A0A093H521_STRCA Loading...

Heterochromatin protein 1-binding protein 3

AlphaFold DB , UniProt , Accession A0A093H521, Species STRCA (Struthio camelus australis), Gene n/a, Length 558 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M33.3Very low38.8Very low236 Ų236131.7 Ų131.7100%1.16376%0.757SS**  0128.10-69.7-59.2-160.100105.6
2A37Very low38.6Very low83 Ų83137.3 Ų137.369%0.68677%0.77SS**  trans61145.8-165.300000113.2
3T39.5Very low38.2Very low115 Ų115138.3 Ų138.371%0.70676%0.764SS**  cis73.5142.122.687.50000113.4
4D38.2Very low37.8Very low131 Ų131142.9 Ų142.970%0.70177%0.773SS**  cis-127.6166.75.6-76.8-82.4000110.3
5L46.9Very low37.6Very low147 Ų147139.2 Ų139.277%0.7777%0.769SS**  cis83.3137.926.2-89.3175.6000118
6S41.8Very low37.9Very low97 Ų97140.1 Ų140.168%0.67877%0.771SS**  trans67.3155.7160.4900000118.3
7E37.3Very low38.3Very low184 Ų184138.5 Ų138.586%0.8677%0.769SS**  cis-164.1173.2-15.8-121.416672.400108.8
8A33.4Very low38Very low86 Ų86139.1 Ų139.171%0.71177%0.77SS**  cis-153.8178.83.300000111.5
9E34.3Very low37.9Very low172 Ų172138.7 Ų138.780%0.80477%0.766SS**  trans-116.3164.4156.5-131.1-164-136.800107.1
10P49.2Very low37.6Very low106 Ų106138.4 Ų138.469%0.68877%0.768SS**  -158.5173.16243-21.3000119
11V35.9Very low37.3Very low92 Ų92135.1 Ų135.156%0.55877%0.766SS**  trans49.8127.7140.9170.80000121.1
12H36.7Very low37.3Very low198 Ų198128.5 Ų128.592%0.91775%0.749SS**  -144.3165.7130-121.1-90.7000112.5
13H33Very low37.2Very low151 Ų151132.9 Ų132.970%0.69976%0.755SS**  trans-116.6162.6-152.9-95.3-79.2000116.9
14K32.7Very low36.8Very low203 Ų203133.3 Ų133.388%0.88375%0.752SS**  trans82.7156.5146.3-83.8169.8178.2177.30120
15A35.6Very low36.8Very low87 Ų87135.2 Ų135.272%0.71976%0.761SS**  trans-140.6162175.600000110.2
16L41Very low36Very low153 Ų153135.8 Ų135.880%0.80176%0.759SS**  trans68.2135.9174.8-51.1179.6000116.8
17P46Very low35.6Very low113 Ų113137.5 Ų137.573%0.73477%0.766SS**  -103.7161.6104.8-17.935.4000112.4
18L32.8Very low35.2Very low149 Ų149134.5 Ų134.578%0.7876%0.755SS**  cis72.3142.732.9-47.7176000112.5
19L34.8Very low35.4Very low132 Ų132138 Ų13869%0.69176%0.755SS**  cis-164.3169.46-154.274.9000111.7
20T31.7Very low35.3Very low132 Ų132136.6 Ų136.681%0.8175%0.752SS**  trans64.1158.1153.235.70000120.6
21G31.6Very low34.5Very low71 Ų71135.8 Ų135.873%0.73275%0.749SS**  cis-178.3161.8-1.300000114.6
22A33.9Very low34.3Very low97 Ų97139.4 Ų139.480%0.80276%0.76SS**  trans-65.7158.3-165.200000119.6
23Q34.2Very low34.2Very low175 Ų175139.2 Ų139.282%0.81876%0.756SS**  -177.2151.5107.1-97.6-166.929.500116.3
24L32.2Very low34.4Very low124 Ų124137.4 Ų137.465%0.64976%0.756SS**  trans29133.7150.7-80.2162000123.9
25I37.5Very low34.4Very low170 Ų170136.2 Ų136.287%0.87275%0.753SS**  -164.5153.7109.9-95.4156.3000109.9
26H30.4Very low34.5Very low159 Ų159139.4 Ų139.474%0.73676%0.758SS**  trans-90.5152-178.1-83.6-117.2000114.1
27T33.7Very low34.1Very low133 Ų133139.1 Ų139.182%0.81676%0.758SS**  -161.6134.7120.144.70000111.4
28D29.6Very low33.6Very low121 Ų121139 Ų13965%0.64776%0.755SS**  trans25.2142.5141.4-77.122.2000121.7
29K37.1Very low33.8Very low160 Ų160140.6 Ų140.670%0.69676%0.761SS**  cis-163.5154.619.4-131165.2-176.8122.10113.9
30L32.7Very low34.4Very low143 Ų143140.1 Ų140.175%0.74977%0.765SS**  trans55.798.4154.9-71.1157.6000117.2
31S31Very low34.8Very low89 Ų89141.3 Ų141.362%0.62277%0.765SS**  90.6102.175.567.80000112
32E32.7Very low34.9Very low168 Ų168148.9 Ų148.979%0.78577%0.772SS**  78106.673.8-175.7-169.5156.800112.6
33K33.3Very low34.9Very low193 Ų193155.1 Ų155.184%0.83977%0.774SS**  -152.2152.4103.3-101.2-165.9175.6-149.70112.3
34V37.2Very low35Very low114 Ų114151.6 Ų151.669%0.69177%0.769SS**  trans-115.8152.6179.3172.70000108
35E33.5Very low34.9Very low178 Ų178153.2 Ų153.283%0.83278%0.784SS**  trans156.6106.2148.9-85.5153-159.700106.2
36D38.4Very low34.7Very low153 Ų153152.5 Ų152.582%0.81878%0.782SS**  48.6104.482.9-92.3-41.3000113.6
37D31.3Very low34.9Very low148 Ų148150.2 Ų150.279%0.79178%0.784SS**  -162.8149.5116-141.4-16.4000115.1
38T35.6Very low34.8Very low111 Ų111149.3 Ų149.368%0.68178%0.783SS**  trans23.5126.8144.1-67.40000122.2
39M37.8Very low34.8Very low182 Ų182150 Ų15090%0.89780%0.797SS**  trans-68147.4158.3-61178.9-70.500112.8
40P48Very low34.6Very low122 Ų122153.3 Ų153.379%0.79281%0.805SS**  trans-131.1148.6140.932.4-19.6000116.1
41I38.8Very low34.4Very low157 Ų157155.5 Ų155.581%0.80581%0.811SS**  trans-78.1132.3179.6-56.2157000111.1
42R34.3Very low34.5Very low230 Ų230157 Ų15787%0.86882%0.817SS**  trans-179.6127.4136.6-92.8142.7-155-134.76.8110.6
43R34.3Very low35.3Very low228 Ų228154.3 Ų154.386%0.8681%0.814SS**  75.99577.9-114.2-178.6177.6156.3-1.8114.8
44S35Very low35.7Very low101 Ų101151.5 Ų151.571%0.70682%0.815SS**  trans28.9131.6135.660.60000121.6
45V31Very low35.3Very low158 Ų158155.9 Ų155.996%0.95883%0.825SS**  -164.5179.5115.4-940000110.6
46N32.6Very low35.2Very low155 Ų155153.2 Ų153.283%0.82983%0.826SS**  trans-143.8108.3-164.2177.6110.6000113.2
47S34.2Very low35Very low111 Ų111155.3 Ų155.378%0.77683%0.828SS**  trans-164.9136.2160.443.40000107.8
48S32.6Very low35.5Very low113 Ų113154.1 Ų154.179%0.7983%0.828SS**  cis74.294.445.9-176.70000113.9
49S29.8Very low35.3Very low135 Ų135152.5 Ų152.594%0.94483%0.826SS**  trans-161.7163.9142.2-117.20000112.3
50R32.3Very low34.8Very low230 Ų230153.5 Ų153.587%0.86883%0.829SS**  trans-118.1137.4-164.4146.9-159176-166.71.4109.8
51E28.1Very low33.9Very low189 Ų189151.3 Ų151.388%0.88383%0.828SS**  trans-159.4154.7156.7-126.1-179.1125.400114.8
52T34Very low33.4Very low122 Ų122153.3 Ų153.375%0.74883%0.834SS**  trans-170.4160.9-177.954.40000109.2
53P48.8Very low33.3Very low110 Ų110149.7 Ų149.771%0.71483%0.827SS**  cis-125.3-166.1-46.441.1-26.6000110
54P42.2Very low33.3Very low134 Ų134145.4 Ų145.487%0.8783%0.826SS**  trans-128.7-176.7143.234.2-21.7000113.8
55K29.3Very low33.2Very low206 Ų206148.9 Ų148.990%0.89683%0.828SS**  trans-152.5128.5-151.2171.6-172.1178.4-1750112.2
56S30.7Very low33.1Very low122 Ų122145 Ų14585%0.85381%0.813SS**  trans-155.5151.2169.146.90000114.3
57K34.5Very low33Very low198 Ų198144.5 Ų144.586%0.86181%0.81SS**  trans-151.3172.6175.9-116.3-165.8-179.6-164.10106
58P41.6Very low34Very low122 Ų122144.5 Ų144.579%0.79281%0.808SS**  cis-113.3-130.931.423.32.5000111
59A30.8Very low33.8Very low77 Ų77147.6 Ų147.664%0.63681%0.81SS**  cis-157.6164.4-1.200000111.4
60E27.7Very low33.8Very low204 Ų204147 Ų14795%0.95380%0.8SS**  trans58.9154.3174.7-56.2177.3133.800114.8
61G29.4Very low33.5Very low76 Ų76141.2 Ų141.278%0.78480%0.795SS**  cis-155.1173.9-19.400000106.3
62E28.7Very low33.9Very low198 Ų198136.4 Ų136.493%0.92578%0.782SS**  cis-147.5-145.62.8-161.6162.68200108.8
63E32.7Very low34Very low154 Ų154139.4 Ų139.472%0.7279%0.788SS**  trans-137.3148.5-165.6-60.7-161.4129.100115.4
64V32.5Very low33.2Very low138 Ų138142.8 Ų142.884%0.83679%0.794SS**  trans-158.6111.3139.3-165.90000106.7
65K32.8Very low33.5Very low174 Ų174140.8 Ų140.876%0.75778%0.783SS**  55.7142.183.3-82.6176.2176.9161.20116.2
66A29.9Very low33.5Very low77 Ų77135.6 Ų135.664%0.63678%0.779SS**  cis-164134.1-2.700000108.9
67D30Very low33.4Very low145 Ų145134.9 Ų134.978%0.77577%0.774SS**  89173.593.1-62.7-60.9000115.3
68P55.5Low33.1Very low111 Ų111131.3 Ų131.372%0.72177%0.768SS**  -140.5-153.6-8144.9-25.9000116.9
69E29.2Very low32.6Very low177 Ų177128.4 Ų128.483%0.82776%0.76SS**  trans85.7150.6171.2-53.9-140.591.200118.6
70V29.3Very low32.6Very low124 Ų124132.3 Ų132.375%0.75277%0.765SS**  cis-142160.525.6-61.80000115.5
71S26.4Very low32.9Very low108 Ų108131.2 Ų131.276%0.75576%0.76SS**  trans46.9154.5146.2-98.90000124.6
72S35.4Very low33Very low88 Ų88135 Ų13562%0.61576%0.758SS**  cis-177.6170.3-27.247.20000111.3
73E36.2Very low33Very low185 Ų185133.6 Ų133.686%0.86475%0.751SS**  trans72.3126.7171.5-57.7175.896.100116.5
74E32.7Very low32.7Very low180 Ų180133 Ų13384%0.84175%0.753SS**  cis74141.140.3-106.1-155.697.400115.4
75S48.8Very low32.5Very low92 Ų92133.9 Ų133.964%0.64375%0.748SS**  cis-160.8-169.86.4-155.80000113.9
76A29.7Very low32.1Very low97 Ų97130.3 Ų130.380%0.80274%0.741SS**  trans78.3141.8163.400000120.3
77S28.5Very low32.1Very low108 Ų108134.3 Ų134.376%0.75575%0.751SS**  cis-169.7163.4-15.9-1680000111.9
78V28.4Very low32.6Very low123 Ų123132.7 Ų132.775%0.74575%0.748SS**  trans66.3138.8173.1179.20000115.1
79G29.2Very low31.3Very low60 Ų60132 Ų13262%0.61975%0.751SS**  cis121.1148.811.400000110.9
80E31.3Very low31.3Very low159 Ų159127.9 Ų127.974%0.74375%0.748SS**  cis-138.4151.6-7.1-70.479.136.200107.7
81E33.8Very low31.2Very low182 Ų182127.4 Ų127.485%0.8575%0.75SS**  40.2142.982.1-63.2-171-178.900117.8
82Q32.6Very low31.4Very low156 Ų156127.1 Ų127.173%0.72975%0.748SS**  cis-164.2171.5-32-164.9179.1-102.600108
83E27.2Very low31Very low167 Ų167132 Ų13278%0.7876%0.761SS**  trans72.5179.1158.9-49.9-170.9164.700119.2
84N26.8Very low30.6Very low142 Ų142126.7 Ų126.776%0.75975%0.749SS**  -166.9171.8-68.6-173.931.6000108.6
85E29.2Very low30.3Very low157 Ų157125.9 Ų125.973%0.73475%0.745SS**  trans67163.6170.2-65.7-133.481.300118.1
86T25.1Very low29.3Very low99 Ų99129.3 Ų129.361%0.60775%0.751SS**  cis-168.3154-37.4-82.30000106.8
87L29.5Very low29.6Very low161 Ų161129.1 Ų129.184%0.84374%0.742SS**  trans144.8156.4147.3-75.3173.5000113.7
88P39.7Very low29.4Very low111 Ų111133.6 Ų133.672%0.72175%0.748SS**  trans-135.2-174.4-146.944.3-27.8000117.2
89A29Very low29.3Very low95 Ų95136.4 Ų136.479%0.78575%0.753SS**  trans73.8147.9154.400000119.2
90A29.5Very low29.5Very low92 Ų92139.5 Ų139.576%0.7676%0.762SS**  cis-166.7151.6-20.700000111
91S26.7Very low29.1Very low114 Ų114140.5 Ų140.580%0.79777%0.767SS**  trans-175.1115.9148.6-81.50000111.7
92S30.9Very low28.6Very low102 Ų102138.5 Ų138.571%0.71376%0.761SS**  trans48.3135.213464.20000121.1
93E25.4Very low28.2Very low189 Ų189139.4 Ų139.488%0.88377%0.766SS**  cis-156.6173.29.2-154.7146.790.100113.3
94A28.8Very low28Very low75 Ų75135.2 Ų135.262%0.6277%0.767SS**  trans-52.2171.7-175.800000118.6
95E27.3Very low28.2Very low162 Ų162137.3 Ų137.376%0.75777%0.77SS**  cis-164.6145.7-16.9-106.1179.69900108.2
96Q26.6Very low27.9Very low164 Ų164133.6 Ų133.677%0.76677%0.774SS**  52.2155.994.6-76.2-15779.700118.6
97P36.8Very low28.2Very low94 Ų94135.8 Ų135.861%0.6178%0.777SS**  cis-146.8-171.6-36.342.9-25000115.7
98K23.1Very low28Very low201 Ų201135.1 Ų135.187%0.87478%0.78SS**  trans78.7150.3149-79.8176.9-179.5177.50124.1
99E25.9Very low27.6Very low183 Ų183139 Ų13986%0.85579%0.785SS**  trans-67167.2159.8-75.2177.2131.800112.1
100P34.1Very low27.4Very low124 Ų124138.9 Ų138.981%0.80578%0.779SS**  cis-152.9-150.743.946.2-22.8000117.3
101E24.1Very low27.4Very low181 Ų181138.9 Ų138.985%0.84677%0.773SS**  trans-59.3150.5-179.6-50.7167.4117.500115.1
102N22Very low27.4Very low139 Ų139141.9 Ų141.974%0.74378%0.775SS**  178.817598.6-161.227.1000113.3
103E24.9Very low27.4Very low176 Ų176144.8 Ų144.882%0.82278%0.777SS**  trans-50.4154.5174.4-58.8165.413400116.5
104G23.8Very low27.6Very low79 Ų79140.2 Ų140.281%0.81476%0.762SS**  trans-177.3100168.400000115.1
105K29.2Very low27.9Very low185 Ų185145.9 Ų145.980%0.80477%0.773SS**  trans-61.1144.8173.4-93-174.3169.5-167.80112.8E107K105-E107 WeakPolarHBondContact CD-OE2 3.24Å; K105-E107 WeakPolarHBondContact CE-OE2 3.36Å; K105-E107 IonicContact NZ-OE2 2.7Å; K105-E107 PolarHBondContact NZ-OE2 2.9Å
106G24.3Very low28Very low80 Ų80144.9 Ų144.983%0.82577%0.766SS**  trans-136.1106.9155.500000110.7
107E30Very low28.1Very low145 Ų145144.3 Ų144.368%0.67877%0.768SS**  trans-102.4125179.3-74179.958.300111.9K105K105-E107 WeakPolarHBondContact CD-OE2 3.24Å; K105-E107 WeakPolarHBondContact CE-OE2 3.36Å; K105-E107 IonicContact NZ-OE2 2.7Å; K105-E107 PolarHBondContact NZ-OE2 2.9Å
108T26.6Very low27.8Very low146 Ų146146.3 Ų146.390%0.89677%0.769SS**  trans-136.4112.9159.627.20000113.2
109K30.6Very low27.9Very low193 Ų193144.8 Ų144.884%0.83976%0.763SS**  trans-42.4161155.1-76.3171.5-177.8174.20113.5
110S25.4Very low28Very low93 Ų93142.5 Ų142.565%0.6576%0.756SS**  cis-175.3-179.7-3.446.20000110.4
111S29.9Very low27.8Very low91 Ų91145.9 Ų145.964%0.63676%0.761SS**  trans57.7140.6138.958.80000120.1
112E26.6Very low28Very low178 Ų178142.5 Ų142.583%0.83276%0.757SS**  cis-155.4-1715.6-153.7133.7106.500112.5
113E29.1Very low28.5Very low162 Ų162145 Ų14576%0.75776%0.762SS**  trans-67.3169.3-179.3-54.8-173.482.800114.4
114T29.5Very low29Very low93 Ų93145.1 Ų145.157%0.57176%0.763SS**  -172.7150.651.416.50000114.3
115K35.3Very low29.5Very low194 Ų194149.9 Ų149.984%0.84376%0.761SS**  trans62.1157.4142.8-69.6165.8-173.9159.50118.9
116K30.1Very low30Very low141 Ų141149.4 Ų149.461%0.61376%0.761SS**  cis-165.4140.2-19.5156176.3-179.7-176.70106.2E118K116-E118 WeakPolarHBondContact CE-OE2 3.36Å; K116-E118 IonicContact NZ-OE2 2.67Å; K116-E118 PolarHBondContact NZ-OE2 2.84Å
117D28.9Very low30.7Very low153 Ų153154.7 Ų154.782%0.81876%0.761SS**  -167.2175.7127.2-111.3-31.1000114.6
118E29.8Very low31.2Very low135 Ų135157.3 Ų157.363%0.63177%0.771SS**  trans-128.5151-143-158-177.7115.700114.5K116K116-E118 WeakPolarHBondContact CE-OE2 3.36Å; K116-E118 IonicContact NZ-OE2 2.67Å; K116-E118 PolarHBondContact NZ-OE2 2.84Å
119K25.8Very low31.6Very low170 Ų170156.3 Ų156.374%0.73976%0.764SS**  trans101.2151.8142.1-144.7173.4174.4168.90120.8
120D27.4Very low32.8Very low134 Ų134156.3 Ų156.372%0.71776%0.764SS**  trans58.378.9166.6-77.1-52.1000119.5
121Q30Very low34.8Very low196 Ų196158.5 Ų158.592%0.91676%0.762SS**  trans-98.2105.2140.5-75.7-168.15.800110.2K123Q121-K123 PolarHBondContact O-N 3.38Å
122S29.2Very low37.1Very low109 Ų109160.2 Ų160.276%0.76277%0.768SS**  trans-68.8113.6173.945.60000110.5E124S122-E124 VanDerWaalsContact C-N 3.32Å; S122-E124 PolarHBondContact O-N 3.24Å
123K32.6Very low39.6Very low191 Ų191156 Ų15683%0.8375%0.751SS**  trans-7778.6-173.6-161.7164.9-166.8160.30111.3Q121 K125Q121-K123 PolarHBondContact O-N 3.38Å; K123-K125 PolarHBondContact O-N 3.48Å
124E34Very low42.1Very low180 Ų180148.9 Ų148.984%0.84172%0.719SS**  trans-61.897.8-179.9-172.8163.1-144.400111S122 E126S122-E124 VanDerWaalsContact C-N 3.32Å; S122-E124 PolarHBondContact O-N 3.24Å; E124-E126 VanDerWaalsContact C-N 3.34Å; E124-E126 PolarHBondContact O-N 3.22Å
125K34.3Very low44.5Very low179 Ų179148.9 Ų148.978%0.77873%0.728SS**  trans-76.188.3173.9-73-179.1178.9175.20108.8K123 K127K123-K125 PolarHBondContact O-N 3.48Å; K125-K127 PolarHBondContact O-N 2.84Å
126E39.9Very low46.8Very low174 Ų174140.9 Ų140.981%0.81369%0.693SS**  trans-46.2111.4162.7-77.7-160.1123.900109.3E124 K128E124-E126 VanDerWaalsContact C-N 3.34Å; E124-E126 PolarHBondContact O-N 3.22Å; E126-K128 PolarHBondContact O-N 3.12Å
127K38.7Very low49.3Very low191 Ų191134.2 Ų134.283%0.8366%0.664SS**  trans-67.1108171.3-71175.6-177.5169.70106.1K125 V129K125-K127 PolarHBondContact O-N 2.84Å; K127-V129 PolarHBondContact O-N 2.91Å
128K40.8Very low51.5Low201 Ų201129.3 Ų129.387%0.87464%0.64SS**  trans-59.784.6172.6-68.6-172.7178-175.30109.8E126 K130E126-K128 PolarHBondContact O-N 3.12Å; K128-K130 PolarHBondContact O-N 3.45Å; K128-K130 VanDerWaalsContact O-N 3.13Å
129V35.5Very low52.9Low124 Ų124127.1 Ų127.175%0.75263%0.632SS**  trans-56117.9165.2178.20000105.3K127 K131K127-V129 PolarHBondContact O-N 2.91Å; V129-K131 PolarHBondContact O-N 3.46Å
130K55.7Low54.5Low194 Ų194120.7 Ų120.784%0.84361%0.609SS**  trans-62.1103.6174.5-64.8-179.6-179.6-178.40106.3K128 T132K128-K130 PolarHBondContact O-N 3.45Å; K128-K130 VanDerWaalsContact O-N 3.13Å; K130-T132 PolarHBondContact O-N 3.21Å
131K68.3Low55.9Low139 Ų139118.2 Ų118.260%0.60461%0.607SS**  trans-52.9114.2176-70.6-179175.5-177.70107.1V129 I133 N394V129-K131 PolarHBondContact O-N 3.46Å; K131-I133 PolarHBondContact O-N 2.95Å; K131-I133 VanDerWaalsContact O-N 3.09Å; K131-N394 PolarHBondContact NZ-OD1 3.4Å
132T76.7Confident57.2Low126 Ų126112.1 Ų112.177%0.77359%0.586SS**PPolyproline II helixtrans-62.3116.2175.9-50.70000107.9K130K130-T132 PolarHBondContact O-N 3.21Å
133I79.7Confident58.8Low89 Ų89111 Ų11146%0.45657%0.568SS.*PPolyproline II helixtrans-79.6128.1171.8-56.4175.8000106.1K131 A137 W396K131-I133 PolarHBondContact O-N 2.95Å; K131-I133 VanDerWaalsContact O-N 3.09Å; I133-A137 HydrophobicContact CG2-CB 4.06Å; I133-A137 WeakPolarHBondContact CG2-O 3.45Å; I133-W396 HydrophobicContact CB-CZ2 4.39Å; I133-W396 HydrophobicContact CG1-CZ2 4.37Å; I133-W396 HydrophobicContact CG2-CZ2 4.38Å
134P82.5Confident60.2Low13 Ų13105 Ų1058%0.08455%0.545CS..PPolyproline II helixtrans-66.8152.1175.330-34.9000109.4W136 A137 T138 W396P134-W136 HydrophobicContact CG-CD2 4.36Å; P134-W136 HydrophobicContact CG-CZ2 4.17Å; P134-W136 PolarHBondContact O-N 3.42Å; P134-W136 VanDerWaalsContact O-N 3.09Å; P134-A137 HydrophobicContact CG-CB 3.75Å; P134-A137 PolarHBondContact O-N 2.9Å; P134-T138 PolarHBondContact O-OG1 3.15Å; P134-W396 VanDerWaalsContact CD-CZ2 3.44Å; P134-W396 HydrophobicContact CG-CD2 4.43Å; P134-W396 HydrophobicContact CG-CE3 4.08Å; P134-W396 HydrophobicContact CG-CH2 4.19Å; P134-W396 HydrophobicContact CG-CZ3 3.95Å
135A80.3Confident61.4Low94 Ų9498.4 Ų98.478%0.77752%0.521SS*.G310 helixtrans-54.7-38-170.200000112.9T138A135-T138 WeakPolarHBondContact O-CB 3.44Å; A135-T138 PolarHBondContact O-N 2.86Å; A135-T138 PolarHBondContact O-OG1 3.09Å
136W82.9Confident62.7Low25 Ų2598.6 Ų98.610%0.09552%0.517CS..G310 helixtrans-70.5-27.1178.967.9-102.7000114.8P134 T138 E260 P264 W396 M397 L411 Y415P134-W136 HydrophobicContact CG-CD2 4.36Å; P134-W136 HydrophobicContact CG-CZ2 4.17Å; P134-W136 PolarHBondContact O-N 3.42Å; P134-W136 VanDerWaalsContact O-N 3.09Å; W136-T138 VanDerWaalsContact C-N 3.28Å; W136-E260 VanDerWaalsContact CZ2-O 3.29Å; W136-E260 WeakPolarHBondContact CZ2-O 3.32Å; W136-E260 PolarHBondContact NE1-O 3.43Å; W136-P264 HydrophobicContact CB-CG 4.12Å; W136-P264 HydrophobicContact CD2-CB 4.29Å; W136-P264 HydrophobicContact CD2-CG 3.18Å; W136-P264 HydrophobicContact CE3-CB 4.39Å; W136-P264 HydrophobicContact CE3-CG 3.58Å; W136-P264 HydrophobicContact CG-CB 4.4Å; W136-P264 HydrophobicContact CG-CG 3.44Å; W136-P264 VanDerWaalsContact CG-CG 3.44Å; W136-P264 HydrophobicContact CH2-CG 4.18Å; W136-P264 HydrophobicContact CZ2-CG 3.84Å; W136-P264 HydrophobicContact CZ3-CG 4.06Å; W136-W396 HydrophobicContact CH2-CB 4Å; W136-W396 HydrophobicContact CZ3-CB 4.31Å; W136-M397 HydrophobicContact CH2-CG 4.22Å; W136-M397 HydrophobicContact CH2-SD 4.4Å; W136-L411 HydrophobicContact CZ3-CD2 4.21Å; W136-Y415 HydrophobicContact CB-CD2 3.81Å; W136-Y415 HydrophobicContact CB-CE2 4.06Å
137A82.1Confident63.6Low2 Ų292.5 Ų92.52%0.01750%0.497CS..G310 helixtrans-95.418.118000000112.4I133 P134 W396 F413I133-A137 HydrophobicContact CG2-CB 4.06Å; I133-A137 WeakPolarHBondContact CG2-O 3.45Å; P134-A137 HydrophobicContact CG-CB 3.75Å; P134-A137 PolarHBondContact O-N 2.9Å; A137-W396 HydrophobicContact CB-CB 3.87Å; A137-W396 HydrophobicContact CB-CD2 3.88Å; A137-W396 HydrophobicContact CB-CG 3.52Å; A137-F413 HydrophobicContact CB-CD2 4.26Å; A137-F413 WeakPolarHBondContact O-CE1 3.16Å; A137-F413 WeakPolarHBondContact O-CZ 3.48Å
138T74.9Confident64.8Low50 Ų5088.7 Ų88.731%0.30748%0.482SS..SBendtrans-91.7150.2171.2-52.70000108.6P134 A135 W136 L144 F413P134-T138 PolarHBondContact O-OG1 3.15Å; A135-T138 WeakPolarHBondContact O-CB 3.44Å; A135-T138 PolarHBondContact O-N 2.86Å; A135-T138 PolarHBondContact O-OG1 3.09Å; W136-T138 VanDerWaalsContact C-N 3.28Å; T138-L144 HydrophobicContact CG2-CD1 3.89Å; T138-L144 HydrophobicContact CG2-CD2 3.95Å; T138-L144 HydrophobicContact CG2-CG 4.29Å; T138-F413 WeakPolarHBondContact O-CD1 3.46Å
139L59.8Low65.5Low89 Ų8985.9 Ų85.947%0.46647%0.47SS..PPolyproline II helixtrans-48.7146.4173.8-69.3168.8000111.2Q143 L144 F413L139-Q143 HydrophobicContact CB-CB 3.99Å; L139-L144 HydrophobicContact CB-CG 4.38Å; L139-L144 VanDerWaalsContact O-CD1 3.24Å; L139-L144 WeakPolarHBondContact O-CD1 3.36Å; L139-L144 WeakPolarHBondContact O-CG 3.45Å; L139-F413 HydrophobicContact CD2-CE1 4.03Å; L139-F413 HydrophobicContact CG-CE1 4.32Å
140S59.4Low66.5Low35 Ų3587.5 Ų87.525%0.24547%0.469CS..PPolyproline II helixtrans-55.3152.6-176.869.40000111.8S142 Q143 L144S140-S142 PolarHBondContact O-N 3.48Å; S140-S142 PolarHBondContact OG-OG 2.93Å; S140-S142 VanDerWaalsContact OG-OG 3.08Å; S140-Q143 WeakPolarHBondContact O-CA 3.47Å; S140-Q143 PolarHBondContact O-N 2.93Å; S140-Q143 PolarHBondContact OG-OE1 3.38Å; S140-L144 PolarHBondContact O-N 3.11Å
141A57.4Low66.5Low82 Ų8283 Ų8368%0.67846%0.458SS*.Hα-helixtrans-51.1-32.318000000113.1A145A141-A145 WeakPolarHBondContact O-CB 3.49Å; A141-A145 PolarHBondContact O-N 3.37Å
142S56.7Low65.9Low68 Ų6882.4 Ų82.448%0.47646%0.457SS..Hα-helixtrans-68.6-37.5175.177.20000114.1S140 R146S140-S142 PolarHBondContact O-N 3.48Å; S140-S142 PolarHBondContact OG-OG 2.93Å; S140-S142 VanDerWaalsContact OG-OG 3.08Å; S142-R146 VanDerWaalsContact O-CG 3.31Å; S142-R146 WeakPolarHBondContact O-CG 3.31Å; S142-R146 PolarHBondContact O-N 3.04Å; S142-R146 VanDerWaalsContact O-N 3.14Å
143Q63.3Low64.5Low85 Ų8584.1 Ų84.140%0.39746%0.458SS..Hα-helixtrans-76.9-41177.4-71159.9-4400110.6L139 S140 R146 A147L139-Q143 HydrophobicContact CB-CB 3.99Å; S140-Q143 WeakPolarHBondContact O-CA 3.47Å; S140-Q143 PolarHBondContact O-N 2.93Å; S140-Q143 PolarHBondContact OG-OE1 3.38Å; Q143-R146 PolarHBondContact O-N 2.85Å; Q143-A147 PolarHBondContact O-N 3.11Å
144L61.6Low63Low64 Ų6483.8 Ų83.834%0.33547%0.469SS..Hα-helixtrans-57.2-49.2169.4-76.5172.2000111.1T138 L139 S140 R146 A147 Q148T138-L144 HydrophobicContact CG2-CD1 3.89Å; T138-L144 HydrophobicContact CG2-CD2 3.95Å; T138-L144 HydrophobicContact CG2-CG 4.29Å; L139-L144 HydrophobicContact CB-CG 4.38Å; L139-L144 VanDerWaalsContact O-CD1 3.24Å; L139-L144 WeakPolarHBondContact O-CD1 3.36Å; L139-L144 WeakPolarHBondContact O-CG 3.45Å; S140-L144 PolarHBondContact O-N 3.11Å; L144-R146 VanDerWaalsContact C-N 3.29Å; L144-R146 PolarHBondContact O-N 2.85Å; L144-A147 PolarHBondContact O-N 3.05Å; L144-Q148 VanDerWaalsContact O-CB 3.24Å; L144-Q148 WeakPolarHBondContact O-CB 3.27Å; L144-Q148 VanDerWaalsContact O-CG 3.27Å; L144-Q148 WeakPolarHBondContact O-CG 3.25Å; L144-Q148 PolarHBondContact O-N 3.26Å
145A58.3Low61.3Low42 Ų4286.3 Ų86.335%0.34749%0.491SS..Hα-helixtrans-61.6-35.1178.700000112.7A141 K149A141-A145 WeakPolarHBondContact O-CB 3.49Å; A141-A145 PolarHBondContact O-N 3.37Å; A145-K149 WeakPolarHBondContact O-CB 3.42Å; A145-K149 WeakPolarHBondContact O-CG 2.99Å; A145-K149 PolarHBondContact O-N 2.87Å
146R62.7Low59.6Low183 Ų18385.3 Ų85.369%0.69148%0.478SS*.Hα-helixtrans-66.7-49.6173.4-75.3169.5178.2168.7-0.1111.8S142 Q143 L144 Q148 K149 Q150S142-R146 VanDerWaalsContact O-CG 3.31Å; S142-R146 WeakPolarHBondContact O-CG 3.31Å; S142-R146 PolarHBondContact O-N 3.04Å; S142-R146 VanDerWaalsContact O-N 3.14Å; Q143-R146 PolarHBondContact O-N 2.85Å; L144-R146 VanDerWaalsContact C-N 3.29Å; L144-R146 PolarHBondContact O-N 2.85Å; R146-Q148 VanDerWaalsContact C-N 3.34Å; R146-Q148 PolarHBondContact O-N 2.84Å; R146-K149 PolarHBondContact O-N 3.49Å; R146-Q150 PolarHBondContact O-N 3.28Å
147A58.2Low58.3Low47 Ų4790.4 Ų90.439%0.38852%0.518SS..Hα-helixtrans-64.1-37.1177.200000112.7Q143 L144 T151Q143-A147 PolarHBondContact O-N 3.11Å; L144-A147 PolarHBondContact O-N 3.05Å; A147-T151 WeakPolarHBondContact O-CB 3.36Å; A147-T151 PolarHBondContact O-N 2.99Å; A147-T151 PolarHBondContact O-OG1 3.03Å
148Q63.4Low56.9Low110 Ų11099.4 Ų99.451%0.51455%0.551SS.*Hα-helixtrans-68.3-44.4174.1-75.9177-26.200111.5L144 R146 Q150 T151 Q152L144-Q148 VanDerWaalsContact O-CB 3.24Å; L144-Q148 WeakPolarHBondContact O-CB 3.27Å; L144-Q148 VanDerWaalsContact O-CG 3.27Å; L144-Q148 WeakPolarHBondContact O-CG 3.25Å; L144-Q148 PolarHBondContact O-N 3.26Å; R146-Q148 VanDerWaalsContact C-N 3.34Å; R146-Q148 PolarHBondContact O-N 2.84Å; Q148-Q150 VanDerWaalsContact C-N 3.33Å; Q148-Q150 PolarHBondContact O-N 2.85Å; Q148-T151 CarbonylContact O-C 3.4Å; Q148-T151 PolarHBondContact O-N 3.1Å; Q148-T151 VanDerWaalsContact O-N 3.11Å; Q148-Q152 WeakPolarHBondContact O-CB 3.41Å; Q148-Q152 VanDerWaalsContact O-CG 3.3Å; Q148-Q152 WeakPolarHBondContact O-CG 3.43Å; Q148-Q152 PolarHBondContact O-N 3.24Å
149K55.7Low56.3Low142 Ų142100.4 Ų100.462%0.61756%0.559SS**Hα-helixtrans-59.4-43.2173.9-80.6-174.3175.8-168.70111.6A145 R146 T151 Q152 M153A145-K149 WeakPolarHBondContact O-CB 3.42Å; A145-K149 WeakPolarHBondContact O-CG 2.99Å; A145-K149 PolarHBondContact O-N 2.87Å; R146-K149 PolarHBondContact O-N 3.49Å; K149-T151 VanDerWaalsContact C-N 3.29Å; K149-T151 PolarHBondContact O-N 3.29Å; K149-Q152 PolarHBondContact O-N 2.86Å; K149-M153 WeakPolarHBondContact O-CG 3.47Å; K149-M153 PolarHBondContact O-N 2.81Å
150Q57.6Low57.2Low159 Ų159103.9 Ų103.974%0.74357%0.57SS**Hα-helixtrans-61.3-37175-165.8174.614.700112.3R146 Q148R146-Q150 PolarHBondContact O-N 3.28Å; Q148-Q150 VanDerWaalsContact C-N 3.33Å; Q148-Q150 PolarHBondContact O-N 2.85Å
151T55.7Low58.4Low98 Ų98103.7 Ų103.760%0.60157%0.566SS**Hα-helixtrans-74.6-35.7175.6-52.90000112.7A147 Q148 K149 A154 A155A147-T151 WeakPolarHBondContact O-CB 3.36Å; A147-T151 PolarHBondContact O-N 2.99Å; A147-T151 PolarHBondContact O-OG1 3.03Å; Q148-T151 CarbonylContact O-C 3.4Å; Q148-T151 PolarHBondContact O-N 3.1Å; Q148-T151 VanDerWaalsContact O-N 3.11Å; K149-T151 VanDerWaalsContact C-N 3.29Å; K149-T151 PolarHBondContact O-N 3.29Å; T151-A154 PolarHBondContact O-N 2.64Å; T151-A155 PolarHBondContact O-N 3.07Å
152Q55.4Low59.8Low127 Ų127100.8 Ų100.859%0.59354%0.539SS*.Hα-helixtrans-72.4-34.4179.8-77.3174.4-700111.9Q148 K149 A154 A155Q148-Q152 WeakPolarHBondContact O-CB 3.41Å; Q148-Q152 VanDerWaalsContact O-CG 3.3Å; Q148-Q152 WeakPolarHBondContact O-CG 3.43Å; Q148-Q152 PolarHBondContact O-N 3.24Å; K149-Q152 PolarHBondContact O-N 2.86Å; Q152-A154 PolarHBondContact O-N 3.28Å; Q152-A155 CarbonylContact O-C 3.44Å; Q152-A155 WeakPolarHBondContact O-CA 3.4Å; Q152-A155 WeakPolarHBondContact O-CB 3.37Å; Q152-A155 PolarHBondContact O-N 3.07Å
153M45.8Very low61.3Low162 Ų162100 Ų10080%0.79854%0.537SS*.Hα-helixtrans-63-30172.4-69.6-66.4158.600112.5K149K149-M153 WeakPolarHBondContact O-CG 3.47Å; K149-M153 PolarHBondContact O-N 2.81Å
154A48.4Very low62.5Low83 Ų8396.1 Ų96.169%0.68652%0.519SS*.Hα-helixtrans-75.7-23.8169.700000113.1T151 Q152 S156T151-A154 PolarHBondContact O-N 2.64Å; Q152-A154 PolarHBondContact O-N 3.28Å; A154-S156 PolarHBondContact O-N 2.99Å; A154-S156 VanDerWaalsContact O-N 3.09Å
155A47.1Very low63.8Low66 Ų6693.1 Ų93.155%0.54550%0.503SS..SBendtrans-85.249.3176.300000112.4T151 Q152T151-A155 PolarHBondContact O-N 3.07Å; Q152-A155 CarbonylContact O-C 3.44Å; Q152-A155 WeakPolarHBondContact O-CA 3.4Å; Q152-A155 WeakPolarHBondContact O-CB 3.37Å; Q152-A155 PolarHBondContact O-N 3.07Å
156S45.6Very low65.3Low72 Ų7292.4 Ų92.450%0.50349%0.494SS..  trans-52.4158.1179.764.50000114.2A154 R158A154-S156 PolarHBondContact O-N 2.99Å; A154-S156 VanDerWaalsContact O-N 3.09Å; S156-R158 VanDerWaalsContact C-N 3.33Å; S156-R158 PolarHBondContact O-N 3.06Å
157S54.3Low66.7Low132 Ų13286.6 Ų86.692%0.92348%0.475SS*.SBendtrans-62.482.1-172.2-165.50000113.8
158R53.1Low68.3Low191 Ų19184.4 Ų84.472%0.72146%0.457SS*.  trans-139124.5171.3-60.5-175.5-171.5-108.6-0.7108.2S156 K160S156-R158 VanDerWaalsContact C-N 3.33Å; S156-R158 PolarHBondContact O-N 3.06Å; R158-K160 PolarHBondContact O-N 3.37Å
159P62.4Low69.6Low72 Ų7279.2 Ų79.247%0.46843%0.432SS..  trans-60.6127.6177.423.8-31.5000109.6A163 I164 Y191P159-A163 HydrophobicContact CB-CB 4.43Å; P159-I164 HydrophobicContact CB-CG1 4Å; P159-I164 HydrophobicContact CG-CD1 4.11Å; P159-I164 HydrophobicContact CG-CG1 3.92Å; P159-I164 WeakPolarHBondContact O-CD1 3.26Å; P159-Y191 HydrophobicContact CG-CE1 4.42Å
160K78Confident71.2Confident161 Ų16179.3 Ų79.370%0.743%0.433SS*.  trans-62.9149.1178.3-68.4170.8-176.91660109.1R158 D162 A163 I164R158-K160 PolarHBondContact O-N 3.37Å; K160-D162 PolarHBondContact O-N 3.32Å; K160-A163 WeakPolarHBondContact O-CB 3.39Å; K160-A163 PolarHBondContact O-N 2.91Å; K160-I164 PolarHBondContact O-N 3.35Å
161M85.8Confident72.8Confident32 Ų3274.5 Ų74.516%0.15842%0.42CS..Hα-helixtrans-48.2-32.5-176.4-17877.3-88.200114I164 L165 I187 L194 A206M161-I164 HydrophobicContact CE-CB 3.99Å; M161-I164 HydrophobicContact CE-CG2 3.82Å; M161-L165 WeakPolarHBondContact O-CB 3.31Å; M161-L165 PolarHBondContact O-N 3.32Å; M161-I187 HydrophobicContact CE-CD1 4.08Å; M161-L194 HydrophobicContact CE-CD2 3.63Å; M161-L194 HydrophobicContact SD-CD2 3.64Å; M161-A206 HydrophobicContact CG-CB 3.49Å; M161-A206 VanDerWaalsContact CG-CB 3.49Å
162D85.9Confident74.3Confident20 Ų2071 Ų7111%0.10740%0.4CS..Hα-helixtrans-67.8-35.5178.1-53.3-28.6000113K160 T166 R209 R213K160-D162 PolarHBondContact O-N 3.32Å; D162-T166 WeakPolarHBondContact O-CB 3.23Å; D162-T166 PolarHBondContact O-N 2.92Å; D162-T166 PolarHBondContact O-OG1 2.82Å; D162-R209 IonicContact OD1-CZ 2.65Å; D162-R209 VanDerWaalsContact OD1-CZ 3.3Å; D162-R209 IonicContact OD1-NE 2.89Å; D162-R209 PolarHBondContact OD1-NE 3.16Å; D162-R209 VanDerWaalsContact OD1-NE 3.12Å; D162-R209 IonicContact OD1-NH2 3.61Å; D162-R209 PolarHBondContact OD1-NH2 3.41Å; D162-R209 IonicContact OD2-CZ 3.12Å; D162-R209 IonicContact OD2-NE 3.62Å; D162-R209 PolarHBondContact OD2-NE 2.89Å; D162-R209 IonicContact OD2-NH2 3.81Å; D162-R209 PolarHBondContact OD2-NH2 3.07Å; D162-R213 IonicContact OD1-NH1 2.75Å; D162-R213 IonicContact OD2-CZ 3.29Å; D162-R213 IonicContact OD2-NH1 3.3Å; D162-R213 PolarHBondContact OD2-NH1 3.37Å; D162-R213 IonicContact OD2-NH2 3.8Å
163A88Confident75.8Confident53 Ų5370.7 Ų70.744%0.43840%0.397SS..Hα-helixtrans-71.3-48176.400000110.9P159 K160 L165 T166 E167P159-A163 HydrophobicContact CB-CB 4.43Å; K160-A163 WeakPolarHBondContact O-CB 3.39Å; K160-A163 PolarHBondContact O-N 2.91Å; A163-L165 PolarHBondContact O-N 2.9Å; A163-T166 PolarHBondContact O-N 2.8Å; A163-T166 VanDerWaalsContact O-N 3.16Å; A163-E167 WeakPolarHBondContact O-CB 3.25Å; A163-E167 PolarHBondContact O-N 2.95Å
164I88.4Confident77.8Confident3 Ų368.3 Ų68.32%0.01538%0.383CS..Hα-helixtrans-56-40.5172.9-62.8175.3000110.7P159 K160 M161 A168 I187 Y191 L194P159-I164 HydrophobicContact CB-CG1 4Å; P159-I164 HydrophobicContact CG-CD1 4.11Å; P159-I164 HydrophobicContact CG-CG1 3.92Å; P159-I164 WeakPolarHBondContact O-CD1 3.26Å; K160-I164 PolarHBondContact O-N 3.35Å; M161-I164 HydrophobicContact CE-CB 3.99Å; M161-I164 HydrophobicContact CE-CG2 3.82Å; I164-A168 VanDerWaalsContact O-CB 3.25Å; I164-A168 WeakPolarHBondContact O-CB 3.4Å; I164-A168 PolarHBondContact O-N 3.46Å; I164-I187 HydrophobicContact CG2-CB 4.41Å; I164-I187 HydrophobicContact CG2-CD1 4.03Å; I164-I187 HydrophobicContact CG2-CG1 3.85Å; I164-I187 HydrophobicContact CG2-CG2 3.64Å; I164-Y191 HydrophobicContact CD1-CD1 4.46Å; I164-Y191 HydrophobicContact CD1-CG 4.41Å; I164-Y191 HydrophobicContact CG1-CE2 4.26Å; I164-Y191 HydrophobicContact CG2-CD2 3.71Å; I164-Y191 HydrophobicContact CG2-CE2 3.86Å; I164-Y191 HydrophobicContact CG2-CG 4.48Å; I164-L194 HydrophobicContact CD1-CD1 4.11Å; I164-L194 HydrophobicContact CD1-CD2 4.12Å
165L89.6Confident79.3Confident0 Ų075.1 Ų75.10%040%0.397CS..Hα-helixtrans-67-44.4177.4178.159.9000112.1M161 A163 A168 I169 I183 L203 A206 L207 E210M161-L165 WeakPolarHBondContact O-CB 3.31Å; M161-L165 PolarHBondContact O-N 3.32Å; A163-L165 PolarHBondContact O-N 2.9Å; L165-A168 PolarHBondContact O-N 3.39Å; L165-I169 HydrophobicContact CD1-CD1 3.84Å; L165-I169 HydrophobicContact CD1-CG1 4.23Å; L165-I169 HydrophobicContact CG-CD1 3.93Å; L165-I169 VanDerWaalsContact O-CG1 3.26Å; L165-I169 WeakPolarHBondContact O-CG1 3.26Å; L165-I169 PolarHBondContact O-N 3.44Å; L165-I183 HydrophobicContact CD1-CG2 3.73Å; L165-L203 HydrophobicContact CD1-CD1 3.79Å; L165-A206 HydrophobicContact CD2-CB 3.91Å; L165-L207 HydrophobicContact CD1-CD2 3.86Å; L165-L207 HydrophobicContact CD1-CG 4.16Å; L165-L207 HydrophobicContact CD2-CD2 4.11Å; L165-L207 HydrophobicContact CD2-CG 4.18Å; L165-E210 HydrophobicContact CD2-CB 4.26Å
166T90.1Very high80.8Confident27 Ų2774.9 Ų74.917%0.16639%0.392CS..Hα-helixtrans-63.5-42.6177.8-59.70000111.3D162 A163 I169 K170 V230D162-T166 WeakPolarHBondContact O-CB 3.23Å; D162-T166 PolarHBondContact O-N 2.92Å; D162-T166 PolarHBondContact O-OG1 2.82Å; A163-T166 PolarHBondContact O-N 2.8Å; A163-T166 VanDerWaalsContact O-N 3.16Å; T166-I169 PolarHBondContact O-N 3.43Å; T166-K170 WeakPolarHBondContact O-CG 3.36Å; T166-K170 PolarHBondContact O-N 3.09Å; T166-K170 VanDerWaalsContact O-N 3.09Å; T166-V230 HydrophobicContact CG2-CG1 4.22Å; T166-V230 HydrophobicContact CG2-CG2 3.99Å
167E91.5Very high82.7Confident62 Ų6271.5 Ų71.529%0.2937%0.368SS..Hα-helixtrans-60.7-50173.1-179.4-174.1-167.500111.7A163 I169 K170 A171 K190 Y191A163-E167 WeakPolarHBondContact O-CB 3.25Å; A163-E167 PolarHBondContact O-N 2.95Å; E167-I169 VanDerWaalsContact C-N 3.32Å; E167-I169 PolarHBondContact O-N 3.05Å; E167-K170 PolarHBondContact O-N 3.08Å; E167-K170 VanDerWaalsContact O-N 3.15Å; E167-A171 WeakPolarHBondContact O-CB 3.37Å; E167-A171 PolarHBondContact O-N 3.05Å; E167-K190 IonicContact OE1-NZ 2.64Å; E167-K190 PolarHBondContact OE1-NZ 3.32Å; E167-Y191 PolarHBondContact OE2-OH 3.3Å; E167-Y191 VanDerWaalsContact OE2-OH 3.07Å
168A92Very high84.4Confident0 Ų065.2 Ų65.20%032%0.324CS..Hα-helixtrans-62.8-35.2178.700000112.9I164 L165 C172 I183 Y186 I187I164-A168 VanDerWaalsContact O-CB 3.25Å; I164-A168 WeakPolarHBondContact O-CB 3.4Å; I164-A168 PolarHBondContact O-N 3.46Å; L165-A168 PolarHBondContact O-N 3.39Å; A168-C172 VanDerWaalsContact O-CB 3.27Å; A168-C172 WeakPolarHBondContact O-CB 3.26Å; A168-C172 PolarHBondContact O-N 2.97Å; A168-I183 HydrophobicContact CB-CG2 4.05Å; A168-Y186 HydrophobicContact CB-CD1 3.6Å; A168-Y186 HydrophobicContact CB-CE1 4.16Å; A168-Y186 HydrophobicContact CB-CG 4.35Å; A168-I187 HydrophobicContact CB-CD1 3.95Å; A168-I187 HydrophobicContact CB-CG1 3.73Å
169I90.9Very high86.2Confident1 Ų157.7 Ų57.71%0.00530%0.301CS..Hα-helixtrans-70-35.6175.3-67.7165.9000111.3L165 T166 E167 F173 A178 I183 I216 F228 V230L165-I169 HydrophobicContact CD1-CD1 3.84Å; L165-I169 HydrophobicContact CD1-CG1 4.23Å; L165-I169 HydrophobicContact CG-CD1 3.93Å; L165-I169 VanDerWaalsContact O-CG1 3.26Å; L165-I169 WeakPolarHBondContact O-CG1 3.26Å; L165-I169 PolarHBondContact O-N 3.44Å; T166-I169 PolarHBondContact O-N 3.43Å; E167-I169 VanDerWaalsContact C-N 3.32Å; E167-I169 PolarHBondContact O-N 3.05Å; I169-F173 PolarHBondContact O-N 3.19Å; I169-A178 HydrophobicContact CB-CB 4.33Å; I169-A178 HydrophobicContact CG1-CB 4.4Å; I169-A178 HydrophobicContact CG2-CB 4.08Å; I169-I183 HydrophobicContact CD1-CD1 4.27Å; I169-I183 HydrophobicContact CG1-CD1 3.58Å; I169-I183 HydrophobicContact CG1-CG1 4Å; I169-I216 HydrophobicContact CD1-CB 4.46Å; I169-I216 HydrophobicContact CD1-CD1 4.03Å; I169-I216 HydrophobicContact CD1-CG2 3.78Å; I169-F228 HydrophobicContact CD1-CB 4.2Å; I169-V230 HydrophobicContact CB-CG2 4.02Å; I169-V230 HydrophobicContact CG2-CG2 3.7Å
170K90.1Very high87.5Confident144 Ų14455.6 Ų55.663%0.62629%0.287SS*.Hα-helixtrans-67.6-47.4172.7-72.3177.2178-173.60111.4T166 E167 F173 V230T166-K170 WeakPolarHBondContact O-CG 3.36Å; T166-K170 PolarHBondContact O-N 3.09Å; T166-K170 VanDerWaalsContact O-N 3.09Å; E167-K170 PolarHBondContact O-N 3.08Å; E167-K170 VanDerWaalsContact O-N 3.15Å; K170-F173 WeakPolarHBondContact O-CB 3.43Å; K170-F173 PolarHBondContact O-N 3.15Å; K170-V230 HydrophobicContact CG-CG2 4.24Å
171A90.2Very high88.1Confident58 Ų5853.4 Ų53.448%0.47929%0.287SS..Hα-helixtrans-71.2-30.7-177.400000113.9E167 Y186E167-A171 WeakPolarHBondContact O-CB 3.37Å; E167-A171 PolarHBondContact O-N 3.05Å; A171-Y186 HydrophobicContact CB-CD2 4.16Å; A171-Y186 HydrophobicContact CB-CE1 4.18Å; A171-Y186 HydrophobicContact CB-CE2 3.44Å; A171-Y186 VanDerWaalsContact CB-CE2 3.44Å; A171-Y186 VanDerWaalsContact CB-CZ 3.44Å; A171-Y186 WeakPolarHBondContact CB-OH 3.43Å
172C88Confident88.3Confident25 Ų2553.1 Ų53.117%0.16929%0.29CS..THydrogen-bonded Turntrans-100.422.4174.9-63.70000113.4A168 Q174 A178 A182 Y186A168-C172 VanDerWaalsContact O-CB 3.27Å; A168-C172 WeakPolarHBondContact O-CB 3.26Å; A168-C172 PolarHBondContact O-N 2.97Å; C172-Q174 PolarHBondContact O-N 3.08Å; C172-A178 HydrophobicContact CB-CB 4.08Å; C172-A178 WeakPolarHBondContact O-CA 3.36Å; C172-A178 VanDerWaalsContact O-CB 3.24Å; C172-A178 WeakPolarHBondContact O-CB 3.43Å; C172-A182 HydrophobicContact CB-CB 3.99Å; C172-Y186 VanDerWaalsContact SG-CB 3.56Å
173F87.4Confident88.5Confident121 Ų12152.2 Ų52.253%0.53129%0.285SS..  trans-65.2133.7178.4-175.8-98.7000111.2I169 K170 V229I169-F173 PolarHBondContact O-N 3.19Å; K170-F173 WeakPolarHBondContact O-CB 3.43Å; K170-F173 PolarHBondContact O-N 3.15Å; F173-V229 HydrophobicContact CD2-CG2 4.39Å; F173-V229 HydrophobicContact CE2-CB 4.44Å; F173-V229 HydrophobicContact CE2-CG1 3.89Å; F173-V229 HydrophobicContact CE2-CG2 3.79Å
174Q85.9Confident88.6Confident112 Ų11253.9 Ų53.952%0.52328%0.28SS..  trans-131.5170.4176.1-66.5-174.9-25.600108.9C172 S176 G177C172-Q174 PolarHBondContact O-N 3.08Å; Q174-S176 PolarHBondContact O-N 3.14Å; Q174-G177 PolarHBondContact O-N 3.37Å
175K80.4Confident88.8Confident225 Ų22561.3 Ų61.398%0.97831%0.312SS*.THydrogen-bonded Turntrans-53.2-20.4179.6-64.8-175.9178.9-178.80114.5
176S78.9Confident88.9Confident61 Ų6164.2 Ų64.243%0.42732%0.323SS..THydrogen-bonded Turntrans-112.310.517758.70000114.6Q174 S227Q174-S176 PolarHBondContact O-N 3.14Å; S176-S227 WeakPolarHBondContact O-CB 3.33Å
177G86.6Confident88.9Confident1 Ų162.9 Ų62.91%0.0132%0.315CS..  trans85.7165.7-172.300000114.2Q174 F228 V229Q174-G177 PolarHBondContact O-N 3.37Å; G177-F228 CarbonylContact C-O 3.44Å; G177-F228 WeakPolarHBondContact CA-O 3.24Å; G177-V229 VanDerWaalsContact CA-CG2 3.49Å
178A89.9Confident88.9Confident0 Ų062.1 Ų62.10%031%0.313CS..EExtended strand (participates in β ladder)trans-75.2126.6-178.600000111.2I169 C172 I183 S227 F228I169-A178 HydrophobicContact CB-CB 4.33Å; I169-A178 HydrophobicContact CG1-CB 4.4Å; I169-A178 HydrophobicContact CG2-CB 4.08Å; C172-A178 HydrophobicContact CB-CB 4.08Å; C172-A178 WeakPolarHBondContact O-CA 3.36Å; C172-A178 VanDerWaalsContact O-CB 3.24Å; C172-A178 WeakPolarHBondContact O-CB 3.43Å; A178-I183 HydrophobicContact CB-CD1 4.03Å; A178-I183 HydrophobicContact CB-CG1 3.92Å; A178-S227 CarbonylContact O-C 3.54Å; A178-S227 WeakPolarHBondContact O-CA 3.44Å; A178-F228 PolarHBondContact N-O 2.91Å; A178-F228 PolarHBondContact O-N 3.34Å
179S90.5Very high88.7Confident33 Ų3370.1 Ų70.123%0.23135%0.35CS..EExtended strand (participates in β ladder)trans-81153.1178.975.10000112.4V181 A182 I183S179-V181 PolarHBondContact O-N 2.85Å; S179-V181 VanDerWaalsContact O-N 3.11Å; S179-A182 PolarHBondContact O-N 3.41Å; S179-A182 VanDerWaalsContact O-N 3.11Å; S179-A182 PolarHBondContact OG-N 3.34Å; S179-I183 WeakPolarHBondContact O-CD1 3.38Å; S179-I183 VanDerWaalsContact O-CG1 3.25Å; S179-I183 WeakPolarHBondContact O-CG1 3.43Å; S179-I183 PolarHBondContact O-N 3.11Å
180V89.3Confident88.7Confident28 Ų2874.6 Ų74.617%0.1737%0.369CS..Hα-helixtrans-52-36.1175-177.40000112.4R184 L203 L207 A224 G226 F228V180-R184 VanDerWaalsContact O-CB 3.23Å; V180-R184 WeakPolarHBondContact O-CB 3.3Å; V180-R184 PolarHBondContact O-N 3.3Å; V180-L203 HydrophobicContact CG1-CD2 4.4Å; V180-L207 HydrophobicContact CG1-CD1 4.34Å; V180-L207 HydrophobicContact CG2-CD1 4.11Å; V180-A224 WeakPolarHBondContact CG2-O 3.44Å; V180-G226 PolarHBondContact N-O 3.39Å; V180-F228 HydrophobicContact CG2-CD2 4.41Å; V180-F228 HydrophobicContact CG2-CE2 3.68Å
181V89.9Confident88.6Confident115 Ų11570.1 Ų70.170%0.69735%0.349SS*.Hα-helixtrans-70.8-44.6-178.9-176.40000110.9S179 R184 K185S179-V181 PolarHBondContact O-N 2.85Å; S179-V181 VanDerWaalsContact O-N 3.11Å; V181-R184 PolarHBondContact O-N 2.94Å; V181-K185 WeakPolarHBondContact O-CB 3.42Å; V181-K185 PolarHBondContact O-N 3.46Å
182A90.2Very high88.2Confident27 Ų2772 Ų7222%0.22336%0.356CS..Hα-helixtrans-63.9-47.5175.700000111.4C172 S179 R184 K185 Y186C172-A182 HydrophobicContact CB-CB 3.99Å; S179-A182 PolarHBondContact O-N 3.41Å; S179-A182 VanDerWaalsContact O-N 3.11Å; S179-A182 PolarHBondContact OG-N 3.34Å; A182-R184 VanDerWaalsContact C-N 3.34Å; A182-R184 PolarHBondContact O-N 2.93Å; A182-K185 PolarHBondContact O-N 2.89Å; A182-Y186 WeakPolarHBondContact O-CB 3.19Å; A182-Y186 PolarHBondContact O-N 3.49Å
183I91.1Very high87.8Confident0 Ų075.5 Ų75.50%038%0.381CS..Hα-helixtrans-56.7-47175.6-64.3161.6000110.6L165 A168 I169 A178 S179 Y186 I187 L203 F228L165-I183 HydrophobicContact CD1-CG2 3.73Å; A168-I183 HydrophobicContact CB-CG2 4.05Å; I169-I183 HydrophobicContact CD1-CD1 4.27Å; I169-I183 HydrophobicContact CG1-CD1 3.58Å; I169-I183 HydrophobicContact CG1-CG1 4Å; A178-I183 HydrophobicContact CB-CD1 4.03Å; A178-I183 HydrophobicContact CB-CG1 3.92Å; S179-I183 WeakPolarHBondContact O-CD1 3.38Å; S179-I183 VanDerWaalsContact O-CG1 3.25Å; S179-I183 WeakPolarHBondContact O-CG1 3.43Å; S179-I183 PolarHBondContact O-N 3.11Å; I183-Y186 PolarHBondContact O-N 2.91Å; I183-I187 HydrophobicContact CG2-CD1 3.71Å; I183-I187 VanDerWaalsContact O-CG1 3.26Å; I183-I187 WeakPolarHBondContact O-CG1 3.33Å; I183-I187 PolarHBondContact O-N 2.68Å; I183-L203 HydrophobicContact CG2-CD1 3.84Å; I183-L203 HydrophobicContact CG2-CD2 4.43Å; I183-F228 HydrophobicContact CD1-CD2 4.35Å
184R90.1Very high87.5Confident88 Ų8871.7 Ų71.733%0.33237%0.366SS..Hα-helixtrans-60.5-48.5176.8176.8179.1-77.1-168.8-7.3111.5V180 V181 A182 Y186 I187 I188 L203V180-R184 VanDerWaalsContact O-CB 3.23Å; V180-R184 WeakPolarHBondContact O-CB 3.3Å; V180-R184 PolarHBondContact O-N 3.3Å; V181-R184 PolarHBondContact O-N 2.94Å; A182-R184 VanDerWaalsContact C-N 3.34Å; A182-R184 PolarHBondContact O-N 2.93Å; R184-Y186 VanDerWaalsContact C-N 3.34Å; R184-Y186 PolarHBondContact O-N 3.08Å; R184-I187 PolarHBondContact O-N 3.31Å; R184-I188 HydrophobicContact CG-CD1 3.64Å; R184-I188 HydrophobicContact CG-CG1 4.41Å; R184-I188 VanDerWaalsContact O-CG1 3.31Å; R184-I188 WeakPolarHBondContact O-CG1 3.34Å; R184-I188 PolarHBondContact O-N 3.43Å; R184-L203 HydrophobicContact CB-CD2 3.82Å; R184-L203 HydrophobicContact CG-CD2 4.49Å
185K92.3Very high87.3Confident160 Ų16069.3 Ų69.370%0.69635%0.354SS*.Hα-helixtrans-61.6-42.2-179.3-170.3176.5-179-179.10111.5V181 A182 H189V181-K185 WeakPolarHBondContact O-CB 3.42Å; V181-K185 PolarHBondContact O-N 3.46Å; A182-K185 PolarHBondContact O-N 2.89Å; K185-H189 WeakPolarHBondContact O-CB 3.34Å; K185-H189 PolarHBondContact O-N 3.03Å; K185-H189 VanDerWaalsContact O-N 3.07Å
186Y91.4Very high87.5Confident60 Ų6058.7 Ų58.724%0.23531%0.309CS..Hα-helixtrans-60.8-48.5176.5-174-91.2000112.3A168 A171 C172 A182 I183 R184 H189 K190A168-Y186 HydrophobicContact CB-CD1 3.6Å; A168-Y186 HydrophobicContact CB-CE1 4.16Å; A168-Y186 HydrophobicContact CB-CG 4.35Å; A171-Y186 HydrophobicContact CB-CD2 4.16Å; A171-Y186 HydrophobicContact CB-CE1 4.18Å; A171-Y186 HydrophobicContact CB-CE2 3.44Å; A171-Y186 VanDerWaalsContact CB-CE2 3.44Å; A171-Y186 VanDerWaalsContact CB-CZ 3.44Å; A171-Y186 WeakPolarHBondContact CB-OH 3.43Å; C172-Y186 VanDerWaalsContact SG-CB 3.56Å; A182-Y186 WeakPolarHBondContact O-CB 3.19Å; A182-Y186 PolarHBondContact O-N 3.49Å; I183-Y186 PolarHBondContact O-N 2.91Å; R184-Y186 VanDerWaalsContact C-N 3.34Å; R184-Y186 PolarHBondContact O-N 3.08Å; Y186-H189 PolarHBondContact O-N 3.42Å; Y186-K190 HydrophobicContact CE1-CB 4.35Å; Y186-K190 HydrophobicContact CE1-CD 3.64Å; Y186-K190 WeakPolarHBondContact O-CB 3.29Å; Y186-K190 PolarHBondContact O-N 3.44Å; Y186-K190 WeakPolarHBondContact OH-CD 3.35Å; Y186-K190 PolarHBondContact OH-NZ 3.13Å; Y186-K190 VanDerWaalsContact OH-NZ 3.12Å
187I90.9Very high87.6Confident0 Ų063 Ų630%032%0.322CS..Hα-helixtrans-71.6-33.8-177-55.1164.4000111.1M161 I164 A168 I183 R184 Y191 L194 L196 L203M161-I187 HydrophobicContact CE-CD1 4.08Å; I164-I187 HydrophobicContact CG2-CB 4.41Å; I164-I187 HydrophobicContact CG2-CD1 4.03Å; I164-I187 HydrophobicContact CG2-CG1 3.85Å; I164-I187 HydrophobicContact CG2-CG2 3.64Å; A168-I187 HydrophobicContact CB-CD1 3.95Å; A168-I187 HydrophobicContact CB-CG1 3.73Å; I183-I187 HydrophobicContact CG2-CD1 3.71Å; I183-I187 VanDerWaalsContact O-CG1 3.26Å; I183-I187 WeakPolarHBondContact O-CG1 3.33Å; I183-I187 PolarHBondContact O-N 2.68Å; R184-I187 PolarHBondContact O-N 3.31Å; I187-Y191 HydrophobicContact CG2-CD2 4.11Å; I187-Y191 CarbonylContact O-C 3.54Å; I187-Y191 VanDerWaalsContact O-C 3.27Å; I187-Y191 VanDerWaalsContact O-CA 3.26Å; I187-Y191 WeakPolarHBondContact O-CA 3.43Å; I187-Y191 WeakPolarHBondContact O-CB 3.49Å; I187-Y191 PolarHBondContact O-N 3.18Å; I187-L194 HydrophobicContact CG2-CD2 3.94Å; I187-L196 HydrophobicContact CB-CD1 3.76Å; I187-L196 HydrophobicContact CD1-CD1 4.35Å; I187-L196 HydrophobicContact CG2-CD1 3.4Å; I187-L196 VanDerWaalsContact CG2-CD1 3.4Å; I187-L203 HydrophobicContact CD1-CD1 4.21Å
188I90.7Very high87.3Confident46 Ų4672.6 Ų72.624%0.23636%0.358CS..Hα-helixtrans-60.7-46171.3-69.5165.3000110.6R184 P192 L196 E197R184-I188 HydrophobicContact CG-CD1 3.64Å; R184-I188 HydrophobicContact CG-CG1 4.41Å; R184-I188 VanDerWaalsContact O-CG1 3.31Å; R184-I188 WeakPolarHBondContact O-CG1 3.34Å; R184-I188 PolarHBondContact O-N 3.43Å; I188-P192 WeakPolarHBondContact O-CA 3.2Å; I188-L196 HydrophobicContact CG1-CB 3.98Å; I188-E197 HydrophobicContact CD1-CG 3.66Å; I188-E197 HydrophobicContact CG1-CG 4.19Å; I188-E197 HydrophobicContact CG2-CG 4.46Å
189H88.6Confident86.9Confident167 Ų16778.2 Ų78.277%0.77338%0.379SS*.Hα-helixtrans-72.4-36.1-177.6-167.3-64.8000113.6K185 Y186K185-H189 WeakPolarHBondContact O-CB 3.34Å; K185-H189 PolarHBondContact O-N 3.03Å; K185-H189 VanDerWaalsContact O-N 3.07Å; Y186-H189 PolarHBondContact O-N 3.42Å
190K90.3Very high86.4Confident95 Ų9577 Ų7741%0.41337%0.372SS..Hα-helixtrans-92.2-26.8-177.3-164.1173.5-170-177.10113.7E167 Y186E167-K190 IonicContact OE1-NZ 2.64Å; E167-K190 PolarHBondContact OE1-NZ 3.32Å; Y186-K190 HydrophobicContact CE1-CB 4.35Å; Y186-K190 HydrophobicContact CE1-CD 3.64Å; Y186-K190 WeakPolarHBondContact O-CB 3.29Å; Y186-K190 PolarHBondContact O-N 3.44Å; Y186-K190 WeakPolarHBondContact OH-CD 3.35Å; Y186-K190 PolarHBondContact OH-NZ 3.13Å; Y186-K190 VanDerWaalsContact OH-NZ 3.12Å
191Y87.1Confident86.3Confident50 Ų5082.5 Ų82.520%0.19639%0.391CS..  trans-134.263.4-177.7-60.9-76.9000111.1P159 I164 E167 I187 S193 L194P159-Y191 HydrophobicContact CG-CE1 4.42Å; I164-Y191 HydrophobicContact CD1-CD1 4.46Å; I164-Y191 HydrophobicContact CD1-CG 4.41Å; I164-Y191 HydrophobicContact CG1-CE2 4.26Å; I164-Y191 HydrophobicContact CG2-CD2 3.71Å; I164-Y191 HydrophobicContact CG2-CE2 3.86Å; I164-Y191 HydrophobicContact CG2-CG 4.48Å; E167-Y191 PolarHBondContact OE2-OH 3.3Å; E167-Y191 VanDerWaalsContact OE2-OH 3.07Å; I187-Y191 HydrophobicContact CG2-CD2 4.11Å; I187-Y191 CarbonylContact O-C 3.54Å; I187-Y191 VanDerWaalsContact O-C 3.27Å; I187-Y191 VanDerWaalsContact O-CA 3.26Å; I187-Y191 WeakPolarHBondContact O-CA 3.43Å; I187-Y191 WeakPolarHBondContact O-CB 3.49Å; I187-Y191 PolarHBondContact O-N 3.18Å; Y191-S193 PolarHBondContact O-N 3.31Å; Y191-S193 VanDerWaalsContact O-N 3.09Å; Y191-L194 WeakPolarHBondContact O-CB 3.47Å; Y191-L194 PolarHBondContact O-N 3.01Å
192P82.5Confident86.3Confident98 Ų9879.5 Ų79.564%0.63637%0.371SS*.G310 helixtrans-57.3-28.5179.123-34000112.7I188 L194 E195I188-P192 WeakPolarHBondContact O-CA 3.2Å; P192-L194 PolarHBondContact O-N 2.98Å; P192-L194 VanDerWaalsContact O-N 3.08Å; P192-E195 PolarHBondContact O-N 2.98Å
193S80.6Confident86.2Confident98 Ų9878.2 Ų78.269%0.68536%0.36SS*.G310 helixtrans-62.8-8.1174.257.50000115.5Y191Y191-S193 PolarHBondContact O-N 3.31Å; Y191-S193 VanDerWaalsContact O-N 3.09Å
194L81.2Confident86Confident42 Ų4284.1 Ų84.122%0.2239%0.386CS..G310 helixtrans-85-11.3171.5-11171.2000114M161 I164 I187 Y191 P192 L196M161-L194 HydrophobicContact CE-CD2 3.63Å; M161-L194 HydrophobicContact SD-CD2 3.64Å; I164-L194 HydrophobicContact CD1-CD1 4.11Å; I164-L194 HydrophobicContact CD1-CD2 4.12Å; I187-L194 HydrophobicContact CG2-CD2 3.94Å; Y191-L194 WeakPolarHBondContact O-CB 3.47Å; Y191-L194 PolarHBondContact O-N 3.01Å; P192-L194 PolarHBondContact O-N 2.98Å; P192-L194 VanDerWaalsContact O-N 3.08Å; L194-L196 HydrophobicContact CB-CD1 4.43Å; L194-L196 HydrophobicContact CB-CG 4.3Å; L194-L196 HydrophobicContact CD2-CD1 4.1Å; L194-L196 PolarHBondContact O-N 3.35Å; L194-L196 VanDerWaalsContact O-N 3.15Å
195E82Confident86Confident61 Ų6185.8 Ų85.829%0.28540%0.397SS..  trans50.437.8177.9-155.2-171.7-162.400113.8P192 E197 R198 R199P192-E195 PolarHBondContact O-N 2.98Å; E195-E197 PolarHBondContact O-N 2.72Å; E195-E197 VanDerWaalsContact O-N 3.08Å; E195-R198 HydrophobicContact CG-CB 4.29Å; E195-R198 HydrophobicContact CG-CG 4.42Å; E195-R198 PolarHBondContact O-N 3.18Å; E195-R198 VanDerWaalsContact O-N 3.14Å; E195-R198 WeakPolarHBondContact OE1-CD 3.48Å; E195-R198 IonicContact OE1-CZ 3.65Å; E195-R198 IonicContact OE1-NE 3.85Å; E195-R198 IonicContact OE1-NH1 2.68Å; E195-R198 PolarHBondContact OE1-NH1 3.32Å; E195-R199 HydrophobicContact CB-CG 4.33Å; E195-R199 WeakPolarHBondContact O-CB 3.48Å; E195-R199 PolarHBondContact O-N 3.25Å; E195-R199 IonicContact OE2-CZ 2.75Å; E195-R199 IonicContact OE2-NE 3.38Å; E195-R199 PolarHBondContact OE2-NE 3.16Å; E195-R199 IonicContact OE2-NH2 3.72Å; E195-R199 PolarHBondContact OE2-NH2 3.35Å
196L83.3Confident85.8Confident3 Ų378.2 Ų78.22%0.01637%0.365CS..THydrogen-bonded Turntrans-67.4-12-168.7-97.6171.1000115.5I187 I188 L194 G200 L202 L203I187-L196 HydrophobicContact CB-CD1 3.76Å; I187-L196 HydrophobicContact CD1-CD1 4.35Å; I187-L196 HydrophobicContact CG2-CD1 3.4Å; I187-L196 VanDerWaalsContact CG2-CD1 3.4Å; I188-L196 HydrophobicContact CG1-CB 3.98Å; L194-L196 HydrophobicContact CB-CD1 4.43Å; L194-L196 HydrophobicContact CB-CG 4.3Å; L194-L196 HydrophobicContact CD2-CD1 4.1Å; L194-L196 PolarHBondContact O-N 3.35Å; L194-L196 VanDerWaalsContact O-N 3.15Å; L196-G200 VanDerWaalsContact O-CA 3.3Å; L196-G200 WeakPolarHBondContact O-CA 3.44Å; L196-G200 PolarHBondContact O-N 3.2Å; L196-L202 HydrophobicContact CD2-CB 4.43Å; L196-L203 HydrophobicContact CD2-CB 3.77Å
197E80.5Confident85.7Confident151 Ų15175.4 Ų75.471%0.70635%0.354SS*.THydrogen-bonded Turntrans-64.1-52.7169.7-64179.6169.900110.6I188 E195I188-E197 HydrophobicContact CD1-CG 3.66Å; I188-E197 HydrophobicContact CG1-CG 4.19Å; I188-E197 HydrophobicContact CG2-CG 4.46Å; E195-E197 PolarHBondContact O-N 2.72Å; E195-E197 VanDerWaalsContact O-N 3.08Å
198R80.5Confident85.6Confident202 Ų20281.2 Ų81.276%0.76238%0.379SS*.THydrogen-bonded Turntrans-78.4-38.9174.6-58-167.9-176.1135.3-7.9111.7E195 G200E195-R198 HydrophobicContact CG-CB 4.29Å; E195-R198 HydrophobicContact CG-CG 4.42Å; E195-R198 PolarHBondContact O-N 3.18Å; E195-R198 VanDerWaalsContact O-N 3.14Å; E195-R198 WeakPolarHBondContact OE1-CD 3.48Å; E195-R198 IonicContact OE1-CZ 3.65Å; E195-R198 IonicContact OE1-NE 3.85Å; E195-R198 IonicContact OE1-NH1 2.68Å; E195-R198 PolarHBondContact OE1-NH1 3.32Å; R198-G200 PolarHBondContact O-N 3.31Å
199R82.4Confident85.5Confident118 Ų11883.6 Ų83.645%0.44539%0.385SS..  trans-95.729.9-172.6-53.7-172.9-166-156.13.3114.2E195 Y201 L202E195-R199 HydrophobicContact CB-CG 4.33Å; E195-R199 WeakPolarHBondContact O-CB 3.48Å; E195-R199 PolarHBondContact O-N 3.25Å; E195-R199 IonicContact OE2-CZ 2.75Å; E195-R199 IonicContact OE2-NE 3.38Å; E195-R199 PolarHBondContact OE2-NE 3.16Å; E195-R199 IonicContact OE2-NH2 3.72Å; E195-R199 PolarHBondContact OE2-NH2 3.35Å; R199-Y201 HydrophobicContact CB-CE1 4.08Å; R199-Y201 PolarHBondContact O-N 3.46Å; R199-L202 HydrophobicContact CB-CD1 3.76Å; R199-L202 HydrophobicContact CB-CG 4.24Å; R199-L202 WeakPolarHBondContact O-CB 2.77Å; R199-L202 PolarHBondContact O-N 2.7Å
200G80.5Confident85.4Confident9 Ų976.1 Ų76.19%0.09335%0.35CS..THydrogen-bonded Turntrans-59.4-5.9-174.600000116.7L196 R198L196-G200 VanDerWaalsContact O-CA 3.3Å; L196-G200 WeakPolarHBondContact O-CA 3.44Å; L196-G200 PolarHBondContact O-N 3.2Å; R198-G200 PolarHBondContact O-N 3.31Å
201Y87Confident85.3Confident142 Ų14273.9 Ų73.956%0.55734%0.343SS*.Hα-helixtrans-74.8-30.717070.2-87.9000113R199 L203 K204 Q205R199-Y201 HydrophobicContact CB-CE1 4.08Å; R199-Y201 PolarHBondContact O-N 3.46Å; Y201-L203 VanDerWaalsContact C-N 3.33Å; Y201-L203 PolarHBondContact O-N 3.24Å; Y201-K204 WeakPolarHBondContact O-CB 3.39Å; Y201-K204 PolarHBondContact O-N 2.75Å; Y201-K204 VanDerWaalsContact O-N 3.13Å; Y201-Q205 PolarHBondContact O-N 3.29Å
202L88.3Confident85.3Confident52 Ų5278 Ų7827%0.27236%0.364SS..Hα-helixtrans-59.9-44.3179.8-67.1175000111.3L196 R199 Q205 A206L196-L202 HydrophobicContact CD2-CB 4.43Å; R199-L202 HydrophobicContact CB-CD1 3.76Å; R199-L202 HydrophobicContact CB-CG 4.24Å; R199-L202 WeakPolarHBondContact O-CB 2.77Å; R199-L202 PolarHBondContact O-N 2.7Å; L202-Q205 PolarHBondContact O-N 2.72Å; L202-A206 WeakPolarHBondContact O-CB 3.44Å; L202-A206 PolarHBondContact O-N 2.7Å
203L88.8Confident85.3Confident1 Ų178.8 Ų78.81%0.00535%0.354CS..Hα-helixtrans-62.6-41.4174.9178.160000112.2L165 V180 I183 R184 I187 L196 Y201 Q205 A206 L207L165-L203 HydrophobicContact CD1-CD1 3.79Å; V180-L203 HydrophobicContact CG1-CD2 4.4Å; I183-L203 HydrophobicContact CG2-CD1 3.84Å; I183-L203 HydrophobicContact CG2-CD2 4.43Å; R184-L203 HydrophobicContact CB-CD2 3.82Å; R184-L203 HydrophobicContact CG-CD2 4.49Å; I187-L203 HydrophobicContact CD1-CD1 4.21Å; L196-L203 HydrophobicContact CD2-CB 3.77Å; Y201-L203 VanDerWaalsContact C-N 3.33Å; Y201-L203 PolarHBondContact O-N 3.24Å; L203-Q205 VanDerWaalsContact C-N 3.34Å; L203-Q205 PolarHBondContact O-N 2.9Å; L203-A206 PolarHBondContact O-N 3.01Å; L203-L207 HydrophobicContact CD1-CD1 4.09Å; L203-L207 HydrophobicContact CD1-CG 4.2Å; L203-L207 HydrophobicContact CG-CD1 4.04Å; L203-L207 WeakPolarHBondContact O-CB 3.16Å; L203-L207 WeakPolarHBondContact O-CG 3.46Å; L203-L207 PolarHBondContact O-N 3.12Å
204K87.7Confident85.4Confident124 Ų12475.6 Ų75.654%0.53934%0.337SS..Hα-helixtrans-63.6-40176-68.2-179.2178.2-1790111.7Y201 K208 A224Y201-K204 WeakPolarHBondContact O-CB 3.39Å; Y201-K204 PolarHBondContact O-N 2.75Å; Y201-K204 VanDerWaalsContact O-N 3.13Å; K204-K208 WeakPolarHBondContact O-CB 3.5Å; K204-K208 PolarHBondContact O-N 2.86Å; K204-K208 VanDerWaalsContact O-N 3.08Å; K204-A224 HydrophobicContact CB-CB 4.32Å; K204-A224 HydrophobicContact CG-CB 4.43Å
205Q89.2Confident85.6Confident122 Ų12275.9 Ų75.957%0.5734%0.338SS*.Hα-helixtrans-69.5-41.2178.7-172.1176.25.400111.9Y201 L202 L203 K208 R209Y201-Q205 PolarHBondContact O-N 3.29Å; L202-Q205 PolarHBondContact O-N 2.72Å; L203-Q205 VanDerWaalsContact C-N 3.34Å; L203-Q205 PolarHBondContact O-N 2.9Å; Q205-K208 PolarHBondContact O-N 2.95Å; Q205-R209 WeakPolarHBondContact O-CB 3.48Å; Q205-R209 PolarHBondContact O-N 2.85Å
206A88.1Confident85.8Confident2 Ų273.1 Ų73.12%0.01733%0.325CS..Hα-helixtrans-65.6-49.5175.200000111.9M161 L165 L202 L203 K208 R209 E210M161-A206 HydrophobicContact CG-CB 3.49Å; M161-A206 VanDerWaalsContact CG-CB 3.49Å; L165-A206 HydrophobicContact CD2-CB 3.91Å; L202-A206 WeakPolarHBondContact O-CB 3.44Å; L202-A206 PolarHBondContact O-N 2.7Å; L203-A206 PolarHBondContact O-N 3.01Å; A206-K208 VanDerWaalsContact C-N 3.28Å; A206-K208 PolarHBondContact O-N 2.68Å; A206-R209 PolarHBondContact O-N 2.75Å; A206-R209 VanDerWaalsContact O-N 3.11Å; A206-E210 WeakPolarHBondContact O-CB 3.4Å; A206-E210 PolarHBondContact O-N 3.29Å
207L89.4Confident86Confident0 Ų080.8 Ų80.80%035%0.354CS..Hα-helixtrans-53.7-44.8174.3-79.9166.9000111.8L165 V180 L203 E210 L211 I216 F228L165-L207 HydrophobicContact CD1-CD2 3.86Å; L165-L207 HydrophobicContact CD1-CG 4.16Å; L165-L207 HydrophobicContact CD2-CD2 4.11Å; L165-L207 HydrophobicContact CD2-CG 4.18Å; V180-L207 HydrophobicContact CG1-CD1 4.34Å; V180-L207 HydrophobicContact CG2-CD1 4.11Å; L203-L207 HydrophobicContact CD1-CD1 4.09Å; L203-L207 HydrophobicContact CD1-CG 4.2Å; L203-L207 HydrophobicContact CG-CD1 4.04Å; L203-L207 WeakPolarHBondContact O-CB 3.16Å; L203-L207 WeakPolarHBondContact O-CG 3.46Å; L203-L207 PolarHBondContact O-N 3.12Å; L207-E210 PolarHBondContact O-N 3.47Å; L207-L211 WeakPolarHBondContact O-CB 3.3Å; L207-L211 WeakPolarHBondContact O-CD1 3.45Å; L207-L211 VanDerWaalsContact O-CG 3.24Å; L207-L211 WeakPolarHBondContact O-CG 3.35Å; L207-L211 PolarHBondContact O-N 3.44Å; L207-I216 HydrophobicContact CD2-CD1 3.69Å; L207-F228 HydrophobicContact CD1-CE2 4.27Å; L207-F228 HydrophobicContact CD2-CD2 3.72Å; L207-F228 HydrophobicContact CD2-CE2 3.91Å; L207-F228 HydrophobicContact CD2-CG 4.09Å; L207-F228 HydrophobicContact CD2-CZ 4.45Å
208K88.7Confident86.5Confident122 Ų12276.1 Ų76.153%0.5333%0.332SS..Hα-helixtrans-61.9-47.6176.3-179.8174.7169.6177.80112.1K204 Q205 A206 E210 L211 E212K204-K208 WeakPolarHBondContact O-CB 3.5Å; K204-K208 PolarHBondContact O-N 2.86Å; K204-K208 VanDerWaalsContact O-N 3.08Å; Q205-K208 PolarHBondContact O-N 2.95Å; A206-K208 VanDerWaalsContact C-N 3.28Å; A206-K208 PolarHBondContact O-N 2.68Å; K208-E210 VanDerWaalsContact C-N 3.31Å; K208-E210 PolarHBondContact O-N 3.06Å; K208-L211 PolarHBondContact O-N 2.97Å; K208-E212 WeakPolarHBondContact CE-OE1 3.39Å; K208-E212 IonicContact NZ-OE1 2.73Å; K208-E212 WeakPolarHBondContact O-CG 3.38Å; K208-E212 PolarHBondContact O-N 3.01Å
209R88.4Confident86.8Confident97 Ų9770 Ų7037%0.36632%0.317SS..Hα-helixtrans-60.6-39.9178.4174.6167.468.6-159.61.2112.4D162 Q205 A206 E212 R213D162-R209 IonicContact OD1-CZ 2.65Å; D162-R209 VanDerWaalsContact OD1-CZ 3.3Å; D162-R209 IonicContact OD1-NE 2.89Å; D162-R209 PolarHBondContact OD1-NE 3.16Å; D162-R209 VanDerWaalsContact OD1-NE 3.12Å; D162-R209 IonicContact OD1-NH2 3.61Å; D162-R209 PolarHBondContact OD1-NH2 3.41Å; D162-R209 IonicContact OD2-CZ 3.12Å; D162-R209 IonicContact OD2-NE 3.62Å; D162-R209 PolarHBondContact OD2-NE 2.89Å; D162-R209 IonicContact OD2-NH2 3.81Å; D162-R209 PolarHBondContact OD2-NH2 3.07Å; Q205-R209 WeakPolarHBondContact O-CB 3.48Å; Q205-R209 PolarHBondContact O-N 2.85Å; A206-R209 PolarHBondContact O-N 2.75Å; A206-R209 VanDerWaalsContact O-N 3.11Å; R209-E212 PolarHBondContact O-N 3.49Å; R209-R213 WeakPolarHBondContact O-CG 3.47Å; R209-R213 PolarHBondContact O-N 3.31Å
210E87.1Confident86.7Confident9 Ų971.6 Ų71.64%0.04233%0.327CS..Hα-helixtrans-79.2-26.7-174.9-141.663.4179.700112.6L165 A206 L207 K208 R213 G214 I215 I216L165-E210 HydrophobicContact CD2-CB 4.26Å; A206-E210 WeakPolarHBondContact O-CB 3.4Å; A206-E210 PolarHBondContact O-N 3.29Å; L207-E210 PolarHBondContact O-N 3.47Å; K208-E210 VanDerWaalsContact C-N 3.31Å; K208-E210 PolarHBondContact O-N 3.06Å; E210-R213 IonicContact OE1-NH1 3.7Å; E210-R213 WeakPolarHBondContact OE2-CD 3.37Å; E210-R213 IonicContact OE2-CZ 3.82Å; E210-R213 IonicContact OE2-NE 2.68Å; E210-R213 IonicContact OE2-NH1 3.01Å; E210-R213 PolarHBondContact OE2-NH1 3.03Å; E210-G214 PolarHBondContact O-N 2.75Å; E210-I215 HydrophobicContact CG-CB 4.01Å; E210-I215 HydrophobicContact CG-CG2 4.08Å; E210-I215 PolarHBondContact O-N 3.41Å; E210-I215 WeakPolarHBondContact OE1-CD1 3.47Å; E210-I216 HydrophobicContact CB-CD1 3.94Å; E210-I216 HydrophobicContact CB-CG1 3.95Å; E210-I216 HydrophobicContact CG-CG1 4.37Å; E210-I216 HydrophobicContact CG-CG2 4.14Å; E210-I216 PolarHBondContact O-N 3Å
211L88.9Confident86.8Confident48 Ų4873.8 Ų73.825%0.25135%0.35SS..Hα-helixtrans-66.4-46.1163.3-74.2162.6000111.7L207 K208 R213 G214 I216 Q218 F228L207-L211 WeakPolarHBondContact O-CB 3.3Å; L207-L211 WeakPolarHBondContact O-CD1 3.45Å; L207-L211 VanDerWaalsContact O-CG 3.24Å; L207-L211 WeakPolarHBondContact O-CG 3.35Å; L207-L211 PolarHBondContact O-N 3.44Å; K208-L211 PolarHBondContact O-N 2.97Å; L211-R213 PolarHBondContact O-N 3.28Å; L211-G214 PolarHBondContact O-N 3.04Å; L211-I216 HydrophobicContact CD2-CG1 4.12Å; L211-I216 HydrophobicContact CG-CD1 4.2Å; L211-I216 HydrophobicContact CG-CG1 4.03Å; L211-Q218 HydrophobicContact CD2-CB 3.97Å; L211-F228 HydrophobicContact CD1-CE1 3.75Å; L211-F228 HydrophobicContact CD1-CZ 4.38Å; L211-F228 HydrophobicContact CD2-CD1 4Å; L211-F228 HydrophobicContact CD2-CE1 3.87Å; L211-F228 HydrophobicContact CG-CD1 4.49Å; L211-F228 HydrophobicContact CG-CE1 4.18Å
212E85.9Confident86.3Confident138 Ų13876.4 Ų76.465%0.64536%0.364SS*.Hα-helixtrans-63.3-27.6178.3-74.9171.5166.900112.6K208 R209K208-E212 WeakPolarHBondContact CE-OE1 3.39Å; K208-E212 IonicContact NZ-OE1 2.73Å; K208-E212 WeakPolarHBondContact O-CG 3.38Å; K208-E212 PolarHBondContact O-N 3.01Å; R209-E212 PolarHBondContact O-N 3.49Å
213R83.3Confident85.6Confident113 Ų11375.8 Ų75.843%0.42637%0.37SS..THydrogen-bonded Turntrans-81-13.4171.4-73.3164.2166.6172-7.2114.4D162 R209 E210 L211 I215D162-R213 IonicContact OD1-NH1 2.75Å; D162-R213 IonicContact OD2-CZ 3.29Å; D162-R213 IonicContact OD2-NH1 3.3Å; D162-R213 PolarHBondContact OD2-NH1 3.37Å; D162-R213 IonicContact OD2-NH2 3.8Å; R209-R213 WeakPolarHBondContact O-CG 3.47Å; R209-R213 PolarHBondContact O-N 3.31Å; E210-R213 IonicContact OE1-NH1 3.7Å; E210-R213 WeakPolarHBondContact OE2-CD 3.37Å; E210-R213 IonicContact OE2-CZ 3.82Å; E210-R213 IonicContact OE2-NE 2.68Å; E210-R213 IonicContact OE2-NH1 3.01Å; E210-R213 PolarHBondContact OE2-NH1 3.03Å; L211-R213 PolarHBondContact O-N 3.28Å; R213-I215 HydrophobicContact CB-CD1 3.91Å; R213-I215 HydrophobicContact CB-CG1 4.05Å; R213-I215 PolarHBondContact O-N 3.5Å
214G81.9Confident84.8Confident32 Ų3277.4 Ų77.433%0.3338%0.384SS..THydrogen-bonded Turntrans70.78.3-174.400000115.4E210 L211 I216E210-G214 PolarHBondContact O-N 2.75Å; L211-G214 PolarHBondContact O-N 3.04Å; G214-I216 VanDerWaalsContact C-N 3.34Å
215I84.8Confident84.4Confident47 Ų4775.6 Ų75.624%0.24139%0.387CS..SBendtrans-73.6-29.3179.1-67.1167.3000110.9E210 R213 V231 A234E210-I215 HydrophobicContact CG-CB 4.01Å; E210-I215 HydrophobicContact CG-CG2 4.08Å; E210-I215 PolarHBondContact O-N 3.41Å; E210-I215 WeakPolarHBondContact OE1-CD1 3.47Å; R213-I215 HydrophobicContact CB-CD1 3.91Å; R213-I215 HydrophobicContact CB-CG1 4.05Å; R213-I215 PolarHBondContact O-N 3.5Å; I215-V231 PolarHBondContact O-N 3.25Å; I215-A234 HydrophobicContact CB-CB 4.26Å; I215-A234 HydrophobicContact CG1-CB 3.8Å
216I87.5Confident84.2Confident3 Ų370.6 Ų70.62%0.01537%0.368CS..EExtended strand (participates in β ladder)trans-119.8143.3168.268.3175.4000110.6I169 L207 E210 L211 G214 F228 V229 V230I169-I216 HydrophobicContact CD1-CB 4.46Å; I169-I216 HydrophobicContact CD1-CD1 4.03Å; I169-I216 HydrophobicContact CD1-CG2 3.78Å; L207-I216 HydrophobicContact CD2-CD1 3.69Å; E210-I216 HydrophobicContact CB-CD1 3.94Å; E210-I216 HydrophobicContact CB-CG1 3.95Å; E210-I216 HydrophobicContact CG-CG1 4.37Å; E210-I216 HydrophobicContact CG-CG2 4.14Å; E210-I216 PolarHBondContact O-N 3Å; L211-I216 HydrophobicContact CD2-CG1 4.12Å; L211-I216 HydrophobicContact CG-CD1 4.2Å; L211-I216 HydrophobicContact CG-CG1 4.03Å; G214-I216 VanDerWaalsContact C-N 3.34Å; I216-F228 HydrophobicContact CD1-CB 4.33Å; I216-F228 HydrophobicContact CD1-CD1 4.16Å; I216-F228 HydrophobicContact CD1-CG 4.28Å; I216-V229 CarbonylContact C-O 3.58Å; I216-V229 VanDerWaalsContact CA-O 3.31Å; I216-V229 WeakPolarHBondContact CA-O 3.1Å; I216-V230 HydrophobicContact CG2-CG2 4.37Å
217R88.1Confident84.2Confident165 Ų16571.3 Ų71.362%0.62337%0.373SS*.EExtended strand (participates in β ladder)trans-108133.7174-171.9173.771.4-169.52.3110.1V219 F228 V229 V231R217-V219 PolarHBondContact O-N 3.28Å; R217-F228 WeakPolarHBondContact O-CA 3.45Å; R217-V229 PolarHBondContact N-O 3.35Å; R217-V229 PolarHBondContact O-N 3.09Å; R217-V231 HydrophobicContact CB-CG2 3.7Å
218Q89.1Confident84.2Confident52 Ų5271.3 Ų71.324%0.24337%0.373CS..EExtended strand (participates in β ladder)trans-73.1121168-174.6152.138.600109.7L211 K220 G221 G223 S225 F228L211-Q218 HydrophobicContact CD2-CB 3.97Å; Q218-K220 WeakPolarHBondContact CG-O 3.36Å; Q218-K220 PolarHBondContact NE2-O 3.08Å; Q218-G221 VanDerWaalsContact NE2-C 3.28Å; Q218-G223 PolarHBondContact NE2-O 3.48Å; Q218-G223 VanDerWaalsContact OE1-N 3.09Å; Q218-G223 PolarHBondContact OE1-O 3.36Å; Q218-S225 PolarHBondContact NE2-O 2.95Å; Q218-F228 HydrophobicContact CB-CD1 4.08Å; Q218-F228 HydrophobicContact CB-CE1 3.78Å; Q218-F228 HydrophobicContact CG-CD1 4.45Å; Q218-F228 HydrophobicContact CG-CE1 3.87Å
219V86.8Confident84.3Confident73 Ų7367.1 Ų67.144%0.44236%0.357SS..EExtended strand (participates in β ladder)trans-94.9-33.4176.61750000111.3R217 S227 V229R217-V219 PolarHBondContact O-N 3.28Å; V219-S227 PolarHBondContact N-O 2.93Å; V219-V229 HydrophobicContact CG2-CB 4.19Å; V219-V229 HydrophobicContact CG2-CG2 3.57Å
220K82Confident84.3Confident153 Ų15363.9 Ų63.967%0.66535%0.348SS*.EExtended strand (participates in β ladder)trans-143150.1178.7-167.9169-177.21740110.2Q218 G226 S227Q218-K220 WeakPolarHBondContact CG-O 3.36Å; Q218-K220 PolarHBondContact NE2-O 3.08Å; K220-G226 CarbonylContact O-C 3.49Å; K220-G226 WeakPolarHBondContact O-CA 3.33Å; K220-S227 PolarHBondContact O-N 2.97Å
221G82.4Confident84.2Confident55 Ų5565.8 Ų65.857%0.56736%0.361SS*.EExtended strand (participates in β ladder)trans89.6-168.418000000113.8Q218 S225Q218-G221 VanDerWaalsContact NE2-C 3.28Å; G221-S225 CarbonylContact C-O 3.55Å; G221-S225 WeakPolarHBondContact CA-O 3.32Å
222K76Confident83.2Confident196 Ų19669.1 Ų69.185%0.85239%0.388SS*.EExtended strand (participates in β ladder)trans-144.4124-177.5-167.3171.4-175.7175.70110.4S225K222-S225 PolarHBondContact N-O 2.85Å; K222-S225 VanDerWaalsContact N-O 3.1Å
223G74.6Confident81.8Confident39 Ų3969.1 Ų69.140%0.40239%0.392SS..THydrogen-bonded Turntrans67.7-148.5-175.300000111.7Q218 S225Q218-G223 PolarHBondContact NE2-O 3.48Å; Q218-G223 VanDerWaalsContact OE1-N 3.09Å; Q218-G223 PolarHBondContact OE1-O 3.36Å; G223-S225 PolarHBondContact O-N 2.98Å
224A71.5Confident80.2Confident35 Ų3566 Ų6629%0.28939%0.39SS..THydrogen-bonded Turntrans-70.912.1-175.200000115.6V180 K204V180-A224 WeakPolarHBondContact CG2-O 3.44Å; K204-A224 HydrophobicContact CB-CB 4.32Å; K204-A224 HydrophobicContact CG-CB 4.43Å
225S77.7Confident78.5Confident87 Ų8767.9 Ų67.961%0.60841%0.41SS*.EExtended strand (participates in β ladder)trans-117.4119.3171.9-174.70000109.5Q218 G221 K222 G223Q218-S225 PolarHBondContact NE2-O 2.95Å; G221-S225 CarbonylContact C-O 3.55Å; G221-S225 WeakPolarHBondContact CA-O 3.32Å; K222-S225 PolarHBondContact N-O 2.85Å; K222-S225 VanDerWaalsContact N-O 3.1Å; G223-S225 PolarHBondContact O-N 2.98Å
226G85.7Confident76.6Confident17 Ų1774.9 Ų74.918%0.17544%0.439CS..EExtended strand (participates in β ladder)trans162.1-164.9-174.900000116.4V180 K220V180-G226 PolarHBondContact N-O 3.39Å; K220-G226 CarbonylContact O-C 3.49Å; K220-G226 WeakPolarHBondContact O-CA 3.33Å
227S87.8Confident74.5Confident16 Ų1680.2 Ų80.211%0.11247%0.472CS..EExtended strand (participates in β ladder)trans-113.7137.9168.1-60.10000110.2S176 A178 V219 K220S176-S227 WeakPolarHBondContact O-CB 3.33Å; A178-S227 CarbonylContact O-C 3.54Å; A178-S227 WeakPolarHBondContact O-CA 3.44Å; V219-S227 PolarHBondContact N-O 2.93Å; K220-S227 PolarHBondContact O-N 2.97Å
228F90.5Very high72.3Confident0 Ų078.8 Ų78.80%048%0.481CS..EExtended strand (participates in β ladder)trans-125.8149.7-171.7-58.9-75.5000112.1I169 G177 A178 V180 I183 L207 L211 I216 R217 Q218I169-F228 HydrophobicContact CD1-CB 4.2Å; G177-F228 CarbonylContact C-O 3.44Å; G177-F228 WeakPolarHBondContact CA-O 3.24Å; A178-F228 PolarHBondContact N-O 2.91Å; A178-F228 PolarHBondContact O-N 3.34Å; V180-F228 HydrophobicContact CG2-CD2 4.41Å; V180-F228 HydrophobicContact CG2-CE2 3.68Å; I183-F228 HydrophobicContact CD1-CD2 4.35Å; L207-F228 HydrophobicContact CD1-CE2 4.27Å; L207-F228 HydrophobicContact CD2-CD2 3.72Å; L207-F228 HydrophobicContact CD2-CE2 3.91Å; L207-F228 HydrophobicContact CD2-CG 4.09Å; L207-F228 HydrophobicContact CD2-CZ 4.45Å; L211-F228 HydrophobicContact CD1-CE1 3.75Å; L211-F228 HydrophobicContact CD1-CZ 4.38Å; L211-F228 HydrophobicContact CD2-CD1 4Å; L211-F228 HydrophobicContact CD2-CE1 3.87Å; L211-F228 HydrophobicContact CG-CD1 4.49Å; L211-F228 HydrophobicContact CG-CE1 4.18Å; I216-F228 HydrophobicContact CD1-CB 4.33Å; I216-F228 HydrophobicContact CD1-CD1 4.16Å; I216-F228 HydrophobicContact CD1-CG 4.28Å; R217-F228 WeakPolarHBondContact O-CA 3.45Å; Q218-F228 HydrophobicContact CB-CD1 4.08Å; Q218-F228 HydrophobicContact CB-CE1 3.78Å; Q218-F228 HydrophobicContact CG-CD1 4.45Å; Q218-F228 HydrophobicContact CG-CE1 3.87Å
229V89.6Confident70.3Confident34 Ų3481.5 Ų81.521%0.20650%0.503CS..EExtended strand (participates in β ladder)trans-135.7135.1178.6176.60000108.9F173 G177 I216 R217 V219F173-V229 HydrophobicContact CD2-CG2 4.39Å; F173-V229 HydrophobicContact CE2-CB 4.44Å; F173-V229 HydrophobicContact CE2-CG1 3.89Å; F173-V229 HydrophobicContact CE2-CG2 3.79Å; G177-V229 VanDerWaalsContact CA-CG2 3.49Å; I216-V229 CarbonylContact C-O 3.58Å; I216-V229 VanDerWaalsContact CA-O 3.31Å; I216-V229 WeakPolarHBondContact CA-O 3.1Å; R217-V229 PolarHBondContact N-O 3.35Å; R217-V229 PolarHBondContact O-N 3.09Å; V219-V229 HydrophobicContact CG2-CB 4.19Å; V219-V229 HydrophobicContact CG2-CG2 3.57Å
230V88.9Confident68.1Low30 Ų3088.2 Ų88.218%0.18253%0.527CS..EExtended strand (participates in β ladder)trans-67.9130.8172.8-176.60000109.2T166 I169 K170 I216T166-V230 HydrophobicContact CG2-CG1 4.22Å; T166-V230 HydrophobicContact CG2-CG2 3.99Å; I169-V230 HydrophobicContact CB-CG2 4.02Å; I169-V230 HydrophobicContact CG2-CG2 3.7Å; K170-V230 HydrophobicContact CG-CG2 4.24Å; I216-V230 HydrophobicContact CG2-CG2 4.37Å
231V85.9Confident66Low49 Ų4985.4 Ų85.430%0.29753%0.532SS..  trans-89.5107.9175.6-1790000108.1I215 R217 N233 A234I215-V231 PolarHBondContact O-N 3.25Å; R217-V231 HydrophobicContact CB-CG2 3.7Å; V231-N233 PolarHBondContact O-N 2.74Å; V231-A234 WeakPolarHBondContact O-CB 3.17Å; V231-A234 PolarHBondContact O-N 3.24Å
232S67.6Low63.9Low118 Ų11894.3 Ų94.383%0.82555%0.548SS*.THydrogen-bonded Turntrans-57.2-24.2-178.5-47.20000113.9
233N55.3Low62Low138 Ų13892.7 Ų92.774%0.73855%0.549SS*.THydrogen-bonded Turntrans-107.237-173.8-61.8-4000112.8V231 G235V231-N233 PolarHBondContact O-N 2.74Å; N233-G235 PolarHBondContact O-N 3.22Å
234A51.4Low60.4Low46 Ų46102.5 Ų102.538%0.3857%0.574SS.*THydrogen-bonded Turntrans-69.726.3-173.400000116.3I215 V231I215-A234 HydrophobicContact CB-CB 4.26Å; I215-A234 HydrophobicContact CG1-CB 3.8Å; V231-A234 WeakPolarHBondContact O-CB 3.17Å; V231-A234 PolarHBondContact O-N 3.24Å
235G45.9Very low58.6Low73 Ų73110.3 Ų110.375%0.75360%0.602SS**THydrogen-bonded Turntrans-108-5.2177.500000115.4N233N233-G235 PolarHBondContact O-N 3.22Å
236K44Very low56.6Low193 Ų193114.7 Ų114.784%0.83961%0.61SS**  trans-129.577.1-173.9-65.4-174.9-179.6-179.10112.4V238K236-V238 PolarHBondContact O-N 3.48Å
237T44.1Very low54.3Low116 Ų116118.9 Ų118.971%0.71264%0.636SS**  trans-77.6114.3171.452.20000111P239T237-P239 VanDerWaalsContact O-CD 3.29Å; T237-P239 WeakPolarHBondContact O-CD 3.27Å
238V40.7Very low52.1Low134 Ų134124 Ų12481%0.81267%0.667SS**  trans-88.1113.5173.3177.70000110.2K236K236-V238 PolarHBondContact O-N 3.48Å
239P47Very low49.4Very low110 Ų110129.1 Ų129.171%0.71470%0.702SS**  trans-79.4129.5166.932.1-31.9000110.2T237 A241T237-P239 VanDerWaalsContact O-CD 3.29Å; T237-P239 WeakPolarHBondContact O-CD 3.27Å; P239-A241 PolarHBondContact O-N 2.79Å
240K42.4Very low47.2Very low214 Ų214132.7 Ų132.793%0.9374%0.736SS**  trans-69.8100.2168.2-81.1-168.4173.1-172.30110.1
241A37.9Very low44.8Very low94 Ų94135.8 Ų135.878%0.77776%0.759SS**PPolyproline II helixtrans-85.4135160.900000109.6P239P239-A241 PolarHBondContact O-N 2.79Å
242R38Very low42.3Very low241 Ų241139.7 Ų139.791%0.90978%0.783SS**PPolyproline II helixtrans-81.6150.4168-104.4176.5163.2166.5-7.3109.8R244R242-R244 PolarHBondContact O-N 2.99Å
243D36.7Very low40.8Very low163 Ų163138.7 Ų138.787%0.87278%0.782SS**PPolyproline II helixtrans-52.4128.6-174.6-60.5-99.9000114.7
244R39.8Very low40.3Very low245 Ų245140.3 Ų140.393%0.92579%0.785SS**  trans-147.573.7149-159.9167.8-177.9172.5-0.6112.1R242R242-R244 PolarHBondContact O-N 2.99Å
245K34.8Very low40Very low199 Ų199146.3 Ų146.387%0.86581%0.805SS**  trans33.889.9154.9-163.5168.1-1751740116.1S247K245-S247 PolarHBondContact O-N 3.12Å
246K34.6Very low40.4Very low179 Ų179151.7 Ų151.778%0.77881%0.811SS**PPolyproline II helixtrans-55.3120.9161.9172.683.4174.7-172.50109.3T248K246-T248 HydrophobicContact CG-CG2 4.18Å
247S38Very low41.8Very low105 Ų105147.1 Ų147.173%0.73480%0.798SS**PPolyproline II helixtrans-89.2144.2150.947.40000108.9K245K245-S247 PolarHBondContact O-N 3.12Å
248T41.1Very low43.8Very low124 Ų124147.9 Ų147.976%0.76179%0.792SS**PPolyproline II helixtrans-104117-178.3410000110.6K246K246-T248 HydrophobicContact CG-CG2 4.18Å
249S32.9Very low46Very low106 Ų106142.3 Ų142.374%0.74176%0.757SS**  trans-143.3102161.854.80000106.8
250A43.9Very low47.9Very low110 Ų110138.9 Ų138.991%0.90973%0.732SS**  trans-105.398.8177.700000108.3
251S38.3Very low50.1Low94 Ų94131.6 Ų131.666%0.65770%0.703SS**SBendtrans-156.7130.8175.854.20000107.4A253S251-A253 PolarHBondContact O-N 2.91Å
252T35.1Very low52.5Low132 Ų132127.8 Ų127.881%0.8167%0.67SS**  trans38.871.6169.446.10000115.5E254T252-E254 PolarHBondContact O-N 2.81Å
253A35.5Very low55.1Low97 Ų97116.3 Ų116.380%0.80263%0.626SS**  trans-73.964.8168.900000111.3S251 Q255S251-A253 PolarHBondContact O-N 2.91Å; A253-Q255 PolarHBondContact O-N 3.24Å
254E43.3Very low57.7Low172 Ų172108.6 Ų108.680%0.80459%0.585SS**  trans-57.6108.7163.9-76.3-168.416800108.7T252 Q256T252-E254 PolarHBondContact O-N 2.81Å; E254-Q256 VanDerWaalsContact C-N 3.29Å; E254-Q256 PolarHBondContact O-N 2.87Å
255Q45.4Very low60.2Low171 Ų17198.6 Ų98.680%0.79955%0.55SS*.  trans-69.785.3-178.3-166.992.8-51.300108.9A253 V257A253-Q255 PolarHBondContact O-N 3.24Å; Q255-V257 WeakPolarHBondContact O-CA 3.24Å; Q255-V257 WeakPolarHBondContact O-CG2 3.49Å; Q255-V257 PolarHBondContact O-N 2.79Å
256Q54.9Low62.9Low187 Ų18789.1 Ų89.187%0.87451%0.509SS*.  trans-38.697-169.5-70.1-173.60.100112.9E254 K258E254-Q256 VanDerWaalsContact C-N 3.29Å; E254-Q256 PolarHBondContact O-N 2.87Å; Q256-K258 PolarHBondContact O-N 3.38Å
257V73.4Confident65.7Low96 Ų9680.6 Ų80.658%0.58247%0.472SS*.  trans-70.1125.4-168.6-170.40000108Q255 L259 D261 I262Q255-V257 WeakPolarHBondContact O-CA 3.24Å; Q255-V257 WeakPolarHBondContact O-CG2 3.49Å; Q255-V257 PolarHBondContact O-N 2.79Å; V257-L259 PolarHBondContact O-N 3.32Å; V257-D261 HydrophobicContact CG1-CB 4.35Å; V257-I262 HydrophobicContact CB-CD1 4.08Å; V257-I262 HydrophobicContact CB-CG1 4.25Å; V257-I262 HydrophobicContact CG1-CD1 4.1Å; V257-I262 HydrophobicContact CG1-CG1 3.74Å
258K85.7Confident68.3Low133 Ų13375.7 Ų75.758%0.57844%0.437SS*.  trans-67140.2-178.1-57.6177.1-163.61170108.5Q256 E260 D261 I262Q256-K258 PolarHBondContact O-N 3.38Å; K258-E260 HydrophobicContact CB-CB 4.45Å; K258-E260 PolarHBondContact O-N 3Å; K258-D261 WeakPolarHBondContact CB-OD2 3.47Å; K258-D261 PolarHBondContact O-N 2.55Å; K258-I262 PolarHBondContact O-N 3.34Å
259L87.3Confident70.6Confident16 Ų1672.8 Ų72.88%0.08441%0.412CS..Hα-helixtrans-59.1-24176.2-159.461.6000112.8V257 D261 I262 L263 I368 L383 L384 T387V257-L259 PolarHBondContact O-N 3.32Å; L259-D261 VanDerWaalsContact C-N 3.31Å; L259-D261 PolarHBondContact O-N 2.86Å; L259-I262 HydrophobicContact CD1-CB 4.47Å; L259-I262 HydrophobicContact CD1-CD1 4.2Å; L259-L263 WeakPolarHBondContact O-CG 3.24Å; L259-L263 PolarHBondContact O-N 3.11Å; L259-I368 HydrophobicContact CD1-CD1 3.77Å; L259-I368 HydrophobicContact CD1-CG1 4Å; L259-I368 HydrophobicContact CD1-CG2 3.95Å; L259-I368 HydrophobicContact CG-CD1 4.4Å; L259-L383 HydrophobicContact CD2-CB 4.41Å; L259-L383 HydrophobicContact CD2-CD2 4.26Å; L259-L383 HydrophobicContact CD2-CG 3.96Å; L259-L384 HydrophobicContact CD2-CB 3.91Å; L259-L384 HydrophobicContact CD2-CD1 4.28Å; L259-T387 HydrophobicContact CB-CG2 4.39Å
260E86.4Confident73.4Confident39 Ų3969.9 Ų69.918%0.18239%0.388CS..Hα-helixtrans-63.5-31170.9-69.2175.1-133.400113.7W136 K258 T387 K390W136-E260 VanDerWaalsContact CZ2-O 3.29Å; W136-E260 WeakPolarHBondContact CZ2-O 3.32Å; W136-E260 PolarHBondContact NE1-O 3.43Å; K258-E260 HydrophobicContact CB-CB 4.45Å; K258-E260 PolarHBondContact O-N 3Å; E260-T387 HydrophobicContact CB-CG2 4.44Å; E260-T387 HydrophobicContact CG-CG2 3.66Å; E260-K390 WeakPolarHBondContact OE1-CD 3.49Å; E260-K390 IonicContact OE1-NZ 2.58Å; E260-K390 PolarHBondContact OE1-NZ 2.99Å; E260-K390 IonicContact OE2-NZ 3.25Å; E260-K390 PolarHBondContact OE2-NZ 3.25Å
261D88.8Confident75.6Confident60 Ų6064.8 Ų64.832%0.32135%0.346SS..Hα-helixtrans-93.6-21.6-177.3-59.6-47.9000111.7V257 K258 L259 P264V257-D261 HydrophobicContact CG1-CB 4.35Å; K258-D261 WeakPolarHBondContact CB-OD2 3.47Å; K258-D261 PolarHBondContact O-N 2.55Å; L259-D261 VanDerWaalsContact C-N 3.31Å; L259-D261 PolarHBondContact O-N 2.86Å; D261-P264 WeakPolarHBondContact O-CD 3.47Å
262I89.4Confident78Confident15 Ų1566.3 Ų66.38%0.07734%0.343CS..Hα-helixtrans-75.4-35.6174.6-70.1158.5000112.6V257 K258 L259 P264 L265 A266 Y367 H372V257-I262 HydrophobicContact CB-CD1 4.08Å; V257-I262 HydrophobicContact CB-CG1 4.25Å; V257-I262 HydrophobicContact CG1-CD1 4.1Å; V257-I262 HydrophobicContact CG1-CG1 3.74Å; K258-I262 PolarHBondContact O-N 3.34Å; L259-I262 HydrophobicContact CD1-CB 4.47Å; L259-I262 HydrophobicContact CD1-CD1 4.2Å; I262-P264 VanDerWaalsContact C-CD 3.47Å; I262-L265 PolarHBondContact O-N 2.76Å; I262-L265 VanDerWaalsContact O-N 3.16Å; I262-A266 PolarHBondContact O-N 3.25Å; I262-Y367 HydrophobicContact CG2-CE1 4.48Å; I262-H372 WeakPolarHBondContact CG2-NE2 3.4Å
263L91.8Very high80.5Confident0 Ų063.3 Ų63.30%033%0.325CS..Hα-helixtrans-52.8-44.3-171.5-82.6168.8000115.1L259 L265 A266 F267 L364 L384 T387 L388 M397L259-L263 WeakPolarHBondContact O-CG 3.24Å; L259-L263 PolarHBondContact O-N 3.11Å; L263-L265 VanDerWaalsContact C-N 3.32Å; L263-L265 PolarHBondContact O-N 2.76Å; L263-A266 PolarHBondContact O-N 3.16Å; L263-F267 HydrophobicContact CD2-CE2 4.18Å; L263-F267 WeakPolarHBondContact O-CB 3.35Å; L263-F267 WeakPolarHBondContact O-CD2 3.47Å; L263-F267 PolarHBondContact O-N 3.06Å; L263-L364 HydrophobicContact CD2-CD1 4.45Å; L263-L364 HydrophobicContact CD2-CD2 4.12Å; L263-L384 HydrophobicContact CD2-CD1 4.04Å; L263-T387 HydrophobicContact CD1-CG2 3.55Å; L263-L388 HydrophobicContact CD1-CD2 3.9Å; L263-L388 HydrophobicContact CD2-CD2 3.95Å; L263-M397 HydrophobicContact CD1-SD 4.01Å
264P92Very high83.2Confident0 Ų059.9 Ų59.90%029%0.292CS..Hα-helixtrans-63.3-37.5-179.4-20.832.8000113.1W136 D261 I262 T268 L411 Y415W136-P264 HydrophobicContact CB-CG 4.12Å; W136-P264 HydrophobicContact CD2-CB 4.29Å; W136-P264 HydrophobicContact CD2-CG 3.18Å; W136-P264 HydrophobicContact CE3-CB 4.39Å; W136-P264 HydrophobicContact CE3-CG 3.58Å; W136-P264 HydrophobicContact CG-CB 4.4Å; W136-P264 HydrophobicContact CG-CG 3.44Å; W136-P264 VanDerWaalsContact CG-CG 3.44Å; W136-P264 HydrophobicContact CH2-CG 4.18Å; W136-P264 HydrophobicContact CZ2-CG 3.84Å; W136-P264 HydrophobicContact CZ3-CG 4.06Å; D261-P264 WeakPolarHBondContact O-CD 3.47Å; I262-P264 VanDerWaalsContact C-CD 3.47Å; P264-T268 WeakPolarHBondContact O-CB 3.39Å; P264-T268 PolarHBondContact O-N 3.03Å; P264-T268 PolarHBondContact O-OG1 2.98Å; P264-L411 HydrophobicContact CB-CD1 4.29Å; P264-Y415 HydrophobicContact CB-CD1 3.51Å; P264-Y415 HydrophobicContact CB-CD2 3.85Å; P264-Y415 HydrophobicContact CB-CE1 3.63Å; P264-Y415 HydrophobicContact CB-CE2 3.96Å; P264-Y415 HydrophobicContact CB-CG 3.63Å
265L92.1Very high85.5Confident36 Ų3654.2 Ų54.219%0.18827%0.266CS..Hα-helixtrans-69.1-46.3176.6-176.359.3000110.5I262 L263 F267 T268 R269 V421 L422I262-L265 PolarHBondContact O-N 2.76Å; I262-L265 VanDerWaalsContact O-N 3.16Å; L263-L265 VanDerWaalsContact C-N 3.32Å; L263-L265 PolarHBondContact O-N 2.76Å; L265-F267 VanDerWaalsContact C-N 3.33Å; L265-F267 PolarHBondContact O-N 3.29Å; L265-T268 CarbonylContact O-C 3.6Å; L265-T268 WeakPolarHBondContact O-CA 3.34Å; L265-T268 WeakPolarHBondContact O-CB 3.37Å; L265-T268 PolarHBondContact O-N 3Å; L265-R269 WeakPolarHBondContact O-CD 3.39Å; L265-R269 VanDerWaalsContact O-CG 3.28Å; L265-R269 WeakPolarHBondContact O-CG 3.49Å; L265-R269 PolarHBondContact O-N 3.09Å; L265-V421 HydrophobicContact CD1-CG1 4.48Å; L265-V421 WeakPolarHBondContact CD1-O 3.37Å; L265-V421 WeakPolarHBondContact CD2-O 3.43Å; L265-L422 HydrophobicContact CD1-CD1 4.06Å
266A92Very high87.8Confident0 Ų046.2 Ų46.20%023%0.229CC..Hα-helixtrans-55.8-46.1174.600000111.8I262 L263 T268 R269 L270 L364 Y367I262-A266 PolarHBondContact O-N 3.25Å; L263-A266 PolarHBondContact O-N 3.16Å; A266-T268 VanDerWaalsContact C-N 3.3Å; A266-T268 PolarHBondContact O-N 2.94Å; A266-R269 PolarHBondContact O-N 3.01Å; A266-L270 HydrophobicContact CB-CD1 4.42Å; A266-L270 VanDerWaalsContact O-CB 3.27Å; A266-L270 WeakPolarHBondContact O-CB 3.42Å; A266-L270 WeakPolarHBondContact O-CD1 3.4Å; A266-L270 WeakPolarHBondContact O-CG 3.46Å; A266-L270 PolarHBondContact O-N 3.03Å; A266-L364 HydrophobicContact CB-CD2 4.15Å; A266-Y367 HydrophobicContact CB-CD1 3.64Å; A266-Y367 HydrophobicContact CB-CE1 3.58Å; A266-Y367 HydrophobicContact CB-CG 4.28Å
267F93Very high89.6Confident0 Ų038.9 Ų38.90%020%0.198CC..Hα-helixtrans-58.4-40.3172.8-91.4-114.1000112.5L263 L265 L270 C271 K357 C359 L364 M397 F409 L411L263-F267 HydrophobicContact CD2-CE2 4.18Å; L263-F267 WeakPolarHBondContact O-CB 3.35Å; L263-F267 WeakPolarHBondContact O-CD2 3.47Å; L263-F267 PolarHBondContact O-N 3.06Å; L265-F267 VanDerWaalsContact C-N 3.33Å; L265-F267 PolarHBondContact O-N 3.29Å; F267-L270 PolarHBondContact O-N 3.17Å; F267-C271 WeakPolarHBondContact O-CB 3.31Å; F267-C271 PolarHBondContact O-N 2.88Å; F267-K357 HydrophobicContact CD1-CB 4.48Å; F267-K357 WeakPolarHBondContact CD1-O 3.38Å; F267-C359 HydrophobicContact CD1-CB 3.77Å; F267-C359 HydrophobicContact CD2-CB 4.13Å; F267-C359 HydrophobicContact CE1-CB 3.72Å; F267-C359 HydrophobicContact CE2-CB 4.08Å; F267-C359 HydrophobicContact CG-CB 3.99Å; F267-C359 HydrophobicContact CZ-CB 3.87Å; F267-L364 HydrophobicContact CD2-CD1 4.48Å; F267-L364 HydrophobicContact CD2-CD2 3.7Å; F267-L364 HydrophobicContact CE2-CD1 3.56Å; F267-L364 HydrophobicContact CE2-CD2 3.6Å; F267-L364 HydrophobicContact CE2-CG 4.16Å; F267-L364 HydrophobicContact CZ-CD1 4.01Å; F267-M397 HydrophobicContact CD2-CE 4.37Å; F267-M397 HydrophobicContact CE1-CE 4.1Å; F267-M397 HydrophobicContact CE2-CE 3.37Å; F267-M397 HydrophobicContact CZ-CE 3.2Å; F267-F409 HydrophobicContact CE1-CB 4.37Å; F267-F409 WeakPolarHBondContact CE1-O 3.37Å; F267-F409 HydrophobicContact CZ-CB 3.81Å; F267-L411 HydrophobicContact CB-CD1 3.98Å; F267-L411 HydrophobicContact CB-CD2 4.39Å; F267-L411 HydrophobicContact CB-CG 4.17Å; F267-L411 HydrophobicContact CD1-CD1 4.42Å; F267-L411 HydrophobicContact CD1-CD2 3.92Å; F267-L411 HydrophobicContact CD1-CG 3.71Å; F267-L411 HydrophobicContact CD2-CD2 4.28Å; F267-L411 HydrophobicContact CE1-CD2 4.22Å; F267-L411 HydrophobicContact CE1-CG 4.28Å; F267-L411 HydrophobicContact CG-CD1 4.36Å; F267-L411 HydrophobicContact CG-CD2 3.94Å; F267-L411 HydrophobicContact CG-CG 4Å
268T92.3Very high90.6Very high2 Ų235.8 Ų35.81%0.01218%0.176CC..Hα-helixtrans-67.9-34.9177.6-53.10000112.1P264 L265 A266 A351 K357 Y415 P417 L422P264-T268 WeakPolarHBondContact O-CB 3.39Å; P264-T268 PolarHBondContact O-N 3.03Å; P264-T268 PolarHBondContact O-OG1 2.98Å; L265-T268 CarbonylContact O-C 3.6Å; L265-T268 WeakPolarHBondContact O-CA 3.34Å; L265-T268 WeakPolarHBondContact O-CB 3.37Å; L265-T268 PolarHBondContact O-N 3Å; A266-T268 VanDerWaalsContact C-N 3.3Å; A266-T268 PolarHBondContact O-N 2.94Å; T268-A351 VanDerWaalsContact CG2-O 3.22Å; T268-A351 WeakPolarHBondContact CG2-O 3.45Å; T268-K357 WeakPolarHBondContact OG1-CD 3.45Å; T268-K357 VanDerWaalsContact OG1-CE 3.23Å; T268-K357 WeakPolarHBondContact OG1-CE 3.4Å; T268-Y415 WeakPolarHBondContact OG1-CD1 3.5Å; T268-P417 HydrophobicContact CG2-CG 3.96Å; T268-L422 HydrophobicContact CG2-CD1 3.82Å
269R90.1Very high90.9Very high63 Ų6333.1 Ų33.124%0.23817%0.174CC..Hα-helixtrans-72.6-42.4175.6-46.7-34.7-66.3-83.7-166.9111.6L265 A266 K274 Y367 L422L265-R269 WeakPolarHBondContact O-CD 3.39Å; L265-R269 VanDerWaalsContact O-CG 3.28Å; L265-R269 WeakPolarHBondContact O-CG 3.49Å; L265-R269 PolarHBondContact O-N 3.09Å; A266-R269 PolarHBondContact O-N 3.01Å; R269-K274 VanDerWaalsContact O-CE 3.29Å; R269-K274 WeakPolarHBondContact O-CE 3.48Å; R269-K274 PolarHBondContact O-NZ 2.94Å; R269-Y367 HydrophobicContact CB-CE2 3.93Å; R269-Y367 HydrophobicContact CG-CE2 3.74Å; R269-L422 PolarHBondContact NH1-O 3.48Å; R269-L422 PolarHBondContact NH2-O 3.35Å
270L90.4Very high91.2Very high45 Ų4534.1 Ų34.124%0.23618%0.18CC..Hα-helixtrans-94.8-16.5-166.8-62.5168.9000115.6A266 F267 E272 C359 A363 L364 Y367A266-L270 HydrophobicContact CB-CD1 4.42Å; A266-L270 VanDerWaalsContact O-CB 3.27Å; A266-L270 WeakPolarHBondContact O-CB 3.42Å; A266-L270 WeakPolarHBondContact O-CD1 3.4Å; A266-L270 WeakPolarHBondContact O-CG 3.46Å; A266-L270 PolarHBondContact O-N 3.03Å; F267-L270 PolarHBondContact O-N 3.17Å; L270-E272 PolarHBondContact O-N 3.01Å; L270-C359 VanDerWaalsContact CB-SG 3.59Å; L270-A363 HydrophobicContact CD1-CB 4.22Å; L270-A363 HydrophobicContact CD2-CB 4.42Å; L270-L364 HydrophobicContact CD1-CD2 3.98Å; L270-Y367 HydrophobicContact CD1-CD2 4.16Å; L270-Y367 HydrophobicContact CD1-CG 3.98Å; L270-Y367 HydrophobicContact CD2-CD2 4Å; L270-Y367 HydrophobicContact CD2-CG 4.48Å; L270-Y367 HydrophobicContact CG-CD2 4.05Å; L270-Y367 HydrophobicContact CG-CG 4.39Å
271C90.8Very high91.6Very high3 Ų332.3 Ų32.32%0.0217%0.171CC..  trans-61.9132.3-178.4-174.30000111F267 K274 N354 T358F267-C271 WeakPolarHBondContact O-CB 3.31Å; F267-C271 PolarHBondContact O-N 2.88Å; C271-K274 VanDerWaalsContact O-CE 3.26Å; C271-K274 WeakPolarHBondContact O-CE 3.11Å; C271-K274 WeakPolarHBondContact O-CG 3.03Å; C271-N354 PolarHBondContact SG-ND2 2.98Å; C271-N354 VanDerWaalsContact SG-ND2 3.36Å; C271-T358 WeakPolarHBondContact CA-O 3.5Å; C271-T358 WeakPolarHBondContact CB-O 3.38Å; C271-T358 PolarHBondContact SG-N 3.13Å; C271-T358 VanDerWaalsContact SG-N 3.4Å; C271-T358 PolarHBondContact SG-O 2.69Å; C271-T358 VanDerWaalsContact SG-O 3.36Å
272E88Confident91.8Very high126 Ų12631.9 Ų31.959%0.58917%0.166SC*.SBendtrans-133.8135.4174.8-67.4-177.5175.100108.3L270 K330L270-E272 PolarHBondContact O-N 3.01Å; E272-K330 IonicContact OE1-NZ 2.72Å; E272-K330 PolarHBondContact OE1-NZ 2.67Å
273P88.9Confident92Very high68 Ų6836.9 Ų36.944%0.44219%0.187SC..SBendcis-67.3172.5-3.131.7-37.1000113E275 Q327 N354P273-E275 HydrophobicContact CB-CG 4.18Å; P273-E275 WeakPolarHBondContact CB-OE1 3.5Å; P273-E275 HydrophobicContact CG-CG 4.37Å; P273-E275 WeakPolarHBondContact CG-OE1 3.31Å; P273-Q327 HydrophobicContact CB-CG 4.39Å; P273-N354 PolarHBondContact O-ND2 3Å
274K91.3Very high92.2Very high26 Ų2637 Ų3711%0.11319%0.188CC..  trans-114.3100.7174.7-71.9-168.9176.6-178.10109.7R269 C271 Q327 L328 I350R269-K274 VanDerWaalsContact O-CE 3.29Å; R269-K274 WeakPolarHBondContact O-CE 3.48Å; R269-K274 PolarHBondContact O-NZ 2.94Å; C271-K274 VanDerWaalsContact O-CE 3.26Å; C271-K274 WeakPolarHBondContact O-CE 3.11Å; C271-K274 WeakPolarHBondContact O-CG 3.03Å; K274-Q327 WeakPolarHBondContact O-CA 3.47Å; K274-L328 HydrophobicContact CB-CB 4.16Å; K274-L328 PolarHBondContact O-N 3.43Å; K274-I350 HydrophobicContact CB-CG2 4.33Å; K274-I350 WeakPolarHBondContact O-CG2 3.32Å
275E92.2Very high92.2Very high53 Ų5337 Ų3725%0.24819%0.188CC..EExtended strand (participates in β ladder)trans-131.2136.3-169.3-71.2173.7-152.300111.1P273 I317 T325 F326 Q327 N354P273-E275 HydrophobicContact CB-CG 4.18Å; P273-E275 WeakPolarHBondContact CB-OE1 3.5Å; P273-E275 HydrophobicContact CG-CG 4.37Å; P273-E275 WeakPolarHBondContact CG-OE1 3.31Å; E275-I317 HydrophobicContact CG-CD1 3.94Å; E275-I317 WeakPolarHBondContact OE1-CD1 3.16Å; E275-I317 WeakPolarHBondContact OE2-CD1 3.43Å; E275-T325 HydrophobicContact CB-CG2 3.97Å; E275-F326 WeakPolarHBondContact CA-O 3.4Å; E275-Q327 HydrophobicContact CG-CB 3.78Å; E275-Q327 HydrophobicContact CG-CG 3.69Å; E275-Q327 PolarHBondContact OE1-NE2 2.95Å; E275-N354 PolarHBondContact N-OD1 3.39Å; E275-N354 WeakPolarHBondContact O-CA 3.33Å; E275-N354 PolarHBondContact O-OD1 3.16Å; E275-N354 VanDerWaalsContact O-OD1 3.11Å
276A93.5Very high92.3Very high3 Ų337.4 Ų37.43%0.02519%0.194CC..EExtended strand (participates in β ladder)trans-143.6147.6168.900000111.3I281 F326 I350 M353A276-I281 HydrophobicContact CB-CD1 4.13Å; A276-I281 HydrophobicContact CB-CG1 3.75Å; A276-F326 PolarHBondContact N-O 3.33Å; A276-F326 PolarHBondContact O-N 3.17Å; A276-I350 HydrophobicContact CB-CB 4.37Å; A276-I350 HydrophobicContact CB-CG1 4.13Å; A276-I350 HydrophobicContact CB-CG2 4.44Å; A276-M353 HydrophobicContact CB-CB 4.25Å
277S93.1Very high92.3Very high32 Ų3243.3 Ų43.322%0.22422%0.221CC..EExtended strand (participates in β ladder)trans-82151.9173.867.90000111.5S279 L280 I281 G324S277-S279 PolarHBondContact O-N 2.91Å; S277-S279 PolarHBondContact OG-OG 2.74Å; S277-L280 PolarHBondContact O-N 3.05Å; S277-L280 WeakPolarHBondContact OG-CG 3.33Å; S277-I281 WeakPolarHBondContact O-CG1 3.38Å; S277-I281 PolarHBondContact O-N 3.4Å; S277-G324 CarbonylContact C-O 3.57Å; S277-G324 VanDerWaalsContact CA-O 3.29Å; S277-G324 WeakPolarHBondContact CA-O 3.21Å
278Y93.6Very high92.3Very high32 Ų3246.6 Ų46.613%0.12523%0.234CC..Hα-helixtrans-47.2-37.5176.4176.8-92.3000113.4K282 P298 L301 K302 L305 G324Y278-K282 HydrophobicContact CE1-CB 4.49Å; Y278-K282 HydrophobicContact CE1-CD 4.5Å; Y278-K282 VanDerWaalsContact O-CB 3.29Å; Y278-K282 WeakPolarHBondContact O-CB 3.49Å; Y278-K282 PolarHBondContact O-N 3.07Å; Y278-P298 PolarHBondContact OH-O 3.44Å; Y278-L301 HydrophobicContact CD2-CD2 4.29Å; Y278-L301 HydrophobicContact CE2-CD2 3.71Å; Y278-L301 HydrophobicContact CE2-CG 3.87Å; Y278-K302 HydrophobicContact CE2-CG 3.56Å; Y278-L305 HydrophobicContact CD2-CD1 3.64Å; Y278-L305 HydrophobicContact CE2-CD1 4.13Å; Y278-G324 PolarHBondContact N-O 3.41Å
279S92.9Very high92.2Very high76 Ų7648.7 Ų48.753%0.53124%0.242SC..Hα-helixtrans-72.5-31.3-179.360.10000113.5S277 K283S277-S279 PolarHBondContact O-N 2.91Å; S277-S279 PolarHBondContact OG-OG 2.74Å; S279-K283 WeakPolarHBondContact O-CB 3.16Å; S279-K283 PolarHBondContact O-N 3.17Å
280L92.8Very high92.1Very high38 Ų3850.2 Ų50.220%0.19926%0.261CS..Hα-helixtrans-77-42.8172.8-62.2179.6000111S277 K283 Y284 M353S277-L280 PolarHBondContact O-N 3.05Å; S277-L280 WeakPolarHBondContact OG-CG 3.33Å; L280-K283 PolarHBondContact O-N 3.48Å; L280-Y284 PolarHBondContact O-N 3.29Å; L280-M353 HydrophobicContact CB-CB 3.96Å; L280-M353 HydrophobicContact CB-CE 3.96Å; L280-M353 HydrophobicContact CB-CG 4.26Å; L280-M353 HydrophobicContact CD2-CE 3.81Å; L280-M353 HydrophobicContact CG-CE 4.33Å
281I93.9Very high92Very high0 Ų056.1 Ų56.10%028%0.284CS..Hα-helixtrans-58.5-50.8174.9-62.6168.4000110A276 S277 K283 Y284 V285 L301 L305 F326 I346 A349 I350A276-I281 HydrophobicContact CB-CD1 4.13Å; A276-I281 HydrophobicContact CB-CG1 3.75Å; S277-I281 WeakPolarHBondContact O-CG1 3.38Å; S277-I281 PolarHBondContact O-N 3.4Å; I281-K283 VanDerWaalsContact C-N 3.3Å; I281-K283 PolarHBondContact O-N 3.41Å; I281-Y284 PolarHBondContact O-N 3.46Å; I281-V285 HydrophobicContact CG2-CG2 4.32Å; I281-V285 WeakPolarHBondContact O-CG2 3.23Å; I281-V285 PolarHBondContact O-N 3.45Å; I281-L301 HydrophobicContact CG2-CD1 3.85Å; I281-L301 HydrophobicContact CG2-CD2 4.3Å; I281-L305 HydrophobicContact CD1-CD2 4.28Å; I281-F326 HydrophobicContact CD1-CD2 4.11Å; I281-I346 HydrophobicContact CG2-CG1 4.34Å; I281-A349 HydrophobicContact CB-CB 4.39Å; I281-A349 HydrophobicContact CG1-CB 4.45Å; I281-A349 HydrophobicContact CG2-CB 4Å; I281-I350 HydrophobicContact CD1-CD1 4.2Å; I281-I350 HydrophobicContact CD1-CG1 3.73Å; I281-I350 HydrophobicContact CG1-CG1 4.05Å
282K93.9Very high91.9Very high52 Ų5257.4 Ų57.423%0.22629%0.291CS..Hα-helixtrans-56.1-45177.2-170.7-173177.5-1450111.7Y278 V285 S286 V294 D295 L301Y278-K282 HydrophobicContact CE1-CB 4.49Å; Y278-K282 HydrophobicContact CE1-CD 4.5Å; Y278-K282 VanDerWaalsContact O-CB 3.29Å; Y278-K282 WeakPolarHBondContact O-CB 3.49Å; Y278-K282 PolarHBondContact O-N 3.07Å; K282-V285 PolarHBondContact O-N 3.48Å; K282-S286 WeakPolarHBondContact O-CB 3.3Å; K282-S286 PolarHBondContact O-N 3.09Å; K282-V294 HydrophobicContact CG-CG1 4.04Å; K282-D295 WeakPolarHBondContact CE-OD1 3.37Å; K282-D295 IonicContact NZ-OD1 2.65Å; K282-D295 PolarHBondContact NZ-OD1 2.9Å; K282-L301 HydrophobicContact CB-CD2 3.81Å; K282-L301 HydrophobicContact CG-CD2 4.18Å
283K93.9Very high91.9Very high119 Ų11957.9 Ų57.952%0.51729%0.291SS..Hα-helixtrans-62.2-43.1179.9-174.8-173-62.9173.50112.1S279 L280 I281 S286 Q287S279-K283 WeakPolarHBondContact O-CB 3.16Å; S279-K283 PolarHBondContact O-N 3.17Å; L280-K283 PolarHBondContact O-N 3.48Å; I281-K283 VanDerWaalsContact C-N 3.3Å; I281-K283 PolarHBondContact O-N 3.41Å; K283-S286 WeakPolarHBondContact O-CB 3.13Å; K283-Q287 VanDerWaalsContact O-CB 3.31Å; K283-Q287 WeakPolarHBondContact O-CB 3.42Å; K283-Q287 PolarHBondContact O-N 3.08Å
284Y94.5Very high91.8Very high2 Ų254.8 Ų54.81%0.00827%0.271CS..Hα-helixtrans-65.5-47.7178.6-168.5-91.1000111.9L280 I281 S286 Q287 Y288 Y289 A349 A352 M353 P417 P419L280-Y284 PolarHBondContact O-N 3.29Å; I281-Y284 PolarHBondContact O-N 3.46Å; Y284-S286 VanDerWaalsContact C-N 3.34Å; Y284-S286 PolarHBondContact O-N 2.65Å; Y284-Q287 PolarHBondContact O-N 3.3Å; Y284-Y288 HydrophobicContact CD1-CD2 4.03Å; Y284-Y288 AromaticContact CD2-CD2 3.65Å; Y284-Y288 HydrophobicContact CD2-CD2 3.65Å; Y284-Y288 AromaticContact CD2-CE2 3.65Å; Y284-Y288 HydrophobicContact CD2-CE2 3.65Å; Y284-Y288 AromaticContact CE1-CD2 3.92Å; Y284-Y288 HydrophobicContact CE1-CD2 3.92Å; Y284-Y288 AromaticContact CE2-CD2 3.49Å; Y284-Y288 HydrophobicContact CE2-CD2 3.49Å; Y284-Y288 VanDerWaalsContact CE2-CD2 3.49Å; Y284-Y288 AromaticContact CE2-CE2 3.4Å; Y284-Y288 HydrophobicContact CE2-CE2 3.4Å; Y284-Y288 VanDerWaalsContact CE2-CE2 3.4Å; Y284-Y288 AromaticContact CG-CD2 3.93Å; Y284-Y288 HydrophobicContact CG-CD2 3.93Å; Y284-Y288 HydrophobicContact CG-CE2 4.38Å; Y284-Y288 AromaticContact CZ-CD2 3.66Å; Y284-Y288 AromaticContact CZ-CE2 3.97Å; Y284-Y288 WeakPolarHBondContact O-CD2 3.37Å; Y284-Y288 PolarHBondContact O-N 3.14Å; Y284-Y289 HydrophobicContact CD1-CE2 4.45Å; Y284-Y289 HydrophobicContact CE1-CE2 4.13Å; Y284-A349 VanDerWaalsContact CD1-CA 3.41Å; Y284-A349 HydrophobicContact CD1-CB 3.52Å; Y284-A349 HydrophobicContact CE1-CB 4.35Å; Y284-A349 HydrophobicContact CG-CB 3.84Å; Y284-A352 HydrophobicContact CD2-CB 3.93Å; Y284-A352 HydrophobicContact CE1-CB 4.46Å; Y284-A352 HydrophobicContact CE2-CB 3.26Å; Y284-M353 HydrophobicContact CD2-CG 3.92Å; Y284-M353 HydrophobicContact CD2-SD 3.68Å; Y284-M353 HydrophobicContact CG-CG 4.15Å; Y284-M353 HydrophobicContact CG-SD 4.37Å; Y284-P417 WeakPolarHBondContact CE2-O 3.36Å; Y284-P417 PolarHBondContact OH-O 3.26Å; Y284-P419 HydrophobicContact CE1-CG 4.16Å; Y284-P419 WeakPolarHBondContact OH-CD 3.39Å
285V93.9Very high91.6Very high0 Ų057.6 Ų57.60%029%0.287CS..Hα-helixtrans-67.3-36.9-179.4-1760000111.3I281 K282 Y289 L292 V294 M342 A345 A349I281-V285 HydrophobicContact CG2-CG2 4.32Å; I281-V285 WeakPolarHBondContact O-CG2 3.23Å; I281-V285 PolarHBondContact O-N 3.45Å; K282-V285 PolarHBondContact O-N 3.48Å; V285-Y289 HydrophobicContact CG1-CD2 4.4Å; V285-Y289 CarbonylContact O-C 3.4Å; V285-Y289 WeakPolarHBondContact O-CA 3.2Å; V285-Y289 WeakPolarHBondContact O-CB 3.2Å; V285-Y289 PolarHBondContact O-N 2.98Å; V285-L292 HydrophobicContact CG1-CB 4.44Å; V285-L292 HydrophobicContact CG1-CD1 3.71Å; V285-V294 HydrophobicContact CG1-CB 4.47Å; V285-V294 HydrophobicContact CG1-CG2 3.65Å; V285-M342 HydrophobicContact CG1-CE 4.08Å; V285-A345 HydrophobicContact CG1-CB 4.23Å; V285-A345 HydrophobicContact CG2-CB 4.17Å; V285-A349 HydrophobicContact CG2-CB 4.12Å
286S93.1Very high91.5Very high46 Ų4661 Ų6132%0.32231%0.311SS..Hα-helixtrans-56.1-47169.1169.90000112.5K282 K283 Y284 D295K282-S286 WeakPolarHBondContact O-CB 3.3Å; K282-S286 PolarHBondContact O-N 3.09Å; K283-S286 WeakPolarHBondContact O-CB 3.13Å; Y284-S286 VanDerWaalsContact C-N 3.34Å; Y284-S286 PolarHBondContact O-N 2.65Å; S286-D295 WeakPolarHBondContact CB-OD2 3.35Å; S286-D295 PolarHBondContact OG-OD2 2.99Å
287Q92.1Very high91.2Very high123 Ų12367 Ų6758%0.57533%0.333SS*.Hα-helixtrans-75.9-36-173.3-176.6178.3-27.700113.8K283 Y284K283-Q287 VanDerWaalsContact O-CB 3.31Å; K283-Q287 WeakPolarHBondContact O-CB 3.42Å; K283-Q287 PolarHBondContact O-N 3.08Å; Y284-Q287 PolarHBondContact O-N 3.3Å
288Y92.1Very high91Very high70 Ų7067.5 Ų67.528%0.27534%0.335SS..Hα-helixtrans-112.9-16.3-171.2-64.2-68.5000115.1Y284 P290 S418 P419Y284-Y288 HydrophobicContact CD1-CD2 4.03Å; Y284-Y288 AromaticContact CD2-CD2 3.65Å; Y284-Y288 HydrophobicContact CD2-CD2 3.65Å; Y284-Y288 AromaticContact CD2-CE2 3.65Å; Y284-Y288 HydrophobicContact CD2-CE2 3.65Å; Y284-Y288 AromaticContact CE1-CD2 3.92Å; Y284-Y288 HydrophobicContact CE1-CD2 3.92Å; Y284-Y288 AromaticContact CE2-CD2 3.49Å; Y284-Y288 HydrophobicContact CE2-CD2 3.49Å; Y284-Y288 VanDerWaalsContact CE2-CD2 3.49Å; Y284-Y288 AromaticContact CE2-CE2 3.4Å; Y284-Y288 HydrophobicContact CE2-CE2 3.4Å; Y284-Y288 VanDerWaalsContact CE2-CE2 3.4Å; Y284-Y288 AromaticContact CG-CD2 3.93Å; Y284-Y288 HydrophobicContact CG-CD2 3.93Å; Y284-Y288 HydrophobicContact CG-CE2 4.38Å; Y284-Y288 AromaticContact CZ-CD2 3.66Å; Y284-Y288 AromaticContact CZ-CE2 3.97Å; Y284-Y288 WeakPolarHBondContact O-CD2 3.37Å; Y284-Y288 PolarHBondContact O-N 3.14Å; Y288-P290 VanDerWaalsContact C-CD 3.41Å; Y288-P290 WeakPolarHBondContact O-CD 3.27Å; Y288-S418 VanDerWaalsContact CE1-CB 3.41Å; Y288-P419 HydrophobicContact CG-CG 4.21Å
289Y91.6Very high90.8Very high46 Ų4671.2 Ų71.218%0.1835%0.354CS..  trans-126.263.8180-61-91.4000111.6Y284 V285 K291 L292 A345 S348 P419Y284-Y289 HydrophobicContact CD1-CE2 4.45Å; Y284-Y289 HydrophobicContact CE1-CE2 4.13Å; V285-Y289 HydrophobicContact CG1-CD2 4.4Å; V285-Y289 CarbonylContact O-C 3.4Å; V285-Y289 WeakPolarHBondContact O-CA 3.2Å; V285-Y289 WeakPolarHBondContact O-CB 3.2Å; V285-Y289 PolarHBondContact O-N 2.98Å; Y289-K291 PolarHBondContact O-N 2.88Å; Y289-L292 HydrophobicContact CG-CD1 4.29Å; Y289-L292 WeakPolarHBondContact O-CB 3.46Å; Y289-L292 PolarHBondContact O-N 3.47Å; Y289-A345 HydrophobicContact CD1-CB 4.02Å; Y289-A345 HydrophobicContact CD2-CB 3.65Å; Y289-A345 HydrophobicContact CE1-CB 4Å; Y289-A345 HydrophobicContact CE2-CB 3.61Å; Y289-A345 HydrophobicContact CG-CB 3.84Å; Y289-S348 PolarHBondContact OH-OG 2.84Å; Y289-P419 HydrophobicContact CE1-CG 4.49Å; Y289-P419 HydrophobicContact CE2-CG 3.62Å; Y289-P419 WeakPolarHBondContact OH-CB 3.17Å; Y289-P419 WeakPolarHBondContact OH-CG 3.17Å
290P88.6Confident90.7Very high95 Ų9571 Ų7162%0.61735%0.347SS*.G310 helixtrans-59.6-30.2178.125.8-34.5000112.5Y288 L292 K293Y288-P290 VanDerWaalsContact C-CD 3.41Å; Y288-P290 WeakPolarHBondContact O-CD 3.27Å; P290-L292 PolarHBondContact O-N 3.06Å; P290-K293 WeakPolarHBondContact O-CG 3.24Å; P290-K293 PolarHBondContact O-N 2.98Å
291K88.3Confident90.7Very high168 Ų16869.2 Ų69.273%0.7334%0.337SS*.G310 helixtrans-48.2-33.8171.7-67.3-172.3179.2-177.40111Y289 E434Y289-K291 PolarHBondContact O-N 2.88Å; K291-E434 IonicContact NZ-OE1 2.63Å; K291-E434 PolarHBondContact NZ-OE1 2.58Å
292L87.8Confident90.7Very high30 Ų3072.3 Ų72.316%0.15735%0.351CS..G310 helixtrans-81.8-13.8-179.3-67173.7000116.5V285 Y289 P290 V294 L341 M342 A345V285-L292 HydrophobicContact CG1-CB 4.44Å; V285-L292 HydrophobicContact CG1-CD1 3.71Å; Y289-L292 HydrophobicContact CG-CD1 4.29Å; Y289-L292 WeakPolarHBondContact O-CB 3.46Å; Y289-L292 PolarHBondContact O-N 3.47Å; P290-L292 PolarHBondContact O-N 3.06Å; L292-V294 VanDerWaalsContact C-N 3.3Å; L292-V294 HydrophobicContact CB-CG2 3.85Å; L292-V294 PolarHBondContact O-N 3.48Å; L292-V294 VanDerWaalsContact O-N 3.16Å; L292-L341 HydrophobicContact CD2-CB 4.41Å; L292-M342 HydrophobicContact CD1-CE 4.04Å; L292-M342 HydrophobicContact CD1-SD 4.18Å; L292-M342 HydrophobicContact CD2-CB 4.39Å; L292-M342 HydrophobicContact CD2-SD 4.41Å; L292-A345 HydrophobicContact CD1-CB 3.68Å
293K87.4Confident90.6Very high137 Ų13774.2 Ų74.260%0.59636%0.363SS*.  trans52.236.2174-59.2176.1-177.6171.60115.6P290 D295 V296 R297P290-K293 WeakPolarHBondContact O-CG 3.24Å; P290-K293 PolarHBondContact O-N 2.98Å; K293-D295 VanDerWaalsContact C-N 3.33Å; K293-D295 PolarHBondContact O-N 2.75Å; K293-V296 PolarHBondContact O-N 2.98Å; K293-R297 PolarHBondContact O-N 3.21Å; K293-R297 VanDerWaalsContact O-N 3.09Å
294V88Confident90.6Very high3 Ų369.1 Ų69.12%0.01834%0.343CS..THydrogen-bonded Turntrans-67.2-24.1-171.1-1790000114.4K282 V285 L292 R297 P298 L301 M342K282-V294 HydrophobicContact CG-CG1 4.04Å; V285-V294 HydrophobicContact CG1-CB 4.47Å; V285-V294 HydrophobicContact CG1-CG2 3.65Å; L292-V294 VanDerWaalsContact C-N 3.3Å; L292-V294 HydrophobicContact CB-CG2 3.85Å; L292-V294 PolarHBondContact O-N 3.48Å; L292-V294 VanDerWaalsContact O-N 3.16Å; V294-R297 CarbonylContact O-C 3.53Å; V294-P298 VanDerWaalsContact O-CA 3.27Å; V294-P298 WeakPolarHBondContact O-CA 3.45Å; V294-P298 VanDerWaalsContact O-N 3.11Å; V294-L301 HydrophobicContact CG1-CB 3.65Å; V294-L301 HydrophobicContact CG1-CD2 3.79Å; V294-L301 HydrophobicContact CG1-CG 4.34Å; V294-M342 HydrophobicContact CG2-CE 4.4Å
295D86.9Confident90.5Very high84 Ų8469 Ų6945%0.44934%0.343SS..THydrogen-bonded Turntrans-69.2-39.6174.1-75.1-61.8000113.5K282 S286 K293K282-D295 WeakPolarHBondContact CE-OD1 3.37Å; K282-D295 IonicContact NZ-OD1 2.65Å; K282-D295 PolarHBondContact NZ-OD1 2.9Å; S286-D295 WeakPolarHBondContact CB-OD2 3.35Å; S286-D295 PolarHBondContact OG-OD2 2.99Å; K293-D295 VanDerWaalsContact C-N 3.33Å; K293-D295 PolarHBondContact O-N 2.75Å
296V89.2Confident90.5Very high125 Ų12571.8 Ų71.876%0.75836%0.356SS*.THydrogen-bonded Turntrans-74.3-39.5177.1-174.60000110.5K293 P298K293-V296 PolarHBondContact O-N 2.98Å; V296-P298 VanDerWaalsContact C-CD 3.46Å; V296-P298 WeakPolarHBondContact O-CD 3.29Å
297R87.9Confident90.4Very high129 Ų12977.4 Ų77.449%0.48737%0.37SS..  trans-123.567.6-177.2-55.7-172.2-62.1178.20.3112.6K293 V294 Q299 L300K293-R297 PolarHBondContact O-N 3.21Å; K293-R297 VanDerWaalsContact O-N 3.09Å; V294-R297 CarbonylContact O-C 3.53Å; R297-Q299 PolarHBondContact O-N 3.35Å; R297-L300 HydrophobicContact CB-CD1 4.05Å; R297-L300 PolarHBondContact O-N 3.47Å
298P88.5Confident90.4Very high42 Ų4271.5 Ų71.527%0.27334%0.343SS..Hα-helixtrans-62.8-15.6-179.325.9-35.2000113.7Y278 V294 V296 L300 K302Y278-P298 PolarHBondContact OH-O 3.44Å; V294-P298 VanDerWaalsContact O-CA 3.27Å; V294-P298 WeakPolarHBondContact O-CA 3.45Å; V294-P298 VanDerWaalsContact O-N 3.11Å; V296-P298 VanDerWaalsContact C-CD 3.46Å; V296-P298 WeakPolarHBondContact O-CD 3.29Å; P298-L300 VanDerWaalsContact C-N 3.31Å; P298-L300 PolarHBondContact O-N 3.36Å; P298-K302 WeakPolarHBondContact O-CG 3.48Å; P298-K302 PolarHBondContact O-N 3.03Å
299Q89.8Confident90.5Very high111 Ų11170 Ų7052%0.51934%0.34SS..Hα-helixtrans-67.4-26.4174.6-54.9-65.118.800113.2R297 K302 N303R297-Q299 PolarHBondContact O-N 3.35Å; Q299-K302 PolarHBondContact O-N 2.93Å; Q299-K302 VanDerWaalsContact OE1-CD 3.29Å; Q299-N303 WeakPolarHBondContact O-CB 3.33Å; Q299-N303 PolarHBondContact O-N 3Å; Q299-N303 PolarHBondContact O-ND2 2.87Å; Q299-N303 PolarHBondContact O-OD1 3Å
300L91.3Very high90.5Very high71 Ų7174.1 Ų74.137%0.37236%0.361SS..Hα-helixtrans-65-51.6176.2-93.462.6000110.9R297 P298 K302 N303 A304R297-L300 HydrophobicContact CB-CD1 4.05Å; R297-L300 PolarHBondContact O-N 3.47Å; P298-L300 VanDerWaalsContact C-N 3.31Å; P298-L300 PolarHBondContact O-N 3.36Å; L300-K302 VanDerWaalsContact C-N 3.29Å; L300-K302 PolarHBondContact O-N 3.48Å; L300-N303 PolarHBondContact O-N 2.89Å; L300-A304 WeakPolarHBondContact O-CB 3.31Å; L300-A304 PolarHBondContact O-N 3.26Å
301L92.6Very high90.6Very high0 Ų075.4 Ų75.40%036%0.357CS..Hα-helixtrans-58.2-41.9174.6171.762.4000111.5Y278 I281 K282 V294 A304 L305 M342 I346Y278-L301 HydrophobicContact CD2-CD2 4.29Å; Y278-L301 HydrophobicContact CE2-CD2 3.71Å; Y278-L301 HydrophobicContact CE2-CG 3.87Å; I281-L301 HydrophobicContact CG2-CD1 3.85Å; I281-L301 HydrophobicContact CG2-CD2 4.3Å; K282-L301 HydrophobicContact CB-CD2 3.81Å; K282-L301 HydrophobicContact CG-CD2 4.18Å; V294-L301 HydrophobicContact CG1-CB 3.65Å; V294-L301 HydrophobicContact CG1-CD2 3.79Å; V294-L301 HydrophobicContact CG1-CG 4.34Å; L301-A304 PolarHBondContact O-N 2.89Å; L301-L305 HydrophobicContact CD1-CD1 3.78Å; L301-L305 HydrophobicContact CD1-CG 3.99Å; L301-L305 HydrophobicContact CG-CD1 3.91Å; L301-L305 WeakPolarHBondContact O-CB 3.45Å; L301-L305 VanDerWaalsContact O-CG 3.31Å; L301-L305 WeakPolarHBondContact O-CG 3.11Å; L301-L305 PolarHBondContact O-N 3.17Å; L301-M342 HydrophobicContact CB-CE 4.32Å; L301-M342 HydrophobicContact CD1-CE 3.75Å; L301-I346 HydrophobicContact CD1-CD1 3.81Å; L301-I346 HydrophobicContact CD1-CG1 3.65Å
302K92.8Very high90.6Very high66 Ų6668.9 Ų68.929%0.28734%0.338SS..Hα-helixtrans-61.4-48.8177-77.1178172.5-175.60112.5Y278 P298 Q299 L300 A304 L305 Q306 A322Y278-K302 HydrophobicContact CE2-CG 3.56Å; P298-K302 WeakPolarHBondContact O-CG 3.48Å; P298-K302 PolarHBondContact O-N 3.03Å; Q299-K302 PolarHBondContact O-N 2.93Å; Q299-K302 VanDerWaalsContact OE1-CD 3.29Å; L300-K302 VanDerWaalsContact C-N 3.29Å; L300-K302 PolarHBondContact O-N 3.48Å; K302-A304 VanDerWaalsContact C-N 3.32Å; K302-A304 PolarHBondContact O-N 2.68Å; K302-L305 PolarHBondContact O-N 2.96Å; K302-Q306 WeakPolarHBondContact O-CB 3.44Å; K302-Q306 PolarHBondContact O-N 3.09Å; K302-A322 HydrophobicContact CB-CB 3.54Å; K302-A322 HydrophobicContact CG-CB 3.86Å; K302-A322 VanDerWaalsContact O-CB 3.25Å; K302-A322 WeakPolarHBondContact O-CB 3.49Å
303N93.1Very high90.7Very high92 Ų9268.7 Ų68.749%0.49234%0.336SS..Hα-helixtrans-67-34.3-180-67.9-6.6000111.7Q299 L300 R307Q299-N303 WeakPolarHBondContact O-CB 3.33Å; Q299-N303 PolarHBondContact O-N 3Å; Q299-N303 PolarHBondContact O-ND2 2.87Å; Q299-N303 PolarHBondContact O-OD1 3Å; L300-N303 PolarHBondContact O-N 2.89Å; N303-R307 WeakPolarHBondContact O-CB 3.38Å; N303-R307 VanDerWaalsContact O-CG 3.23Å; N303-R307 WeakPolarHBondContact O-CG 3.4Å; N303-R307 PolarHBondContact O-N 2.76Å
304A92.9Very high90.9Very high12 Ų1262.3 Ų62.310%0.09931%0.309CS..Hα-helixtrans-66.1-47173.400000112.1L300 L301 K302 Q306 R307 A308 M342 I346L300-A304 WeakPolarHBondContact O-CB 3.31Å; L300-A304 PolarHBondContact O-N 3.26Å; L301-A304 PolarHBondContact O-N 2.89Å; K302-A304 VanDerWaalsContact C-N 3.32Å; K302-A304 PolarHBondContact O-N 2.68Å; A304-Q306 PolarHBondContact O-N 2.92Å; A304-R307 PolarHBondContact O-N 3.05Å; A304-A308 WeakPolarHBondContact O-CB 3.27Å; A304-A308 PolarHBondContact O-N 2.89Å; A304-M342 HydrophobicContact CB-CG 3.54Å; A304-I346 HydrophobicContact CB-CD1 3.8Å
305L93.3Very high91.1Very high0 Ų066.1 Ų66.10%033%0.326CS..Hα-helixtrans-61.6-42.7175.3-72.7167.3000112.1Y278 I281 L301 K302 A308 V309 L314 F326 I346Y278-L305 HydrophobicContact CD2-CD1 3.64Å; Y278-L305 HydrophobicContact CE2-CD1 4.13Å; I281-L305 HydrophobicContact CD1-CD2 4.28Å; L301-L305 HydrophobicContact CD1-CD1 3.78Å; L301-L305 HydrophobicContact CD1-CG 3.99Å; L301-L305 HydrophobicContact CG-CD1 3.91Å; L301-L305 WeakPolarHBondContact O-CB 3.45Å; L301-L305 VanDerWaalsContact O-CG 3.31Å; L301-L305 WeakPolarHBondContact O-CG 3.11Å; L301-L305 PolarHBondContact O-N 3.17Å; K302-L305 PolarHBondContact O-N 2.96Å; L305-A308 PolarHBondContact O-N 2.77Å; L305-V309 WeakPolarHBondContact O-CG2 3.34Å; L305-V309 PolarHBondContact O-N 2.73Å; L305-L314 HydrophobicContact CD2-CD1 3.63Å; L305-F326 HydrophobicContact CB-CE1 4.33Å; L305-F326 HydrophobicContact CB-CZ 4.19Å; L305-F326 HydrophobicContact CD1-CD2 4.29Å; L305-F326 HydrophobicContact CD1-CE2 3.85Å; L305-F326 HydrophobicContact CD1-CZ 4.25Å; L305-F326 HydrophobicContact CD2-CD2 4.1Å; L305-F326 HydrophobicContact CD2-CE2 4.36Å; L305-F326 HydrophobicContact CD2-CG 4.18Å; L305-I346 HydrophobicContact CD2-CD1 4.09Å; L305-I346 HydrophobicContact CD2-CG1 4.38Å; L305-I346 HydrophobicContact CD2-CG2 3.74Å; L305-I346 HydrophobicContact CG-CD1 4.13Å
306Q93.1Very high91.4Very high58 Ų5864.7 Ų64.727%0.27132%0.317SS..Hα-helixtrans-59.1-50175.7-175.263.238.700111.2K302 A304 A308 V309 E310 G321 A322K302-Q306 WeakPolarHBondContact O-CB 3.44Å; K302-Q306 PolarHBondContact O-N 3.09Å; A304-Q306 PolarHBondContact O-N 2.92Å; Q306-A308 PolarHBondContact O-N 2.94Å; Q306-V309 PolarHBondContact O-N 2.63Å; Q306-E310 WeakPolarHBondContact CG-OE1 3.49Å; Q306-E310 PolarHBondContact NE2-OE1 3.3Å; Q306-E310 WeakPolarHBondContact O-CG 3.17Å; Q306-E310 PolarHBondContact O-N 2.99Å; Q306-G321 VanDerWaalsContact OE1-C 3.3Å; Q306-A322 HydrophobicContact CB-CB 4.35Å
307R92.3Very high91.5Very high163 Ų16362.6 Ų62.662%0.61530%0.3SS*.Hα-helixtrans-60.8-40.2175.6-74.9170.7176.2-169.7-2.1112.7N303 A304 V309 E310 K311N303-R307 WeakPolarHBondContact O-CB 3.38Å; N303-R307 VanDerWaalsContact O-CG 3.23Å; N303-R307 WeakPolarHBondContact O-CG 3.4Å; N303-R307 PolarHBondContact O-N 2.76Å; A304-R307 PolarHBondContact O-N 3.05Å; R307-V309 VanDerWaalsContact C-N 3.32Å; R307-V309 PolarHBondContact O-N 3.23Å; R307-E310 PolarHBondContact O-N 3.5Å; R307-K311 WeakPolarHBondContact O-CB 3.4Å; R307-K311 VanDerWaalsContact O-CG 3.23Å; R307-K311 WeakPolarHBondContact O-CG 3.29Å; R307-K311 PolarHBondContact O-N 2.83Å
308A91.6Very high91.6Very high0 Ų059.5 Ų59.50%030%0.296CS..Hα-helixtrans-67.6-31.8178.900000112.6A304 L305 Q306 G312 Q313 L314 L337A304-A308 WeakPolarHBondContact O-CB 3.27Å; A304-A308 PolarHBondContact O-N 2.89Å; L305-A308 PolarHBondContact O-N 2.77Å; Q306-A308 PolarHBondContact O-N 2.94Å; A308-G312 PolarHBondContact O-N 3.05Å; A308-Q313 WeakPolarHBondContact O-CB 3.31Å; A308-Q313 PolarHBondContact O-N 3.37Å; A308-L314 HydrophobicContact CB-CB 4.36Å; A308-L314 HydrophobicContact CB-CD1 3.74Å; A308-L314 HydrophobicContact CB-CG 3.88Å; A308-L314 PolarHBondContact O-N 2.65Å; A308-L337 HydrophobicContact CB-CD1 3.74Å
309V93.2Very high91.4Very high38 Ų3860.1 Ų60.123%0.2331%0.31CS..Hα-helixtrans-71.9-43170173.30000111.2L305 Q306 R307 K311 G312 L314 Q316 F326L305-V309 WeakPolarHBondContact O-CG2 3.34Å; L305-V309 PolarHBondContact O-N 2.73Å; Q306-V309 PolarHBondContact O-N 2.63Å; R307-V309 VanDerWaalsContact C-N 3.32Å; R307-V309 PolarHBondContact O-N 3.23Å; V309-K311 PolarHBondContact O-N 2.85Å; V309-G312 WeakPolarHBondContact O-CA 3.32Å; V309-G312 PolarHBondContact O-N 3.06Å; V309-L314 WeakPolarHBondContact CA-O 3.46Å; V309-L314 HydrophobicContact CG2-CB 3.85Å; V309-Q316 HydrophobicContact CG2-CB 4.43Å; V309-F326 HydrophobicContact CG2-CD1 3.82Å; V309-F326 HydrophobicContact CG2-CE1 3.92Å
310E92.2Very high91.1Very high133 Ų13364.1 Ų64.162%0.62133%0.326SS*.Hα-helixtrans-64.6-36.8177.2-72.6163.5-178.800113Q306 R307 G312Q306-E310 WeakPolarHBondContact CG-OE1 3.49Å; Q306-E310 PolarHBondContact NE2-OE1 3.3Å; Q306-E310 WeakPolarHBondContact O-CG 3.17Å; Q306-E310 PolarHBondContact O-N 2.99Å; R307-E310 PolarHBondContact O-N 3.5Å; E310-G312 PolarHBondContact O-N 2.7Å
311K90.7Very high90.6Very high122 Ų12262 Ų6253%0.5332%0.321SS..THydrogen-bonded Turntrans-69.5-10.7169.5-71.5171.4174.1-177.90113.2R307 V309 Q313 E343R307-K311 WeakPolarHBondContact O-CB 3.4Å; R307-K311 VanDerWaalsContact O-CG 3.23Å; R307-K311 WeakPolarHBondContact O-CG 3.29Å; R307-K311 PolarHBondContact O-N 2.83Å; V309-K311 PolarHBondContact O-N 2.85Å; K311-Q313 VanDerWaalsContact C-N 3.29Å; K311-Q313 HydrophobicContact CB-CG 3.88Å; K311-Q313 HydrophobicContact CD-CG 4.41Å; K311-Q313 PolarHBondContact O-N 3.02Å; K311-E343 VanDerWaalsContact NZ-CD 3.34Å; K311-E343 IonicContact NZ-OE1 2.59Å; K311-E343 PolarHBondContact NZ-OE1 3.38Å; K311-E343 IonicContact NZ-OE2 2.67Å; K311-E343 PolarHBondContact NZ-OE2 3.3Å
312G88.9Confident89.8Confident31 Ų3163 Ų6332%0.3233%0.329SS..THydrogen-bonded Turntrans71.914.1-174.900000115.3A308 V309 E310 K329A308-G312 PolarHBondContact O-N 3.05Å; V309-G312 WeakPolarHBondContact O-CA 3.32Å; V309-G312 PolarHBondContact O-N 3.06Å; E310-G312 PolarHBondContact O-N 2.7Å; G312-K329 WeakPolarHBondContact O-CD 3.23Å
313Q89.9Confident89.5Confident25 Ų2562.9 Ų62.912%0.11734%0.337CS..SBendtrans-78.4-30.6176.9-58.5171.8-56.500111.9A308 K311 K329 L336 L337A308-Q313 WeakPolarHBondContact O-CB 3.31Å; A308-Q313 PolarHBondContact O-N 3.37Å; K311-Q313 VanDerWaalsContact C-N 3.29Å; K311-Q313 HydrophobicContact CB-CG 3.88Å; K311-Q313 HydrophobicContact CD-CG 4.41Å; K311-Q313 PolarHBondContact O-N 3.02Å; Q313-K329 VanDerWaalsContact O-CB 3.29Å; Q313-K329 WeakPolarHBondContact O-CB 3.23Å; Q313-K329 PolarHBondContact O-N 2.92Å; Q313-L336 HydrophobicContact CB-CB 4.14Å; Q313-L336 HydrophobicContact CG-CB 4.11Å; Q313-L336 WeakPolarHBondContact CG-O 3.5Å; Q313-L336 PolarHBondContact NE2-O 2.86Å; Q313-L337 HydrophobicContact CB-CB 4.23Å; Q313-L337 HydrophobicContact CB-CD1 4.12Å
314L91.7Very high89.3Confident4 Ų459.3 Ų59.32%0.02132%0.321CS..EExtended strand (participates in β ladder)trans-116.9150.7172.5-66.4-178000110.5L305 A308 V309 F326 Q327 L328 L337 I346 I350L305-L314 HydrophobicContact CD2-CD1 3.63Å; A308-L314 HydrophobicContact CB-CB 4.36Å; A308-L314 HydrophobicContact CB-CD1 3.74Å; A308-L314 HydrophobicContact CB-CG 3.88Å; A308-L314 PolarHBondContact O-N 2.65Å; V309-L314 WeakPolarHBondContact CA-O 3.46Å; V309-L314 HydrophobicContact CG2-CB 3.85Å; L314-F326 HydrophobicContact CD1-CB 4.26Å; L314-Q327 WeakPolarHBondContact CA-O 3.43Å; L314-L328 HydrophobicContact CD2-CB 4.4Å; L314-L328 HydrophobicContact CD2-CD1 3.71Å; L314-L337 HydrophobicContact CD1-CD2 4.23Å; L314-L337 HydrophobicContact CD2-CD2 4Å; L314-L337 HydrophobicContact CG-CD2 4.17Å; L314-I346 HydrophobicContact CD1-CG2 4.19Å; L314-I350 HydrophobicContact CD1-CD1 4.19Å; L314-I350 HydrophobicContact CD2-CD1 3.65Å
315E91.8Very high89.3Confident83 Ų8360.2 Ų60.239%0.38833%0.326SS..EExtended strand (participates in β ladder)trans-115129.3172-170.5159.7153.100109.8I317 F326 Q327 K329E315-I317 PolarHBondContact O-N 3.29Å; E315-F326 WeakPolarHBondContact O-CA 3.22Å; E315-Q327 HydrophobicContact CB-CB 4.39Å; E315-Q327 PolarHBondContact N-O 3.28Å; E315-Q327 PolarHBondContact O-N 3.5Å; E315-K329 IonicContact OE2-NZ 3.13Å; E315-K329 PolarHBondContact OE2-NZ 2.64Å
316Q92.9Very high89.3Confident54 Ų5460.3 Ų60.325%0.25233%0.326SS..EExtended strand (participates in β ladder)trans-89.8105.2179.1177.9166.533.200110V309 T318 G321 S323 F326V309-Q316 HydrophobicContact CG2-CB 4.43Å; Q316-T318 VanDerWaalsContact CG-O 3.22Å; Q316-T318 WeakPolarHBondContact CG-O 3.11Å; Q316-T318 PolarHBondContact NE2-O 2.89Å; Q316-T318 VanDerWaalsContact NE2-O 3.07Å; Q316-G321 PolarHBondContact NE2-O 3.19Å; Q316-G321 PolarHBondContact OE1-O 3.38Å; Q316-S323 PolarHBondContact NE2-O 3.42Å; Q316-F326 HydrophobicContact CB-CD1 4.47Å; Q316-F326 HydrophobicContact CB-CE1 4.44Å; Q316-F326 HydrophobicContact CG-CE1 4.49Å
317I91.2Very high89.3Confident81 Ų8159.9 Ų59.942%0.41532%0.324SS..  trans-79.8-37.4178-60.5176.8000110.9E275 E315 T325 Q327E275-I317 HydrophobicContact CG-CD1 3.94Å; E275-I317 WeakPolarHBondContact OE1-CD1 3.16Å; E275-I317 WeakPolarHBondContact OE2-CD1 3.43Å; E315-I317 PolarHBondContact O-N 3.29Å; I317-T325 PolarHBondContact N-O 3.25Å; I317-T325 VanDerWaalsContact N-O 3.1Å; I317-Q327 HydrophobicContact CD1-CB 3.75Å; I317-Q327 HydrophobicContact CD1-CG 4.23Å; I317-Q327 HydrophobicContact CG1-CB 4.13Å
318T89.6Confident89.3Confident63 Ų6352.6 Ų52.639%0.38730%0.298SS..SBendtrans-134.5157-176.472.70000112.2Q316 G324 T325Q316-T318 VanDerWaalsContact CG-O 3.22Å; Q316-T318 WeakPolarHBondContact CG-O 3.11Å; Q316-T318 PolarHBondContact NE2-O 2.89Å; Q316-T318 VanDerWaalsContact NE2-O 3.07Å; T318-G324 WeakPolarHBondContact O-CA 3.33Å; T318-T325 WeakPolarHBondContact OG1-CB 3.38Å; T318-T325 PolarHBondContact OG1-N 3.32Å; T318-T325 PolarHBondContact OG1-OG1 3.43Å
319G84.6Confident89.1Confident56 Ų5656.8 Ų56.858%0.57732%0.316SS*.SBendtrans83.6-161.1-179.500000113.6S323G319-S323 WeakPolarHBondContact CA-O 3.44Å
320K83.3Confident88.6Confident194 Ų19459.1 Ų59.184%0.84332%0.323SS*.SBendtrans-145.9129.4178.3-68.4-173.8178.3-178.90109.4S323K320-S323 PolarHBondContact N-O 3.41Å
321G80.4Confident87.1Confident26 Ų2656.2 Ų56.227%0.26832%0.317SS..SBendtrans61.3-144.8-176.900000111.8Q306 Q316 S323Q306-G321 VanDerWaalsContact OE1-C 3.3Å; Q316-G321 PolarHBondContact NE2-O 3.19Å; Q316-G321 PolarHBondContact OE1-O 3.38Å; G321-S323 PolarHBondContact O-N 3.47Å
322A77.5Confident85.8Confident21 Ų2153.3 Ų53.317%0.17432%0.322CS..SBendtrans-69.833.8-174.300000117.1K302 Q306K302-A322 HydrophobicContact CB-CB 3.54Å; K302-A322 HydrophobicContact CG-CB 3.86Å; K302-A322 VanDerWaalsContact O-CB 3.25Å; K302-A322 WeakPolarHBondContact O-CB 3.49Å; Q306-A322 HydrophobicContact CB-CB 4.35Å
323S84.8Confident84.5Confident65 Ų6559.5 Ų59.546%0.45534%0.342SS..SBendtrans-150.8136.2178.9-173.20000112Q316 G319 K320 G321Q316-S323 PolarHBondContact NE2-O 3.42Å; G319-S323 WeakPolarHBondContact CA-O 3.44Å; K320-S323 PolarHBondContact N-O 3.41Å; G321-S323 PolarHBondContact O-N 3.47Å
324G89.9Confident83.5Confident16 Ų1666.6 Ų66.617%0.16537%0.373CS..SBendtrans132.6-151179.900000112.4S277 Y278 T318S277-G324 CarbonylContact C-O 3.57Å; S277-G324 VanDerWaalsContact CA-O 3.29Å; S277-G324 WeakPolarHBondContact CA-O 3.21Å; Y278-G324 PolarHBondContact N-O 3.41Å; T318-G324 WeakPolarHBondContact O-CA 3.33Å
325T93.1Very high82.8Confident32 Ų3268.6 Ų68.620%0.19639%0.386CS..EExtended strand (participates in β ladder)trans-100.3128175-54.80000110.7E275 I317 T318E275-T325 HydrophobicContact CB-CG2 3.97Å; I317-T325 PolarHBondContact N-O 3.25Å; I317-T325 VanDerWaalsContact N-O 3.1Å; T318-T325 WeakPolarHBondContact OG1-CB 3.38Å; T318-T325 PolarHBondContact OG1-N 3.32Å; T318-T325 PolarHBondContact OG1-OG1 3.43Å
326F93.4Very high82.1Confident1 Ų168.2 Ų68.20%0.00439%0.386CS..EExtended strand (participates in β ladder)trans-111.1131177.8-57.7-85.4000109.9E275 A276 I281 L305 V309 L314 E315 Q316E275-F326 WeakPolarHBondContact CA-O 3.4Å; A276-F326 PolarHBondContact N-O 3.33Å; A276-F326 PolarHBondContact O-N 3.17Å; I281-F326 HydrophobicContact CD1-CD2 4.11Å; L305-F326 HydrophobicContact CB-CE1 4.33Å; L305-F326 HydrophobicContact CB-CZ 4.19Å; L305-F326 HydrophobicContact CD1-CD2 4.29Å; L305-F326 HydrophobicContact CD1-CE2 3.85Å; L305-F326 HydrophobicContact CD1-CZ 4.25Å; L305-F326 HydrophobicContact CD2-CD2 4.1Å; L305-F326 HydrophobicContact CD2-CE2 4.36Å; L305-F326 HydrophobicContact CD2-CG 4.18Å; V309-F326 HydrophobicContact CG2-CD1 3.82Å; V309-F326 HydrophobicContact CG2-CE1 3.92Å; L314-F326 HydrophobicContact CD1-CB 4.26Å; E315-F326 WeakPolarHBondContact O-CA 3.22Å; Q316-F326 HydrophobicContact CB-CD1 4.47Å; Q316-F326 HydrophobicContact CB-CE1 4.44Å; Q316-F326 HydrophobicContact CG-CE1 4.49Å
327Q92.8Very high81.5Confident50 Ų5066 Ų6623%0.23438%0.376CS..EExtended strand (participates in β ladder)trans-101.7137.1174.6-169.7-176.972.800109.7P273 K274 E275 L314 E315 I317 K329P273-Q327 HydrophobicContact CB-CG 4.39Å; K274-Q327 WeakPolarHBondContact O-CA 3.47Å; E275-Q327 HydrophobicContact CG-CB 3.78Å; E275-Q327 HydrophobicContact CG-CG 3.69Å; E275-Q327 PolarHBondContact OE1-NE2 2.95Å; L314-Q327 WeakPolarHBondContact CA-O 3.43Å; E315-Q327 HydrophobicContact CB-CB 4.39Å; E315-Q327 PolarHBondContact N-O 3.28Å; E315-Q327 PolarHBondContact O-N 3.5Å; I317-Q327 HydrophobicContact CD1-CB 3.75Å; I317-Q327 HydrophobicContact CD1-CG 4.23Å; I317-Q327 HydrophobicContact CG1-CB 4.13Å; Q327-K329 PolarHBondContact O-N 2.85Å
328L91.4Very high80.9Confident10 Ų1063.4 Ų63.45%0.05237%0.37CS..EExtended strand (participates in β ladder)trans-80.7111.9179.5-173.558.8000110.9K274 L314 P335 L337 L347 I350K274-L328 HydrophobicContact CB-CB 4.16Å; K274-L328 PolarHBondContact O-N 3.43Å; L314-L328 HydrophobicContact CD2-CB 4.4Å; L314-L328 HydrophobicContact CD2-CD1 3.71Å; L328-P335 HydrophobicContact CD1-CB 4.05Å; L328-P335 HydrophobicContact CD2-CB 3.85Å; L328-P335 HydrophobicContact CD2-CG 3.83Å; L328-P335 HydrophobicContact CG-CB 4.01Å; L328-P335 HydrophobicContact CG-CG 4.46Å; L328-L337 HydrophobicContact CD1-CB 3.83Å; L328-L337 HydrophobicContact CD1-CD2 4.28Å; L328-L347 HydrophobicContact CD2-CG 4.49Å; L328-I350 HydrophobicContact CB-CG2 4.13Å
329K88.6Confident80.4Confident87 Ų8763.8 Ų63.838%0.37839%0.386SS..  trans-76.4136.9-179.7-146.8-178.2-169.199.40110.3G312 Q313 E315 Q327 L336G312-K329 WeakPolarHBondContact O-CD 3.23Å; Q313-K329 VanDerWaalsContact O-CB 3.29Å; Q313-K329 WeakPolarHBondContact O-CB 3.23Å; Q313-K329 PolarHBondContact O-N 2.92Å; E315-K329 IonicContact OE2-NZ 3.13Å; E315-K329 PolarHBondContact OE2-NZ 2.64Å; Q327-K329 PolarHBondContact O-N 2.85Å; K329-L336 PolarHBondContact O-N 2.94Å
330K81.6Confident80.5Confident88 Ų8864.5 Ų64.538%0.38338%0.38SS..EExtended strand (participates in β ladder)trans-107.7142.4-176.4-64.8-167.8177.1-162.90112.1E272E272-K330 IonicContact OE1-NZ 2.72Å; E272-K330 PolarHBondContact OE1-NZ 2.67Å
331S60.2Low80.8Confident71 Ų7161.4 Ų61.450%0.49737%0.371SS..EExtended strand (participates in β ladder)trans-122.684.1165.358.40000108.9L336S331-L336 WeakPolarHBondContact OG-CD2 3.39Å; S331-L336 WeakPolarHBondContact OG-CG 3.43Å
332G64.8Low81.2Confident61 Ų6161.4 Ų61.463%0.62937%0.365SS*.THydrogen-bonded Turntrans79.6-148.1-166.800000112
333E60.3Low81.9Confident161 Ų16161 Ų6175%0.75236%0.359SS*.THydrogen-bonded Turntrans-77-25-175.6-67.8-172.1137.900113.6K366E333-K366 IonicContact OE1-NZ 2.7Å; E333-K366 PolarHBondContact OE1-NZ 2.98Å
334K69.8Low82.2Confident174 Ų17459.1 Ų59.176%0.75734%0.344SS*.EExtended strand (participates in β ladder)trans-91142.5177.9-65.8-170177.9-172.20112
335P76.6Confident82.3Confident47 Ų4758.4 Ų58.431%0.30534%0.336SS..EExtended strand (participates in β ladder)trans-63.8155.3170.3-24.136.7000113.4L328 L347L328-P335 HydrophobicContact CD1-CB 4.05Å; L328-P335 HydrophobicContact CD2-CB 3.85Å; L328-P335 HydrophobicContact CD2-CG 3.83Å; L328-P335 HydrophobicContact CG-CB 4.01Å; L328-P335 HydrophobicContact CG-CG 4.46Å; P335-L347 HydrophobicContact CB-CD1 3.73Å; P335-L347 HydrophobicContact CG-CD1 3.86Å
336L77.1Confident82.3Confident75 Ų7556.9 Ų56.939%0.39333%0.327SS..SBendtrans-82.3-13.8174-81.3169.1000114.3Q313 K329 S331Q313-L336 HydrophobicContact CB-CB 4.14Å; Q313-L336 HydrophobicContact CG-CB 4.11Å; Q313-L336 WeakPolarHBondContact CG-O 3.5Å; Q313-L336 PolarHBondContact NE2-O 2.86Å; K329-L336 PolarHBondContact O-N 2.94Å; S331-L336 WeakPolarHBondContact OG-CD2 3.39Å; S331-L336 WeakPolarHBondContact OG-CG 3.43Å
337L80.1Confident82.3Confident6 Ų657.4 Ų57.43%0.03133%0.33CS..  trans-93.5136.1-177.7-171.565.7000110.4A308 Q313 L314 L328 E343 I346 L347A308-L337 HydrophobicContact CB-CD1 3.74Å; Q313-L337 HydrophobicContact CB-CB 4.23Å; Q313-L337 HydrophobicContact CB-CD1 4.12Å; L314-L337 HydrophobicContact CD1-CD2 4.23Å; L314-L337 HydrophobicContact CD2-CD2 4Å; L314-L337 HydrophobicContact CG-CD2 4.17Å; L328-L337 HydrophobicContact CD1-CB 3.83Å; L328-L337 HydrophobicContact CD1-CD2 4.28Å; L337-E343 HydrophobicContact CD1-CB 3.73Å; L337-E343 HydrophobicContact CD1-CG 3.83Å; L337-E343 HydrophobicContact CG-CB 4.04Å; L337-I346 HydrophobicContact CD2-CB 4.13Å; L337-I346 HydrophobicContact CD2-CG2 3.67Å; L337-L347 HydrophobicContact CD2-CB 4.25Å; L337-L347 WeakPolarHBondContact O-CD1 3.18Å
338G79Confident82.3Confident28 Ų2855.3 Ų55.329%0.28932%0.321SS..  trans144.3170.1179.400000112D344G338-D344 VanDerWaalsContact CA-OD2 3.24Å; G338-D344 WeakPolarHBondContact CA-OD2 3.37Å
339G79.5Confident82.4Confident71 Ų7154.8 Ų54.873%0.73232%0.318SS*.SBendtrans97.48.3-176.300000114.4D344G339-D344 PolarHBondContact N-OD2 2.85Å
340T86.6Confident82.6Confident71 Ų7150.7 Ų50.744%0.43630%0.3SS..SBendtrans-146.3144164.4630000109M342 E343 D344T340-M342 PolarHBondContact O-N 3.08Å; T340-E343 PolarHBondContact O-N 2.85Å; T340-E343 VanDerWaalsContact OG1-CB 3.3Å; T340-E343 WeakPolarHBondContact OG1-CB 3.03Å; T340-E343 VanDerWaalsContact OG1-CG 3.23Å; T340-E343 WeakPolarHBondContact OG1-CG 3.26Å; T340-E343 PolarHBondContact OG1-N 3.36Å; T340-E343 PolarHBondContact OG1-OE2 3.32Å; T340-D344 PolarHBondContact O-N 2.87Å
341L88.6Confident83.2Confident128 Ų12846.6 Ų46.667%0.6728%0.283SS*.Hα-helixtrans-49.8-35.6-178.6-60176.1000113.4L292 A345L292-L341 HydrophobicContact CD2-CB 4.41Å; L341-A345 WeakPolarHBondContact O-CB 3.48Å; L341-A345 PolarHBondContact O-N 3.48Å
342M90.3Very high84.7Confident26 Ų2643.2 Ų43.213%0.12826%0.259CS..Hα-helixtrans-72.8-39.4176.9-174.374.5-98.900112.7V285 L292 V294 L301 A304 T340 I346V285-M342 HydrophobicContact CG1-CE 4.08Å; L292-M342 HydrophobicContact CD1-CE 4.04Å; L292-M342 HydrophobicContact CD1-SD 4.18Å; L292-M342 HydrophobicContact CD2-CB 4.39Å; L292-M342 HydrophobicContact CD2-SD 4.41Å; V294-M342 HydrophobicContact CG2-CE 4.4Å; L301-M342 HydrophobicContact CB-CE 4.32Å; L301-M342 HydrophobicContact CD1-CE 3.75Å; A304-M342 HydrophobicContact CB-CG 3.54Å; T340-M342 PolarHBondContact O-N 3.08Å; M342-I346 HydrophobicContact CE-CD1 4.02Å; M342-I346 HydrophobicContact CE-CG1 3.89Å; M342-I346 HydrophobicContact CG-CD1 4.35Å; M342-I346 WeakPolarHBondContact O-CD1 3.28Å; M342-I346 WeakPolarHBondContact O-CG1 3.48Å; M342-I346 PolarHBondContact O-N 3.47Å; M342-I346 VanDerWaalsContact O-N 3.08Å
343E90.9Very high86Confident13 Ų1340.5 Ų40.56%0.06123%0.23CC..Hα-helixtrans-76.1-37.1179.6-70.2175.4155.900111.7K311 L337 T340 I346 L347K311-E343 VanDerWaalsContact NZ-CD 3.34Å; K311-E343 IonicContact NZ-OE1 2.59Å; K311-E343 PolarHBondContact NZ-OE1 3.38Å; K311-E343 IonicContact NZ-OE2 2.67Å; K311-E343 PolarHBondContact NZ-OE2 3.3Å; L337-E343 HydrophobicContact CD1-CB 3.73Å; L337-E343 HydrophobicContact CD1-CG 3.83Å; L337-E343 HydrophobicContact CG-CB 4.04Å; T340-E343 PolarHBondContact O-N 2.85Å; T340-E343 VanDerWaalsContact OG1-CB 3.3Å; T340-E343 WeakPolarHBondContact OG1-CB 3.03Å; T340-E343 VanDerWaalsContact OG1-CG 3.23Å; T340-E343 WeakPolarHBondContact OG1-CG 3.26Å; T340-E343 PolarHBondContact OG1-N 3.36Å; T340-E343 PolarHBondContact OG1-OE2 3.32Å; E343-I346 PolarHBondContact O-N 2.98Å; E343-L347 WeakPolarHBondContact O-CB 3.4Å; E343-L347 PolarHBondContact O-N 2.8Å
344D91.3Very high87.5Confident26 Ų2633.1 Ų33.114%0.13920%0.196CC..Hα-helixtrans-67.9-37.9171.8-81.6-93.8000112.6G338 G339 T340 L347 S348 K426G338-D344 VanDerWaalsContact CA-OD2 3.24Å; G338-D344 WeakPolarHBondContact CA-OD2 3.37Å; G339-D344 PolarHBondContact N-OD2 2.85Å; T340-D344 PolarHBondContact O-N 2.87Å; D344-L347 PolarHBondContact O-N 2.74Å; D344-S348 WeakPolarHBondContact O-CB 3.27Å; D344-S348 PolarHBondContact O-N 2.77Å; D344-S348 PolarHBondContact O-OG 3.48Å; D344-K426 IonicContact OD1-NZ 3.21Å; D344-K426 PolarHBondContact OD1-NZ 2.89Å
345A92.5Very high88.3Confident0 Ų029 Ų290%018%0.179CC..Hα-helixtrans-64.7-37.317100000112.3V285 Y289 L292 L341 A349V285-A345 HydrophobicContact CG1-CB 4.23Å; V285-A345 HydrophobicContact CG2-CB 4.17Å; Y289-A345 HydrophobicContact CD1-CB 4.02Å; Y289-A345 HydrophobicContact CD2-CB 3.65Å; Y289-A345 HydrophobicContact CE1-CB 4Å; Y289-A345 HydrophobicContact CE2-CB 3.61Å; Y289-A345 HydrophobicContact CG-CB 3.84Å; L292-A345 HydrophobicContact CD1-CB 3.68Å; L341-A345 WeakPolarHBondContact O-CB 3.48Å; L341-A345 PolarHBondContact O-N 3.48Å; A345-A349 WeakPolarHBondContact O-CB 3.42Å; A345-A349 PolarHBondContact O-N 2.87Å
346I93.3Very high88.9Confident0 Ų030.6 Ų30.60%019%0.19CC..Hα-helixtrans-66.6-44.6173-70.6161.5000110.9I281 L301 A304 L305 L314 L337 M342 E343 S348 A349 I350I281-I346 HydrophobicContact CG2-CG1 4.34Å; L301-I346 HydrophobicContact CD1-CD1 3.81Å; L301-I346 HydrophobicContact CD1-CG1 3.65Å; A304-I346 HydrophobicContact CB-CD1 3.8Å; L305-I346 HydrophobicContact CD2-CD1 4.09Å; L305-I346 HydrophobicContact CD2-CG1 4.38Å; L305-I346 HydrophobicContact CD2-CG2 3.74Å; L305-I346 HydrophobicContact CG-CD1 4.13Å; L314-I346 HydrophobicContact CD1-CG2 4.19Å; L337-I346 HydrophobicContact CD2-CB 4.13Å; L337-I346 HydrophobicContact CD2-CG2 3.67Å; M342-I346 HydrophobicContact CE-CD1 4.02Å; M342-I346 HydrophobicContact CE-CG1 3.89Å; M342-I346 HydrophobicContact CG-CD1 4.35Å; M342-I346 WeakPolarHBondContact O-CD1 3.28Å; M342-I346 WeakPolarHBondContact O-CG1 3.48Å; M342-I346 PolarHBondContact O-N 3.47Å; M342-I346 VanDerWaalsContact O-N 3.08Å; E343-I346 PolarHBondContact O-N 2.98Å; I346-S348 PolarHBondContact O-N 3.33Å; I346-A349 PolarHBondContact O-N 3.04Å; I346-I350 HydrophobicContact CG2-CD1 3.66Å; I346-I350 HydrophobicContact CG2-CG1 4.3Å; I346-I350 WeakPolarHBondContact O-CG1 3.44Å; I346-I350 PolarHBondContact O-N 2.92Å
347L92.5Very high89.6Confident13 Ų1327.4 Ų27.47%0.06817%0.173CC..Hα-helixtrans-58.6-47176.4169.1150.8000111.3L328 P335 L337 E343 D344 I350 A351 Y423L328-L347 HydrophobicContact CD2-CG 4.49Å; P335-L347 HydrophobicContact CB-CD1 3.73Å; P335-L347 HydrophobicContact CG-CD1 3.86Å; L337-L347 HydrophobicContact CD2-CB 4.25Å; L337-L347 WeakPolarHBondContact O-CD1 3.18Å; E343-L347 WeakPolarHBondContact O-CB 3.4Å; E343-L347 PolarHBondContact O-N 2.8Å; D344-L347 PolarHBondContact O-N 2.74Å; L347-I350 PolarHBondContact O-N 3.46Å; L347-A351 WeakPolarHBondContact O-CB 3.45Å; L347-A351 PolarHBondContact O-N 3.07Å; L347-Y423 HydrophobicContact CD2-CE1 4.48Å; L347-Y423 HydrophobicContact CD2-CE2 3.87Å; L347-Y423 VanDerWaalsContact CD2-OH 3.26Å; L347-Y423 WeakPolarHBondContact CD2-OH 3.18Å
348S93.2Very high90.2Very high5 Ų529.1 Ų29.14%0.03518%0.183CC..Hα-helixtrans-64.4-41.7178.3-60.60000111.1Y289 D344 I346 A351 A352Y289-S348 PolarHBondContact OH-OG 2.84Å; D344-S348 WeakPolarHBondContact O-CB 3.27Å; D344-S348 PolarHBondContact O-N 2.77Å; D344-S348 PolarHBondContact O-OG 3.48Å; I346-S348 PolarHBondContact O-N 3.33Å; S348-A351 PolarHBondContact O-N 3.1Å; S348-A352 WeakPolarHBondContact O-CB 3.48Å; S348-A352 PolarHBondContact O-N 3.16Å
349A94.1Very high90.8Very high0 Ų028 Ų280%017%0.172CC..Hα-helixtrans-62.6-45.8174.400000113.2I281 Y284 V285 A345 I346 A352 M353I281-A349 HydrophobicContact CB-CB 4.39Å; I281-A349 HydrophobicContact CG1-CB 4.45Å; I281-A349 HydrophobicContact CG2-CB 4Å; Y284-A349 VanDerWaalsContact CD1-CA 3.41Å; Y284-A349 HydrophobicContact CD1-CB 3.52Å; Y284-A349 HydrophobicContact CE1-CB 4.35Å; Y284-A349 HydrophobicContact CG-CB 3.84Å; V285-A349 HydrophobicContact CG2-CB 4.12Å; A345-A349 WeakPolarHBondContact O-CB 3.42Å; A345-A349 PolarHBondContact O-N 2.87Å; I346-A349 PolarHBondContact O-N 3.04Å; A349-A352 PolarHBondContact O-N 2.77Å; A349-M353 WeakPolarHBondContact O-CB 3.41Å; A349-M353 VanDerWaalsContact O-CG 3.23Å; A349-M353 WeakPolarHBondContact O-CG 3.45Å; A349-M353 PolarHBondContact O-N 3.21Å
350I93.5Very high91.5Very high0 Ų026.7 Ų26.70%015%0.151CC..Hα-helixtrans-65-42.7178.9-67.2166.8000110.3K274 A276 I281 L314 L328 I346 L347 N354K274-I350 HydrophobicContact CB-CG2 4.33Å; K274-I350 WeakPolarHBondContact O-CG2 3.32Å; A276-I350 HydrophobicContact CB-CB 4.37Å; A276-I350 HydrophobicContact CB-CG1 4.13Å; A276-I350 HydrophobicContact CB-CG2 4.44Å; I281-I350 HydrophobicContact CD1-CD1 4.2Å; I281-I350 HydrophobicContact CD1-CG1 3.73Å; I281-I350 HydrophobicContact CG1-CG1 4.05Å; L314-I350 HydrophobicContact CD1-CD1 4.19Å; L314-I350 HydrophobicContact CD2-CD1 3.65Å; L328-I350 HydrophobicContact CB-CG2 4.13Å; I346-I350 HydrophobicContact CG2-CD1 3.66Å; I346-I350 HydrophobicContact CG2-CG1 4.3Å; I346-I350 WeakPolarHBondContact O-CG1 3.44Å; I346-I350 PolarHBondContact O-N 2.92Å; L347-I350 PolarHBondContact O-N 3.46Å; I350-N354 WeakPolarHBondContact O-CB 3.35Å; I350-N354 PolarHBondContact O-N 3.38Å
351A92.4Very high91.8Very high2 Ų223.4 Ų23.42%0.01713%0.131CC..Hα-helixtrans-64.4-47.2176.700000112.3T268 L347 S348 L422T268-A351 VanDerWaalsContact CG2-O 3.22Å; T268-A351 WeakPolarHBondContact CG2-O 3.45Å; L347-A351 WeakPolarHBondContact O-CB 3.45Å; L347-A351 PolarHBondContact O-N 3.07Å; S348-A351 PolarHBondContact O-N 3.1Å; A351-L422 HydrophobicContact CB-CD2 3.94Å
352A93.3Very high92Very high0 Ų022.1 Ų22.10%013%0.128CC..Hα-helixtrans-70.3-40.3-178.800000113.5Y284 S348 A349 K357 P417 L422Y284-A352 HydrophobicContact CD2-CB 3.93Å; Y284-A352 HydrophobicContact CE1-CB 4.46Å; Y284-A352 HydrophobicContact CE2-CB 3.26Å; S348-A352 WeakPolarHBondContact O-CB 3.48Å; S348-A352 PolarHBondContact O-N 3.16Å; A349-A352 PolarHBondContact O-N 2.77Å; A352-K357 WeakPolarHBondContact O-CE 3.25Å; A352-K357 PolarHBondContact O-NZ 3.18Å; A352-P417 HydrophobicContact CB-CG 4.22Å; A352-L422 HydrophobicContact CB-CD2 4.23Å
353M91.2Very high92.1Very high4 Ų422.1 Ų22.12%0.0213%0.133CC..Hα-helixtrans-90.50.5-172.4-58.8-58.1-62.800114.7A276 L280 Y284 A349 E355 Y416A276-M353 HydrophobicContact CB-CB 4.25Å; L280-M353 HydrophobicContact CB-CB 3.96Å; L280-M353 HydrophobicContact CB-CE 3.96Å; L280-M353 HydrophobicContact CB-CG 4.26Å; L280-M353 HydrophobicContact CD2-CE 3.81Å; L280-M353 HydrophobicContact CG-CE 4.33Å; Y284-M353 HydrophobicContact CD2-CG 3.92Å; Y284-M353 HydrophobicContact CD2-SD 3.68Å; Y284-M353 HydrophobicContact CG-CG 4.15Å; Y284-M353 HydrophobicContact CG-SD 4.37Å; A349-M353 WeakPolarHBondContact O-CB 3.41Å; A349-M353 VanDerWaalsContact O-CG 3.23Å; A349-M353 WeakPolarHBondContact O-CG 3.45Å; A349-M353 PolarHBondContact O-N 3.21Å; M353-E355 PolarHBondContact O-N 2.72Å; M353-Y416 HydrophobicContact CE-CD1 3.73Å; M353-Y416 HydrophobicContact CE-CD2 4.12Å; M353-Y416 HydrophobicContact CE-CE1 3.62Å; M353-Y416 HydrophobicContact CE-CE2 4.02Å; M353-Y416 HydrophobicContact CE-CG 4Å; M353-Y416 HydrophobicContact SD-CD1 3.49Å; M353-Y416 WeakPolarHBondContact SD-CD1 3.44Å; M353-Y416 HydrophobicContact SD-CD2 4.26Å; M353-Y416 HydrophobicContact SD-CE1 4.02Å; M353-Y416 HydrophobicContact SD-CG 3.64Å
354N91.1Very high92.2Very high7 Ų721.5 Ų21.54%0.03713%0.13CC..  trans-57.4128.7178.8-168.227.8000112.6C271 P273 E275 I350 K357C271-N354 PolarHBondContact SG-ND2 2.98Å; C271-N354 VanDerWaalsContact SG-ND2 3.36Å; P273-N354 PolarHBondContact O-ND2 3Å; E275-N354 PolarHBondContact N-OD1 3.39Å; E275-N354 WeakPolarHBondContact O-CA 3.33Å; E275-N354 PolarHBondContact O-OD1 3.16Å; E275-N354 VanDerWaalsContact O-OD1 3.11Å; I350-N354 WeakPolarHBondContact O-CB 3.35Å; I350-N354 PolarHBondContact O-N 3.38Å; N354-K357 WeakPolarHBondContact O-CE 3.5Å; N354-K357 WeakPolarHBondContact O-CG 3.49Å; N354-K357 PolarHBondContact O-NZ 2.95Å
355E87.1Confident92.2Very high87 Ų8722.7 Ų22.741%0.40713%0.133SC..SBendtrans-147.2137.4177.9-70.8-173.217000111M353 P414 Y416M353-E355 PolarHBondContact O-N 2.72Å; E355-P414 WeakPolarHBondContact OE1-CB 3.45Å; E355-Y416 HydrophobicContact CG-CE1 4.43Å; E355-Y416 WeakPolarHBondContact OE1-CE1 3.4Å; E355-Y416 PolarHBondContact OE1-OH 2.79Å
356P88.6Confident92.2Very high81 Ų8127.5 Ų27.553%0.52616%0.155SC..SBendcis-77.4135.90.231.1-34.4000112.9T358 Q410P356-T358 HydrophobicContact CB-CG2 4.31Å; P356-T358 HydrophobicContact CG-CG2 4.31Å; P356-T358 PolarHBondContact O-N 3.32Å; P356-T358 VanDerWaalsContact O-N 3.07Å; P356-Q410 HydrophobicContact CB-CG 4.4Å
357K91.7Very high92.1Very high8 Ų828.4 Ų28.44%0.03516%0.158CC..  trans-74.899.8173.9-66.4-169.3169.967.50110.1F267 T268 A352 N354 Q410 L411 Y415F267-K357 HydrophobicContact CD1-CB 4.48Å; F267-K357 WeakPolarHBondContact CD1-O 3.38Å; T268-K357 WeakPolarHBondContact OG1-CD 3.45Å; T268-K357 VanDerWaalsContact OG1-CE 3.23Å; T268-K357 WeakPolarHBondContact OG1-CE 3.4Å; A352-K357 WeakPolarHBondContact O-CE 3.25Å; A352-K357 PolarHBondContact O-NZ 3.18Å; N354-K357 WeakPolarHBondContact O-CE 3.5Å; N354-K357 WeakPolarHBondContact O-CG 3.49Å; N354-K357 PolarHBondContact O-NZ 2.95Å; K357-Q410 WeakPolarHBondContact O-CA 3.39Å; K357-L411 HydrophobicContact CB-CD1 3.98Å; K357-L411 HydrophobicContact CB-CG 4.21Å; K357-L411 HydrophobicContact CD-CD1 4Å; K357-L411 PolarHBondContact O-N 3.11Å; K357-L411 VanDerWaalsContact O-N 3.1Å; K357-Y415 WeakPolarHBondContact CE-O 3.5Å; K357-Y415 PolarHBondContact NZ-O 2.76Å
358T92.6Very high92Very high41 Ų4128 Ų2825%0.25216%0.156SC..EExtended strand (participates in β ladder)trans-111.2150174.677.30000110.9C271 P356 F409 Q410C271-T358 WeakPolarHBondContact CA-O 3.5Å; C271-T358 WeakPolarHBondContact CB-O 3.38Å; C271-T358 PolarHBondContact SG-N 3.13Å; C271-T358 VanDerWaalsContact SG-N 3.4Å; C271-T358 PolarHBondContact SG-O 2.69Å; C271-T358 VanDerWaalsContact SG-O 3.36Å; P356-T358 HydrophobicContact CB-CG2 4.31Å; P356-T358 HydrophobicContact CG-CG2 4.31Å; P356-T358 PolarHBondContact O-N 3.32Å; P356-T358 VanDerWaalsContact O-N 3.07Å; T358-F409 CarbonylContact C-O 3.53Å; T358-F409 VanDerWaalsContact CA-O 3.32Å; T358-F409 WeakPolarHBondContact CA-O 3.29Å; T358-Q410 HydrophobicContact CG2-CB 4.11Å; T358-Q410 HydrophobicContact CG2-CG 4.06Å
359C93.1Very high91.8Very high6 Ų630.8 Ų30.84%0.04117%0.17CC..EExtended strand (participates in β ladder)trans-151.7144.8176.8-1700000111.8F267 L270 L364 T408 F409F267-C359 HydrophobicContact CD1-CB 3.77Å; F267-C359 HydrophobicContact CD2-CB 4.13Å; F267-C359 HydrophobicContact CE1-CB 3.72Å; F267-C359 HydrophobicContact CE2-CB 4.08Å; F267-C359 HydrophobicContact CG-CB 3.99Å; F267-C359 HydrophobicContact CZ-CB 3.87Å; L270-C359 VanDerWaalsContact CB-SG 3.59Å; C359-L364 HydrophobicContact CB-CD2 4.32Å; C359-L364 HydrophobicContact CB-CG 4.32Å; C359-T408 WeakPolarHBondContact O-CA 3.49Å; C359-F409 PolarHBondContact N-O 3.29Å; C359-F409 PolarHBondContact O-N 3.49Å
360S93.8Very high91.6Very high42 Ų4236.4 Ų36.429%0.29420%0.196SC..EExtended strand (participates in β ladder)trans-77.4146.7173.677.80000111.8T362 A363 L364S360-T362 PolarHBondContact O-N 3.3Å; S360-A363 PolarHBondContact O-N 3.46Å; S360-A363 WeakPolarHBondContact OG-CB 3.25Å; S360-A363 PolarHBondContact OG-N 2.91Å; S360-L364 WeakPolarHBondContact O-CG 3.36Å; S360-L364 PolarHBondContact O-N 3.19Å
361T92.6Very high91.2Very high3 Ų340 Ų402%0.01822%0.216CC..Hα-helixtrans-60.3-25172.251.30000112.8K365 L388 G407 F409T361-K365 WeakPolarHBondContact O-CD 3.38Å; T361-K365 WeakPolarHBondContact O-CE 3.45Å; T361-K365 WeakPolarHBondContact O-CG 3.37Å; T361-K365 PolarHBondContact O-N 3.3Å; T361-K365 VanDerWaalsContact O-N 3.13Å; T361-L388 HydrophobicContact CG2-CD1 4.07Å; T361-G407 PolarHBondContact N-O 2.75Å; T361-G407 PolarHBondContact OG1-N 3.27Å; T361-G407 PolarHBondContact OG1-O 3.24Å; T361-F409 HydrophobicContact CG2-CD2 3.61Å; T361-F409 HydrophobicContact CG2-CE2 3.45Å; T361-F409 VanDerWaalsContact CG2-CE2 3.45Å
362T92.9Very high90.8Very high100 Ų10043.4 Ų43.461%0.61323%0.231SC*.Hα-helixtrans-72.8-45.9175.7-52.70000111.5S360 L364 K365 K366S360-T362 PolarHBondContact O-N 3.3Å; T362-L364 PolarHBondContact O-N 2.9Å; T362-K365 PolarHBondContact O-N 2.89Å; T362-K366 PolarHBondContact O-N 2.88Å
363A93.3Very high90Very high27 Ų2748.3 Ų48.322%0.22326%0.263CS..Hα-helixtrans-62.9-41.4175.400000111.8L270 S360 K365 K366 Y367L270-A363 HydrophobicContact CD1-CB 4.22Å; L270-A363 HydrophobicContact CD2-CB 4.42Å; S360-A363 PolarHBondContact O-N 3.46Å; S360-A363 WeakPolarHBondContact OG-CB 3.25Å; S360-A363 PolarHBondContact OG-N 2.91Å; A363-K365 VanDerWaalsContact C-N 3.34Å; A363-K365 PolarHBondContact O-N 3.38Å; A363-K366 PolarHBondContact O-N 3.38Å; A363-Y367 WeakPolarHBondContact O-CB 3.49Å; A363-Y367 PolarHBondContact O-N 3.25Å
364L92.1Very high89.2Confident0 Ų049.7 Ų49.70%028%0.278CS..Hα-helixtrans-61.5-40.2174.5-66.1168.8000112.4L263 A266 F267 L270 C359 S360 T362 I368 L384 L388L263-L364 HydrophobicContact CD2-CD1 4.45Å; L263-L364 HydrophobicContact CD2-CD2 4.12Å; A266-L364 HydrophobicContact CB-CD2 4.15Å; F267-L364 HydrophobicContact CD2-CD1 4.48Å; F267-L364 HydrophobicContact CD2-CD2 3.7Å; F267-L364 HydrophobicContact CE2-CD1 3.56Å; F267-L364 HydrophobicContact CE2-CD2 3.6Å; F267-L364 HydrophobicContact CE2-CG 4.16Å; F267-L364 HydrophobicContact CZ-CD1 4.01Å; L270-L364 HydrophobicContact CD1-CD2 3.98Å; C359-L364 HydrophobicContact CB-CD2 4.32Å; C359-L364 HydrophobicContact CB-CG 4.32Å; S360-L364 WeakPolarHBondContact O-CG 3.36Å; S360-L364 PolarHBondContact O-N 3.19Å; T362-L364 PolarHBondContact O-N 2.9Å; L364-I368 WeakPolarHBondContact O-CB 3.23Å; L364-I368 WeakPolarHBondContact O-CD1 3.42Å; L364-I368 WeakPolarHBondContact O-CG1 3.39Å; L364-I368 PolarHBondContact O-N 3.23Å; L364-L384 HydrophobicContact CB-CD2 4.17Å; L364-L388 HydrophobicContact CD1-CD1 4.27Å; L364-L388 HydrophobicContact CD1-CD2 4.34Å
365K92.2Very high88.4Confident50 Ų5056.3 Ų56.322%0.21732%0.319CS..Hα-helixtrans-63-46.6175.2-72.5158.1-166.4164.20111.3T361 T362 A363 L369 L384 F405T361-K365 WeakPolarHBondContact O-CD 3.38Å; T361-K365 WeakPolarHBondContact O-CE 3.45Å; T361-K365 WeakPolarHBondContact O-CG 3.37Å; T361-K365 PolarHBondContact O-N 3.3Å; T361-K365 VanDerWaalsContact O-N 3.13Å; T362-K365 PolarHBondContact O-N 2.89Å; A363-K365 VanDerWaalsContact C-N 3.34Å; A363-K365 PolarHBondContact O-N 3.38Å; K365-L369 WeakPolarHBondContact O-CB 3.35Å; K365-L369 WeakPolarHBondContact O-CD1 3.33Å; K365-L369 VanDerWaalsContact O-CG 3.25Å; K365-L369 WeakPolarHBondContact O-CG 3.23Å; K365-L369 PolarHBondContact O-N 3.03Å; K365-L384 HydrophobicContact CG-CD2 3.89Å; K365-F405 HydrophobicContact CD-CZ 4.48Å; K365-F405 HydrophobicContact CG-CZ 4.47Å
366K92.7Very high88.1Confident102 Ų10257.1 Ų57.144%0.44333%0.326SS..Hα-helixtrans-55.5-59.9175.5-179-174.3171.8-169.70109.9E333 T362 A363 I368 L369 E370E333-K366 IonicContact OE1-NZ 2.7Å; E333-K366 PolarHBondContact OE1-NZ 2.98Å; T362-K366 PolarHBondContact O-N 2.88Å; A363-K366 PolarHBondContact O-N 3.38Å; K366-I368 PolarHBondContact O-N 2.94Å; K366-L369 PolarHBondContact O-N 3.27Å; K366-E370 VanDerWaalsContact CE-CD 3.42Å; K366-E370 WeakPolarHBondContact CE-OE1 3.35Å; K366-E370 VanDerWaalsContact CE-OE2 3.25Å; K366-E370 WeakPolarHBondContact CE-OE2 3.31Å; K366-E370 VanDerWaalsContact CG-CD 3.44Å; K366-E370 WeakPolarHBondContact CG-OE1 3.48Å; K366-E370 WeakPolarHBondContact CG-OE2 3.11Å; K366-E370 WeakPolarHBondContact O-CG 3.49Å; K366-E370 PolarHBondContact O-N 3.29Å; K366-E370 VanDerWaalsContact O-N 3.09Å
367Y91.1Very high88.1Confident19 Ų1956.3 Ų56.38%0.07532%0.322CS..Hα-helixtrans-55.1-45-177.3-177-83.5000113.7I262 A266 R269 L270 A363 E370 N371I262-Y367 HydrophobicContact CG2-CE1 4.48Å; A266-Y367 HydrophobicContact CB-CD1 3.64Å; A266-Y367 HydrophobicContact CB-CE1 3.58Å; A266-Y367 HydrophobicContact CB-CG 4.28Å; R269-Y367 HydrophobicContact CB-CE2 3.93Å; R269-Y367 HydrophobicContact CG-CE2 3.74Å; L270-Y367 HydrophobicContact CD1-CD2 4.16Å; L270-Y367 HydrophobicContact CD1-CG 3.98Å; L270-Y367 HydrophobicContact CD2-CD2 4Å; L270-Y367 HydrophobicContact CD2-CG 4.48Å; L270-Y367 HydrophobicContact CG-CD2 4.05Å; L270-Y367 HydrophobicContact CG-CG 4.39Å; A363-Y367 WeakPolarHBondContact O-CB 3.49Å; A363-Y367 PolarHBondContact O-N 3.25Å; Y367-E370 PolarHBondContact O-N 2.82Å; Y367-N371 HydrophobicContact CD1-CB 4.24Å; Y367-N371 WeakPolarHBondContact CD2-ND2 3.16Å; Y367-N371 HydrophobicContact CE1-CB 3.92Å; Y367-N371 VanDerWaalsContact O-CB 3.31Å; Y367-N371 WeakPolarHBondContact O-CB 3.4Å; Y367-N371 PolarHBondContact O-N 3.05Å; Y367-N371 PolarHBondContact O-ND2 2.82Å
368I90.1Very high87.9Confident3 Ų362.4 Ų62.42%0.01536%0.355CS..Hα-helixtrans-70.6-33.5-176.6-72.7161.9000112L259 L364 K366 E370 H372 L384L259-I368 HydrophobicContact CD1-CD1 3.77Å; L259-I368 HydrophobicContact CD1-CG1 4Å; L259-I368 HydrophobicContact CD1-CG2 3.95Å; L259-I368 HydrophobicContact CG-CD1 4.4Å; L364-I368 WeakPolarHBondContact O-CB 3.23Å; L364-I368 WeakPolarHBondContact O-CD1 3.42Å; L364-I368 WeakPolarHBondContact O-CG1 3.39Å; L364-I368 PolarHBondContact O-N 3.23Å; K366-I368 PolarHBondContact O-N 2.94Å; I368-E370 VanDerWaalsContact C-N 3.33Å; I368-H372 CarbonylContact O-C 3.55Å; I368-H372 PolarHBondContact O-N 3Å; I368-L384 HydrophobicContact CD1-CD1 3.54Å; I368-L384 HydrophobicContact CD1-CD2 3.76Å; I368-L384 HydrophobicContact CD1-CG 4.13Å
369L89.4Confident87.6Confident65 Ų6566.7 Ų66.734%0.3437%0.371SS..Hα-helixtrans-71.5-29.7174.7-68.9170.3000112.3K365 K366 V381K365-L369 WeakPolarHBondContact O-CB 3.35Å; K365-L369 WeakPolarHBondContact O-CD1 3.33Å; K365-L369 VanDerWaalsContact O-CG 3.25Å; K365-L369 WeakPolarHBondContact O-CG 3.23Å; K365-L369 PolarHBondContact O-N 3.03Å; K366-L369 PolarHBondContact O-N 3.27Å; L369-V381 HydrophobicContact CD1-CG2 4.44Å
370E88.7Confident87.4Confident117 Ų11767.6 Ų67.655%0.54737%0.374SS..Hα-helixtrans-86.1-47.6-179-70.5167.9171.300113.2K366 Y367 I368K366-E370 VanDerWaalsContact CE-CD 3.42Å; K366-E370 WeakPolarHBondContact CE-OE1 3.35Å; K366-E370 VanDerWaalsContact CE-OE2 3.25Å; K366-E370 WeakPolarHBondContact CE-OE2 3.31Å; K366-E370 VanDerWaalsContact CG-CD 3.44Å; K366-E370 WeakPolarHBondContact CG-OE1 3.48Å; K366-E370 WeakPolarHBondContact CG-OE2 3.11Å; K366-E370 WeakPolarHBondContact O-CG 3.49Å; K366-E370 PolarHBondContact O-N 3.29Å; K366-E370 VanDerWaalsContact O-N 3.09Å; Y367-E370 PolarHBondContact O-N 2.82Å; I368-E370 VanDerWaalsContact C-N 3.33Å
371N85.9Confident87.2Confident76 Ų7667.7 Ų67.741%0.40637%0.373SS..Hα-helixtrans-89.3-19.3-170.8-67.3-111.7000112.7Y367Y367-N371 HydrophobicContact CD1-CB 4.24Å; Y367-N371 WeakPolarHBondContact CD2-ND2 3.16Å; Y367-N371 HydrophobicContact CE1-CB 3.92Å; Y367-N371 VanDerWaalsContact O-CB 3.31Å; Y367-N371 WeakPolarHBondContact O-CB 3.4Å; Y367-N371 PolarHBondContact O-N 3.05Å; Y367-N371 PolarHBondContact O-ND2 2.82Å
372H82.5Confident87.1Confident73 Ų7371.9 Ų71.934%0.33839%0.392SS..SBendtrans-139.961.9179.8-58.3-60.3000110.6I262 I368 G374 Q380I262-H372 WeakPolarHBondContact CG2-NE2 3.4Å; I368-H372 CarbonylContact O-C 3.55Å; I368-H372 PolarHBondContact O-N 3Å; H372-G374 PolarHBondContact O-N 2.81Å; H372-Q380 PolarHBondContact O-NE2 3.34Å
373P78.3Confident87Confident103 Ų10370.1 Ų70.167%0.66938%0.379SS*.  trans-59.9113.3-176.925.7-35000111.2
374G72.7Confident86.9Confident34 Ų3468.9 Ų68.935%0.35137%0.369SS..  trans-97161.7178.900000112.2H372 N376 Q380H372-G374 PolarHBondContact O-N 2.81Å; G374-N376 PolarHBondContact O-N 3.06Å; G374-Q380 VanDerWaalsContact CA-CD 3.46Å
375T74.2Confident86.9Confident145 Ų14572.8 Ų72.889%0.8939%0.386SS*.SBendtrans-52.1-21.8-175.8-32.10000114.8
376N82.1Confident87Confident105 Ų10578 Ų7856%0.56140%0.404SS*.  trans-147.5113.5174.7-81.4-87000110.9G374 N378 F379 Q380G374-N376 PolarHBondContact O-N 3.06Å; N376-N378 VanDerWaalsContact C-N 3.34Å; N376-N378 PolarHBondContact O-N 3.47Å; N376-F379 HydrophobicContact CB-CB 3.83Å; N376-F379 WeakPolarHBondContact O-CB 3.41Å; N376-F379 PolarHBondContact O-N 3.43Å; N376-Q380 PolarHBondContact O-N 3.17Å; N376-Q380 VanDerWaalsContact O-N 3.12Å
377S87.6Confident86.9Confident63 Ų6373.5 Ų73.544%0.44139%0.385SS..Hα-helixtrans-53.6-45.3178.655.90000113.4F379 Q380 V381S377-F379 VanDerWaalsContact C-N 3.3Å; S377-F379 PolarHBondContact O-N 3.09Å; S377-Q380 WeakPolarHBondContact O-CB 3.44Å; S377-Q380 PolarHBondContact O-N 3.22Å; S377-Q380 VanDerWaalsContact O-N 3.12Å; S377-V381 WeakPolarHBondContact O-CG2 3.26Å; S377-V381 PolarHBondContact O-N 3.17Å
378N87.2Confident87Confident136 Ų13672.7 Ų72.773%0.72738%0.382SS*.Hα-helixtrans-58.6-38.7175.6-78.9-69.4000112.9N376 H382N376-N378 VanDerWaalsContact C-N 3.34Å; N376-N378 PolarHBondContact O-N 3.47Å; N378-H382 PolarHBondContact O-N 2.79Å; N378-H382 VanDerWaalsContact O-N 3.11Å
379F88.1Confident87.1Confident131 Ų13175.6 Ų75.658%0.57540%0.395SS*.Hα-helixtrans-67.3-38.7176.5179.5-98.9000111.2N376 S377 H382 L383N376-F379 HydrophobicContact CB-CB 3.83Å; N376-F379 WeakPolarHBondContact O-CB 3.41Å; N376-F379 PolarHBondContact O-N 3.43Å; S377-F379 VanDerWaalsContact C-N 3.3Å; S377-F379 PolarHBondContact O-N 3.09Å; F379-H382 CarbonylContact O-C 3.52Å; F379-H382 PolarHBondContact O-N 3.09Å; F379-L383 HydrophobicContact CE1-CD2 4.5Å; F379-L383 WeakPolarHBondContact O-CB 3.19Å; F379-L383 PolarHBondContact O-N 3.12Å
380Q87Confident87.2Confident25 Ų2576.6 Ų76.612%0.11740%0.397CS..Hα-helixtrans-66.9-41.9176.7-62-167.8-78.500113H372 G374 N376 S377 H382 L383 L384H372-Q380 PolarHBondContact O-NE2 3.34Å; G374-Q380 VanDerWaalsContact CA-CD 3.46Å; N376-Q380 PolarHBondContact O-N 3.17Å; N376-Q380 VanDerWaalsContact O-N 3.12Å; S377-Q380 WeakPolarHBondContact O-CB 3.44Å; S377-Q380 PolarHBondContact O-N 3.22Å; S377-Q380 VanDerWaalsContact O-N 3.12Å; Q380-H382 VanDerWaalsContact C-N 3.26Å; Q380-H382 PolarHBondContact O-N 3Å; Q380-L383 PolarHBondContact O-N 3.31Å; Q380-L384 WeakPolarHBondContact O-CB 3.4Å; Q380-L384 PolarHBondContact O-N 3Å
381V89.6Confident87.3Confident44 Ų4471 Ų7127%0.26737%0.371SS..Hα-helixtrans-61.8-37.5174.8174.50000110.7L369 S377 K385 F405L369-V381 HydrophobicContact CD1-CG2 4.44Å; S377-V381 WeakPolarHBondContact O-CG2 3.26Å; S377-V381 PolarHBondContact O-N 3.17Å; V381-K385 PolarHBondContact O-N 2.91Å; V381-K385 VanDerWaalsContact O-N 3.09Å; V381-F405 HydrophobicContact CG1-CE1 3.71Å; V381-F405 HydrophobicContact CG1-CZ 4.12Å; V381-F405 WeakPolarHBondContact O-CZ 3.17Å
382H90.4Very high87.5Confident92 Ų9270.8 Ų70.843%0.42637%0.367SS..Hα-helixtrans-72.1-35.2173.5-175-96.3000113.4N378 F379 Q380 K385 R386N378-H382 PolarHBondContact O-N 2.79Å; N378-H382 VanDerWaalsContact O-N 3.11Å; F379-H382 CarbonylContact O-C 3.52Å; F379-H382 PolarHBondContact O-N 3.09Å; Q380-H382 VanDerWaalsContact C-N 3.26Å; Q380-H382 PolarHBondContact O-N 3Å; H382-K385 WeakPolarHBondContact O-CB 3.29Å; H382-K385 PolarHBondContact O-N 3.39Å; H382-R386 PolarHBondContact O-N 3.12Å; H382-R386 VanDerWaalsContact O-N 3.09Å
383L91.4Very high87.9Confident63 Ų6374.8 Ų74.833%0.3338%0.383SS..Hα-helixtrans-64.3-48.6173.2-177.561000110.5L259 F379 Q380 K385 R386 T387L259-L383 HydrophobicContact CD2-CB 4.41Å; L259-L383 HydrophobicContact CD2-CD2 4.26Å; L259-L383 HydrophobicContact CD2-CG 3.96Å; F379-L383 HydrophobicContact CE1-CD2 4.5Å; F379-L383 WeakPolarHBondContact O-CB 3.19Å; F379-L383 PolarHBondContact O-N 3.12Å; Q380-L383 PolarHBondContact O-N 3.31Å; L383-K385 VanDerWaalsContact C-N 3.3Å; L383-K385 PolarHBondContact O-N 3.31Å; L383-R386 CarbonylContact O-C 3.54Å; L383-R386 WeakPolarHBondContact O-CB 3.16Å; L383-R386 PolarHBondContact O-N 3.34Å; L383-T387 WeakPolarHBondContact O-CB 3.41Å; L383-T387 PolarHBondContact O-N 3.46Å; L383-T387 PolarHBondContact O-OG1 3.22Å
384L91.8Very high88.3Confident1 Ų171.7 Ų71.71%0.00536%0.361CS..Hα-helixtrans-54.4-44.1173.7177.956.8000112L259 L263 L364 K365 I368 Q380 R386 T387 L388 F405L259-L384 HydrophobicContact CD2-CB 3.91Å; L259-L384 HydrophobicContact CD2-CD1 4.28Å; L263-L384 HydrophobicContact CD2-CD1 4.04Å; L364-L384 HydrophobicContact CB-CD2 4.17Å; K365-L384 HydrophobicContact CG-CD2 3.89Å; I368-L384 HydrophobicContact CD1-CD1 3.54Å; I368-L384 HydrophobicContact CD1-CD2 3.76Å; I368-L384 HydrophobicContact CD1-CG 4.13Å; Q380-L384 WeakPolarHBondContact O-CB 3.4Å; Q380-L384 PolarHBondContact O-N 3Å; L384-R386 PolarHBondContact O-N 3.36Å; L384-T387 PolarHBondContact O-N 3.05Å; L384-L388 HydrophobicContact CD1-CD1 4.08Å; L384-L388 HydrophobicContact CD1-CD2 4.39Å; L384-L388 HydrophobicContact CD1-CG 3.9Å; L384-L388 HydrophobicContact CG-CD1 4.31Å; L384-L388 WeakPolarHBondContact O-CG 3.34Å; L384-L388 PolarHBondContact O-N 3Å; L384-F405 HydrophobicContact CB-CZ 4.39Å; L384-F405 HydrophobicContact CD2-CE2 4.44Å; L384-F405 HydrophobicContact CD2-CZ 4.27Å; L384-F405 HydrophobicContact CG-CE2 4.05Å; L384-F405 HydrophobicContact CG-CZ 4.17Å
385K92.8Very high89.1Confident82 Ų8272 Ų7236%0.35737%0.365SS..Hα-helixtrans-56.5-48.5173.7176.9172.4-179.4-177.40112.3V381 H382 L383 T387 Q389 F405V381-K385 PolarHBondContact O-N 2.91Å; V381-K385 VanDerWaalsContact O-N 3.09Å; H382-K385 WeakPolarHBondContact O-CB 3.29Å; H382-K385 PolarHBondContact O-N 3.39Å; L383-K385 VanDerWaalsContact C-N 3.3Å; L383-K385 PolarHBondContact O-N 3.31Å; K385-T387 VanDerWaalsContact C-N 3.34Å; K385-Q389 WeakPolarHBondContact O-CB 3.21Å; K385-Q389 VanDerWaalsContact O-CG 3.29Å; K385-Q389 WeakPolarHBondContact O-CG 3.27Å; K385-Q389 PolarHBondContact O-N 3.35Å; K385-F405 VanDerWaalsContact CA-CE2 3.41Å; K385-F405 HydrophobicContact CB-CB 4.47Å; K385-F405 HydrophobicContact CB-CD1 3.83Å; K385-F405 HydrophobicContact CB-CD2 3.67Å; K385-F405 HydrophobicContact CB-CE1 3.85Å; K385-F405 HydrophobicContact CB-CE2 3.72Å; K385-F405 HydrophobicContact CB-CG 3.72Å; K385-F405 HydrophobicContact CB-CZ 3.79Å; K385-F405 HydrophobicContact CD-CB 3.88Å; K385-F405 HydrophobicContact CD-CD1 3.83Å; K385-F405 HydrophobicContact CD-CG 3.86Å; K385-F405 HydrophobicContact CG-CB 3.84Å; K385-F405 HydrophobicContact CG-CD1 3.99Å; K385-F405 HydrophobicContact CG-CD2 3.9Å; K385-F405 HydrophobicContact CG-CE2 4.46Å; K385-F405 HydrophobicContact CG-CG 3.63Å
386R92.8Very high89.9Confident160 Ų16065.6 Ų65.660%0.60432%0.324SS*.Hα-helixtrans-65.7-37.6178-176.5177.3-72.9168.5-5111.8H382 L383 L384 K390H382-R386 PolarHBondContact O-N 3.12Å; H382-R386 VanDerWaalsContact O-N 3.09Å; L383-R386 CarbonylContact O-C 3.54Å; L383-R386 WeakPolarHBondContact O-CB 3.16Å; L383-R386 PolarHBondContact O-N 3.34Å; L384-R386 PolarHBondContact O-N 3.36Å; R386-K390 WeakPolarHBondContact O-CB 3.16Å; R386-K390 PolarHBondContact O-N 3.48Å
387T91.9Very high90.3Very high7 Ų760.8 Ų60.84%0.04330%0.299CS..Hα-helixtrans-67.9-51179.5-60.80000112L259 E260 L263 L383 L384 K385 Q389 K390 C391L259-T387 HydrophobicContact CB-CG2 4.39Å; E260-T387 HydrophobicContact CB-CG2 4.44Å; E260-T387 HydrophobicContact CG-CG2 3.66Å; L263-T387 HydrophobicContact CD1-CG2 3.55Å; L383-T387 WeakPolarHBondContact O-CB 3.41Å; L383-T387 PolarHBondContact O-N 3.46Å; L383-T387 PolarHBondContact O-OG1 3.22Å; L384-T387 PolarHBondContact O-N 3.05Å; K385-T387 VanDerWaalsContact C-N 3.34Å; T387-Q389 VanDerWaalsContact C-N 3.33Å; T387-Q389 PolarHBondContact O-N 2.86Å; T387-K390 WeakPolarHBondContact O-CA 3.44Å; T387-K390 VanDerWaalsContact O-CB 3.32Å; T387-K390 WeakPolarHBondContact O-CB 3.42Å; T387-K390 PolarHBondContact O-N 2.94Å; T387-C391 PolarHBondContact O-N 2.87Å; T387-C391 PolarHBondContact O-SG 3.42Å; T387-C391 VanDerWaalsContact O-SG 3.32Å
388L92.4Very high90.5Very high1 Ų163 Ų631%0.00530%0.302CS..Hα-helixtrans-58.7-45.5177.4-68.9178.7000111.2L263 T361 L364 L384 K390 C391 E392 M397 F405 F409L263-L388 HydrophobicContact CD1-CD2 3.9Å; L263-L388 HydrophobicContact CD2-CD2 3.95Å; T361-L388 HydrophobicContact CG2-CD1 4.07Å; L364-L388 HydrophobicContact CD1-CD1 4.27Å; L364-L388 HydrophobicContact CD1-CD2 4.34Å; L384-L388 HydrophobicContact CD1-CD1 4.08Å; L384-L388 HydrophobicContact CD1-CD2 4.39Å; L384-L388 HydrophobicContact CD1-CG 3.9Å; L384-L388 HydrophobicContact CG-CD1 4.31Å; L384-L388 WeakPolarHBondContact O-CG 3.34Å; L384-L388 PolarHBondContact O-N 3Å; L388-K390 PolarHBondContact O-N 3.01Å; L388-C391 PolarHBondContact O-N 2.94Å; L388-E392 VanDerWaalsContact O-CB 3.27Å; L388-E392 WeakPolarHBondContact O-CB 3.33Å; L388-E392 PolarHBondContact O-N 3.05Å; L388-M397 HydrophobicContact CD2-CE 3.49Å; L388-M397 VanDerWaalsContact CD2-CE 3.49Å; L388-M397 HydrophobicContact CD2-SD 4.04Å; L388-F405 HydrophobicContact CD1-CD2 4.39Å; L388-F405 HydrophobicContact CD1-CE2 4.07Å; L388-F409 HydrophobicContact CB-CE1 4.28Å; L388-F409 HydrophobicContact CB-CZ 4.42Å; L388-F409 HydrophobicContact CD1-CD2 4.28Å; L388-F409 HydrophobicContact CD1-CE2 4.2Å; L388-F409 HydrophobicContact CD1-CZ 4.46Å
389Q92.1Very high90.8Very high65 Ų6558.6 Ų58.630%0.30428%0.277SS..Hα-helixtrans-62.9-24.4175.1-71.8-176.8-20.700113.8K385 T387 K393K385-Q389 WeakPolarHBondContact O-CB 3.21Å; K385-Q389 VanDerWaalsContact O-CG 3.29Å; K385-Q389 WeakPolarHBondContact O-CG 3.27Å; K385-Q389 PolarHBondContact O-N 3.35Å; T387-Q389 VanDerWaalsContact C-N 3.33Å; T387-Q389 PolarHBondContact O-N 2.86Å; Q389-K393 WeakPolarHBondContact O-CB 3.32Å; Q389-K393 WeakPolarHBondContact O-CD 3.49Å; Q389-K393 WeakPolarHBondContact O-CG 3.4Å; Q389-K393 PolarHBondContact O-N 2.81Å
390K91.6Very high91.1Very high85 Ų8556.3 Ų56.337%0.3727%0.27SS..Hα-helixtrans-77.3-44.3173.8-169.5-161-174.6-167.50110.9E260 R386 T387 L388 K393 N394E260-K390 WeakPolarHBondContact OE1-CD 3.49Å; E260-K390 IonicContact OE1-NZ 2.58Å; E260-K390 PolarHBondContact OE1-NZ 2.99Å; E260-K390 IonicContact OE2-NZ 3.25Å; E260-K390 PolarHBondContact OE2-NZ 3.25Å; R386-K390 WeakPolarHBondContact O-CB 3.16Å; R386-K390 PolarHBondContact O-N 3.48Å; T387-K390 WeakPolarHBondContact O-CA 3.44Å; T387-K390 VanDerWaalsContact O-CB 3.32Å; T387-K390 WeakPolarHBondContact O-CB 3.42Å; T387-K390 PolarHBondContact O-N 2.94Å; L388-K390 PolarHBondContact O-N 3.01Å; K390-K393 PolarHBondContact O-N 3.31Å; K390-N394 WeakPolarHBondContact O-CB 3.5Å; K390-N394 PolarHBondContact O-N 3.28Å; K390-N394 VanDerWaalsContact O-N 3.1Å; K390-N394 PolarHBondContact O-ND2 3.04Å
391C90.4Very high91.3Very high0 Ų058.4 Ų58.40%029%0.287CS..Hα-helixtrans-64.4-44.4177.6-61.40000111.5T387 L388 N394 G395 W396 M397T387-C391 PolarHBondContact O-N 2.87Å; T387-C391 PolarHBondContact O-SG 3.42Å; T387-C391 VanDerWaalsContact O-SG 3.32Å; L388-C391 PolarHBondContact O-N 2.94Å; C391-N394 CarbonylContact O-C 3.59Å; C391-N394 PolarHBondContact O-N 3.48Å; C391-N394 VanDerWaalsContact O-N 3.16Å; C391-G395 PolarHBondContact O-N 2.82Å; C391-G395 VanDerWaalsContact O-N 3.08Å; C391-W396 HydrophobicContact CB-CB 4.19Å; C391-W396 HydrophobicContact CB-CE3 4.29Å; C391-W396 PolarHBondContact O-N 3.32Å; C391-M397 HydrophobicContact CB-CB 4.04Å; C391-M397 HydrophobicContact CB-CG 3.74Å; C391-M397 HydrophobicContact CB-SD 3.44Å; C391-M397 WeakPolarHBondContact CB-SD 3.34Å
392E90.6Very high91.2Very high71 Ų7158.4 Ų58.433%0.33230%0.296SS..Hα-helixtrans-53.1-56.6171.4-176.1-166.1171.800111.2L388 N394 G395 M397L388-E392 VanDerWaalsContact O-CB 3.27Å; L388-E392 WeakPolarHBondContact O-CB 3.33Å; L388-E392 PolarHBondContact O-N 3.05Å; E392-N394 PolarHBondContact O-N 3.11Å; E392-N394 VanDerWaalsContact O-N 3.07Å; E392-G395 PolarHBondContact O-N 3.36Å; E392-M397 WeakPolarHBondContact CA-O 3.25Å
393K90.5Very high91Very high157 Ų15763 Ų6368%0.68331%0.314SS*.THydrogen-bonded Turntrans-67.2-7.9178.7-70.9174.1-175178.90115.2Q389 K390Q389-K393 WeakPolarHBondContact O-CB 3.32Å; Q389-K393 WeakPolarHBondContact O-CD 3.49Å; Q389-K393 WeakPolarHBondContact O-CG 3.4Å; Q389-K393 PolarHBondContact O-N 2.81Å; K390-K393 PolarHBondContact O-N 3.31Å
394N88.2Confident90.6Very high38 Ų3861.3 Ų61.320%0.20331%0.312CS..THydrogen-bonded Turntrans-106.2-2.1173.5-69.3-19.4000112.6K131 K390 C391 E392 W396K131-N394 PolarHBondContact NZ-OD1 3.4Å; K390-N394 WeakPolarHBondContact O-CB 3.5Å; K390-N394 PolarHBondContact O-N 3.28Å; K390-N394 VanDerWaalsContact O-N 3.1Å; K390-N394 PolarHBondContact O-ND2 3.04Å; C391-N394 CarbonylContact O-C 3.59Å; C391-N394 PolarHBondContact O-N 3.48Å; C391-N394 VanDerWaalsContact O-N 3.16Å; E392-N394 PolarHBondContact O-N 3.11Å; E392-N394 VanDerWaalsContact O-N 3.07Å; N394-W396 VanDerWaalsContact C-N 3.28Å; N394-W396 HydrophobicContact CB-CD2 3.66Å; N394-W396 VanDerWaalsContact CB-CE2 3.47Å; N394-W396 HydrophobicContact CB-CE3 4.2Å; N394-W396 HydrophobicContact CB-CG 3.98Å; N394-W396 HydrophobicContact CB-CH2 4.37Å; N394-W396 HydrophobicContact CB-CZ2 3.84Å; N394-W396 WeakPolarHBondContact ND2-CH2 3.29Å; N394-W396 VanDerWaalsContact ND2-CZ2 3.27Å; N394-W396 WeakPolarHBondContact ND2-CZ2 3.44Å; N394-W396 WeakPolarHBondContact ND2-CZ3 3.34Å; N394-W396 PolarHBondContact O-N 3.1Å
395G88.9Confident90.2Very high41 Ų4163.2 Ų63.242%0.42332%0.321SS..THydrogen-bonded Turntrans72.515.2-177.100000114.6C391 E392 C412 F413C391-G395 PolarHBondContact O-N 2.82Å; C391-G395 VanDerWaalsContact O-N 3.08Å; E392-G395 PolarHBondContact O-N 3.36Å; G395-C412 VanDerWaalsContact O-CB 3.31Å; G395-C412 WeakPolarHBondContact O-CB 3.35Å; G395-C412 PolarHBondContact O-SG 2.95Å; G395-F413 WeakPolarHBondContact O-CE2 3.47Å
396W89.8Confident90Very high11 Ų1161.6 Ų61.64%0.04232%0.32CS..SBendtrans-80.1-24.5178.8-55.5-21000112.4I133 P134 W136 A137 C391 N394 C412I133-W396 HydrophobicContact CB-CZ2 4.39Å; I133-W396 HydrophobicContact CG1-CZ2 4.37Å; I133-W396 HydrophobicContact CG2-CZ2 4.38Å; P134-W396 VanDerWaalsContact CD-CZ2 3.44Å; P134-W396 HydrophobicContact CG-CD2 4.43Å; P134-W396 HydrophobicContact CG-CE3 4.08Å; P134-W396 HydrophobicContact CG-CH2 4.19Å; P134-W396 HydrophobicContact CG-CZ3 3.95Å; W136-W396 HydrophobicContact CH2-CB 4Å; W136-W396 HydrophobicContact CZ3-CB 4.31Å; A137-W396 HydrophobicContact CB-CB 3.87Å; A137-W396 HydrophobicContact CB-CD2 3.88Å; A137-W396 HydrophobicContact CB-CG 3.52Å; C391-W396 HydrophobicContact CB-CB 4.19Å; C391-W396 HydrophobicContact CB-CE3 4.29Å; C391-W396 PolarHBondContact O-N 3.32Å; N394-W396 VanDerWaalsContact C-N 3.28Å; N394-W396 HydrophobicContact CB-CD2 3.66Å; N394-W396 VanDerWaalsContact CB-CE2 3.47Å; N394-W396 HydrophobicContact CB-CE3 4.2Å; N394-W396 HydrophobicContact CB-CG 3.98Å; N394-W396 HydrophobicContact CB-CH2 4.37Å; N394-W396 HydrophobicContact CB-CZ2 3.84Å; N394-W396 WeakPolarHBondContact ND2-CH2 3.29Å; N394-W396 VanDerWaalsContact ND2-CZ2 3.27Å; N394-W396 WeakPolarHBondContact ND2-CZ2 3.44Å; N394-W396 WeakPolarHBondContact ND2-CZ3 3.34Å; N394-W396 PolarHBondContact O-N 3.1Å; W396-C412 PolarHBondContact O-N 2.93Å
397M91.5Very high89.9Confident4 Ų455.3 Ų55.32%0.0231%0.305CS..EExtended strand (participates in β ladder)trans-144.5153.5-179-60.2174.367.800109.5W136 L263 F267 L388 C391 E392 F409 Q410 L411 C412W136-M397 HydrophobicContact CH2-CG 4.22Å; W136-M397 HydrophobicContact CH2-SD 4.4Å; L263-M397 HydrophobicContact CD1-SD 4.01Å; F267-M397 HydrophobicContact CD2-CE 4.37Å; F267-M397 HydrophobicContact CE1-CE 4.1Å; F267-M397 HydrophobicContact CE2-CE 3.37Å; F267-M397 HydrophobicContact CZ-CE 3.2Å; L388-M397 HydrophobicContact CD2-CE 3.49Å; L388-M397 VanDerWaalsContact CD2-CE 3.49Å; L388-M397 HydrophobicContact CD2-SD 4.04Å; C391-M397 HydrophobicContact CB-CB 4.04Å; C391-M397 HydrophobicContact CB-CG 3.74Å; C391-M397 HydrophobicContact CB-SD 3.44Å; C391-M397 WeakPolarHBondContact CB-SD 3.34Å; E392-M397 WeakPolarHBondContact CA-O 3.25Å; M397-F409 HydrophobicContact CE-CB 4.19Å; M397-Q410 CarbonylContact C-O 3.43Å; M397-Q410 WeakPolarHBondContact CA-O 3.38Å; M397-Q410 WeakPolarHBondContact CB-O 3.35Å; M397-L411 HydrophobicContact CE-CD2 4.2Å; M397-L411 HydrophobicContact CG-CD2 4.05Å; M397-L411 HydrophobicContact SD-CD2 4.39Å; M397-C412 VanDerWaalsContact CA-SG 3.53Å
398E92Very high90Very high110 Ų11057.1 Ų57.151%0.51432%0.316SS..EExtended strand (participates in β ladder)trans-120.2143.5178.3-173.1168.3-154.500110.6I400 F409 Q410E398-I400 HydrophobicContact CB-CD1 4.24Å; E398-I400 HydrophobicContact CG-CD1 3.97Å; E398-F409 CarbonylContact O-C 3.47Å; E398-F409 WeakPolarHBondContact O-CA 3.4Å; E398-Q410 PolarHBondContact N-O 3.25Å; E398-Q410 PolarHBondContact O-N 3.09Å
399Q93.8Very high90.1Very high42 Ų4257.1 Ų57.120%0.19632%0.316CS..EExtended strand (participates in β ladder)trans-88.6101.9170.7176.2158.952.700109.1S401 G404 S406 F409Q399-S401 WeakPolarHBondContact CG-O 2.81Å; Q399-S401 PolarHBondContact NE2-O 3.44Å; Q399-G404 PolarHBondContact NE2-O 3.08Å; Q399-S406 PolarHBondContact NE2-O 3.5Å; Q399-F409 HydrophobicContact CB-CD1 4.16Å; Q399-F409 HydrophobicContact CB-CE1 3.79Å; Q399-F409 HydrophobicContact CB-CZ 4.01Å; Q399-F409 HydrophobicContact CG-CE1 4.41Å; Q399-F409 HydrophobicContact CG-CE2 4.38Å; Q399-F409 HydrophobicContact CG-CZ 4.14Å
400I93.1Very high90.1Very high84 Ų8456.4 Ų56.443%0.43131%0.313SS..EExtended strand (participates in β ladder)trans-78.4-30.7-178.8-54.9-59.7000111.5E398 T408 Q410E398-I400 HydrophobicContact CB-CD1 4.24Å; E398-I400 HydrophobicContact CG-CD1 3.97Å; I400-T408 PolarHBondContact N-O 3.44Å; I400-Q410 HydrophobicContact CD1-CB 3.91Å; I400-Q410 HydrophobicContact CG1-CB 3.56Å
401S92.8Very high90.2Very high69 Ų6953 Ų5348%0.48330%0.298SS..EExtended strand (participates in β ladder)trans-151.2161.7178.1-169.60000112.6Q399 G407 T408Q399-S401 WeakPolarHBondContact CG-O 2.81Å; Q399-S401 PolarHBondContact NE2-O 3.44Å; S401-G407 CarbonylContact O-C 3.58Å; S401-G407 WeakPolarHBondContact O-CA 3.45Å; S401-T408 VanDerWaalsContact CB-OG1 3.29Å; S401-T408 WeakPolarHBondContact CB-OG1 3.48Å; S401-T408 PolarHBondContact N-O 3.24Å; S401-T408 PolarHBondContact N-OG1 3.13Å; S401-T408 PolarHBondContact O-N 2.94Å
402G86.9Confident90.2Very high43 Ų4355.7 Ų55.744%0.44332%0.316SS..SBendtrans83.7-174.5-174.800000113.4
403K85.7Confident90.1Very high188 Ų18854.2 Ų54.282%0.81731%0.309SS*.SBendtrans-133.8125.1176-16665.7173.7-179.90110.5F405 S406K403-F405 PolarHBondContact O-N 2.93Å; K403-S406 PolarHBondContact N-OG 2.98Å; K403-S406 PolarHBondContact O-OG 2.88Å
404G82.6Confident90.1Very high28 Ų2849.6 Ų49.629%0.28930%0.295SS..SBendtrans64-127.4-17900000110.9Q399 S406Q399-G404 PolarHBondContact NE2-O 3.08Å; G404-S406 PolarHBondContact O-N 2.76Å
405F84Confident90.2Very high42 Ų4249.8 Ų49.818%0.18429%0.293CS..SBendtrans-85.950.4-174.8-170-127.6000114.1K365 V381 L384 K385 L388 K403K365-F405 HydrophobicContact CD-CZ 4.48Å; K365-F405 HydrophobicContact CG-CZ 4.47Å; V381-F405 HydrophobicContact CG1-CE1 3.71Å; V381-F405 HydrophobicContact CG1-CZ 4.12Å; V381-F405 WeakPolarHBondContact O-CZ 3.17Å; L384-F405 HydrophobicContact CB-CZ 4.39Å; L384-F405 HydrophobicContact CD2-CE2 4.44Å; L384-F405 HydrophobicContact CD2-CZ 4.27Å; L384-F405 HydrophobicContact CG-CE2 4.05Å; L384-F405 HydrophobicContact CG-CZ 4.17Å; K385-F405 VanDerWaalsContact CA-CE2 3.41Å; K385-F405 HydrophobicContact CB-CB 4.47Å; K385-F405 HydrophobicContact CB-CD1 3.83Å; K385-F405 HydrophobicContact CB-CD2 3.67Å; K385-F405 HydrophobicContact CB-CE1 3.85Å; K385-F405 HydrophobicContact CB-CE2 3.72Å; K385-F405 HydrophobicContact CB-CG 3.72Å; K385-F405 HydrophobicContact CB-CZ 3.79Å; K385-F405 HydrophobicContact CD-CB 3.88Å; K385-F405 HydrophobicContact CD-CD1 3.83Å; K385-F405 HydrophobicContact CD-CG 3.86Å; K385-F405 HydrophobicContact CG-CB 3.84Å; K385-F405 HydrophobicContact CG-CD1 3.99Å; K385-F405 HydrophobicContact CG-CD2 3.9Å; K385-F405 HydrophobicContact CG-CE2 4.46Å; K385-F405 HydrophobicContact CG-CG 3.63Å; L388-F405 HydrophobicContact CD1-CD2 4.39Å; L388-F405 HydrophobicContact CD1-CE2 4.07Å; K403-F405 PolarHBondContact O-N 2.93Å
406S88.1Confident90.3Very high47 Ų4752 Ų5233%0.32929%0.289SS..SBendtrans-145.7173.3-178.464.70000111.3Q399 K403 G404Q399-S406 PolarHBondContact NE2-O 3.5Å; K403-S406 PolarHBondContact N-OG 2.98Å; K403-S406 PolarHBondContact O-OG 2.88Å; G404-S406 PolarHBondContact O-N 2.76Å
407G90.7Very high90.4Very high28 Ų2851.7 Ų51.729%0.28929%0.289SS..SBendtrans69.4-146.1175.200000114.5T361 S401T361-G407 PolarHBondContact N-O 2.75Å; T361-G407 PolarHBondContact OG1-N 3.27Å; T361-G407 PolarHBondContact OG1-O 3.24Å; S401-G407 CarbonylContact O-C 3.58Å; S401-G407 WeakPolarHBondContact O-CA 3.45Å
408T93.9Very high90.4Very high45 Ų4553.4 Ų53.428%0.27630%0.301SS..EExtended strand (participates in β ladder)trans-117.9146.1-171.754.20000112.3C359 I400 S401C359-T408 WeakPolarHBondContact O-CA 3.49Å; I400-T408 PolarHBondContact N-O 3.44Å; S401-T408 VanDerWaalsContact CB-OG1 3.29Å; S401-T408 WeakPolarHBondContact CB-OG1 3.48Å; S401-T408 PolarHBondContact N-O 3.24Å; S401-T408 PolarHBondContact N-OG1 3.13Å; S401-T408 PolarHBondContact O-N 2.94Å
409F94.2Very high90.3Very high2 Ų249.4 Ų49.41%0.00929%0.285CS..EExtended strand (participates in β ladder)trans-121.5160.6175.7-75.1-103.5000109.7F267 T358 C359 T361 L388 M397 E398 Q399F267-F409 HydrophobicContact CE1-CB 4.37Å; F267-F409 WeakPolarHBondContact CE1-O 3.37Å; F267-F409 HydrophobicContact CZ-CB 3.81Å; T358-F409 CarbonylContact C-O 3.53Å; T358-F409 VanDerWaalsContact CA-O 3.32Å; T358-F409 WeakPolarHBondContact CA-O 3.29Å; C359-F409 PolarHBondContact N-O 3.29Å; C359-F409 PolarHBondContact O-N 3.49Å; T361-F409 HydrophobicContact CG2-CD2 3.61Å; T361-F409 HydrophobicContact CG2-CE2 3.45Å; T361-F409 VanDerWaalsContact CG2-CE2 3.45Å; L388-F409 HydrophobicContact CB-CE1 4.28Å; L388-F409 HydrophobicContact CB-CZ 4.42Å; L388-F409 HydrophobicContact CD1-CD2 4.28Å; L388-F409 HydrophobicContact CD1-CE2 4.2Å; L388-F409 HydrophobicContact CD1-CZ 4.46Å; M397-F409 HydrophobicContact CE-CB 4.19Å; E398-F409 CarbonylContact O-C 3.47Å; E398-F409 WeakPolarHBondContact O-CA 3.4Å; Q399-F409 HydrophobicContact CB-CD1 4.16Å; Q399-F409 HydrophobicContact CB-CE1 3.79Å; Q399-F409 HydrophobicContact CB-CZ 4.01Å; Q399-F409 HydrophobicContact CG-CE1 4.41Å; Q399-F409 HydrophobicContact CG-CE2 4.38Å; Q399-F409 HydrophobicContact CG-CZ 4.14Å
410Q93.7Very high90Very high50 Ų5048.1 Ų48.123%0.23428%0.283CS..EExtended strand (participates in β ladder)trans-132.1147.6177178.8170.1-5000110.1P356 K357 T358 M397 E398 I400P356-Q410 HydrophobicContact CB-CG 4.4Å; K357-Q410 WeakPolarHBondContact O-CA 3.39Å; T358-Q410 HydrophobicContact CG2-CB 4.11Å; T358-Q410 HydrophobicContact CG2-CG 4.06Å; M397-Q410 CarbonylContact C-O 3.43Å; M397-Q410 WeakPolarHBondContact CA-O 3.38Å; M397-Q410 WeakPolarHBondContact CB-O 3.35Å; E398-Q410 PolarHBondContact N-O 3.25Å; E398-Q410 PolarHBondContact O-N 3.09Å; I400-Q410 HydrophobicContact CD1-CB 3.91Å; I400-Q410 HydrophobicContact CG1-CB 3.56Å
411L92.4Very high89.8Confident12 Ų1247.3 Ų47.36%0.06328%0.282CS..EExtended strand (participates in β ladder)trans-76.8129.6168.9-58.1-178.2000110W136 P264 F267 K357 M397 F413W136-L411 HydrophobicContact CZ3-CD2 4.21Å; P264-L411 HydrophobicContact CB-CD1 4.29Å; F267-L411 HydrophobicContact CB-CD1 3.98Å; F267-L411 HydrophobicContact CB-CD2 4.39Å; F267-L411 HydrophobicContact CB-CG 4.17Å; F267-L411 HydrophobicContact CD1-CD1 4.42Å; F267-L411 HydrophobicContact CD1-CD2 3.92Å; F267-L411 HydrophobicContact CD1-CG 3.71Å; F267-L411 HydrophobicContact CD2-CD2 4.28Å; F267-L411 HydrophobicContact CE1-CD2 4.22Å; F267-L411 HydrophobicContact CE1-CG 4.28Å; F267-L411 HydrophobicContact CG-CD1 4.36Å; F267-L411 HydrophobicContact CG-CD2 3.94Å; F267-L411 HydrophobicContact CG-CG 4Å; K357-L411 HydrophobicContact CB-CD1 3.98Å; K357-L411 HydrophobicContact CB-CG 4.21Å; K357-L411 HydrophobicContact CD-CD1 4Å; K357-L411 PolarHBondContact O-N 3.11Å; K357-L411 VanDerWaalsContact O-N 3.1Å; M397-L411 HydrophobicContact CE-CD2 4.2Å; M397-L411 HydrophobicContact CG-CD2 4.05Å; M397-L411 HydrophobicContact SD-CD2 4.39Å; L411-F413 VanDerWaalsContact C-N 3.29Å
412C90.7Very high89.5Confident57 Ų5744 Ų4439%0.38526%0.259SS..SBendtrans-79.5-14175.1-60.30000113.1G395 W396 M397G395-C412 VanDerWaalsContact O-CB 3.31Å; G395-C412 WeakPolarHBondContact O-CB 3.35Å; G395-C412 PolarHBondContact O-SG 2.95Å; W396-C412 PolarHBondContact O-N 2.93Å; M397-C412 VanDerWaalsContact CA-SG 3.53Å
413F89.1Confident89.4Confident41 Ų4144.1 Ų44.118%0.1825%0.246CC..SBendtrans-118.8130.5-174.8-70.3-91.8000110.5A137 T138 L139 G395 L411 Y415A137-F413 HydrophobicContact CB-CD2 4.26Å; A137-F413 WeakPolarHBondContact O-CE1 3.16Å; A137-F413 WeakPolarHBondContact O-CZ 3.48Å; T138-F413 WeakPolarHBondContact O-CD1 3.46Å; L139-F413 HydrophobicContact CD2-CE1 4.03Å; L139-F413 HydrophobicContact CG-CE1 4.32Å; G395-F413 WeakPolarHBondContact O-CE2 3.47Å; L411-F413 VanDerWaalsContact C-N 3.29Å; F413-Y415 PolarHBondContact O-N 3.39Å
414P89.6Confident89.2Confident60 Ų6038.7 Ų38.739%0.3923%0.23SC..  trans-53.8125.8169.7-31.338.8000112.2E355 Y416E355-P414 WeakPolarHBondContact OE1-CB 3.45Å; P414-Y416 HydrophobicContact CB-CE1 4.39Å; P414-Y416 HydrophobicContact CB-CE2 4.2Å
415Y90.8Very high88.6Confident42 Ų4244.4 Ų44.417%0.16525%0.249CC..  trans-128.6121.7177.7178.5-106000109.3W136 P264 T268 K357 F413 P417W136-Y415 HydrophobicContact CB-CD2 3.81Å; W136-Y415 HydrophobicContact CB-CE2 4.06Å; P264-Y415 HydrophobicContact CB-CD1 3.51Å; P264-Y415 HydrophobicContact CB-CD2 3.85Å; P264-Y415 HydrophobicContact CB-CE1 3.63Å; P264-Y415 HydrophobicContact CB-CE2 3.96Å; P264-Y415 HydrophobicContact CB-CG 3.63Å; T268-Y415 WeakPolarHBondContact OG1-CD1 3.5Å; K357-Y415 WeakPolarHBondContact CE-O 3.5Å; K357-Y415 PolarHBondContact NZ-O 2.76Å; F413-Y415 PolarHBondContact O-N 3.39Å; Y415-P417 HydrophobicContact CD1-CG 4.39Å; Y415-P417 HydrophobicContact CE1-CB 3.91Å; Y415-P417 HydrophobicContact CE1-CG 3.84Å
416Y91.7Very high87.7Confident86 Ų8646.6 Ų46.634%0.33726%0.259SS..  trans-127.891.6-178.4-48-47.9000108.3M353 E355 P414M353-Y416 HydrophobicContact CE-CD1 3.73Å; M353-Y416 HydrophobicContact CE-CD2 4.12Å; M353-Y416 HydrophobicContact CE-CE1 3.62Å; M353-Y416 HydrophobicContact CE-CE2 4.02Å; M353-Y416 HydrophobicContact CE-CG 4Å; M353-Y416 HydrophobicContact SD-CD1 3.49Å; M353-Y416 WeakPolarHBondContact SD-CD1 3.44Å; M353-Y416 HydrophobicContact SD-CD2 4.26Å; M353-Y416 HydrophobicContact SD-CE1 4.02Å; M353-Y416 HydrophobicContact SD-CG 3.64Å; E355-Y416 HydrophobicContact CG-CE1 4.43Å; E355-Y416 WeakPolarHBondContact OE1-CE1 3.4Å; E355-Y416 PolarHBondContact OE1-OH 2.79Å; P414-Y416 HydrophobicContact CB-CE1 4.39Å; P414-Y416 HydrophobicContact CB-CE2 4.2Å
417P91.9Very high86.2Confident5 Ų548.3 Ų48.33%0.03226%0.261CS..  trans-71.2147.9178.128.1-32.7000111.3T268 Y284 A352 Y415 V421 L422T268-P417 HydrophobicContact CG2-CG 3.96Å; Y284-P417 WeakPolarHBondContact CE2-O 3.36Å; Y284-P417 PolarHBondContact OH-O 3.26Å; A352-P417 HydrophobicContact CB-CG 4.22Å; Y415-P417 HydrophobicContact CD1-CG 4.39Å; Y415-P417 HydrophobicContact CE1-CB 3.91Å; Y415-P417 HydrophobicContact CE1-CG 3.84Å; P417-V421 HydrophobicContact CB-CB 4.14Å; P417-V421 HydrophobicContact CB-CG1 3.81Å; P417-L422 HydrophobicContact CG-CB 4.42Å; P417-L422 HydrophobicContact CG-CD1 4.05Å
418S91.2Very high84.3Confident40 Ų4053.9 Ų53.928%0.2828%0.28SS..  trans-66.7163169.253.10000111.8Y288 G420 V421 L422Y288-S418 VanDerWaalsContact CE1-CB 3.41Å; S418-G420 PolarHBondContact O-N 2.94Å; S418-V421 PolarHBondContact O-N 3.43Å; S418-V421 VanDerWaalsContact O-N 3.17Å; S418-V421 WeakPolarHBondContact OG-CG2 3.44Å; S418-L422 WeakPolarHBondContact O-CB 3.37Å; S418-L422 PolarHBondContact O-N 3.07Å
419P89.9Confident82.4Confident26 Ų2656.2 Ų56.217%0.16929%0.291CS..Hα-helixtrans-51.2-52.8178.6-31.337.9000113.6Y284 Y288 Y289 V421 L422 Y423Y284-P419 HydrophobicContact CE1-CG 4.16Å; Y284-P419 WeakPolarHBondContact OH-CD 3.39Å; Y288-P419 HydrophobicContact CG-CG 4.21Å; Y289-P419 HydrophobicContact CE1-CG 4.49Å; Y289-P419 HydrophobicContact CE2-CG 3.62Å; Y289-P419 WeakPolarHBondContact OH-CB 3.17Å; Y289-P419 WeakPolarHBondContact OH-CG 3.17Å; P419-V421 VanDerWaalsContact C-N 3.35Å; P419-V421 PolarHBondContact O-N 3.1Å; P419-L422 CarbonylContact O-C 3.27Å; P419-L422 WeakPolarHBondContact O-CA 3.29Å; P419-L422 WeakPolarHBondContact O-CB 3.32Å; P419-L422 PolarHBondContact O-N 2.88Å; P419-Y423 PolarHBondContact O-N 2.76Å
420G86.8Confident80.5Confident16 Ų1660.6 Ų60.617%0.16531%0.311CS..Hα-helixtrans-61.7-33.3178.100000115.1S418 L422 Y423 P424 Q427S418-G420 PolarHBondContact O-N 2.94Å; G420-L422 PolarHBondContact O-N 3.25Å; G420-Y423 CarbonylContact O-C 3.6Å; G420-P424 WeakPolarHBondContact O-CA 3.19Å; G420-P424 WeakPolarHBondContact O-CD 3.42Å; G420-P424 WeakPolarHBondContact O-CG 3.37Å; G420-Q427 VanDerWaalsContact CA-OE1 3.27Å
421V89.3Confident78.4Confident66 Ų6662.7 Ų62.740%0.432%0.324SS..Hα-helixtrans-71.2-23.6173.1173.40000111.5L265 P417 S418 P419L265-V421 HydrophobicContact CD1-CG1 4.48Å; L265-V421 WeakPolarHBondContact CD1-O 3.37Å; L265-V421 WeakPolarHBondContact CD2-O 3.43Å; P417-V421 HydrophobicContact CB-CB 4.14Å; P417-V421 HydrophobicContact CB-CG1 3.81Å; S418-V421 PolarHBondContact O-N 3.43Å; S418-V421 VanDerWaalsContact O-N 3.17Å; S418-V421 WeakPolarHBondContact OG-CG2 3.44Å; P419-V421 VanDerWaalsContact C-N 3.35Å; P419-V421 PolarHBondContact O-N 3.1Å
422L86.5Confident76.3Confident0 Ų065 Ų650%034%0.341CS..Hα-helixtrans-90.9-34.3178.4-16864.4000112.4L265 T268 R269 A351 A352 P417 S418 P419 G420L265-L422 HydrophobicContact CD1-CD1 4.06Å; T268-L422 HydrophobicContact CG2-CD1 3.82Å; R269-L422 PolarHBondContact NH1-O 3.48Å; R269-L422 PolarHBondContact NH2-O 3.35Å; A351-L422 HydrophobicContact CB-CD2 3.94Å; A352-L422 HydrophobicContact CB-CD2 4.23Å; P417-L422 HydrophobicContact CG-CB 4.42Å; P417-L422 HydrophobicContact CG-CD1 4.05Å; S418-L422 WeakPolarHBondContact O-CB 3.37Å; S418-L422 PolarHBondContact O-N 3.07Å; P419-L422 CarbonylContact O-C 3.27Å; P419-L422 WeakPolarHBondContact O-CA 3.29Å; P419-L422 WeakPolarHBondContact O-CB 3.32Å; P419-L422 PolarHBondContact O-N 2.88Å; G420-L422 PolarHBondContact O-N 3.25Å
423Y85.4Confident74.4Confident46 Ų4668.3 Ų68.318%0.1835%0.351CS..  trans-137.275.8-179.9-61.6-82.1000110.2L347 P419 G420 E425 K426 Q427L347-Y423 HydrophobicContact CD2-CE1 4.48Å; L347-Y423 HydrophobicContact CD2-CE2 3.87Å; L347-Y423 VanDerWaalsContact CD2-OH 3.26Å; L347-Y423 WeakPolarHBondContact CD2-OH 3.18Å; P419-Y423 PolarHBondContact O-N 2.76Å; G420-Y423 CarbonylContact O-C 3.6Å; Y423-E425 VanDerWaalsContact C-N 3.31Å; Y423-E425 PolarHBondContact O-N 2.95Å; Y423-K426 HydrophobicContact CG-CD 4.43Å; Y423-K426 PolarHBondContact O-N 2.87Å; Y423-Q427 PolarHBondContact O-N 3.38Å
424P80.4Confident72.4Confident74 Ų7471 Ų7148%0.48136%0.364SS..Hα-helixtrans-61.6-39.5-179.1-21.732.4000112.7G420 Q427 Q428G420-P424 WeakPolarHBondContact O-CA 3.19Å; G420-P424 WeakPolarHBondContact O-CD 3.42Å; G420-P424 WeakPolarHBondContact O-CG 3.37Å; P424-Q427 PolarHBondContact O-N 3.02Å; P424-Q428 PolarHBondContact O-N 3.41Å
425E69.8Low70.3Confident148 Ų14870.7 Ų70.769%0.69236%0.363SS*.Hα-helixtrans-55.2-55.7178.6-61.9160.8160.300110.8Y423 Q427 Q428 D429Y423-E425 VanDerWaalsContact C-N 3.31Å; Y423-E425 PolarHBondContact O-N 2.95Å; E425-Q427 PolarHBondContact O-N 2.88Å; E425-Q428 PolarHBondContact O-N 2.81Å; E425-D429 PolarHBondContact O-N 2.93Å; E425-D429 VanDerWaalsContact O-N 3.12Å
426K65.1Low68.3Low88 Ų8873.5 Ų73.538%0.38338%0.381SS..Hα-helixtrans-55.7-28.3178.1-82.1-172.4158.8-114.30114.4D344 Y423 D429 E430D344-K426 IonicContact OD1-NZ 3.21Å; D344-K426 PolarHBondContact OD1-NZ 2.89Å; Y423-K426 HydrophobicContact CG-CD 4.43Å; Y423-K426 PolarHBondContact O-N 2.87Å; K426-D429 WeakPolarHBondContact CA-OD2 3.12Å; K426-E430 WeakPolarHBondContact O-CG 3.22Å; K426-E430 PolarHBondContact O-N 3.07Å
427Q56.7Low66.4Low82 Ų8276 Ų7638%0.38340%0.396SS..Hα-helixtrans-82.5-25.9178.5-155.8-174.3-28.800111.6G420 Y423 P424 E425 D429 D431G420-Q427 VanDerWaalsContact CA-OE1 3.27Å; Y423-Q427 PolarHBondContact O-N 3.38Å; P424-Q427 PolarHBondContact O-N 3.02Å; E425-Q427 PolarHBondContact O-N 2.88Å; Q427-D429 VanDerWaalsContact C-N 3.3Å; Q427-D431 PolarHBondContact NE2-OD1 3.04Å; Q427-D431 WeakPolarHBondContact O-CB 3.05Å; Q427-D431 PolarHBondContact O-N 3.41Å
428Q51.5Low64.2Low145 Ų14582.7 Ų82.768%0.67843%0.427SS*.Hα-helixtrans-72.8-27.4169-58.4-170.3-74.600111.9P424 E425 S432P424-Q428 PolarHBondContact O-N 3.41Å; E425-Q428 PolarHBondContact O-N 2.81Å; Q428-S432 WeakPolarHBondContact O-CB 3.22Å; Q428-S432 PolarHBondContact O-N 3.37Å
429D53.2Low62.3Low94 Ų9487.3 Ų87.350%0.50344%0.444SS..Hα-helixtrans-68.2-52.9168.4-50.7-40000110E425 K426 Q427 D431 S432 E433E425-D429 PolarHBondContact O-N 2.93Å; E425-D429 VanDerWaalsContact O-N 3.12Å; K426-D429 WeakPolarHBondContact CA-OD2 3.12Å; Q427-D429 VanDerWaalsContact C-N 3.3Å; D429-D431 PolarHBondContact O-N 3.4Å; D429-S432 WeakPolarHBondContact O-CB 3.33Å; D429-S432 PolarHBondContact O-N 3.36Å; D429-S432 VanDerWaalsContact O-N 3.08Å; D429-E433 PolarHBondContact O-N 2.9Å
430E53.9Low60.4Low94 Ų9492.9 Ų92.944%0.43947%0.468SS..Hα-helixtrans-61.4-41.6177.8-73.7173.9-175.300113.1K426 S432 E433 E434K426-E430 WeakPolarHBondContact O-CG 3.22Å; K426-E430 PolarHBondContact O-N 3.07Å; E430-S432 PolarHBondContact O-N 3.4Å; E430-E433 PolarHBondContact O-N 2.87Å; E430-E434 WeakPolarHBondContact O-CB 3.19Å; E430-E434 PolarHBondContact O-N 3Å
431D51.5Low58.6Low94 Ų9499.6 Ų99.650%0.50350%0.495SS..Hα-helixtrans-69.7-11.6176.3-63.4-16.7000112.2Q427 D429Q427-D431 PolarHBondContact NE2-OD1 3.04Å; Q427-D431 WeakPolarHBondContact O-CB 3.05Å; Q427-D431 PolarHBondContact O-N 3.41Å; D429-D431 PolarHBondContact O-N 3.4Å
432S48.1Very low56.7Low61 Ų61103.6 Ų103.643%0.42751%0.509SS..Hα-helixtrans-96.2-42.1174-166.50000111.5Q428 D429 E430 E434 S435 D436Q428-S432 WeakPolarHBondContact O-CB 3.22Å; Q428-S432 PolarHBondContact O-N 3.37Å; D429-S432 WeakPolarHBondContact O-CB 3.33Å; D429-S432 PolarHBondContact O-N 3.36Å; D429-S432 VanDerWaalsContact O-N 3.08Å; E430-S432 PolarHBondContact O-N 3.4Å; S432-E434 VanDerWaalsContact C-N 3.33Å; S432-E434 PolarHBondContact O-N 3.25Å; S432-S435 WeakPolarHBondContact O-CA 3.29Å; S432-S435 WeakPolarHBondContact O-CB 3.34Å; S432-S435 PolarHBondContact O-N 3.25Å; S432-D436 PolarHBondContact O-N 3.22Å
433E51Low55.1Low126 Ų126106.7 Ų106.759%0.58953%0.531SS*.Hα-helixtrans-63-38.2173.9-69.1177.217400111D429 E430 S435 D436 E437D429-E433 PolarHBondContact O-N 2.9Å; E430-E433 PolarHBondContact O-N 2.87Å; E433-S435 PolarHBondContact O-N 2.92Å; E433-D436 PolarHBondContact O-N 3.06Å; E433-E437 WeakPolarHBondContact O-CG 3.49Å; E433-E437 PolarHBondContact O-N 2.84Å
434E46.6Very low53.4Low98 Ų98111.8 Ų111.846%0.45856%0.556SS.*Hα-helixtrans-71-10.3173.9-154162.3-122.400112.1K291 E430 S432 E438K291-E434 IonicContact NZ-OE1 2.63Å; K291-E434 PolarHBondContact NZ-OE1 2.58Å; E430-E434 WeakPolarHBondContact O-CB 3.19Å; E430-E434 PolarHBondContact O-N 3Å; S432-E434 VanDerWaalsContact C-N 3.33Å; S432-E434 PolarHBondContact O-N 3.25Å; E434-E438 WeakPolarHBondContact O-CG 3.36Å
435S45.3Very low51.7Low53 Ų53116.1 Ų116.137%0.37157%0.57SS.*Hα-helixtrans-95.4-35.9172.9-168.70000113S432 E433 E437 E438 E439S432-S435 WeakPolarHBondContact O-CA 3.29Å; S432-S435 WeakPolarHBondContact O-CB 3.34Å; S432-S435 PolarHBondContact O-N 3.25Å; E433-S435 PolarHBondContact O-N 2.92Å; S435-E437 VanDerWaalsContact C-N 3.35Å; S435-E438 PolarHBondContact O-N 3.02Å; S435-E439 PolarHBondContact O-N 2.9Å
436D48.3Very low50.7Low101 Ų101116.3 Ų116.354%0.5457%0.571SS.*Hα-helixtrans-67.8-37.1171.7-68.2-35.7000110.1S432 E433 E439 E440S432-D436 PolarHBondContact O-N 3.22Å; E433-D436 PolarHBondContact O-N 3.06Å; D436-E439 PolarHBondContact O-N 2.84Å; D436-E440 PolarHBondContact O-N 2.98Å
437E51Low49.8Very low140 Ų140120 Ų12065%0.65459%0.59SS**Hα-helixtrans-66.1-33.2172.7-74-175.9176.400112.8E433 S435 E441E433-E437 WeakPolarHBondContact O-CG 3.49Å; E433-E437 PolarHBondContact O-N 2.84Å; S435-E437 VanDerWaalsContact C-N 3.35Å; E437-E441 PolarHBondContact O-N 3.36Å
438E47.5Very low49.1Very low144 Ų144124.7 Ų124.767%0.67361%0.612SS**Hα-helixtrans-74.6-35.6174.6-79.3-175.6178.100112.5E434 S435 E442E434-E438 WeakPolarHBondContact O-CG 3.36Å; S435-E438 PolarHBondContact O-N 3.02Å; E438-E442 PolarHBondContact O-N 3.37Å; E438-E442 VanDerWaalsContact O-N 3.16Å
439E50.3Low48.4Very low137 Ų137122.5 Ų122.564%0.6461%0.612SS**Hα-helixtrans-71-30173.6-75.4-170.7-162.400112.8S435 D436 S443S435-E439 PolarHBondContact O-N 2.9Å; D436-E439 PolarHBondContact O-N 2.84Å; E439-S443 PolarHBondContact O-N 3.16Å
440E50.6Low47.8Very low143 Ų143126.5 Ų126.567%0.66863%0.628SS**Hα-helixtrans-70-46.7173-76.1-169.116800112.2D436 S443 E444D436-E440 PolarHBondContact O-N 2.98Å; E440-S443 PolarHBondContact O-N 3.5Å; E440-S443 PolarHBondContact O-OG 2.77Å; E440-E444 PolarHBondContact O-N 2.59Å
441E48.1Very low47.2Very low157 Ų157130.8 Ų130.873%0.73465%0.648SS**Hα-helixtrans-66.7-35177.4-77.1-16617900113E437 S443 E444 E445E437-E441 PolarHBondContact O-N 3.36Å; E441-S443 PolarHBondContact O-N 3.06Å; E441-E444 PolarHBondContact O-N 3.02Å; E441-E445 PolarHBondContact O-N 3.44Å
442E50.5Low46.7Very low150 Ų150135.9 Ų135.970%0.70167%0.669SS**Hα-helixtrans-65.1-28173.7-167.4167.9-131.900111.8E438 E446E438-E442 PolarHBondContact O-N 3.37Å; E438-E442 VanDerWaalsContact O-N 3.16Å; E442-E446 PolarHBondContact O-N 3.05Å
443S51.8Low46.3Very low65 Ų65141.9 Ų141.946%0.45569%0.69SS.*Hα-helixtrans-77.7-31.8175.978.20000114.4E439 E440 E441 E447E439-S443 PolarHBondContact O-N 3.16Å; E440-S443 PolarHBondContact O-N 3.5Å; E440-S443 PolarHBondContact O-OG 2.77Å; E441-S443 PolarHBondContact O-N 3.06Å; S443-E447 PolarHBondContact O-N 3.41Å
444E49.4Very low45.4Very low153 Ų153142 Ų14272%0.71571%0.705SS**Hα-helixtrans-73.1-31.5174.5-68.7-163.616600111.9E440 E441 E448E440-E444 PolarHBondContact O-N 2.59Å; E441-E444 PolarHBondContact O-N 3.02Å; E444-E448 PolarHBondContact O-N 2.97Å
445E46Very low45Very low165 Ų165145.7 Ų145.777%0.77172%0.722SS**Hα-helixtrans-71.7-27.4173.6-72.6-159.916700113.7E441E441-E445 PolarHBondContact O-N 3.44Å
446E48Very low44.5Very low152 Ų152151.4 Ų151.471%0.7174%0.743SS**Hα-helixtrans-73.5-39172.9-74.6-156.3150.800112.6E442 S449E442-E446 PolarHBondContact O-N 3.05Å; E446-S449 PolarHBondContact O-N 2.78Å
447E45.6Very low43.8Very low165 Ų165155.8 Ų155.877%0.77176%0.76SS**Hα-helixtrans-69.1-34.5178.5-75.3-158.5171.100113.5S443 S449S443-E447 PolarHBondContact O-N 3.41Å; E447-S449 PolarHBondContact O-N 2.67Å
448E42.1Very low43.1Very low181 Ų181157.6 Ų157.685%0.84677%0.769SS**THydrogen-bonded Turntrans-70.7-12.8176.5-160.2172.7-13300112.4E444E444-E448 PolarHBondContact O-N 2.97Å
449S38.8Very low44Very low99 Ų99155 Ų15569%0.69276%0.764SS**THydrogen-bonded Turntrans-86.6-13-179.4-169.40000115.5E446 E447E446-S449 PolarHBondContact O-N 2.78Å; E447-S449 PolarHBondContact O-N 2.67Å
450E40.5Very low43.8Very low178 Ų178154.1 Ų154.183%0.83277%0.77SS**SBendtrans-96.1-8.9-174.7-67.8-150.8143.800115.1
451E40.1Very low43.8Very low184 Ų184152.3 Ų152.386%0.8677%0.771SS**SBendtrans-89.2-4.9-173.2-69.1-147.5145.300117.1
452E41.6Very low43.8Very low202 Ų202154.7 Ų154.794%0.94478%0.779SS**SBendtrans-10039-177.4-78.3-136.8149.200116.8
453E39.1Very low43.1Very low187 Ų187158.1 Ų158.187%0.87479%0.792SS**  trans-150.185.5166-158.2172.2-141.600117
454S32Very low42.4Very low128 Ų128165.4 Ų165.490%0.89581%0.809SS**  trans-169.8146.3146-130.20000117.6
455E37.9Very low41.9Very low176 Ų176164.1 Ų164.182%0.82281%0.805SS**  trans-87.6174172.5-85170.9146.200111.7
456E35.4Very low41.6Very low173 Ų173164.4 Ų164.481%0.80881%0.806SS**  cis-167.2178.1-8.3161.5172.5-158.800109.1
457E33Very low41.1Very low192 Ų192166 Ų16690%0.89781%0.811SS**  trans97.4158.3158.1-117.8-166.8134.900121.1
458E36.2Very low40.9Very low178 Ų178169.1 Ų169.183%0.83282%0.815SS**  trans-123.4-162-148.4-135.8-145.2140.100114.8
459P66.3Low41.1Very low89 Ų89166 Ų16658%0.57881%0.811SS**  trans-120.6-167.8-136.638.8-16.4000114.7
460P46.6Very low42Very low119 Ų119166.9 Ų166.977%0.77381%0.814SS**  -149-158.7108.444.8-26.9000113.5
461P51.5Low42.1Very low105 Ų105164.6 Ų164.668%0.68282%0.815SS**  -135.7139.3-104.436.8-14.5000119.6
462K47.7Very low42Very low208 Ų208165.2 Ų165.290%0.90481%0.814SS**  trans50.9126.4135.7-62.6168.7-178.7162.20121.5
463K36.4Very low42.1Very low221 Ų221160.5 Ų160.596%0.96180%0.804SS**  trans-147.9142.6135.4-116.6163.9-170.6170.10114.9
464R36.3Very low42.2Very low218 Ų218162.4 Ų162.482%0.82380%0.803SS**  trans-83.3165.6-175-129174.452.9-158-3.8110
465M38.3Very low42.4Very low126 Ų126161 Ų16162%0.62179%0.793SS**  cis-146.2-168.517.1-53.5-177.759.900108.7
466Q40.1Very low42.3Very low171 Ų171164.3 Ų164.380%0.79980%0.798SS**  cis-148.6-128.43.5-157.4162.1-10.400112.2
467K37.5Very low42.2Very low187 Ų187160.1 Ų160.181%0.81379%0.793SS**  trans-168.2146.9-172-133.1171.3-173.6170.80115.4
468R40.8Very low42.9Very low230 Ų230156.9 Ų156.987%0.86879%0.789SS**  trans72.1170.8161.2-49.817790-174.98.7117.8
469P47Very low43.4Very low116 Ų116153.9 Ų153.975%0.75379%0.785SS**  cis-131.5-178.9-30.226.4-3.7000114.5
470P56.8Low42.1Very low117 Ų117159 Ų15976%0.7680%0.803SS**  trans-104.4162.8-178.839.5-35.4000116.7
471P43.3Very low41.8Very low130 Ų130162.7 Ų162.784%0.84481%0.807SS**  trans-93.8169.4172.836.8-34.2000115
472K39.1Very low40.9Very low196 Ų196168 Ų16885%0.85281%0.813SS**  trans-131.2134.6-171.1-79.1179.8173.6176.40115.1
473S43.5Very low40.3Very low103 Ų103168.5 Ų168.572%0.7281%0.81SS**  trans54.1165.5135.376.60000124.1
474R41Very low40.2Very low228 Ų228166.5 Ų166.586%0.8680%0.804SS**  trans85.9145.9170-54.7171.772.6160.12.4116.9
475S35.3Very low40.2Very low99 Ų99161.9 Ų161.969%0.69281%0.805SS**  cis-169.7126.3-23.550.60000114.8
476R35.4Very low40.2Very low245 Ų245165 Ų16593%0.92582%0.815SS**  trans54.1117.6136.8-171.8174179.2-162.90122.6
477A34.2Very low40.4Very low85 Ų85162.8 Ų162.870%0.70282%0.815SS**  trans79.8155.6138.200000122.1
478P46.9Very low40.4Very low123 Ų123163.4 Ų163.480%0.79982%0.818SS**  cis-134.7-136.2-2843.2-22.8000112.7
479P47.1Very low41.1Very low115 Ų115157.7 Ų157.775%0.74781%0.811SS**  trans-126163.5-13832.8-8000117.9
480M39.8Very low40.4Very low197 Ų197163 Ų16397%0.9782%0.816SS**  trans-136.3159.8166.5-66.6-161.894.200113.6
481K39.3Very low39.5Very low197 Ų197166 Ų16686%0.85782%0.816SS**  trans-99147.6-165.6-52.1166.3-177.4173.20112.3
482R33.6Very low39.2Very low215 Ų215165.4 Ų165.481%0.81181%0.811SS**  171.4127.8115.9-96.1166.260173.4-1.7116.6
483R34.5Very low39.3Very low220 Ų220162.3 Ų162.383%0.8381%0.811SS**  trans57134.9132.6-67.7176.162177-0.9121.7
484E34Very low39Very low179 Ų179162 Ų16284%0.83682%0.815SS**  trans-70.8166.1171.9-45.4151.6102.800114
485S37.7Very low38.8Very low120 Ų120155.4 Ų155.484%0.83981%0.809SS**  trans-144.6137.1162.557.20000112.1
486K37Very low38.8Very low192 Ų192161.3 Ų161.384%0.83582%0.816SS**  trans-104.9144.1178.2-66.1175.2179.2172.90111.4
487P43.7Very low38.7Very low124 Ų124160.3 Ų160.381%0.80581%0.812SS**  trans-91143.4175.634.7-33.8000113.9
488K37.7Very low38.7Very low201 Ų201159.9 Ų159.987%0.87482%0.816SS**  trans-167174.1171.4-80.1-159.8178.7-179.80108.6
489P55.6Low38.2Very low109 Ų109164.2 Ų164.271%0.70882%0.823SS**  -140.9168.7-56.241.7-25.9000113.8
490R33.8Very low37.6Very low228 Ų228163.3 Ų163.386%0.8683%0.825SS**  trans160.4161.2150.6-97.2177.8172.1-125.45.4110.9
491K36.8Very low37.4Very low179 Ų179163.8 Ų163.878%0.77882%0.821SS**  cis-160.5162.9-37.7-122.7-170.4-179.2-172.50109.7
492T37.5Very low38Very low119 Ų119159.8 Ų159.873%0.7382%0.815SS**  trans-71.9166-179.253.70000116.3
493P41.7Very low39Very low131 Ų131155 Ų15585%0.85181%0.813SS**  trans-103.4170.9134.435.5-31.7000113.4
494A35.4Very low39.6Very low97 Ų97150.4 Ų150.480%0.80281%0.811SS**  trans-142.5174.4-167.600000108.9
495A37.2Very low39.8Very low89 Ų89151.8 Ų151.874%0.73681%0.814SS**  cis-176167.7-24.100000107.1
496R35.1Very low39.8Very low223 Ų223152 Ų15284%0.84281%0.81SS**  trans149.8153.4163.4-90.8166.5166.7-130.8-1.2109.5
497R34.6Very low39.8Very low223 Ų223152.2 Ų152.284%0.84281%0.811SS**  cis-161.3136.5-20.2-121.5170.797.4-132.612.4107.4
498G32.9Very low39.4Very low77 Ų77152.7 Ų152.779%0.79481%0.812SS**  trans171.6140.3172.300000112
499K36.8Very low39.5Very low214 Ų214149.2 Ų149.293%0.9381%0.81SS**  trans-134.3143.2-178.9-85-168.2175.2-174.40112.3
500A34Very low38.4Very low96 Ų96149 Ų14979%0.79382%0.817SS**  trans63113.914900000120.5
501K36.7Very low38.5Very low206 Ų206147.9 Ų147.990%0.89682%0.819SS**  -160.3141.7117.4-106.2170.8-176.2178.20110.3
502P52.4Low38.3Very low113 Ų113149.4 Ų149.473%0.73483%0.825SS**PPolyproline II helixtrans-86.1158.1173.135-34.2000112
503P53.3Low38.1Very low116 Ų116148.1 Ų148.175%0.75383%0.827SS**PPolyproline II helixtrans-69.3152.217130.1-34.7000111.9
504P47.8Very low38Very low123 Ų123151.6 Ų151.680%0.79983%0.829SS**PPolyproline II helixtrans-79.9141.8-167.330.8-35.8000114.5
505K38.8Very low38.1Very low208 Ų208153.1 Ų153.190%0.90483%0.83SS**  trans-108.5123.3158.8-73.6-176.7176.1-178.70109.1
506V36.9Very low37.9Very low124 Ų124153.4 Ų153.475%0.75283%0.832SS**  trans-133.899172.3-177.20000111.9
507K36.3Very low38Very low196 Ų196147.5 Ų147.585%0.85283%0.831SS**  trans53.6116.3138.8-57.2-179.8-177.9-179.10120.8
508T36.7Very low38.4Very low135 Ų135142.6 Ų142.683%0.82883%0.829SS**  trans-73.2143.615149.10000112.3
509P38.4Very low38.3Very low128 Ų128142.7 Ų142.783%0.83182%0.822SS**  trans-85.1158.3154.534.6-31.4000111.4
510A33.7Very low38.1Very low104 Ų104139.8 Ų139.886%0.8682%0.815SS**  trans-115.8166.2-174.900000114.1
511K36.3Very low38.1Very low205 Ų205145 Ų14589%0.89182%0.82SS**  trans-58.4135.6-169.1-61172.9177.3175.50116.1
512K31.9Very low38.2Very low210 Ų210144.5 Ų144.591%0.91382%0.818SS**  trans170.9146.6138-96.4168.1-177.9-1770107.7
513A32.5Very low37.7Very low92 Ų92144.7 Ų144.776%0.7682%0.819SS**  cis-152.7-169.6-10.700000109.6
514K40.3Very low36.7Very low205 Ų205144.7 Ų144.789%0.89182%0.822SS**  trans-63.4156177.3-56.9175.5-178.9176.90112.8
515P37.2Very low35.8Very low128 Ų128142.7 Ų142.783%0.83182%0.823SS**  trans-111.7140.3141.334.6-27.8000111.7
516A33.6Very low35.3Very low95 Ų95136.6 Ų136.679%0.78582%0.82SS**  trans-110.4166.2159.400000108.6
517A37.8Very low35.1Very low99 Ų99135.8 Ų135.882%0.81882%0.819SS**  trans-65.2152.9175.500000111.8
518P41.2Very low34.9Very low121 Ų121131.7 Ų131.779%0.78682%0.815SS**  -145.6141.6111.736.9-22.3000117
519A31.3Very low34.8Very low79 Ų79130.3 Ų130.365%0.65381%0.811SS**  trans40.3118.813200000124.3
520I33.9Very low34.6Very low153 Ų153133.9 Ų133.979%0.78581%0.813SS**  64.4116126.4-51.1164.7000119.9
521K33.2Very low34.5Very low206 Ų206138.3 Ų138.390%0.89681%0.813SS**  -166.9148.2117.5-105168.9-170.2175.50114.8
522K37.7Very low35.2Very low195 Ų195133.7 Ų133.785%0.84881%0.805SS**  trans-64.1170.3-171-55.7171.8170.5175.70115.1
523P42.1Very low35.1Very low116 Ų116128 Ų12875%0.75380%0.796SS**  -136.6168.486.340-29000116.5
524S33.1Very low35.2Very low117 Ų117127.9 Ų127.982%0.81880%0.795SS**  trans30.4137.7155.2560000122.7
525G28.5Very low34.8Very low80 Ų80124.4 Ų124.483%0.82580%0.797SS**  cis141.4107.4-6.900000114.8
526G29.4Very low34.5Very low81 Ų81121.9 Ų121.984%0.83579%0.794SS**  trans95.1146.1173.400000114.9
527S31.5Very low34.5Very low107 Ų107129.1 Ų129.175%0.74880%0.801SS**  cis-159.8150.8-13.251.70000111.3
528S33Very low34.3Very low109 Ų109133.5 Ų133.576%0.76280%0.802SS**  trans51.8147154.750.20000122.1
529S34.8Very low33.8Very low106 Ų106135.2 Ų135.274%0.74180%0.8SS**  cis-172.5149-21.849.40000111.1
530K33.7Very low33.9Very low203 Ų203138.8 Ų138.888%0.88381%0.813SS**  trans44.5115.5154.2-64.9179.3177.4178.20122.5
531K32.1Very low33.9Very low197 Ų197140.8 Ų140.886%0.85782%0.816SS**  11163.3115.4-85.7-166.5173.1-176.30120.1
532P50.8Low34.7Very low109 Ų109136.9 Ų136.971%0.70881%0.812SS**  cis-148.8-174.1-28.442.7-23.3000116.6
533A29.8Very low34.5Very low89 Ų89133.4 Ų133.474%0.73681%0.812SS**  trans78122139.200000125.1
534A34.2Very low34.2Very low90 Ų90131.9 Ų131.974%0.74481%0.809SS**  71.1146.4128.100000124.5
535S31.2Very low34.3Very low133 Ų133136.7 Ų136.793%0.9382%0.815SS**  trans68.2158.517779.20000116.1
536G30.9Very low34.4Very low75 Ų75136.2 Ų136.277%0.77381%0.81SS**  cis-162.8-179.10.400000112.8
537R34.9Very low34.8Very low246 Ų246142.7 Ų142.793%0.92882%0.815SS**  trans-76.5146.2-173.6-58.3169.8172.8175.9-4.2114.1
538K32.2Very low34.9Very low192 Ų192142.3 Ų142.384%0.83581%0.812SS**  -174.2-178.4107.5-125.7-175.9172.5-178.40115.3
539E32.1Very low35.2Very low157 Ų157144.3 Ų144.373%0.73482%0.82SS**  trans-100.9158.3-166.3-42.7139.185.800114.4
540V33.6Very low35.3Very low153 Ų153146.3 Ų146.393%0.92782%0.819SS**  trans-144.2159.7145.81790000110.2
541K34Very low35.5Very low196 Ų196146.9 Ų146.985%0.85282%0.816SS**  trans-85.5170.9-166.8-87.9178.4177.4174.50117.1
542P50Low36.1Very low124 Ų124147 Ų14781%0.80582%0.816SS**  trans-106.9173.9-170.241.9-37000116.5
543S33.4Very low35.7Very low122 Ų122147 Ų14785%0.85382%0.819SS**  trans-159.1164.9162.5680000109.8
544A34.5Very low36.4Very low83 Ų83150.9 Ų150.969%0.68683%0.827SS**  cis-166.5164.3-32.100000109.5
545K34.9Very low37Very low219 Ų219158.4 Ų158.495%0.95284%0.836SS**  trans71.7141177.7-50168.6-177.8171.50115.4
546G32.2Very low37.7Very low69 Ų69156.3 Ų156.371%0.71183%0.826SS**  cis162.3154.8-14.500000115.2
547K37.5Very low38.4Very low218 Ų218162.6 Ų162.695%0.94883%0.832SS**  trans69.1159.4170.5-62.2-179.5179.2-179.30117.6
548S33.8Very low38.8Very low99 Ų99164.2 Ų164.269%0.69285%0.846SS**  cis177.8118.6-35.71680000110.6
549T38.7Very low39.1Very low150 Ų150162.9 Ų162.992%0.9285%0.847SS**  trans-147.7153.6150.530.20000109.6
550M37Very low39.5Very low149 Ų149163.2 Ų163.273%0.73485%0.853SS**  trans-129.3149.1-162.9-102.9-159.1-17300114.1
551R37.6Very low39.8Very low215 Ų215163.7 Ų163.781%0.81185%0.849SS**  trans46.4126.2141.5-65.2176.1167.6178.1-6.5119
552K45Very low40.2Very low198 Ų198161.8 Ų161.886%0.86185%0.849SS**  -157.8141.294.5-114.8170.9-178.4174.20112.6
553S42.2Very low39.6Very low111 Ų111164.2 Ų164.278%0.77685%0.851SS**  trans-118.5148.4158.960.80000108.2
554L44.6Very low40Very low170 Ų170167 Ų16789%0.8985%0.851SS**  trans-142.1125.5164.7-82.7178.7000109.5
555R46.1Very low40.4Very low248 Ų248173 Ų17394%0.93686%0.863SS**  trans-139.7107169.9175.1-162.7178-157.80.4107.4
556A45.8Very low40.8Very low88 Ų88169.5 Ų169.573%0.72786%0.856SS**  trans-163.4134.3161.600000112
557K46.5Very low41.5Very low207 Ų207177.8 Ų177.890%0.987%0.868SS**  trans39.3119.8143.2-60.1180176.6-177.30119
558K43.2Very low41.9Very low281 Ų281174.2 Ų174.2100%1.22286%0.861SS**  -129.6087.5-152.3168.4-174.2178.30109.6

Retrieved 558 of 558 residues in 526.8 ms (Link to these results)