A0A096LR04_POEFO Loading...

La ribonucleoprotein 4Aa

AlphaFold DB , UniProt , Accession A0A096LR04, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 802 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M42.7Very low39.4Very low229 Ų229139.5 Ų139.5100%1.12882%0.823SS**  0750-52.6173.390.100106
2S34.4Very low38.8Very low106 Ų106141.3 Ų141.374%0.74183%0.825SS**  cis78.2135.228.3-48.20000114.4
3S38.1Very low38.3Very low109 Ų109141.5 Ų141.576%0.76281%0.814SS**  trans74.8108.3-179.2-55.40000113
4D40.4Very low38Very low149 Ų149142.4 Ų142.480%0.79781%0.807SS**  cis79.7108.225.6-51-75.6000116.2
5Q41.7Very low37.5Very low186 Ų186145.4 Ų145.487%0.86981%0.811SS**  trans179.4114.4139.7-95.8174.311.100106
6S36.4Very low37.2Very low115 Ų115141.1 Ų141.180%0.80480%0.8SS**  cis83.6117.448.378.30000113.8
7G31.2Very low37.3Very low83 Ų83141.4 Ų141.486%0.85680%0.799SS**  trans167.681.7175.300000114.3
8E37.1Very low37.7Very low189 Ų189140.1 Ų140.188%0.88380%0.797SS**  trans-107.9-175.4162.6-132.1-151.8128.400109.5
9P53.6Low37.4Very low98 Ų98135.5 Ų135.564%0.63678%0.784SS**  -101.9173.6-128.442-32.7000114.5
10P43.4Very low38.5Very low131 Ų131135.2 Ų135.285%0.85179%0.787SS**  trans-98.4155.9158.936.3-29.8000112.6
11L34.6Very low38.2Very low139 Ų139138.8 Ų138.873%0.72879%0.793SS**  trans-131.1131.9-169.8-164.9173000109.4Q13L11-Q13 HydrophobicContact CD2-CB 4.01Å
12L31.9Very low37.9Very low162 Ų162134 Ų13485%0.84878%0.782SS**  trans-144.8123.6155.5-74.3-178.9000106.3
13Q31.8Very low37.6Very low144 Ų144133 Ų13367%0.67379%0.788SS**  cis70.1131.236.6-156.8174.31900111.7L11L11-Q13 HydrophobicContact CD2-CB 4.01Å
14E34.4Very low37.5Very low153 Ų153131.1 Ų131.172%0.71579%0.786SS**  cis-177.9146.8-16.3166.4-173.6160.700105.7
15E31Very low37.3Very low188 Ų188133.2 Ų133.288%0.87979%0.788SS**  trans141.8158.7163.3-86.9-160.1121.800109.9
16A33.1Very low36.9Very low77 Ų77130.8 Ų130.864%0.63678%0.781SS**  cis-176.4146.3-35.800000106.3
17D37.8Very low36.6Very low146 Ų146134.8 Ų134.878%0.78179%0.787SS**  trans-82.9143.5168.3175.864.7000110.6G19D17-G19 PolarHBondContact OD2-N 2.76Å
18P45Very low36.9Very low118 Ų118135.3 Ų135.377%0.76678%0.783SS**  trans-123.9105.9149.734.5-23.4000112.4
19G31.3Very low38Very low52 Ų52131.6 Ų131.654%0.53678%0.776SS.*  trans-60.1-164.915800000115.5D17D17-G19 PolarHBondContact OD2-N 2.76Å
20P59.8Low37Very low130 Ų130135.6 Ų135.684%0.84479%0.791SS**  trans-90.4164-141.634.2-39.1000116
21K32.9Very low36.3Very low210 Ų210132.2 Ų132.291%0.91378%0.78SS**  trans-128.1147.5153.2-82.2-166.2173.3-178.20112.6
22S35.6Very low36.2Very low128 Ų128130.9 Ų130.990%0.89578%0.782SS**  trans-88.7162-175.649.40000113
23G29Very low36.3Very low85 Ų85132.2 Ų132.288%0.87678%0.784SS**  trans-157.880.3169.900000110
24G34.6Very low36.2Very low70 Ų70128.9 Ų128.972%0.72279%0.788SS**  trans-103144.5175.200000111.6
25K36.5Very low36.1Very low194 Ų194125 Ų12584%0.84379%0.789SS**  trans174.2152.6164.4-102.6178175.5-159.30107.8
26D33.2Very low36.3Very low135 Ų135122.4 Ų122.472%0.72279%0.792SS**  cis-174.7168.2-35.4-110.4-41.7000106.9
27E31.8Very low36.3Very low199 Ų199122.6 Ų122.693%0.9380%0.801SS**  trans63.7165170.2-69.2-16983.900118.2
28A36.1Very low36Very low93 Ų93118.8 Ų118.877%0.76980%0.797SS**  trans-133.5-110.6-165.100000115.2
29P61.2Low35.5Very low112 Ų112121.9 Ų121.973%0.72780%0.803SS**  -113.6164.1-119.935.9-23.3000114.6
30L31.2Very low35.6Very low181 Ų181124.8 Ų124.895%0.94881%0.81SS**  trans166.3156.7156.4-91157.4000107.4
31G29.2Very low34.5Very low61 Ų61124.7 Ų124.763%0.62981%0.807SS**  cis159.4104.7-9.100000113.8
32S33.6Very low34.8Very low111 Ų111120 Ų12078%0.77680%0.801SS**  trans69.5159.2163.7-149.90000120.5
33E32.6Very low35Very low190 Ų190123.3 Ų123.389%0.88880%0.799SS**  trans53.6152.5164.9-73.5173.593.600120.2
34G31.4Very low35.5Very low73 Ų73122.8 Ų122.875%0.75379%0.793SS**  cis157.4136.3-6.400000113.1
35G31.5Very low35.7Very low71 Ų71124.7 Ų124.773%0.73280%0.803SS**  trans98.3111.8150.800000121.4
36S35.7Very low35.8Very low135 Ų135118.8 Ų118.894%0.94480%0.796SS**  trans67.5154.2155.177.20000119.4
37G32Very low36.4Very low80 Ų80120.8 Ų120.883%0.82581%0.806SS**  cis176.2155.2-8.200000113.6
38G32.1Very low36.9Very low67 Ų67117.1 Ų117.169%0.69179%0.793SS**  trans115.1114.1178.200000113.1
39M33.6Very low37.9Very low182 Ų182119 Ų11990%0.89780%0.797SS**  cis82.3130.845.4-62.9-179.577.800113.4
40V33.3Very low36.8Very low114 Ų114119 Ų11969%0.69179%0.791SS**  cis-164.5176.1-7.991.60000111.5
41T37.4Very low37.6Very low127 Ų127115.4 Ų115.478%0.77979%0.788SS**  trans71.4149.3-179.275.60000115.8
42S38.9Very low38.1Very low111 Ų111120.6 Ų120.678%0.77679%0.793SS**  cis-164.4-180-24.459.90000107.5
43K40.3Very low38.3Very low199 Ų199119.5 Ų119.587%0.86578%0.781SS**  cis-153.4150.89.4-169.9178177.4-179.40109.2
44G39Very low38.3Very low73 Ų73121.5 Ų121.575%0.75378%0.781SS**  trans-102.5163178.100000115.1
45A39.1Very low38.5Very low111 Ų111124 Ų12492%0.91777%0.773SS**  trans-140.1117.4166.200000109.3
46G39.8Very low38.4Very low69 Ų69127 Ų12771%0.71177%0.767SS**  trans-137.5138.5177.300000110.6
47L43.9Very low38.4Very low177 Ų177126.7 Ų126.793%0.92775%0.754SS**  trans-141.9140.1175.5-61.9172.6000106.3
48N42.2Very low38.9Very low123 Ų123128.4 Ų128.466%0.65875%0.751SS**  cis-141.8115.56.1169.515.2000109.6N50N48-N50 VanDerWaalsContact C-N 3.29Å; N48-N50 PolarHBondContact O-N 2.65Å; N48-N50 VanDerWaalsContact OD1-CB 3.26Å; N48-N50 WeakPolarHBondContact OD1-CB 3.41Å; N48-N50 PolarHBondContact OD1-N 3.33Å
49P57.1Low38.8Very low132 Ų132131.2 Ų131.286%0.85775%0.754SS**  trans-87.118.6-17936.4-36.7000114.3
50N39.8Very low38.6Very low113 Ų113127 Ų12760%0.60475%0.749SS**  trans-114.138.9-168.8-152.14.2000114N48N48-N50 VanDerWaalsContact C-N 3.29Å; N48-N50 PolarHBondContact O-N 2.65Å; N48-N50 VanDerWaalsContact OD1-CB 3.26Å; N48-N50 WeakPolarHBondContact OD1-CB 3.41Å; N48-N50 PolarHBondContact OD1-N 3.33Å
51A46.8Very low38.3Very low105 Ų105126.7 Ų126.787%0.86875%0.751SS**  trans-89.710516500000108.8
52K40.6Very low37.9Very low170 Ų170125.7 Ų125.774%0.73975%0.75SS**  trans-110.3143.1-170-109.8-173.8176.8-176.50112.6
53V37.1Very low37.3Very low87 Ų87129.4 Ų129.453%0.52776%0.755SS.*  trans68.6131.5151.3174.30000114.7
54W32.8Very low36.7Very low233 Ų233124.2 Ų124.288%0.88375%0.748SS**  cis-120.4137.420.3-51.967.6000109.2
55Q35.1Very low36.2Very low126 Ų126127.1 Ų127.159%0.58975%0.751SS**  71.1126.354.1-65.7-157.7-88.500113.2
56E30.8Very low35.6Very low132 Ų132128.2 Ų128.262%0.61775%0.747SS**  cis-130.31764.3-66.6-64.35500110.2
57I34.7Very low35Very low130 Ų130130.3 Ų130.367%0.66775%0.751SS**  cis71.4140.731.2-66.2171.1000112.7
58P43.1Very low35Very low116 Ų116127.4 Ų127.475%0.75374%0.743SS**  cis-108.71664.618.15.7000114.3
59V29.4Very low34.3Very low126 Ų126129.4 Ų129.476%0.76475%0.748SS**  cis95.2109.328176.10000115.4
60A29.1Very low33.2Very low94 Ų94134.1 Ų134.178%0.77775%0.749SS**  trans161.5169.514900000109.9
61S26.8Very low33.1Very low107 Ų107134.3 Ų134.375%0.74876%0.756SS**  -177145-56.4-91.10000108.6
62S29Very low33Very low106 Ų106134.7 Ų134.774%0.74175%0.749SS**  trans67.4127.8164.2-57.50000121.2
63E27.4Very low32.7Very low189 Ų189131.7 Ų131.788%0.88375%0.75SS**  trans48.3149.1132.6-58.5-175.2121.200124.5
64A27.9Very low32.1Very low89 Ų89134.3 Ų134.374%0.73676%0.761SS**  trans83.898.7151.200000122.2
65V28.2Very low32.1Very low134 Ų134130.3 Ų130.381%0.81276%0.755SS**  trans73.2155.9137.7-166.10000118.8
66T26.4Very low31.9Very low134 Ų134129 Ų12982%0.82276%0.76SS**  trans90.2124.1169.569.10000120
67S27.4Very low31.8Very low114 Ų114131.4 Ų131.480%0.79777%0.765SS**  trans-82.4177.8153.1-42.90000109.2
68P43.1Very low31.4Very low116 Ų116130.1 Ų130.175%0.75377%0.767SS**  cis-142.1-176.69.144.4-25.5000116.9
69H27.7Very low30.8Very low165 Ų165131.3 Ų131.376%0.76476%0.763SS**  trans16.7130.8143.6-162.2-73.2000121.6
70W33.7Very low32.3Very low231 Ų231130.7 Ų130.788%0.87576%0.762SS**  trans-47.7147.4173.7-55.188.5000117.8
71P37.8Very low32.2Very low116 Ų116131.1 Ų131.175%0.75376%0.759SS**  -131.7174.6128.937.3-26000113.6
72P45.4Very low32.5Very low113 Ų113131.2 Ų131.273%0.73476%0.759SS**  trans-127172.3-161.843.7-31.2000117.9
73S34.4Very low32.7Very low107 Ų107130.6 Ų130.675%0.74876%0.761SS**  trans70.7137.1150.3-60.70000122.5
74D24.1Very low32.7Very low143 Ų143125.1 Ų125.177%0.76576%0.755SS**  trans-169.3131.3132.5-99.5-11000108.9
75I33.2Very low32.8Very low148 Ų148127.3 Ų127.376%0.75976%0.763SS**  82.4140.266.3-74.3-172.9000112.1
76S30.6Very low32.9Very low100 Ų100130.4 Ų130.470%0.69977%0.766SS**  cis-127.2-167.13.5-140.10000109.8
77Y28.2Very low33.8Very low181 Ų181129.1 Ų129.171%0.7176%0.76SS**  cis-145.7-171.310.7-157.1-146.7000107.1
78S26.5Very low33.7Very low103 Ų103133.8 Ų133.872%0.7276%0.762SS**  cis-149.8173.925.5-56.40000113.1
79E30.8Very low33Very low142 Ų142132.6 Ų132.666%0.66476%0.756SS**  trans-120.5-174.6-175.9-120.8-147.699.800111.4S81E79-S81 PolarHBondContact OE1-N 3.39Å; E79-S81 VanDerWaalsContact OE1-N 3.08Å
80P60Low33.2Very low113 Ų113131.3 Ų131.373%0.73476%0.759SS**  cis-139.3176.120.442.9-23.9000120
81S27.5Very low33Very low103 Ų103123.9 Ų123.972%0.7275%0.754SS**  trans91.4138.3147.3-162.70000118.1E79E79-S81 PolarHBondContact OE1-N 3.39Å; E79-S81 VanDerWaalsContact OE1-N 3.08Å
82S33.3Very low32.8Very low108 Ų108127.5 Ų127.576%0.75576%0.759SS**  cis178.8156.2-17175.10000108
83A32.8Very low31.9Very low94 Ų94129 Ų12978%0.77777%0.766SS**  cis-172.2160.3-35.200000107.2
84G28.4Very low31.6Very low73 Ų73127.6 Ų127.675%0.75376%0.76SS**  trans17793.8176.700000119.2
85C29.7Very low32.1Very low136 Ų136129 Ų12992%0.91977%0.767SS**  trans58.5153.6148.6-61.10000122.7
86K30.2Very low32.1Very low199 Ų199125 Ų12587%0.86576%0.762SS**  trans-131.5-156.5175.8-43.6178.8-179.2179.70108.1
87P46Very low32.1Very low107 Ų107127.4 Ų127.470%0.69577%0.767SS**  -128.2166.4-54.931.2-14.3000114.3
88Y25Very low32.7Very low212 Ų212123.3 Ų123.383%0.83177%0.765SS**  trans179.4156.1141.2-112.8-136.1000110.2
89S27.6Very low33Very low90 Ų90123.5 Ų123.563%0.62977%0.766SS**  cis87.7130.712.3-53.10000115.2
90V32.8Very low33.5Very low139 Ų139121.4 Ų121.484%0.84277%0.767SS**  cis-148.3163.9-6.2-165.60000108.6
91G29.7Very low32.2Very low74 Ų74122.2 Ų122.276%0.76377%0.77SS**  trans-154.5137.9166.500000113.7
92F33.2Very low32.5Very low193 Ų193121.5 Ų121.585%0.84677%0.771SS**  trans-152.9135.7-167.3-168.3-76.4000112
93T26.7Very low32.4Very low145 Ų145122.7 Ų122.789%0.8977%0.774SS**  trans-160.3152.5165.414.80000111.9
94A27.8Very low32.3Very low76 Ų76122.2 Ų122.263%0.62877%0.769SS**  trans-157.5164.1178.500000111.9
95L34.3Very low32.5Very low174 Ų174127.2 Ų127.291%0.91177%0.773SS**  trans60.3167.3176-89.366.5000115.7
96G32.9Very low32.6Very low63 Ų63128.5 Ų128.565%0.64977%0.769SS**  cis-159.3166.8-5.500000106.8
97D31.5Very low33Very low150 Ų150123.3 Ų123.380%0.80276%0.763SS**  177.8170.552.9-128.347.9000106.7
98S39.4Very low32.3Very low96 Ų96125 Ų12567%0.67177%0.772SS**  cis-166.6174.80.2-142.60000112.1
99S32.9Very low32.9Very low107 Ų107122.3 Ų122.375%0.74877%0.771SS**  trans80.7136155.7-162.40000120.5
100S42.7Very low33.2Very low98 Ų98121.6 Ų121.669%0.68578%0.778SS**  cis-167.8163.5-15.9-81.50000112.8
101T31.7Very low33.2Very low130 Ų130124 Ų12480%0.79878%0.783SS**  trans72.5103.7154.6-49.30000118.4
102A33.4Very low33.3Very low88 Ų88127.4 Ų127.473%0.72778%0.783SS**  82153.976.900000114.9
103T31.4Very low34Very low133 Ų133122.3 Ų122.382%0.81677%0.77SS**  cis-162.3165.914.9-21.60000113.2
104A31.9Very low34.4Very low83 Ų83122.9 Ų122.969%0.68676%0.762SS**  trans7097.8145.300000124
105E32Very low34.6Very low178 Ų178126.3 Ų126.383%0.83277%0.766SS**  48.4152.5103.7-70.3-173.2-126.900126.7
106I31.7Very low34.7Very low163 Ų163126.2 Ų126.284%0.83677%0.765SS**  trans88.4147.5157.9-67.2145.2000118.8
107A38Very low34.6Very low90 Ų90126.7 Ų126.774%0.74477%0.77SS**  trans-128.1169-168.600000112.9
108V31.8Very low34.6Very low143 Ų143129.8 Ų129.887%0.86778%0.777SS**  trans-164.7164.5154.1125.80000112.1
109N36.5Very low34.7Very low155 Ų155130.1 Ų130.183%0.82978%0.779SS**  trans-76.7143.5-173.9-51.7-37.2000115
110G34.6Very low35Very low75 Ų75131 Ų13177%0.77378%0.783SS**  85.8149.611900000121.6
111M33.2Very low34.6Very low191 Ų191130.6 Ų130.694%0.94179%0.785SS**  trans81.6132166.3-139.36875.200119.4
112D32Very low34.5Very low144 Ų144132.9 Ų132.977%0.7779%0.787SS**  trans-69.1172.6165.7-151.337.1000110.3
113P47.6Very low34.7Very low87 Ų87133.4 Ų133.457%0.56579%0.785SS**  cis-142.2175.911.243.9-25.3000118.8
114Q35.8Very low34.7Very low157 Ų157133.1 Ų133.173%0.73478%0.783SS**  trans68.7151.5146.3-91.9171.9-51.400119.4
115E31.8Very low34.8Very low148 Ų148135.9 Ų135.969%0.69279%0.792SS**  cis-155151.1-2.1-162.4168.4-109.200111.2
116L36.7Very low34.9Very low171 Ų171130.8 Ų130.890%0.89579%0.786SS**SBendtrans173.8124133.1-97.6169.4000112.9
117G29.8Very low35.1Very low74 Ų74128.1 Ų128.176%0.76378%0.782SS**  trans86.283.8155.100000118.4
118F32.6Very low35.4Very low215 Ų215129.7 Ų129.794%0.94379%0.788SS**  trans-82.5155.2169-87.2-90.3000113.8
119S40.2Very low36.3Very low103 Ų103129.5 Ų129.572%0.7278%0.782SS**  trans-84.5156.2172.9163.20000112.3
120P38.6Very low36.8Very low126 Ų126127.7 Ų127.782%0.81878%0.782SS**  trans-120.2172.3131.736.2-30.9000111.9
121A35.8Very low37.4Very low89 Ų89131 Ų13174%0.73678%0.775SS**  trans-118.9-168.3-161.400000114.6
122E30.1Very low38.1Very low178 Ų178127 Ų12783%0.83276%0.761SS**  trans91.7113.3162.4-55.2-151.9103.400120.5
123S36.2Very low38.8Very low99 Ų99128.5 Ų128.569%0.69276%0.764SS**  58.1116.4121.4-50.60000121.3
124T31.5Very low39Very low126 Ų126132 Ų13277%0.77377%0.772SS**  160.2135.9111.3-700000114
125T35.3Very low39.8Very low142 Ų142128 Ų12887%0.87175%0.754SS**  trans65.2125.3161.3-66.30000120.5
126G32.5Very low41Very low70 Ų70125 Ų12572%0.72275%0.745SS**  trans165.3112.915900000115
127S36.9Very low42.8Very low107 Ų107120.7 Ų120.775%0.74873%0.73SS**  trans25.4117.8171.1-87.60000120.8
128S44.9Very low45.1Very low124 Ų124120 Ų12087%0.86771%0.712SS**  trans-90.4104.6153.1-570000110.2
129D48.8Very low47.5Very low139 Ų139114.6 Ų114.674%0.74369%0.691SS**  trans-126.586.5170.9-92.7-59000110.4
130S48.9Very low49.9Very low117 Ų117114 Ų11482%0.81868%0.679SS**  trans-153.759.6176.264.20000110.3
131K46.8Very low52.5Low144 Ų144110.9 Ų110.963%0.62666%0.655SS**  trans-137.87.8-174.5-150.2-145.3170.1-149.90115
132T46.3Very low55.2Low106 Ų106112.3 Ų112.365%0.6564%0.641SS**SBendtrans-90.5-30.4-168.1-430000113.4
133E48Very low58.2Low177 Ų177108.7 Ų108.783%0.82763%0.625SS**Hα-helixtrans-81.8-36.7-171.5-61.2-171.7154.900113.6Q135 V136E133-Q135 VanDerWaalsContact C-N 3.31Å; E133-Q135 PolarHBondContact O-N 3.22Å; E133-V136 PolarHBondContact O-N 3.03Å
134E51.8Low60.9Low159 Ų159106.3 Ų106.374%0.74361%0.608SS**Hα-helixtrans-71-22.5176.1-67.2-170134.500113.7S137 S138E134-S137 PolarHBondContact O-OG 3.42Å; E134-S137 VanDerWaalsContact O-OG 3.13Å; E134-S138 PolarHBondContact O-N 3.24Å; E134-S138 PolarHBondContact O-OG 3.48Å
135Q52.1Low63.9Low74 Ų74100.3 Ų100.335%0.34657%0.571SS.*Hα-helixtrans-68.4-41.1175.5-75.3-161.2-134.500111.4E133 S137 S138 E139E133-Q135 VanDerWaalsContact C-N 3.31Å; E133-Q135 PolarHBondContact O-N 3.22Å; Q135-S137 VanDerWaalsContact C-N 3.34Å; Q135-S137 PolarHBondContact O-N 2.9Å; Q135-S138 PolarHBondContact O-N 3.15Å; Q135-S138 PolarHBondContact O-OG 3.39Å; Q135-E139 PolarHBondContact NE2-OE1 3.45Å; Q135-E139 VanDerWaalsContact NE2-OE1 3.09Å; Q135-E139 VanDerWaalsContact O-CB 3.26Å; Q135-E139 WeakPolarHBondContact O-CB 3.49Å; Q135-E139 VanDerWaalsContact O-CG 3.28Å; Q135-E139 WeakPolarHBondContact O-CG 3.43Å; Q135-E139 PolarHBondContact O-N 3.01Å
136V57Low66.7Low86 Ų8696.9 Ų96.952%0.52154%0.544SS..Hα-helixtrans-64.4-38-177.5-167.50000111.7E133 N140E133-V136 PolarHBondContact O-N 3.03Å; V136-N140 WeakPolarHBondContact O-CB 3.48Å; V136-N140 PolarHBondContact O-N 3.06Å; V136-N140 VanDerWaalsContact O-N 3.12Å; V136-N140 PolarHBondContact O-ND2 2.83Å
137S74.9Confident69.5Low80 Ų8099.3 Ų99.356%0.55954%0.535SS*.Hα-helixtrans-72.4-43.5178.259.90000112.5E134 Q135 N140 L141E134-S137 PolarHBondContact O-OG 3.42Å; E134-S137 VanDerWaalsContact O-OG 3.13Å; Q135-S137 VanDerWaalsContact C-N 3.34Å; Q135-S137 PolarHBondContact O-N 2.9Å; S137-N140 PolarHBondContact O-N 3.45Å; S137-L141 WeakPolarHBondContact O-CB 3.43Å; S137-L141 PolarHBondContact O-N 3.31Å
138S78.1Confident72.3Confident58 Ų5896.4 Ų96.441%0.40651%0.51SS..Hα-helixtrans-70.3-33.5179.455.50000113.3E134 Q135 R142E134-S138 PolarHBondContact O-N 3.24Å; E134-S138 PolarHBondContact O-OG 3.48Å; Q135-S138 PolarHBondContact O-N 3.15Å; Q135-S138 PolarHBondContact O-OG 3.39Å; S138-R142 WeakPolarHBondContact O-CG 3.4Å; S138-R142 PolarHBondContact O-N 2.92Å
139E83.7Confident74.6Confident103 Ų10390.7 Ų90.748%0.48147%0.469SS..Hα-helixtrans-71.5-42.5173.4-71.3169.5-16400111.4Q135 L141 R142 E143Q135-E139 PolarHBondContact NE2-OE1 3.45Å; Q135-E139 VanDerWaalsContact NE2-OE1 3.09Å; Q135-E139 VanDerWaalsContact O-CB 3.26Å; Q135-E139 WeakPolarHBondContact O-CB 3.49Å; Q135-E139 VanDerWaalsContact O-CG 3.28Å; Q135-E139 WeakPolarHBondContact O-CG 3.43Å; Q135-E139 PolarHBondContact O-N 3.01Å; E139-L141 VanDerWaalsContact C-N 3.31Å; E139-L141 PolarHBondContact O-N 3.22Å; E139-R142 PolarHBondContact O-N 3.5Å; E139-E143 PolarHBondContact O-N 2.87Å
140N90Very high76.6Confident91 Ų9185.7 Ų85.749%0.48744%0.442SS..Hα-helixtrans-61.7-36.7172.5-87.1-74000112.8V136 S137 S144V136-N140 WeakPolarHBondContact O-CB 3.48Å; V136-N140 PolarHBondContact O-N 3.06Å; V136-N140 VanDerWaalsContact O-N 3.12Å; V136-N140 PolarHBondContact O-ND2 2.83Å; S137-N140 PolarHBondContact O-N 3.45Å; N140-S144 WeakPolarHBondContact O-CB 3.41Å; N140-S144 PolarHBondContact O-N 3.47Å; N140-S144 PolarHBondContact O-OG 3.06Å
141L92.1Very high78.6Confident59 Ų5984.8 Ų84.831%0.30942%0.423SS..Hα-helixtrans-64.6-47.4173.2177.459.7000111.4S137 E139 E143 S144 L145 L188 L194S137-L141 WeakPolarHBondContact O-CB 3.43Å; S137-L141 PolarHBondContact O-N 3.31Å; E139-L141 VanDerWaalsContact C-N 3.31Å; E139-L141 PolarHBondContact O-N 3.22Å; L141-E143 VanDerWaalsContact C-N 3.34Å; L141-E143 PolarHBondContact O-N 2.74Å; L141-S144 PolarHBondContact O-N 3.05Å; L141-L145 WeakPolarHBondContact O-CB 3.48Å; L141-L145 PolarHBondContact O-N 3.33Å; L141-L188 HydrophobicContact CD1-CB 4.11Å; L141-L188 HydrophobicContact CD1-CD2 4.31Å; L141-L188 WeakPolarHBondContact CD1-O 3.38Å; L141-L194 HydrophobicContact CD2-CD2 4.39Å
142R93.1Very high80.7Confident119 Ų11979.7 Ų79.745%0.44940%0.4SS..Hα-helixtrans-59.1-42.1175.9-83.4177.7160.7-156.2-12.8112.2S138 E139 K146 L194 D197 V198S138-R142 WeakPolarHBondContact O-CG 3.4Å; S138-R142 PolarHBondContact O-N 2.92Å; E139-R142 PolarHBondContact O-N 3.5Å; R142-K146 VanDerWaalsContact O-CB 3.28Å; R142-K146 WeakPolarHBondContact O-CB 3.31Å; R142-K146 PolarHBondContact O-N 3.31Å; R142-L194 HydrophobicContact CG-CD1 3.68Å; R142-D197 IonicContact NH2-OD2 3.69Å; R142-V198 HydrophobicContact CB-CG2 4.47Å; R142-V198 HydrophobicContact CG-CG2 4.23Å
143E92.7Very high82.7Confident103 Ų10375 Ų7548%0.48137%0.37SS..Hα-helixtrans-65.2-41.7174.1-83.6-156.3-161.500113.3E139 L141 K146 K147E139-E143 PolarHBondContact O-N 2.87Å; L141-E143 VanDerWaalsContact C-N 3.34Å; L141-E143 PolarHBondContact O-N 2.74Å; E143-K146 PolarHBondContact O-N 2.94Å; E143-K147 WeakPolarHBondContact O-CD 3.06Å; E143-K147 VanDerWaalsContact O-CG 3.24Å; E143-K147 WeakPolarHBondContact O-CG 3.32Å; E143-K147 PolarHBondContact O-N 3.49Å; E143-K147 WeakPolarHBondContact OE2-CE 3.31Å; E143-K147 IonicContact OE2-NZ 3.63Å; E143-K147 PolarHBondContact OE2-NZ 3.4Å
144S93.7Very high84.5Confident49 Ų4967.2 Ų67.234%0.34334%0.336SS..Hα-helixtrans-66.1-45.6-179.9-58.90000110.8N140 L141 K146 K147 E148N140-S144 WeakPolarHBondContact O-CB 3.41Å; N140-S144 PolarHBondContact O-N 3.47Å; N140-S144 PolarHBondContact O-OG 3.06Å; L141-S144 PolarHBondContact O-N 3.05Å; S144-K146 VanDerWaalsContact C-N 3.33Å; S144-K146 PolarHBondContact O-N 2.93Å; S144-K147 PolarHBondContact O-N 2.88Å; S144-E148 WeakPolarHBondContact O-CB 3.5Å; S144-E148 PolarHBondContact O-N 3.29Å
145L95Very high85.9Confident0 Ų066.8 Ų66.80%033%0.328CS..Hα-helixtrans-60.2-41.6173.4179.759.3000111.7L141 E148 L149 I185 L188 T189 L194 I195 V198L141-L145 WeakPolarHBondContact O-CB 3.48Å; L141-L145 PolarHBondContact O-N 3.33Å; L145-E148 PolarHBondContact O-N 2.95Å; L145-L149 HydrophobicContact CD1-CD1 3.9Å; L145-L149 HydrophobicContact CD1-CG 4.17Å; L145-L149 HydrophobicContact CG-CD1 3.81Å; L145-L149 WeakPolarHBondContact O-CB 3.07Å; L145-L149 WeakPolarHBondContact O-CD1 3.35Å; L145-L149 WeakPolarHBondContact O-CG 3.34Å; L145-L149 PolarHBondContact O-N 2.68Å; L145-I185 HydrophobicContact CD1-CG1 4.26Å; L145-I185 HydrophobicContact CD1-CG2 3.93Å; L145-L188 HydrophobicContact CB-CD1 4.44Å; L145-T189 HydrophobicContact CD1-CG2 4.17Å; L145-T189 HydrophobicContact CD2-CG2 3.71Å; L145-L194 HydrophobicContact CD2-CD2 4.17Å; L145-L194 HydrophobicContact CD2-CG 3.92Å; L145-I195 HydrophobicContact CD1-CG1 4.38Å; L145-I195 HydrophobicContact CD2-CG1 4.15Å; L145-V198 HydrophobicContact CD2-CB 4.41Å; L145-V198 HydrophobicContact CD2-CG2 4.15Å; L145-V198 HydrophobicContact CG-CG1 4.39Å
146K93.4Very high87.3Confident70 Ų7069.3 Ų69.330%0.30434%0.339SS..Hα-helixtrans-60.5-49.9175-177.5179.2171.3-179.50111.9R142 E143 S144 E148 L149 E150 V198R142-K146 VanDerWaalsContact O-CB 3.28Å; R142-K146 WeakPolarHBondContact O-CB 3.31Å; R142-K146 PolarHBondContact O-N 3.31Å; E143-K146 PolarHBondContact O-N 2.94Å; S144-K146 VanDerWaalsContact C-N 3.33Å; S144-K146 PolarHBondContact O-N 2.93Å; K146-E148 VanDerWaalsContact C-N 3.3Å; K146-E148 PolarHBondContact O-N 3.13Å; K146-L149 PolarHBondContact O-N 2.77Å; K146-E150 VanDerWaalsContact CE-CD 3.43Å; K146-E150 WeakPolarHBondContact CE-OE1 3.48Å; K146-E150 WeakPolarHBondContact CE-OE2 3.27Å; K146-E150 HydrophobicContact CG-CG 4.3Å; K146-E150 IonicContact NZ-OE1 2.8Å; K146-E150 WeakPolarHBondContact O-CB 3.34Å; K146-E150 WeakPolarHBondContact O-CG 3.44Å; K146-E150 PolarHBondContact O-N 2.81Å; K146-V198 HydrophobicContact CB-CG1 3.64Å; K146-V198 HydrophobicContact CG-CG1 4.21Å
147K92.1Very high88.8Confident120 Ų12066.4 Ų66.452%0.52232%0.321SS..Hα-helixtrans-59.9-40.9-179.8-71.2159.2-168.2163.70111.4E143 S144 F151E143-K147 WeakPolarHBondContact O-CD 3.06Å; E143-K147 VanDerWaalsContact O-CG 3.24Å; E143-K147 WeakPolarHBondContact O-CG 3.32Å; E143-K147 PolarHBondContact O-N 3.49Å; E143-K147 WeakPolarHBondContact OE2-CE 3.31Å; E143-K147 IonicContact OE2-NZ 3.63Å; E143-K147 PolarHBondContact OE2-NZ 3.4Å; S144-K147 PolarHBondContact O-N 2.88Å; K147-F151 WeakPolarHBondContact O-CB 3.18Å; K147-F151 PolarHBondContact O-N 3.1Å
148E94Very high89.4Confident47 Ų4762.8 Ų62.822%0.2230%0.295CS..Hα-helixtrans-67.9-44.7177.4-17767.7179.300112.1S144 L145 K146 F151 Y152 G184 I185 L188S144-E148 WeakPolarHBondContact O-CB 3.5Å; S144-E148 PolarHBondContact O-N 3.29Å; L145-E148 PolarHBondContact O-N 2.95Å; K146-E148 VanDerWaalsContact C-N 3.3Å; K146-E148 PolarHBondContact O-N 3.13Å; E148-F151 WeakPolarHBondContact O-CB 3.41Å; E148-F151 PolarHBondContact O-N 2.92Å; E148-Y152 HydrophobicContact CG-CD2 4.19Å; E148-Y152 HydrophobicContact CG-CE2 3.62Å; E148-Y152 WeakPolarHBondContact O-CD2 3.49Å; E148-Y152 PolarHBondContact O-N 3.23Å; E148-Y152 WeakPolarHBondContact OE1-CE2 3.39Å; E148-Y152 PolarHBondContact OE1-OH 3.31Å; E148-G184 WeakPolarHBondContact OE1-CA 3.38Å; E148-I185 HydrophobicContact CG-CG1 3.89Å; E148-L188 HydrophobicContact CB-CD1 4.1Å; E148-L188 HydrophobicContact CG-CD1 4.33Å
149L93.8Very high89.6Confident3 Ų362.4 Ų62.42%0.01629%0.292CS..Hα-helixtrans-63.8-41.9174.7-70163.2000112.2L145 K146 F151 Y152 F153 I179 I185 V198 L199L145-L149 HydrophobicContact CD1-CD1 3.9Å; L145-L149 HydrophobicContact CD1-CG 4.17Å; L145-L149 HydrophobicContact CG-CD1 3.81Å; L145-L149 WeakPolarHBondContact O-CB 3.07Å; L145-L149 WeakPolarHBondContact O-CD1 3.35Å; L145-L149 WeakPolarHBondContact O-CG 3.34Å; L145-L149 PolarHBondContact O-N 2.68Å; K146-L149 PolarHBondContact O-N 2.77Å; L149-F151 VanDerWaalsContact C-N 3.28Å; L149-F151 PolarHBondContact O-N 2.97Å; L149-Y152 PolarHBondContact O-N 3.43Å; L149-F153 WeakPolarHBondContact O-CD2 3.19Å; L149-F153 PolarHBondContact O-N 3.38Å; L149-I179 HydrophobicContact CD2-CG2 3.59Å; L149-I185 HydrophobicContact CD2-CD1 3.46Å; L149-I185 VanDerWaalsContact CD2-CD1 3.46Å; L149-I185 HydrophobicContact CD2-CG1 4.15Å; L149-I185 HydrophobicContact CG-CD1 4.24Å; L149-V198 HydrophobicContact CD1-CB 4.25Å; L149-V198 HydrophobicContact CD1-CG1 3.73Å; L149-L199 HydrophobicContact CB-CD2 4.23Å; L149-L199 HydrophobicContact CD1-CD2 4.07Å; L149-L199 HydrophobicContact CD1-CG 4.1Å; L149-L199 HydrophobicContact CD2-CD2 3.93Å; L149-L199 HydrophobicContact CD2-CG 4.34Å; L149-L199 HydrophobicContact CG-CD2 4.31Å
150E90.8Very high89.8Confident35 Ų3564.4 Ų64.416%0.16430%0.3CS..Hα-helixtrans-67.4-28.4175.1-72.1179.4163.400111.9K146 S154 S202 M204K146-E150 VanDerWaalsContact CE-CD 3.43Å; K146-E150 WeakPolarHBondContact CE-OE1 3.48Å; K146-E150 WeakPolarHBondContact CE-OE2 3.27Å; K146-E150 HydrophobicContact CG-CG 4.3Å; K146-E150 IonicContact NZ-OE1 2.8Å; K146-E150 WeakPolarHBondContact O-CB 3.34Å; K146-E150 WeakPolarHBondContact O-CG 3.44Å; K146-E150 PolarHBondContact O-N 2.81Å; E150-S154 WeakPolarHBondContact O-CA 3.44Å; E150-S154 WeakPolarHBondContact O-CB 3.46Å; E150-S154 PolarHBondContact O-N 2.77Å; E150-S202 WeakPolarHBondContact CG-OG 3.31Å; E150-S202 VanDerWaalsContact OE1-CB 3.29Å; E150-S202 WeakPolarHBondContact OE1-CB 3.26Å; E150-S202 PolarHBondContact OE1-OG 2.87Å; E150-M204 HydrophobicContact CB-SD 4.01Å; E150-M204 HydrophobicContact CG-CB 4.26Å; E150-M204 HydrophobicContact CG-CG 4.41Å; E150-M204 HydrophobicContact CG-SD 4.02Å
151F90.9Very high89.9Confident98 Ų9861.5 Ų61.543%0.4328%0.284SS..Hα-helixtrans-69.7-49.4170.3174.9-100.1000112.3K147 E148 L149 F153 S154 N157K147-F151 WeakPolarHBondContact O-CB 3.18Å; K147-F151 PolarHBondContact O-N 3.1Å; E148-F151 WeakPolarHBondContact O-CB 3.41Å; E148-F151 PolarHBondContact O-N 2.92Å; L149-F151 VanDerWaalsContact C-N 3.28Å; L149-F151 PolarHBondContact O-N 2.97Å; F151-F153 VanDerWaalsContact C-N 3.31Å; F151-F153 PolarHBondContact O-N 3.16Å; F151-S154 WeakPolarHBondContact O-CB 3.36Å; F151-S154 PolarHBondContact O-N 2.88Å; F151-S154 PolarHBondContact O-OG 2.8Å; F151-N157 HydrophobicContact CE1-CB 4.21Å; F151-N157 HydrophobicContact CE2-CB 4.33Å; F151-N157 HydrophobicContact CZ-CB 4.05Å; F151-N157 WeakPolarHBondContact O-CB 3.47Å
152Y91.2Very high89.9Confident36 Ų3665.4 Ų65.414%0.14131%0.305CS..Hα-helixtrans-57.9-44.2178.9-76.8-65.9000112.2E148 L149 S154 N157 L164 M182 I185E148-Y152 HydrophobicContact CG-CD2 4.19Å; E148-Y152 HydrophobicContact CG-CE2 3.62Å; E148-Y152 WeakPolarHBondContact O-CD2 3.49Å; E148-Y152 PolarHBondContact O-N 3.23Å; E148-Y152 WeakPolarHBondContact OE1-CE2 3.39Å; E148-Y152 PolarHBondContact OE1-OH 3.31Å; L149-Y152 PolarHBondContact O-N 3.43Å; Y152-S154 VanDerWaalsContact C-N 3.29Å; Y152-S154 PolarHBondContact O-N 3.08Å; Y152-N157 PolarHBondContact O-ND2 2.87Å; Y152-L164 WeakPolarHBondContact O-CD2 3.2Å; Y152-M182 HydrophobicContact CD1-CE 4.32Å; Y152-M182 HydrophobicContact CD1-SD 3.68Å; Y152-M182 HydrophobicContact CD2-SD 3.76Å; Y152-M182 HydrophobicContact CE1-SD 3.85Å; Y152-M182 HydrophobicContact CE2-CB 4.43Å; Y152-M182 HydrophobicContact CE2-SD 3.9Å; Y152-M182 HydrophobicContact CG-CE 4.49Å; Y152-M182 HydrophobicContact CG-SD 3.68Å; Y152-I185 HydrophobicContact CD2-CD1 3.64Å; Y152-I185 HydrophobicContact CD2-CG1 4.31Å; Y152-I185 HydrophobicContact CE2-CD1 3.67Å; Y152-I185 HydrophobicContact CE2-CG1 3.95Å
153F89.2Confident90Very high7 Ų765.2 Ų65.23%0.03130%0.304CS..THydrogen-bonded Turntrans-83.81.7176.5-70-63.2000114.8L149 F151 L164 V174 I179 L199 V205 V214 P216L149-F153 WeakPolarHBondContact O-CD2 3.19Å; L149-F153 PolarHBondContact O-N 3.38Å; F151-F153 VanDerWaalsContact C-N 3.31Å; F151-F153 PolarHBondContact O-N 3.16Å; F153-L164 HydrophobicContact CD1-CD2 4.32Å; F153-L164 HydrophobicContact CE1-CD1 4.37Å; F153-L164 HydrophobicContact CE1-CD2 4.19Å; F153-V174 HydrophobicContact CE1-CG2 4.35Å; F153-I179 HydrophobicContact CE2-CD1 3.81Å; F153-I179 HydrophobicContact CE2-CG1 4.48Å; F153-I179 HydrophobicContact CZ-CD1 3.49Å; F153-I179 VanDerWaalsContact CZ-CD1 3.49Å; F153-I179 HydrophobicContact CZ-CG1 4.19Å; F153-L199 HydrophobicContact CE2-CD2 4.49Å; F153-V205 HydrophobicContact CB-CG1 3.78Å; F153-V205 HydrophobicContact CD2-CG1 3.51Å; F153-V205 HydrophobicContact CE2-CG1 4.27Å; F153-V205 HydrophobicContact CG-CG1 3.69Å; F153-V214 HydrophobicContact CE2-CG1 3.91Å; F153-V214 HydrophobicContact CZ-CG1 3.73Å; F153-P216 HydrophobicContact CD1-CB 4.48Å; F153-P216 HydrophobicContact CD1-CG 3.86Å
154S84.6Confident90Very high15 Ų1560.3 Ų60.311%0.10528%0.282CS..SBendtrans-59.7143.5172.675.80000110.3E150 F151 Y152 E156 N157 L158E150-S154 WeakPolarHBondContact O-CA 3.44Å; E150-S154 WeakPolarHBondContact O-CB 3.46Å; E150-S154 PolarHBondContact O-N 2.77Å; F151-S154 WeakPolarHBondContact O-CB 3.36Å; F151-S154 PolarHBondContact O-N 2.88Å; F151-S154 PolarHBondContact O-OG 2.8Å; Y152-S154 VanDerWaalsContact C-N 3.29Å; Y152-S154 PolarHBondContact O-N 3.08Å; S154-E156 PolarHBondContact O-N 3.14Å; S154-N157 PolarHBondContact O-N 3.35Å; S154-N157 WeakPolarHBondContact OG-CB 3.45Å; S154-N157 PolarHBondContact OG-N 3.24Å; S154-L158 WeakPolarHBondContact O-CB 3.31Å; S154-L158 PolarHBondContact O-N 3.17Å
155R81.6Confident89.8Confident150 Ų15060.8 Ų60.857%0.56628%0.279SS*.Hα-helixtrans-56.8-26.6178.5179.1177.6171-142.3-1.3112.9S159 N297 F299R155-S159 VanDerWaalsContact O-CB 3.26Å; R155-S159 WeakPolarHBondContact O-CB 3.36Å; R155-S159 PolarHBondContact O-N 3.09Å; R155-S159 PolarHBondContact O-OG 2.74Å; R155-N297 PolarHBondContact NH2-ND2 2.68Å; R155-N297 VanDerWaalsContact NH2-ND2 3.2Å; R155-F299 HydrophobicContact CG-CD2 4.2Å; R155-F299 HydrophobicContact CG-CE2 4.34Å
156E81.5Confident89.7Confident126 Ų12664.5 Ų64.559%0.58931%0.305SS*.Hα-helixtrans-93.9-27.1-175.757.4-178.7-116.800114.9S154 K160S154-E156 PolarHBondContact O-N 3.14Å; E156-K160 VanDerWaalsContact O-CD 3.24Å; E156-K160 WeakPolarHBondContact O-CD 3.19Å; E156-K160 WeakPolarHBondContact O-CE 3.15Å; E156-K160 WeakPolarHBondContact O-CG 3.39Å; E156-K160 PolarHBondContact O-NZ 3.02Å
157N88.8Confident89.7Confident26 Ų2664.3 Ų64.314%0.13931%0.305CS..Hα-helixtrans-71.7-56.2162.4-178.662.1000109.4F151 Y152 S154 S159 K160 D161F151-N157 HydrophobicContact CE1-CB 4.21Å; F151-N157 HydrophobicContact CE2-CB 4.33Å; F151-N157 HydrophobicContact CZ-CB 4.05Å; F151-N157 WeakPolarHBondContact O-CB 3.47Å; Y152-N157 PolarHBondContact O-ND2 2.87Å; S154-N157 PolarHBondContact O-N 3.35Å; S154-N157 WeakPolarHBondContact OG-CB 3.45Å; S154-N157 PolarHBondContact OG-N 3.24Å; N157-S159 PolarHBondContact O-N 3.33Å; N157-S159 VanDerWaalsContact O-N 3.08Å; N157-K160 CarbonylContact O-C 3.59Å; N157-K160 WeakPolarHBondContact O-CA 3.41Å; N157-K160 PolarHBondContact O-N 3.07Å; N157-D161 PolarHBondContact ND2-OD2 2.78Å; N157-D161 VanDerWaalsContact ND2-OD2 3.13Å; N157-D161 WeakPolarHBondContact O-CB 3.37Å; N157-D161 PolarHBondContact O-N 2.92Å
158L87.6Confident89.7Confident4 Ų460 Ų602%0.02129%0.287CS..Hα-helixtrans-58.5-30.5-172.7-174.168.9000113.4S154 K160 L164 M165 M168 P216 F300S154-L158 WeakPolarHBondContact O-CB 3.31Å; S154-L158 PolarHBondContact O-N 3.17Å; L158-K160 PolarHBondContact O-N 3.08Å; L158-L164 HydrophobicContact CD1-CB 4.26Å; L158-L164 HydrophobicContact CD1-CD2 3.79Å; L158-L164 HydrophobicContact CD1-CG 3.75Å; L158-M165 HydrophobicContact CD1-CE 3.88Å; L158-M165 HydrophobicContact CG-CE 3.86Å; L158-M165 WeakPolarHBondContact O-CE 3.2Å; L158-M168 HydrophobicContact CD1-CE 3.74Å; L158-M168 HydrophobicContact CD1-SD 4.41Å; L158-M168 HydrophobicContact CD2-CE 3.87Å; L158-M168 HydrophobicContact CG-CE 4.4Å; L158-P216 HydrophobicContact CD2-CB 4.45Å; L158-P216 HydrophobicContact CD2-CG 3.53Å; L158-F300 HydrophobicContact CD2-CE2 3.86Å; L158-F300 HydrophobicContact CD2-CZ 3.65Å; L158-F300 HydrophobicContact CG-CZ 3.89Å
159S81.8Confident89.6Confident49 Ų4960.2 Ų60.234%0.34329%0.29SS..THydrogen-bonded Turntrans-73-10.5174.853.30000115R155 N157R155-S159 VanDerWaalsContact O-CB 3.26Å; R155-S159 WeakPolarHBondContact O-CB 3.36Å; R155-S159 PolarHBondContact O-N 3.09Å; R155-S159 PolarHBondContact O-OG 2.74Å; N157-S159 PolarHBondContact O-N 3.33Å; N157-S159 VanDerWaalsContact O-N 3.08Å
160K88.7Confident89.3Confident146 Ų14665.1 Ų65.164%0.63533%0.325SS*.THydrogen-bonded Turntrans-115.3-31.7179.4-56.1169.5-166.71420112.2E156 N157 L158 L162E156-K160 VanDerWaalsContact O-CD 3.24Å; E156-K160 WeakPolarHBondContact O-CD 3.19Å; E156-K160 WeakPolarHBondContact O-CE 3.15Å; E156-K160 WeakPolarHBondContact O-CG 3.39Å; E156-K160 PolarHBondContact O-NZ 3.02Å; N157-K160 CarbonylContact O-C 3.59Å; N157-K160 WeakPolarHBondContact O-CA 3.41Å; N157-K160 PolarHBondContact O-N 3.07Å; L158-K160 PolarHBondContact O-N 3.08Å; K160-L162 PolarHBondContact O-N 2.91Å
161D90.4Very high88.9Confident30 Ų3068 Ų6816%0.1634%0.341CS..  trans-73.688.8-176.3-172.4-14.9000111.4N157 Y163 L164 M165N157-D161 PolarHBondContact ND2-OD2 2.78Å; N157-D161 VanDerWaalsContact ND2-OD2 3.13Å; N157-D161 WeakPolarHBondContact O-CB 3.37Å; N157-D161 PolarHBondContact O-N 2.92Å; D161-Y163 PolarHBondContact O-N 3.15Å; D161-Y163 WeakPolarHBondContact OD1-CA 3.33Å; D161-Y163 WeakPolarHBondContact OD1-CB 3.35Å; D161-Y163 PolarHBondContact OD1-N 2.87Å; D161-L164 HydrophobicContact CB-CB 4.19Å; D161-L164 VanDerWaalsContact CG-CB 3.47Å; D161-L164 PolarHBondContact O-N 2.89Å; D161-L164 PolarHBondContact OD1-N 2.9Å; D161-L164 WeakPolarHBondContact OD2-CB 3.11Å; D161-M165 VanDerWaalsContact O-CB 3.31Å; D161-M165 WeakPolarHBondContact O-CB 3.42Å; D161-M165 PolarHBondContact O-N 3.18Å
162L92.8Very high88.8Confident141 Ų14165.7 Ų65.774%0.73833%0.332SS*.Hα-helixtrans-64.1-23.8176.8-58.4-177.9000112.8K160 S166K160-L162 PolarHBondContact O-N 2.91Å; L162-S166 WeakPolarHBondContact O-CB 3.33Å; L162-S166 PolarHBondContact O-N 3.09Å; L162-S166 VanDerWaalsContact O-N 3.07Å
163Y94.6Very high88.9Confident114 Ų11465.2 Ų65.245%0.44733%0.33SS..Hα-helixtrans-71.4-57.4176.3174.1-107.1000109.4D161 M165 S166 Q167 T178D161-Y163 PolarHBondContact O-N 3.15Å; D161-Y163 WeakPolarHBondContact OD1-CA 3.33Å; D161-Y163 WeakPolarHBondContact OD1-CB 3.35Å; D161-Y163 PolarHBondContact OD1-N 2.87Å; Y163-M165 PolarHBondContact O-N 3.04Å; Y163-S166 WeakPolarHBondContact O-CA 3.3Å; Y163-S166 WeakPolarHBondContact O-CB 3.45Å; Y163-S166 PolarHBondContact O-N 3.21Å; Y163-S166 PolarHBondContact O-OG 2.84Å; Y163-Q167 HydrophobicContact CD2-CG 4.32Å; Y163-Q167 HydrophobicContact CE1-CG 4.18Å; Y163-Q167 HydrophobicContact CE2-CG 3.95Å; Y163-Q167 WeakPolarHBondContact O-CG 3.45Å; Y163-Q167 PolarHBondContact O-N 3.08Å; Y163-Q167 VanDerWaalsContact O-N 3.15Å; Y163-T178 HydrophobicContact CE1-CG2 4.14Å; Y163-T178 WeakPolarHBondContact OH-CG2 3.4Å
164L93.1Very high89.2Confident0 Ų064.9 Ų64.90%033%0.329CS..Hα-helixtrans-59.8-34.9178.7-170.352.6000111.9Y152 F153 L158 D161 S166 Q167 M168 V174 M182Y152-L164 WeakPolarHBondContact O-CD2 3.2Å; F153-L164 HydrophobicContact CD1-CD2 4.32Å; F153-L164 HydrophobicContact CE1-CD1 4.37Å; F153-L164 HydrophobicContact CE1-CD2 4.19Å; L158-L164 HydrophobicContact CD1-CB 4.26Å; L158-L164 HydrophobicContact CD1-CD2 3.79Å; L158-L164 HydrophobicContact CD1-CG 3.75Å; D161-L164 HydrophobicContact CB-CB 4.19Å; D161-L164 VanDerWaalsContact CG-CB 3.47Å; D161-L164 PolarHBondContact O-N 2.89Å; D161-L164 PolarHBondContact OD1-N 2.9Å; D161-L164 WeakPolarHBondContact OD2-CB 3.11Å; L164-S166 PolarHBondContact O-N 3.04Å; L164-Q167 PolarHBondContact O-N 3.25Å; L164-M168 PolarHBondContact O-N 3.08Å; L164-V174 HydrophobicContact CD1-CB 4.29Å; L164-V174 HydrophobicContact CD1-CG1 3.8Å; L164-V174 HydrophobicContact CD1-CG2 3.72Å; L164-M182 HydrophobicContact CD1-CE 3.67Å; L164-M182 HydrophobicContact CD2-CE 4.3Å; L164-M182 HydrophobicContact CG-CE 4.43Å
165M90.4Very high89.8Confident60 Ų6066.4 Ų66.430%0.29634%0.339SS..Hα-helixtrans-60.1-40.1170.5-160.458.542.600113.6L158 D161 Y163 Q167 F300L158-M165 HydrophobicContact CD1-CE 3.88Å; L158-M165 HydrophobicContact CG-CE 3.86Å; L158-M165 WeakPolarHBondContact O-CE 3.2Å; D161-M165 VanDerWaalsContact O-CB 3.31Å; D161-M165 WeakPolarHBondContact O-CB 3.42Å; D161-M165 PolarHBondContact O-N 3.18Å; Y163-M165 PolarHBondContact O-N 3.04Å; M165-Q167 VanDerWaalsContact C-N 3.28Å; M165-Q167 PolarHBondContact O-N 2.67Å; M165-F300 HydrophobicContact CE-CD1 4.07Å; M165-F300 HydrophobicContact CE-CE1 3.29Å; M165-F300 HydrophobicContact CE-CZ 3.72Å; M165-F300 HydrophobicContact SD-CD1 3.71Å; M165-F300 HydrophobicContact SD-CE1 3.58Å; M165-F300 VanDerWaalsContact SD-CE1 3.58Å; M165-F300 HydrophobicContact SD-CZ 4.34Å
166S92.6Very high90.4Very high77 Ų7759.7 Ų59.754%0.53831%0.314SS..Hα-helixtrans-73.6-19.7179.176.50000113.8L162 Y163 L164L162-S166 WeakPolarHBondContact O-CB 3.33Å; L162-S166 PolarHBondContact O-N 3.09Å; L162-S166 VanDerWaalsContact O-N 3.07Å; Y163-S166 WeakPolarHBondContact O-CA 3.3Å; Y163-S166 WeakPolarHBondContact O-CB 3.45Å; Y163-S166 PolarHBondContact O-N 3.21Å; Y163-S166 PolarHBondContact O-OG 2.84Å; L164-S166 PolarHBondContact O-N 3.04Å
167Q93.5Very high91Very high67 Ų6763 Ų6331%0.31332%0.321SS..THydrogen-bonded Turntrans-93.3-4.3-179.6-59.6-61.8-64.900112.8Y163 L164 M165 V174 T178Y163-Q167 HydrophobicContact CD2-CG 4.32Å; Y163-Q167 HydrophobicContact CE1-CG 4.18Å; Y163-Q167 HydrophobicContact CE2-CG 3.95Å; Y163-Q167 WeakPolarHBondContact O-CG 3.45Å; Y163-Q167 PolarHBondContact O-N 3.08Å; Y163-Q167 VanDerWaalsContact O-N 3.15Å; L164-Q167 PolarHBondContact O-N 3.25Å; M165-Q167 VanDerWaalsContact C-N 3.28Å; M165-Q167 PolarHBondContact O-N 2.67Å; Q167-V174 HydrophobicContact CB-CG1 4.05Å; Q167-T178 HydrophobicContact CB-CG2 4.03Å; Q167-T178 HydrophobicContact CG-CG2 3.7Å
168M92.9Very high91.3Very high28 Ų2862.5 Ų62.514%0.13832%0.319CS..  trans-77.7134.7172.8-79.9-172.6164.100112.3L158 L164 Q172 F173 V174 P216L158-M168 HydrophobicContact CD1-CE 3.74Å; L158-M168 HydrophobicContact CD1-SD 4.41Å; L158-M168 HydrophobicContact CD2-CE 3.87Å; L158-M168 HydrophobicContact CG-CE 4.4Å; L164-M168 PolarHBondContact O-N 3.08Å; M168-Q172 HydrophobicContact CE-CB 4.23Å; M168-Q172 WeakPolarHBondContact CE-O 3.3Å; M168-Q172 HydrophobicContact SD-CB 3.9Å; M168-Q172 HydrophobicContact SD-CG 4.08Å; M168-F173 WeakPolarHBondContact CA-O 3.24Å; M168-V174 HydrophobicContact CB-CG2 4.47Å; M168-V174 HydrophobicContact CE-CG2 4.3Å; M168-V174 HydrophobicContact CG-CG2 3.55Å; M168-P216 VanDerWaalsContact CE-CD 3.46Å; M168-P216 HydrophobicContact CE-CG 3.65Å
169D91.2Very high91.6Very high53 Ų5362.3 Ų62.328%0.28332%0.318SS..  trans-81.8-173.4167.468.823.9000113.3D171 Q172 F173 K213D169-D171 PolarHBondContact O-N 3.08Å; D169-D171 VanDerWaalsContact O-N 3.14Å; D169-D171 PolarHBondContact OD1-N 3.01Å; D169-Q172 PolarHBondContact O-N 3.41Å; D169-Q172 VanDerWaalsContact O-N 3.1Å; D169-Q172 PolarHBondContact OD1-N 2.98Å; D169-F173 PolarHBondContact N-O 3.49Å; D169-F173 PolarHBondContact OD1-N 2.83Å; D169-K213 IonicContact OD2-NZ 3.07Å; D169-K213 PolarHBondContact OD2-NZ 3.07Å
170S86.4Confident92.2Very high106 Ų10660.4 Ų60.474%0.74131%0.305SS*.THydrogen-bonded Turntrans-55.5-29-17945.60000114.4
171D84Confident92.4Very high94 Ų9456.6 Ų56.650%0.50330%0.297SS..THydrogen-bonded Turntrans-107.715.5-174.1-62.5-78.4000111.8D169 F173 R215D169-D171 PolarHBondContact O-N 3.08Å; D169-D171 VanDerWaalsContact O-N 3.14Å; D169-D171 PolarHBondContact OD1-N 3.01Å; D171-F173 VanDerWaalsContact C-N 3.25Å; D171-F173 HydrophobicContact CB-CD2 3.98Å; D171-F173 HydrophobicContact CB-CE2 4.34Å; D171-F173 PolarHBondContact O-N 3.14Å; D171-R215 WeakPolarHBondContact O-CD 3.19Å; D171-R215 PolarHBondContact O-NH1 3.36Å
172Q88.6Confident92.6Very high51 Ų5156 Ų5624%0.23829%0.293CS..SBendtrans65.321.8176.9-64.8159.216.500114.1M168 D169 R215 H218 F300M168-Q172 HydrophobicContact CE-CB 4.23Å; M168-Q172 WeakPolarHBondContact CE-O 3.3Å; M168-Q172 HydrophobicContact SD-CB 3.9Å; M168-Q172 HydrophobicContact SD-CG 4.08Å; D169-Q172 PolarHBondContact O-N 3.41Å; D169-Q172 VanDerWaalsContact O-N 3.1Å; D169-Q172 PolarHBondContact OD1-N 2.98Å; Q172-R215 WeakPolarHBondContact O-CB 3.48Å; Q172-H218 PolarHBondContact OE1-CE1 3.12Å; Q172-H218 PolarHBondContact OE1-ND1 3.24Å; Q172-H218 PolarHBondContact OE1-NE2 3.46Å; Q172-F300 HydrophobicContact CG-CD2 4.48Å
173F93.3Very high92.6Very high25 Ų2555 Ų5511%0.1129%0.285CS..  trans-83.8141.7172.2-74.6-82000111.8M168 D169 D171 D208 K213 V214 R215M168-F173 WeakPolarHBondContact CA-O 3.24Å; D169-F173 PolarHBondContact N-O 3.49Å; D169-F173 PolarHBondContact OD1-N 2.83Å; D171-F173 VanDerWaalsContact C-N 3.25Å; D171-F173 HydrophobicContact CB-CD2 3.98Å; D171-F173 HydrophobicContact CB-CE2 4.34Å; D171-F173 PolarHBondContact O-N 3.14Å; F173-D208 HydrophobicContact CD1-CB 4.48Å; F173-D208 HydrophobicContact CE1-CB 4.01Å; F173-K213 HydrophobicContact CB-CB 4.08Å; F173-K213 HydrophobicContact CB-CD 3.93Å; F173-K213 HydrophobicContact CB-CG 4.47Å; F173-K213 HydrophobicContact CD1-CB 3.92Å; F173-K213 HydrophobicContact CG-CB 4.3Å; F173-K213 HydrophobicContact CG-CD 4.48Å; F173-V214 WeakPolarHBondContact CA-O 3.44Å; F173-R215 HydrophobicContact CD1-CB 3.83Å; F173-R215 HydrophobicContact CD1-CG 3.89Å; F173-R215 HydrophobicContact CE1-CB 4.19Å; F173-R215 HydrophobicContact CE1-CG 3.72Å; F173-R215 VanDerWaalsContact CE2-NH1 3.3Å; F173-R215 HydrophobicContact CG-CB 4.11Å; F173-R215 HydrophobicContact CG-CG 4.37Å; F173-R215 HydrophobicContact CZ-CG 4.06Å
174V95.5Very high92.4Very high0 Ų050.7 Ų50.70%028%0.275CS..EExtended strand (participates in β ladder)trans-116.4137.2174.8-177.90000107.7F153 L164 Q167 M168 T178 I179 K213 V214F153-V174 HydrophobicContact CE1-CG2 4.35Å; L164-V174 HydrophobicContact CD1-CB 4.29Å; L164-V174 HydrophobicContact CD1-CG1 3.8Å; L164-V174 HydrophobicContact CD1-CG2 3.72Å; Q167-V174 HydrophobicContact CB-CG1 4.05Å; M168-V174 HydrophobicContact CB-CG2 4.47Å; M168-V174 HydrophobicContact CE-CG2 4.3Å; M168-V174 HydrophobicContact CG-CG2 3.55Å; V174-T178 HydrophobicContact CG1-CG2 4.26Å; V174-I179 HydrophobicContact CB-CD1 4.19Å; V174-I179 HydrophobicContact CG1-CD1 4Å; V174-I179 HydrophobicContact CG1-CG1 3.92Å; V174-K213 WeakPolarHBondContact O-CA 3.47Å; V174-V214 PolarHBondContact N-O 3.02Å; V174-V214 PolarHBondContact O-N 3.48Å
175P95.8Very high92.5Very high48 Ų4850.7 Ų50.731%0.31228%0.275SS..EExtended strand (participates in β ladder)trans-62.4137.9174.5-20.132.4000111.7W177 T178P175-W177 VanDerWaalsContact C-N 3.26Å; P175-W177 PolarHBondContact O-N 2.9Å; P175-T178 VanDerWaalsContact O-CB 3.29Å; P175-T178 WeakPolarHBondContact O-CB 3.48Å; P175-T178 PolarHBondContact O-N 3.06Å
176I95.1Very high92.7Very high8 Ų852.6 Ų52.64%0.04128%0.282CS..Hα-helixtrans-69.1-27.6-176.7-69.1173.2000112.2T178 I179 A180 I195 L196 L199 V207 E212 V214I176-T178 VanDerWaalsContact C-N 3.31Å; I176-T178 PolarHBondContact O-N 2.8Å; I176-I179 HydrophobicContact CG1-CD1 4.43Å; I176-I179 WeakPolarHBondContact O-CB 3.35Å; I176-I179 PolarHBondContact O-N 3.08Å; I176-I179 VanDerWaalsContact O-N 3.12Å; I176-A180 PolarHBondContact O-N 2.89Å; I176-I195 HydrophobicContact CG2-CG2 4.01Å; I176-L196 HydrophobicContact CD1-CD2 3.44Å; I176-L196 VanDerWaalsContact CD1-CD2 3.44Å; I176-L196 HydrophobicContact CG2-CD2 4.3Å; I176-L199 HydrophobicContact CD1-CD1 3.87Å; I176-L199 HydrophobicContact CG1-CD1 4.04Å; I176-L199 HydrophobicContact CG2-CD1 4.21Å; I176-V207 HydrophobicContact CD1-CG1 4.11Å; I176-E212 PolarHBondContact N-O 2.95Å; I176-V214 HydrophobicContact CD1-CB 4.05Å; I176-V214 HydrophobicContact CD1-CG1 4.25Å; I176-V214 HydrophobicContact CG1-CB 4.05Å; I176-V214 HydrophobicContact CG1-CG1 3.73Å
177W94.6Very high92.7Very high197 Ų19754.2 Ų54.275%0.74629%0.288SS*.Hα-helixtrans-54.3-43.3167.1179.7-91.4000113.4P175 I179 A180 S181P175-W177 VanDerWaalsContact C-N 3.26Å; P175-W177 PolarHBondContact O-N 2.9Å; W177-I179 PolarHBondContact O-N 2.95Å; W177-A180 PolarHBondContact O-N 2.77Å; W177-S181 WeakPolarHBondContact O-CB 3.35Å; W177-S181 PolarHBondContact O-N 3.2Å
178T94.7Very high92.7Very high14 Ų1453.7 Ų53.79%0.08629%0.287CS..Hα-helixtrans-63-31.9179.2-56.10000111.8Y163 Q167 V174 P175 I176Y163-T178 HydrophobicContact CE1-CG2 4.14Å; Y163-T178 WeakPolarHBondContact OH-CG2 3.4Å; Q167-T178 HydrophobicContact CB-CG2 4.03Å; Q167-T178 HydrophobicContact CG-CG2 3.7Å; V174-T178 HydrophobicContact CG1-CG2 4.26Å; P175-T178 VanDerWaalsContact O-CB 3.29Å; P175-T178 WeakPolarHBondContact O-CB 3.48Å; P175-T178 PolarHBondContact O-N 3.06Å; I176-T178 VanDerWaalsContact C-N 3.31Å; I176-T178 PolarHBondContact O-N 2.8Å
179I93.9Very high92.7Very high0 Ų053.3 Ų53.30%029%0.286CS..Hα-helixtrans-81.6-43.8-178-62.7160.2000110.3L149 F153 V174 I176 W177 S181 M182 I185 V214L149-I179 HydrophobicContact CD2-CG2 3.59Å; F153-I179 HydrophobicContact CE2-CD1 3.81Å; F153-I179 HydrophobicContact CE2-CG1 4.48Å; F153-I179 HydrophobicContact CZ-CD1 3.49Å; F153-I179 VanDerWaalsContact CZ-CD1 3.49Å; F153-I179 HydrophobicContact CZ-CG1 4.19Å; V174-I179 HydrophobicContact CB-CD1 4.19Å; V174-I179 HydrophobicContact CG1-CD1 4Å; V174-I179 HydrophobicContact CG1-CG1 3.92Å; I176-I179 HydrophobicContact CG1-CD1 4.43Å; I176-I179 WeakPolarHBondContact O-CB 3.35Å; I176-I179 PolarHBondContact O-N 3.08Å; I176-I179 VanDerWaalsContact O-N 3.12Å; W177-I179 PolarHBondContact O-N 2.95Å; I179-S181 PolarHBondContact O-N 3.43Å; I179-M182 HydrophobicContact CG1-CE 4.18Å; I179-M182 HydrophobicContact CG2-SD 4.3Å; I179-M182 VanDerWaalsContact O-CB 3.27Å; I179-M182 WeakPolarHBondContact O-CB 3.31Å; I179-M182 WeakPolarHBondContact O-CG 3.44Å; I179-M182 PolarHBondContact O-N 3.16Å; I179-I185 HydrophobicContact CG2-CD1 3.54Å; I179-I185 WeakPolarHBondContact O-CD1 3.24Å; I179-V214 HydrophobicContact CD1-CG1 3.15Å
180A94.3Very high92.9Very high9 Ų956.2 Ų56.27%0.07431%0.306CS..Hα-helixtrans-64.2-22172.700000112.9I176 W177 M182 M192 I195I176-A180 PolarHBondContact O-N 2.89Å; W177-A180 PolarHBondContact O-N 2.77Å; A180-M182 VanDerWaalsContact C-N 3.35Å; A180-M192 HydrophobicContact CB-CE 3.52Å; A180-M192 HydrophobicContact CB-SD 3.69Å; A180-I195 HydrophobicContact CB-CD1 3.52Å
181S93.4Very high93.2Very high67 Ų6754.7 Ų54.747%0.46929%0.29SS..THydrogen-bonded Turntrans-82.5-2.3172-1710000114.5W177 I179W177-S181 WeakPolarHBondContact O-CB 3.35Å; W177-S181 PolarHBondContact O-N 3.2Å; I179-S181 PolarHBondContact O-N 3.43Å
182M93.6Very high93.7Very high16 Ų1653.4 Ų53.48%0.07928%0.282CS..SBendtrans-74.6138.7174.5-64172.5173.700110.5Y152 L164 I179 A180 G184 I185 K186Y152-M182 HydrophobicContact CD1-CE 4.32Å; Y152-M182 HydrophobicContact CD1-SD 3.68Å; Y152-M182 HydrophobicContact CD2-SD 3.76Å; Y152-M182 HydrophobicContact CE1-SD 3.85Å; Y152-M182 HydrophobicContact CE2-CB 4.43Å; Y152-M182 HydrophobicContact CE2-SD 3.9Å; Y152-M182 HydrophobicContact CG-CE 4.49Å; Y152-M182 HydrophobicContact CG-SD 3.68Å; L164-M182 HydrophobicContact CD1-CE 3.67Å; L164-M182 HydrophobicContact CD2-CE 4.3Å; L164-M182 HydrophobicContact CG-CE 4.43Å; I179-M182 HydrophobicContact CG1-CE 4.18Å; I179-M182 HydrophobicContact CG2-SD 4.3Å; I179-M182 VanDerWaalsContact O-CB 3.27Å; I179-M182 WeakPolarHBondContact O-CB 3.31Å; I179-M182 WeakPolarHBondContact O-CG 3.44Å; I179-M182 PolarHBondContact O-N 3.16Å; A180-M182 VanDerWaalsContact C-N 3.35Å; M182-G184 PolarHBondContact O-N 3.43Å; M182-I185 HydrophobicContact CB-CD1 4.28Å; M182-I185 PolarHBondContact O-N 3.5Å; M182-I185 VanDerWaalsContact O-N 3.17Å; M182-I185 HydrophobicContact SD-CD1 4.01Å; M182-K186 VanDerWaalsContact O-CB 3.26Å; M182-K186 WeakPolarHBondContact O-CB 3.26Å; M182-K186 PolarHBondContact O-N 3.28Å
183E92.6Very high93.9Very high121 Ų12157.9 Ų57.957%0.56530%0.303SS*.Hα-helixtrans-61.9-42.2-170.1-16263.6-171.800113.1I185 K186 V187E183-I185 VanDerWaalsContact C-N 3.31Å; E183-I185 PolarHBondContact O-N 2.82Å; E183-K186 PolarHBondContact O-N 3.27Å; E183-K186 IonicContact OE1-NZ 2.67Å; E183-K186 IonicContact OE2-NZ 2.67Å; E183-K186 PolarHBondContact OE2-NZ 3.12Å; E183-V187 HydrophobicContact CG-CG2 4.46Å; E183-V187 WeakPolarHBondContact O-CB 3.23Å; E183-V187 VanDerWaalsContact O-CG2 3.24Å; E183-V187 WeakPolarHBondContact O-CG2 3.35Å; E183-V187 PolarHBondContact O-N 2.67Å
184G90.8Very high93.9Very high24 Ų2457.9 Ų57.925%0.24730%0.304CS..Hα-helixtrans-64.2-32.1178.600000114.2E148 M182 L188E148-G184 WeakPolarHBondContact OE1-CA 3.38Å; M182-G184 PolarHBondContact O-N 3.43Å; G184-L188 WeakPolarHBondContact O-CG 3.47Å
185I94.6Very high93.9Very high0 Ų057.9 Ų57.90%030%0.304CS..Hα-helixtrans-78.9-44.1175.1-71.9157.8000110.8L145 E148 L149 Y152 I179 M182 E183 V187 L188 T189 I195L145-I185 HydrophobicContact CD1-CG1 4.26Å; L145-I185 HydrophobicContact CD1-CG2 3.93Å; E148-I185 HydrophobicContact CG-CG1 3.89Å; L149-I185 HydrophobicContact CD2-CD1 3.46Å; L149-I185 VanDerWaalsContact CD2-CD1 3.46Å; L149-I185 HydrophobicContact CD2-CG1 4.15Å; L149-I185 HydrophobicContact CG-CD1 4.24Å; Y152-I185 HydrophobicContact CD2-CD1 3.64Å; Y152-I185 HydrophobicContact CD2-CG1 4.31Å; Y152-I185 HydrophobicContact CE2-CD1 3.67Å; Y152-I185 HydrophobicContact CE2-CG1 3.95Å; I179-I185 HydrophobicContact CG2-CD1 3.54Å; I179-I185 WeakPolarHBondContact O-CD1 3.24Å; M182-I185 HydrophobicContact CB-CD1 4.28Å; M182-I185 PolarHBondContact O-N 3.5Å; M182-I185 VanDerWaalsContact O-N 3.17Å; M182-I185 HydrophobicContact SD-CD1 4.01Å; E183-I185 VanDerWaalsContact C-N 3.31Å; E183-I185 PolarHBondContact O-N 2.82Å; I185-V187 VanDerWaalsContact C-N 3.26Å; I185-V187 PolarHBondContact O-N 2.57Å; I185-L188 WeakPolarHBondContact O-CA 3.47Å; I185-L188 WeakPolarHBondContact O-CB 3.42Å; I185-L188 PolarHBondContact O-N 3.22Å; I185-T189 PolarHBondContact O-N 2.89Å; I185-I195 HydrophobicContact CG2-CD1 3.7Å; I185-I195 HydrophobicContact CG2-CG1 4.27Å
186K94.4Very high93.9Very high99 Ų9957.2 Ų57.243%0.4330%0.297SS..Hα-helixtrans-63.9-27.7179.8178.5170.7143.4-111.10113.5M182 E183 T189M182-K186 VanDerWaalsContact O-CB 3.26Å; M182-K186 WeakPolarHBondContact O-CB 3.26Å; M182-K186 PolarHBondContact O-N 3.28Å; E183-K186 PolarHBondContact O-N 3.27Å; E183-K186 IonicContact OE1-NZ 2.67Å; E183-K186 IonicContact OE2-NZ 2.67Å; E183-K186 PolarHBondContact OE2-NZ 3.12Å; K186-T189 WeakPolarHBondContact CA-O 3.04Å
187V94.4Very high93.8Very high111 Ų11160.6 Ų60.667%0.67332%0.315SS*.Hα-helixtrans-72.7-27.5171.2166.10000112.1E183 I185E183-V187 HydrophobicContact CG-CG2 4.46Å; E183-V187 WeakPolarHBondContact O-CB 3.23Å; E183-V187 VanDerWaalsContact O-CG2 3.24Å; E183-V187 WeakPolarHBondContact O-CG2 3.35Å; E183-V187 PolarHBondContact O-N 2.67Å; I185-V187 VanDerWaalsContact C-N 3.26Å; I185-V187 PolarHBondContact O-N 2.57Å
188L92.9Very high93.8Very high57 Ų5751.6 Ų51.630%0.29828%0.282SS..Hα-helixtrans-86.5-45.5176.9-65.5171.4000112.1L141 L145 E148 G184 I185L141-L188 HydrophobicContact CD1-CB 4.11Å; L141-L188 HydrophobicContact CD1-CD2 4.31Å; L141-L188 WeakPolarHBondContact CD1-O 3.38Å; L145-L188 HydrophobicContact CB-CD1 4.44Å; E148-L188 HydrophobicContact CB-CD1 4.1Å; E148-L188 HydrophobicContact CG-CD1 4.33Å; G184-L188 WeakPolarHBondContact O-CG 3.47Å; I185-L188 WeakPolarHBondContact O-CA 3.47Å; I185-L188 WeakPolarHBondContact O-CB 3.42Å; I185-L188 PolarHBondContact O-N 3.22Å
189T93.4Very high93.7Very high19 Ų1951 Ų5112%0.11728%0.278CS..  trans-154.4153.5178.3-170.60000112.9L145 I185 K186 D191 L194 I195L145-T189 HydrophobicContact CD1-CG2 4.17Å; L145-T189 HydrophobicContact CD2-CG2 3.71Å; I185-T189 PolarHBondContact O-N 2.89Å; K186-T189 WeakPolarHBondContact CA-O 3.04Å; T189-D191 PolarHBondContact OG1-N 3.43Å; T189-L194 HydrophobicContact CG2-CD2 4.24Å; T189-I195 HydrophobicContact CG2-CD1 3.93Å; T189-I195 HydrophobicContact CG2-CG1 3.7Å
190T94.1Very high93.6Very high114 Ų11458 Ų5870%0.69931%0.305SS*.  trans-107.9-1.5167.551.60000113M192T190-M192 WeakPolarHBondContact O-CE 3.36Å
191D94.2Very high93.4Very high74 Ų7460.9 Ų60.940%0.39633%0.325SS..  trans-81.1123.9179.2176.527000112.1T189 E193 L194 I195T189-D191 PolarHBondContact OG1-N 3.43Å; D191-E193 PolarHBondContact OD1-N 3.28Å; D191-L194 HydrophobicContact CB-CB 4.1Å; D191-L194 WeakPolarHBondContact OD2-CB 3.32Å; D191-L194 PolarHBondContact OD2-N 2.88Å; D191-I195 WeakPolarHBondContact O-CD1 3.48Å; D191-I195 VanDerWaalsContact O-CG1 3.28Å; D191-I195 WeakPolarHBondContact O-CG1 3.45Å; D191-I195 PolarHBondContact O-N 3.07Å
192M93.3Very high93.1Very high68 Ų6858 Ų5834%0.33531%0.305SS..Hα-helixtrans-72.3-33.4176.7-56.1-63.2113.800112.1A180 T190 I195 L196A180-M192 HydrophobicContact CB-CE 3.52Å; A180-M192 HydrophobicContact CB-SD 3.69Å; T190-M192 WeakPolarHBondContact O-CE 3.36Å; M192-I195 PolarHBondContact O-N 2.93Å; M192-L196 WeakPolarHBondContact O-CB 3.33Å; M192-L196 WeakPolarHBondContact O-CD1 3.37Å; M192-L196 VanDerWaalsContact O-CG 3.24Å; M192-L196 WeakPolarHBondContact O-CG 3.42Å; M192-L196 PolarHBondContact O-N 2.96Å
193E93.1Very high92.4Very high145 Ų14559.2 Ų59.268%0.67831%0.313SS*.Hα-helixtrans-71.6-44.4-176.6-62.9-166.8171.800110.7D191 I195 L196 D197D191-E193 PolarHBondContact OD1-N 3.28Å; E193-I195 VanDerWaalsContact C-N 3.32Å; E193-I195 PolarHBondContact O-N 3Å; E193-L196 WeakPolarHBondContact O-CB 3.23Å; E193-L196 PolarHBondContact O-N 2.83Å; E193-L196 VanDerWaalsContact O-N 3.14Å; E193-D197 PolarHBondContact O-N 3.24Å
194L94.1Very high91.7Very high25 Ų2557.6 Ų57.613%0.13131%0.307CS..Hα-helixtrans-56.7-42170.3-175.363.6000112.9L141 R142 L145 T189 D191 V198L141-L194 HydrophobicContact CD2-CD2 4.39Å; R142-L194 HydrophobicContact CG-CD1 3.68Å; L145-L194 HydrophobicContact CD2-CD2 4.17Å; L145-L194 HydrophobicContact CD2-CG 3.92Å; T189-L194 HydrophobicContact CG2-CD2 4.24Å; D191-L194 HydrophobicContact CB-CB 4.1Å; D191-L194 WeakPolarHBondContact OD2-CB 3.32Å; D191-L194 PolarHBondContact OD2-N 2.88Å; L194-V198 HydrophobicContact CD1-CG2 4.45Å; L194-V198 WeakPolarHBondContact O-CB 3.49Å; L194-V198 WeakPolarHBondContact O-CG2 3.47Å; L194-V198 PolarHBondContact O-N 2.81Å
195I94.8Very high91.6Very high0 Ų057 Ų570%030%0.298CS..Hα-helixtrans-64.4-43175.7-68.9168.2000110.5L145 I176 A180 I185 T189 D191 M192 E193 V198 L199L145-I195 HydrophobicContact CD1-CG1 4.38Å; L145-I195 HydrophobicContact CD2-CG1 4.15Å; I176-I195 HydrophobicContact CG2-CG2 4.01Å; A180-I195 HydrophobicContact CB-CD1 3.52Å; I185-I195 HydrophobicContact CG2-CD1 3.7Å; I185-I195 HydrophobicContact CG2-CG1 4.27Å; T189-I195 HydrophobicContact CG2-CD1 3.93Å; T189-I195 HydrophobicContact CG2-CG1 3.7Å; D191-I195 WeakPolarHBondContact O-CD1 3.48Å; D191-I195 VanDerWaalsContact O-CG1 3.28Å; D191-I195 WeakPolarHBondContact O-CG1 3.45Å; D191-I195 PolarHBondContact O-N 3.07Å; M192-I195 PolarHBondContact O-N 2.93Å; E193-I195 VanDerWaalsContact C-N 3.32Å; E193-I195 PolarHBondContact O-N 3Å; I195-V198 PolarHBondContact O-N 3.27Å; I195-L199 HydrophobicContact CG2-CD1 3.85Å; I195-L199 HydrophobicContact CG2-CG 4.32Å; I195-L199 VanDerWaalsContact O-CB 3.3Å; I195-L199 WeakPolarHBondContact O-CB 3.4Å; I195-L199 VanDerWaalsContact O-CG 3.24Å; I195-L199 WeakPolarHBondContact O-CG 3.25Å; I195-L199 PolarHBondContact O-N 3.1Å
196L94.8Very high91.3Very high33 Ų3360.7 Ų60.717%0.17332%0.315CS..Hα-helixtrans-64-44.1178.6-77164.9000112.8I176 M192 E193 L199 R200 G211I176-L196 HydrophobicContact CD1-CD2 3.44Å; I176-L196 VanDerWaalsContact CD1-CD2 3.44Å; I176-L196 HydrophobicContact CG2-CD2 4.3Å; M192-L196 WeakPolarHBondContact O-CB 3.33Å; M192-L196 WeakPolarHBondContact O-CD1 3.37Å; M192-L196 VanDerWaalsContact O-CG 3.24Å; M192-L196 WeakPolarHBondContact O-CG 3.42Å; M192-L196 PolarHBondContact O-N 2.96Å; E193-L196 WeakPolarHBondContact O-CB 3.23Å; E193-L196 PolarHBondContact O-N 2.83Å; E193-L196 VanDerWaalsContact O-N 3.14Å; L196-L199 PolarHBondContact O-N 2.93Å; L196-R200 WeakPolarHBondContact O-CB 3.31Å; L196-R200 VanDerWaalsContact O-CG 3.26Å; L196-R200 WeakPolarHBondContact O-CG 2.95Å; L196-R200 PolarHBondContact O-N 2.9Å; L196-G211 WeakPolarHBondContact CD2-O 3.35Å
197D94.1Very high91.2Very high80 Ų8057 Ų5743%0.42830%0.302SS..Hα-helixtrans-63.7-46.1176.6-91.75.9000111.6R142 E193 R200 S201R142-D197 IonicContact NH2-OD2 3.69Å; E193-D197 PolarHBondContact O-N 3.24Å; D197-R200 PolarHBondContact O-N 3.21Å; D197-S201 WeakPolarHBondContact O-CB 3.49Å; D197-S201 PolarHBondContact O-N 2.98Å
198V94.7Very high91.1Very high7 Ų753.9 Ų53.94%0.04228%0.281CS..Hα-helixtrans-64.8-42.8178.11730000110.9R142 L145 K146 L149 L194 I195 R200 S201 S202R142-V198 HydrophobicContact CB-CG2 4.47Å; R142-V198 HydrophobicContact CG-CG2 4.23Å; L145-V198 HydrophobicContact CD2-CB 4.41Å; L145-V198 HydrophobicContact CD2-CG2 4.15Å; L145-V198 HydrophobicContact CG-CG1 4.39Å; K146-V198 HydrophobicContact CB-CG1 3.64Å; K146-V198 HydrophobicContact CG-CG1 4.21Å; L149-V198 HydrophobicContact CD1-CB 4.25Å; L149-V198 HydrophobicContact CD1-CG1 3.73Å; L194-V198 HydrophobicContact CD1-CG2 4.45Å; L194-V198 WeakPolarHBondContact O-CB 3.49Å; L194-V198 WeakPolarHBondContact O-CG2 3.47Å; L194-V198 PolarHBondContact O-N 2.81Å; I195-V198 PolarHBondContact O-N 3.27Å; V198-R200 PolarHBondContact O-N 3.46Å; V198-S201 PolarHBondContact O-N 2.84Å; V198-S201 VanDerWaalsContact O-N 3.17Å; V198-S201 PolarHBondContact O-OG 2.89Å; V198-S202 PolarHBondContact O-N 3.05Å; V198-S202 VanDerWaalsContact O-N 3.12Å
199L93.1Very high90.9Very high2 Ų260.4 Ų60.41%0.0131%0.31CS..Hα-helixtrans-61.4-39.9173.4-76.2175.1000112.6L149 F153 I176 I195 L196 S201 S202 V205 V207 V214L149-L199 HydrophobicContact CB-CD2 4.23Å; L149-L199 HydrophobicContact CD1-CD2 4.07Å; L149-L199 HydrophobicContact CD1-CG 4.1Å; L149-L199 HydrophobicContact CD2-CD2 3.93Å; L149-L199 HydrophobicContact CD2-CG 4.34Å; L149-L199 HydrophobicContact CG-CD2 4.31Å; F153-L199 HydrophobicContact CE2-CD2 4.49Å; I176-L199 HydrophobicContact CD1-CD1 3.87Å; I176-L199 HydrophobicContact CG1-CD1 4.04Å; I176-L199 HydrophobicContact CG2-CD1 4.21Å; I195-L199 HydrophobicContact CG2-CD1 3.85Å; I195-L199 HydrophobicContact CG2-CG 4.32Å; I195-L199 VanDerWaalsContact O-CB 3.3Å; I195-L199 WeakPolarHBondContact O-CB 3.4Å; I195-L199 VanDerWaalsContact O-CG 3.24Å; I195-L199 WeakPolarHBondContact O-CG 3.25Å; I195-L199 PolarHBondContact O-N 3.1Å; L196-L199 PolarHBondContact O-N 2.93Å; L199-S201 VanDerWaalsContact C-N 3.31Å; L199-S201 PolarHBondContact O-N 3.49Å; L199-S202 PolarHBondContact O-N 2.8Å; L199-V205 HydrophobicContact CD2-CG2 4.04Å; L199-V205 WeakPolarHBondContact O-CG2 3.45Å; L199-V207 HydrophobicContact CB-CG2 3.65Å; L199-V214 HydrophobicContact CD1-CB 4.3Å; L199-V214 HydrophobicContact CD1-CG1 4Å; L199-V214 HydrophobicContact CD1-CG2 4.44Å; L199-V214 HydrophobicContact CD2-CG2 4.19Å
200R90.9Very high90.7Very high147 Ų14766.1 Ų66.156%0.55533%0.333SS*.Hα-helixtrans-67.7-29.4174.7-77.4170.9169.9165.6-2.5112.8L196 D197 V198 V207L196-R200 WeakPolarHBondContact O-CB 3.31Å; L196-R200 VanDerWaalsContact O-CG 3.26Å; L196-R200 WeakPolarHBondContact O-CG 2.95Å; L196-R200 PolarHBondContact O-N 2.9Å; D197-R200 PolarHBondContact O-N 3.21Å; V198-R200 PolarHBondContact O-N 3.46Å; R200-V207 HydrophobicContact CG-CB 4.3Å; R200-V207 HydrophobicContact CG-CG1 4.49Å; R200-V207 HydrophobicContact CG-CG2 4.1Å
201S89.3Confident90.5Very high70 Ų7061.2 Ų61.249%0.4931%0.305SS..Hα-helixtrans-78.8-21.2177.781.30000114.2D197 V198 L199D197-S201 WeakPolarHBondContact O-CB 3.49Å; D197-S201 PolarHBondContact O-N 2.98Å; V198-S201 PolarHBondContact O-N 2.84Å; V198-S201 VanDerWaalsContact O-N 3.17Å; V198-S201 PolarHBondContact O-OG 2.89Å; L199-S201 VanDerWaalsContact C-N 3.31Å; L199-S201 PolarHBondContact O-N 3.49Å
202S87.1Confident90.5Very high7 Ų762.9 Ų62.95%0.04931%0.31CS..  trans-82.8127.7-176172.50000111.8E150 V198 L199 M204E150-S202 WeakPolarHBondContact CG-OG 3.31Å; E150-S202 VanDerWaalsContact OE1-CB 3.29Å; E150-S202 WeakPolarHBondContact OE1-CB 3.26Å; E150-S202 PolarHBondContact OE1-OG 2.87Å; V198-S202 PolarHBondContact O-N 3.05Å; V198-S202 VanDerWaalsContact O-N 3.12Å; L199-S202 PolarHBondContact O-N 2.8Å; S202-M204 PolarHBondContact O-N 3.38Å; S202-M204 PolarHBondContact OG-N 2.86Å
203P80.6Confident90.5Very high40 Ų4063 Ų6326%0.2631%0.309SS..THydrogen-bonded Turntrans-71.9-13.2175.131.5-35.6000113N217P203-N217 WeakPolarHBondContact O-CB 3.36Å; P203-N217 PolarHBondContact O-ND2 3.41Å
204M77.2Confident90.5Very high88 Ų8856.1 Ų56.143%0.43328%0.277SS..THydrogen-bonded Turntrans-84.6-7.6-174.3-65.5-170.760.400113.9E150 S202 N217E150-M204 HydrophobicContact CB-SD 4.01Å; E150-M204 HydrophobicContact CG-CB 4.26Å; E150-M204 HydrophobicContact CG-CG 4.41Å; E150-M204 HydrophobicContact CG-SD 4.02Å; S202-M204 PolarHBondContact O-N 3.38Å; S202-M204 PolarHBondContact OG-N 2.86Å; M204-N217 VanDerWaalsContact C-CB 3.44Å; M204-N217 WeakPolarHBondContact O-CB 3.33Å; M204-N217 PolarHBondContact O-N 3.3Å
205V88Confident90.4Very high11 Ų1158 Ų587%0.06728%0.282CS..EExtended strand (participates in β ladder)trans-130.3162.8-178-720000111.7F153 L199 V214 R215F153-V205 HydrophobicContact CB-CG1 3.78Å; F153-V205 HydrophobicContact CD2-CG1 3.51Å; F153-V205 HydrophobicContact CE2-CG1 4.27Å; F153-V205 HydrophobicContact CG-CG1 3.69Å; L199-V205 HydrophobicContact CD2-CG2 4.04Å; L199-V205 WeakPolarHBondContact O-CG2 3.45Å; V205-V214 HydrophobicContact CB-CG2 3.71Å; V205-V214 HydrophobicContact CG1-CG2 4.19Å; V205-V214 HydrophobicContact CG2-CG2 4.28Å; V205-R215 CarbonylContact C-O 3.49Å; V205-R215 WeakPolarHBondContact CA-O 3.41Å
206Q89.1Confident90.1Very high77 Ų7758.5 Ų58.536%0.3629%0.285SS..EExtended strand (participates in β ladder)trans-127.1111.8169.1-176.8-176.313.400108.7V214 R215Q206-V214 WeakPolarHBondContact O-CA 3.43Å; Q206-V214 WeakPolarHBondContact O-CG2 3.43Å; Q206-R215 HydrophobicContact CB-CG 4.06Å; Q206-R215 PolarHBondContact N-O 3.48Å; Q206-R215 PolarHBondContact O-N 2.82Å
207V92.3Very high89.3Confident23 Ų2358.7 Ų58.714%0.13929%0.286CS..EExtended strand (participates in β ladder)trans-74.5144.8169.5-176.20000109.1I176 L199 R200 V214I176-V207 HydrophobicContact CD1-CG1 4.11Å; L199-V207 HydrophobicContact CB-CG2 3.65Å; R200-V207 HydrophobicContact CG-CB 4.3Å; R200-V207 HydrophobicContact CG-CG1 4.49Å; R200-V207 HydrophobicContact CG-CG2 4.1Å; V207-V214 HydrophobicContact CG2-CB 4.3Å; V207-V214 HydrophobicContact CG2-CG2 3.94Å
208D91.3Very high88.1Confident45 Ų4557.3 Ų57.324%0.24128%0.277CS..  trans-66.9156.6173.3179.346.5000111.9F173 K210 G211 K213F173-D208 HydrophobicContact CD1-CB 4.48Å; F173-D208 HydrophobicContact CE1-CB 4.01Å; D208-K210 PolarHBondContact O-N 3.32Å; D208-K210 VanDerWaalsContact O-N 3.09Å; D208-G211 PolarHBondContact O-N 3.05Å; D208-K213 HydrophobicContact CB-CB 3.98Å; D208-K213 WeakPolarHBondContact CB-O 3.4Å; D208-K213 PolarHBondContact N-O 2.89Å
209E89.3Confident86.7Confident193 Ų19360.9 Ų60.990%0.90229%0.292SS*.THydrogen-bonded Turntrans-56-32.3-177.6-65.7-177.8176.300112.4
210K89.4Confident85.5Confident140 Ų14066.8 Ų66.861%0.60931%0.314SS*.THydrogen-bonded Turntrans-81.6-18.4176.9-62-176.9167.5-165.90115.6D208 E212D208-K210 PolarHBondContact O-N 3.32Å; D208-K210 VanDerWaalsContact O-N 3.09Å; K210-E212 VanDerWaalsContact C-N 3.32Å; K210-E212 HydrophobicContact CB-CB 4.47Å; K210-E212 HydrophobicContact CB-CG 4Å; K210-E212 HydrophobicContact CD-CG 4.14Å; K210-E212 VanDerWaalsContact CD-OE1 3.29Å; K210-E212 WeakPolarHBondContact CD-OE1 3.29Å; K210-E212 WeakPolarHBondContact CD-OE2 3.36Å; K210-E212 IonicContact NZ-OE1 2.66Å; K210-E212 PolarHBondContact NZ-OE1 3.1Å; K210-E212 IonicContact NZ-OE2 3.63Å; K210-E212 PolarHBondContact NZ-OE2 3.48Å
211G90.2Very high85.2Confident10 Ų1061 Ų6110%0.10330%0.296CS..SBendtrans73.813.6-167.500000115.4L196 D208L196-G211 WeakPolarHBondContact CD2-O 3.35Å; D208-G211 PolarHBondContact O-N 3.05Å
212E93.4Very high85.2Confident110 Ų11059.4 Ų59.451%0.51428%0.282SS..SBendtrans-81-24.5176.8-68.6171.8-175.300112.6I176 K210I176-E212 PolarHBondContact N-O 2.95Å; K210-E212 VanDerWaalsContact C-N 3.32Å; K210-E212 HydrophobicContact CB-CB 4.47Å; K210-E212 HydrophobicContact CB-CG 4Å; K210-E212 HydrophobicContact CD-CG 4.14Å; K210-E212 VanDerWaalsContact CD-OE1 3.29Å; K210-E212 WeakPolarHBondContact CD-OE1 3.29Å; K210-E212 WeakPolarHBondContact CD-OE2 3.36Å; K210-E212 IonicContact NZ-OE1 2.66Å; K210-E212 PolarHBondContact NZ-OE1 3.1Å; K210-E212 IonicContact NZ-OE2 3.63Å; K210-E212 PolarHBondContact NZ-OE2 3.48Å
213K94.1Very high85.4Confident71 Ų7159 Ų5931%0.30928%0.279SS..EExtended strand (participates in β ladder)trans-142.8157.4-166.1-72.4179.8169.9-1670112.2D169 F173 V174 D208D169-K213 IonicContact OD2-NZ 3.07Å; D169-K213 PolarHBondContact OD2-NZ 3.07Å; F173-K213 HydrophobicContact CB-CB 4.08Å; F173-K213 HydrophobicContact CB-CD 3.93Å; F173-K213 HydrophobicContact CB-CG 4.47Å; F173-K213 HydrophobicContact CD1-CB 3.92Å; F173-K213 HydrophobicContact CG-CB 4.3Å; F173-K213 HydrophobicContact CG-CD 4.48Å; V174-K213 WeakPolarHBondContact O-CA 3.47Å; D208-K213 HydrophobicContact CB-CB 3.98Å; D208-K213 WeakPolarHBondContact CB-O 3.4Å; D208-K213 PolarHBondContact N-O 2.89Å
214V93.7Very high86Confident0 Ų057.4 Ų57.40%027%0.268CS..EExtended strand (participates in β ladder)trans-143.9150.5173.463.90000111.5F153 F173 V174 I176 I179 L199 V205 Q206 V207F153-V214 HydrophobicContact CE2-CG1 3.91Å; F153-V214 HydrophobicContact CZ-CG1 3.73Å; F173-V214 WeakPolarHBondContact CA-O 3.44Å; V174-V214 PolarHBondContact N-O 3.02Å; V174-V214 PolarHBondContact O-N 3.48Å; I176-V214 HydrophobicContact CD1-CB 4.05Å; I176-V214 HydrophobicContact CD1-CG1 4.25Å; I176-V214 HydrophobicContact CG1-CB 4.05Å; I176-V214 HydrophobicContact CG1-CG1 3.73Å; I179-V214 HydrophobicContact CD1-CG1 3.15Å; L199-V214 HydrophobicContact CD1-CB 4.3Å; L199-V214 HydrophobicContact CD1-CG1 4Å; L199-V214 HydrophobicContact CD1-CG2 4.44Å; L199-V214 HydrophobicContact CD2-CG2 4.19Å; V205-V214 HydrophobicContact CB-CG2 3.71Å; V205-V214 HydrophobicContact CG1-CG2 4.19Å; V205-V214 HydrophobicContact CG2-CG2 4.28Å; Q206-V214 WeakPolarHBondContact O-CA 3.43Å; Q206-V214 WeakPolarHBondContact O-CG2 3.43Å; V207-V214 HydrophobicContact CG2-CB 4.3Å; V207-V214 HydrophobicContact CG2-CG2 3.94Å
215R90.3Very high86.8Confident65 Ų6553.2 Ų53.225%0.24525%0.247CC..EExtended strand (participates in β ladder)trans-131.7161.1173.665179.6176.2-162-6.7111.7D171 Q172 F173 V205 Q206D171-R215 WeakPolarHBondContact O-CD 3.19Å; D171-R215 PolarHBondContact O-NH1 3.36Å; Q172-R215 WeakPolarHBondContact O-CB 3.48Å; F173-R215 HydrophobicContact CD1-CB 3.83Å; F173-R215 HydrophobicContact CD1-CG 3.89Å; F173-R215 HydrophobicContact CE1-CB 4.19Å; F173-R215 HydrophobicContact CE1-CG 3.72Å; F173-R215 VanDerWaalsContact CE2-NH1 3.3Å; F173-R215 HydrophobicContact CG-CB 4.11Å; F173-R215 HydrophobicContact CG-CG 4.37Å; F173-R215 HydrophobicContact CZ-CG 4.06Å; V205-R215 CarbonylContact C-O 3.49Å; V205-R215 WeakPolarHBondContact CA-O 3.41Å; Q206-R215 HydrophobicContact CB-CG 4.06Å; Q206-R215 PolarHBondContact N-O 3.48Å; Q206-R215 PolarHBondContact O-N 2.82Å
216P88.2Confident86.9Confident10 Ų1057.5 Ų57.57%0.06526%0.263CS..EExtended strand (participates in β ladder)trans-60.6140.3167.9-8.418.1000110.6F153 L158 M168 H218F153-P216 HydrophobicContact CD1-CB 4.48Å; F153-P216 HydrophobicContact CD1-CG 3.86Å; L158-P216 HydrophobicContact CD2-CB 4.45Å; L158-P216 HydrophobicContact CD2-CG 3.53Å; M168-P216 VanDerWaalsContact CE-CD 3.46Å; M168-P216 HydrophobicContact CE-CG 3.65Å; P216-H218 PolarHBondContact O-N 3.3Å; P216-H218 PolarHBondContact O-ND1 2.76Å
217N79.9Confident86.7Confident36 Ų3659.5 Ų59.519%0.19327%0.272CS..  trans-75.390177.4-173.65.5000110.6P203 M204 K219P203-N217 WeakPolarHBondContact O-CB 3.36Å; P203-N217 PolarHBondContact O-ND2 3.41Å; M204-N217 VanDerWaalsContact C-CB 3.44Å; M204-N217 WeakPolarHBondContact O-CB 3.33Å; M204-N217 PolarHBondContact O-N 3.3Å; N217-K219 PolarHBondContact O-N 3.08Å; N217-K219 VanDerWaalsContact O-N 3.12Å; N217-K219 WeakPolarHBondContact OD1-CB 3.36Å; N217-K219 VanDerWaalsContact OD1-CD 3.26Å; N217-K219 WeakPolarHBondContact OD1-CD 3.36Å; N217-K219 WeakPolarHBondContact OD1-CG 3.33Å; N217-K219 PolarHBondContact OD1-N 3.14Å
218H67.1Low86.4Confident51 Ų5158.5 Ų58.524%0.23627%0.266CS..  trans-75.612.2179.9-7293.2000114.4Q172 P216 I296 F300Q172-H218 PolarHBondContact OE1-CE1 3.12Å; Q172-H218 PolarHBondContact OE1-ND1 3.24Å; Q172-H218 PolarHBondContact OE1-NE2 3.46Å; P216-H218 PolarHBondContact O-N 3.3Å; P216-H218 PolarHBondContact O-ND1 2.76Å; H218-I296 HydrophobicContact CB-CG2 4.15Å; H218-I296 WeakPolarHBondContact O-CD1 3.24Å; H218-I296 WeakPolarHBondContact O-CG1 3.42Å; H218-I296 WeakPolarHBondContact O-CG2 3.46Å; H218-F300 AromaticContact NE2-CD2 3.96Å; H218-F300 AromaticContact NE2-CE2 3.7Å
219K65.9Low86Confident83 Ų8358.2 Ų58.236%0.36127%0.267SS..  trans-62.5150.1-178.3-79.6172173.2-105.10112.7N217 C221 D267N217-K219 PolarHBondContact O-N 3.08Å; N217-K219 VanDerWaalsContact O-N 3.12Å; N217-K219 WeakPolarHBondContact OD1-CB 3.36Å; N217-K219 VanDerWaalsContact OD1-CD 3.26Å; N217-K219 WeakPolarHBondContact OD1-CD 3.36Å; N217-K219 WeakPolarHBondContact OD1-CG 3.33Å; N217-K219 PolarHBondContact OD1-N 3.14Å; K219-C221 PolarHBondContact O-N 2.95Å; K219-D267 HydrophobicContact CB-CB 3.97Å; K219-D267 WeakPolarHBondContact CD-OD1 3.48Å; K219-D267 WeakPolarHBondContact CE-OD1 3.43Å; K219-D267 HydrophobicContact CG-CB 4.24Å; K219-D267 WeakPolarHBondContact CG-OD1 3.24Å; K219-D267 IonicContact NZ-OD1 3.93Å; K219-D267 PolarHBondContact NZ-OD1 3.49Å
220R68.1Low85.8Confident126 Ų12654.8 Ų54.848%0.47525%0.25SS..  trans-80.960.1176.5-68.6-172-176.9763.2111.8I222 D267 A270 I293 I296R220-I222 VanDerWaalsContact C-N 3.34Å; R220-I222 PolarHBondContact O-N 2.76Å; R220-D267 HydrophobicContact CB-CB 4.44Å; R220-A270 VanDerWaalsContact O-CB 3.3Å; R220-A270 WeakPolarHBondContact O-CB 3.44Å; R220-I293 HydrophobicContact CB-CG2 3.75Å; R220-I296 HydrophobicContact CG-CD1 4.1Å; R220-I296 HydrophobicContact CG-CG1 3.38Å
221C84.4Confident85.6Confident25 Ų2554.3 Ų54.317%0.16926%0.26CS..  trans-79.6-5.6-175.6570000115.4K219 F264K219-C221 PolarHBondContact O-N 2.95Å; C221-F264 WeakPolarHBondContact CB-O 3.33Å; C221-F264 WeakPolarHBondContact O-CD2 3.41Å; C221-F264 PolarHBondContact O-N 3.25Å
222I89.3Confident85.5Confident36 Ų3654 Ų5419%0.18526%0.256CS..EExtended strand (participates in β ladder)trans-106.8124.4-175.3-59.2172.8000111.3R220 Y261 I262 T263 K294R220-I222 VanDerWaalsContact C-N 3.34Å; R220-I222 PolarHBondContact O-N 2.76Å; I222-Y261 HydrophobicContact CG2-CD1 4.49Å; I222-Y261 HydrophobicContact CG2-CG 4.28Å; I222-I262 CarbonylContact C-O 3.51Å; I222-I262 WeakPolarHBondContact CA-O 3.34Å; I222-T263 HydrophobicContact CG1-CG2 4.07Å; I222-K294 HydrophobicContact CB-CB 3.94Å; I222-K294 HydrophobicContact CB-CD 3.75Å; I222-K294 HydrophobicContact CB-CG 4.48Å; I222-K294 HydrophobicContact CD1-CD 3.97Å; I222-K294 HydrophobicContact CG1-CD 4.44Å; I222-K294 HydrophobicContact CG2-CB 4.11Å; I222-K294 HydrophobicContact CG2-CD 3.51Å; I222-K294 WeakPolarHBondContact O-CB 3.43Å; I222-K294 PolarHBondContact O-N 3.4Å
223I92.6Very high85.4Confident0 Ų051.8 Ų51.80%025%0.251CS..EExtended strand (participates in β ladder)trans-90140.8164.5-58.2-178.5000109L225 F241 Y261 I262 F264 A270 A273 L277 A291I223-L225 HydrophobicContact CG2-CD2 4.19Å; I223-F241 HydrophobicContact CD1-CE1 4.43Å; I223-Y261 WeakPolarHBondContact O-CA 3.48Å; I223-I262 PolarHBondContact N-O 3.49Å; I223-I262 PolarHBondContact O-N 3.41Å; I223-F264 HydrophobicContact CB-CE2 4.31Å; I223-F264 HydrophobicContact CD1-CD2 4.32Å; I223-F264 HydrophobicContact CD1-CE2 3.51Å; I223-F264 HydrophobicContact CD1-CZ 4.05Å; I223-F264 HydrophobicContact CG1-CD2 4.27Å; I223-F264 HydrophobicContact CG1-CE2 3.74Å; I223-A270 WeakPolarHBondContact CD1-O 3.37Å; I223-A270 HydrophobicContact CG1-CB 4.42Å; I223-A273 HydrophobicContact CD1-CB 3.81Å; I223-L277 HydrophobicContact CD1-CD1 3.94Å; I223-L277 HydrophobicContact CG2-CD1 3.91Å; I223-A291 HydrophobicContact CG2-CB 4.27Å
224I93.1Very high85.2Confident5 Ų551.3 Ų51.33%0.02625%0.254CS..EExtended strand (participates in β ladder)trans-107111170.6-51.8-179.2000107.8R226 N259 W260 Y261 A291 R292 K294I224-R226 HydrophobicContact CG2-CG 4.4Å; I224-N259 HydrophobicContact CG2-CB 3.71Å; I224-W260 CarbonylContact C-O 3.56Å; I224-W260 VanDerWaalsContact CA-O 3.3Å; I224-W260 WeakPolarHBondContact CA-O 3.4Å; I224-Y261 HydrophobicContact CB-CD1 4.36Å; I224-Y261 HydrophobicContact CB-CE1 4.46Å; I224-Y261 HydrophobicContact CD1-CD1 4.46Å; I224-Y261 HydrophobicContact CD1-CE1 3.94Å; I224-Y261 HydrophobicContact CG1-CD1 3.84Å; I224-Y261 HydrophobicContact CG1-CE1 3.83Å; I224-Y261 HydrophobicContact CG2-CD1 4.13Å; I224-Y261 HydrophobicContact CG2-CE1 3.97Å; I224-A291 CarbonylContact O-C 3.52Å; I224-A291 WeakPolarHBondContact O-CA 3.35Å; I224-R292 HydrophobicContact CB-CG 3.89Å; I224-R292 HydrophobicContact CD1-CG 4.46Å; I224-R292 PolarHBondContact N-O 3.03Å; I224-R292 PolarHBondContact O-N 3.46Å; I224-K294 HydrophobicContact CD1-CB 3.95Å; I224-K294 HydrophobicContact CD1-CD 4.23Å; I224-K294 HydrophobicContact CD1-CG 3.94Å; I224-K294 HydrophobicContact CG1-CB 3.93Å; I224-K294 HydrophobicContact CG1-CD 4.31Å; I224-K294 HydrophobicContact CG1-CG 4.31Å
225L92.9Very high85Confident0 Ų058.1 Ų58.10%029%0.286CS..EExtended strand (participates in β ladder)trans-82.8143.8165.7-59.2-177000110I223 V228 V237 L240 F241 N259 W260 I262 L277 I289 A291I223-L225 HydrophobicContact CG2-CD2 4.19Å; L225-V228 HydrophobicContact CB-CG2 4.22Å; L225-V228 HydrophobicContact CD1-CG2 4.23Å; L225-V237 HydrophobicContact CD1-CG1 4.07Å; L225-L240 HydrophobicContact CD1-CD1 4Å; L225-F241 HydrophobicContact CD1-CE2 4.25Å; L225-F241 HydrophobicContact CD1-CZ 4.2Å; L225-N259 VanDerWaalsContact O-CA 3.31Å; L225-N259 WeakPolarHBondContact O-CA 3.29Å; L225-W260 HydrophobicContact CB-CB 4.24Å; L225-W260 PolarHBondContact N-O 2.82Å; L225-W260 PolarHBondContact O-N 2.84Å; L225-I262 HydrophobicContact CB-CD1 4.35Å; L225-I262 HydrophobicContact CD1-CD1 3.87Å; L225-I262 HydrophobicContact CG-CD1 3.71Å; L225-L277 HydrophobicContact CD2-CD1 3.71Å; L225-L277 HydrophobicContact CD2-CD2 4.17Å; L225-I289 HydrophobicContact CD2-CG2 3.83Å; L225-A291 HydrophobicContact CD2-CB 3.69Å
226R90.1Very high85Confident102 Ų10258.5 Ų58.539%0.38529%0.29SS..EExtended strand (participates in β ladder)trans-130.3158.4172.7-63.6177.7151.6-165.9-12.5108.9I224 V228 N259 M290I224-R226 HydrophobicContact CG2-CG 4.4Å; R226-V228 PolarHBondContact O-N 3.29Å; R226-V228 VanDerWaalsContact O-N 3.16Å; R226-N259 WeakPolarHBondContact CG-OD1 3.45Å; R226-N259 PolarHBondContact NE-OD1 3Å; R226-N259 VanDerWaalsContact NE-OD1 3.08Å; R226-M290 HydrophobicContact CB-CB 3.96Å; R226-M290 WeakPolarHBondContact CB-O 3.44Å; R226-M290 PolarHBondContact N-O 3.21Å; R226-M290 PolarHBondContact O-N 2.98Å
227E85.1Confident85.1Confident118 Ų11858 Ų5855%0.55129%0.287SS*.SBendtrans690.2-180-61.1163.3-149.600114.3M290E227-M290 HydrophobicContact CG-CB 4.39Å; E227-M290 WeakPolarHBondContact OE1-CG 3.46Å; E227-M290 WeakPolarHBondContact OE2-CG 3.39Å
228V86.5Confident85.6Confident2 Ų259.5 Ų59.51%0.01229%0.293CS..  trans-79.3122.8157.9-1770000108.2L225 R226 T232 V237 F284L225-V228 HydrophobicContact CB-CG2 4.22Å; L225-V228 HydrophobicContact CD1-CG2 4.23Å; R226-V228 PolarHBondContact O-N 3.29Å; R226-V228 VanDerWaalsContact O-N 3.16Å; V228-T232 HydrophobicContact CG1-CG2 4.08Å; V228-V237 HydrophobicContact CG1-CG2 4.21Å; V228-F284 HydrophobicContact CG1-CD1 4.23Å; V228-F284 HydrophobicContact CG1-CE1 3.87Å; V228-F284 HydrophobicContact CG2-CD1 4.1Å
229P82.8Confident86.7Confident40 Ų4060 Ų6026%0.2630%0.302SS..  trans-74.2164.1-178.131.3-34.4000112.5T231 T232 W260P229-T231 VanDerWaalsContact C-N 3.28Å; P229-T231 PolarHBondContact O-N 3.34Å; P229-T232 WeakPolarHBondContact CG-OG1 3.17Å; P229-T232 PolarHBondContact O-N 3.05Å; P229-W260 PolarHBondContact O-NE1 2.93Å
230E83.9Confident87.7Confident120 Ų12056.8 Ų56.856%0.56129%0.289SS*.THydrogen-bonded Turntrans-69.1-25.7174.6-175.5171-177.600112.6T232 F254E230-T232 PolarHBondContact O-N 2.92Å; E230-F254 HydrophobicContact CB-CE1 4.1Å; E230-F254 HydrophobicContact CB-CE2 3.83Å; E230-F254 HydrophobicContact CB-CZ 3.54Å; E230-F254 HydrophobicContact CG-CD1 4.03Å; E230-F254 HydrophobicContact CG-CE1 3.5Å; E230-F254 HydrophobicContact CG-CE2 4.05Å; E230-F254 HydrophobicContact CG-CZ 3.51Å; E230-F254 WeakPolarHBondContact OE1-CE1 3.36Å
231T85.7Confident88.7Confident131 Ų13151.2 Ų51.280%0.80427%0.268SS*.THydrogen-bonded Turntrans-76.2-2.7177.758.30000113.9P229P229-T231 VanDerWaalsContact C-N 3.28Å; P229-T231 PolarHBondContact O-N 3.34Å
232T87.8Confident88.8Confident4 Ų456.4 Ų56.43%0.02529%0.287CS..SBendtrans-78.4126.5171.9-73.20000108.6V228 P229 E230 E236 V237 W260 F284V228-T232 HydrophobicContact CG1-CG2 4.08Å; P229-T232 WeakPolarHBondContact CG-OG1 3.17Å; P229-T232 PolarHBondContact O-N 3.05Å; E230-T232 PolarHBondContact O-N 2.92Å; T232-E236 HydrophobicContact CG2-CB 3.5Å; T232-E236 VanDerWaalsContact CG2-CB 3.5Å; T232-E236 HydrophobicContact CG2-CG 4.48Å; T232-V237 HydrophobicContact CG2-CG2 3.68Å; T232-W260 VanDerWaalsContact O-CZ2 3.31Å; T232-W260 WeakPolarHBondContact O-CZ2 3.47Å; T232-F284 HydrophobicContact CG2-CE1 3.96Å; T232-F284 HydrophobicContact CG2-CZ 3.55Å; T232-F284 WeakPolarHBondContact OG1-CE1 3.45Å
233P91.1Very high88.6Confident62 Ų6257.8 Ų57.840%0.40330%0.295SS..  trans-65.2149.8177.627.9-34000110.9E235 E236 V237P233-E235 PolarHBondContact O-N 3.09Å; P233-E235 VanDerWaalsContact O-N 3.1Å; P233-E236 WeakPolarHBondContact CD-OE1 3.35Å; P233-E236 HydrophobicContact CG-CB 3.98Å; P233-E236 HydrophobicContact CG-CG 3.94Å; P233-E236 WeakPolarHBondContact O-CB 3.22Å; P233-E236 PolarHBondContact O-N 2.84Å; P233-V237 PolarHBondContact O-N 3.31Å
234V90.1Very high88.2Confident62 Ų6266.5 Ų66.538%0.37634%0.336SS..Hα-helixtrans-55.3-33-18067.50000112.2E236 V237 E238 V252 W260V234-E236 PolarHBondContact O-N 2.93Å; V234-V237 WeakPolarHBondContact O-CB 3.13Å; V234-V237 PolarHBondContact O-N 2.94Å; V234-E238 WeakPolarHBondContact O-CG 3.41Å; V234-E238 PolarHBondContact O-N 2.81Å; V234-V252 HydrophobicContact CG2-CB 3.84Å; V234-V252 HydrophobicContact CG2-CG1 3.74Å; V234-W260 HydrophobicContact CB-CZ3 4.35Å; V234-W260 HydrophobicContact CG2-CZ3 4.29Å
235E90.3Very high87.5Confident143 Ų14370.5 Ų70.567%0.66836%0.357SS*.Hα-helixtrans-60.1-38.2174.9-62.3172.7-151.600113.7P233 V237 S239P233-E235 PolarHBondContact O-N 3.09Å; P233-E235 VanDerWaalsContact O-N 3.1Å; E235-V237 VanDerWaalsContact C-N 3.35Å; E235-S239 WeakPolarHBondContact O-CB 3.45Å; E235-S239 PolarHBondContact O-N 2.79Å
236E91.1Very high87.1Confident72 Ų7271 Ų7134%0.33636%0.361SS..Hα-helixtrans-71.7-29173.4-92.1-177.3-123.200111.8T232 P233 V234 S239 L240 F284 Q285T232-E236 HydrophobicContact CG2-CB 3.5Å; T232-E236 VanDerWaalsContact CG2-CB 3.5Å; T232-E236 HydrophobicContact CG2-CG 4.48Å; P233-E236 WeakPolarHBondContact CD-OE1 3.35Å; P233-E236 HydrophobicContact CG-CB 3.98Å; P233-E236 HydrophobicContact CG-CG 3.94Å; P233-E236 WeakPolarHBondContact O-CB 3.22Å; P233-E236 PolarHBondContact O-N 2.84Å; V234-E236 PolarHBondContact O-N 2.93Å; E236-S239 PolarHBondContact O-OG 3.21Å; E236-S239 VanDerWaalsContact O-OG 3.05Å; E236-L240 WeakPolarHBondContact O-CG 3.24Å; E236-F284 HydrophobicContact CB-CE2 4.48Å; E236-F284 HydrophobicContact CB-CZ 4.3Å; E236-F284 VanDerWaalsContact OE2-CZ 3.24Å; E236-F284 WeakPolarHBondContact OE2-CZ 3.34Å; E236-Q285 PolarHBondContact OE2-NE2 3.24Å
237V90.3Very high87.1Confident0 Ų067.1 Ų67.10%035%0.349CS..Hα-helixtrans-76.6-40.6176.1-173.20000110.5L225 V228 T232 P233 V234 E235 L240 F241 V252 W260 I262L225-V237 HydrophobicContact CD1-CG1 4.07Å; V228-V237 HydrophobicContact CG1-CG2 4.21Å; T232-V237 HydrophobicContact CG2-CG2 3.68Å; P233-V237 PolarHBondContact O-N 3.31Å; V234-V237 WeakPolarHBondContact O-CB 3.13Å; V234-V237 PolarHBondContact O-N 2.94Å; E235-V237 VanDerWaalsContact C-N 3.35Å; V237-L240 WeakPolarHBondContact O-CB 3.15Å; V237-L240 PolarHBondContact O-N 2.66Å; V237-F241 VanDerWaalsContact O-CD2 3.23Å; V237-F241 WeakPolarHBondContact O-CD2 3.46Å; V237-F241 WeakPolarHBondContact O-CE2 3.26Å; V237-V252 HydrophobicContact CB-CG1 4.01Å; V237-V252 HydrophobicContact CG1-CG1 3.68Å; V237-W260 HydrophobicContact CB-CD2 4.49Å; V237-W260 HydrophobicContact CB-CE3 4.35Å; V237-W260 HydrophobicContact CG1-CB 4.34Å; V237-W260 HydrophobicContact CG1-CD2 4.11Å; V237-W260 HydrophobicContact CG1-CE3 4.12Å; V237-W260 HydrophobicContact CG1-CG 4.24Å; V237-W260 HydrophobicContact CG2-CD2 3.81Å; V237-W260 HydrophobicContact CG2-CE3 3.96Å; V237-W260 HydrophobicContact CG2-CG 4.47Å; V237-W260 HydrophobicContact CG2-CH2 3.88Å; V237-W260 HydrophobicContact CG2-CZ2 3.75Å; V237-W260 HydrophobicContact CG2-CZ3 3.98Å; V237-I262 HydrophobicContact CG1-CD1 4.35Å; V237-I262 HydrophobicContact CG1-CG1 4.48Å
238E89.9Confident87.2Confident68 Ų6870.4 Ų70.432%0.31836%0.361SS..Hα-helixtrans-63.8-37.4172.4-74.1-178.4-177.600112.7V234 L240 F241 K242 V252V234-E238 WeakPolarHBondContact O-CG 3.41Å; V234-E238 PolarHBondContact O-N 2.81Å; E238-L240 PolarHBondContact O-N 2.6Å; E238-F241 WeakPolarHBondContact O-CA 3.46Å; E238-F241 PolarHBondContact O-N 3.42Å; E238-K242 PolarHBondContact O-N 3.15Å; E238-K242 WeakPolarHBondContact OE2-CE 3.35Å; E238-K242 IonicContact OE2-NZ 2.65Å; E238-K242 PolarHBondContact OE2-NZ 3.23Å; E238-V252 HydrophobicContact CG-CB 4.46Å; E238-V252 HydrophobicContact CG-CG2 3.75Å
239S89.5Confident87.4Confident62 Ų6271.8 Ų71.843%0.43437%0.37SS..Hα-helixtrans-65-21.9-178.372.20000113.2E235 E236 F241 K242E235-S239 WeakPolarHBondContact O-CB 3.45Å; E235-S239 PolarHBondContact O-N 2.79Å; E236-S239 PolarHBondContact O-OG 3.21Å; E236-S239 VanDerWaalsContact O-OG 3.05Å; S239-F241 PolarHBondContact O-N 3.28Å; S239-F241 VanDerWaalsContact O-N 3.07Å; S239-K242 PolarHBondContact O-N 2.66Å
240L87.6Confident87.6Confident14 Ų1474 Ų747%0.07338%0.378CS..THydrogen-bonded Turntrans-63.4-7.8167.9-50.4177.7000113.8L225 E236 V237 E238 Y276 L277 V281 F284 I289L225-L240 HydrophobicContact CD1-CD1 4Å; E236-L240 WeakPolarHBondContact O-CG 3.24Å; V237-L240 WeakPolarHBondContact O-CB 3.15Å; V237-L240 PolarHBondContact O-N 2.66Å; E238-L240 PolarHBondContact O-N 2.6Å; L240-Y276 WeakPolarHBondContact O-CE1 3.16Å; L240-L277 HydrophobicContact CB-CD2 4.37Å; L240-V281 HydrophobicContact CD2-CG1 3.97Å; L240-F284 HydrophobicContact CD1-CD2 4.2Å; L240-F284 HydrophobicContact CD2-CD2 3.6Å; L240-F284 HydrophobicContact CD2-CE2 4.04Å; L240-F284 HydrophobicContact CG-CD2 4.42Å; L240-I289 HydrophobicContact CD1-CD1 4.44Å
241F89.7Confident87.6Confident10 Ų1069.8 Ų69.84%0.04436%0.362CS..THydrogen-bonded Turntrans-126.1-1.1178.3-52.6-86.9000113.2I223 L225 V237 E238 S239 N243 V249 I262 F264 A273 L277I223-F241 HydrophobicContact CD1-CE1 4.43Å; L225-F241 HydrophobicContact CD1-CE2 4.25Å; L225-F241 HydrophobicContact CD1-CZ 4.2Å; V237-F241 VanDerWaalsContact O-CD2 3.23Å; V237-F241 WeakPolarHBondContact O-CD2 3.46Å; V237-F241 WeakPolarHBondContact O-CE2 3.26Å; E238-F241 WeakPolarHBondContact O-CA 3.46Å; E238-F241 PolarHBondContact O-N 3.42Å; S239-F241 PolarHBondContact O-N 3.28Å; S239-F241 VanDerWaalsContact O-N 3.07Å; F241-N243 VanDerWaalsContact C-N 3.35Å; F241-N243 PolarHBondContact O-N 2.99Å; F241-N243 VanDerWaalsContact O-N 3.12Å; F241-V249 HydrophobicContact CB-CG2 3.6Å; F241-V249 HydrophobicContact CD1-CG2 4.25Å; F241-V249 HydrophobicContact CD2-CG2 4.12Å; F241-V249 HydrophobicContact CG-CG2 3.73Å; F241-I262 HydrophobicContact CD2-CG2 4.4Å; F241-I262 HydrophobicContact CE1-CG2 4.29Å; F241-I262 HydrophobicContact CE2-CB 4.43Å; F241-I262 HydrophobicContact CE2-CG1 3.76Å; F241-I262 HydrophobicContact CE2-CG2 4.02Å; F241-I262 HydrophobicContact CZ-CB 4.21Å; F241-I262 HydrophobicContact CZ-CG1 3.87Å; F241-I262 HydrophobicContact CZ-CG2 3.94Å; F241-F264 HydrophobicContact CD1-CE1 4.24Å; F241-F264 AromaticContact CD1-CZ 3.65Å; F241-F264 HydrophobicContact CD1-CZ 3.65Å; F241-F264 HydrophobicContact CE1-CE2 4.43Å; F241-F264 AromaticContact CE1-CZ 3.7Å; F241-F264 HydrophobicContact CE1-CZ 3.7Å; F241-F264 HydrophobicContact CG-CZ 4.44Å; F241-A273 HydrophobicContact CD1-CB 4.26Å; F241-A273 HydrophobicContact CE1-CB 4.38Å; F241-L277 HydrophobicContact CE1-CD1 3.57Å; F241-L277 HydrophobicContact CE1-CD2 3.96Å; F241-L277 HydrophobicContact CE1-CG 3.8Å; F241-L277 HydrophobicContact CZ-CD1 3.8Å; F241-L277 HydrophobicContact CZ-CD2 3.95Å; F241-L277 HydrophobicContact CZ-CG 4.2Å
242K85.7Confident87.8Confident133 Ų13364.7 Ų64.758%0.57833%0.331SS*.  trans-86.472.1177.6-70.7170.7-178.8159.20110.4E238 S239E238-K242 PolarHBondContact O-N 3.15Å; E238-K242 WeakPolarHBondContact OE2-CE 3.35Å; E238-K242 IonicContact OE2-NZ 2.65Å; E238-K242 PolarHBondContact OE2-NZ 3.23Å; S239-K242 PolarHBondContact O-N 2.66Å
243N85.3Confident87.8Confident65 Ų6569.3 Ų69.335%0.34835%0.352SS..SBendtrans-152.8149.6173.8-171.36.2000110.2F241 N245 C246 Y276F241-N243 VanDerWaalsContact C-N 3.35Å; F241-N243 PolarHBondContact O-N 2.99Å; F241-N243 VanDerWaalsContact O-N 3.12Å; N243-N245 VanDerWaalsContact C-N 3.27Å; N243-N245 PolarHBondContact O-N 3.48Å; N243-C246 WeakPolarHBondContact O-CB 3.17Å; N243-C246 PolarHBondContact O-N 3.06Å; N243-Y276 HydrophobicContact CB-CE2 4.11Å; N243-Y276 WeakPolarHBondContact CB-OH 3.38Å; N243-Y276 WeakPolarHBondContact ND2-CE2 3.44Å; N243-Y276 PolarHBondContact ND2-OH 3.38Å
244E82.9Confident87.7Confident183 Ų18369.7 Ų69.786%0.85535%0.348SS*.THydrogen-bonded Turntrans-55.3-35-174.3-57.4-58.8137.100113.9C246E244-C246 PolarHBondContact O-N 2.88Å
245N80.4Confident87.5Confident89 Ų8967.2 Ų67.248%0.47633%0.333SS..THydrogen-bonded Turntrans-72.8-8.3177.5-76-3.7000113.7N243 Q272 Y276 E280N243-N245 VanDerWaalsContact C-N 3.27Å; N243-N245 PolarHBondContact O-N 3.48Å; N245-Q272 PolarHBondContact O-NE2 3.41Å; N245-Y276 HydrophobicContact CB-CD2 3.87Å; N245-Y276 HydrophobicContact CB-CE2 4.12Å; N245-E280 PolarHBondContact ND2-OE1 2.92Å
246C84.4Confident86.8Confident12 Ų1268.3 Ų68.38%0.08134%0.338CS..SBendtrans-115.5123.3-170.3-152.30000111.2N243 E244 Y276N243-C246 WeakPolarHBondContact O-CB 3.17Å; N243-C246 PolarHBondContact O-N 3.06Å; E244-C246 PolarHBondContact O-N 2.88Å; C246-Y276 HydrophobicContact CB-CD1 3.81Å; C246-Y276 HydrophobicContact CB-CD2 4.27Å; C246-Y276 HydrophobicContact CB-CE1 4.02Å; C246-Y276 HydrophobicContact CB-CE2 4.48Å; C246-Y276 HydrophobicContact CB-CG 3.96Å; C246-Y276 WeakPolarHBondContact SG-CD1 3.2Å
247P89Confident86.4Confident19 Ų1971.7 Ų71.712%0.12336%0.359CS..PPolyproline II helixtrans-69.7155-176.827.9-34.8000112.4V249 F264 D269 Q272 A273P247-V249 PolarHBondContact O-N 2.66Å; P247-F264 HydrophobicContact CG-CD1 4.21Å; P247-F264 HydrophobicContact CG-CE1 4.39Å; P247-F264 WeakPolarHBondContact O-CE1 3.48Å; P247-D269 HydrophobicContact CB-CB 3.82Å; P247-D269 HydrophobicContact CG-CB 3.69Å; P247-D269 VanDerWaalsContact CG-O 3.24Å; P247-D269 WeakPolarHBondContact CG-O 3.3Å; P247-Q272 HydrophobicContact CG-CB 4.22Å; P247-Q272 HydrophobicContact CG-CG 4.45Å; P247-A273 HydrophobicContact CG-CB 4.12Å
248K87.5Confident86.2Confident188 Ų18876.1 Ų76.182%0.81738%0.383SS*.PPolyproline II helixtrans-61.8131.3-173.7-172.1175.4178.9-178.50112.7
249V89.6Confident86.2Confident30 Ų3073.4 Ų73.418%0.18237%0.37CS..EExtended strand (participates in β ladder)trans-76.7144.2172.2177.40000110.8F241 P247 S251 V252 I262 F264F241-V249 HydrophobicContact CB-CG2 3.6Å; F241-V249 HydrophobicContact CD1-CG2 4.25Å; F241-V249 HydrophobicContact CD2-CG2 4.12Å; F241-V249 HydrophobicContact CG-CG2 3.73Å; P247-V249 PolarHBondContact O-N 2.66Å; V249-S251 WeakPolarHBondContact CG1-O 3.49Å; V249-V252 HydrophobicContact CG1-CG2 3.61Å; V249-I262 HydrophobicContact CB-CG2 4.36Å; V249-I262 HydrophobicContact CG1-CG2 3.64Å; V249-I262 HydrophobicContact CG2-CG2 3.75Å; V249-F264 HydrophobicContact CG2-CD1 4.42Å; V249-F264 HydrophobicContact CG2-CE1 3.63Å; V249-F264 HydrophobicContact CG2-CZ 3.83Å
250I87.1Confident86.4Confident87 Ų8771 Ų7145%0.44635%0.352SS..EExtended strand (participates in β ladder)trans-100.6-50175.3-60.6-178000111.6T263 Q265I250-T263 PolarHBondContact N-O 3.05Å; I250-Q265 HydrophobicContact CD1-CB 3.99Å
251S85.4Confident86.6Confident31 Ų3173.2 Ų73.222%0.21736%0.359CS..EExtended strand (participates in β ladder)trans-135.3145.1176.275.20000111.5V249 E253 I262 T263V249-S251 WeakPolarHBondContact CG1-O 3.49Å; S251-E253 WeakPolarHBondContact CB-OE1 3.29Å; S251-E253 PolarHBondContact OG-OE1 3.05Å; S251-I262 WeakPolarHBondContact O-CA 3.4Å; S251-T263 PolarHBondContact N-O 2.87Å; S251-T263 PolarHBondContact O-N 3.27Å; S251-T263 VanDerWaalsContact OG-CB 3.25Å; S251-T263 WeakPolarHBondContact OG-CB 3.32Å; S251-T263 PolarHBondContact OG-OG1 3.47Å
252V89.9Confident86.7Confident25 Ų2572.8 Ų72.815%0.15236%0.357CS..EExtended strand (participates in β ladder)trans-123.3104.1167.7-178.40000107.5V234 V237 E238 V249 W260 I262V234-V252 HydrophobicContact CG2-CB 3.84Å; V234-V252 HydrophobicContact CG2-CG1 3.74Å; V237-V252 HydrophobicContact CB-CG1 4.01Å; V237-V252 HydrophobicContact CG1-CG1 3.68Å; E238-V252 HydrophobicContact CG-CB 4.46Å; E238-V252 HydrophobicContact CG-CG2 3.75Å; V249-V252 HydrophobicContact CG1-CG2 3.61Å; V252-W260 HydrophobicContact CG1-CE3 3.71Å; V252-W260 HydrophobicContact CG1-CZ3 4.03Å; V252-I262 HydrophobicContact CG1-CG1 4.39Å; V252-I262 HydrophobicContact CG2-CG1 4.36Å; V252-I262 HydrophobicContact CG2-CG2 4.45Å
253E88.1Confident86.8Confident101 Ų10167.5 Ų67.547%0.47234%0.336SS..EExtended strand (participates in β ladder)trans-111.6122-176.5-69.9155.1-130.200109.5S251 A255 Y261S251-E253 WeakPolarHBondContact CB-OE1 3.29Å; S251-E253 PolarHBondContact OG-OE1 3.05Å; E253-A255 PolarHBondContact O-N 3.33Å; E253-Y261 PolarHBondContact N-O 3.24Å; E253-Y261 PolarHBondContact O-N 3Å
254F88.2Confident87Confident70 Ų7064.6 Ų64.631%0.30732%0.321SS..EExtended strand (participates in β ladder)trans-69.5127.6165-177.6-108.6000109.4E230 W260E230-F254 HydrophobicContact CB-CE1 4.1Å; E230-F254 HydrophobicContact CB-CE2 3.83Å; E230-F254 HydrophobicContact CB-CZ 3.54Å; E230-F254 HydrophobicContact CG-CD1 4.03Å; E230-F254 HydrophobicContact CG-CE1 3.5Å; E230-F254 HydrophobicContact CG-CE2 4.05Å; E230-F254 HydrophobicContact CG-CZ 3.51Å; E230-F254 WeakPolarHBondContact OE1-CE1 3.36Å; F254-W260 HydrophobicContact CB-CD2 4.25Å; F254-W260 HydrophobicContact CB-CE3 3.92Å; F254-W260 HydrophobicContact CB-CH2 4.11Å; F254-W260 HydrophobicContact CB-CZ2 4.39Å; F254-W260 HydrophobicContact CB-CZ3 3.86Å; F254-W260 AromaticContact CD2-CD2 3.84Å; F254-W260 HydrophobicContact CD2-CD2 3.84Å; F254-W260 AromaticContact CD2-CE2 3.58Å; F254-W260 HydrophobicContact CD2-CE3 4.38Å; F254-W260 HydrophobicContact CD2-CG 4.19Å; F254-W260 AromaticContact CD2-CZ2 3.95Å; F254-W260 HydrophobicContact CD2-CZ2 3.95Å; F254-W260 AromaticContact CD2-NE1 3.72Å; F254-W260 HydrophobicContact CG-CZ2 4.49Å
255A84.8Confident86.9Confident9 Ų961 Ų617%0.07430%0.304CS..EExtended strand (participates in β ladder)trans-121.2142-174.600000111.7E253 N259 Y261E253-A255 PolarHBondContact O-N 3.33Å; A255-N259 CarbonylContact C-O 3.37Å; A255-N259 WeakPolarHBondContact CA-O 2.92Å; A255-N259 WeakPolarHBondContact CB-O 3.44Å; A255-N259 PolarHBondContact N-O 3.03Å; A255-N259 PolarHBondContact O-N 3.48Å; A255-N259 VanDerWaalsContact O-N 3.16Å; A255-Y261 HydrophobicContact CB-CD1 4.07Å; A255-Y261 HydrophobicContact CB-CD2 3.55Å; A255-Y261 HydrophobicContact CB-CE1 3.98Å; A255-Y261 HydrophobicContact CB-CE2 3.44Å; A255-Y261 VanDerWaalsContact CB-CE2 3.44Å; A255-Y261 HydrophobicContact CB-CG 3.86Å
256H76.1Confident86.8Confident166 Ų16657.7 Ų57.777%0.76929%0.288SS*.THydrogen-bonded Turntrans-39.7143.1176-61.587.9000113.3N259H256-N259 PolarHBondContact O-ND2 3.02Å
257N83.1Confident86.8Confident143 Ų14359 Ų5977%0.76529%0.294SS*.THydrogen-bonded Turntrans7234.1-174.4-38.1-90.1000114.8N259N257-N259 VanDerWaalsContact C-ND2 3.31Å; N257-N259 PolarHBondContact O-N 2.99Å; N257-N259 PolarHBondContact O-ND2 3.32Å
258N85.2Confident86.7Confident94 Ų9462.2 Ų62.250%0.50331%0.313SS..THydrogen-bonded Turntrans54.550.5176.2-56.722.3000112.7
259N91.3Very high86.8Confident10 Ų1055.2 Ų55.25%0.05329%0.285CS..EExtended strand (participates in β ladder)trans-121.1143171.3-52.2-101.9000108.2I224 L225 R226 A255 H256 N257 Y261I224-N259 HydrophobicContact CG2-CB 3.71Å; L225-N259 VanDerWaalsContact O-CA 3.31Å; L225-N259 WeakPolarHBondContact O-CA 3.29Å; R226-N259 WeakPolarHBondContact CG-OD1 3.45Å; R226-N259 PolarHBondContact NE-OD1 3Å; R226-N259 VanDerWaalsContact NE-OD1 3.08Å; A255-N259 CarbonylContact C-O 3.37Å; A255-N259 WeakPolarHBondContact CA-O 2.92Å; A255-N259 WeakPolarHBondContact CB-O 3.44Å; A255-N259 PolarHBondContact N-O 3.03Å; A255-N259 PolarHBondContact O-N 3.48Å; A255-N259 VanDerWaalsContact O-N 3.16Å; H256-N259 PolarHBondContact O-ND2 3.02Å; N257-N259 VanDerWaalsContact C-ND2 3.31Å; N257-N259 PolarHBondContact O-N 2.99Å; N257-N259 PolarHBondContact O-ND2 3.32Å; N259-Y261 HydrophobicContact CB-CE1 4.27Å
260W92.7Very high86.9Confident13 Ų1353.8 Ų53.85%0.04928%0.276CS..EExtended strand (participates in β ladder)trans-99.6135.3164.5-65.179.2000108.8I224 L225 P229 T232 V234 V237 V252 F254 I262I224-W260 CarbonylContact C-O 3.56Å; I224-W260 VanDerWaalsContact CA-O 3.3Å; I224-W260 WeakPolarHBondContact CA-O 3.4Å; L225-W260 HydrophobicContact CB-CB 4.24Å; L225-W260 PolarHBondContact N-O 2.82Å; L225-W260 PolarHBondContact O-N 2.84Å; P229-W260 PolarHBondContact O-NE1 2.93Å; T232-W260 VanDerWaalsContact O-CZ2 3.31Å; T232-W260 WeakPolarHBondContact O-CZ2 3.47Å; V234-W260 HydrophobicContact CB-CZ3 4.35Å; V234-W260 HydrophobicContact CG2-CZ3 4.29Å; V237-W260 HydrophobicContact CB-CD2 4.49Å; V237-W260 HydrophobicContact CB-CE3 4.35Å; V237-W260 HydrophobicContact CG1-CB 4.34Å; V237-W260 HydrophobicContact CG1-CD2 4.11Å; V237-W260 HydrophobicContact CG1-CE3 4.12Å; V237-W260 HydrophobicContact CG1-CG 4.24Å; V237-W260 HydrophobicContact CG2-CD2 3.81Å; V237-W260 HydrophobicContact CG2-CE3 3.96Å; V237-W260 HydrophobicContact CG2-CG 4.47Å; V237-W260 HydrophobicContact CG2-CH2 3.88Å; V237-W260 HydrophobicContact CG2-CZ2 3.75Å; V237-W260 HydrophobicContact CG2-CZ3 3.98Å; V252-W260 HydrophobicContact CG1-CE3 3.71Å; V252-W260 HydrophobicContact CG1-CZ3 4.03Å; F254-W260 HydrophobicContact CB-CD2 4.25Å; F254-W260 HydrophobicContact CB-CE3 3.92Å; F254-W260 HydrophobicContact CB-CH2 4.11Å; F254-W260 HydrophobicContact CB-CZ2 4.39Å; F254-W260 HydrophobicContact CB-CZ3 3.86Å; F254-W260 AromaticContact CD2-CD2 3.84Å; F254-W260 HydrophobicContact CD2-CD2 3.84Å; F254-W260 AromaticContact CD2-CE2 3.58Å; F254-W260 HydrophobicContact CD2-CE3 4.38Å; F254-W260 HydrophobicContact CD2-CG 4.19Å; F254-W260 AromaticContact CD2-CZ2 3.95Å; F254-W260 HydrophobicContact CD2-CZ2 3.95Å; F254-W260 AromaticContact CD2-NE1 3.72Å; F254-W260 HydrophobicContact CG-CZ2 4.49Å; W260-I262 HydrophobicContact CB-CD1 3.65Å
261Y91.8Very high87.1Confident60 Ų6054.2 Ų54.224%0.23528%0.276CS..EExtended strand (participates in β ladder)trans-101.2121.3170.6-66.4-17.5000108.9I222 I223 I224 E253 A255 N259I222-Y261 HydrophobicContact CG2-CD1 4.49Å; I222-Y261 HydrophobicContact CG2-CG 4.28Å; I223-Y261 WeakPolarHBondContact O-CA 3.48Å; I224-Y261 HydrophobicContact CB-CD1 4.36Å; I224-Y261 HydrophobicContact CB-CE1 4.46Å; I224-Y261 HydrophobicContact CD1-CD1 4.46Å; I224-Y261 HydrophobicContact CD1-CE1 3.94Å; I224-Y261 HydrophobicContact CG1-CD1 3.84Å; I224-Y261 HydrophobicContact CG1-CE1 3.83Å; I224-Y261 HydrophobicContact CG2-CD1 4.13Å; I224-Y261 HydrophobicContact CG2-CE1 3.97Å; E253-Y261 PolarHBondContact N-O 3.24Å; E253-Y261 PolarHBondContact O-N 3Å; A255-Y261 HydrophobicContact CB-CD1 4.07Å; A255-Y261 HydrophobicContact CB-CD2 3.55Å; A255-Y261 HydrophobicContact CB-CE1 3.98Å; A255-Y261 HydrophobicContact CB-CE2 3.44Å; A255-Y261 VanDerWaalsContact CB-CE2 3.44Å; A255-Y261 HydrophobicContact CB-CG 3.86Å; N259-Y261 HydrophobicContact CB-CE1 4.27Å
262I92.1Very high87.4Confident0 Ų057 Ų570%029%0.286CS..EExtended strand (participates in β ladder)trans-117.1117.6-179.5-62.170.1000107.1I222 I223 L225 V237 F241 V249 S251 V252 W260 F264I222-I262 CarbonylContact C-O 3.51Å; I222-I262 WeakPolarHBondContact CA-O 3.34Å; I223-I262 PolarHBondContact N-O 3.49Å; I223-I262 PolarHBondContact O-N 3.41Å; L225-I262 HydrophobicContact CB-CD1 4.35Å; L225-I262 HydrophobicContact CD1-CD1 3.87Å; L225-I262 HydrophobicContact CG-CD1 3.71Å; V237-I262 HydrophobicContact CG1-CD1 4.35Å; V237-I262 HydrophobicContact CG1-CG1 4.48Å; F241-I262 HydrophobicContact CD2-CG2 4.4Å; F241-I262 HydrophobicContact CE1-CG2 4.29Å; F241-I262 HydrophobicContact CE2-CB 4.43Å; F241-I262 HydrophobicContact CE2-CG1 3.76Å; F241-I262 HydrophobicContact CE2-CG2 4.02Å; F241-I262 HydrophobicContact CZ-CB 4.21Å; F241-I262 HydrophobicContact CZ-CG1 3.87Å; F241-I262 HydrophobicContact CZ-CG2 3.94Å; V249-I262 HydrophobicContact CB-CG2 4.36Å; V249-I262 HydrophobicContact CG1-CG2 3.64Å; V249-I262 HydrophobicContact CG2-CG2 3.75Å; S251-I262 WeakPolarHBondContact O-CA 3.4Å; V252-I262 HydrophobicContact CG1-CG1 4.39Å; V252-I262 HydrophobicContact CG2-CG1 4.36Å; V252-I262 HydrophobicContact CG2-CG2 4.45Å; W260-I262 HydrophobicContact CB-CD1 3.65Å; I262-F264 HydrophobicContact CB-CE2 4.22Å; I262-F264 HydrophobicContact CG2-CD2 4.41Å; I262-F264 HydrophobicContact CG2-CE2 3.52Å; I262-F264 HydrophobicContact CG2-CZ 3.62Å
263T88.3Confident87.6Confident23 Ų2355.8 Ų55.814%0.14128%0.279CS..EExtended strand (participates in β ladder)trans-102.9134.5-174.3-49.80000110.9I222 I250 S251I222-T263 HydrophobicContact CG1-CG2 4.07Å; I250-T263 PolarHBondContact N-O 3.05Å; S251-T263 PolarHBondContact N-O 2.87Å; S251-T263 PolarHBondContact O-N 3.27Å; S251-T263 VanDerWaalsContact OG-CB 3.25Å; S251-T263 WeakPolarHBondContact OG-CB 3.32Å; S251-T263 PolarHBondContact OG-OG1 3.47Å
264F89Confident87.8Confident3 Ų354.1 Ų54.11%0.01327%0.268CS..EExtended strand (participates in β ladder)trans-115.3169.5177.3-63-92.3000111.6C221 I223 F241 P247 V249 I262 D269 A270 A273C221-F264 WeakPolarHBondContact CB-O 3.33Å; C221-F264 WeakPolarHBondContact O-CD2 3.41Å; C221-F264 PolarHBondContact O-N 3.25Å; I223-F264 HydrophobicContact CB-CE2 4.31Å; I223-F264 HydrophobicContact CD1-CD2 4.32Å; I223-F264 HydrophobicContact CD1-CE2 3.51Å; I223-F264 HydrophobicContact CD1-CZ 4.05Å; I223-F264 HydrophobicContact CG1-CD2 4.27Å; I223-F264 HydrophobicContact CG1-CE2 3.74Å; F241-F264 HydrophobicContact CD1-CE1 4.24Å; F241-F264 AromaticContact CD1-CZ 3.65Å; F241-F264 HydrophobicContact CD1-CZ 3.65Å; F241-F264 HydrophobicContact CE1-CE2 4.43Å; F241-F264 AromaticContact CE1-CZ 3.7Å; F241-F264 HydrophobicContact CE1-CZ 3.7Å; F241-F264 HydrophobicContact CG-CZ 4.44Å; P247-F264 HydrophobicContact CG-CD1 4.21Å; P247-F264 HydrophobicContact CG-CE1 4.39Å; P247-F264 WeakPolarHBondContact O-CE1 3.48Å; V249-F264 HydrophobicContact CG2-CD1 4.42Å; V249-F264 HydrophobicContact CG2-CE1 3.63Å; V249-F264 HydrophobicContact CG2-CZ 3.83Å; I262-F264 HydrophobicContact CB-CE2 4.22Å; I262-F264 HydrophobicContact CG2-CD2 4.41Å; I262-F264 HydrophobicContact CG2-CE2 3.52Å; I262-F264 HydrophobicContact CG2-CZ 3.62Å; F264-D269 HydrophobicContact CB-CB 3.84Å; F264-D269 HydrophobicContact CD1-CB 4.35Å; F264-D269 HydrophobicContact CG-CB 4.38Å; F264-A270 HydrophobicContact CB-CB 4.27Å; F264-A270 HydrophobicContact CD2-CB 3.91Å; F264-A270 HydrophobicContact CG-CB 4.31Å; F264-A273 HydrophobicContact CD1-CB 4.22Å; F264-A273 HydrophobicContact CE1-CB 3.46Å; F264-A273 VanDerWaalsContact CE1-CB 3.46Å; F264-A273 HydrophobicContact CE2-CB 3.97Å; F264-A273 HydrophobicContact CZ-CB 3.32Å
265Q80.5Confident88Confident107 Ų10756.7 Ų56.750%0.528%0.279SS..SBendtrans-66.7-37.8179.2-173.568.624.400112.8I250I250-Q265 HydrophobicContact CD1-CB 3.99Å
266S78.4Confident88.4Confident20 Ų2057.5 Ų57.514%0.1428%0.281CS..SBendtrans-136.4171.2179.477.60000114T268 D269 A270S266-T268 VanDerWaalsContact C-N 3.29Å; S266-T268 WeakPolarHBondContact OG-CB 3.24Å; S266-T268 PolarHBondContact OG-N 3.48Å; S266-D269 VanDerWaalsContact CB-OD2 3.23Å; S266-D269 WeakPolarHBondContact CB-OD2 3.46Å; S266-D269 PolarHBondContact N-OD2 3.37Å; S266-D269 PolarHBondContact OG-N 2.9Å; S266-D269 VanDerWaalsContact OG-N 3.09Å; S266-D269 PolarHBondContact OG-OD2 3.04Å; S266-A270 PolarHBondContact O-N 3.33Å; S266-A270 VanDerWaalsContact O-N 3.08Å
267D84Confident89.2Confident41 Ų4149.6 Ų49.622%0.21924%0.244CC..Hα-helixtrans-71.7-22.6168.663.4-51.8000113.1K219 R220 Q271K219-D267 HydrophobicContact CB-CB 3.97Å; K219-D267 WeakPolarHBondContact CD-OD1 3.48Å; K219-D267 WeakPolarHBondContact CE-OD1 3.43Å; K219-D267 HydrophobicContact CG-CB 4.24Å; K219-D267 WeakPolarHBondContact CG-OD1 3.24Å; K219-D267 IonicContact NZ-OD1 3.93Å; K219-D267 PolarHBondContact NZ-OD1 3.49Å; R220-D267 HydrophobicContact CB-CB 4.44Å; D267-Q271 WeakPolarHBondContact O-CB 3.39Å; D267-Q271 WeakPolarHBondContact O-CG 3.39Å; D267-Q271 PolarHBondContact O-N 3.45Å; D267-Q271 PolarHBondContact O-NE2 3.34Å
268T87.1Confident89.5Confident86 Ų8647.2 Ų47.253%0.52823%0.225SC..Hα-helixtrans-67-47.1171-50.80000109.6S266 Q271 Q272S266-T268 VanDerWaalsContact C-N 3.29Å; S266-T268 WeakPolarHBondContact OG-CB 3.24Å; S266-T268 PolarHBondContact OG-N 3.48Å; T268-Q271 WeakPolarHBondContact O-CB 3.32Å; T268-Q271 PolarHBondContact O-N 3.12Å; T268-Q271 VanDerWaalsContact O-N 3.15Å; T268-Q272 PolarHBondContact O-N 3.17Å
269D91.1Very high89.7Confident40 Ų4049.6 Ų49.621%0.21423%0.232CC..Hα-helixtrans-62.8-48.7178.8-56-47.3000111.1P247 F264 S266 Q271 Q272 A273P247-D269 HydrophobicContact CB-CB 3.82Å; P247-D269 HydrophobicContact CG-CB 3.69Å; P247-D269 VanDerWaalsContact CG-O 3.24Å; P247-D269 WeakPolarHBondContact CG-O 3.3Å; F264-D269 HydrophobicContact CB-CB 3.84Å; F264-D269 HydrophobicContact CD1-CB 4.35Å; F264-D269 HydrophobicContact CG-CB 4.38Å; S266-D269 VanDerWaalsContact CB-OD2 3.23Å; S266-D269 WeakPolarHBondContact CB-OD2 3.46Å; S266-D269 PolarHBondContact N-OD2 3.37Å; S266-D269 PolarHBondContact OG-N 2.9Å; S266-D269 VanDerWaalsContact OG-N 3.09Å; S266-D269 PolarHBondContact OG-OD2 3.04Å; D269-Q271 PolarHBondContact O-N 3.12Å; D269-Q272 PolarHBondContact O-N 2.97Å; D269-Q272 VanDerWaalsContact O-N 3.08Å; D269-A273 WeakPolarHBondContact O-CB 3.43Å; D269-A273 PolarHBondContact O-N 3.48Å
270A90.3Very high89.5Confident0 Ų053.7 Ų53.70%025%0.252CS..Hα-helixtrans-62.4-2817600000112.9R220 I223 F264 S266 Y274R220-A270 VanDerWaalsContact O-CB 3.3Å; R220-A270 WeakPolarHBondContact O-CB 3.44Å; I223-A270 WeakPolarHBondContact CD1-O 3.37Å; I223-A270 HydrophobicContact CG1-CB 4.42Å; F264-A270 HydrophobicContact CB-CB 4.27Å; F264-A270 HydrophobicContact CD2-CB 3.91Å; F264-A270 HydrophobicContact CG-CB 4.31Å; S266-A270 PolarHBondContact O-N 3.33Å; S266-A270 VanDerWaalsContact O-N 3.08Å; A270-Y274 WeakPolarHBondContact O-CB 3.27Å; A270-Y274 PolarHBondContact O-N 2.92Å; A270-Y274 VanDerWaalsContact O-N 3.08Å
271Q90.8Very high89.1Confident96 Ų9654.5 Ų54.545%0.44926%0.258SS..Hα-helixtrans-74-39.2171.2-80.3170.984.700112.6D267 T268 D269 Y274 K275 I293D267-Q271 WeakPolarHBondContact O-CB 3.39Å; D267-Q271 WeakPolarHBondContact O-CG 3.39Å; D267-Q271 PolarHBondContact O-N 3.45Å; D267-Q271 PolarHBondContact O-NE2 3.34Å; T268-Q271 WeakPolarHBondContact O-CB 3.32Å; T268-Q271 PolarHBondContact O-N 3.12Å; T268-Q271 VanDerWaalsContact O-N 3.15Å; D269-Q271 PolarHBondContact O-N 3.12Å; Q271-Y274 PolarHBondContact O-N 2.56Å; Q271-K275 WeakPolarHBondContact O-CG 3.43Å; Q271-K275 PolarHBondContact O-N 3.17Å; Q271-I293 HydrophobicContact CG-CD1 3.88Å
272Q92.7Very high88.6Confident90 Ų9058.1 Ų58.142%0.42127%0.274SS..Hα-helixtrans-67-51.2176.4-179.1173.4-28.800111.2N245 P247 T268 D269 Y274 K275 Y276N245-Q272 PolarHBondContact O-NE2 3.41Å; P247-Q272 HydrophobicContact CG-CB 4.22Å; P247-Q272 HydrophobicContact CG-CG 4.45Å; T268-Q272 PolarHBondContact O-N 3.17Å; D269-Q272 PolarHBondContact O-N 2.97Å; D269-Q272 VanDerWaalsContact O-N 3.08Å; Q272-Y274 PolarHBondContact O-N 2.85Å; Q272-K275 WeakPolarHBondContact O-CB 3.42Å; Q272-K275 PolarHBondContact O-N 3.14Å; Q272-K275 VanDerWaalsContact O-N 3.1Å; Q272-Y276 WeakPolarHBondContact O-CB 3.28Å; Q272-Y276 PolarHBondContact O-N 2.9Å
273A93.4Very high88.3Confident0 Ų061.6 Ų61.60%030%0.296CS..Hα-helixtrans-59.1-34.9174.300000112.3I223 F241 P247 F264 D269 Y276 L277I223-A273 HydrophobicContact CD1-CB 3.81Å; F241-A273 HydrophobicContact CD1-CB 4.26Å; F241-A273 HydrophobicContact CE1-CB 4.38Å; P247-A273 HydrophobicContact CG-CB 4.12Å; F264-A273 HydrophobicContact CD1-CB 4.22Å; F264-A273 HydrophobicContact CE1-CB 3.46Å; F264-A273 VanDerWaalsContact CE1-CB 3.46Å; F264-A273 HydrophobicContact CE2-CB 3.97Å; F264-A273 HydrophobicContact CZ-CB 3.32Å; D269-A273 WeakPolarHBondContact O-CB 3.43Å; D269-A273 PolarHBondContact O-N 3.48Å; A273-Y276 PolarHBondContact O-N 3.49Å; A273-L277 WeakPolarHBondContact O-CB 3.26Å; A273-L277 VanDerWaalsContact O-CG 3.31Å; A273-L277 WeakPolarHBondContact O-CG 3.35Å; A273-L277 PolarHBondContact O-N 3.4Å
274Y93.4Very high88.3Confident66 Ų6661.6 Ų61.626%0.25929%0.294SS..Hα-helixtrans-68-36.5175-179.9-103.8000113.5A270 Q271 Q272 R278 A291 I293A270-Y274 WeakPolarHBondContact O-CB 3.27Å; A270-Y274 PolarHBondContact O-N 2.92Å; A270-Y274 VanDerWaalsContact O-N 3.08Å; Q271-Y274 PolarHBondContact O-N 2.56Å; Q272-Y274 PolarHBondContact O-N 2.85Å; Y274-R278 HydrophobicContact CE1-CG 4.31Å; Y274-R278 HydrophobicContact CE2-CG 4.17Å; Y274-R278 VanDerWaalsContact O-CG 3.31Å; Y274-R278 WeakPolarHBondContact O-CG 3.4Å; Y274-R278 PolarHBondContact O-N 3.13Å; Y274-R278 PolarHBondContact OH-NE 3.36Å; Y274-A291 HydrophobicContact CD2-CB 4.08Å; Y274-A291 HydrophobicContact CE2-CB 3.85Å; Y274-A291 WeakPolarHBondContact CE2-O 3.21Å; Y274-I293 HydrophobicContact CD1-CD1 4.01Å; Y274-I293 HydrophobicContact CD1-CG1 4.09Å; Y274-I293 HydrophobicContact CD2-CG1 3.9Å; Y274-I293 HydrophobicContact CG-CD1 3.89Å; Y274-I293 HydrophobicContact CG-CG1 3.63Å
275K92.6Very high88.1Confident123 Ų12366.6 Ų66.654%0.53532%0.317SS..Hα-helixtrans-66-50.9171.2-71.3173-177.81790110.6Q271 Q272 L277 R278 E279Q271-K275 WeakPolarHBondContact O-CG 3.43Å; Q271-K275 PolarHBondContact O-N 3.17Å; Q272-K275 WeakPolarHBondContact O-CB 3.42Å; Q272-K275 PolarHBondContact O-N 3.14Å; Q272-K275 VanDerWaalsContact O-N 3.1Å; K275-L277 VanDerWaalsContact C-N 3.34Å; K275-L277 PolarHBondContact O-N 3.4Å; K275-R278 CarbonylContact O-C 3.55Å; K275-R278 WeakPolarHBondContact O-CA 3.36Å; K275-R278 WeakPolarHBondContact O-CB 3.04Å; K275-R278 PolarHBondContact O-N 2.93Å; K275-E279 WeakPolarHBondContact O-CB 3.42Å; K275-E279 PolarHBondContact O-N 2.99Å
276Y93Very high88.3Confident26 Ų2664.9 Ų64.910%0.10233%0.329CS..Hα-helixtrans-51.6-48177.4176-94.2000112.6L240 N243 N245 C246 Q272 A273 R278 E279 E280 V281L240-Y276 WeakPolarHBondContact O-CE1 3.16Å; N243-Y276 HydrophobicContact CB-CE2 4.11Å; N243-Y276 WeakPolarHBondContact CB-OH 3.38Å; N243-Y276 WeakPolarHBondContact ND2-CE2 3.44Å; N243-Y276 PolarHBondContact ND2-OH 3.38Å; N245-Y276 HydrophobicContact CB-CD2 3.87Å; N245-Y276 HydrophobicContact CB-CE2 4.12Å; C246-Y276 HydrophobicContact CB-CD1 3.81Å; C246-Y276 HydrophobicContact CB-CD2 4.27Å; C246-Y276 HydrophobicContact CB-CE1 4.02Å; C246-Y276 HydrophobicContact CB-CE2 4.48Å; C246-Y276 HydrophobicContact CB-CG 3.96Å; C246-Y276 WeakPolarHBondContact SG-CD1 3.2Å; Q272-Y276 WeakPolarHBondContact O-CB 3.28Å; Q272-Y276 PolarHBondContact O-N 2.9Å; A273-Y276 PolarHBondContact O-N 3.49Å; Y276-R278 PolarHBondContact O-N 2.88Å; Y276-E279 PolarHBondContact O-N 3.44Å; Y276-E280 HydrophobicContact CD2-CB 3.95Å; Y276-E280 VanDerWaalsContact CD2-CD 3.47Å; Y276-E280 HydrophobicContact CD2-CG 4.05Å; Y276-E280 VanDerWaalsContact CD2-OE1 3.27Å; Y276-E280 WeakPolarHBondContact CD2-OE1 3.14Å; Y276-E280 HydrophobicContact CE2-CB 3.78Å; Y276-E280 HydrophobicContact CE2-CG 4.11Å; Y276-E280 VanDerWaalsContact CE2-OE2 3.31Å; Y276-E280 WeakPolarHBondContact CE2-OE2 3.39Å; Y276-E280 PolarHBondContact O-N 3.3Å; Y276-V281 HydrophobicContact CD1-CG2 3.67Å; Y276-V281 HydrophobicContact CE1-CG2 3.16Å; Y276-V281 PolarHBondContact O-N 3.45Å; Y276-V281 VanDerWaalsContact O-N 3.13Å
277L92.3Very high88.8Confident1 Ų169.8 Ų69.81%0.00535%0.348CS..Iπ-helixtrans-57.8-31.6174.1-80.5170000114.2I223 L225 L240 F241 A273 K275 V281 K282 A291I223-L277 HydrophobicContact CD1-CD1 3.94Å; I223-L277 HydrophobicContact CG2-CD1 3.91Å; L225-L277 HydrophobicContact CD2-CD1 3.71Å; L225-L277 HydrophobicContact CD2-CD2 4.17Å; L240-L277 HydrophobicContact CB-CD2 4.37Å; F241-L277 HydrophobicContact CE1-CD1 3.57Å; F241-L277 HydrophobicContact CE1-CD2 3.96Å; F241-L277 HydrophobicContact CE1-CG 3.8Å; F241-L277 HydrophobicContact CZ-CD1 3.8Å; F241-L277 HydrophobicContact CZ-CD2 3.95Å; F241-L277 HydrophobicContact CZ-CG 4.2Å; A273-L277 WeakPolarHBondContact O-CB 3.26Å; A273-L277 VanDerWaalsContact O-CG 3.31Å; A273-L277 WeakPolarHBondContact O-CG 3.35Å; A273-L277 PolarHBondContact O-N 3.4Å; K275-L277 VanDerWaalsContact C-N 3.34Å; K275-L277 PolarHBondContact O-N 3.4Å; L277-V281 HydrophobicContact CD2-CG2 4.37Å; L277-K282 WeakPolarHBondContact O-CA 3.24Å; L277-K282 PolarHBondContact O-N 3.34Å; L277-A291 HydrophobicContact CB-CB 4.46Å; L277-A291 HydrophobicContact CD1-CB 3.94Å
278R89.7Confident88.9Confident93 Ų9371.7 Ų71.735%0.35136%0.362SS..Iπ-helixtrans-91.1-31-176-74.4-63.9-169.4-176.4-0.7113.4Y274 K275 Y276 I289 A291Y274-R278 HydrophobicContact CE1-CG 4.31Å; Y274-R278 HydrophobicContact CE2-CG 4.17Å; Y274-R278 VanDerWaalsContact O-CG 3.31Å; Y274-R278 WeakPolarHBondContact O-CG 3.4Å; Y274-R278 PolarHBondContact O-N 3.13Å; Y274-R278 PolarHBondContact OH-NE 3.36Å; K275-R278 CarbonylContact O-C 3.55Å; K275-R278 WeakPolarHBondContact O-CA 3.36Å; K275-R278 WeakPolarHBondContact O-CB 3.04Å; K275-R278 PolarHBondContact O-N 2.93Å; Y276-R278 PolarHBondContact O-N 2.88Å; R278-I289 PolarHBondContact NH1-O 2.73Å; R278-A291 PolarHBondContact NH2-O 3.04Å
279E89.8Confident89.1Confident143 Ų14367.7 Ų67.767%0.66834%0.338SS*.Iπ-helixtrans-100.2-47-171.8-68169-146.800111.5K275 Y276K275-E279 WeakPolarHBondContact O-CB 3.42Å; K275-E279 PolarHBondContact O-N 2.99Å; Y276-E279 PolarHBondContact O-N 3.44Å
280E86.4Confident89Confident97 Ų9769.6 Ų69.645%0.45335%0.346SS..Iπ-helixtrans-95.5-60.1-177.7-64.7-172.1-127.300112.4N245 Y276N245-E280 PolarHBondContact ND2-OE1 2.92Å; Y276-E280 HydrophobicContact CD2-CB 3.95Å; Y276-E280 VanDerWaalsContact CD2-CD 3.47Å; Y276-E280 HydrophobicContact CD2-CG 4.05Å; Y276-E280 VanDerWaalsContact CD2-OE1 3.27Å; Y276-E280 WeakPolarHBondContact CD2-OE1 3.14Å; Y276-E280 HydrophobicContact CE2-CB 3.78Å; Y276-E280 HydrophobicContact CE2-CG 4.11Å; Y276-E280 VanDerWaalsContact CE2-OE2 3.31Å; Y276-E280 WeakPolarHBondContact CE2-OE2 3.39Å; Y276-E280 PolarHBondContact O-N 3.3Å
281V84.1Confident89.1Confident29 Ų2969.7 Ų69.718%0.17635%0.347CS..Iπ-helixtrans-66.8-59-174-166.90000110.5L240 Y276 L277 T283 I289L240-V281 HydrophobicContact CD2-CG1 3.97Å; Y276-V281 HydrophobicContact CD1-CG2 3.67Å; Y276-V281 HydrophobicContact CE1-CG2 3.16Å; Y276-V281 PolarHBondContact O-N 3.45Å; Y276-V281 VanDerWaalsContact O-N 3.13Å; L277-V281 HydrophobicContact CD2-CG2 4.37Å; V281-T283 PolarHBondContact O-N 2.94Å; V281-I289 HydrophobicContact CB-CD1 4.11Å; V281-I289 HydrophobicContact CG1-CD1 3.45Å; V281-I289 VanDerWaalsContact CG1-CD1 3.45Å
282K81.3Confident89.2Confident136 Ų13670.5 Ų70.559%0.59135%0.346SS*.  trans59.9-38.4171-171.7178.4177.5-179.20117.4L277 P288 I289L277-K282 WeakPolarHBondContact O-CA 3.24Å; L277-K282 PolarHBondContact O-N 3.34Å; K282-P288 WeakPolarHBondContact O-CA 3.28Å; K282-I289 PolarHBondContact O-N 2.89Å
283T87Confident89.1Confident74 Ų7468.5 Ų68.545%0.45434%0.337SS..EExtended strand (participates in β ladder)trans-134.6138.4-179.949.40000111.4V281 K287V281-T283 PolarHBondContact O-N 2.94Å; T283-K287 CarbonylContact C-O 3.55Å; T283-K287 WeakPolarHBondContact CA-O 3.49Å; T283-K287 WeakPolarHBondContact CB-O 3.17Å
284F87Confident88.9Confident23 Ų2371.2 Ų71.210%0.10135%0.349CS..EExtended strand (participates in β ladder)trans-120131.3172.7179.2-115.4000109.2V228 T232 E236 L240 G286 K287 I289V228-F284 HydrophobicContact CG1-CD1 4.23Å; V228-F284 HydrophobicContact CG1-CE1 3.87Å; V228-F284 HydrophobicContact CG2-CD1 4.1Å; T232-F284 HydrophobicContact CG2-CE1 3.96Å; T232-F284 HydrophobicContact CG2-CZ 3.55Å; T232-F284 WeakPolarHBondContact OG1-CE1 3.45Å; E236-F284 HydrophobicContact CB-CE2 4.48Å; E236-F284 HydrophobicContact CB-CZ 4.3Å; E236-F284 VanDerWaalsContact OE2-CZ 3.24Å; E236-F284 WeakPolarHBondContact OE2-CZ 3.34Å; L240-F284 HydrophobicContact CD1-CD2 4.2Å; L240-F284 HydrophobicContact CD2-CD2 3.6Å; L240-F284 HydrophobicContact CD2-CE2 4.04Å; L240-F284 HydrophobicContact CG-CD2 4.42Å; F284-G286 PolarHBondContact O-N 3.33Å; F284-G286 VanDerWaalsContact O-N 3.08Å; F284-K287 PolarHBondContact N-O 3.17Å; F284-K287 PolarHBondContact O-N 3Å; F284-I289 HydrophobicContact CB-CD1 3.81Å; F284-I289 HydrophobicContact CB-CG1 3.62Å
285Q85.3Confident87.9Confident107 Ų10771.5 Ų71.550%0.537%0.366SS..THydrogen-bonded Turntrans48.138.3-177.1-58.2178.9-2.300113E236 K287E236-Q285 PolarHBondContact OE2-NE2 3.24Å; Q285-K287 VanDerWaalsContact C-N 3.3Å; Q285-K287 PolarHBondContact O-N 2.95Å
286G85Confident86.9Confident72 Ų7268 Ų6874%0.74235%0.352SS*.THydrogen-bonded Turntrans76.9-1.6-177.800000116.5F284F284-G286 PolarHBondContact O-N 3.33Å; F284-G286 VanDerWaalsContact O-N 3.08Å
287K88.3Confident85Confident123 Ų12371.3 Ų71.354%0.53537%0.372SS..EExtended strand (participates in β ladder)trans-105.2146.7178.9-62.3168.7-173.6163.90110.6T283 F284 Q285T283-K287 CarbonylContact C-O 3.55Å; T283-K287 WeakPolarHBondContact CA-O 3.49Å; T283-K287 WeakPolarHBondContact CB-O 3.17Å; F284-K287 PolarHBondContact N-O 3.17Å; F284-K287 PolarHBondContact O-N 3Å; Q285-K287 VanDerWaalsContact C-N 3.3Å; Q285-K287 PolarHBondContact O-N 2.95Å
288P87.6Confident83.2Confident80 Ų8074.8 Ų74.852%0.51939%0.393SS..EExtended strand (participates in β ladder)trans-63.5140.2177.627.9-35.2000112.1K282K282-P288 WeakPolarHBondContact O-CA 3.28Å
289I89.4Confident81.3Confident3 Ų375.6 Ų75.62%0.01540%0.399CS..  trans-84.7124.1177.9-56.7176.1000110L225 L240 R278 V281 K282 F284 A291L225-I289 HydrophobicContact CD2-CG2 3.83Å; L240-I289 HydrophobicContact CD1-CD1 4.44Å; R278-I289 PolarHBondContact NH1-O 2.73Å; V281-I289 HydrophobicContact CB-CD1 4.11Å; V281-I289 HydrophobicContact CG1-CD1 3.45Å; V281-I289 VanDerWaalsContact CG1-CD1 3.45Å; K282-I289 PolarHBondContact O-N 2.89Å; F284-I289 HydrophobicContact CB-CD1 3.81Å; F284-I289 HydrophobicContact CB-CG1 3.62Å; I289-A291 HydrophobicContact CG2-CB 4.4Å; I289-A291 PolarHBondContact O-N 3.31Å
290M89.2Confident79.5Confident79 Ų7971.5 Ų71.539%0.38938%0.379SS..  trans-99.759.1-179-77.2-68.4-86.900113.1R226 E227R226-M290 HydrophobicContact CB-CB 3.96Å; R226-M290 WeakPolarHBondContact CB-O 3.44Å; R226-M290 PolarHBondContact N-O 3.21Å; R226-M290 PolarHBondContact O-N 2.98Å; E227-M290 HydrophobicContact CG-CB 4.39Å; E227-M290 WeakPolarHBondContact OE1-CG 3.46Å; E227-M290 WeakPolarHBondContact OE2-CG 3.39Å
291A93.4Very high77.6Confident2 Ų269.4 Ų69.42%0.01738%0.378CS..  trans-65.1147.7173.400000113I223 I224 L225 Y274 L277 R278 I289I223-A291 HydrophobicContact CG2-CB 4.27Å; I224-A291 CarbonylContact O-C 3.52Å; I224-A291 WeakPolarHBondContact O-CA 3.35Å; L225-A291 HydrophobicContact CD2-CB 3.69Å; Y274-A291 HydrophobicContact CD2-CB 4.08Å; Y274-A291 HydrophobicContact CE2-CB 3.85Å; Y274-A291 WeakPolarHBondContact CE2-O 3.21Å; L277-A291 HydrophobicContact CB-CB 4.46Å; L277-A291 HydrophobicContact CD1-CB 3.94Å; R278-A291 PolarHBondContact NH2-O 3.04Å; I289-A291 HydrophobicContact CG2-CB 4.4Å; I289-A291 PolarHBondContact O-N 3.31Å
292R92.7Very high75.9Confident114 Ų11476.2 Ų76.243%0.4341%0.406SS..EExtended strand (participates in β ladder)trans-149.3143.9162.963.8180-175.6152.26.2110.5I224I224-R292 HydrophobicContact CB-CG 3.89Å; I224-R292 HydrophobicContact CD1-CG 4.46Å; I224-R292 PolarHBondContact N-O 3.03Å; I224-R292 PolarHBondContact O-N 3.46Å
293I90.8Very high74.2Confident47 Ų4777 Ų7724%0.24142%0.416CS..EExtended strand (participates in β ladder)trans-69.3134.2169.8-56.8-179.3000109.1R220 Q271 Y274 A295R220-I293 HydrophobicContact CB-CG2 3.75Å; Q271-I293 HydrophobicContact CG-CD1 3.88Å; Y274-I293 HydrophobicContact CD1-CD1 4.01Å; Y274-I293 HydrophobicContact CD1-CG1 4.09Å; Y274-I293 HydrophobicContact CD2-CG1 3.9Å; Y274-I293 HydrophobicContact CG-CD1 3.89Å; Y274-I293 HydrophobicContact CG-CG1 3.63Å; I293-A295 PolarHBondContact O-N 2.89Å
294K88.1Confident72Confident57 Ų5776.3 Ų76.325%0.24842%0.424CS..PPolyproline II helixtrans-66.5125.1175.2-167.3163179.3-178.70108.5I222 I224I222-K294 HydrophobicContact CB-CB 3.94Å; I222-K294 HydrophobicContact CB-CD 3.75Å; I222-K294 HydrophobicContact CB-CG 4.48Å; I222-K294 HydrophobicContact CD1-CD 3.97Å; I222-K294 HydrophobicContact CG1-CD 4.44Å; I222-K294 HydrophobicContact CG2-CB 4.11Å; I222-K294 HydrophobicContact CG2-CD 3.51Å; I222-K294 WeakPolarHBondContact O-CB 3.43Å; I222-K294 PolarHBondContact O-N 3.4Å; I224-K294 HydrophobicContact CD1-CB 3.95Å; I224-K294 HydrophobicContact CD1-CD 4.23Å; I224-K294 HydrophobicContact CD1-CG 3.94Å; I224-K294 HydrophobicContact CG1-CB 3.93Å; I224-K294 HydrophobicContact CG1-CD 4.31Å; I224-K294 HydrophobicContact CG1-CG 4.31Å
295A74.3Confident69.6Low73 Ų7384 Ų8460%0.60345%0.453SS*.PPolyproline II helixtrans-64.1140.9171.700000109.6I293 N297I293-A295 PolarHBondContact O-N 2.89Å; A295-N297 PolarHBondContact O-N 3.3Å; A295-N297 VanDerWaalsContact O-N 3.08Å
296I69.8Low67.2Low49 Ų4988 Ų8825%0.25146%0.464SS..PPolyproline II helixtrans-54.9118.3165.2-42169.9000106.3H218 R220 T298H218-I296 HydrophobicContact CB-CG2 4.15Å; H218-I296 WeakPolarHBondContact O-CD1 3.24Å; H218-I296 WeakPolarHBondContact O-CG1 3.42Å; H218-I296 WeakPolarHBondContact O-CG2 3.46Å; R220-I296 HydrophobicContact CG-CD1 4.1Å; R220-I296 HydrophobicContact CG-CG1 3.38Å; I296-T298 HydrophobicContact CB-CG2 4.04Å; I296-T298 HydrophobicContact CG2-CG2 3.72Å; I296-T298 PolarHBondContact O-N 2.93Å
297N53.8Low64.8Low96 Ų9688.5 Ų88.551%0.51346%0.456SS..  trans-80.875.7167.9-170.292.1000107.5R155 A295 F299R155-N297 PolarHBondContact NH2-ND2 2.68Å; R155-N297 VanDerWaalsContact NH2-ND2 3.2Å; A295-N297 PolarHBondContact O-N 3.3Å; A295-N297 VanDerWaalsContact O-N 3.08Å; N297-F299 VanDerWaalsContact C-N 3.26Å; N297-F299 VanDerWaalsContact ND2-CD2 3.35Å; N297-F299 WeakPolarHBondContact ND2-CD2 3.41Å; N297-F299 PolarHBondContact O-N 2.89Å
298T53.7Low62.4Low73 Ų7389.5 Ų89.545%0.44846%0.464SS..  trans-59.188.5175.947.80000109.1I296 F300 A301I296-T298 HydrophobicContact CB-CG2 4.04Å; I296-T298 HydrophobicContact CG2-CG2 3.72Å; I296-T298 PolarHBondContact O-N 2.93Å; T298-F300 PolarHBondContact O-N 3.06Å; T298-F300 VanDerWaalsContact O-N 3.17Å; T298-A301 WeakPolarHBondContact O-CB 3.28Å; T298-A301 PolarHBondContact O-N 2.89Å
299F50.8Low59.8Low111 Ų11191.6 Ų91.649%0.48747%0.471SS..THydrogen-bonded Turntrans-59.3-26.6178.8-118.3-79.4000111.1R155 N297 A301R155-F299 HydrophobicContact CG-CD2 4.2Å; R155-F299 HydrophobicContact CG-CE2 4.34Å; N297-F299 VanDerWaalsContact C-N 3.26Å; N297-F299 VanDerWaalsContact ND2-CD2 3.35Å; N297-F299 WeakPolarHBondContact ND2-CD2 3.41Å; N297-F299 PolarHBondContact O-N 2.89Å; F299-A301 VanDerWaalsContact C-N 3.34Å
300F52.1Low57.1Low56 Ų5697.7 Ų97.725%0.24651%0.514CS..THydrogen-bonded Turntrans-93.719.1179.1-39-54.1000113.1L158 M165 Q172 H218 T298 K302L158-F300 HydrophobicContact CD2-CE2 3.86Å; L158-F300 HydrophobicContact CD2-CZ 3.65Å; L158-F300 HydrophobicContact CG-CZ 3.89Å; M165-F300 HydrophobicContact CE-CD1 4.07Å; M165-F300 HydrophobicContact CE-CE1 3.29Å; M165-F300 HydrophobicContact CE-CZ 3.72Å; M165-F300 HydrophobicContact SD-CD1 3.71Å; M165-F300 HydrophobicContact SD-CE1 3.58Å; M165-F300 VanDerWaalsContact SD-CE1 3.58Å; M165-F300 HydrophobicContact SD-CZ 4.34Å; Q172-F300 HydrophobicContact CG-CD2 4.48Å; H218-F300 AromaticContact NE2-CD2 3.96Å; H218-F300 AromaticContact NE2-CE2 3.7Å; T298-F300 PolarHBondContact O-N 3.06Å; T298-F300 VanDerWaalsContact O-N 3.17Å; F300-K302 PolarHBondContact O-N 3.05Å; F300-K302 VanDerWaalsContact O-N 3.14Å
301A45.6Very low54.6Low53 Ų5398.2 Ų98.244%0.43853%0.526SS..  trans-55.9120.2165.600000108.5T298 F299 N303T298-A301 WeakPolarHBondContact O-CB 3.28Å; T298-A301 PolarHBondContact O-N 2.89Å; F299-A301 VanDerWaalsContact C-N 3.34Å; A301-N303 PolarHBondContact O-N 2.9Å
302K49.3Very low51.8Low173 Ų173106.4 Ų106.475%0.75257%0.568SS**SBendtrans-76.644.3-160.1-148.2166.5-174.4170.70113.9F300F300-K302 PolarHBondContact O-N 3.05Å; F300-K302 VanDerWaalsContact O-N 3.14Å
303N45.1Very low49.2Very low152 Ų152111.6 Ų111.681%0.81359%0.589SS**SBendtrans-109.956.5-168.1-70.712.4000111.7A301A301-N303 PolarHBondContact O-N 2.9Å
304G40.7Very low46.4Very low59 Ų59113.8 Ų113.861%0.60861%0.614SS**SBendtrans-172.2-68175.500000111.5R306G304-R306 PolarHBondContact O-N 3.22Å; G304-R306 VanDerWaalsContact O-N 3.07Å
305Y36.3Very low43.7Very low185 Ų185119.2 Ų119.273%0.72564%0.641SS**  trans-68.2106.2172.1-113.6-106.8000110.5M308Y305-M308 HydrophobicContact CD1-CE 4.18Å; Y305-M308 HydrophobicContact CD1-SD 3.96Å; Y305-M308 HydrophobicContact CE1-CE 3.56Å; Y305-M308 HydrophobicContact CE1-SD 3.46Å; Y305-M308 WeakPolarHBondContact CE1-SD 3.26Å
306R36.2Very low41.8Very low191 Ų191124.1 Ų124.172%0.72165%0.651SS**  trans-63.2145.7149.3-57.3-65.6177.4-109.7-1.4107G304 M308G304-R306 PolarHBondContact O-N 3.22Å; G304-R306 VanDerWaalsContact O-N 3.07Å; R306-M308 PolarHBondContact O-N 3.44Å
307S34.4Very low40Very low82 Ų82127 Ų12757%0.57368%0.676SS**  trans-57.1131.2160.4-61.10000108D309S307-D309 WeakPolarHBondContact CB-OD1 3.43Å; S307-D309 PolarHBondContact O-N 2.87Å; S307-D309 VanDerWaalsContact O-N 3.09Å
308M37.8Very low39.1Very low144 Ų144130 Ų13071%0.70969%0.687SS**  trans-74.692157.7-66.878.6-175.700105.5Y305 R306 S310Y305-M308 HydrophobicContact CD1-CE 4.18Å; Y305-M308 HydrophobicContact CD1-SD 3.96Å; Y305-M308 HydrophobicContact CE1-CE 3.56Å; Y305-M308 HydrophobicContact CE1-SD 3.46Å; Y305-M308 WeakPolarHBondContact CE1-SD 3.26Å; R306-M308 PolarHBondContact O-N 3.44Å; M308-S310 PolarHBondContact O-N 3.22Å
309D32.3Very low38Very low125 Ų125134.7 Ų134.767%0.66871%0.709SS**  trans-58.2126.2-175.7-66.2-44000110.1S307 S311S307-D309 WeakPolarHBondContact CB-OD1 3.43Å; S307-D309 PolarHBondContact O-N 2.87Å; S307-D309 VanDerWaalsContact O-N 3.09Å; D309-S311 PolarHBondContact O-N 3.01Å
310S33.7Very low37.2Very low131 Ų131137.5 Ų137.592%0.91672%0.723SS**  trans-72.682.2-178.6-1690000109.3M308M308-S310 PolarHBondContact O-N 3.22Å
311S35.8Very low36.2Very low90 Ų90139.8 Ų139.863%0.62975%0.747SS**  trans-141.646.3-166.8-68.70000111.9D309D309-S311 PolarHBondContact O-N 3.01Å
312L34.1Very low35.7Very low173 Ų173145 Ų14591%0.90676%0.762SS**SBendtrans-90.70.9174.4-83171.3000114.5
313Y38.4Very low34.9Very low223 Ų223147.5 Ų147.588%0.87577%0.768SS**  trans-13776.4172.8-104.1-89.5000111.8
314A32.9Very low34.1Very low93 Ų93145.5 Ų145.577%0.76977%0.766SS**  trans-120.1107.3157.800000107.1Q316A314-Q316 PolarHBondContact O-N 3.39Å
315Q31Very low33.5Very low172 Ų172147.8 Ų147.880%0.80477%0.772SS**  trans-70.5132.4-165.7-169.5170.7-67.100112.1S317Q315-S317 PolarHBondContact O-N 2.87Å
316Q34.2Very low34Very low175 Ų175144.5 Ų144.582%0.81877%0.774SS**  trans-66.8102177.1-174.4179.21900110.7A314A314-Q316 PolarHBondContact O-N 3.39Å
317S31.2Very low34Very low110 Ų110143.4 Ų143.477%0.76978%0.782SS**  trans-110119.1167.451.80000110.1Q315Q315-S317 PolarHBondContact O-N 2.87Å
318Q35.2Very low34.1Very low160 Ų160149 Ų14975%0.74879%0.792SS**  trans-78.9146.2175.8-65.1171.9-24.400110
319N30Very low34.1Very low171 Ų171149.1 Ų149.191%0.91479%0.792SS**  trans-145137.8144.7-131.8-22.1000109.8
320Q35.2Very low34.1Very low169 Ų169151 Ų15179%0.7980%0.797SS**  trans-96.9137.8-173.3-60.9-178.215.200111.4
321S30.4Very low34.2Very low105 Ų105151.7 Ų151.773%0.73479%0.785SS**  trans-168.5110.5132.145.80000111.7
322Q36Very low34Very low162 Ų162153.6 Ų153.676%0.75779%0.793SS**  27.1118.2129.9-59.8167.5-15.400117.9
323Y31.6Very low34Very low226 Ų226155.7 Ų155.789%0.88679%0.79SS**  -169.6174.5101.5-108.7-77000111.8
324S28.6Very low34.2Very low110 Ų110150.9 Ų150.977%0.76979%0.786SS**PPolyproline II helixtrans-78.5155.5-164.6-165.20000115.2
325S28.9Very low34.2Very low106 Ų106154.8 Ų154.874%0.74179%0.788SS**PPolyproline II helixtrans-98.9125.5169.4-175.70000110.5
326P46.2Very low34.5Very low116 Ų116154.8 Ų154.875%0.75379%0.789SS**PPolyproline II helixtrans-81.3130.1179.131.4-32.8000112.3
327L35.8Very low34.6Very low169 Ų169154.7 Ų154.789%0.88579%0.788SS**PPolyproline II helixtrans-65.8144.9161.7-65.9164.6000109.7
328Y37.7Very low34.4Very low200 Ų200160.2 Ų160.278%0.78479%0.794SS**  trans-110.4143.4162.5-162.2-87.5000110.2H331Y328-H331 AromaticContact CE1-NE2 3.78Å; Y328-H331 PolarHBondContact OH-NE2 3.32Å
329M36.4Very low35.1Very low146 Ų146157.6 Ų157.672%0.71979%0.791SS**PPolyproline II helixtrans-95.5153.9-161.2-78.3-125.465.400115.6
330Q32.8Very low35.3Very low163 Ų163155.5 Ų155.576%0.76278%0.784SS**PPolyproline II helixtrans-52.5133.4156.6-167.890.2-5.700110.5
331H36.3Very low35.3Very low146 Ų146157.8 Ų157.868%0.67679%0.787SS**PPolyproline II helixtrans-95.3135.1166.5-76.9-83.4000110.7Y328Y328-H331 AromaticContact CE1-NE2 3.78Å; Y328-H331 PolarHBondContact OH-NE2 3.32Å
332V30.3Very low35.4Very low130 Ų130155.9 Ų155.979%0.78878%0.783SS**  trans-106.5136.8179.5176.20000109.5
333Y35.2Very low35.5Very low218 Ų218155.4 Ų155.486%0.85578%0.784SS**PPolyproline II helixtrans-97.4141.4171-88.8-91.8000111.1
334P43.4Very low36.2Very low122 Ų122151.2 Ų151.279%0.79278%0.782SS**PPolyproline II helixtrans-83.1155.3172.833.6-34000113.2
335Q31.9Very low37.4Very low174 Ų174151.1 Ų151.181%0.81378%0.779SS**PPolyproline II helixtrans-76.7145.2178.7-96.1-84.116.900114
336Q38.3Very low38.9Very low173 Ų173150.9 Ų150.981%0.80878%0.775SS**  trans-149108.7149.2-74.1-156.210.300113.2
337Q34.7Very low38.4Very low173 Ų173150.9 Ų150.981%0.80877%0.772SS**  trans55.1128.8133.6-64.1175.9-21.200123
338Y27.4Very low38.5Very low226 Ų226153.7 Ų153.789%0.88677%0.771SS**  trans-63.7-177.5173.4-83.1-82000116.7
339P50.6Low38.5Very low105 Ų105150.2 Ų150.268%0.68277%0.771SS**  cis-134.6-168.8-7.421.35.1000116.2
340V34Very low39.3Very low126 Ų126148.8 Ų148.876%0.76477%0.773SS**  trans89.6138.6162.5-174.40000115.5
341Y35Very low39.4Very low218 Ų218146.3 Ų146.386%0.85577%0.774SS**  cis-121.8-143.5-3.5-138.1-29.3000111.2
342G32.9Very low40.5Very low64 Ų64145.1 Ų145.166%0.6678%0.779SS**  cis95.4140.68.600000114
343I37.3Very low41Very low152 Ų152145.1 Ų145.178%0.77978%0.779SS**  cis-130.4134.4-1.4-71.7165.5000109.7
344V46.3Very low41.8Very low139 Ų139140.1 Ų140.184%0.84277%0.773SS**  trans-153.7140.5159-1610000107.5
345P54.1Low41.4Very low108 Ų108144 Ų14470%0.70177%0.774SS**  -157.6-168.5122.140.9-22.7000113.5
346P59.6Low41.4Very low101 Ų101142.4 Ų142.466%0.65677%0.765SS**  cis-120.1172.9-26.519.73.4000112.6
347T36Very low41.2Very low115 Ų115141.2 Ų141.271%0.70676%0.759SS**  157.4169.397.6470000107.5
348W37.5Very low41.4Very low228 Ų228138.7 Ų138.786%0.86476%0.755SS**  cis-159.2152.4-31-104.7140.5000108.7
349T39.3Very low43Very low127 Ų127133.4 Ų133.478%0.77975%0.749SS**  trans-156.4154.6178.153.70000112.9
350P53.3Low42.5Very low117 Ų117137 Ų13776%0.7676%0.762SS**  trans-136.4136.7136.326.1-7.7000112.6
351S34.8Very low42.7Very low111 Ų111135 Ų13578%0.77676%0.758SS**  78.5155.970.894.30000114.6
352P58.6Low43.4Very low120 Ų120129.4 Ų129.478%0.77975%0.748SS**  cis-129.7-165.81.241.9-24000115.5
353T40.2Very low43.4Very low130 Ų130135.3 Ų135.380%0.79876%0.756SS**  trans-115174.5-175.262.30000112.5
354P53.2Low43.9Very low113 Ų113133 Ų13373%0.73475%0.751SS**  -160.3170.277.444.1-23.6000119.4
355Y34Very low43.2Very low203 Ų203134 Ų13480%0.79675%0.751SS**  trans53.4155.3147-103.5-145.8000122.2
356F32.1Very low42.2Very low142 Ų142134.5 Ų134.562%0.62376%0.758SS**  cis-145.7-161.6-3.2-167.4-130.9000112
357E34Very low41Very low147 Ų147132.5 Ų132.569%0.68776%0.755SS**  trans-119.2-175.3-155.6-158.5-179.5167.300114
358T39.1Very low41.3Very low120 Ų120136.2 Ų136.274%0.73676%0.762SS**  trans88.2148.4165.558.80000119.9
359P61.3Low41.2Very low116 Ų116131.1 Ų131.175%0.75376%0.756SS**  trans-117.7177.5-158.543.1-31.5000114.3
360L40.5Very low41.1Very low181 Ų181132.7 Ų132.795%0.94876%0.759SS**  trans-153.6173.9160.7-112.3160.7000113.4
361A37.3Very low40Very low82 Ų82129.8 Ų129.868%0.67875%0.751SS**  trans-94.7166.9-153.100000115.7
362P50.2Low40.2Very low101 Ų101134.8 Ų134.866%0.65676%0.759SS**  trans-86.2-167.8179.636.6-37.6000113.9
363F33.3Very low39Very low189 Ų189132.3 Ų132.383%0.82976%0.755SS**  trans90.4169.2176.7-44.3-63.3000115.2
364P47.3Very low38.6Very low104 Ų104132.6 Ų132.668%0.67576%0.762SS**  -139.9160.6-84.540-22.5000117.3
365N32.3Very low38Very low158 Ų158132.2 Ų132.285%0.84577%0.768SS**  trans66.1156.8157.5-74.5-38.3000119.9
366S32.5Very low38.1Very low120 Ų120125.7 Ų125.784%0.83976%0.763SS**  trans66.7140.4-179.9-148.10000114.6
367G35.2Very low38.2Very low58 Ų58127.8 Ų127.860%0.59877%0.774SS**  cis171.5168.1-3.400000110.2
368F41.3Very low38.2Very low194 Ų194129.5 Ų129.585%0.85178%0.776SS**  trans66.1105.3172.6-60.5-85.9000119
369V36.2Very low38.2Very low120 Ų120131.9 Ų131.973%0.72778%0.776SS**  40121.6115.7178.70000118.9
370N35.5Very low36.9Very low160 Ų160130.8 Ų130.886%0.85678%0.777SS**  trans40.3136.7153.5-66.9-20.1000119.6
371G31.4Very low36.3Very low56 Ų56125.6 Ų125.658%0.57777%0.766SS**  cis121.216225.800000109.8
372F38.4Very low36.1Very low217 Ų217127 Ų12795%0.95277%0.772SS**  trans65.9131.3-156-60.3-96.3000112.6
373G33.6Very low35.2Very low67 Ų67128.7 Ų128.769%0.69178%0.78SS**  cis114.9119.3-1300000114.7
374S32.9Very low35.1Very low136 Ų136123.1 Ų123.195%0.95177%0.769SS**  trans-165.3162.6157.4-84.40000109.1
375A39.3Very low34.5Very low105 Ų105125.9 Ų125.987%0.86878%0.777SS**  trans-136.1158.6-170.700000112.8
376G35.5Very low34.4Very low66 Ų66124.6 Ų124.668%0.6877%0.77SS**  trans106.2133155.200000116.5
377H34.7Very low34.7Very low187 Ų187126.1 Ų126.187%0.86677%0.768SS**  trans-150.7165.9147.5-9876.1000107.6
378Y34.4Very low34.5Very low183 Ų183130 Ų13072%0.71878%0.781SS**  trans-135.9171.2-161.645.3-127.9000112.8
379K38.6Very low34.4Very low170 Ų170131.2 Ų131.274%0.73978%0.78SS**  cis-131.116118.1-55.2-90.3178178.90110.5
380A34.9Very low35Very low93 Ų93130.9 Ų130.977%0.76978%0.78SS**  cis84.586.39.500000118.5
381G28.2Very low34.8Very low71 Ų71132.7 Ų132.773%0.73278%0.781SS**  trans-175.5146.2161.500000111.1
382S32.4Very low34.7Very low113 Ų113136.6 Ų136.679%0.7979%0.788SS**  cis-157.7164.7-7.3-89.90000109.2
383T31Very low34.5Very low135 Ų135136.7 Ų136.783%0.82878%0.782SS**  cis-115-131.46.1-29.30000109.9
384A31.5Very low34.3Very low72 Ų72139.4 Ų139.460%0.59578%0.781SS**  cis-138-142.4-0.200000110N386A384-N386 PolarHBondContact O-ND2 2.94Å
385L35.3Very low34.4Very low163 Ų163143.5 Ų143.585%0.85378%0.776SS**  trans-123.4131.2-173.8-53.9174.7000109.6
386N29.8Very low34.3Very low131 Ų131144.8 Ų144.870%0.70177%0.772SS**  cis76.2146.937-66-62.5000114.9A384A384-N386 PolarHBondContact O-ND2 2.94Å
387L38.1Very low34.8Very low151 Ų151146.6 Ų146.679%0.79177%0.772SS**  cis178.2129.7-27.6175.373000108
388T30.6Very low34.8Very low141 Ų141145.8 Ų145.887%0.86577%0.773SS**  trans-157.7144.1159.340000114.8
389R40.1Very low34.9Very low219 Ų219145.5 Ų145.583%0.82677%0.772SS**  trans-95.7-171.5157-71.8-178.7168.1-129.43.6109.3
390P48.1Very low34.8Very low112 Ų112143 Ų14373%0.72778%0.775SS**  -148.2166.698.740.5-25.9000118
391F30.9Very low35Very low199 Ų199148.1 Ų148.187%0.87378%0.775SS**  trans65.4164.1157-73.4-60.3000123.6
392N30.3Very low35.4Very low137 Ų137153.5 Ų153.573%0.73378%0.778SS**  trans-175.4129.5-150.9-175.1-18.4000110.9
393R35Very low36Very low219 Ų219154.9 Ų154.983%0.82678%0.777SS**  trans159.6145.7165.2-90.2142.781.9125.6-7.6107.8
394N28.8Very low36.3Very low125 Ų125154.8 Ų154.867%0.66878%0.776SS**  cis-145.2137.510.7-96.1-42.1000113.5
395R35.4Very low36.6Very low222 Ų222159.4 Ų159.484%0.83879%0.789SS**  trans43114.9135.9-62.6-172.7179.8-139.9-2.2123.3
396V35.8Very low36.9Very low132 Ų132158.8 Ų158.880%0.879%0.786SS**  28.4151.7123.9-75.60000122.1
397P46.6Very low37.4Very low103 Ų103156.4 Ų156.467%0.66979%0.785SS**  cis-138160.52941.2-23.6000119.5Y399P397-Y399 HydrophobicContact CG-CD2 4.5Å
398L35.7Very low37.5Very low171 Ų171159.6 Ų159.690%0.89579%0.793SS**  trans-71.8135.2154.1-73.8167.3000110
399Y35.3Very low38Very low177 Ų177163.5 Ų163.569%0.69479%0.792SS**  trans-119.593.7157.3-106.2-72000110.1P397 R401P397-Y399 HydrophobicContact CG-CD2 4.5Å; Y399-R401 HydrophobicContact CD1-CG 3.79Å; Y399-R401 HydrophobicContact CE1-CG 4.46Å; Y399-R401 PolarHBondContact O-N 3.35Å
400S37.4Very low37.6Very low116 Ų116159.5 Ų159.581%0.81179%0.787SS**  trans-73.8105.3155.6-178.30000107.6
401R38.2Very low37.1Very low202 Ų202162 Ų16276%0.76279%0.788SS**  trans-110.1103.1164.1-70.5-158.4-174.2-1544.6109.4Y399Y399-R401 HydrophobicContact CD1-CG 3.79Å; Y399-R401 HydrophobicContact CE1-CG 4.46Å; Y399-R401 PolarHBondContact O-N 3.35Å
402K36.5Very low37.1Very low183 Ų183159.5 Ų159.580%0.79679%0.789SS**  trans-77.9140.4163.9-166.5158.6-177.7174.50108.4
403N45.1Very low37.5Very low142 Ų142161.5 Ų161.576%0.75979%0.791SS**  trans65.470.4168.3-60.68.1000119.2
404V37.3Very low37.4Very low134 Ų134157.5 Ų157.581%0.81279%0.794SS**  trans-141.4121.3130-171.40000103.8
405I38.7Very low37.3Very low168 Ų168158.7 Ų158.786%0.86280%0.795SS**SBendcis-126.3113.444.1-60153.7000111.1
406N41.7Very low37.1Very low150 Ų150154 Ų15480%0.80279%0.786SS**  trans-158.967.2151.5-159.712.6000110.6
407A38.8Very low36.7Very low81 Ų81159.6 Ų159.667%0.66979%0.792SS**  trans-144.834.8-172.700000114
408F40.7Very low36.1Very low219 Ų219160.6 Ų160.696%0.96180%0.797SS**SBendtrans-153.159.7163-93.1-60.8000111.6
409R41.1Very low35.8Very low222 Ų222157.8 Ų157.884%0.83879%0.792SS**  trans-145.474.9165.6-171.1172.5-78.9-166.5-3.5111.8
410N32.4Very low35.5Very low136 Ų136157.8 Ų157.873%0.72780%0.798SS**  trans-176.2120.2161.6-95-25.3000105.5
411H37.1Very low35.3Very low164 Ų164157.9 Ų157.976%0.75979%0.793SS**  cis-148.1137.32.8-40-101.1000111
412V32.1Very low34.8Very low147 Ų147154.6 Ų154.689%0.89180%0.796SS**  trans-148.4142.8149.8176.50000107.7
413K38.3Very low34.4Very low178 Ų178150.9 Ų150.977%0.77480%0.799SS**  trans-89.8141.8176.1-59.4169.5-178.4172.50110.8Q415K413-Q415 PolarHBondContact O-N 2.95Å
414P31.5Very low33.6Very low136 Ų136148.6 Ų148.688%0.88380%0.8SS**  trans-78.3103.3151.631.6-27.3000108.2
415Q27.7Very low33.2Very low150 Ų150147.6 Ų147.670%0.70180%0.799SS**  trans-99.1143.1165.8-117.1-84.7-6000109.3K413K413-Q415 PolarHBondContact O-N 2.95Å
416I31.7Very low32.8Very low124 Ų124147 Ų14764%0.63680%0.796SS**  trans-43.2140173.7-66.9152.4000111.2T418I416-T418 HydrophobicContact CG2-CG2 4Å
417R27.1Very low32Very low249 Ų249145.7 Ų145.794%0.9479%0.794SS**  trans-88.8113.4162.5-82.1-169.6173.4138.2-0.2110
418T33Very low32.6Very low123 Ų123146.9 Ų146.976%0.75580%0.795SS**  trans-129.1107.3158.844.30000108.3I416I416-T418 HydrophobicContact CG2-CG2 4Å
419S29.9Very low32.1Very low113 Ų113143 Ų14379%0.7979%0.788SS**  trans-75.2143.2155.846.10000109
420E30.3Very low32.1Very low176 Ų176137.6 Ų137.682%0.82278%0.782SS**  cis-165.3-179.7-10.5-166.4164.6-147.600108
421V31.8Very low32.1Very low118 Ų118138.4 Ų138.472%0.71579%0.786SS**  trans71.287.6164.5-163.90000118.4
422T28.8Very low31.9Very low134 Ų134138 Ų13882%0.82278%0.784SS**  34.3119.7116.1-40.20000121.3
423A27.5Very low31.9Very low105 Ų105135.6 Ų135.687%0.86877%0.774SS**  -177.4166.5123.600000111.9
424A28.7Very low31.9Very low94 Ų94134.2 Ų134.278%0.77777%0.774SS**  trans-121140.2-159.200000116.6
425S29.4Very low31.8Very low113 Ų113134.2 Ų134.279%0.7977%0.772SS**  trans73.1155.4132.9-150.30000123
426I29.6Very low31.8Very low154 Ų154130.1 Ų130.179%0.7977%0.77SS**  trans85.1143.8162.7-43.5-170.9000118.8
427T25.2Very low31.7Very low124 Ų124132.4 Ų132.476%0.76178%0.782SS**  trans-96.6-171.4-172.446.90000112.8
428P51.1Low31.8Very low106 Ų106131.3 Ų131.369%0.68878%0.778SS**  cis-136.8175.7-44.335.4-18.6000114.8
429V29.2Very low31.7Very low136 Ų136130.5 Ų130.582%0.82478%0.778SS**  trans68.9156.4147.5151.70000117.5
430P41.5Very low32.6Very low110 Ų110130.7 Ų130.771%0.71478%0.776SS**  cis-126.2-173.6-19.729.4-6.5000116
431L32.5Very low32.4Very low153 Ų153130.7 Ų130.780%0.80178%0.776SS**  trans2155.3131.3-122.763.9000118.7
432E33Very low33.3Very low156 Ų156130.1 Ų130.173%0.72978%0.775SS**  cis-141.517430.8-65.9-168.1111.500111.9
433S31.7Very low34.5Very low95 Ų95128.7 Ų128.766%0.66477%0.768SS**  cis-166.6143.245.2-63.50000115.6
434L38.3Very low34.8Very low150 Ų150129.9 Ų129.979%0.78576%0.764SS**  trans49138.5132.2-54.8175.9000120.5
435T30.4Very low34.8Very low136 Ų136133.3 Ų133.383%0.83477%0.768SS**  cis-160.1162.6337.70000108.4
436G28.3Very low34.9Very low64 Ų64131.2 Ų131.266%0.6676%0.763SS**  cis159.5163.5-2.900000112
437L29.5Very low35.2Very low172 Ų172128.8 Ų128.890%0.90177%0.766SS**  trans68.4151.4167.6-51.6178.3000117.8
438R27.3Very low36.5Very low226 Ų226128.3 Ų128.385%0.85377%0.765SS**  cis-170.2128.7-17.7169.3178.5-178.61740.4112
439S30.9Very low35.7Very low106 Ų106130.1 Ų130.174%0.74178%0.775SS**  trans12160.9139.2-120.40000122.7
440P49.2Very low35.7Very low117 Ų117127.9 Ų127.976%0.7677%0.765SS**  cis-142.8-160.2-30.137.5-14.1000115.7
441Q27.6Very low35.1Very low176 Ų176127.9 Ų127.982%0.82276%0.763SS**  trans-50.4-179.5165.4-102.1-167.4-33.300118.1
442P49.4Very low35.1Very low106 Ų106128.7 Ų128.769%0.68876%0.762SS**  cis-127.5-97.5-24.628-3.2000120.2
443P54.9Low34.9Very low104 Ų104129.6 Ų129.668%0.67577%0.767SS**  -141.7179.4-129.942.4-18.9000122
444V32.2Very low34.8Very low129 Ų129130.2 Ų130.278%0.78277%0.767SS**  trans75.6155.3157.3-140.70000122.3
445I30.3Very low34.4Very low167 Ų167129.1 Ų129.186%0.85677%0.766SS**  trans79.1145.4163-52178.7000115.6
446G30.1Very low34.5Very low68 Ų68126.9 Ų126.970%0.70176%0.762SS**  cis157.9-151.5-3.500000112.4
447A35.8Very low34.7Very low103 Ų103130.9 Ų130.985%0.85177%0.768SS**  trans98.9157167.200000120.2
448P54Low35.2Very low114 Ų114129 Ų12974%0.7476%0.757SS**  trans-136.9-177.5-150.746.5-30000117.7
449T33.2Very low35.4Very low145 Ų145124.1 Ų124.189%0.8975%0.753SS**  trans173173.9152.820.10000109.7
450S28.9Very low35.6Very low88 Ų88124.4 Ų124.462%0.61576%0.755SS**  -169.1140.8-58.3-176.20000111.9
451T29.7Very low34.8Very low111 Ų111123.1 Ų123.168%0.68175%0.754SS**  trans66.9161.9152.433.70000123.2
452H31.6Very low34.9Very low169 Ų169124 Ų12478%0.78276%0.756SS**  trans79.4119.8174.1-53.1-66.8000116.5
453Q30.5Very low33.9Very low176 Ų176123.2 Ų123.282%0.82275%0.752SS**  cis63.4127.111.7-87.9-167.812.800115.9
454T28.6Very low32.6Very low107 Ų107126.8 Ų126.866%0.65676%0.76SS**  cis-165.5171-9.2-19.90000109.8
455T29.2Very low32.6Very low127 Ų127128.6 Ų128.678%0.77976%0.764SS**  trans62.9131160.544.80000117.9
456A33.7Very low32.7Very low90 Ų90126 Ų12674%0.74476%0.761SS**  72.6139.657.100000112.4
457D32.8Very low33Very low147 Ų147128 Ų12879%0.78677%0.765SS**  cis-149.6-157.1-3.4-163.634.8000107.5
458I40Very low32.9Very low132 Ų132128.3 Ų128.368%0.67776%0.76SS**  cis-156176.413.6-39.3154.8000109.2
459T30.9Very low31.6Very low124 Ų124128 Ų12876%0.76176%0.761SS**  trans102.4101.2152.164.50000122.4
460S35.8Very low31.3Very low113 Ų113126.2 Ų126.279%0.7976%0.755SS**  81.197.2115.5-165.90000123.1
461A31.5Very low31.3Very low89 Ų89126.9 Ų126.974%0.73676%0.759SS**  109130.1123.500000122.3
462F29.8Very low31.2Very low196 Ų196129.1 Ų129.186%0.8677%0.766SS**  trans78.4106.5151-106.8-109.2000122.4
463S28.4Very low31.1Very low88 Ų88128.5 Ų128.562%0.61577%0.768SS**  trans66.2127.4131.9-70.70000121.1
464Q28.5Very low31.8Very low179 Ų179125.5 Ų125.584%0.83676%0.764SS**  cis-141.8170-3.9-65.2-160.7-31.800112.5
465L31.8Very low31.7Very low167 Ų167126.8 Ų126.887%0.87477%0.767SS**  trans-65.7147.1-168-54.7165.2000114.1
466S30.9Very low31.8Very low112 Ų112127.2 Ų127.278%0.78377%0.765SS**  cis98.9149.318.2-60.60000116.9
467S38.1Very low31.6Very low112 Ų112129.6 Ų129.678%0.78377%0.765SS**  trans-122.5168.1-163.5-50.10000114
468S32.1Very low31.7Very low108 Ų108127.7 Ų127.776%0.75576%0.763SS**  trans102.2142.3151.3-41.60000119.3
469S28.5Very low31.3Very low108 Ų108125.3 Ų125.376%0.75577%0.771SS**  trans73.8155.4153.373.80000120.2
470S25.1Very low31.5Very low108 Ų108128.3 Ų128.376%0.75578%0.779SS**  trans19.5150.3146.250.60000121.3
471S30.3Very low31.5Very low101 Ų101127.4 Ų127.471%0.70678%0.778SS**  cis174.9-175-4.2-178.70000107
472L27.4Very low31.4Very low159 Ų159126.6 Ų126.683%0.83278%0.778SS**  trans84.2129.8164.2-48.4176.2000119.1
473D29.3Very low31.5Very low155 Ų155129.9 Ų129.983%0.82979%0.785SS**  trans-72.1171.4164.5-45.8-100.2000112.1
474P44.6Very low31.4Very low113 Ų113129 Ų12973%0.73479%0.79SS**  -151.7163.684.339.5-21.2000118
475N27.6Very low31.7Very low134 Ų134131.9 Ų131.972%0.71779%0.793SS**  trans62.7143.9160.1-75.249.5000118.8
476D30.1Very low31.9Very low137 Ų137135.4 Ų135.473%0.73380%0.795SS**  cis-140.9165.8-11.3-88.9-48.9000106.4
477D30.1Very low31.8Very low139 Ų139135.2 Ų135.274%0.74379%0.793SS**  cis-160.1160.635.6177.617.8000110.9
478S35Very low31.5Very low108 Ų108135.2 Ų135.276%0.75579%0.789SS**  trans62.8127.5152.7-79.10000123
479G32Very low31.7Very low81 Ų81135.7 Ų135.784%0.83579%0.787SS**  trans130.472.4143.700000119.1
480M35.5Very low31.9Very low187 Ų187142 Ų14292%0.92180%0.796SS**  trans-61.5146.5-176.2-85.7-73.2170.700118.6
481A33.9Very low32.5Very low94 Ų94148 Ų14878%0.77780%0.802SS**  trans69.1109.6139.600000122.9
482G30.8Very low32.5Very low72 Ų72146.2 Ų146.274%0.74280%0.8SS**  91.4126.593.900000121.2
483R30.8Very low32.7Very low266 Ų266145.6 Ų145.6100%1.00480%0.803SS**  trans69.9166.3166.7-51.6-179.3-175-108.80.8115.2
484G27.8Very low33.1Very low69 Ų69149 Ų14971%0.71180%0.804SS**  trans-154.8-160.2-173.900000115.4
485R34.3Very low32.9Very low240 Ų240155.4 Ų155.491%0.90681%0.814SS**  trans79.5156-167-60.8-178.2170.5-98.4-0.3115.4
486R35.9Very low33.1Very low241 Ų241159.1 Ų159.191%0.90982%0.818SS**  trans90.3129.3179.7-52.8169.3-148.6-121.75.8111.2
487S28.9Very low33.8Very low108 Ų108163.6 Ų163.676%0.75582%0.824SS**  cis75.4129.744.8-163.30000110.3
488T32.4Very low33.9Very low112 Ų112163.9 Ų163.969%0.68782%0.821SS**  cis-163.515810.3-121.20000112.2
489T35Very low33.9Very low117 Ų117168.4 Ų168.472%0.71883%0.83SS**  trans30.2141.7165.460.70000122.1
490Y32.9Very low34Very low240 Ų240171.1 Ų171.194%0.94182%0.821SS**  -135.8159.4126-132.2-96.8000111.9
491R37.3Very low34.1Very low234 Ų234171.1 Ų171.188%0.88381%0.811SS**  trans-143.5129.9-172.7-168.5-154.7-123.9-78.58.2110
492G31.6Very low34Very low65 Ų65173.6 Ų173.667%0.6781%0.811SS**  trans151.8156.2172.100000113
493T30Very low34.2Very low145 Ų145177.1 Ų177.189%0.8982%0.819SS**  cis-155165.1-15.8-23.50000109.8
494R37.7Very low34.3Very low227 Ų227174.4 Ų174.486%0.85781%0.808SS**  trans-92.3155170.4-79.2-177.2166-168.2-4.2111
495R41.1Very low34.6Very low248 Ų248177.5 Ų177.594%0.93682%0.816SS**  trans74.9153.6176.7-49.4165178.3152.8-4.4111.6
496R32.3Very low34.6Very low212 Ų212170.4 Ų170.480%0.880%0.799SS**  cis-141.7163.314.7175.9178.1169.4173.7-1.6110E498R496-E498 IonicContact CZ-OE2 3.05Å; R496-E498 IonicContact NE-OE2 2.76Å; R496-E498 PolarHBondContact NE-OE2 3.36Å; R496-E498 IonicContact NH2-OE1 2.66Å; R496-E498 IonicContact NH2-OE2 2.93Å; R496-E498 PolarHBondContact NH2-OE2 2.74Å
497R44.2Very low35Very low230 Ų230164.6 Ų164.687%0.86879%0.793SS**  trans-96129.3167.2157.9-171.6-88159.2-7.5108.9
498E33.1Very low35.1Very low145 Ų145167.6 Ų167.668%0.67880%0.799SS**  trans-177.1123.3149.2-104.9151.4138.400109.8R496R496-E498 IonicContact CZ-OE2 3.05Å; R496-E498 IonicContact NE-OE2 2.76Å; R496-E498 PolarHBondContact NE-OE2 3.36Å; R496-E498 IonicContact NH2-OE1 2.66Å; R496-E498 IonicContact NH2-OE2 2.93Å; R496-E498 PolarHBondContact NH2-OE2 2.74Å
499E34.8Very low35.3Very low203 Ų203166.6 Ų166.695%0.94980%0.802SS**  171.2172.3129.7-166137.9-148.200108.2
500E34.6Very low35.3Very low138 Ų138170.5 Ų170.565%0.64581%0.812SS**  trans-131.8161.2-155.8-153.8-154.5126.300113
501R36.7Very low35.5Very low187 Ų187165.4 Ų165.471%0.70681%0.806SS**  trans71.6107.7163.8-49.3173.8-162.9133.419.2117.9
502N31.5Very low35.3Very low147 Ų147164 Ų16479%0.78681%0.806SS**  -177.4137.498.4-93.7-21.7000114.6
503T35.8Very low35.6Very low146 Ų146167.1 Ų167.190%0.89681%0.812SS**  trans64.6153.7163.760.80000119.6
504R32.8Very low35.9Very low209 Ų209165 Ų16579%0.78980%0.803SS**  trans-152.3144-168.3-172-173.6-168.4-158.83.9109.4V506R504-V506 HydrophobicContact CG-CG2 4.1Å
505P34.6Very low36.3Very low133 Ų133159.6 Ų159.686%0.86480%0.797SS**  -126-176.8125.7-0.922.7000114.6
506V33.8Very low36.6Very low92 Ų92153.9 Ų153.956%0.55879%0.793SS**  trans-149.7140.3-167.4163.80000106.2R504R504-V506 HydrophobicContact CG-CG2 4.1Å
507P43.8Very low37.3Very low119 Ų119153.3 Ų153.377%0.77380%0.796SS**  -145.8-172.563.644-24.5000114.3
508L31.8Very low37.6Very low171 Ų171152 Ų15290%0.89580%0.797SS**  cis-134176.7-10.2-162.454.1000108.1
509A35.4Very low38.8Very low91 Ų91150.7 Ų150.775%0.75280%0.795SS**  trans-110.3152.7-172.300000114.6
510E36.3Very low39.8Very low198 Ų198148.3 Ų148.393%0.92579%0.787SS**  trans-143.4161.9149-151.4167.9-140.800110.7
511V37.1Very low40.9Very low134 Ų134143.6 Ų143.681%0.81277%0.773SS**  trans-102.9134.8-153.4177.80000113.5
512K32.6Very low41.7Very low203 Ų203139 Ų13988%0.88377%0.774SS**  trans-109.8112.4175.5-172.8167.4-175.2166.40111.9
513V37.6Very low43Very low131 Ų131138 Ų13879%0.79477%0.774SS**PPolyproline II helixtrans-72.3143.1177.2-1770000111
514S35.5Very low44.1Very low100 Ų100136.6 Ų136.670%0.69976%0.761SS**PPolyproline II helixtrans-96149.2177.1520000112.3
515P46.1Very low46Very low114 Ų114134.2 Ų134.274%0.7476%0.756SS**PPolyproline II helixtrans-69.7153.118029.1-35.6000112.5
516P49.1Very low47.6Very low129 Ų129133 Ų13384%0.83875%0.748SS**PPolyproline II helixtrans-69.9148.5-174.529-35.9000112.9
517K46.1Very low48.9Very low199 Ų199134.2 Ų134.287%0.86576%0.758SS**PPolyproline II helixtrans-90.3134.5166.9-69.8178.5179175.10109.5
518F49.8Very low49.5Very low202 Ų202135.3 Ų135.389%0.88676%0.757SS**PPolyproline II helixtrans-74.7123.1163.8-120.5-96.8000108.4
519D59.6Low50.3Low119 Ų119133.5 Ų133.564%0.63676%0.755SS**  trans-115.4123.2178.3-156.7-9.1000110.5A521 N524D519-A521 PolarHBondContact O-N 2.94Å; D519-A521 VanDerWaalsContact O-N 3.15Å; D519-N524 PolarHBondContact O-ND2 3.17Å
520L55.7Low51.2Low152 Ų152133 Ų13380%0.79676%0.759SS**  trans-91.141.2-169.1-69.9172.4000112.2
521A57Low51.6Low40 Ų40127.9 Ų127.933%0.33174%0.744SS.*  trans-64140.3168.400000110.5D519 T523 N524D519-A521 PolarHBondContact O-N 2.94Å; D519-A521 VanDerWaalsContact O-N 3.15Å; A521-T523 PolarHBondContact O-N 2.66Å; A521-N524 PolarHBondContact O-N 2.8Å
522A54.1Low52.2Low89 Ų89128.5 Ų128.574%0.73675%0.748SS**G310 helixtrans-60.9-17.3179.700000113.6N524 F525A522-N524 VanDerWaalsContact C-N 3.28Å; A522-N524 PolarHBondContact O-N 3.09Å; A522-F525 PolarHBondContact O-N 2.79Å
523T58.9Low52.6Low127 Ų127124.1 Ų124.178%0.77974%0.738SS**G310 helixtrans-72.2-13.1174.350.70000114.5A521 F525A521-T523 PolarHBondContact O-N 2.66Å; T523-F525 VanDerWaalsContact C-N 3.3Å
524N58.9Low53Low117 Ų117123.2 Ų123.263%0.62674%0.738SS**G310 helixtrans-83.90.6174.8-85.5-41.2000113.8D519 A521 A522D519-N524 PolarHBondContact O-ND2 3.17Å; A521-N524 PolarHBondContact O-N 2.8Å; A522-N524 VanDerWaalsContact C-N 3.28Å; A522-N524 PolarHBondContact O-N 3.09Å
525F72.1Confident53.1Low158 Ų158124.4 Ų124.469%0.69374%0.74SS**SBendtrans-90.2125.7168.6-76.8-87.7000110.2A522 T523A522-F525 PolarHBondContact O-N 2.79Å; T523-F525 VanDerWaalsContact C-N 3.3Å
526P67.7Low52.5Low108 Ų108127.5 Ų127.570%0.70175%0.745SS**PPolyproline II helixtrans-65.3139.6174.727.9-33.8000110.1
527P61.3Low51.8Low117 Ų117124.7 Ų124.776%0.7674%0.739SS**PPolyproline II helixtrans-64138.1-179.526.4-34.1000111
528L56.6Low51.4Low142 Ų142123.1 Ų123.174%0.74374%0.735SS**PPolyproline II helixtrans-67.7139.9177.9-65.7174.7000110.6G530 C531L528-G530 PolarHBondContact O-N 3.36Å; L528-C531 PolarHBondContact O-N 2.89Å
529P48.7Very low51.4Low134 Ų134118.6 Ų118.687%0.8773%0.726SS**THydrogen-bonded Turntrans-62.6122.8-176.725.4-34.1000111
530G55.1Low50.2Low81 Ų81118 Ų11884%0.83573%0.726SS**THydrogen-bonded Turntrans114.6-10.2179.300000115.5L528L528-G530 PolarHBondContact O-N 3.36Å
531C45.2Very low49.5Very low89 Ų89118 Ų11860%0.60173%0.726SS**  trans-92.4104.7178.3-164.30000112.1L528L528-C531 PolarHBondContact O-N 2.89Å
532V48.2Very low48.5Very low147 Ų147123.8 Ų123.889%0.89175%0.747SS**  trans-87.2101.9170.2-78.10000110.5
533V42.2Very low48.1Very low112 Ų112125.9 Ų125.968%0.67975%0.746SS**  trans-95.5107.2176.7-178.90000109.9T535V533-T535 HydrophobicContact CG1-CG2 4.07Å
534S44.7Very low47.6Very low112 Ų112130.7 Ų130.778%0.78375%0.749SS**  trans-81.2143.4163.2-174.10000109.8
535T39Very low46.5Very low124 Ų124132.3 Ų132.376%0.76176%0.755SS**  trans-132.295.7175.345.10000111.4V533V533-T535 HydrophobicContact CG1-CG2 4.07Å
536Q32.8Very low45Very low180 Ų180129.6 Ų129.684%0.84176%0.755SS**  trans-157.6119.8169.8-109.4-72.8-2.900107.9
537G33.4Very low43.7Very low69 Ų69130.9 Ų130.971%0.71176%0.757SS**  trans71.4111167.400000118.3
538E38.3Very low43.1Very low167 Ų167131 Ų13178%0.7876%0.755SS**  trans-67.7167.1140.9-116.3-143.1132.600109.4
539P49.4Very low42.2Very low106 Ų106130.9 Ų130.969%0.68876%0.759SS**  cis-149.215838.842.4-21.9000119.9
540V34.9Very low42Very low107 Ų107135.5 Ų135.565%0.64876%0.76SS**  trans72.3153134.8167.80000121.4
541L40.1Very low41.2Very low152 Ų152135 Ų13580%0.79676%0.755SS**  trans75157-179.4-53.6-170.9000118.6
542E37.7Very low40.8Very low162 Ų162138.5 Ų138.576%0.75777%0.767SS**  -164.1132.5-59.9173.5167.6-178.200108.6R544E542-R544 PolarHBondContact O-N 3.38Å
543N45.8Very low40.1Very low133 Ų133142 Ų14271%0.71177%0.765SS**  trans-5.7105.2159.1-17736.6000119.4
544R47.6Very low39.9Very low227 Ų227145.1 Ų145.186%0.85777%0.77SS**  trans-159.3115.7147.5-102146.8-170-156.53109.1E542E542-R544 PolarHBondContact O-N 3.38Å
545M36.6Very low39.3Very low152 Ų152146.5 Ų146.575%0.74977%0.773SS**  76.2104.480-73.4-175.973.100114.8
546S39.2Very low38.9Very low100 Ų100147.3 Ų147.370%0.69977%0.769SS**  trans53.7128.4137.762.20000122.3
547D40.4Very low38.9Very low136 Ų136146 Ų14673%0.72776%0.762SS**  trans75.6130.1143.4-132.3-29.3000119.7V549D547-V549 PolarHBondContact OD1-N 2.98Å
548V48.3Very low38.8Very low120 Ų120147.6 Ų147.673%0.72776%0.759SS**  -168.1118.7113.1147.70000108.4
549V39.6Very low38.3Very low138 Ų138146 Ų14684%0.83676%0.756SS**  trans-83.2114.1171.11760000110.9D547D547-V549 PolarHBondContact OD1-N 2.98Å
550R43.5Very low37.6Very low232 Ų232149.2 Ų149.288%0.87576%0.759SS**  trans-163.2135.5167.1-97.1166.566.2-175.20.6108.2
551G38.2Very low37.3Very low71 Ų71150.4 Ų150.473%0.73276%0.762SS**  cis-170.8-169.4-3.900000110.7
552L37.3Very low36.9Very low162 Ų162148.5 Ų148.585%0.84876%0.756SS**  trans-63.1165.5174-77.784.6000111.2
553Y34.3Very low36.4Very low219 Ų219147.7 Ų147.786%0.85976%0.763SS**  -165167.351.336.7-103.9000115.2
554K37.3Very low35.6Very low178 Ų178147.3 Ų147.377%0.77477%0.765SS**  trans-72164.2167.5-67.5-177.1172.6-171.30112.3
555T31Very low34.8Very low141 Ų141141.6 Ų141.687%0.86576%0.76SS**  -164.3163.5127.8-75.50000108.9
556E31.4Very low35.2Very low141 Ų141140.4 Ų140.466%0.65976%0.763SS**  trans-113.6-177.7-172.6-52.1-174.5160.600114.1
557Q33.6Very low34.7Very low152 Ų152139.9 Ų139.971%0.7177%0.765SS**  trans97.7122.9138.9-82.4177.542.600122.6
558T29.9Very low34.5Very low103 Ų103139 Ų13963%0.63277%0.77SS**  trans76.7108.6133.456.10000123.3
559N29.2Very low33.9Very low135 Ų135136.8 Ų136.872%0.72276%0.764SS**  79.2132.9113.4-73.9-22.3000124
560K33.2Very low33.5Very low172 Ų172139.1 Ų139.175%0.74877%0.765SS**  trans86.3105.6133-75.8179.8174.8-170.60121.8
561D29.2Very low32.8Very low133 Ų133133.6 Ų133.671%0.71176%0.758SS**  76.9122.5117.7-81.7-64.8000123.8
562T31.2Very low32.3Very low112 Ų112138 Ų13869%0.68776%0.764SS**  62.2119.7128.1-610000120.9
563T27.6Very low32.2Very low145 Ų145134.2 Ų134.289%0.8976%0.756SS**  trans-158.1159.9141-79.70000110
564V29.3Very low32.1Very low125 Ų125130.3 Ų130.376%0.75876%0.755SS**  trans-103.9160.9-159.8175.90000113.7
565S30.9Very low31.9Very low106 Ų106129.1 Ų129.174%0.74175%0.752SS**  trans-58.3174.7172.2-34.80000115.4
566P44.3Very low31.9Very low128 Ų128127.9 Ų127.983%0.83174%0.744SS**  -134.6167122.638-29.5000115.2
567A30.4Very low31.9Very low89 Ų89125.2 Ų125.274%0.73675%0.746SS**  trans-94.7178.5172.500000111.7
568S35.3Very low31.9Very low118 Ų118124.1 Ų124.183%0.82575%0.75SS**  161.9168.885.5-97.70000109.9
569A36.4Very low31.6Very low73 Ų73125.9 Ų125.960%0.60376%0.76SS**  cis-168.4162.9-12.200000111.6
570Q30.5Very low31.7Very low186 Ų186125.6 Ų125.687%0.86976%0.763SS**  trans-168.4-145.3143.2-103.1151.710700114.6
571T29Very low31.7Very low117 Ų117122.5 Ų122.572%0.71876%0.763SS**  trans-154.5-178.9-132.642.60000113.4
572L27.3Very low31.7Very low164 Ų164123.6 Ų123.686%0.85977%0.769SS**  cis-145.4-136.213.3-158.670.7000111.8
573A35.4Very low32.6Very low82 Ų82124 Ų12468%0.67877%0.774SS**  trans-148-164.4178.100000108.8
574T31Very low32.7Very low136 Ų136121.4 Ų121.483%0.83477%0.767SS**  cis-174.9168.411.9-129.60000106.3
575E33.2Very low33.4Very low153 Ų153120.6 Ų120.672%0.71576%0.764SS**  cis-174.6-178.5-25.9-134.4-66.281.300107.8
576V31.7Very low33.4Very low116 Ų116121.3 Ų121.370%0.70376%0.764SS**  trans77.1135.7164.3169.40000116.6
577A32.5Very low32.8Very low84 Ų84121.4 Ų121.469%0.69476%0.762SS**  cis98.5146.815.100000116
578V31.7Very low32.8Very low130 Ų130122.1 Ų122.179%0.78876%0.761SS**  cis-166.4156.1-20.758.40000109.6
579T25.3Very low32.7Very low140 Ų140126 Ų12686%0.85976%0.764SS**  trans-144.2178.2179.211.30000115.4
580V31.2Very low32.3Very low128 Ų128127.4 Ų127.478%0.77677%0.769SS**  trans-150.3154.3-130.9152.30000117
581S31.7Very low32.3Very low108 Ų108124.6 Ų124.676%0.75576%0.764SS**  trans85.6116.6154.8-80.10000125.5
582N29.8Very low32.4Very low156 Ų156124.3 Ų124.383%0.83477%0.767SS**  40.7163.7118.7-1016.3000123.8
583P51Low32.6Very low121 Ų121125.2 Ų125.279%0.78677%0.767SS**  cis-137.4-158.12441.2-19.1000118
584A28Very low33.2Very low89 Ų89126.5 Ų126.574%0.73677%0.768SS**  trans-103.1-155.4-167.100000114.2
585P44.7Very low33Very low109 Ų109128.6 Ų128.671%0.70877%0.773SS**  cis-150.9172.24.643.9-21.4000121.8
586T30.1Very low32.8Very low121 Ų121124.9 Ų124.974%0.74278%0.776SS**  trans65.6133.314048.60000128.8
587V32.5Very low32.6Very low130 Ų130124.8 Ų124.879%0.78878%0.78SS**  trans76.6143.2134.4170.80000118.5
588S30.7Very low32.3Very low103 Ų103128.5 Ų128.572%0.7279%0.788SS**  cis-153.3160.530.7-9.80000117.7
589K32.9Very low32.2Very low201 Ų201126.2 Ų126.287%0.87478%0.783SS**  trans-0.8164.7137.7-72.8177.7179.4178.60121.5
590S28.6Very low32.3Very low102 Ų102125.4 Ų125.471%0.71378%0.783SS**  cis168.8175.3-20.467.70000108.1
591V30.8Very low32Very low126 Ų126131.3 Ų131.376%0.76479%0.791SS**  cis-167.7-1763.887.60000110.7
592S30.1Very low31.9Very low111 Ų111133.6 Ų133.678%0.77679%0.793SS**  trans90.8156.2157.7650000122.8
593Q31.9Very low31.9Very low184 Ų184130.3 Ų130.386%0.8678%0.782SS**  trans-113.4-162.8-173.4-54.1175.9-56.700109.4
594P47.4Very low30.9Very low108 Ų108131.6 Ų131.670%0.70178%0.783SS**  cis-144.4-174.6045.2-25.4000117.8
595L28Very low31.3Very low181 Ų181135.3 Ų135.395%0.94879%0.785SS**  trans55.6134.1147.8-118.171.7000122.7
596G27.6Very low30.8Very low75 Ų75137 Ų13777%0.77378%0.783SS**  trans174.5148165.800000112
597S27.2Very low31.1Very low113 Ų113138.5 Ų138.579%0.7978%0.78SS**  trans-142173.5-17161.30000114.5
598L27.8Very low31.3Very low162 Ų162141.4 Ų141.485%0.84878%0.776SS**  trans93.1116.8165.9-67.1162.5000121
599A28.5Very low31.4Very low83 Ų83143.4 Ų143.469%0.68678%0.784SS**  62.8105.8126.800000123.1
600S27.3Very low31.5Very low123 Ų123141 Ų14186%0.8678%0.776SS**  46.8121.1119.5-52.50000122.8
601R24.5Very low31.7Very low251 Ų251146.3 Ų146.395%0.94778%0.78SS**  -151.9160.7119-135.8178.1-169.3-128.9-1113
602I31.6Very low31.9Very low157 Ų157144.4 Ų144.481%0.80578%0.778SS**  trans-118152.6-175.5-68.8171.9000110.7
603S29.2Very low31.8Very low86 Ų86145 Ų14560%0.60177%0.768SS**  trans-23.3150.2165.1-177.50000119.2
604N29.6Very low33.4Very low149 Ų149141.8 Ų141.880%0.79776%0.763SS**  -177.3-173.3115.3-88.2-12.4000114.8
605Q35.9Very low33.9Very low167 Ų167142.2 Ų142.278%0.7877%0.766SS**  trans-116.4176.2-149.4-48.2178.611.100116.4
606E34.1Very low33.9Very low144 Ų144139.8 Ų139.867%0.67376%0.759SS**  trans112.8136.9132.5-101.5-151.1131.100124.9
607K37Very low34.1Very low153 Ų153142 Ų14267%0.66576%0.762SS**  trans65.7120.7145.9-92.1-167.9-175.2840126.8
608R36.9Very low34.1Very low191 Ų191146.8 Ų146.872%0.72177%0.769SS**  67.5146.1116.3-157.3-175.7178.9-156.3-5.4122E610R608-E610 IonicContact NH2-OE2 3.17Å; R608-E610 PolarHBondContact NH2-OE2 3.48Å
609V32.9Very low34.3Very low145 Ų145145.2 Ų145.288%0.87977%0.766SS**  trans-179.3175.2131.7147.80000112
610E33.7Very low34.3Very low150 Ų150148 Ų14870%0.70177%0.774SS**  trans-149.5150.9-155.8168.9-163145.600111R608R608-E610 IonicContact NH2-OE2 3.17Å; R608-E610 PolarHBondContact NH2-OE2 3.48Å
611R34.5Very low34.7Very low213 Ų213149.8 Ų149.880%0.80477%0.769SS**  trans-170.8165153.1-160.2143.5-176.4159.40.3114.8E613R611-E613 WeakPolarHBondContact CG-OE2 3.48Å; R611-E613 IonicContact CZ-OE1 3.32Å; R611-E613 VanDerWaalsContact CZ-OE1 3.32Å; R611-E613 IonicContact NE-OE1 2.96Å; R611-E613 PolarHBondContact NE-OE1 3.12Å; R611-E613 IonicContact NE-OE2 3.28Å; R611-E613 PolarHBondContact NE-OE2 3Å; R611-E613 IonicContact NH2-OE1 2.77Å; R611-E613 PolarHBondContact NH2-OE1 2.79Å
612A33.9Very low34.8Very low87 Ų87148.3 Ų148.372%0.71976%0.763SS**  trans-112-137.5179.200000113
613E27.4Very low35.3Very low122 Ų122146.8 Ų146.857%0.5776%0.762SS**  cis-144.7161.224.3-87.79199.200112.8R611R611-E613 WeakPolarHBondContact CG-OE2 3.48Å; R611-E613 IonicContact CZ-OE1 3.32Å; R611-E613 VanDerWaalsContact CZ-OE1 3.32Å; R611-E613 IonicContact NE-OE1 2.96Å; R611-E613 PolarHBondContact NE-OE1 3.12Å; R611-E613 IonicContact NE-OE2 3.28Å; R611-E613 PolarHBondContact NE-OE2 3Å; R611-E613 IonicContact NH2-OE1 2.77Å; R611-E613 PolarHBondContact NH2-OE1 2.79Å
614P67.3Low35.8Very low117 Ų117148.5 Ų148.576%0.7677%0.771SS**  trans-100.3-162.9-174.743.1-39.4000114.1
615P57.8Low35.7Very low117 Ų117146.6 Ų146.676%0.7676%0.764SS**  cis-142.7-136.76.945.1-22000116.3
616V26.2Very low35.7Very low131 Ų131147.4 Ų147.479%0.79477%0.768SS**  trans106.4147.3166.8-176.80000118.6
617S32.4Very low35.9Very low121 Ų121144.2 Ų144.285%0.84677%0.766SS**  trans-170.7168.2177.9-86.20000116.3
618K28.3Very low35.6Very low213 Ų213143 Ų14393%0.92677%0.772SS**  trans-149.4172.8167.1-141.9174.9-173177.50112.5
619V31Very low35.2Very low129 Ų129139.6 Ų139.678%0.78277%0.772SS**  trans-127.4142.6-146.5171.50000116.8
620T28.6Very low35.2Very low141 Ų141139.7 Ų139.787%0.86577%0.768SS**  trans-172.5154.6133.7-75.90000111.5
621Q36.6Very low35.1Very low161 Ų161137.5 Ų137.575%0.75277%0.769SS**  trans-94.1145.8-168.8-58.1173.1-17.100115.5
622R26.8Very low35.3Very low220 Ų220132.9 Ų132.983%0.8377%0.769SS**  161.8139.1107.7-86.8-173.4-178.2-165.20.9113.1
623T40.3Very low36.1Very low125 Ų125134.2 Ų134.277%0.76777%0.77SS**  trans56.8117.6164.328.30000119.2
624P41.3Very low36.4Very low123 Ų123133.5 Ų133.580%0.79978%0.779SS**  -138.3163.3115.938.2-27.5000112.3
625V27.2Very low35Very low108 Ų108133 Ų13366%0.65578%0.778SS**  cis82.794.40.4-170.10000118.1
626Q36.1Very low33.9Very low184 Ų184131.9 Ų131.986%0.8677%0.773SS**  trans66.1167139.1-74.5178.82.300119.5
627A37.4Very low34.3Very low77 Ų77131 Ų13164%0.63677%0.773SS**  cis-158.5-176.9-20.200000107.9
628T30.5Very low34.4Very low128 Ų128130.3 Ų130.379%0.78577%0.768SS**  157.3139.995.3-65.20000106.5
629V28.9Very low34.6Very low120 Ų120125.6 Ų125.673%0.72776%0.762SS**  cis-133.1145.52.7-102.10000107.8
630N32.4Very low34.6Very low146 Ų146124.6 Ų124.678%0.78176%0.761SS**  61.7136.969.7-73.513.2000114.9
631S32.3Very low34.9Very low105 Ų105126.2 Ų126.273%0.73476%0.759SS**  cis-163.5167.6-4.7-83.40000111.5
632S38.4Very low35.3Very low115 Ų115123.7 Ų123.780%0.80476%0.756SS**  trans-89.1164.2164.7-38.60000111.6
633P50.9Low35.3Very low115 Ų115118.6 Ų118.675%0.74775%0.749SS**  -153.8179.67339.8-18.9000118.1
634S34.1Very low34.7Very low108 Ų108117.8 Ų117.876%0.75575%0.749SS**  trans75.7164.1167.9-10.40000116.9
635S37.5Very low34.1Very low106 Ų106116.8 Ų116.874%0.74175%0.745SS**  cis-177-171.1-3059.50000107.7
636S34.8Very low34.3Very low93 Ų93117.4 Ų117.465%0.6575%0.754SS**  cis-172.4162.2-0.419.70000110.2
637S35.4Very low34Very low113 Ų113119.5 Ų119.579%0.7975%0.754SS**  trans62.7152.7161.942.70000120
638S33.9Very low34.1Very low106 Ų106121.1 Ų121.174%0.74176%0.758SS**  cis-174.6144.6-15.251.70000113.1
639S32.4Very low34.2Very low115 Ų115123.3 Ų123.380%0.80476%0.76SS**  trans58.4153.9152.5-136.30000120
640S31.9Very low34.9Very low108 Ų108122.7 Ų122.776%0.75576%0.758SS**  cis-146.4160.98.3-540000112.3
641Q34.3Very low34.8Very low175 Ų175120.8 Ų120.882%0.81876%0.756SS**  trans-90.1-179.2165.1-118-171.514.700110.7
642P44.6Very low34.7Very low108 Ų108120.4 Ų120.470%0.70176%0.759SS**  cis-146.5-179.435.544.3-23000119.5
643T26.6Very low34.3Very low112 Ų112119.1 Ų119.169%0.68776%0.756SS**  trans-10.9150.5155.962.90000118.8
644S28.5Very low33.4Very low108 Ų108118.8 Ų118.876%0.75576%0.756SS**  -176.6173.964.157.20000115.7
645S27.2Very low33.5Very low102 Ų102119.9 Ų119.971%0.71376%0.758SS**  trans-44.1145.7173.751.90000118.4
646S32.3Very low33.8Very low121 Ų121120.7 Ų120.785%0.84676%0.761SS**  167.4150.6107.2520000115.3
647R30.3Very low33.6Very low229 Ų229120.9 Ų120.986%0.86477%0.768SS**  trans-90.9141.3165.1169.6-175.1177-111.5-0.6106.5
648P39.5Very low33.5Very low111 Ų111121.8 Ų121.872%0.72177%0.769SS**  -151.1178.960.240.9-19.5000119.1
649Q31.1Very low33.9Very low174 Ų174122 Ų12281%0.81377%0.768SS**  trans-61.1-179.2152-74.9-173.2-33.100111.8
650P45.4Very low33.8Very low106 Ų106121.1 Ų121.169%0.68876%0.762SS**  cis-141.5-16413.642.9-22.3000116.1
651S28.6Very low33.9Very low106 Ų106122.4 Ų122.474%0.74177%0.765SS**  trans75121.4153.4-66.70000117.3
652A31.8Very low34.3Very low97 Ų97120 Ų12080%0.80277%0.765SS**  78.6135.768.500000112.2
653A28.8Very low33.7Very low89 Ų89119.1 Ų119.174%0.73677%0.766SS**  cis-159.5-166.7-1.800000110.5
654S31.7Very low34.7Very low107 Ų107119.7 Ų119.775%0.74877%0.772SS**  trans80.699.1155-53.50000119.5
655T37.6Very low34.7Very low132 Ų132119.1 Ų119.181%0.8177%0.768SS**  -16.6147.2124.939.60000115.7
656P42.7Very low35Very low123 Ų123120.8 Ų120.880%0.79977%0.774SS**  -153.1-178.471.342.4-23000118.8
657A30.3Very low34.9Very low96 Ų96119.6 Ų119.679%0.79377%0.772SS**  trans87.8117.7154.300000121.1
658T33.3Very low34.9Very low132 Ų132112.7 Ų112.781%0.8176%0.763SS**  trans-55.4168.4153.945.10000113.6
659P43.4Very low34.7Very low112 Ų112114.8 Ų114.873%0.72777%0.767SS**  cis-150.6-174.333.940.4-17000119.8
660S30Very low34.7Very low96 Ų96113.1 Ų113.167%0.67177%0.769SS**  trans63.8103.6148.954.80000122.8
661T34.6Very low34.3Very low134 Ų134114.3 Ų114.382%0.82278%0.775SS**  30127.2108-420000117.6
662P42.4Very low34.8Very low125 Ų125115.2 Ų115.281%0.81278%0.778SS**  -147.6176.163.540.7-21000119
663A32.1Very low34.8Very low89 Ų89115.3 Ų115.374%0.73678%0.779SS**  trans-96176.517100000110.7
664P46.8Very low35.3Very low124 Ų124120.4 Ų120.481%0.80579%0.787SS**  cis-130.1-152.940.241.2-20.2000112.3
665S29.8Very low35.7Very low96 Ų96123.7 Ų123.767%0.67179%0.791SS**  cis-158.3137.66.553.20000114.9
666T32Very low36.2Very low137 Ų137123.4 Ų123.484%0.8479%0.791SS**  trans56.3134.4133.1-42.40000123.7
667A31.4Very low37Very low96 Ų96128.9 Ų128.979%0.79380%0.796SS**  trans81.1137.5163.300000119
668A30.1Very low38.3Very low84 Ų84134.2 Ų134.269%0.69480%0.801SS**  cis-162.8144.8-15.900000113.5
669I34.9Very low39.8Very low156 Ų156134 Ų13480%0.880%0.795SS**  trans57.8112.5153.4-55.6159.6000120.1
670T30.3Very low40.6Very low139 Ų139131.9 Ų131.985%0.85378%0.782SS**  -171.5153.9119.615.30000112.5
671T36.8Very low41.7Very low131 Ų131136.5 Ų136.580%0.80479%0.786SS**  trans-128.4155.6176.2400000108.5
672P40.6Very low42.9Very low124 Ų124132.9 Ų132.981%0.80577%0.77SS**  -124.4148.361.17.817.5000113.8
673A30.6Very low44Very low100 Ų100132.1 Ų132.183%0.82676%0.756SS**  84.5124.964.800000114.1
674Q39.5Very low45.6Very low195 Ų195132.4 Ų132.491%0.91175%0.748SS**  trans-138.4164.3-173.4-157.317729.500111.3
675E40.1Very low46.2Very low176 Ų176130.6 Ų130.682%0.82274%0.737SS**PPolyproline II helixtrans-65154.9-164-63.4176.4111.600117.1
676P48.8Very low47.6Very low127 Ų127133.8 Ų133.883%0.82574%0.742SS**PPolyproline II helixtrans-74.3126.5-179.629.8-35.3000113.5
677R59.5Low48.5Very low237 Ų237137.4 Ų137.489%0.89474%0.74SS**PPolyproline II helixtrans-69.8142.4167.9-79.5-174.9170.5127.4-0.5111.6
678K56.4Low49.9Very low208 Ų208138.1 Ų138.190%0.90474%0.736SS**PPolyproline II helixtrans-76.5125.7170.4-61.6177.2-177.6177.80109.2
679L65.1Low51Low128 Ų128140 Ų14067%0.6774%0.742SS**PPolyproline II helixtrans-72.5150.5179.7-66.5171.3000111.9
680S61.2Low51.4Low67 Ų67142.1 Ų142.147%0.46975%0.745SS.*PPolyproline II helixtrans-80.1146.1176.1-177.40000111.7A682 E683S680-A682 PolarHBondContact O-N 3.42Å; S680-A682 VanDerWaalsContact O-N 3.14Å; S680-E683 WeakPolarHBondContact CB-OE2 3.35Å; S680-E683 PolarHBondContact N-OE2 3.35Å; S680-E683 WeakPolarHBondContact O-CB 3.26Å; S680-E683 PolarHBondContact O-N 3.13Å
681Y53.3Low52.2Low193 Ų193142.1 Ų142.176%0.75774%0.74SS**Hα-helixtrans-54.7-34.1176.5-172.4-105.2000112.5E683 V684 C685Y681-E683 VanDerWaalsContact C-N 3.28Å; Y681-E683 PolarHBondContact O-N 3.27Å; Y681-V684 PolarHBondContact O-N 3.44Å; Y681-C685 PolarHBondContact O-N 3.17Å; Y681-C685 PolarHBondContact O-SG 2.96Å
682A58.9Low53.1Low59 Ų59141.4 Ų141.449%0.48874%0.738SS.*Hα-helixtrans-66.4-24.1177.100000114.3S680S680-A682 PolarHBondContact O-N 3.42Å; S680-A682 VanDerWaalsContact O-N 3.14Å
683E66.3Low53.7Low109 Ų109141.3 Ų141.351%0.50974%0.737SS.*Hα-helixtrans-82.7-24.6178.6-61.3173.6111.800111.9S680 Y681S680-E683 WeakPolarHBondContact CB-OE2 3.35Å; S680-E683 PolarHBondContact N-OE2 3.35Å; S680-E683 WeakPolarHBondContact O-CB 3.26Å; S680-E683 PolarHBondContact O-N 3.13Å; Y681-E683 VanDerWaalsContact C-N 3.28Å; Y681-E683 PolarHBondContact O-N 3.27Å
684V64.7Low54.3Low95 Ų95143 Ų14358%0.57674%0.739SS**Hα-helixtrans-76.6-39.7177.8-176.60000110.9Y681 Q686Y681-V684 PolarHBondContact O-N 3.44Å; V684-Q686 VanDerWaalsContact C-N 3.27Å; V684-Q686 PolarHBondContact O-N 2.77Å
685C60.8Low54.1Low85 Ų85138.6 Ų138.657%0.57474%0.737SS**THydrogen-bonded Turntrans-74.2-4.7-175-64.10000115.7Y681Y681-C685 PolarHBondContact O-N 3.17Å; Y681-C685 PolarHBondContact O-SG 2.96Å
686Q59Low53.9Low163 Ų163134.9 Ų134.976%0.76274%0.736SS**THydrogen-bonded Turntrans-107.913.4-175.8-70-163.55900115.1V684 P688V684-Q686 VanDerWaalsContact C-N 3.27Å; V684-Q686 PolarHBondContact O-N 2.77Å; Q686-P688 WeakPolarHBondContact O-CD 3.05Å
687R49.6Very low53.5Low214 Ų214135 Ų13581%0.80874%0.737SS**  trans-94.8113.6172.8-69.3-173176.9-174.6-0.9110.7
688P61.4Low52.4Low110 Ų110128.4 Ų128.471%0.71473%0.733SS**  trans-67.415717229.4-34.5000110.8Q686Q686-P688 WeakPolarHBondContact O-CD 3.05Å
689P52.4Low51.9Low125 Ų125124.4 Ų124.481%0.81273%0.728SS**  trans-56.3144.7173-22.734000111.5
690K44.9Very low50.4Low199 Ų199124 Ų12487%0.86574%0.736SS**  trans-109.4120.5177.1-169.668.2175176.20109.1
691D46.7Very low48.9Very low139 Ų139124.4 Ų124.474%0.74375%0.751SS**PPolyproline II helixtrans-62.4151.9-179.8-59.4-71.6000113.1
692P56.3Low47.9Very low117 Ų117122.5 Ų122.576%0.7676%0.76SS**PPolyproline II helixtrans-70.5145.1176.330-35.5000112.2
693P52Low46.8Very low122 Ų122123.9 Ų123.979%0.79277%0.771SS**PPolyproline II helixtrans-75.4149.6177.331-34.8000112.8
694P42.5Very low45.3Very low134 Ų134124.9 Ų124.987%0.8779%0.79SS**PPolyproline II helixtrans-81.6168.117834.9-36.8000113.2
695A35.8Very low43.6Very low104 Ų104124.2 Ų124.286%0.8680%0.802SS**  trans-127.9127.7-177.100000113.7
696A35.5Very low42.3Very low97 Ų97128.7 Ų128.780%0.80281%0.814SS**  trans176.2167.6166.300000109.4
697P41.6Very low42Very low131 Ų131125.5 Ų125.585%0.85181%0.808SS**  cis-123.9-165.1-34.136.8-19.5000111.4
698A37Very low41.1Very low98 Ų98121.5 Ų121.581%0.8180%0.802SS**  trans-135.5154.5-176.500000115.2
699P45.1Very low39.9Very low123 Ų123125.6 Ų125.680%0.79980%0.803SS**  trans-129.4170.716140.2-27.9000113.3
700S33.3Very low39.2Very low120 Ų120126 Ų12684%0.83980%0.795SS**  cis-173.5117.3-33.556.40000110.6
701G30.6Very low38.7Very low75 Ų75122 Ų12277%0.77378%0.781SS**  trans132.3139.117300000113.2
702T32.2Very low38Very low154 Ų154124.9 Ų124.995%0.94578%0.782SS**  cis-137.5168.28.8-51.10000110.3
703A34.7Very low36.8Very low88 Ų88125 Ų12573%0.72778%0.781SS**  trans-99.3154.9-156.400000117.5
704S34.7Very low35.8Very low129 Ų129126.7 Ų126.790%0.90278%0.783SS**  168.6157.7116.750.70000113
705G30.4Very low35.2Very low81 Ų81129.8 Ų129.884%0.83578%0.782SS**  trans105.3123.8160.700000118.6
706Q33.4Very low34.9Very low179 Ų179128.9 Ų128.984%0.83678%0.775SS**  trans-135.4168.4165.7-91.7-90.3-15.700106
707P51.9Low34.5Very low96 Ų96133.3 Ų133.362%0.62378%0.779SS**  cis-141.3-171.910.936.2-13.4000117.5
708L31.2Very low33.8Very low131 Ų131135.3 Ų135.369%0.68678%0.777SS**  trans83.8102.2139.3-120.277.9000121.9
709R36.7Very low34.1Very low195 Ų195136.2 Ų136.274%0.73678%0.775SS**  160.3132.899.6-89.1-163.6136123.34.6116.3
710E36.8Very low33.2Very low135 Ų135133.6 Ų133.663%0.63177%0.771SS**  38143.2125.5-58.4-178.6-123.800121.7
711L34Very low33Very low113 Ų113134.2 Ų134.259%0.59278%0.775SS**  cis-174.4152.6-10.1-121.7165.8000111.1
712R32.3Very low32.8Very low201 Ų201133.6 Ų133.676%0.75877%0.768SS**  trans71.7138.1167.9-52.5172.1-173.291.12.4116.1
713V31.6Very low32.6Very low120 Ų120133.3 Ų133.373%0.72777%0.767SS**  cis93.1110.312.3-173.50000117
714N29.9Very low32.3Very low156 Ų156134.4 Ų134.483%0.83477%0.768SS**  trans65.1158.9162.8-62.7-10.4000116.3
715K29.7Very low32.6Very low199 Ų199134.5 Ų134.587%0.86577%0.766SS**  cis-157.7-171.139.4-156.5174.6174-171.30112.7
716A29.3Very low32.4Very low85 Ų85133.9 Ų133.970%0.70276%0.76SS**  trans-114.4-173-17900000113.3
717E27.6Very low32.1Very low190 Ų190132.9 Ų132.989%0.88876%0.761SS**  trans91.1145.7172.8-67.6-172.3103.800120
718E28.2Very low31.2Very low173 Ų173138.4 Ų138.481%0.80878%0.775SS**  trans-67.7179.3165.2-84.5-89.5156.900112
719P42Very low31.1Very low117 Ų117139.6 Ų139.676%0.7678%0.777SS**  cis-131.8172.5-338.1-21.8000116.2
720G27.5Very low30.7Very low69 Ų69137.3 Ų137.371%0.71177%0.774SS**  105.1132.6125.500000121.8
721S28Very low30.4Very low133 Ų133141.4 Ų141.493%0.9378%0.784SS**  trans61.8118.3147.2-175.50000121.3
722G26.2Very low30.2Very low61 Ų61138.8 Ų138.863%0.62978%0.784SS**  trans152.2120.8144.100000118.1
723T28.8Very low30.1Very low149 Ų149137.3 Ų137.391%0.91479%0.786SS**  trans51.6114.4149.435.50000121.9
724S27.2Very low30Very low110 Ų110137.9 Ų137.977%0.76979%0.785SS**  trans-65.2-178.9144.6-35.40000111.2
725P41.4Very low30.1Very low131 Ų131138.6 Ų138.685%0.85178%0.78SS**  cis-136.6-164.17.943.7-24.5000114.9
726G27.2Very low30Very low69 Ų69137.9 Ų137.971%0.71178%0.78SS**  trans113.779.3173.500000112.2
727D27Very low30.1Very low158 Ų158136.8 Ų136.885%0.84578%0.777SS**  63.3104.267.4-161.7-5.1000112.8
728K33Very low30.2Very low212 Ų212131.7 Ų131.792%0.92278%0.775SS**  trans-161.2149.1160.7-119.6167.3-172.3177.30114
729Q28.5Very low30.2Very low155 Ų155135.4 Ų135.472%0.72478%0.782SS**  trans-112.6155.4-167.3154.7-174-25.800111.1
730E28Very low29.5Very low147 Ų147139 Ų13969%0.68779%0.789SS**  trans64.1138.4171.8-74.3172.2100.300117.4
731R30.1Very low29.7Very low222 Ų222141.9 Ų141.984%0.83880%0.797SS**  cis103.7111.625.7-170.1-154.2-67.7-99.46.4112
732G29.9Very low29.7Very low58 Ų58145.8 Ų145.860%0.59880%0.797SS**  trans169.5111.9170.800000107.1
733H31.5Very low29.8Very low170 Ų170150.1 Ų150.179%0.78780%0.8SS**  58.4125.687.1-73.4-67000113
734D28.7Very low29.8Very low132 Ų132148.8 Ų148.871%0.70680%0.798SS**  cis-164.3-173.7-9.2-143.4-48.9000109.7
735K32.3Very low30.3Very low171 Ų171153.9 Ų153.974%0.74380%0.8SS**  trans80.1114.4175.8-57.3-167.2178.5-163.60114.7
736E26.9Very low30.6Very low184 Ų184153.4 Ų153.486%0.8680%0.797SS**  95.1108.259.7-177.3179.7-155.500110.6
737G31.6Very low31.5Very low62 Ų62156.3 Ų156.364%0.63980%0.803SS**  trans177131.3-177.700000109.7
738G29.7Very low32.2Very low82 Ų82159.8 Ų159.885%0.84580%0.804SS**  trans-75.8154.3-168.400000115
739W28.9Very low32.2Very low251 Ų251156 Ų15695%0.95179%0.79SS**  trans-109104.6176.9-63.894.8000111.2
740E28.2Very low32.5Very low194 Ų194156.7 Ų156.791%0.90779%0.786SS**  trans-90.4144.7157.9-83.4-160.19200110.6
741C30Very low32.8Very low129 Ų129156 Ų15687%0.87279%0.786SS**  trans-75.9147.1-179.4-58.90000112.6
742K27.9Very low33Very low214 Ų214149.9 Ų149.993%0.9378%0.778SS**  trans-145139.8144.3-128.3166.5-171.5168.40113.5
743E30Very low33.1Very low152 Ų152156.7 Ų156.771%0.7179%0.794SS**  trans-88.1151.5-173.9179.8175.7-172.400112
744S28.7Very low33.1Very low122 Ų122151.4 Ų151.485%0.85379%0.786SS**  trans-155.2124.7161.1-780000112.4
745R36.6Very low33.2Very low217 Ų217155.4 Ų155.482%0.81979%0.793SS**  trans-112151.6159.4-59.5-176.3-174.4-167-0108.4
746P47.6Very low33.1Very low120 Ų120157.2 Ų157.278%0.77980%0.796SS**  -152.8-162.3106.740.7-22.9000111.9
747P47Very low33.3Very low130 Ų130158.2 Ų158.284%0.84479%0.792SS**  cis-118.9-160.5-21.117.28000112.4
748R40.7Very low33.2Very low232 Ų232161.1 Ų161.188%0.87580%0.803SS**  trans-146.8156.8-170.4-154.5-169.5-161.1147.31.4112.7
749E33.3Very low33.2Very low132 Ų132163.9 Ų163.962%0.61780%0.799SS**  trans-149.7162160.6-83.9-58.368.300107.3
750R35.3Very low33.5Very low170 Ų170155.5 Ų155.564%0.64279%0.79SS**  cis82.9137.534.9-169.2-175-37.7-55.5-14.6114.2
751D33.8Very low34.4Very low131 Ų131152.8 Ų152.870%0.70179%0.789SS**  cis-160.7-161.5-37.3-88.6-30.9000104
752S34.3Very low34.8Very low95 Ų95158.8 Ų158.866%0.66479%0.793SS**  cis-157.8143.49-45.10000110.7
753Q32.2Very low35Very low200 Ų200152.5 Ų152.594%0.93579%0.789SS**  trans62.5155.5160-58.6174.6-1400117.6
754G30.9Very low35.1Very low60 Ų60149.3 Ų149.362%0.61980%0.797SS**  cis172160.1-1000000112.7
755Y31.5Very low35.2Very low216 Ų216147.5 Ų147.585%0.84780%0.797SS**  trans68.4159.9172.2-60.5-77.4000118.3
756Y29.7Very low35.1Very low208 Ų208140.5 Ų140.582%0.81679%0.793SS**  cis-141.9164.7-3.8-139.7-75.2000110.6
757R32.4Very low34.4Very low205 Ų205143 Ų14377%0.77480%0.799SS**  trans-77.2162.1172.7-75-173.1-179.3-125.47.2114.4
758S27.8Very low33.9Very low124 Ų124146 Ų14687%0.86780%0.798SS**  trans-151.3159.6145.5-84.30000111.8
759N30.9Very low33.5Very low140 Ų140145.4 Ų145.475%0.74980%0.803SS**  trans-127.9143.1-165-67.1-40000114.3
760G34.7Very low33.3Very low74 Ų74148.6 Ų148.676%0.76381%0.809SS**  trans79.4-179.1150.700000117.6
761P46.1Very low33.4Very low138 Ų138147.5 Ų147.590%0.89682%0.816SS**  cis-109.3-167.99.340.7-32.7000115.5
762R39.8Very low33.3Very low255 Ų255148.4 Ų148.496%0.96282%0.816SS**  trans-99.4155-168.9-77.8175.7160.1-169.5-3.1115.3
763G30.7Very low33.5Very low81 Ų81155 Ų15584%0.83583%0.826SS**  trans-172.4143.9144.900000111.1
764G33.4Very low33.5Very low86 Ų86157 Ų15789%0.88783%0.825SS**  cis151.872.1-6.900000114
765G29.6Very low34.1Very low83 Ų83159.5 Ų159.586%0.85683%0.831SS**  trans167.6128.5173.200000114.7
766G34.7Very low34.7Very low70 Ų70154.9 Ų154.972%0.72283%0.827SS**  trans-113.5126.9173.700000111.2
767L34.2Very low35.3Very low172 Ų172151.1 Ų151.190%0.90183%0.828SS**  trans-125.2157.7174.7-75176.8000111.6
768K35.2Very low35.3Very low193 Ų193146.2 Ų146.284%0.83983%0.831SS**  trans-113.3116.1-158.4-55.8169.2-171.8175.20108.6R770K768-R770 PolarHBondContact O-N 3.28Å
769F31.9Very low35.7Very low221 Ų221152.1 Ų152.197%0.96984%0.835SS**  trans-64122173.2-83.2-81.5000109.7
770R30.7Very low35.8Very low198 Ų198157.3 Ų157.375%0.74784%0.844SS**  trans-126.8111176.9176.2178.6175.4125.94.1108.4K768 Q772K768-R770 PolarHBondContact O-N 3.28Å; R770-Q772 HydrophobicContact CG-CG 4.28Å; R770-Q772 PolarHBondContact O-N 3.08Å
771D36.5Very low35.8Very low148 Ų148157.6 Ų157.679%0.79185%0.847SS**  trans-59.5120.6168.9-87-75.3000111.4
772Q32.8Very low35Very low149 Ų149156.8 Ų156.870%0.69685%0.845SS**  trans-14788.1169.4-81.2-77.385.500107.5R770R770-Q772 HydrophobicContact CG-CG 4.28Å; R770-Q772 PolarHBondContact O-N 3.08Å
773R37.6Very low35.3Very low235 Ų235149.7 Ų149.789%0.88783%0.831SS**  trans-66.4144.9171.9-68.3-175.3178.1-130.52.2110.5
774R32.2Very low35.5Very low240 Ų240155.4 Ų155.491%0.90684%0.836SS**  trans-130.4142.6157.7-98.4-172174.6174.5-0.3110.2
775P43.3Very low35.5Very low114 Ų114155.2 Ų155.274%0.7483%0.834SS**PPolyproline II helixtrans-84.9165.6-178.335.4-36.4000112.8
776P44.4Very low35.6Very low118 Ų118155.1 Ų155.177%0.76683%0.834SS**PPolyproline II helixtrans-70.1156.1176.229.8-36.4000113.2
777P41.8Very low35.7Very low129 Ų129161.7 Ų161.784%0.83884%0.843SS**PPolyproline II helixtrans-82.1127.9-179.232-33.9000113
778A32.9Very low35.7Very low102 Ų102164.9 Ų164.984%0.84384%0.843SS**PPolyproline II helixtrans-81.8138.8167.500000111.2
779R35.5Very low35.7Very low248 Ų248162.8 Ų162.894%0.93684%0.84SS**PPolyproline II helixtrans-79.8139.9174.6-67.9-179.9176.5-114.22.6110.8
780R34.4Very low35.9Very low250 Ų250158.8 Ų158.894%0.94383%0.834SS**PPolyproline II helixtrans-84.1146.4160.2-75.3-174.9177.8-120.56.8109.5
781G34Very low36.1Very low80 Ų80153.2 Ų153.283%0.82584%0.838SS**  trans-92.3175.4165.400000112.7
782S28.7Very low36.5Very low121 Ų121155.9 Ų155.985%0.84684%0.842SS**  trans-129.6149.7167.2-158.80000108.4
783P46.1Very low36.8Very low105 Ų105158 Ų15868%0.68285%0.852SS**  trans-105.4146.1-160.637.4-31.9000114.7
784Q35.2Very low37.1Very low201 Ų201155 Ų15594%0.93985%0.848SS**  trans178.3140.3141.6-98.4147.512.100112.4
785G32.8Very low37.2Very low82 Ų82151.3 Ų151.385%0.84585%0.847SS**  trans87.6115.5147.700000121
786G32.5Very low37.1Very low82 Ų82152.6 Ų152.685%0.84585%0.846SS**  trans95.7124.7134.800000119.9
787F36.5Very low37.2Very low208 Ų208152.3 Ų152.391%0.91284%0.844SS**  trans-90.6138.4163.8-66.8-107.2000111.2
788R34.9Very low37.6Very low238 Ų238151.8 Ų151.890%0.89884%0.841SS**  -162.8125.3127.1-61.1-156.4-169.4-101.8-6.1106.4
789L34.8Very low38.2Very low149 Ų149153.9 Ų153.978%0.7884%0.843SS**  68.3116.369.6-83.6169.9000116.2
790T36.4Very low38.1Very low138 Ų138147 Ų14785%0.84783%0.832SS**  trans62.2146.2150.854.50000121.6
791G34.3Very low38.9Very low80 Ų80140.9 Ų140.983%0.82583%0.825SS**  trans134.4110.115000000115.3
792K44.8Very low38.9Very low204 Ų204150.5 Ų150.589%0.88784%0.844SS**  trans-87.8142.1149.9-61.5174.9-178.4175.30106.6
793E39.4Very low39.4Very low193 Ų193152 Ų15290%0.90284%0.844SS**  -172.6179.1114.6-108.5173.9-16200113.1
794Q44.8Very low39.1Very low172 Ų172154.5 Ų154.580%0.80485%0.853SS**  trans-73.2162.3-173-59.6162.1-15.100111.9
795N32.7Very low39.3Very low164 Ų164151.9 Ų151.988%0.87785%0.848SS**  trans-153147145.6-120.5-91.1000112.1
796I42.4Very low39.7Very low141 Ų141156 Ų15672%0.72385%0.848SS**  trans-105.9145.3-180-70.7172.5000107
797P45.6Very low40.1Very low112 Ų112160.6 Ų160.673%0.72785%0.848SS**  trans-60.9145.9-174.823.3-35.1000113.3
798P51.3Low40.3Very low118 Ų118157.5 Ų157.577%0.76684%0.844SS**  trans-78.3151.3-174.632.4-36.4000112.8
799V44.1Very low40.7Very low146 Ų146151.7 Ų151.789%0.88584%0.84SS**  trans-119.2130.1163.5179.70000108.3
800S35.1Very low41.2Very low103 Ų103151.9 Ų151.972%0.7285%0.845SS**  trans-126.6153.7-176.4-67.80000109.8
801P50Low41.6Very low121 Ų121153.1 Ų153.179%0.78684%0.844SS**  -103.9152.7-117.335.3-38.5000115.9
802K34.6Very low42.3Very low283 Ų283159.7 Ų159.7100%1.2385%0.846SS**  trans-161.30146.2-113.9169-175.1175.70110.7

Retrieved 802 of 802 residues in 137.7 ms (Link to these results)