.1-170.8-179.3175.83.2114.6
83P48.6Very low38.3Very low111 Ų111164.2 Ų164.272%0.72182%0.818SS**  cis-141.3152.930.335.4-13.3000120
84D37.3Very low38.4Very low137 Ų137164.3 Ų164.373%0.73381%0.813SS**  trans-67.5138.8158-64.7-70.5000111.9
85L39.9Very low38.9Very low154 Ų154168.1 Ų168.181%0.80682%0.818SS**  trans-142.9130.6160-100.1153.5000110.1
86F38.8Very low38.8Very low154 Ų154169.2 Ų169.268%0.67582%0.82SS**  trans80.975.9158.8-100.7-95.5000120.3R88F86-R88 HydrophobicContact CD1-CG 3.69Å; F86-R88 HydrophobicContact CE1-CG 3.69Å
87R39.7Very low38.9Very low240 Ų240171.3 Ų171.391%0.90682%0.823SS**  trans-86.7102.7151.6-168.5169.2-146.5-131.10.2109.3
88R42.8Very low39.3Very low212 Ų212173 Ų17380%0.882%0.822SS**  trans-84.6126.8171.2-91.6174-165.8-156.3-0.7110.8F86F86-R88 HydrophobicContact CD1-CG 3.69Å; F86-R88 HydrophobicContact CE1-CG 3.69Å
89H40.5Very low39.3Very low162 Ų162174.1 Ų174.175%0.7582%0.823SS**  trans-65137.1170.6-84.846.8000111.2
90F33.4Very low39.1Very low210 Ų210167.5 Ų167.592%0.92182%0.821SS**  trans-96.5106.1161.8-150.6-98.5000106.7
91K38.5Very low38.6Very low181 Ų181160.9 Ų160.979%0.78782%0.818SS**  trans-90.9116.7168.8-83.3-176.7175.7-179.10107.9
92S35Very low38.3Very low115 Ų115153.6 Ų153.680%0.80481%0.811SS**  trans-58.8131.5160.6177.90000109.4
93S39.2Very low37.7Very low110 Ų110147.8 Ų147.877%0.76981%0.81SS**  trans-134.2104.8164.951.30000108.8
94S36.1Very low36.9Very low98 Ų98147 Ų14769%0.68581%0.813SS**  trans-55.2128.5168.147.60000112.1Q96S94-Q96 PolarHBondContact O-N 3.42Å
95I43.5Very low36.8Very low172 Ų172147 Ų14788%0.88282%0.818SS**  trans-78.7113167.1-65.3171.6000107.9
96Q39.6Very low36.6Very low172 Ų172150.9 Ų150.980%0.80482%0.822SS**  trans-79.1131.7173.4-73.2174.6-37.700110S94S94-Q96 PolarHBondContact O-N 3.42Å
97R36.9Very low36.5Very low249 Ų249150.3 Ų150.394%0.9483%0.831SS**  trans-77.5132.4161.6-71.1178.7177.4-143.4-1.5108.2
98S40.3Very low36.2Very low117 Ų117143.1 Ų143.182%0.81882%0.823SS**  trans-131.7117.4162.747.90000109.4
99A33.7Very low35.7Very low105 Ų105145 Ų14587%0.86883%0.83SS**  trans-82.1142.9163.600000109.2
100A33.8Very low35.3Very low107 Ų107145.8 Ų145.888%0.88483%0.834SS**  trans-164.6136.3149.300000109.6
101A31.1Very low35.5Very low102 Ų102144.2 Ų144.284%0.84383%0.829SS**  trans-96.6155.5-178.500000111.9
102A34.4Very low36.5Very low97 Ų97140.5 Ų140.580%0.80282%0.823SS**  trans167.8109.3144.800000107.2
103A28.7Very low37.1Very low99 Ų99140.7 Ų140.782%0.81882%0.822SS**  87.8128.473.200000114.1
104A31Very low36.7Very low93 Ų93139.7 Ų139.777%0.76982%0.82SS**  trans70.7138.316600000116.2
105T35.6Very low36.2Very low139 Ų139142.1 Ų142.185%0.85383%0.826SS**  cis-162.115325.3-20.90000109.6
106R35.3Very low35.6Very low235 Ų235138.8 Ų138.889%0.88782%0.818SS**  trans-53.2149.8172.4-66.8164.7156.4163.8-7.8112.9
107T36.5Very low35.1Very low142 Ų142135.9 Ų135.987%0.87182%0.817SS**  -168.4128.2124.3-71.80000110.2
108A34.2Very low35.1Very low88 Ų88130.7 Ų130.773%0.72781%0.812SS**  trans-78.6150.8173.300000111.7
109R32.7Very low34.7Very low253 Ų253131.4 Ų131.496%0.95581%0.812SS**  trans-165.3127140.8-112.1172.6-178.9-164.9-0.7111.8
110Q31.9Very low35.3Very low177 Ų177134.6 Ų134.683%0.82781%0.811SS**  trans-88.9143.4167.5-65.4170.4-18.600109.3
111H37.5Very low35.5Very low178 Ų178138.5 Ų138.582%0.82481%0.811SS**  178.8143.1119.8-114.9-87000111.9
112P59.6Low35.6Very low102 Ų102141.5 Ų141.566%0.66281%0.813SS**  trans-90.2172.2166.841.4-36.1000110.5
113P46.8Very low35.9Very low119 Ų119144.9 Ų144.977%0.77381%0.814SS**  -157.4170.38338.1-16.1000117.9
114A31.4Very low36Very low89 Ų89146.9 Ų146.974%0.73681%0.811SS**  trans47137.9145.500000119
115D26.5Very low36Very low149 Ų149150.6 Ų150.680%0.79781%0.812SS**  cis175.616042.5-144.2-18.4000109.5
116S29.4Very low36.2Very low102 Ų102154.8 Ų154.871%0.71381%0.814SS**  trans72.5133.4152.576.90000124
117S29.8Very low36.6Very low112 Ų112146.4 Ų146.478%0.78379%0.791SS**  trans105.2117145.276.80000119
118V36.9Very low36.5Very low140 Ų140147 Ų14785%0.84879%0.789SS**  trans-79.7129.1168.2177.30000107.9
119T32.3Very low37.1Very low131 Ų131150.4 Ų150.480%0.80479%0.793SS**  trans-143.7118.7155.750.80000109.9
120M45.3Very low37.5Very low172 Ų172145.7 Ų145.785%0.84778%0.782SS**  trans-66158.4154.7-72.6-178.8-169.900109.1
121E37.9Very low37.9Very low190 Ų190146.3 Ų146.389%0.88879%0.785SS**  trans89.895.7168.4-52.3-179.9-178.800115.8
122D33.1Very low37.9Very low165 Ų165145.4 Ų145.488%0.88278%0.779SS**  -143.8138.8123.5-150.7-9.5000110.6
123M40.7Very low36.9Very low168 Ų168144 Ų14483%0.82878%0.776SS**  trans-13175.3-158.8-138.8-89-159.800105.8
124N31.1Very low36.7Very low140 Ų140147.7 Ų147.775%0.74978%0.783SS**  trans174114.4160.4-108.4-22.2000111.8
125E31.3Very low37.4Very low171 Ų171147 Ų14780%0.79979%0.785SS**  -16187116.5-121.5-170.413100110.6S127E125-S127 VanDerWaalsContact CD-OG 3.29Å; E125-S127 WeakPolarHBondContact CG-OG 3.32Å; E125-S127 PolarHBondContact O-N 3.09Å; E125-S127 PolarHBondContact OE1-OG 3.29Å
126Y40.1Very low38.2Very low227 Ų227143.9 Ų143.989%0.8978%0.775SS**  trans-70.895.1151.5-81.5-93.7000108.4
127S42.8Very low39Very low59 Ų59147.5 Ų147.541%0.41378%0.778SS.*  trans-166.138.6174.754.70000115.1E125E125-S127 VanDerWaalsContact CD-OG 3.29Å; E125-S127 WeakPolarHBondContact CG-OG 3.32Å; E125-S127 PolarHBondContact O-N 3.09Å; E125-S127 PolarHBondContact OE1-OG 3.29Å
128N34.2Very low40.2Very low155 Ų155143.8 Ų143.883%0.82975%0.749SS**  trans-110.562.8156.8-83.5-16.4000110.5E130N128-E130 PolarHBondContact O-N 2.75Å; N128-E130 VanDerWaalsContact O-N 3.09Å
129I47.4Very low40.8Very low159 Ų159144.3 Ų144.382%0.81575%0.747SS**  trans-74.481.2153.3-58.6171.5000105.2E131I129-E131 PolarHBondContact O-N 2.95Å
130E42Very low41.6Very low154 Ų154139 Ų13972%0.7272%0.716SS**  trans-69.5118.8161.2-75.3-164.616500107.8N128 F132N128-E130 PolarHBondContact O-N 2.75Å; N128-E130 VanDerWaalsContact O-N 3.09Å; E130-F132 VanDerWaalsContact O-CD2 3.3Å; E130-F132 WeakPolarHBondContact O-CD2 3.45Å; E130-F132 PolarHBondContact O-N 2.97Å
131E40Very low41.5Very low191 Ų191134.9 Ų134.989%0.89370%0.704SS**  trans-48.698.3-178.1-161.9170.5174.400111.3I129 A133I129-E131 PolarHBondContact O-N 2.95Å; E131-A133 PolarHBondContact O-N 3.42Å; E131-A133 VanDerWaalsContact O-N 3.11Å
132F36.9Very low42Very low159 Ų159135.6 Ų135.670%0.69770%0.704SS**  trans-64.4111.3178.5-78.7-91.7000110.3E130 E134E130-F132 VanDerWaalsContact O-CD2 3.3Å; E130-F132 WeakPolarHBondContact O-CD2 3.45Å; E130-F132 PolarHBondContact O-N 2.97Å; F132-E134 PolarHBondContact O-N 3.29Å
133A38.5Very low42.7Very low73 Ų73134 Ų13460%0.60370%0.695SS**  trans-58.311015600000108.8E131 G135 S136E131-A133 PolarHBondContact O-N 3.42Å; E131-A133 VanDerWaalsContact O-N 3.11Å; A133-G135 PolarHBondContact O-N 3.11Å; A133-S136 PolarHBondContact O-N 2.77Å; A133-S136 PolarHBondContact O-OG 3.43Å
134E43.5Very low43.1Very low196 Ų196133 Ų13392%0.91669%0.689SS**THydrogen-bonded Turntrans-54.1114.8-178.7-164.7162.2-163.500110.8F132F132-E134 PolarHBondContact O-N 3.29Å
135G44.8Very low44.1Very low74 Ų74133.9 Ų133.976%0.76369%0.688SS**THydrogen-bonded Turntrans117.92.5177.400000116.5A133 K137A133-G135 PolarHBondContact O-N 3.11Å; G135-K137 PolarHBondContact O-N 3.08Å
136S44Very low45.7Very low84 Ų84127.9 Ų127.959%0.58766%0.662SS**  trans-75.592.3179.4-65.80000112.3A133 I138A133-S136 PolarHBondContact O-N 2.77Å; A133-S136 PolarHBondContact O-OG 3.43Å; S136-I138 PolarHBondContact O-N 2.95Å
137K46.9Very low47.2Very low178 Ų178121.7 Ų121.777%0.77464%0.644SS**  trans22101.8144.9-57168.5-170.6165.30114.2G135 N139G135-K137 PolarHBondContact O-N 3.08Å; K137-N139 PolarHBondContact O-N 3.39Å
138I55.6Low48.9Very low34 Ų34119.3 Ų119.317%0.17463%0.629CS.*  trans-38.9113.2151.438.7163000108.7S136 A140 K149 D176S136-I138 PolarHBondContact O-N 2.95Å; I138-A140 HydrophobicContact CD1-CB 4.47Å; I138-A140 PolarHBondContact O-N 3.4Å; I138-K149 VanDerWaalsContact CD1-CE 3.41Å; I138-D176 VanDerWaalsContact CA-OD2 3.3Å; I138-D176 WeakPolarHBondContact CA-OD2 3.44Å; I138-D176 HydrophobicContact CG2-CB 4.4Å; I138-D176 WeakPolarHBondContact CG2-OD2 3.01Å
139N49.4Very low51.4Low151 Ų151113.8 Ų113.881%0.80760%0.598SS**  trans-73.357172-85.1-28.4000109K137K137-N139 PolarHBondContact O-N 3.39Å
140A48.8Very low53.4Low19 Ų19106.2 Ų106.216%0.15756%0.559CS.*  trans-82.5105160.200000105.3I138 K142 D146I138-A140 HydrophobicContact CD1-CB 4.47Å; I138-A140 PolarHBondContact O-N 3.4Å; A140-K142 PolarHBondContact O-N 3.2Å; A140-D146 WeakPolarHBondContact CA-OD2 3.2Å; A140-D146 WeakPolarHBondContact CB-OD2 3.3Å
141S42.4Very low55.8Low85 Ų85101.5 Ų101.559%0.59454%0.536SS*.  trans-43.2115.6170.9-61.40000108.3N143 Q144S141-N143 PolarHBondContact O-N 3.03Å; S141-Q144 PolarHBondContact O-N 3.47Å
142K47.8Very low58.2Low206 Ų20692.4 Ų92.490%0.89649%0.494SS*.THydrogen-bonded Turntrans-51.9-3.6-163.4-84.6174.6176.4171.50117.5A140A140-K142 PolarHBondContact O-N 3.2Å
143N48Very low60.8Low131 Ų13185.1 Ų85.170%0.70146%0.464SS*.THydrogen-bonded Turntrans-135.60.5-168-91.27.1000116.1S141S141-N143 PolarHBondContact O-N 3.03Å
144Q49.3Very low63.3Low146 Ų14683.1 Ų83.168%0.68245%0.45SS*.SBendtrans-111.8136.4174.5-75.21762.500109.2S141 D146S141-Q144 PolarHBondContact O-N 3.47Å; Q144-D146 PolarHBondContact O-N 3.48Å
145Q52.8Low65.5Low160 Ų16073.8 Ų73.875%0.74841%0.407SS*.  trans-59.494.9163.4-75.5164.84.800105.4D147Q145-D147 VanDerWaalsContact C-N 3.27Å; Q145-D147 PolarHBondContact O-N 3.09Å
146D64.1Low67.7Low45 Ų4571.5 Ų71.524%0.24138%0.379CS..  trans-67.598.8171.9-69-36.2000105.4A140 Q144 G148 K149 L195A140-D146 WeakPolarHBondContact CA-OD2 3.2Å; A140-D146 WeakPolarHBondContact CB-OD2 3.3Å; Q144-D146 PolarHBondContact O-N 3.48Å; D146-G148 PolarHBondContact O-N 3Å; D146-G148 VanDerWaalsContact O-N 3.08Å; D146-K149 HydrophobicContact CB-CB 3.94Å; D146-K149 VanDerWaalsContact O-CB 3.31Å; D146-K149 WeakPolarHBondContact O-CB 3.45Å; D146-K149 PolarHBondContact O-N 2.9Å; D146-L195 HydrophobicContact CB-CD1 4.14Å
147D71.1Confident69.9Low96 Ų9674.8 Ų74.851%0.51338%0.378SS..THydrogen-bonded Turntrans-58.6-19.3177.5-75.9-32.2000111.7Q145 K149 A199 V202Q145-D147 VanDerWaalsContact C-N 3.27Å; Q145-D147 PolarHBondContact O-N 3.09Å; D147-K149 VanDerWaalsContact C-N 3.34Å; D147-A199 HydrophobicContact CB-CB 3.78Å; D147-V202 WeakPolarHBondContact O-CG2 3.25Å
148G78.9Confident71.8Confident10 Ų1073.1 Ų73.110%0.10338%0.378CS..THydrogen-bonded Turntrans-78.3-7.8170.400000115.1D146 F196D146-G148 PolarHBondContact O-N 3Å; D146-G148 VanDerWaalsContact O-N 3.08Å; G148-F196 PolarHBondContact O-N 2.95Å
149K87.6Confident73.3Confident38 Ų3871.8 Ų71.817%0.16537%0.372CS..EExtended strand (participates in β ladder)trans-90.8129.9-177.5-166.3-178.4178.7177.60111.9I138 D146 D147 V194 L195 A223I138-K149 VanDerWaalsContact CD1-CE 3.41Å; D146-K149 HydrophobicContact CB-CB 3.94Å; D146-K149 VanDerWaalsContact O-CB 3.31Å; D146-K149 WeakPolarHBondContact O-CB 3.45Å; D146-K149 PolarHBondContact O-N 2.9Å; D147-K149 VanDerWaalsContact C-N 3.34Å; K149-V194 CarbonylContact C-O 3.56Å; K149-V194 WeakPolarHBondContact CA-O 3.48Å; K149-L195 HydrophobicContact CB-CD1 3.99Å; K149-A223 HydrophobicContact CB-CB 4.02Å; K149-A223 HydrophobicContact CD-CB 4.03Å; K149-A223 HydrophobicContact CG-CB 3.65Å; K149-A223 WeakPolarHBondContact O-CB 3.31Å; K149-A223 PolarHBondContact O-N 2.64Å
150M89.2Confident75.2Confident0 Ų066.8 Ų66.80%035%0.349CS..EExtended strand (participates in β ladder)trans-124.2143.2-178.7-152.6-165.6-71.400111.5I152 F193 V194 F196 V202 V205 P220 K221M150-I152 HydrophobicContact CB-CD1 4.5Å; M150-I152 HydrophobicContact CG-CD1 4.17Å; M150-I152 HydrophobicContact SD-CD1 3.51Å; M150-I152 VanDerWaalsContact SD-CD1 3.51Å; M150-F193 CarbonylContact O-C 3.59Å; M150-F193 VanDerWaalsContact O-CA 3.31Å; M150-F193 WeakPolarHBondContact O-CA 3.21Å; M150-V194 PolarHBondContact N-O 2.61Å; M150-V194 PolarHBondContact O-N 3.33Å; M150-F196 HydrophobicContact CB-CE2 4.47Å; M150-F196 HydrophobicContact CE-CD2 4.17Å; M150-F196 HydrophobicContact CE-CE2 3.53Å; M150-F196 HydrophobicContact CE-CZ 4.4Å; M150-F196 HydrophobicContact SD-CE2 4.44Å; M150-V202 VanDerWaalsContact CE-CA 3.43Å; M150-V202 HydrophobicContact CE-CB 3.83Å; M150-V202 HydrophobicContact CE-CG1 3.61Å; M150-V202 HydrophobicContact CE-CG2 3.97Å; M150-V202 HydrophobicContact CG-CG1 4.3Å; M150-V205 HydrophobicContact CE-CB 3.42Å; M150-V205 VanDerWaalsContact CE-CB 3.42Å; M150-V205 HydrophobicContact CE-CG1 3.63Å; M150-V205 HydrophobicContact CE-CG2 3.76Å; M150-V205 HydrophobicContact SD-CB 4.18Å; M150-V205 HydrophobicContact SD-CG1 3.68Å; M150-P220 HydrophobicContact SD-CB 3.47Å; M150-P220 WeakPolarHBondContact SD-CB 3.31Å; M150-K221 WeakPolarHBondContact CG-O 3.4Å
151F91.3Very high77.1Confident55 Ų5569.6 Ų69.624%0.24136%0.357CS..EExtended strand (participates in β ladder)trans-95.3131.7168.7168-91.9000108.4F191 F193 P220 K221 A223F151-F191 HydrophobicContact CD2-CD2 4.41Å; F151-F191 HydrophobicContact CE2-CB 3.85Å; F151-F191 AromaticContact CE2-CD2 3.6Å; F151-F191 HydrophobicContact CE2-CD2 3.6Å; F151-F191 HydrophobicContact CE2-CE2 4.41Å; F151-F191 AromaticContact CE2-CG 3.95Å; F151-F191 HydrophobicContact CE2-CG 3.95Å; F151-F191 HydrophobicContact CZ-CB 3.88Å; F151-F191 HydrophobicContact CZ-CD2 4.4Å; F151-F191 HydrophobicContact CZ-CG 4.32Å; F151-F193 HydrophobicContact CB-CD1 4.32Å; F151-F193 HydrophobicContact CB-CE1 4.16Å; F151-F193 HydrophobicContact CD2-CD1 4.39Å; F151-F193 AromaticContact CD2-CE1 3.8Å; F151-F193 HydrophobicContact CD2-CE1 3.8Å; F151-F193 AromaticContact CD2-CZ 3.95Å; F151-F193 HydrophobicContact CD2-CZ 3.95Å; F151-F193 HydrophobicContact CG-CE1 4.48Å; F151-P220 CarbonylContact O-C 3.56Å; F151-P220 WeakPolarHBondContact O-CA 3.3Å; F151-K221 HydrophobicContact CD1-CB 4.2Å; F151-K221 PolarHBondContact N-O 2.75Å; F151-K221 PolarHBondContact O-N 3.07Å; F151-K221 VanDerWaalsContact O-O 3.11Å; F151-A223 HydrophobicContact CB-CB 4.44Å
152I90.9Very high79.4Confident0 Ų073.7 Ų73.70%036%0.364CS..EExtended strand (participates in β ladder)trans-115.9108.8175.3-46.7-64.7000108.2M150 L155 L164 L168 F191 G192 V194 I218 P220M150-I152 HydrophobicContact CB-CD1 4.5Å; M150-I152 HydrophobicContact CG-CD1 4.17Å; M150-I152 HydrophobicContact SD-CD1 3.51Å; M150-I152 VanDerWaalsContact SD-CD1 3.51Å; I152-L155 HydrophobicContact CB-CD2 4.44Å; I152-L155 HydrophobicContact CG2-CD2 3.57Å; I152-L155 HydrophobicContact CG2-CG 4.15Å; I152-L164 HydrophobicContact CG1-CD1 4.38Å; I152-L164 HydrophobicContact CG2-CD1 4.15Å; I152-L168 HydrophobicContact CD1-CD1 4.05Å; I152-L168 HydrophobicContact CD1-CD2 4.45Å; I152-L168 HydrophobicContact CG1-CD1 4.14Å; I152-F191 CarbonylContact O-C 3.58Å; I152-F191 WeakPolarHBondContact O-CA 3.33Å; I152-F191 WeakPolarHBondContact O-CB 3.06Å; I152-G192 PolarHBondContact N-O 3.11Å; I152-G192 PolarHBondContact O-N 3.39Å; I152-V194 HydrophobicContact CG1-CG2 3.87Å; I152-I218 HydrophobicContact CG2-CB 4.08Å; I152-I218 HydrophobicContact CG2-CD1 4.02Å; I152-I218 HydrophobicContact CG2-CG1 4.39Å; I152-P220 HydrophobicContact CD1-CB 3.75Å
153G91.6Very high81.4Confident7 Ų766.5 Ų66.57%0.07234%0.336CS..EExtended strand (participates in β ladder)trans-91.5163.8173.700000112.2L155 I218 D219G153-L155 VanDerWaalsContact C-N 3.33Å; G153-L155 PolarHBondContact O-N 3.43Å; G153-I218 CarbonylContact O-C 3.56Å; G153-I218 VanDerWaalsContact O-CA 3.29Å; G153-I218 WeakPolarHBondContact O-CA 2.94Å; G153-D219 PolarHBondContact N-O 3.07Å; G153-D219 PolarHBondContact O-N 3.31Å
154G90.3Very high83.4Confident31 Ų3160.3 Ų60.332%0.3230%0.302SS..SBendtrans78.111.6170.200000115.5G190 K216G154-G190 PolarHBondContact N-O 3.1Å; G154-G190 VanDerWaalsContact N-O 3.09Å; G154-K216 WeakPolarHBondContact O-CD 3.14Å; G154-K216 VanDerWaalsContact O-CE 3.3Å; G154-K216 WeakPolarHBondContact O-CE 3.2Å; G154-K216 WeakPolarHBondContact O-CG 3.34Å
155L91.4Very high85.4Confident0 Ų055.2 Ų55.20%028%0.282CS..  trans-58.1152.3176.5-58.9179.2000111.4I152 G153 T159 L164 I179 G190 L213 K216 I218I152-L155 HydrophobicContact CB-CD2 4.44Å; I152-L155 HydrophobicContact CG2-CD2 3.57Å; I152-L155 HydrophobicContact CG2-CG 4.15Å; G153-L155 VanDerWaalsContact C-N 3.33Å; G153-L155 PolarHBondContact O-N 3.43Å; L155-T159 HydrophobicContact CD2-CG2 4.39Å; L155-L164 HydrophobicContact CD1-CD2 4Å; L155-L164 HydrophobicContact CD2-CD1 3.83Å; L155-I179 HydrophobicContact CD1-CD1 4.44Å; L155-I179 HydrophobicContact CD1-CG1 4.37Å; L155-G190 PolarHBondContact N-O 2.87Å; L155-G190 WeakPolarHBondContact O-CA 3.33Å; L155-L213 HydrophobicContact CD2-CD2 4.08Å; L155-K216 PolarHBondContact O-NZ 2.82Å; L155-I218 HydrophobicContact CD2-CB 4.41Å; L155-I218 HydrophobicContact CD2-CG2 3.8Å
156S90.8Very high87.2Confident26 Ų2654.6 Ų54.618%0.18228%0.279CS..  trans-67.1157.1169.1-163.80000109.8D158 T159S156-D158 PolarHBondContact O-N 3.04Å; S156-T159 WeakPolarHBondContact CA-OG1 3.5Å; S156-T159 WeakPolarHBondContact CB-OG1 3.42Å; S156-T159 PolarHBondContact N-OG1 2.75Å; S156-T159 VanDerWaalsContact N-OG1 3.12Å; S156-T159 PolarHBondContact O-N 3.26Å
157W89.2Confident88.4Confident152 Ų15253.7 Ų53.758%0.57627%0.272SS*.SBendtrans-68.6-24.8176.3-63.3-28.4000112.1S188W157-S188 WeakPolarHBondContact O-CB 3.48Å
158D87.3Confident89.3Confident144 Ų14449.2 Ų49.277%0.7725%0.248SC*.SBendtrans-95.8-5.4-179.5-51.7-50.5000112.7S156 S160S156-D158 PolarHBondContact O-N 3.04Å; D158-S160 PolarHBondContact O-N 3.26Å
159T86.8Confident89.8Confident6 Ų652 Ų524%0.03727%0.266CS..  trans-63.1125.3177.6-61.30000110L155 S156 D163 I179 L213 D214L155-T159 HydrophobicContact CD2-CG2 4.39Å; S156-T159 WeakPolarHBondContact CA-OG1 3.5Å; S156-T159 WeakPolarHBondContact CB-OG1 3.42Å; S156-T159 PolarHBondContact N-OG1 2.75Å; S156-T159 VanDerWaalsContact N-OG1 3.12Å; S156-T159 PolarHBondContact O-N 3.26Å; T159-D163 HydrophobicContact CG2-CB 4.48Å; T159-I179 HydrophobicContact CG2-CD1 4.44Å; T159-I179 VanDerWaalsContact O-CD1 3.26Å; T159-I179 WeakPolarHBondContact O-CD1 3.18Å; T159-L213 HydrophobicContact CG2-CD2 3.42Å; T159-L213 VanDerWaalsContact CG2-CD2 3.42Å; T159-D214 WeakPolarHBondContact CB-OD2 3.47Å; T159-D214 PolarHBondContact OG1-OD2 2.85Å
160S89.4Confident89.9Confident46 Ų4657.7 Ų57.732%0.32229%0.286SS..  trans-94.6166.9179800000112.9D158 K162 D163 L164 I179D158-S160 PolarHBondContact O-N 3.26Å; S160-K162 PolarHBondContact O-N 3.08Å; S160-K162 PolarHBondContact OG-N 3.22Å; S160-D163 VanDerWaalsContact CB-OD2 3.3Å; S160-D163 WeakPolarHBondContact CB-OD2 3.17Å; S160-D163 PolarHBondContact N-OD2 3.26Å; S160-D163 PolarHBondContact O-N 3Å; S160-D163 PolarHBondContact OG-N 3.04Å; S160-D163 PolarHBondContact OG-OD2 3.4Å; S160-L164 PolarHBondContact O-N 3.2Å; S160-I179 WeakPolarHBondContact O-CD1 3.47Å
161K89.1Confident89.8Confident78 Ų7859 Ų5934%0.33929%0.292SS..Hα-helixtrans-54.9-37.6173.1-176.4-179.9173.11630110.7T165 D176 C177K161-T165 WeakPolarHBondContact O-CB 3.35Å; K161-T165 PolarHBondContact O-N 2.96Å; K161-T165 PolarHBondContact O-OG1 3.16Å; K161-D176 IonicContact NZ-OD1 2.75Å; K161-D176 PolarHBondContact NZ-OD1 2.78Å; K161-C177 VanDerWaalsContact CD-O 3.31Å; K161-C177 WeakPolarHBondContact CD-O 3.5Å; K161-C177 WeakPolarHBondContact CE-O 3.31Å; K161-C177 WeakPolarHBondContact CE-SG 3.45Å; K161-C177 HydrophobicContact CG-CB 4.34Å; K161-C177 WeakPolarHBondContact CG-SG 3.16Å; K161-C177 PolarHBondContact NZ-O 2.83Å; K161-C177 VanDerWaalsContact NZ-O 3.09Å
162K90.3Very high89.7Confident170 Ų17057.2 Ų57.274%0.73929%0.289SS*.Hα-helixtrans-66.1-52-177-65-175.8178.1-1770111.2S160 L164 T165 E166S160-K162 PolarHBondContact O-N 3.08Å; S160-K162 PolarHBondContact OG-N 3.22Å; K162-L164 VanDerWaalsContact C-N 3.28Å; K162-L164 PolarHBondContact O-N 2.98Å; K162-T165 WeakPolarHBondContact O-CB 3.44Å; K162-T165 PolarHBondContact O-N 2.79Å; K162-E166 PolarHBondContact O-N 3.46Å
163D90.6Very high89.6Confident56 Ų5662.3 Ų62.330%0.29931%0.313SS..Hα-helixtrans-60.3-41.4-178.1-44.9-44.1000111.3T159 S160 Y167T159-D163 HydrophobicContact CG2-CB 4.48Å; S160-D163 VanDerWaalsContact CB-OD2 3.3Å; S160-D163 WeakPolarHBondContact CB-OD2 3.17Å; S160-D163 PolarHBondContact N-OD2 3.26Å; S160-D163 PolarHBondContact O-N 3Å; S160-D163 PolarHBondContact OG-N 3.04Å; S160-D163 PolarHBondContact OG-OD2 3.4Å; D163-Y167 VanDerWaalsContact O-CB 3.32Å; D163-Y167 WeakPolarHBondContact O-CB 3.41Å; D163-Y167 PolarHBondContact O-N 3.34Å
164L90Very high89.6Confident0 Ų063.2 Ų63.20%032%0.317CS..Hα-helixtrans-64.4-40.8176.7-174.961.3000112.1I152 L155 S160 K162 L168 I179 V194 L213I152-L164 HydrophobicContact CG1-CD1 4.38Å; I152-L164 HydrophobicContact CG2-CD1 4.15Å; L155-L164 HydrophobicContact CD1-CD2 4Å; L155-L164 HydrophobicContact CD2-CD1 3.83Å; S160-L164 PolarHBondContact O-N 3.2Å; K162-L164 VanDerWaalsContact C-N 3.28Å; K162-L164 PolarHBondContact O-N 2.98Å; L164-L168 HydrophobicContact CD1-CD1 3.73Å; L164-L168 HydrophobicContact CD1-CG 4.3Å; L164-L168 HydrophobicContact CG-CD1 3.93Å; L164-L168 WeakPolarHBondContact O-CB 3.32Å; L164-L168 WeakPolarHBondContact O-CG 3.33Å; L164-L168 PolarHBondContact O-N 3.47Å; L164-I179 HydrophobicContact CD2-CG1 4.25Å; L164-V194 HydrophobicContact CD2-CG2 3.73Å; L164-V194 HydrophobicContact CG-CG2 4.13Å; L164-L213 HydrophobicContact CD1-CD2 4.2Å
165T90.2Very high89.5Confident40 Ų4065.9 Ų65.925%0.24533%0.326CS..Hα-helixtrans-66.5-49.4178.2-50.30000110.7K161 K162 Y167 L168 S169 V174 C177K161-T165 WeakPolarHBondContact O-CB 3.35Å; K161-T165 PolarHBondContact O-N 2.96Å; K161-T165 PolarHBondContact O-OG1 3.16Å; K162-T165 WeakPolarHBondContact O-CB 3.44Å; K162-T165 PolarHBondContact O-N 2.79Å; T165-Y167 VanDerWaalsContact C-N 3.3Å; T165-Y167 PolarHBondContact O-N 3.39Å; T165-L168 PolarHBondContact O-N 2.94Å; T165-S169 VanDerWaalsContact O-CB 3.25Å; T165-S169 WeakPolarHBondContact O-CB 3.19Å; T165-S169 PolarHBondContact O-N 3.31Å; T165-V174 HydrophobicContact CG2-CB 4Å; T165-V174 HydrophobicContact CG2-CG1 4.12Å; T165-V174 HydrophobicContact CG2-CG2 4.45Å; T165-C177 PolarHBondContact OG1-SG 2.97Å
166E90.9Very high89.2Confident147 Ų14767.1 Ų67.169%0.68733%0.333SS*.Hα-helixtrans-59.6-43.6-179.9-175177.7176.500110.9K162K162-E166 PolarHBondContact O-N 3.46Å
167Y90.1Very high89.1Confident26 Ų2666 Ų6610%0.10233%0.326CS..Hα-helixtrans-62.4-48175.9-176.2-94000112D163 T165 S169 R170 F171 H211 K212 L213 I218D163-Y167 VanDerWaalsContact O-CB 3.32Å; D163-Y167 WeakPolarHBondContact O-CB 3.41Å; D163-Y167 PolarHBondContact O-N 3.34Å; T165-Y167 VanDerWaalsContact C-N 3.3Å; T165-Y167 PolarHBondContact O-N 3.39Å; Y167-S169 VanDerWaalsContact C-N 3.34Å; Y167-R170 VanDerWaalsContact CE2-CZ 3.44Å; Y167-R170 WeakPolarHBondContact O-CD 3.45Å; Y167-R170 WeakPolarHBondContact O-CG 3.38Å; Y167-R170 PolarHBondContact O-NE 3.3Å; Y167-F171 HydrophobicContact CD1-CE2 4.47Å; Y167-F171 AromaticContact CE1-CE2 3.99Å; Y167-F171 HydrophobicContact CE1-CE2 3.99Å; Y167-H211 HydrophobicContact CE1-CB 4.23Å; Y167-H211 AromaticContact CE1-ND1 3.64Å; Y167-H211 AromaticContact CZ-ND1 3.85Å; Y167-H211 PolarHBondContact OH-ND1 3.21Å; Y167-H211 VanDerWaalsContact OH-ND1 3.15Å; Y167-K212 WeakPolarHBondContact CE2-O 3.43Å; Y167-L213 VanDerWaalsContact CB-CD1 3.47Å; Y167-L213 HydrophobicContact CD1-CD1 4.39Å; Y167-L213 HydrophobicContact CD2-CD1 3.69Å; Y167-L213 HydrophobicContact CG-CD1 3.6Å; Y167-I218 HydrophobicContact CD1-CD1 4.18Å; Y167-I218 HydrophobicContact CE1-CD1 3.89Å
168L89.1Confident89.1Confident1 Ų160.3 Ų60.31%0.00531%0.308CS..Hα-helixtrans-77-21.3-175.8-71.1172.5000113.7I152 L164 T165 R170 F171 G172 V174 V194 F196 V205I152-L168 HydrophobicContact CD1-CD1 4.05Å; I152-L168 HydrophobicContact CD1-CD2 4.45Å; I152-L168 HydrophobicContact CG1-CD1 4.14Å; L164-L168 HydrophobicContact CD1-CD1 3.73Å; L164-L168 HydrophobicContact CD1-CG 4.3Å; L164-L168 HydrophobicContact CG-CD1 3.93Å; L164-L168 WeakPolarHBondContact O-CB 3.32Å; L164-L168 WeakPolarHBondContact O-CG 3.33Å; L164-L168 PolarHBondContact O-N 3.47Å; T165-L168 PolarHBondContact O-N 2.94Å; L168-R170 PolarHBondContact O-N 3.34Å; L168-R170 VanDerWaalsContact O-N 3.08Å; L168-F171 HydrophobicContact CD2-CD2 4.27Å; L168-F171 PolarHBondContact O-N 2.61Å; L168-G172 PolarHBondContact O-N 2.78Å; L168-V174 HydrophobicContact CB-CG2 3.98Å; L168-V194 HydrophobicContact CD1-CB 4.01Å; L168-V194 HydrophobicContact CD1-CG1 3.86Å; L168-V194 HydrophobicContact CD1-CG2 3.56Å; L168-F196 HydrophobicContact CB-CE1 4.29Å; L168-F196 HydrophobicContact CB-CZ 3.87Å; L168-F196 HydrophobicContact CD1-CZ 4.47Å; L168-F196 HydrophobicContact CD2-CZ 4.23Å; L168-F196 HydrophobicContact CG-CZ 4.41Å; L168-V205 HydrophobicContact CD2-CG1 4.4Å; L168-V205 HydrophobicContact CD2-CG2 4.23Å
169S89.6Confident89.3Confident68 Ų6854.9 Ų54.948%0.47628%0.278SS..THydrogen-bonded Turntrans-60.2-19.8176.9-167.20000113.1T165 Y167 F171 G172T165-S169 VanDerWaalsContact O-CB 3.25Å; T165-S169 WeakPolarHBondContact O-CB 3.19Å; T165-S169 PolarHBondContact O-N 3.31Å; Y167-S169 VanDerWaalsContact C-N 3.34Å; S169-F171 PolarHBondContact O-N 3.42Å; S169-G172 VanDerWaalsContact CA-O 3.31Å; S169-G172 WeakPolarHBondContact CA-O 3.38Å
170R89.8Confident89.4Confident159 Ų15958.6 Ų58.660%0.629%0.294SS*.THydrogen-bonded Turntrans-68.3-22.2174.580.1-17366.6-167.8-10.4113.6Y167 L168Y167-R170 VanDerWaalsContact CE2-CZ 3.44Å; Y167-R170 WeakPolarHBondContact O-CD 3.45Å; Y167-R170 WeakPolarHBondContact O-CG 3.38Å; Y167-R170 PolarHBondContact O-NE 3.3Å; L168-R170 PolarHBondContact O-N 3.34Å; L168-R170 VanDerWaalsContact O-N 3.08Å
171F88Confident89.4Confident28 Ų2859.6 Ų59.612%0.12330%0.298CS..THydrogen-bonded Turntrans-100-24.6-178.4-56.2-67.7000112.2Y167 L168 S169 V205 L208 H211Y167-F171 HydrophobicContact CD1-CE2 4.47Å; Y167-F171 AromaticContact CE1-CE2 3.99Å; Y167-F171 HydrophobicContact CE1-CE2 3.99Å; L168-F171 HydrophobicContact CD2-CD2 4.27Å; L168-F171 PolarHBondContact O-N 2.61Å; S169-F171 PolarHBondContact O-N 3.42Å; F171-V205 HydrophobicContact CB-CG2 3.47Å; F171-V205 VanDerWaalsContact CB-CG2 3.47Å; F171-V205 HydrophobicContact CD1-CG2 4.32Å; F171-V205 HydrophobicContact CD2-CG2 3.55Å; F171-V205 HydrophobicContact CE2-CG2 4.37Å; F171-V205 HydrophobicContact CG-CG2 3.51Å; F171-L208 HydrophobicContact CD1-CD1 4.36Å; F171-L208 HydrophobicContact CE1-CD1 3.22Å; F171-L208 HydrophobicContact CE1-CG 4.37Å; F171-L208 HydrophobicContact CZ-CD1 3.4Å; F171-H211 AromaticContact CE2-CE1 3.8Å; F171-H211 AromaticContact CE2-ND1 3.99Å; F171-H211 AromaticContact CZ-CE1 3.68Å; F171-H211 AromaticContact CZ-ND1 3.98Å
172G88.2Confident89.3Confident17 Ų1758.4 Ų58.418%0.17530%0.296CS..SBendtrans172.6173.817300000113.7L168 S169 V174 S201L168-G172 PolarHBondContact O-N 2.78Å; S169-G172 VanDerWaalsContact CA-O 3.31Å; S169-G172 WeakPolarHBondContact CA-O 3.38Å; G172-V174 PolarHBondContact O-N 2.8Å; G172-S201 WeakPolarHBondContact CA-OG 3.28Å
173E89.6Confident89Confident107 Ų10756.3 Ų56.350%0.530%0.299SS..  trans-68.2117.5-179.6-166.7-178.2149.400110.5F196 K197E173-F196 WeakPolarHBondContact O-CA 3.3Å; E173-K197 HydrophobicContact CB-CB 4.23Å; E173-K197 HydrophobicContact CB-CD 4.32Å; E173-K197 VanDerWaalsContact CD-CD 3.4Å; E173-K197 HydrophobicContact CG-CD 4.25Å; E173-K197 PolarHBondContact O-N 3.35Å; E173-K197 WeakPolarHBondContact OE1-CD 3.18Å; E173-K197 IonicContact OE1-NZ 2.71Å; E173-K197 PolarHBondContact OE1-NZ 2.8Å; E173-K197 WeakPolarHBondContact OE2-CD 3.29Å; E173-K197 IonicContact OE2-NZ 2.95Å; E173-K197 PolarHBondContact OE2-NZ 3.48Å
174V90.1Very high88.7Confident25 Ų2559.8 Ų59.815%0.15232%0.322CS..EExtended strand (participates in β ladder)trans-87.8117.2177176.90000108.9T165 L168 G172 D176 C177 V194 F196T165-V174 HydrophobicContact CG2-CB 4Å; T165-V174 HydrophobicContact CG2-CG1 4.12Å; T165-V174 HydrophobicContact CG2-CG2 4.45Å; L168-V174 HydrophobicContact CB-CG2 3.98Å; G172-V174 PolarHBondContact O-N 2.8Å; V174-D176 WeakPolarHBondContact CG1-O 3.48Å; V174-C177 HydrophobicContact CG1-CB 4.25Å; V174-V194 HydrophobicContact CB-CG1 4.41Å; V174-V194 HydrophobicContact CG1-CG1 3.56Å; V174-V194 HydrophobicContact CG2-CG1 4Å; V174-F196 HydrophobicContact CG2-CD1 4.02Å; V174-F196 HydrophobicContact CG2-CE1 3.67Å; V174-F196 HydrophobicContact CG2-CZ 4.28Å
175V88.6Confident88.6Confident87 Ų8764.1 Ų64.153%0.52735%0.349SS..EExtended strand (participates in β ladder)trans-79.1-44.2177.8176.30000110.8L195 K197V175-L195 HydrophobicContact CB-CD2 4.35Å; V175-L195 HydrophobicContact CB-CG 4.33Å; V175-L195 HydrophobicContact CG1-CD2 4.23Å; V175-L195 PolarHBondContact N-O 3.25Å; V175-K197 HydrophobicContact CG2-CB 3.65Å; V175-K197 HydrophobicContact CG2-CG 4.3Å
176D86.2Confident88.3Confident26 Ų2664.8 Ų64.814%0.13936%0.363CS..EExtended strand (participates in β ladder)trans-151.4155.3177-167.821.4000111.5I138 K161 V174 V194 L195I138-D176 VanDerWaalsContact CA-OD2 3.3Å; I138-D176 WeakPolarHBondContact CA-OD2 3.44Å; I138-D176 HydrophobicContact CG2-CB 4.4Å; I138-D176 WeakPolarHBondContact CG2-OD2 3.01Å; K161-D176 IonicContact NZ-OD1 2.75Å; K161-D176 PolarHBondContact NZ-OD1 2.78Å; V174-D176 WeakPolarHBondContact CG1-O 3.48Å; D176-V194 CarbonylContact O-C 3.56Å; D176-V194 WeakPolarHBondContact O-CA 3.26Å; D176-L195 HydrophobicContact CB-CB 4.38Å; D176-L195 PolarHBondContact N-O 3.46Å; D176-L195 PolarHBondContact O-N 2.84Å
177C89Confident88.1Confident4 Ų465.1 Ų65.13%0.02736%0.358CS..EExtended strand (participates in β ladder)trans-146.7140.6174.850.90000110.4K161 T165 V174 F193 V194K161-C177 VanDerWaalsContact CD-O 3.31Å; K161-C177 WeakPolarHBondContact CD-O 3.5Å; K161-C177 WeakPolarHBondContact CE-O 3.31Å; K161-C177 WeakPolarHBondContact CE-SG 3.45Å; K161-C177 HydrophobicContact CG-CB 4.34Å; K161-C177 WeakPolarHBondContact CG-SG 3.16Å; K161-C177 PolarHBondContact NZ-O 2.83Å; K161-C177 VanDerWaalsContact NZ-O 3.09Å; T165-C177 PolarHBondContact OG1-SG 2.97Å; V174-C177 HydrophobicContact CG1-CB 4.25Å; C177-F193 CarbonylContact C-O 3.38Å; C177-F193 WeakPolarHBondContact CA-O 3.42Å; C177-V194 HydrophobicContact CB-CB 4.49Å; C177-V194 HydrophobicContact CB-CG1 4.36Å; C177-V194 HydrophobicContact CB-CG2 3.93Å
178T88.8Confident88Confident32 Ų3264.5 Ų64.520%0.19636%0.358CS..EExtended strand (participates in β ladder)trans-140.2116.3-175.5-68.60000108.8K180 G192 F193T178-K180 HydrophobicContact CG2-CD 4.38Å; T178-G192 CarbonylContact O-C 3.48Å; T178-G192 WeakPolarHBondContact O-CA 3.31Å; T178-F193 PolarHBondContact N-O 2.65Å; T178-F193 PolarHBondContact O-N 2.68Å
179I90.8Very high87.9Confident30 Ų3071.7 Ų71.715%0.15439%0.385CS..EExtended strand (participates in β ladder)trans-87.6134.3170.6-61-177.8000108.2L155 T159 S160 L164 T181 S188L155-I179 HydrophobicContact CD1-CD1 4.44Å; L155-I179 HydrophobicContact CD1-CG1 4.37Å; T159-I179 HydrophobicContact CG2-CD1 4.44Å; T159-I179 VanDerWaalsContact O-CD1 3.26Å; T159-I179 WeakPolarHBondContact O-CD1 3.18Å; S160-I179 WeakPolarHBondContact O-CD1 3.47Å; L164-I179 HydrophobicContact CD2-CG1 4.25Å; I179-T181 PolarHBondContact O-N 2.75Å; I179-S188 WeakPolarHBondContact CG2-OG 3.2Å
180K88.4Confident87.9Confident83 Ų8368.9 Ų68.936%0.36137%0.366SS..EExtended strand (participates in β ladder)trans-86.9112.7176.5-68.7-56.9-172.5-172.80109.3T178 R189 F191 F193T178-K180 HydrophobicContact CG2-CD 4.38Å; K180-R189 WeakPolarHBondContact O-CB 3.34Å; K180-R189 WeakPolarHBondContact O-CG 3.49Å; K180-R189 PolarHBondContact O-N 3.32Å; K180-F191 HydrophobicContact CB-CD2 4.09Å; K180-F191 HydrophobicContact CB-CE1 4.41Å; K180-F191 HydrophobicContact CB-CE2 3.58Å; K180-F191 HydrophobicContact CB-CZ 3.75Å; K180-F191 HydrophobicContact CG-CD2 4.13Å; K180-F191 HydrophobicContact CG-CE2 3.52Å; K180-F191 HydrophobicContact CG-CZ 4.1Å; K180-F191 PolarHBondContact N-O 3Å; K180-F193 HydrophobicContact CG-CD2 4.31Å; K180-F193 HydrophobicContact CG-CE2 4.14Å
181T90.1Very high88Confident68 Ų6863.3 Ų63.342%0.41735%0.347SS..EExtended strand (participates in β ladder)trans-97.2156.8170.251.20000110.4I179 R187I179-T181 PolarHBondContact O-N 2.75Å; T181-R187 CarbonylContact C-O 3.58Å; T181-R187 WeakPolarHBondContact CA-O 3.29Å
182D86.7Confident88.2Confident53 Ų5362 Ų6228%0.28334%0.341SS..  trans-71.6123.2169.9176.23.4000109V184 T185 G186 R187 R189D182-V184 PolarHBondContact O-N 2.81Å; D182-V184 PolarHBondContact OD1-N 3.04Å; D182-T185 WeakPolarHBondContact CB-OG1 3.44Å; D182-T185 VanDerWaalsContact CG-OG1 3.27Å; D182-T185 WeakPolarHBondContact OD2-CG2 3.44Å; D182-T185 PolarHBondContact OD2-OG1 2.81Å; D182-G186 VanDerWaalsContact O-CA 3.24Å; D182-G186 WeakPolarHBondContact O-CA 3.48Å; D182-G186 PolarHBondContact O-N 2.89Å; D182-R187 PolarHBondContact N-O 2.89Å; D182-R189 HydrophobicContact CB-CG 4.46Å
183P84.4Confident88.4Confident125 Ų12562.9 Ų62.981%0.81234%0.34SS*.THydrogen-bonded Turntrans-65.1-18.9-177.727-36.6000114
184V84.3Confident88.4Confident130 Ų13057.9 Ų57.979%0.78832%0.317SS*.THydrogen-bonded Turntrans-90.2-45.8-178.9-177.20000111.2D182D182-V184 PolarHBondContact O-N 2.81Å; D182-V184 PolarHBondContact OD1-N 3.04Å
185T87.5Confident88.4Confident91 Ų9157.7 Ų57.756%0.55832%0.315SS*.THydrogen-bonded Turntrans-98.8-12-173.863.20000113.5D182 R187D182-T185 WeakPolarHBondContact CB-OG1 3.44Å; D182-T185 VanDerWaalsContact CG-OG1 3.27Å; D182-T185 WeakPolarHBondContact OD2-CG2 3.44Å; D182-T185 PolarHBondContact OD2-OG1 2.81Å; T185-R187 PolarHBondContact O-N 3.15Å; T185-R187 VanDerWaalsContact O-N 3.07Å; T185-R187 PolarHBondContact OG1-N 3.01Å
186G84.1Confident88.5Confident53 Ų5353.8 Ų53.855%0.54629%0.291SS..  trans69.1-5.7-17300000114.1D182D182-G186 VanDerWaalsContact O-CA 3.24Å; D182-G186 WeakPolarHBondContact O-CA 3.48Å; D182-G186 PolarHBondContact O-N 2.89Å
187R86.1Confident88.6Confident155 Ų15558.1 Ų58.159%0.58531%0.308SS*.  trans-70.7138.8-176.5-174177.2-77.5-177.2-4.2110.8T181 D182 T185 R189T181-R187 CarbonylContact C-O 3.58Å; T181-R187 WeakPolarHBondContact CA-O 3.29Å; D182-R187 PolarHBondContact N-O 2.89Å; T185-R187 PolarHBondContact O-N 3.15Å; T185-R187 VanDerWaalsContact O-N 3.07Å; T185-R187 PolarHBondContact OG1-N 3.01Å; R187-R189 PolarHBondContact O-N 3.34Å
188S89.3Confident88.5Confident12 Ų1262.2 Ų62.28%0.08433%0.33CS..EExtended strand (participates in β ladder)trans-58.6134172.3178.80000110.9W157 I179 G190W157-S188 WeakPolarHBondContact O-CB 3.48Å; I179-S188 WeakPolarHBondContact CG2-OG 3.2Å; S188-G190 PolarHBondContact O-N 3.33Å; S188-G190 PolarHBondContact OG-N 3.15Å
189R87.4Confident88.4Confident152 Ų15262.7 Ų62.757%0.57434%0.337SS*.EExtended strand (participates in β ladder)trans-78.83.2175.2-58.8177.263.3-176.3-3.1112.1K180 D182 R187 F191K180-R189 WeakPolarHBondContact O-CB 3.34Å; K180-R189 WeakPolarHBondContact O-CG 3.49Å; K180-R189 PolarHBondContact O-N 3.32Å; D182-R189 HydrophobicContact CB-CG 4.46Å; R187-R189 PolarHBondContact O-N 3.34Å; R189-F191 VanDerWaalsContact C-N 3.3Å; R189-F191 HydrophobicContact CB-CD1 3.69Å; R189-F191 HydrophobicContact CB-CE1 3.39Å; R189-F191 HydrophobicContact CB-CZ 4.27Å; R189-F191 HydrophobicContact CG-CE1 4.31Å; R189-F191 WeakPolarHBondContact O-CD1 3.21Å; R189-F191 PolarHBondContact O-N 2.85Å
190G89.2Confident88.3Confident9 Ų964.1 Ų64.19%0.09335%0.353CS..EExtended strand (participates in β ladder)trans72.722.8179.900000113.5G154 L155 S188G154-G190 PolarHBondContact N-O 3.1Å; G154-G190 VanDerWaalsContact N-O 3.09Å; L155-G190 PolarHBondContact N-O 2.87Å; L155-G190 WeakPolarHBondContact O-CA 3.33Å; S188-G190 PolarHBondContact O-N 3.33Å; S188-G190 PolarHBondContact OG-N 3.15Å
191F91.6Very high88.4Confident43 Ų4360.3 Ų60.319%0.18934%0.337CS..EExtended strand (participates in β ladder)trans-150.215617370.7-91.4000111.9F151 I152 K180 R189 F193F151-F191 HydrophobicContact CD2-CD2 4.41Å; F151-F191 HydrophobicContact CE2-CB 3.85Å; F151-F191 AromaticContact CE2-CD2 3.6Å; F151-F191 HydrophobicContact CE2-CD2 3.6Å; F151-F191 HydrophobicContact CE2-CE2 4.41Å; F151-F191 AromaticContact CE2-CG 3.95Å; F151-F191 HydrophobicContact CE2-CG 3.95Å; F151-F191 HydrophobicContact CZ-CB 3.88Å; F151-F191 HydrophobicContact CZ-CD2 4.4Å; F151-F191 HydrophobicContact CZ-CG 4.32Å; I152-F191 CarbonylContact O-C 3.58Å; I152-F191 WeakPolarHBondContact O-CA 3.33Å; I152-F191 WeakPolarHBondContact O-CB 3.06Å; K180-F191 HydrophobicContact CB-CD2 4.09Å; K180-F191 HydrophobicContact CB-CE1 4.41Å; K180-F191 HydrophobicContact CB-CE2 3.58Å; K180-F191 HydrophobicContact CB-CZ 3.75Å; K180-F191 HydrophobicContact CG-CD2 4.13Å; K180-F191 HydrophobicContact CG-CE2 3.52Å; K180-F191 HydrophobicContact CG-CZ 4.1Å; K180-F191 PolarHBondContact N-O 3Å; R189-F191 VanDerWaalsContact C-N 3.3Å; R189-F191 HydrophobicContact CB-CD1 3.69Å; R189-F191 HydrophobicContact CB-CE1 3.39Å; R189-F191 HydrophobicContact CB-CZ 4.27Å; R189-F191 HydrophobicContact CG-CE1 4.31Å; R189-F191 WeakPolarHBondContact O-CD1 3.21Å; R189-F191 PolarHBondContact O-N 2.85Å; F191-F193 HydrophobicContact CD2-CE2 4.43Å; F191-F193 HydrophobicContact CE2-CE2 4.21Å
192G91.5Very high88.3Confident0 Ų057.1 Ų57.10%032%0.318CS..EExtended strand (participates in β ladder)trans-147.4175.4-179.900000112.9I152 T178I152-G192 PolarHBondContact N-O 3.11Å; I152-G192 PolarHBondContact O-N 3.39Å; T178-G192 CarbonylContact O-C 3.48Å; T178-G192 WeakPolarHBondContact O-CA 3.31Å
193F92.1Very high88.4Confident36 Ų3658.1 Ų58.116%0.15832%0.323CS..EExtended strand (participates in β ladder)trans-122.1141.7171.5-64.7-85.3000109M150 F151 C177 T178 K180 F191 A223M150-F193 CarbonylContact O-C 3.59Å; M150-F193 VanDerWaalsContact O-CA 3.31Å; M150-F193 WeakPolarHBondContact O-CA 3.21Å; F151-F193 HydrophobicContact CB-CD1 4.32Å; F151-F193 HydrophobicContact CB-CE1 4.16Å; F151-F193 HydrophobicContact CD2-CD1 4.39Å; F151-F193 AromaticContact CD2-CE1 3.8Å; F151-F193 HydrophobicContact CD2-CE1 3.8Å; F151-F193 AromaticContact CD2-CZ 3.95Å; F151-F193 HydrophobicContact CD2-CZ 3.95Å; F151-F193 HydrophobicContact CG-CE1 4.48Å; C177-F193 CarbonylContact C-O 3.38Å; C177-F193 WeakPolarHBondContact CA-O 3.42Å; T178-F193 PolarHBondContact N-O 2.65Å; T178-F193 PolarHBondContact O-N 2.68Å; K180-F193 HydrophobicContact CG-CD2 4.31Å; K180-F193 HydrophobicContact CG-CE2 4.14Å; F191-F193 HydrophobicContact CD2-CE2 4.43Å; F191-F193 HydrophobicContact CE2-CE2 4.21Å; F193-A223 HydrophobicContact CD1-CB 4.29Å
194V90.8Very high88.6Confident1 Ų157.5 Ų57.51%0.00631%0.307CS..EExtended strand (participates in β ladder)trans-130.2139.1178.5-177.70000107.8K149 M150 I152 L164 L168 V174 D176 C177 F196K149-V194 CarbonylContact C-O 3.56Å; K149-V194 WeakPolarHBondContact CA-O 3.48Å; M150-V194 PolarHBondContact N-O 2.61Å; M150-V194 PolarHBondContact O-N 3.33Å; I152-V194 HydrophobicContact CG1-CG2 3.87Å; L164-V194 HydrophobicContact CD2-CG2 3.73Å; L164-V194 HydrophobicContact CG-CG2 4.13Å; L168-V194 HydrophobicContact CD1-CB 4.01Å; L168-V194 HydrophobicContact CD1-CG1 3.86Å; L168-V194 HydrophobicContact CD1-CG2 3.56Å; V174-V194 HydrophobicContact CB-CG1 4.41Å; V174-V194 HydrophobicContact CG1-CG1 3.56Å; V174-V194 HydrophobicContact CG2-CG1 4Å; D176-V194 CarbonylContact O-C 3.56Å; D176-V194 WeakPolarHBondContact O-CA 3.26Å; C177-V194 HydrophobicContact CB-CB 4.49Å; C177-V194 HydrophobicContact CB-CG1 4.36Å; C177-V194 HydrophobicContact CB-CG2 3.93Å; V194-F196 HydrophobicContact CG1-CD2 4.42Å; V194-F196 HydrophobicContact CG1-CE2 4.12Å; V194-F196 HydrophobicContact CG1-CZ 4.41Å
195L89.3Confident88.9Confident22 Ų2251.3 Ų51.312%0.11527%0.27CS..EExtended strand (participates in β ladder)trans-114.8113.9176.3-178.365.8000107.3D146 K149 V175 D176D146-L195 HydrophobicContact CB-CD1 4.14Å; K149-L195 HydrophobicContact CB-CD1 3.99Å; V175-L195 HydrophobicContact CB-CD2 4.35Å; V175-L195 HydrophobicContact CB-CG 4.33Å; V175-L195 HydrophobicContact CG1-CD2 4.23Å; V175-L195 PolarHBondContact N-O 3.25Å; D176-L195 HydrophobicContact CB-CB 4.38Å; D176-L195 PolarHBondContact N-O 3.46Å; D176-L195 PolarHBondContact O-N 2.84Å
196F90.4Very high88.9Confident5 Ų550 Ų502%0.02226%0.259CS..EExtended strand (participates in β ladder)trans-84153.4169.3-71.4-82.8000110.3G148 M150 L168 E173 V174 V194 D198 V202 V205G148-F196 PolarHBondContact O-N 2.95Å; M150-F196 HydrophobicContact CB-CE2 4.47Å; M150-F196 HydrophobicContact CE-CD2 4.17Å; M150-F196 HydrophobicContact CE-CE2 3.53Å; M150-F196 HydrophobicContact CE-CZ 4.4Å; M150-F196 HydrophobicContact SD-CE2 4.44Å; L168-F196 HydrophobicContact CB-CE1 4.29Å; L168-F196 HydrophobicContact CB-CZ 3.87Å; L168-F196 HydrophobicContact CD1-CZ 4.47Å; L168-F196 HydrophobicContact CD2-CZ 4.23Å; L168-F196 HydrophobicContact CG-CZ 4.41Å; E173-F196 WeakPolarHBondContact O-CA 3.3Å; V174-F196 HydrophobicContact CG2-CD1 4.02Å; V174-F196 HydrophobicContact CG2-CE1 3.67Å; V174-F196 HydrophobicContact CG2-CZ 4.28Å; V194-F196 HydrophobicContact CG1-CD2 4.42Å; V194-F196 HydrophobicContact CG1-CE2 4.12Å; V194-F196 HydrophobicContact CG1-CZ 4.41Å; F196-D198 VanDerWaalsContact C-N 3.34Å; F196-D198 WeakPolarHBondContact CB-O 3.16Å; F196-V202 HydrophobicContact CB-CG2 4.42Å; F196-V202 HydrophobicContact CD2-CG2 3.77Å; F196-V202 HydrophobicContact CG-CG2 4.44Å; F196-V205 HydrophobicContact CE2-CG2 4.46Å; F196-V205 HydrophobicContact CZ-CG2 4.08Å
197K88.1Confident89.2Confident117 Ų11755.2 Ų55.251%0.50927%0.269SS..SBendtrans-65.8-42171.2-171.3173179.9174.30111.2E173 V175E173-K197 HydrophobicContact CB-CB 4.23Å; E173-K197 HydrophobicContact CB-CD 4.32Å; E173-K197 VanDerWaalsContact CD-CD 3.4Å; E173-K197 HydrophobicContact CG-CD 4.25Å; E173-K197 PolarHBondContact O-N 3.35Å; E173-K197 WeakPolarHBondContact OE1-CD 3.18Å; E173-K197 IonicContact OE1-NZ 2.71Å; E173-K197 PolarHBondContact OE1-NZ 2.8Å; E173-K197 WeakPolarHBondContact OE2-CD 3.29Å; E173-K197 IonicContact OE2-NZ 2.95Å; E173-K197 PolarHBondContact OE2-NZ 3.48Å; V175-K197 HydrophobicContact CG2-CB 3.65Å; V175-K197 HydrophobicContact CG2-CG 4.3Å
198D87.5Confident89.1Confident89 Ų8951.8 Ų51.848%0.47626%0.262SS..SBendtrans-112136-178.5-60.4-47.3000111.4F196 A200 S201F196-D198 VanDerWaalsContact C-N 3.34Å; F196-D198 WeakPolarHBondContact CB-O 3.16Å; D198-A200 PolarHBondContact O-N 2.86Å; D198-S201 WeakPolarHBondContact O-CB 3.3Å; D198-S201 PolarHBondContact O-N 2.92Å
199A87.4Confident88.5Confident43 Ų4360.7 Ų60.736%0.35530%0.299SS..Hα-helixtrans-64.1-28.3172.400000112.3D147 S201 V202 D203D147-A199 HydrophobicContact CB-CB 3.78Å; A199-S201 PolarHBondContact O-N 3.12Å; A199-V202 VanDerWaalsContact O-CB 3.28Å; A199-V202 WeakPolarHBondContact O-CB 3.42Å; A199-V202 PolarHBondContact O-N 2.87Å; A199-D203 PolarHBondContact O-N 3.2Å
200A89Confident88.4Confident59 Ų5960.9 Ų60.949%0.48831%0.307SS..Hα-helixtrans-61.8-29.2176.100000112.7D198 V202 D203 K204D198-A200 PolarHBondContact O-N 2.86Å; A200-V202 VanDerWaalsContact C-N 3.26Å; A200-V202 PolarHBondContact O-N 2.89Å; A200-D203 PolarHBondContact O-N 3.4Å; A200-K204 WeakPolarHBondContact O-CG 3.3Å; A200-K204 PolarHBondContact O-N 3Å; A200-K204 VanDerWaalsContact O-N 3.16Å
201S89.3Confident88.4Confident4 Ų460.5 Ų60.53%0.02830%0.303CS..Hα-helixtrans-65.6-33.2174.3-55.80000111.7G172 D198 A199 D203 K204 V205G172-S201 WeakPolarHBondContact CA-OG 3.28Å; D198-S201 WeakPolarHBondContact O-CB 3.3Å; D198-S201 PolarHBondContact O-N 2.92Å; A199-S201 PolarHBondContact O-N 3.12Å; S201-D203 VanDerWaalsContact C-N 3.34Å; S201-K204 PolarHBondContact O-N 3.4Å; S201-V205 WeakPolarHBondContact O-CG2 3.43Å; S201-V205 PolarHBondContact O-N 2.74Å
202V87.7Confident88.2Confident1 Ų164.6 Ų64.61%0.00632%0.32CS..Hα-helixtrans-65.1-41.7175.8178.10000110.7D147 M150 F196 A199 A200 V205 L206 R222D147-V202 WeakPolarHBondContact O-CG2 3.25Å; M150-V202 VanDerWaalsContact CE-CA 3.43Å; M150-V202 HydrophobicContact CE-CB 3.83Å; M150-V202 HydrophobicContact CE-CG1 3.61Å; M150-V202 HydrophobicContact CE-CG2 3.97Å; M150-V202 HydrophobicContact CG-CG1 4.3Å; F196-V202 HydrophobicContact CB-CG2 4.42Å; F196-V202 HydrophobicContact CD2-CG2 3.77Å; F196-V202 HydrophobicContact CG-CG2 4.44Å; A199-V202 VanDerWaalsContact O-CB 3.28Å; A199-V202 WeakPolarHBondContact O-CB 3.42Å; A199-V202 PolarHBondContact O-N 2.87Å; A200-V202 VanDerWaalsContact C-N 3.26Å; A200-V202 PolarHBondContact O-N 2.89Å; V202-V205 PolarHBondContact O-N 2.86Å; V202-L206 HydrophobicContact CG1-CD1 3.87Å; V202-L206 HydrophobicContact CG1-CG 4.48Å; V202-L206 VanDerWaalsContact O-CG 3.29Å; V202-L206 WeakPolarHBondContact O-CG 3.22Å; V202-L206 PolarHBondContact O-N 3.39Å; V202-R222 HydrophobicContact CG1-CG 4.16Å
203D89.2Confident88Confident73 Ų7365.2 Ų65.239%0.3932%0.324SS..Hα-helixtrans-65.4-40.7178.6-69.5-36.9000112.7A199 A200 S201 V205 L206 E207 R222A199-D203 PolarHBondContact O-N 3.2Å; A200-D203 PolarHBondContact O-N 3.4Å; S201-D203 VanDerWaalsContact C-N 3.34Å; D203-V205 VanDerWaalsContact C-N 3.3Å; D203-V205 PolarHBondContact O-N 2.92Å; D203-L206 PolarHBondContact O-N 3.3Å; D203-L206 VanDerWaalsContact O-N 3.15Å; D203-E207 WeakPolarHBondContact O-CB 3.4Å; D203-E207 PolarHBondContact O-N 3.13Å; D203-R222 IonicContact OD1-CZ 3.63Å; D203-R222 IonicContact OD1-NE 3Å; D203-R222 IonicContact OD1-NH2 3.93Å; D203-R222 PolarHBondContact OD1-NH2 3.14Å; D203-R222 IonicContact OD2-NH2 2.89Å
204K89.9Confident87.6Confident112 Ų11267.8 Ų67.849%0.48734%0.339SS..Hα-helixtrans-61.2-37.9175.1-68.8173.8-174.1176.70113A200 S201A200-K204 WeakPolarHBondContact O-CG 3.3Å; A200-K204 PolarHBondContact O-N 3Å; A200-K204 VanDerWaalsContact O-N 3.16Å; S201-K204 PolarHBondContact O-N 3.4Å
205V89.1Confident87.3Confident0 Ų070.7 Ų70.70%037%0.369CS..Hα-helixtrans-67.7-45.4174.6176.10000109.6M150 L168 F171 F196 S201 V202 D203 E207 L208 H211 P220M150-V205 HydrophobicContact CE-CB 3.42Å; M150-V205 VanDerWaalsContact CE-CB 3.42Å; M150-V205 HydrophobicContact CE-CG1 3.63Å; M150-V205 HydrophobicContact CE-CG2 3.76Å; M150-V205 HydrophobicContact SD-CB 4.18Å; M150-V205 HydrophobicContact SD-CG1 3.68Å; L168-V205 HydrophobicContact CD2-CG1 4.4Å; L168-V205 HydrophobicContact CD2-CG2 4.23Å; F171-V205 HydrophobicContact CB-CG2 3.47Å; F171-V205 VanDerWaalsContact CB-CG2 3.47Å; F171-V205 HydrophobicContact CD1-CG2 4.32Å; F171-V205 HydrophobicContact CD2-CG2 3.55Å; F171-V205 HydrophobicContact CE2-CG2 4.37Å; F171-V205 HydrophobicContact CG-CG2 3.51Å; F196-V205 HydrophobicContact CE2-CG2 4.46Å; F196-V205 HydrophobicContact CZ-CG2 4.08Å; S201-V205 WeakPolarHBondContact O-CG2 3.43Å; S201-V205 PolarHBondContact O-N 2.74Å; V202-V205 PolarHBondContact O-N 2.86Å; D203-V205 VanDerWaalsContact C-N 3.3Å; D203-V205 PolarHBondContact O-N 2.92Å; V205-E207 VanDerWaalsContact C-N 3.27Å; V205-E207 PolarHBondContact O-N 2.95Å; V205-L208 PolarHBondContact O-N 2.89Å; V205-L208 VanDerWaalsContact O-N 3.1Å; V205-H211 WeakPolarHBondContact CG1-NE2 3.29Å; V205-H211 PolarHBondContact O-NE2 2.86Å; V205-P220 HydrophobicContact CG1-CB 3.53Å; V205-P220 HydrophobicContact CG1-CG 3.62Å
206L88.9Confident87.2Confident63 Ų6373.4 Ų73.433%0.3338%0.38SS..Hα-helixtrans-68.6-25.4-179.3-66.9168.3000113.9V202 D203 L208 P220 R222V202-L206 HydrophobicContact CG1-CD1 3.87Å; V202-L206 HydrophobicContact CG1-CG 4.48Å; V202-L206 VanDerWaalsContact O-CG 3.29Å; V202-L206 WeakPolarHBondContact O-CG 3.22Å; V202-L206 PolarHBondContact O-N 3.39Å; D203-L206 PolarHBondContact O-N 3.3Å; D203-L206 VanDerWaalsContact O-N 3.15Å; L206-L208 PolarHBondContact O-N 3.11Å; L206-P220 WeakPolarHBondContact CD2-O 3.34Å; L206-R222 HydrophobicContact CD1-CG 3.5Å
207E88.3Confident87.2Confident163 Ų16378.6 Ų78.676%0.76241%0.407SS*.Hα-helixtrans-63-32.9172.6-172.3171.7-162.100111.2D203 V205 K209D203-E207 WeakPolarHBondContact O-CB 3.4Å; D203-E207 PolarHBondContact O-N 3.13Å; V205-E207 VanDerWaalsContact C-N 3.27Å; V205-E207 PolarHBondContact O-N 2.95Å; E207-K209 PolarHBondContact O-N 2.9Å
208L85.1Confident87.4Confident83 Ų8373.5 Ų73.544%0.43539%0.385SS..  trans-81.3109.1169-68.1-178.1000110.3F171 V205 L206 E210 H211F171-L208 HydrophobicContact CD1-CD1 4.36Å; F171-L208 HydrophobicContact CE1-CD1 3.22Å; F171-L208 HydrophobicContact CE1-CG 4.37Å; F171-L208 HydrophobicContact CZ-CD1 3.4Å; V205-L208 PolarHBondContact O-N 2.89Å; V205-L208 VanDerWaalsContact O-N 3.1Å; L206-L208 PolarHBondContact O-N 3.11Å; L208-E210 PolarHBondContact O-N 3.05Å; L208-H211 WeakPolarHBondContact CB-NE2 3.34Å; L208-H211 PolarHBondContact O-CD2 3.14Å; L208-H211 PolarHBondContact O-NE2 2.79Å; L208-H211 VanDerWaalsContact O-NE2 3.11Å
209K76.6Confident87.5Confident199 Ų19974 Ų7487%0.86539%0.388SS*.SBendtrans-70.2-22.7-179.2-164.2171.8-178.4174.70113.5E207E207-K209 PolarHBondContact O-N 2.9Å
210E86.3Confident87.6Confident156 Ų15672.6 Ų72.673%0.72938%0.375SS*.  trans-129.7121.8-175.5-64-172.8156.900110.9L208L208-E210 PolarHBondContact O-N 3.05Å
211H87.5Confident87.7Confident1 Ų175.1 Ų75.11%0.00538%0.375CS..EExtended strand (participates in β ladder)trans-124.5138.1174.5-68.2-87.7000109.8Y167 F171 V205 L208 L217 I218 P220Y167-H211 HydrophobicContact CE1-CB 4.23Å; Y167-H211 AromaticContact CE1-ND1 3.64Å; Y167-H211 AromaticContact CZ-ND1 3.85Å; Y167-H211 PolarHBondContact OH-ND1 3.21Å; Y167-H211 VanDerWaalsContact OH-ND1 3.15Å; F171-H211 AromaticContact CE2-CE1 3.8Å; F171-H211 AromaticContact CE2-ND1 3.99Å; F171-H211 AromaticContact CZ-CE1 3.68Å; F171-H211 AromaticContact CZ-ND1 3.98Å; V205-H211 WeakPolarHBondContact CG1-NE2 3.29Å; V205-H211 PolarHBondContact O-NE2 2.86Å; L208-H211 WeakPolarHBondContact CB-NE2 3.34Å; L208-H211 PolarHBondContact O-CD2 3.14Å; L208-H211 PolarHBondContact O-NE2 2.79Å; L208-H211 VanDerWaalsContact O-NE2 3.11Å; H211-L217 CarbonylContact O-C 3.55Å; H211-L217 WeakPolarHBondContact O-CA 3.24Å; H211-I218 HydrophobicContact CB-CD1 3.7Å; H211-I218 HydrophobicContact CB-CG1 3.21Å; H211-I218 PolarHBondContact O-N 3.47Å; H211-P220 WeakPolarHBondContact CD2-CG 3.48Å
212K88.4Confident87.6Confident130 Ų13080.7 Ų80.757%0.56540%0.396SS*.EExtended strand (participates in β ladder)trans-128.8126.4-179.5-168.6175.1177.3178.10109.9Y167 G215 K216 L217Y167-K212 WeakPolarHBondContact CE2-O 3.43Å; K212-G215 VanDerWaalsContact CE-O 3.3Å; K212-G215 WeakPolarHBondContact CE-O 3.03Å; K212-K216 CarbonylContact C-O 3.59Å; K212-K216 VanDerWaalsContact CA-O 3.3Å; K212-K216 WeakPolarHBondContact CA-O 3.43Å; K212-L217 HydrophobicContact CB-CD2 4.29Å
213L87.5Confident87.4Confident13 Ų1381.6 Ų81.67%0.06840%0.403CS..EExtended strand (participates in β ladder)trans-133.5131.8177.9-167.776.9000108.4L155 T159 L164 Y167 G215 K216 I218L155-L213 HydrophobicContact CD2-CD2 4.08Å; T159-L213 HydrophobicContact CG2-CD2 3.42Å; T159-L213 VanDerWaalsContact CG2-CD2 3.42Å; L164-L213 HydrophobicContact CD1-CD2 4.2Å; Y167-L213 VanDerWaalsContact CB-CD1 3.47Å; Y167-L213 HydrophobicContact CD1-CD1 4.39Å; Y167-L213 HydrophobicContact CD2-CD1 3.69Å; Y167-L213 HydrophobicContact CG-CD1 3.6Å; L213-G215 PolarHBondContact O-N 2.81Å; L213-G215 VanDerWaalsContact O-N 3.13Å; L213-K216 PolarHBondContact N-O 3.06Å; L213-K216 PolarHBondContact O-N 3.34Å; L213-K216 VanDerWaalsContact O-O 3.06Å; L213-I218 HydrophobicContact CB-CD1 4.38Å; L213-I218 HydrophobicContact CB-CG2 3.76Å
214D83.5Confident86.8Confident90 Ų9086.1 Ų86.148%0.48142%0.42SS..THydrogen-bonded Turntrans52.535.8179.1-50.6-33.7000114.3T159 K216T159-D214 WeakPolarHBondContact CB-OD2 3.47Å; T159-D214 PolarHBondContact OG1-OD2 2.85Å; D214-K216 PolarHBondContact O-N 3.19Å
215G83.6Confident85.7Confident61 Ų6183.3 Ų83.363%0.62942%0.417SS*.THydrogen-bonded Turntrans80.5-4.3-177.700000114.9K212 L213K212-G215 VanDerWaalsContact CE-O 3.3Å; K212-G215 WeakPolarHBondContact CE-O 3.03Å; L213-G215 PolarHBondContact O-N 2.81Å; L213-G215 VanDerWaalsContact O-N 3.13Å
216K88.4Confident84.3Confident79 Ų7991 Ų9134%0.34346%0.457SS..EExtended strand (participates in β ladder)trans-110.7144.5-176.1-158.8171.2175.7-171.30111.6G154 L155 K212 L213 D214G154-K216 WeakPolarHBondContact O-CD 3.14Å; G154-K216 VanDerWaalsContact O-CE 3.3Å; G154-K216 WeakPolarHBondContact O-CE 3.2Å; G154-K216 WeakPolarHBondContact O-CG 3.34Å; L155-K216 PolarHBondContact O-NZ 2.82Å; K212-K216 CarbonylContact C-O 3.59Å; K212-K216 VanDerWaalsContact CA-O 3.3Å; K212-K216 WeakPolarHBondContact CA-O 3.43Å; L213-K216 PolarHBondContact N-O 3.06Å; L213-K216 PolarHBondContact O-N 3.34Å; L213-K216 VanDerWaalsContact O-O 3.06Å; D214-K216 PolarHBondContact O-N 3.19Å
217L89.9Confident82.7Confident115 Ų11596 Ų9660%0.60248%0.476SS*.EExtended strand (participates in β ladder)trans-78125.4175.4-70.1172.3000109.8H211 K212H211-L217 CarbonylContact O-C 3.55Å; H211-L217 WeakPolarHBondContact O-CA 3.24Å; K212-L217 HydrophobicContact CB-CD2 4.29Å
218I92.2Very high80.9Confident10 Ų1090.9 Ų90.95%0.05147%0.467CS..EExtended strand (participates in β ladder)trans-101.5145.5176.172.2176.2000109.2I152 G153 L155 Y167 H211 L213 P220I152-I218 HydrophobicContact CG2-CB 4.08Å; I152-I218 HydrophobicContact CG2-CD1 4.02Å; I152-I218 HydrophobicContact CG2-CG1 4.39Å; G153-I218 CarbonylContact O-C 3.56Å; G153-I218 VanDerWaalsContact O-CA 3.29Å; G153-I218 WeakPolarHBondContact O-CA 2.94Å; L155-I218 HydrophobicContact CD2-CB 4.41Å; L155-I218 HydrophobicContact CD2-CG2 3.8Å; Y167-I218 HydrophobicContact CD1-CD1 4.18Å; Y167-I218 HydrophobicContact CE1-CD1 3.89Å; H211-I218 HydrophobicContact CB-CD1 3.7Å; H211-I218 HydrophobicContact CB-CG1 3.21Å; H211-I218 PolarHBondContact O-N 3.47Å; L213-I218 HydrophobicContact CB-CD1 4.38Å; L213-I218 HydrophobicContact CB-CG2 3.76Å; I218-P220 VanDerWaalsContact O-CD 3.29Å; I218-P220 WeakPolarHBondContact O-CD 3.44Å
219D89.5Confident79.4Confident98 Ų9896.7 Ų96.752%0.52449%0.489SS..EExtended strand (participates in β ladder)trans-114.988.7-178.7-177.637.6000109.2G153G153-D219 PolarHBondContact N-O 3.07Å; G153-D219 PolarHBondContact O-N 3.31Å
220P90.1Very high78.2Confident14 Ų1491.5 Ų91.59%0.09147%0.468CS..EExtended strand (participates in β ladder)trans-72.6131.9173.125.2-25.7000110.5M150 F151 I152 V205 L206 H211 I218M150-P220 HydrophobicContact SD-CB 3.47Å; M150-P220 WeakPolarHBondContact SD-CB 3.31Å; F151-P220 CarbonylContact O-C 3.56Å; F151-P220 WeakPolarHBondContact O-CA 3.3Å; I152-P220 HydrophobicContact CD1-CB 3.75Å; V205-P220 HydrophobicContact CG1-CB 3.53Å; V205-P220 HydrophobicContact CG1-CG 3.62Å; L206-P220 WeakPolarHBondContact CD2-O 3.34Å; H211-P220 WeakPolarHBondContact CD2-CG 3.48Å; I218-P220 VanDerWaalsContact O-CD 3.29Å; I218-P220 WeakPolarHBondContact O-CD 3.44Å
221K89.9Confident76.7Confident112 Ų11286.3 Ų86.349%0.48745%0.447SS..EExtended strand (participates in β ladder)trans-139.5146.3178.7-167.1166.7-168.7154.90109.6M150 F151 A223M150-K221 WeakPolarHBondContact CG-O 3.4Å; F151-K221 HydrophobicContact CD1-CB 4.2Å; F151-K221 PolarHBondContact N-O 2.75Å; F151-K221 PolarHBondContact O-N 3.07Å; F151-K221 VanDerWaalsContact O-O 3.11Å; K221-A223 PolarHBondContact O-N 3.16Å; K221-A223 VanDerWaalsContact O-N 3.14Å
222R88.4Confident75.6Confident121 Ų12187.9 Ų87.946%0.45746%0.458SS..EExtended strand (participates in β ladder)trans-50.9126.9170.1-67.7-164.1171.9-1476.3109.7V202 D203 L206 K224V202-R222 HydrophobicContact CG1-CG 4.16Å; D203-R222 IonicContact OD1-CZ 3.63Å; D203-R222 IonicContact OD1-NE 3Å; D203-R222 IonicContact OD1-NH2 3.93Å; D203-R222 PolarHBondContact OD1-NH2 3.14Å; D203-R222 IonicContact OD2-NH2 2.89Å; L206-R222 HydrophobicContact CD1-CG 3.5Å; R222-K224 PolarHBondContact O-N 3.45Å
223A82.7Confident75Confident20 Ų2086.9 Ų86.917%0.16545%0.453CS..PPolyproline II helixtrans-65.7117.3-177.400000107.9K149 F151 F193 K221 A225K149-A223 HydrophobicContact CB-CB 4.02Å; K149-A223 HydrophobicContact CD-CB 4.03Å; K149-A223 HydrophobicContact CG-CB 3.65Å; K149-A223 WeakPolarHBondContact O-CB 3.31Å; K149-A223 PolarHBondContact O-N 2.64Å; F151-A223 HydrophobicContact CB-CB 4.44Å; F193-A223 HydrophobicContact CD1-CB 4.29Å; K221-A223 PolarHBondContact O-N 3.16Å; K221-A223 VanDerWaalsContact O-N 3.14Å; A223-A225 PolarHBondContact O-N 2.81Å; A223-A225 VanDerWaalsContact O-N 3.11Å
224K77.4Confident74.9Confident169 Ų16989.4 Ų89.474%0.73546%0.464SS*.PPolyproline II helixtrans-67.3116.1161.7-66.1-175.3178.9-176.10105.4R222 L226R222-K224 PolarHBondContact O-N 3.45Å; K224-L226 PolarHBondContact O-N 3.42Å
225A65.4Low75.1Confident53 Ų5385.2 Ų85.244%0.43844%0.441SS..  trans-50.5111.9163.500000105.6A223 K227A223-A225 PolarHBondContact O-N 2.81Å; A223-A225 VanDerWaalsContact O-N 3.11Å; A225-K227 PolarHBondContact O-N 3.14Å
226L61Low75.4Confident160 Ų16084.6 Ų84.684%0.83842%0.422SS*.  trans-64.193.6169.6-165.681.4000102.7K224 G228K224-L226 PolarHBondContact O-N 3.42Å; L226-G228 VanDerWaalsContact C-N 3.3Å; L226-G228 WeakPolarHBondContact O-CA 3.5Å; L226-G228 PolarHBondContact O-N 3.27Å
227K54.8Low75.4Confident169 Ų16980.9 Ų80.974%0.73541%0.405SS*.  trans-45.9104.3178.5-80.4-171.2175.3-171.70105.4A225 K229A225-K227 PolarHBondContact O-N 3.14Å; K227-K229 PolarHBondContact O-N 3.22Å
228G49.9Very low75.3Confident55 Ų5575.7 Ų75.757%0.56738%0.38SS*.  trans-82.672.3-147.100000109.5L226 E230L226-G228 VanDerWaalsContact C-N 3.3Å; L226-G228 WeakPolarHBondContact O-CA 3.5Å; L226-G228 PolarHBondContact O-N 3.27Å; G228-E230 PolarHBondContact O-N 3.33Å
229K54Low74.9Confident205 Ų20577.4 Ų77.489%0.89140%0.4SS*.  trans37.145.3-169.2-66.6-177.2177.9-176.40110.3K227 P231K227-K229 PolarHBondContact O-N 3.22Å; K229-P231 VanDerWaalsContact O-N 3.1Å
230E51.8Low74.7Confident91 Ų9173.4 Ų73.443%0.42538%0.378SS..  trans-52.6127165.1-76.2172.5-159.200104.2G228 P232G228-E230 PolarHBondContact O-N 3.33Å; E230-P232 VanDerWaalsContact O-CD 3.24Å; E230-P232 WeakPolarHBondContact O-CD 3.37Å
231P55Low74.3Confident46 Ų4673.9 Ų73.930%0.29938%0.382SS..  trans-51.7115.6174.323.7-31.3000104.3K229 K233 E284 V287K229-P231 VanDerWaalsContact O-N 3.1Å; P231-K233 PolarHBondContact O-N 3.1Å; P231-E284 HydrophobicContact CG-CB 4.09Å; P231-E284 WeakPolarHBondContact CG-OE2 3.24Å; P231-V287 HydrophobicContact CB-CG1 4.36Å
232P63.5Low73.7Confident35 Ų3572 Ų7223%0.22738%0.381CS..  trans-58.6123.6-174.122.9-31000104.9E230 K234 V307E230-P232 VanDerWaalsContact O-CD 3.24Å; E230-P232 WeakPolarHBondContact O-CD 3.37Å; P232-K234 HydrophobicContact CB-CB 4.46Å; P232-K234 WeakPolarHBondContact CB-O 3.3Å; P232-K234 WeakPolarHBondContact CG-O 3.22Å; P232-K234 CarbonylContact O-C 3.58Å; P232-K234 PolarHBondContact O-N 3.28Å; P232-K234 VanDerWaalsContact O-O 3.06Å; P232-V307 VanDerWaalsContact CD-CG1 3.49Å; P232-V307 HydrophobicContact CG-CB 4.24Å; P232-V307 HydrophobicContact CG-CG1 3.34Å
233K77.2Confident73.3Confident108 Ų10872.3 Ų72.347%0.4739%0.392SS..SBendtrans-49.6-21.4167.8-62.8-170177.9-156.80111.2P231 T280 Y281 T282P231-K233 PolarHBondContact O-N 3.1Å; K233-T280 HydrophobicContact CB-CG2 4.46Å; K233-T280 WeakPolarHBondContact O-CA 3.24Å; K233-Y281 WeakPolarHBondContact CB-O 3.35Å; K233-Y281 PolarHBondContact O-N 3.38Å; K233-T282 PolarHBondContact NZ-O 3.36Å
234K85.4Confident73.2Confident67 Ų6771.5 Ų71.529%0.29139%0.385SS..EExtended strand (participates in β ladder)trans-84.6122.2168.5-161.9169.6-173.6165.30112.7P232 E263 F278 I279 A308P232-K234 HydrophobicContact CB-CB 4.46Å; P232-K234 WeakPolarHBondContact CB-O 3.3Å; P232-K234 WeakPolarHBondContact CG-O 3.22Å; P232-K234 CarbonylContact O-C 3.58Å; P232-K234 PolarHBondContact O-N 3.28Å; P232-K234 VanDerWaalsContact O-O 3.06Å; K234-E263 IonicContact NZ-OE2 3.6Å; K234-E263 PolarHBondContact NZ-OE2 2.91Å; K234-F278 HydrophobicContact CD-CB 4.32Å; K234-F278 HydrophobicContact CD-CD1 4.41Å; K234-F278 VanDerWaalsContact CE-CG 3.48Å; K234-F278 HydrophobicContact CG-CB 4.18Å; K234-F278 HydrophobicContact CG-CD1 4.37Å; K234-I279 CarbonylContact C-O 3.59Å; K234-I279 VanDerWaalsContact CA-O 3.28Å; K234-I279 WeakPolarHBondContact CA-O 3.36Å; K234-A308 HydrophobicContact CB-CB 3.9Å; K234-A308 HydrophobicContact CD-CB 4.27Å; K234-A308 HydrophobicContact CG-CB 3.69Å; K234-A308 WeakPolarHBondContact O-CB 3.43Å; K234-A308 PolarHBondContact O-N 2.74Å
235V87.6Confident73.5Confident1 Ų164.8 Ų64.81%0.00636%0.36CS..EExtended strand (participates in β ladder)trans-105.7139.5175.3-1770000109.2V237 F278 I279 Y281 V287 I305V235-V237 HydrophobicContact CG1-CG2 4.23Å; V235-F278 CarbonylContact O-C 3.54Å; V235-F278 VanDerWaalsContact O-CA 3.25Å; V235-F278 WeakPolarHBondContact O-CA 3.47Å; V235-I279 PolarHBondContact N-O 3.29Å; V235-I279 PolarHBondContact O-N 3.49Å; V235-Y281 HydrophobicContact CB-CE2 4.45Å; V235-Y281 HydrophobicContact CG2-CD2 4.03Å; V235-Y281 HydrophobicContact CG2-CE2 3.88Å; V235-V287 HydrophobicContact CG2-CB 4.01Å; V235-V287 HydrophobicContact CG2-CG1 3.76Å; V235-V287 HydrophobicContact CG2-CG2 3.54Å; V235-I305 HydrophobicContact CG1-CG2 3.25Å
236F88.3Confident74.5Confident49 Ų4966.9 Ų66.922%0.21536%0.36CS..EExtended strand (participates in β ladder)trans-95.1126.8167.8171.3-90.9000108.9F276 F278 I305 K306 A308F236-F276 HydrophobicContact CD2-CD2 4.4Å; F236-F276 HydrophobicContact CE2-CB 3.62Å; F236-F276 HydrophobicContact CE2-CD1 4.43Å; F236-F276 AromaticContact CE2-CD2 3.73Å; F236-F276 HydrophobicContact CE2-CD2 3.73Å; F236-F276 AromaticContact CE2-CG 3.69Å; F236-F276 HydrophobicContact CE2-CG 3.69Å; F236-F276 HydrophobicContact CZ-CB 3.72Å; F236-F276 HydrophobicContact CZ-CG 4.13Å; F236-F278 HydrophobicContact CB-CD1 4.15Å; F236-F278 HydrophobicContact CB-CE1 4.04Å; F236-F278 HydrophobicContact CD2-CD1 4.13Å; F236-F278 AromaticContact CD2-CE1 3.55Å; F236-F278 HydrophobicContact CD2-CE1 3.55Å; F236-F278 AromaticContact CD2-CZ 3.79Å; F236-F278 HydrophobicContact CD2-CZ 3.79Å; F236-F278 HydrophobicContact CE2-CZ 4.36Å; F236-F278 HydrophobicContact CG-CE1 4.29Å; F236-I305 WeakPolarHBondContact O-CA 3.49Å; F236-K306 HydrophobicContact CB-CB 4.39Å; F236-K306 HydrophobicContact CD1-CB 4.02Å; F236-K306 HydrophobicContact CD1-CD 4.41Å; F236-K306 PolarHBondContact N-O 2.79Å; F236-K306 PolarHBondContact O-N 2.95Å; F236-A308 HydrophobicContact CB-CB 4.33Å
237V88.4Confident75.7Confident0 Ų066.5 Ų66.50%035%0.354CS..EExtended strand (participates in β ladder)trans-117.2107.4175.1-175.50000107.4V235 L240 F253 F276 C277 I279 C303 E304 I305V235-V237 HydrophobicContact CG1-CG2 4.23Å; V237-L240 HydrophobicContact CB-CD1 4.39Å; V237-L240 HydrophobicContact CG1-CD1 3.98Å; V237-L240 HydrophobicContact CG1-CD2 4.09Å; V237-L240 HydrophobicContact CG1-CG 4Å; V237-F253 HydrophobicContact CB-CZ 4.32Å; V237-F253 HydrophobicContact CG1-CE2 3.99Å; V237-F253 HydrophobicContact CG1-CZ 3.69Å; V237-F253 HydrophobicContact CG2-CE1 4.19Å; V237-F253 HydrophobicContact CG2-CE2 4.07Å; V237-F253 HydrophobicContact CG2-CZ 3.65Å; V237-F276 CarbonylContact O-C 3.45Å; V237-F276 WeakPolarHBondContact O-CA 3.47Å; V237-F276 VanDerWaalsContact O-CB 3.3Å; V237-F276 WeakPolarHBondContact O-CB 3.44Å; V237-C277 PolarHBondContact N-O 2.79Å; V237-C277 PolarHBondContact O-N 3.23Å; V237-I279 HydrophobicContact CG2-CD1 3.91Å; V237-I279 HydrophobicContact CG2-CG1 4.31Å; V237-C303 HydrophobicContact CG1-CB 3.71Å; V237-E304 CarbonylContact C-O 3.5Å; V237-E304 WeakPolarHBondContact CA-O 3.32Å; V237-I305 HydrophobicContact CG2-CG1 4.48Å
238G88.1Confident77.2Confident6 Ų662.6 Ų62.66%0.06234%0.338CS..EExtended strand (participates in β ladder)trans-103164.2177.300000112.4G275 C303 E304G238-G275 CarbonylContact C-O 3.53Å; G238-C303 CarbonylContact O-C 3.4Å; G238-C303 WeakPolarHBondContact O-CA 3.18Å; G238-C303 WeakPolarHBondContact O-CB 3.13Å; G238-E304 PolarHBondContact N-O 3.5Å; G238-E304 PolarHBondContact O-N 3.49Å
239G85.1Confident79Confident46 Ų4660 Ų6047%0.47431%0.312SS..  trans77.918.9177.500000114.4G275 K302G239-G275 PolarHBondContact N-O 2.87Å; G239-K302 CarbonylContact O-C 3.53Å
240L85.2Confident80.6Confident14 Ų1456.1 Ų56.17%0.07330%0.295CS..  trans-71.2136.5171.7-67.7167.9000109.5V237 T244 I249 G275 C277 I298 C303V237-L240 HydrophobicContact CB-CD1 4.39Å; V237-L240 HydrophobicContact CG1-CD1 3.98Å; V237-L240 HydrophobicContact CG1-CD2 4.09Å; V237-L240 HydrophobicContact CG1-CG 4Å; L240-T244 HydrophobicContact CD2-CG2 4.47Å; L240-I249 HydrophobicContact CD1-CD1 3.73Å; L240-I249 HydrophobicContact CD1-CG1 4.37Å; L240-I249 HydrophobicContact CD2-CD1 4.47Å; L240-I249 HydrophobicContact CD2-CG1 4.37Å; L240-G275 PolarHBondContact N-O 3.4Å; L240-G275 WeakPolarHBondContact O-CA 3.36Å; L240-C277 HydrophobicContact CD1-CB 3.86Å; L240-C277 WeakPolarHBondContact CD1-SG 3.25Å; L240-I298 HydrophobicContact CD2-CB 4.5Å; L240-I298 HydrophobicContact CD2-CD1 4.25Å; L240-C303 HydrophobicContact CD2-CB 3.85Å; L240-C303 HydrophobicContact CG-CB 4.29Å
241S81.2Confident82.4Confident24 Ų2459.2 Ų59.217%0.16831%0.309CS..  trans-65.4141.6172.3-176.90000109.3D243 T244S241-D243 PolarHBondContact O-N 3.42Å; S241-D243 VanDerWaalsContact O-N 3.1Å; S241-T244 WeakPolarHBondContact CB-OG1 3.5Å; S241-T244 PolarHBondContact N-OG1 3.09Å; S241-T244 VanDerWaalsContact O-CB 3.27Å; S241-T244 WeakPolarHBondContact O-CB 3.44Å; S241-T244 PolarHBondContact O-N 2.95Å; S241-T244 PolarHBondContact O-OG1 3.25Å
242P78.2Confident84Confident72 Ų7260.8 Ų60.847%0.46831%0.31SS..THydrogen-bonded Turntrans-58.4-21.1174.825.7-36000113T244 R273P242-T244 VanDerWaalsContact C-N 3.3Å; P242-T244 PolarHBondContact O-N 2.75Å; P242-R273 HydrophobicContact CB-CB 4.41Å; P242-R273 VanDerWaalsContact O-CD 3.32Å; P242-R273 WeakPolarHBondContact O-CD 3.43Å; P242-R273 PolarHBondContact O-NH1 3.5Å
243D79.7Confident85.1Confident128 Ų12859.1 Ų59.168%0.68430%0.299SS*.THydrogen-bonded Turntrans-76.6-17.5176.5-54-40.4000113S241 S245S241-D243 PolarHBondContact O-N 3.42Å; S241-D243 VanDerWaalsContact O-N 3.1Å; D243-S245 PolarHBondContact O-N 3.12Å
244T80.8Confident85.5Confident3 Ų355.8 Ų55.82%0.01830%0.295CS..  trans-69.4115.9-176-39.40000110.5L240 S241 P242 Q248 I249 R273 I298L240-T244 HydrophobicContact CD2-CG2 4.47Å; S241-T244 WeakPolarHBondContact CB-OG1 3.5Å; S241-T244 PolarHBondContact N-OG1 3.09Å; S241-T244 VanDerWaalsContact O-CB 3.27Å; S241-T244 WeakPolarHBondContact O-CB 3.44Å; S241-T244 PolarHBondContact O-N 2.95Å; S241-T244 PolarHBondContact O-OG1 3.25Å; P242-T244 VanDerWaalsContact C-N 3.3Å; P242-T244 PolarHBondContact O-N 2.75Å; T244-Q248 HydrophobicContact CG2-CB 4.22Å; T244-I249 HydrophobicContact CG2-CD1 4.28Å; T244-I249 HydrophobicContact CG2-CG1 3.92Å; T244-R273 PolarHBondContact O-NH1 3.32Å; T244-I298 HydrophobicContact CG2-CG2 3.78Å
245S83.7Confident85.6Confident29 Ų2956.7 Ų56.720%0.20332%0.315CS..  trans-75.4157.7177.665.40000112D243 E247 Q248 I249D243-S245 PolarHBondContact O-N 3.12Å; S245-E247 PolarHBondContact O-N 3.42Å; S245-Q248 PolarHBondContact O-N 3.35Å; S245-Q248 WeakPolarHBondContact OG-CG 3.21Å; S245-Q248 PolarHBondContact OG-N 3.48Å; S245-I249 WeakPolarHBondContact O-CG1 3.26Å; S245-I249 PolarHBondContact O-N 3.37Å
246E85.4Confident85.4Confident97 Ų9759.6 Ų59.645%0.45333%0.328SS..Hα-helixtrans-58.3-34.5172.4-178.5179.7164.900111.8Q248 I249 K250 I262 L264E246-Q248 PolarHBondContact O-N 2.98Å; E246-I249 WeakPolarHBondContact O-CB 3.3Å; E246-I249 PolarHBondContact O-N 2.96Å; E246-K250 WeakPolarHBondContact O-CB 3.18Å; E246-K250 PolarHBondContact O-N 3.47Å; E246-I262 HydrophobicContact CG-CB 4.49Å; E246-I262 HydrophobicContact CG-CD1 4.24Å; E246-I262 HydrophobicContact CG-CG2 4.38Å; E246-L264 HydrophobicContact CB-CD1 4.11Å; E246-L264 HydrophobicContact CB-CD2 4.48Å; E246-L264 HydrophobicContact CG-CD1 3.86Å
247E87.2Confident85.3Confident152 Ų15258.1 Ų58.171%0.7133%0.327SS*.Hα-helixtrans-60-46.5178-63.2168.7-179.800111.8S245 I249 K250 E251S245-E247 PolarHBondContact O-N 3.42Å; E247-I249 VanDerWaalsContact C-N 3.31Å; E247-I249 PolarHBondContact O-N 3.33Å; E247-K250 PolarHBondContact O-N 3.45Å; E247-E251 WeakPolarHBondContact O-CB 3.41Å; E247-E251 PolarHBondContact O-N 3.33Å
248Q86.4Confident85.3Confident86 Ų8664.8 Ų64.840%0.40236%0.358SS..Hα-helixtrans-63.5-39177.3-71174.6-10.800112T244 S245 E246 Y252 I298T244-Q248 HydrophobicContact CG2-CB 4.22Å; S245-Q248 PolarHBondContact O-N 3.35Å; S245-Q248 WeakPolarHBondContact OG-CG 3.21Å; S245-Q248 PolarHBondContact OG-N 3.48Å; E246-Q248 PolarHBondContact O-N 2.98Å; Q248-Y252 WeakPolarHBondContact O-CB 3.21Å; Q248-Y252 PolarHBondContact O-N 2.78Å; Q248-I298 HydrophobicContact CB-CG2 4.5Å
249I86.6Confident85.4Confident1 Ų165.8 Ų65.81%0.00536%0.362CS..Hα-helixtrans-64.1-49.2175.6-66165.2000108.6L240 T244 S245 E246 E247 E251 Y252 F253 I262 L264 I279L240-I249 HydrophobicContact CD1-CD1 3.73Å; L240-I249 HydrophobicContact CD1-CG1 4.37Å; L240-I249 HydrophobicContact CD2-CD1 4.47Å; L240-I249 HydrophobicContact CD2-CG1 4.37Å; T244-I249 HydrophobicContact CG2-CD1 4.28Å; T244-I249 HydrophobicContact CG2-CG1 3.92Å; S245-I249 WeakPolarHBondContact O-CG1 3.26Å; S245-I249 PolarHBondContact O-N 3.37Å; E246-I249 WeakPolarHBondContact O-CB 3.3Å; E246-I249 PolarHBondContact O-N 2.96Å; E247-I249 VanDerWaalsContact C-N 3.31Å; E247-I249 PolarHBondContact O-N 3.33Å; I249-E251 PolarHBondContact O-N 3.07Å; I249-Y252 PolarHBondContact O-N 3.43Å; I249-F253 HydrophobicContact CB-CD2 4.34Å; I249-F253 HydrophobicContact CG2-CD2 3.52Å; I249-F253 HydrophobicContact CG2-CE2 3.94Å; I249-F253 WeakPolarHBondContact O-CB 3.43Å; I249-F253 WeakPolarHBondContact O-CD2 3.2Å; I249-F253 PolarHBondContact O-N 2.76Å; I249-I262 HydrophobicContact CG2-CG2 4.37Å; I249-L264 HydrophobicContact CD1-CD2 3.91Å; I249-I279 HydrophobicContact CG2-CD1 3.79Å; I249-I279 HydrophobicContact CG2-CG1 4.47Å
250K88.4Confident85.5Confident123 Ų12370 Ų7054%0.53537%0.369SS..Hα-helixtrans-62.6-39.9-179.7-170.9175.5-179.11780112.5E246 E247 G254 I259 I262E246-K250 WeakPolarHBondContact O-CB 3.18Å; E246-K250 PolarHBondContact O-N 3.47Å; E247-K250 PolarHBondContact O-N 3.45Å; K250-G254 WeakPolarHBondContact O-CA 3.37Å; K250-G254 PolarHBondContact O-N 3.25Å; K250-I259 HydrophobicContact CG-CD1 4.3Å; K250-I262 HydrophobicContact CB-CD1 3.69Å; K250-I262 HydrophobicContact CD-CD1 4.43Å; K250-I262 HydrophobicContact CG-CD1 4Å
251E88.8Confident85.5Confident157 Ų15773.8 Ų73.873%0.73439%0.389SS*.Hα-helixtrans-66.9-47.7177.9-174171.4-156.600111.4E247 I249 A255E247-E251 WeakPolarHBondContact O-CB 3.41Å; E247-E251 PolarHBondContact O-N 3.33Å; I249-E251 PolarHBondContact O-N 3.07Å; E251-A255 PolarHBondContact O-N 2.9Å
252Y88.3Confident85.8Confident79 Ų7973.5 Ų73.531%0.3139%0.385SS..Hα-helixtrans-66.9-48.7179.1-174.2-95.5000112.3Q248 I249 A255 F256 H296 I298Q248-Y252 WeakPolarHBondContact O-CB 3.21Å; Q248-Y252 PolarHBondContact O-N 2.78Å; I249-Y252 PolarHBondContact O-N 3.43Å; Y252-A255 WeakPolarHBondContact O-CB 3.31Å; Y252-A255 PolarHBondContact O-N 2.87Å; Y252-F256 AromaticContact CD1-CE2 3.93Å; Y252-F256 HydrophobicContact CD1-CE2 3.93Å; Y252-F256 AromaticContact CE1-CE2 3.57Å; Y252-F256 HydrophobicContact CE1-CE2 3.57Å; Y252-F256 HydrophobicContact CE1-CZ 4.08Å; Y252-F256 AromaticContact CZ-CE2 3.96Å; Y252-F256 WeakPolarHBondContact O-CD2 3.39Å; Y252-F256 VanDerWaalsContact O-CE2 3.3Å; Y252-F256 WeakPolarHBondContact O-CE2 3.28Å; Y252-H296 HydrophobicContact CE1-CB 3.94Å; Y252-H296 AromaticContact CE1-ND1 3.55Å; Y252-H296 AromaticContact CZ-ND1 3.66Å; Y252-H296 PolarHBondContact OH-ND1 2.94Å; Y252-I298 HydrophobicContact CD1-CD1 3.51Å; Y252-I298 HydrophobicContact CD1-CG1 3.71Å; Y252-I298 HydrophobicContact CD2-CG1 4.41Å; Y252-I298 HydrophobicContact CE1-CD1 4.07Å; Y252-I298 HydrophobicContact CE1-CG1 4.03Å; Y252-I298 HydrophobicContact CG-CD1 4.02Å; Y252-I298 HydrophobicContact CG-CG1 3.91Å
253F86.9Confident86.1Confident0 Ų074.4 Ų74.40%038%0.383CS..Hα-helixtrans-77.6-28.1-176.9-76.4-66.9000113.1V237 I249 A255 F256 I259 I279 Y281 L290 I298 I305V237-F253 HydrophobicContact CB-CZ 4.32Å; V237-F253 HydrophobicContact CG1-CE2 3.99Å; V237-F253 HydrophobicContact CG1-CZ 3.69Å; V237-F253 HydrophobicContact CG2-CE1 4.19Å; V237-F253 HydrophobicContact CG2-CE2 4.07Å; V237-F253 HydrophobicContact CG2-CZ 3.65Å; I249-F253 HydrophobicContact CB-CD2 4.34Å; I249-F253 HydrophobicContact CG2-CD2 3.52Å; I249-F253 HydrophobicContact CG2-CE2 3.94Å; I249-F253 WeakPolarHBondContact O-CB 3.43Å; I249-F253 WeakPolarHBondContact O-CD2 3.2Å; I249-F253 PolarHBondContact O-N 2.76Å; F253-A255 PolarHBondContact O-N 2.8Å; F253-F256 PolarHBondContact O-N 3.17Å; F253-F256 VanDerWaalsContact O-N 3.07Å; F253-I259 HydrophobicContact CB-CD1 3.8Å; F253-I279 HydrophobicContact CB-CD1 3.76Å; F253-I279 HydrophobicContact CD1-CD1 3.92Å; F253-I279 HydrophobicContact CD2-CD1 3.22Å; F253-I279 HydrophobicContact CE1-CD1 4.32Å; F253-I279 HydrophobicContact CE2-CD1 3.67Å; F253-I279 HydrophobicContact CG-CD1 3.34Å; F253-I279 HydrophobicContact CZ-CD1 4.21Å; F253-Y281 VanDerWaalsContact CB-OH 3.31Å; F253-Y281 WeakPolarHBondContact CB-OH 3Å; F253-Y281 WeakPolarHBondContact CD1-OH 3.32Å; F253-Y281 PolarHBondContact O-OH 2.89Å; F253-L290 HydrophobicContact CD1-CD1 3.92Å; F253-L290 HydrophobicContact CD1-CD2 4.04Å; F253-L290 HydrophobicContact CE1-CD1 4.14Å; F253-L290 HydrophobicContact CE1-CD2 3.92Å; F253-I298 HydrophobicContact CD2-CD1 3.9Å; F253-I298 HydrophobicContact CE2-CD1 3.13Å; F253-I298 HydrophobicContact CZ-CD1 3.53Å; F253-I305 HydrophobicContact CE1-CD1 3.65Å; F253-I305 HydrophobicContact CZ-CD1 4.14Å
254G85.6Confident86.4Confident37 Ų3770.1 Ų70.138%0.38136%0.36SS..Hα-helixtrans-64.7-25.1173.400000112.8K250 F256 G257K250-G254 WeakPolarHBondContact O-CA 3.37Å; K250-G254 PolarHBondContact O-N 3.25Å; G254-F256 PolarHBondContact O-N 2.8Å; G254-G257 WeakPolarHBondContact CA-O 3.02Å; G254-G257 PolarHBondContact O-N 2.88Å
255A87.4Confident86.3Confident87 Ų8771.8 Ų71.872%0.71937%0.372SS*.THydrogen-bonded Turntrans-66.4-22.2172.900000113.3E251 Y252 F253E251-A255 PolarHBondContact O-N 2.9Å; Y252-A255 WeakPolarHBondContact O-CB 3.31Å; Y252-A255 PolarHBondContact O-N 2.87Å; F253-A255 PolarHBondContact O-N 2.8Å
256F84.5Confident86.2Confident61 Ų6175.1 Ų75.127%0.26839%0.385SS..THydrogen-bonded Turntrans-88.7-26.8179-64.7-90.3000112.8Y252 F253 G254 P286 L290 H296Y252-F256 AromaticContact CD1-CE2 3.93Å; Y252-F256 HydrophobicContact CD1-CE2 3.93Å; Y252-F256 AromaticContact CE1-CE2 3.57Å; Y252-F256 HydrophobicContact CE1-CE2 3.57Å; Y252-F256 HydrophobicContact CE1-CZ 4.08Å; Y252-F256 AromaticContact CZ-CE2 3.96Å; Y252-F256 WeakPolarHBondContact O-CD2 3.39Å; Y252-F256 VanDerWaalsContact O-CE2 3.3Å; Y252-F256 WeakPolarHBondContact O-CE2 3.28Å; F253-F256 PolarHBondContact O-N 3.17Å; F253-F256 VanDerWaalsContact O-N 3.07Å; G254-F256 PolarHBondContact O-N 2.8Å; F256-P286 HydrophobicContact CB-CB 4.21Å; F256-L290 HydrophobicContact CB-CD2 4.49Å; F256-L290 HydrophobicContact CD1-CD2 3.88Å; F256-L290 HydrophobicContact CD1-CG 4.48Å; F256-L290 HydrophobicContact CD2-CD2 3.96Å; F256-L290 HydrophobicContact CE1-CD2 4.05Å; F256-L290 HydrophobicContact CE2-CD2 4.12Å; F256-L290 HydrophobicContact CG-CD2 3.84Å; F256-L290 HydrophobicContact CG-CG 4.4Å; F256-L290 HydrophobicContact CZ-CD2 4.16Å; F256-H296 AromaticContact CZ-CE1 3.78Å
257G86.3Confident85.8Confident19 Ų1973.2 Ų73.220%0.19638%0.378CS..SBendtrans173.3172.9178.600000112.8G254 I259G254-G257 WeakPolarHBondContact CA-O 3.02Å; G254-G257 PolarHBondContact O-N 2.88Å; G257-I259 PolarHBondContact O-N 2.9Å
258E88.6Confident85.2Confident139 Ų13972.2 Ų72.265%0.6538%0.382SS*.  trans-72.7122.4-178.8-175.1177.3-176.200111.5Y281 T282E258-Y281 WeakPolarHBondContact O-CA 3.34Å; E258-Y281 WeakPolarHBondContact O-CD1 3.5Å; E258-T282 HydrophobicContact CG-CG2 4.16Å; E258-T282 PolarHBondContact O-N 3Å; E258-T282 VanDerWaalsContact O-N 3.12Å; E258-T282 PolarHBondContact O-OG1 2.99Å
259I89.4Confident84.6Confident28 Ų2877.1 Ų77.114%0.14440%0.402CS..EExtended strand (participates in β ladder)trans-91.5122.3-178.9-59.9169.4000109.2K250 F253 G257 I262 I279 Y281K250-I259 HydrophobicContact CG-CD1 4.3Å; F253-I259 HydrophobicContact CB-CD1 3.8Å; G257-I259 PolarHBondContact O-N 2.9Å; I259-I262 HydrophobicContact CD1-CD1 4.17Å; I259-I262 HydrophobicContact CG2-CD1 4.09Å; I259-I262 HydrophobicContact CG2-CG1 3.52Å; I259-I279 HydrophobicContact CB-CG2 4.39Å; I259-I279 HydrophobicContact CD1-CG2 4.12Å; I259-I279 HydrophobicContact CG1-CG2 3.9Å; I259-I279 HydrophobicContact CG2-CG2 3.68Å; I259-Y281 HydrophobicContact CG1-CD1 4.03Å; I259-Y281 HydrophobicContact CG1-CE1 3.62Å
260E87.2Confident83.9Confident134 Ų13480.6 Ų80.663%0.62642%0.424SS*.EExtended strand (participates in β ladder)trans-79.6-43.6174.5-171.4-175.8177.200111.3T280 T282E260-T280 HydrophobicContact CB-CG2 4.42Å; E260-T280 WeakPolarHBondContact CB-O 3.43Å; E260-T280 PolarHBondContact N-O 2.92Å; E260-T282 HydrophobicContact CB-CG2 4.16Å
261N85.3Confident83Confident94 Ų9481 Ų8150%0.50343%0.432SS..EExtended strand (participates in β ladder)trans-154.5144.3-176.9-167.39000112.5T280N261-T280 PolarHBondContact N-O 2.71Å; N261-T280 VanDerWaalsContact N-O 3.17Å; N261-T280 PolarHBondContact O-N 2.81Å
262I86.3Confident82.2Confident17 Ų1779.4 Ų79.49%0.08742%0.424CS..EExtended strand (participates in β ladder)trans-122123.2174.2-49.9177.9000108.7E246 I249 K250 I259 L264 F278 I279E246-I262 HydrophobicContact CG-CB 4.49Å; E246-I262 HydrophobicContact CG-CD1 4.24Å; E246-I262 HydrophobicContact CG-CG2 4.38Å; I249-I262 HydrophobicContact CG2-CG2 4.37Å; K250-I262 HydrophobicContact CB-CD1 3.69Å; K250-I262 HydrophobicContact CD-CD1 4.43Å; K250-I262 HydrophobicContact CG-CD1 4Å; I259-I262 HydrophobicContact CD1-CD1 4.17Å; I259-I262 HydrophobicContact CG2-CD1 4.09Å; I259-I262 HydrophobicContact CG2-CG1 3.52Å; I262-L264 HydrophobicContact CB-CD1 4.31Å; I262-L264 HydrophobicContact CG2-CD1 3.45Å; I262-L264 VanDerWaalsContact CG2-CD1 3.45Å; I262-L264 HydrophobicContact CG2-CG 4.43Å; I262-F278 CarbonylContact C-O 3.32Å; I262-F278 WeakPolarHBondContact CA-O 3.38Å; I262-I279 HydrophobicContact CG2-CG1 4.31Å
263E85.1Confident81.4Confident91 Ų9180 Ų8043%0.42543%0.426SS..EExtended strand (participates in β ladder)trans-112.3116-179.7-143.7178.9-161.300108.7K234 P265 C277 F278K234-E263 IonicContact NZ-OE2 3.6Å; K234-E263 PolarHBondContact NZ-OE2 2.91Å; E263-P265 VanDerWaalsContact O-CD 3.3Å; E263-P265 WeakPolarHBondContact O-CD 3.35Å; E263-C277 CarbonylContact O-C 3.53Å; E263-C277 VanDerWaalsContact O-CA 3.32Å; E263-C277 WeakPolarHBondContact O-CA 3.21Å; E263-F278 HydrophobicContact CB-CB 4.12Å; E263-F278 PolarHBondContact N-O 2.68Å; E263-F278 PolarHBondContact O-N 2.78Å
264L85.4Confident80.7Confident38 Ų3886.3 Ų86.320%0.19945%0.45CS..  trans-113.989.1176.5-67.591000110.4E246 I249 I262 M266 C277E246-L264 HydrophobicContact CB-CD1 4.11Å; E246-L264 HydrophobicContact CB-CD2 4.48Å; E246-L264 HydrophobicContact CG-CD1 3.86Å; I249-L264 HydrophobicContact CD1-CD2 3.91Å; I262-L264 HydrophobicContact CB-CD1 4.31Å; I262-L264 HydrophobicContact CG2-CD1 3.45Å; I262-L264 VanDerWaalsContact CG2-CD1 3.45Å; I262-L264 HydrophobicContact CG2-CG 4.43Å; L264-M266 PolarHBondContact O-N 2.89Å; L264-M266 VanDerWaalsContact O-N 3.13Å; L264-C277 HydrophobicContact CD2-CB 4.46Å; L264-C277 HydrophobicContact CG-CB 3.84Å
265P80.4Confident80.4Confident39 Ų3985.4 Ų85.425%0.25344%0.441SS..PPolyproline II helixtrans-64.2116176.5-26.238.7000111.7E263 R274 F276 F278E263-P265 VanDerWaalsContact O-CD 3.3Å; E263-P265 WeakPolarHBondContact O-CD 3.35Å; P265-R274 WeakPolarHBondContact O-CB 3.41Å; P265-R274 WeakPolarHBondContact O-CG 3.47Å; P265-R274 PolarHBondContact O-N 2.81Å; P265-F276 HydrophobicContact CB-CE2 4.01Å; P265-F276 HydrophobicContact CB-CZ 4.22Å; P265-F276 HydrophobicContact CG-CE2 3.78Å; P265-F276 HydrophobicContact CG-CZ 4.46Å; P265-F278 HydrophobicContact CG-CD2 4.31Å; P265-F278 HydrophobicContact CG-CE2 4.27Å
266M80.8Confident80.4Confident98 Ų9883 Ų8348%0.48341%0.414SS..BIsolated β-bridgetrans-85149.3170.1-59-179.6-173.600109.9L264 T268L264-M266 PolarHBondContact O-N 2.89Å; L264-M266 VanDerWaalsContact O-N 3.13Å; M266-T268 PolarHBondContact O-N 2.84Å
267D77.1Confident80.5Confident57 Ų5780.1 Ų80.131%0.30540%0.402SS..PPolyproline II helixtrans-72.6122171.7-162.7-30000108.7K269 N271 E272 R274D267-K269 PolarHBondContact O-N 3.25Å; D267-K269 PolarHBondContact OD1-N 3.23Å; D267-K269 VanDerWaalsContact OD1-N 3.09Å; D267-N271 VanDerWaalsContact O-CA 3.26Å; D267-N271 WeakPolarHBondContact O-CA 3.49Å; D267-N271 PolarHBondContact O-N 2.86Å; D267-E272 PolarHBondContact N-O 3.43Å; D267-R274 HydrophobicContact CB-CG 3.94Å
268T73.6Confident80.7Confident131 Ų13181 Ų8180%0.80440%0.4SS*.THydrogen-bonded Turntrans-69-12.2-177.555.80000113M266M266-T268 PolarHBondContact O-N 2.84Å
269K73.9Confident80.7Confident189 Ų18974.4 Ų74.482%0.82237%0.369SS*.THydrogen-bonded Turntrans-94.8-39.5-178.4-63.4-177.2-179.8-177.20113.6D267D267-K269 PolarHBondContact O-N 3.25Å; D267-K269 PolarHBondContact OD1-N 3.23Å; D267-K269 VanDerWaalsContact OD1-N 3.09Å
270T73Confident80.6Confident75 Ų7574.5 Ų74.546%0.4637%0.371SS..THydrogen-bonded Turntrans-108.2-6.9-177.460.70000112.8E272T270-E272 WeakPolarHBondContact CB-OE2 3.33Å; T270-E272 PolarHBondContact O-N 3.04Å; T270-E272 VanDerWaalsContact O-N 3.09Å; T270-E272 WeakPolarHBondContact OG1-CB 3.13Å; T270-E272 PolarHBondContact OG1-N 3.41Å; T270-E272 PolarHBondContact OG1-OE2 2.95Å
271N69.4Low80.7Confident130 Ų13068.1 Ų68.170%0.69534%0.341SS*.  trans5417.3-168.6-94.7-53.5000113.4D267D267-N271 VanDerWaalsContact O-CA 3.26Å; D267-N271 WeakPolarHBondContact O-CA 3.49Å; D267-N271 PolarHBondContact O-N 2.86Å
272E71.8Confident80.7Confident125 Ų12565.4 Ų65.458%0.58433%0.328SS*.  trans-87.7146176.3-65.4171.8143.100109.6D267 T270 R274D267-E272 PolarHBondContact N-O 3.43Å; T270-E272 WeakPolarHBondContact CB-OE2 3.33Å; T270-E272 PolarHBondContact O-N 3.04Å; T270-E272 VanDerWaalsContact O-N 3.09Å; T270-E272 WeakPolarHBondContact OG1-CB 3.13Å; T270-E272 PolarHBondContact OG1-N 3.41Å; T270-E272 PolarHBondContact OG1-OE2 2.95Å; E272-R274 PolarHBondContact O-N 3.04Å
273R72.1Confident80.6Confident90 Ų9069 Ų6934%0.3435%0.348SS..BIsolated β-bridgetrans-65.9131.3174.6-61.9-175-179.2146.4-11.2108.2P242 T244 G275P242-R273 HydrophobicContact CB-CB 4.41Å; P242-R273 VanDerWaalsContact O-CD 3.32Å; P242-R273 WeakPolarHBondContact O-CD 3.43Å; P242-R273 PolarHBondContact O-NH1 3.5Å; T244-R273 PolarHBondContact O-NH1 3.32Å; R273-G275 PolarHBondContact O-N 3.02Å
274R71.3Confident80.5Confident133 Ų13370 Ų7050%0.50235%0.352SS..  trans-69.512.1-178.8-65.9179.566.7-169.5-4.2114.2P265 D267 E272 F276P265-R274 WeakPolarHBondContact O-CB 3.41Å; P265-R274 WeakPolarHBondContact O-CG 3.47Å; P265-R274 PolarHBondContact O-N 2.81Å; D267-R274 HydrophobicContact CB-CG 3.94Å; E272-R274 PolarHBondContact O-N 3.04Å; R274-F276 HydrophobicContact CB-CD1 3.69Å; R274-F276 HydrophobicContact CB-CE1 3.27Å; R274-F276 HydrophobicContact CB-CZ 3.88Å; R274-F276 HydrophobicContact CG-CE1 4.2Å; R274-F276 WeakPolarHBondContact O-CD1 3.22Å; R274-F276 PolarHBondContact O-N 2.83Å
275G79.8Confident80.5Confident19 Ų1974.3 Ų74.320%0.19637%0.371CS..SBendtrans64.321.4179.800000114G238 G239 L240 R273G238-G275 CarbonylContact C-O 3.53Å; G239-G275 PolarHBondContact N-O 2.87Å; L240-G275 PolarHBondContact N-O 3.4Å; L240-G275 WeakPolarHBondContact O-CA 3.36Å; R273-G275 PolarHBondContact O-N 3.02Å
276F86.8Confident80.6Confident37 Ų3772.6 Ų72.616%0.16236%0.36CS..EExtended strand (participates in β ladder)trans-144.6152.6173.666.1-99.1000111.4F236 V237 P265 R274 F278F236-F276 HydrophobicContact CD2-CD2 4.4Å; F236-F276 HydrophobicContact CE2-CB 3.62Å; F236-F276 HydrophobicContact CE2-CD1 4.43Å; F236-F276 AromaticContact CE2-CD2 3.73Å; F236-F276 HydrophobicContact CE2-CD2 3.73Å; F236-F276 AromaticContact CE2-CG 3.69Å; F236-F276 HydrophobicContact CE2-CG 3.69Å; F236-F276 HydrophobicContact CZ-CB 3.72Å; F236-F276 HydrophobicContact CZ-CG 4.13Å; V237-F276 CarbonylContact O-C 3.45Å; V237-F276 WeakPolarHBondContact O-CA 3.47Å; V237-F276 VanDerWaalsContact O-CB 3.3Å; V237-F276 WeakPolarHBondContact O-CB 3.44Å; P265-F276 HydrophobicContact CB-CE2 4.01Å; P265-F276 HydrophobicContact CB-CZ 4.22Å; P265-F276 HydrophobicContact CG-CE2 3.78Å; P265-F276 HydrophobicContact CG-CZ 4.46Å; R274-F276 HydrophobicContact CB-CD1 3.69Å; R274-F276 HydrophobicContact CB-CE1 3.27Å; R274-F276 HydrophobicContact CB-CZ 3.88Å; R274-F276 HydrophobicContact CG-CE1 4.2Å; R274-F276 WeakPolarHBondContact O-CD1 3.22Å; R274-F276 PolarHBondContact O-N 2.83Å; F276-F278 HydrophobicContact CD2-CD2 4.47Å; F276-F278 AromaticContact CD2-CE2 3.97Å; F276-F278 HydrophobicContact CD2-CE2 3.97Å; F276-F278 HydrophobicContact CE2-CD2 4.47Å; F276-F278 AromaticContact CE2-CE2 3.71Å; F276-F278 HydrophobicContact CE2-CE2 3.71Å; F276-F278 HydrophobicContact CE2-CZ 4.34Å
277C87.6Confident80.8Confident0 Ų068 Ų680%034%0.337CS..EExtended strand (participates in β ladder)trans-132164.2170.476.10000110.7V237 L240 E263 L264V237-C277 PolarHBondContact N-O 2.79Å; V237-C277 PolarHBondContact O-N 3.23Å; L240-C277 HydrophobicContact CD1-CB 3.86Å; L240-C277 WeakPolarHBondContact CD1-SG 3.25Å; E263-C277 CarbonylContact O-C 3.53Å; E263-C277 VanDerWaalsContact O-CA 3.32Å; E263-C277 WeakPolarHBondContact O-CA 3.21Å; L264-C277 HydrophobicContact CD2-CB 4.46Å; L264-C277 HydrophobicContact CG-CB 3.84Å
278F89.1Confident81.1Confident38 Ų3871.9 Ų71.917%0.16735%0.352CS..EExtended strand (participates in β ladder)trans-116.4135.9166.9-61.6-88.1000109.9K234 V235 F236 I262 E263 P265 F276 A308K234-F278 HydrophobicContact CD-CB 4.32Å; K234-F278 HydrophobicContact CD-CD1 4.41Å; K234-F278 VanDerWaalsContact CE-CG 3.48Å; K234-F278 HydrophobicContact CG-CB 4.18Å; K234-F278 HydrophobicContact CG-CD1 4.37Å; V235-F278 CarbonylContact O-C 3.54Å; V235-F278 VanDerWaalsContact O-CA 3.25Å; V235-F278 WeakPolarHBondContact O-CA 3.47Å; F236-F278 HydrophobicContact CB-CD1 4.15Å; F236-F278 HydrophobicContact CB-CE1 4.04Å; F236-F278 HydrophobicContact CD2-CD1 4.13Å; F236-F278 AromaticContact CD2-CE1 3.55Å; F236-F278 HydrophobicContact CD2-CE1 3.55Å; F236-F278 AromaticContact CD2-CZ 3.79Å; F236-F278 HydrophobicContact CD2-CZ 3.79Å; F236-F278 HydrophobicContact CE2-CZ 4.36Å; F236-F278 HydrophobicContact CG-CE1 4.29Å; I262-F278 CarbonylContact C-O 3.32Å; I262-F278 WeakPolarHBondContact CA-O 3.38Å; E263-F278 HydrophobicContact CB-CB 4.12Å; E263-F278 PolarHBondContact N-O 2.68Å; E263-F278 PolarHBondContact O-N 2.78Å; P265-F278 HydrophobicContact CG-CD2 4.31Å; P265-F278 HydrophobicContact CG-CE2 4.27Å; F276-F278 HydrophobicContact CD2-CD2 4.47Å; F276-F278 AromaticContact CD2-CE2 3.97Å; F276-F278 HydrophobicContact CD2-CE2 3.97Å; F276-F278 HydrophobicContact CE2-CD2 4.47Å; F276-F278 AromaticContact CE2-CE2 3.71Å; F276-F278 HydrophobicContact CE2-CE2 3.71Å; F276-F278 HydrophobicContact CE2-CZ 4.34Å; F278-A308 HydrophobicContact CD1-CB 3.94Å; F278-A308 HydrophobicContact CE1-CB 4.16Å
279I89.1Confident81.6Confident0 Ų070.6 Ų70.60%034%0.335CS..EExtended strand (participates in β ladder)trans-121.2122.3179.5-55.4178.4000107.5K234 V235 V237 I249 F253 I259 I262 Y281K234-I279 CarbonylContact C-O 3.59Å; K234-I279 VanDerWaalsContact CA-O 3.28Å; K234-I279 WeakPolarHBondContact CA-O 3.36Å; V235-I279 PolarHBondContact N-O 3.29Å; V235-I279 PolarHBondContact O-N 3.49Å; V237-I279 HydrophobicContact CG2-CD1 3.91Å; V237-I279 HydrophobicContact CG2-CG1 4.31Å; I249-I279 HydrophobicContact CG2-CD1 3.79Å; I249-I279 HydrophobicContact CG2-CG1 4.47Å; F253-I279 HydrophobicContact CB-CD1 3.76Å; F253-I279 HydrophobicContact CD1-CD1 3.92Å; F253-I279 HydrophobicContact CD2-CD1 3.22Å; F253-I279 HydrophobicContact CE1-CD1 4.32Å; F253-I279 HydrophobicContact CE2-CD1 3.67Å; F253-I279 HydrophobicContact CG-CD1 3.34Å; F253-I279 HydrophobicContact CZ-CD1 4.21Å; I259-I279 HydrophobicContact CB-CG2 4.39Å; I259-I279 HydrophobicContact CD1-CG2 4.12Å; I259-I279 HydrophobicContact CG1-CG2 3.9Å; I259-I279 HydrophobicContact CG2-CG2 3.68Å; I262-I279 HydrophobicContact CG2-CG1 4.31Å; I279-Y281 HydrophobicContact CB-CE2 4.14Å; I279-Y281 HydrophobicContact CG2-CD2 4.07Å; I279-Y281 HydrophobicContact CG2-CE1 4.3Å; I279-Y281 HydrophobicContact CG2-CE2 3.57Å
280T87.8Confident82.1Confident29 Ų2961.6 Ų61.618%0.17830%0.296CS..EExtended strand (participates in β ladder)trans-99.6121172.1-53.20000108.2K233 E260 N261K233-T280 HydrophobicContact CB-CG2 4.46Å; K233-T280 WeakPolarHBondContact O-CA 3.24Å; E260-T280 HydrophobicContact CB-CG2 4.42Å; E260-T280 WeakPolarHBondContact CB-O 3.43Å; E260-T280 PolarHBondContact N-O 2.92Å; N261-T280 PolarHBondContact N-O 2.71Å; N261-T280 VanDerWaalsContact N-O 3.17Å; N261-T280 PolarHBondContact O-N 2.81Å
281Y89.1Confident82.5Confident0 Ų060.7 Ų60.70%029%0.288CS..EExtended strand (participates in β ladder)trans-94.5154.7173.9-69-86.6000111.2K233 V235 F253 E258 I259 I279 D283 P286 V287 L290K233-Y281 WeakPolarHBondContact CB-O 3.35Å; K233-Y281 PolarHBondContact O-N 3.38Å; V235-Y281 HydrophobicContact CB-CE2 4.45Å; V235-Y281 HydrophobicContact CG2-CD2 4.03Å; V235-Y281 HydrophobicContact CG2-CE2 3.88Å; F253-Y281 VanDerWaalsContact CB-OH 3.31Å; F253-Y281 WeakPolarHBondContact CB-OH 3Å; F253-Y281 WeakPolarHBondContact CD1-OH 3.32Å; F253-Y281 PolarHBondContact O-OH 2.89Å; E258-Y281 WeakPolarHBondContact O-CA 3.34Å; E258-Y281 WeakPolarHBondContact O-CD1 3.5Å; I259-Y281 HydrophobicContact CG1-CD1 4.03Å; I259-Y281 HydrophobicContact CG1-CE1 3.62Å; I279-Y281 HydrophobicContact CB-CE2 4.14Å; I279-Y281 HydrophobicContact CG2-CD2 4.07Å; I279-Y281 HydrophobicContact CG2-CE1 4.3Å; I279-Y281 HydrophobicContact CG2-CE2 3.57Å; Y281-D283 VanDerWaalsContact CB-O 3.24Å; Y281-D283 WeakPolarHBondContact CB-O 3.44Å; Y281-P286 HydrophobicContact CD1-CB 3.64Å; Y281-P286 HydrophobicContact CD1-CG 3.4Å; Y281-P286 VanDerWaalsContact CD1-CG 3.4Å; Y281-P286 HydrophobicContact CD2-CB 4.34Å; Y281-P286 HydrophobicContact CD2-CG 4.2Å; Y281-P286 HydrophobicContact CE1-CB 3.68Å; Y281-P286 HydrophobicContact CE1-CG 4.01Å; Y281-P286 HydrophobicContact CE2-CB 4.38Å; Y281-P286 HydrophobicContact CG-CB 3.98Å; Y281-P286 HydrophobicContact CG-CG 3.51Å; Y281-V287 HydrophobicContact CD2-CG2 3.83Å; Y281-V287 HydrophobicContact CG-CG2 4.47Å; Y281-L290 HydrophobicContact CE2-CD1 3.83Å; Y281-L290 VanDerWaalsContact OH-CD1 3.26Å; Y281-L290 WeakPolarHBondContact OH-CD1 3.3Å
282T85.8Confident83.2Confident37 Ų3761.4 Ų61.423%0.22729%0.287CS..SBendtrans-65.6-43.7168.5510000110.7K233 E258 E260K233-T282 PolarHBondContact NZ-O 3.36Å; E258-T282 HydrophobicContact CG-CG2 4.16Å; E258-T282 PolarHBondContact O-N 3Å; E258-T282 VanDerWaalsContact O-N 3.12Å; E258-T282 PolarHBondContact O-OG1 2.99Å; E260-T282 HydrophobicContact CB-CG2 4.16Å
283D84.3Confident83.7Confident93 Ų9358.5 Ų58.550%0.49728%0.28SS..SBendtrans-105.7157.3-176.4-64.1-44000113.7Y281 P286Y281-D283 VanDerWaalsContact CB-O 3.24Å; Y281-D283 WeakPolarHBondContact CB-O 3.44Å; D283-P286 HydrophobicContact CB-CG 4.48Å; D283-P286 WeakPolarHBondContact O-CD 3.48Å; D283-P286 WeakPolarHBondContact O-CG 3.4Å
284E83.1Confident84Confident112 Ų11261.7 Ų61.752%0.52329%0.292SS..SBendtrans-88.2-16.9176.460.5174.6-164.400114.1P231 V287 K288P231-E284 HydrophobicContact CG-CB 4.09Å; P231-E284 WeakPolarHBondContact CG-OE2 3.24Å; E284-V287 WeakPolarHBondContact O-CB 3.09Å; E284-V287 PolarHBondContact O-N 3.06Å; E284-K288 PolarHBondContact O-N 2.75Å; E284-K288 VanDerWaalsContact O-N 3.1Å
285E84.1Confident84.7Confident129 Ų12961.8 Ų61.860%0.60329%0.294SS*.Hα-helixtrans-57.1-48.8176.5-63.5-154.9166.900114.5V287 K288 K289E285-V287 VanDerWaalsContact C-N 3.26Å; E285-V287 PolarHBondContact O-N 2.83Å; E285-K288 PolarHBondContact O-N 3.25Å; E285-K289 PolarHBondContact O-N 3.06Å; E285-K289 VanDerWaalsContact O-N 3.14Å
286P84.1Confident84.9Confident3 Ų361.6 Ų61.62%0.01929%0.288CS..Hα-helixtrans-58.3-41.2176.518.9-31.7000111.5F256 Y281 D283 K288 K289 L290F256-P286 HydrophobicContact CB-CB 4.21Å; Y281-P286 HydrophobicContact CD1-CB 3.64Å; Y281-P286 HydrophobicContact CD1-CG 3.4Å; Y281-P286 VanDerWaalsContact CD1-CG 3.4Å; Y281-P286 HydrophobicContact CD2-CB 4.34Å; Y281-P286 HydrophobicContact CD2-CG 4.2Å; Y281-P286 HydrophobicContact CE1-CB 3.68Å; Y281-P286 HydrophobicContact CE1-CG 4.01Å; Y281-P286 HydrophobicContact CE2-CB 4.38Å; Y281-P286 HydrophobicContact CG-CB 3.98Å; Y281-P286 HydrophobicContact CG-CG 3.51Å; D283-P286 HydrophobicContact CB-CG 4.48Å; D283-P286 WeakPolarHBondContact O-CD 3.48Å; D283-P286 WeakPolarHBondContact O-CG 3.4Å; P286-K288 VanDerWaalsContact C-N 3.33Å; P286-K288 PolarHBondContact O-N 3.28Å; P286-K289 PolarHBondContact O-N 3.32Å; P286-L290 WeakPolarHBondContact O-CB 3.46Å; P286-L290 WeakPolarHBondContact O-CG 3.09Å; P286-L290 PolarHBondContact O-N 3.49Å
287V83.8Confident84.6Confident0 Ų066.6 Ų66.60%031%0.312CS..Hα-helixtrans-59.3-45178.7-179.80000111.1P231 V235 Y281 E284 E285 L290 L291P231-V287 HydrophobicContact CB-CG1 4.36Å; V235-V287 HydrophobicContact CG2-CB 4.01Å; V235-V287 HydrophobicContact CG2-CG1 3.76Å; V235-V287 HydrophobicContact CG2-CG2 3.54Å; Y281-V287 HydrophobicContact CD2-CG2 3.83Å; Y281-V287 HydrophobicContact CG-CG2 4.47Å; E284-V287 WeakPolarHBondContact O-CB 3.09Å; E284-V287 PolarHBondContact O-N 3.06Å; E285-V287 VanDerWaalsContact C-N 3.26Å; E285-V287 PolarHBondContact O-N 2.83Å; V287-L290 PolarHBondContact O-N 3.01Å; V287-L291 HydrophobicContact CG1-CD1 3.89Å; V287-L291 HydrophobicContact CG1-CG 4.37Å; V287-L291 WeakPolarHBondContact O-CG 3.46Å; V287-L291 PolarHBondContact O-N 3.45Å
288K83.4Confident84.2Confident140 Ų14066.9 Ų66.961%0.60931%0.313SS*.Hα-helixtrans-64-45.3-179.7-169.3178.6176.4-173.30112E284 E285 P286 L290 L291 E292E284-K288 PolarHBondContact O-N 2.75Å; E284-K288 VanDerWaalsContact O-N 3.1Å; E285-K288 PolarHBondContact O-N 3.25Å; P286-K288 VanDerWaalsContact C-N 3.33Å; P286-K288 PolarHBondContact O-N 3.28Å; K288-L290 VanDerWaalsContact C-N 3.33Å; K288-L290 PolarHBondContact O-N 3.43Å; K288-L291 PolarHBondContact O-N 2.88Å; K288-L291 VanDerWaalsContact O-N 3.16Å; K288-E292 PolarHBondContact O-N 2.84Å; K288-E292 VanDerWaalsContact O-N 3.14Å
289K84Confident83.5Confident104 Ų10467.9 Ų67.945%0.45233%0.334SS..Hα-helixtrans-61.3-40.7176.7-69.3173.7-175.9165.30111.9E285 P286 L291 E292 S293E285-K289 PolarHBondContact O-N 3.06Å; E285-K289 VanDerWaalsContact O-N 3.14Å; P286-K289 PolarHBondContact O-N 3.32Å; K289-L291 VanDerWaalsContact C-N 3.32Å; K289-L291 PolarHBondContact O-N 3.43Å; K289-E292 WeakPolarHBondContact O-CB 3.46Å; K289-E292 PolarHBondContact O-N 3.06Å; K289-S293 PolarHBondContact O-N 3.49Å
290L84.1Confident82.6Confident0 Ų072.4 Ų72.40%037%0.366CS..Hα-helixtrans-70-27.5176.8-68172.9000113.1F253 F256 Y281 P286 V287 K288 S293 I305F253-L290 HydrophobicContact CD1-CD1 3.92Å; F253-L290 HydrophobicContact CD1-CD2 4.04Å; F253-L290 HydrophobicContact CE1-CD1 4.14Å; F253-L290 HydrophobicContact CE1-CD2 3.92Å; F256-L290 HydrophobicContact CB-CD2 4.49Å; F256-L290 HydrophobicContact CD1-CD2 3.88Å; F256-L290 HydrophobicContact CD1-CG 4.48Å; F256-L290 HydrophobicContact CD2-CD2 3.96Å; F256-L290 HydrophobicContact CE1-CD2 4.05Å; F256-L290 HydrophobicContact CE2-CD2 4.12Å; F256-L290 HydrophobicContact CG-CD2 3.84Å; F256-L290 HydrophobicContact CG-CG 4.4Å; F256-L290 HydrophobicContact CZ-CD2 4.16Å; Y281-L290 HydrophobicContact CE2-CD1 3.83Å; Y281-L290 VanDerWaalsContact OH-CD1 3.26Å; Y281-L290 WeakPolarHBondContact OH-CD1 3.3Å; P286-L290 WeakPolarHBondContact O-CB 3.46Å; P286-L290 WeakPolarHBondContact O-CG 3.09Å; P286-L290 PolarHBondContact O-N 3.49Å; V287-L290 PolarHBondContact O-N 3.01Å; K288-L290 VanDerWaalsContact C-N 3.33Å; K288-L290 PolarHBondContact O-N 3.43Å; L290-S293 CarbonylContact O-C 3.58Å; L290-I305 HydrophobicContact CB-CD1 3.78Å; L290-I305 HydrophobicContact CB-CG2 4.1Å; L290-I305 HydrophobicContact CD1-CD1 4.35Å; L290-I305 HydrophobicContact CD2-CD1 3.63Å; L290-I305 HydrophobicContact CG-CD1 4.11Å
291L82.8Confident82Confident55 Ų5571.5 Ų71.529%0.28836%0.363SS..Hα-helixtrans-77.4-25.7175.1-71.3170.9000113.1V287 K288 K289 S293 V307V287-L291 HydrophobicContact CG1-CD1 3.89Å; V287-L291 HydrophobicContact CG1-CG 4.37Å; V287-L291 WeakPolarHBondContact O-CG 3.46Å; V287-L291 PolarHBondContact O-N 3.45Å; K288-L291 PolarHBondContact O-N 2.88Å; K288-L291 VanDerWaalsContact O-N 3.16Å; K289-L291 VanDerWaalsContact C-N 3.32Å; K289-L291 PolarHBondContact O-N 3.43Å; L291-S293 VanDerWaalsContact C-N 3.34Å; L291-V307 HydrophobicContact CD1-CG2 3.81Å; L291-V307 HydrophobicContact CD2-CG2 3.73Å; L291-V307 HydrophobicContact CG-CG2 4.45Å
292E83Confident81.8Confident145 Ų14577.9 Ų77.968%0.67839%0.39SS*.Hα-helixtrans-65.2-41.8170.8-70173.2-171.600110.6K288 K289K288-E292 PolarHBondContact O-N 2.84Å; K288-E292 VanDerWaalsContact O-N 3.14Å; K289-E292 WeakPolarHBondContact O-CB 3.46Å; K289-E292 PolarHBondContact O-N 3.06Å
293S82.7Confident81.8Confident64 Ų6476.1 Ų76.145%0.44838%0.38SS..SBendtrans-101.383.3176.9-64.60000111.5K289 L290 L291 Y295 H296K289-S293 PolarHBondContact O-N 3.49Å; L290-S293 CarbonylContact O-C 3.58Å; L291-S293 VanDerWaalsContact C-N 3.34Å; S293-Y295 PolarHBondContact O-N 3.3Å; S293-H296 WeakPolarHBondContact CB-NE2 3.32Å; S293-H296 PolarHBondContact O-CD2 3.33Å; S293-H296 PolarHBondContact O-NE2 2.83Å
294R79.3Confident82Confident157 Ų15774.2 Ų74.259%0.59237%0.368SS*.  trans-59.2-21.4-176.3-67-169-173.1-132.93.1115.6E304 I305R294-E304 CarbonylContact O-C 3.57Å; R294-E304 WeakPolarHBondContact O-CA 3.3Å; R294-I305 PolarHBondContact O-N 3.44Å
295Y85.3Confident82.2Confident136 Ų13668.9 Ų68.953%0.53334%0.343SS..EExtended strand (participates in β ladder)trans-122.4126.9-178.6-62.4-74.2000110.5S293 K302 C303 E304S293-Y295 PolarHBondContact O-N 3.3Å; Y295-K302 HydrophobicContact CD1-CD 4.46Å; Y295-K302 VanDerWaalsContact CD1-CE 3.44Å; Y295-C303 WeakPolarHBondContact CA-O 3.38Å; Y295-E304 HydrophobicContact CD1-CB 4.27Å; Y295-E304 HydrophobicContact CD1-CG 4.37Å; Y295-E304 HydrophobicContact CE1-CB 4.17Å; Y295-E304 HydrophobicContact CE1-CG 4Å
296H83.9Confident82.3Confident15 Ų1567 Ų677%0.06933%0.332CS..EExtended strand (participates in β ladder)trans-123.1161.4173.8-70.3-100.8000109.2Y252 F256 S293 C303 I305Y252-H296 HydrophobicContact CE1-CB 3.94Å; Y252-H296 AromaticContact CE1-ND1 3.55Å; Y252-H296 AromaticContact CZ-ND1 3.66Å; Y252-H296 PolarHBondContact OH-ND1 2.94Å; F256-H296 AromaticContact CZ-CE1 3.78Å; S293-H296 WeakPolarHBondContact CB-NE2 3.32Å; S293-H296 PolarHBondContact O-CD2 3.33Å; S293-H296 PolarHBondContact O-NE2 2.83Å; H296-C303 VanDerWaalsContact C-SG 3.54Å; H296-C303 VanDerWaalsContact CB-SG 3.5Å; H296-C303 PolarHBondContact N-O 3.32Å; H296-C303 PolarHBondContact O-N 2.8Å; H296-C303 PolarHBondContact O-SG 3.12Å; H296-I305 WeakPolarHBondContact CD2-CD1 3.48Å; H296-I305 WeakPolarHBondContact NE2-CD1 3.27Å
297Q80.9Confident82.2Confident141 Ų14170.2 Ų70.266%0.65935%0.352SS*.EExtended strand (participates in β ladder)trans-123.1120.3179-168161.813.100108.3
298I79.3Confident81.9Confident6 Ų670.6 Ų70.63%0.03136%0.355CS..EExtended strand (participates in β ladder)trans-130.7117.8-176.7-56.5177.5000107.3L240 T244 Q248 Y252 F253 S300 G301L240-I298 HydrophobicContact CD2-CB 4.5Å; L240-I298 HydrophobicContact CD2-CD1 4.25Å; T244-I298 HydrophobicContact CG2-CG2 3.78Å; Q248-I298 HydrophobicContact CB-CG2 4.5Å; Y252-I298 HydrophobicContact CD1-CD1 3.51Å; Y252-I298 HydrophobicContact CD1-CG1 3.71Å; Y252-I298 HydrophobicContact CD2-CG1 4.41Å; Y252-I298 HydrophobicContact CE1-CD1 4.07Å; Y252-I298 HydrophobicContact CE1-CG1 4.03Å; Y252-I298 HydrophobicContact CG-CD1 4.02Å; Y252-I298 HydrophobicContact CG-CG1 3.91Å; F253-I298 HydrophobicContact CD2-CD1 3.9Å; F253-I298 HydrophobicContact CE2-CD1 3.13Å; F253-I298 HydrophobicContact CZ-CD1 3.53Å; I298-S300 PolarHBondContact O-N 3.33Å; I298-G301 PolarHBondContact N-O 3.07Å; I298-G301 PolarHBondContact O-N 3.48Å; I298-G301 VanDerWaalsContact O-N 3.12Å
299G73.4Confident81.4Confident59 Ų5968.9 Ų68.961%0.60835%0.349SS*.THydrogen-bonded Turntrans58.7-125.2-172.300000111.8
300S71.5Confident80.6Confident95 Ų9568 Ų6866%0.66435%0.354SS*.THydrogen-bonded Turntrans-91.3-6.2177.157.50000114.1I298I298-S300 PolarHBondContact O-N 3.33Å
301G74.4Confident79.6Confident11 Ų1176.4 Ų76.411%0.11339%0.391CS..EExtended strand (participates in β ladder)trans-102.3142.5-174.900000113.4I298I298-G301 PolarHBondContact N-O 3.07Å; I298-G301 PolarHBondContact O-N 3.48Å; I298-G301 VanDerWaalsContact O-N 3.12Å
302K84.3Confident78.5Confident133 Ų13380.7 Ų80.758%0.57841%0.409SS*.EExtended strand (participates in β ladder)trans-91.8112.7168.1-177.5178.2-178.9178.50108.9G239 Y295G239-K302 CarbonylContact O-C 3.53Å; Y295-K302 HydrophobicContact CD1-CD 4.46Å; Y295-K302 VanDerWaalsContact CD1-CE 3.44Å
303C87.3Confident77.4Confident1 Ų176.9 Ų76.91%0.00740%0.396CS..EExtended strand (participates in β ladder)trans-95.9146.8178.859.30000112.6V237 G238 L240 Y295 H296V237-C303 HydrophobicContact CG1-CB 3.71Å; G238-C303 CarbonylContact O-C 3.4Å; G238-C303 WeakPolarHBondContact O-CA 3.18Å; G238-C303 WeakPolarHBondContact O-CB 3.13Å; L240-C303 HydrophobicContact CD2-CB 3.85Å; L240-C303 HydrophobicContact CG-CB 4.29Å; Y295-C303 WeakPolarHBondContact CA-O 3.38Å; H296-C303 VanDerWaalsContact C-SG 3.54Å; H296-C303 VanDerWaalsContact CB-SG 3.5Å; H296-C303 PolarHBondContact N-O 3.32Å; H296-C303 PolarHBondContact O-N 2.8Å; H296-C303 PolarHBondContact O-SG 3.12Å
304E87.7Confident76.4Confident52 Ų5279.6 Ų79.624%0.24340%0.397CS..EExtended strand (participates in β ladder)trans-111.5132.4176.1-174.7-171.3-166.700109.4V237 G238 R294 Y295 K306V237-E304 CarbonylContact C-O 3.5Å; V237-E304 WeakPolarHBondContact CA-O 3.32Å; G238-E304 PolarHBondContact N-O 3.5Å; G238-E304 PolarHBondContact O-N 3.49Å; R294-E304 CarbonylContact O-C 3.57Å; R294-E304 WeakPolarHBondContact O-CA 3.3Å; Y295-E304 HydrophobicContact CD1-CB 4.27Å; Y295-E304 HydrophobicContact CD1-CG 4.37Å; Y295-E304 HydrophobicContact CE1-CB 4.17Å; Y295-E304 HydrophobicContact CE1-CG 4Å; E304-K306 VanDerWaalsContact CD-CE 3.43Å; E304-K306 WeakPolarHBondContact OE1-CE 3.5Å; E304-K306 IonicContact OE1-NZ 2.68Å; E304-K306 PolarHBondContact OE1-NZ 3.1Å; E304-K306 WeakPolarHBondContact OE2-CE 3.32Å; E304-K306 IonicContact OE2-NZ 2.61Å; E304-K306 PolarHBondContact OE2-NZ 3.25Å
305I88.1Confident75.7Confident1 Ų180.5 Ų80.51%0.00540%0.401CS..EExtended strand (participates in β ladder)trans-104.2128.7-179.6-58.5-173.7000111V235 F236 V237 F253 L290 R294 H296V235-I305 HydrophobicContact CG1-CG2 3.25Å; F236-I305 WeakPolarHBondContact O-CA 3.49Å; V237-I305 HydrophobicContact CG2-CG1 4.48Å; F253-I305 HydrophobicContact CE1-CD1 3.65Å; F253-I305 HydrophobicContact CZ-CD1 4.14Å; L290-I305 HydrophobicContact CB-CD1 3.78Å; L290-I305 HydrophobicContact CB-CG2 4.1Å; L290-I305 HydrophobicContact CD1-CD1 4.35Å; L290-I305 HydrophobicContact CD2-CD1 3.63Å; L290-I305 HydrophobicContact CG-CD1 4.11Å; R294-I305 PolarHBondContact O-N 3.44Å; H296-I305 WeakPolarHBondContact CD2-CD1 3.48Å; H296-I305 WeakPolarHBondContact NE2-CD1 3.27Å
306K85.5Confident74.5Confident88 Ų8879.9 Ų79.938%0.38340%0.402SS..EExtended strand (participates in β ladder)trans-133.1154.6175.4-71169.9166.1144.20110.6F236 E304 A308F236-K306 HydrophobicContact CB-CB 4.39Å; F236-K306 HydrophobicContact CD1-CB 4.02Å; F236-K306 HydrophobicContact CD1-CD 4.41Å; F236-K306 PolarHBondContact N-O 2.79Å; F236-K306 PolarHBondContact O-N 2.95Å; E304-K306 VanDerWaalsContact CD-CE 3.43Å; E304-K306 WeakPolarHBondContact OE1-CE 3.5Å; E304-K306 IonicContact OE1-NZ 2.68Å; E304-K306 PolarHBondContact OE1-NZ 3.1Å; E304-K306 WeakPolarHBondContact OE2-CE 3.32Å; E304-K306 IonicContact OE2-NZ 2.61Å; E304-K306 PolarHBondContact OE2-NZ 3.25Å; K306-A308 PolarHBondContact O-N 3.31Å
307V82.4Confident73.3Confident71 Ų7183.8 Ų83.843%0.4342%0.421SS..EExtended strand (participates in β ladder)trans-54.8120.8165.3169.40000108.5P232 L291 Q309P232-V307 VanDerWaalsContact CD-CG1 3.49Å; P232-V307 HydrophobicContact CG-CB 4.24Å; P232-V307 HydrophobicContact CG-CG1 3.34Å; L291-V307 HydrophobicContact CD1-CG2 3.81Å; L291-V307 HydrophobicContact CD2-CG2 3.73Å; L291-V307 HydrophobicContact CG-CG2 4.45Å; V307-Q309 PolarHBondContact O-N 2.84Å
308A76.8Confident72.1Confident8 Ų881.8 Ų81.87%0.06641%0.411CS..PPolyproline II helixtrans-66.9123.7178.800000109.6K234 F236 F278 K306K234-A308 HydrophobicContact CB-CB 3.9Å; K234-A308 HydrophobicContact CD-CB 4.27Å; K234-A308 HydrophobicContact CG-CB 3.69Å; K234-A308 WeakPolarHBondContact O-CB 3.43Å; K234-A308 PolarHBondContact O-N 2.74Å; F236-A308 HydrophobicContact CB-CB 4.33Å; F278-A308 HydrophobicContact CD1-CB 3.94Å; F278-A308 HydrophobicContact CE1-CB 4.16Å; K306-A308 PolarHBondContact O-N 3.31Å
309Q73.4Confident71.1Confident104 Ų10488.4 Ų88.449%0.48644%0.442SS..PPolyproline II helixtrans-87.1140171.4-66.3-167.5-24.100109.7V307 K311V307-Q309 PolarHBondContact O-N 2.84Å; Q309-K311 PolarHBondContact O-N 3.13Å
310P66.9Low70.3Confident85 Ų8593.5 Ų93.555%0.55245%0.45SS*.PPolyproline II helixtrans-60141.9175.123.2-30.9000110.4E312 V313 Y314P310-E312 PolarHBondContact O-N 2.97Å; P310-V313 HydrophobicContact CG-CB 4.24Å; P310-V313 HydrophobicContact CG-CG2 3.75Å; P310-V313 PolarHBondContact O-N 3.25Å; P310-Y314 PolarHBondContact O-N 2.99Å
311K61.9Low69.4Low178 Ų17896.1 Ų96.177%0.77445%0.452SS*.Hα-helixtrans-53.7-30-175.3-169.7175.2-179.1177.40113.4Q309 R315Q309-K311 PolarHBondContact O-N 3.13Å; K311-R315 PolarHBondContact O-N 2.83Å
312E59.7Low68.2Low145 Ų145104.6 Ų104.668%0.67849%0.486SS*.Hα-helixtrans-66.8-44.7177.9-169.7176.8-177.500112.6P310 Y314 R315 Q316P310-E312 PolarHBondContact O-N 2.97Å; E312-Y314 VanDerWaalsContact C-N 3.35Å; E312-Y314 PolarHBondContact O-N 3.5Å; E312-R315 PolarHBondContact O-N 2.74Å; E312-Q316 PolarHBondContact O-N 3.46Å
313V60.4Low66.4Low65 Ų65101.7 Ų101.739%0.39449%0.493SS..Hα-helixtrans-66.1-39.9178.2176.10000110.4P310 Q316 Q317P310-V313 HydrophobicContact CG-CB 4.24Å; P310-V313 HydrophobicContact CG-CG2 3.75Å; P310-V313 PolarHBondContact O-N 3.25Å; V313-Q316 PolarHBondContact O-N 3.13Å; V313-Q317 WeakPolarHBondContact O-CB 3.41Å; V313-Q317 PolarHBondContact O-N 3.39Å
314Y63Low64.7Low120 Ų120104.7 Ų104.747%0.47152%0.524SS..Hα-helixtrans-66.6-38176.7-168.2-100.3000112.7P310 E312 Q317 Q318P310-Y314 PolarHBondContact O-N 2.99Å; E312-Y314 VanDerWaalsContact C-N 3.35Å; E312-Y314 PolarHBondContact O-N 3.5Å; Y314-Q317 PolarHBondContact O-N 3.39Å; Y314-Q318 HydrophobicContact CE1-CG 4.08Å; Y314-Q318 PolarHBondContact O-N 3.02Å; Y314-Q318 PolarHBondContact OH-NE2 3.24Å; Y314-Q318 VanDerWaalsContact OH-NE2 3.13Å
315R63.3Low62.8Low177 Ų177113.8 Ų113.867%0.66856%0.556SS**Hα-helixtrans-64.6-44.4174.3-91.4-179.268.6-171.21.4112.2K311 E312 Q317 Q318 Q319K311-R315 PolarHBondContact O-N 2.83Å; E312-R315 PolarHBondContact O-N 2.74Å; R315-Q317 VanDerWaalsContact C-N 3.34Å; R315-Q318 PolarHBondContact O-N 3.41Å; R315-Q319 WeakPolarHBondContact O-CB 3.26Å; R315-Q319 PolarHBondContact O-N 3.17Å
316Q59.5Low60.6Low122 Ų122117.4 Ų117.457%0.5759%0.594SS**Hα-helixtrans-63.5-39.8176.4-86.8178.2-2.200112E312 V313 Q319 Q320E312-Q316 PolarHBondContact O-N 3.46Å; V313-Q316 PolarHBondContact O-N 3.13Å; Q316-Q319 PolarHBondContact O-N 2.92Å; Q316-Q320 PolarHBondContact O-N 2.87Å
317Q58.9Low58.7Low97 Ų97118.5 Ų118.545%0.45362%0.619SS.*Hα-helixtrans-71.6-36.5-179.6-153.9167.250.700112.6V313 Y314 R315 Q319 Q320 Q321V313-Q317 WeakPolarHBondContact O-CB 3.41Å; V313-Q317 PolarHBondContact O-N 3.39Å; Y314-Q317 PolarHBondContact O-N 3.39Å; R315-Q317 VanDerWaalsContact C-N 3.34Å; Q317-Q319 VanDerWaalsContact C-N 3.34Å; Q317-Q320 PolarHBondContact O-N 2.85Å; Q317-Q321 PolarHBondContact O-N 3.09Å; Q317-Q321 VanDerWaalsContact O-N 3.07Å
318Q57.2Low57Low99 Ų99120 Ų12046%0.46364%0.639SS.*Hα-helixtrans-66-35.5169.1-87.4-165.14.900112.4Y314 R315 Q320 Q321 K322Y314-Q318 HydrophobicContact CE1-CG 4.08Å; Y314-Q318 PolarHBondContact O-N 3.02Å; Y314-Q318 PolarHBondContact OH-NE2 3.24Å; Y314-Q318 VanDerWaalsContact OH-NE2 3.13Å; R315-Q318 PolarHBondContact O-N 3.41Å; Q318-Q320 VanDerWaalsContact C-N 3.34Å; Q318-Q321 PolarHBondContact O-N 3.48Å; Q318-K322 VanDerWaalsContact O-CB 3.32Å; Q318-K322 WeakPolarHBondContact O-CB 3.43Å; Q318-K322 PolarHBondContact O-N 3.09Å
319Q57.4Low55.6Low146 Ų146124.7 Ų124.768%0.68268%0.678SS**Hα-helixtrans-70-32.5179.4-152.6163.518.200111.8R315 Q316 Q317 G323R315-Q319 WeakPolarHBondContact O-CB 3.26Å; R315-Q319 PolarHBondContact O-N 3.17Å; Q316-Q319 PolarHBondContact O-N 2.92Å; Q317-Q319 VanDerWaalsContact C-N 3.34Å; Q319-G323 PolarHBondContact O-N 3.49Å
320Q56.3Low53.8Low165 Ų165123.5 Ų123.577%0.77169%0.693SS**Hα-helixtrans-71.2-37.9169.7-94.5173.21.100113.4Q316 Q317 Q318 G323Q316-Q320 PolarHBondContact O-N 2.87Å; Q317-Q320 PolarHBondContact O-N 2.85Å; Q318-Q320 VanDerWaalsContact C-N 3.34Å; Q320-G323 PolarHBondContact O-N 3.04Å
321Q52.9Low52.5Low150 Ų150123 Ų12370%0.70170%0.703SS**Hα-helixtrans-75.1-26.9176.7-79.5-177.25.800113.8Q317 Q318 G323Q317-Q321 PolarHBondContact O-N 3.09Å; Q317-Q321 VanDerWaalsContact O-N 3.07Å; Q318-Q321 PolarHBondContact O-N 3.48Å; Q321-G323 VanDerWaalsContact C-N 3.31Å
322K49.7Very low51.6Low190 Ų190126.6 Ų126.683%0.82671%0.712SS**THydrogen-bonded Turntrans-83.1-5.7176-141.7178.5-176.7-175.20113.7Q318Q318-K322 VanDerWaalsContact O-CB 3.32Å; Q318-K322 WeakPolarHBondContact O-CB 3.43Å; Q318-K322 PolarHBondContact O-N 3.09Å
323G46.2Very low50.6Low71 Ų71124 Ų12473%0.73273%0.725SS**THydrogen-bonded Turntrans-87.6-7.5169.700000114.8Q319 Q320 Q321Q319-G323 PolarHBondContact O-N 3.49Å; Q320-G323 PolarHBondContact O-N 3.04Å; Q321-G323 VanDerWaalsContact C-N 3.31Å
324G51Low49.7Very low64 Ų64124 Ų12466%0.6674%0.738SS**SBendtrans-112.7-1.2-170.300000116.8
325R47.4Very low48.7Very low244 Ų244125.3 Ų125.392%0.92176%0.758SS**SBendtrans-142.572-179.2-76.8-175.1172.2172.9-3.2110.9
326G43.4Very low47.3Very low77 Ų77129 Ų12979%0.79477%0.772SS**SBendtrans-174.110.2177.200000116.7
327A44.9Very low46.1Very low110 Ų110126.4 Ų126.491%0.90978%0.778SS**SBendtrans-119.933177.800000112.7
328A45.8Very low45Very low104 Ų104134.1 Ų134.186%0.8680%0.803SS**SBendtrans-142.449174.300000111
329A47.3Very low43.9Very low106 Ų106133 Ų13388%0.87682%0.818SS**  trans-152.782.9168.400000108.9
330G36.9Very low42.8Very low78 Ų78138.5 Ų138.580%0.80483%0.833SS**  trans166.162.9-178.400000107.2
331G39.4Very low41.7Very low74 Ų74133.8 Ų133.876%0.76383%0.829SS**  77.47052.500000109.5
332R43.7Very low40.9Very low254 Ų254135.5 Ų135.596%0.95884%0.837SS**  trans47.190.3155.5-81.6177.8166.5166.1-3.6116.9
333G38Very low40Very low92 Ų92134.9 Ų134.995%0.94884%0.837SS**  trans-133.961.4158.100000110.3
334G41.6Very low39.4Very low64 Ų64135.9 Ų135.966%0.6683%0.833SS**SBendtrans-152.4104.9-178.300000111.2
335T41.5Very low38.5Very low147 Ų147138.1 Ų138.190%0.90283%0.834SS**  trans72.979.1155.2-38.40000116.6
336R35.1Very low37.7Very low255 Ų255137.3 Ų137.396%0.96283%0.832SS**  trans-105.6117.7146.6-96.1-175.4-177.5151.9-0.5109.3
337G34.4Very low37.1Very low68 Ų68136.6 Ų136.670%0.70183%0.825SS**  trans95.496.6142.300000116.9
338R35.5Very low36.6Very low259 Ų259141.6 Ų141.698%0.97783%0.826SS**  -164100.2120-103.1-174.8-169.3-163.54.4109.7
339G33.8Very low35.9Very low75 Ų75140.5 Ų140.577%0.77382%0.817SS**  trans-96.8129151.200000108.5
340R33.1Very low35.3Very low261 Ų261140.8 Ų140.899%0.98581%0.813SS**  trans160.8136.8142.5-98.6-171.1171.7-159.4-0.9111.7
341G33.1Very low35.1Very low67 Ų67148.7 Ų148.769%0.69182%0.818SS**  trans118.194.1157.300000113.2
342Q36.2Very low34.8Very low186 Ų186148.9 Ų148.987%0.86982%0.82SS**  68.8103.8104.1-79.7-176.63.900113
343Q32.6Very low34.2Very low177 Ų177140.9 Ų140.983%0.82782%0.817SS**  79.2128.178.2-173.4154.221.100114
344S32.9Very low34Very low92 Ų92140.2 Ų140.264%0.64381%0.81SS**  trans89.5109.6154-74.60000121.3
345T31.9Very low33.8Very low111 Ų111143.8 Ų143.868%0.68181%0.814SS**  57.1137.8109.6-21.70000122
346Y30.9Very low33.8Very low226 Ų226145.8 Ų145.889%0.88681%0.813SS**  trans78.3113.8156.6-83.8-77.4000119.7
347G31.5Very low33.9Very low63 Ų63140.8 Ų140.865%0.64980%0.8SS**  121.1127.411300000117.8
348K34.4Very low33.9Very low215 Ų215144.2 Ų144.294%0.93580%0.803SS**  trans65.7157.6150.1-71.5-174174.51800116.8
349A31.1Very low33.9Very low81 Ų81139.3 Ų139.367%0.66980%0.796SS**  cis-175.8143.1-2400000103.7
350S33.1Very low33.9Very low112 Ų112144.8 Ų144.878%0.78380%0.795SS**  trans32.7116.6143.7-159.60000119.4
351R33.6Very low34.2Very low243 Ų243137.4 Ų137.492%0.91777%0.771SS**  166.9141.2117.1-95.3-179.3178.3177.30.6113.1
352G32.5Very low35.4Very low78 Ų78139.8 Ų139.880%0.80477%0.774SS**  trans84.6112154.500000113.4
353G31.6Very low35.7Very low87 Ų87144 Ų14490%0.89778%0.784SS**  cis87.7103.737.600000108.4
354G34.3Very low35.9Very low78 Ų78142.3 Ų142.380%0.80478%0.782SS**  trans151.298.5171.300000113.7
355N37.1Very low36.1Very low138 Ų138144.9 Ų144.974%0.73879%0.789SS**  trans-34.6152.9153.5-84.4-25.1000112.4
356H42.1Very low36.3Very low190 Ų190146.8 Ų146.888%0.8880%0.795SS**  -172.898119.3-87.699000109.6
357Q35.8Very low36.6Very low149 Ų149142.2 Ų142.270%0.69679%0.79SS**  trans1.4135.3138.1-140.6110.8-15.800119.2
358N34.8Very low36.9Very low140 Ų140147.1 Ų147.175%0.74980%0.799SS**  trans58.6122.3140.2-66.6-13.2000119.7
359N35.1Very low37.1Very low156 Ų156142.6 Ų142.683%0.83479%0.79SS**  -174.7141.382-1596.1000112.2
360Y33.5Very low37.5Very low191 Ų191147 Ų14775%0.74980%0.798SS**  trans-47.6134.7166.9-110.2-125.8000112.4
361Q39.8Very low37.9Very low106 Ų106149.7 Ų149.750%0.49580%0.799SS.*  67.2153.986.2-97.9169-40.500114.5Y363Q361-Y363 HydrophobicContact CG-CD2 4.44Å
362P58Low38.2Very low116 Ų116141.9 Ų141.975%0.75379%0.79SS**  cis-129.9153.131.413.914.1000114.4
363Y44Very low38.7Very low274 Ų274147.7 Ų147.7100%1.07579%0.788SS**  59.8093.3-85.5-66.7000116Q361Q361-Y363 HydrophobicContact CG-CD2 4.44Å

Retrieved 363 of 363 residues in 213.6 ms (Link to these results)