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Protein fork head

Fkh promotes terminal as opposed to segmental development. In the absence of fkh, this developmental switch does not occur. The nuclear localization of the fkh protein suggest that fkh regulates the transcription of other, subordinate, genes.

AlphaFold DB , UniProt , Accession P14734, Species DROME (Drosophila melanogaster, Fruit fly), Gene fkh, Length 510 aa.

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(Predicted Aligned Error values between residue pairs)
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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M48.9Very low58.5Low226 Ų226153 Ų153100%1.11382%0.819SS**  0-164.80-58.7178.4175.200108
2Q48.9Very low57.9Low158 Ų158149.8 Ų149.874%0.73882%0.818SS**  trans-31.7138.4-174.2-53.685.8-5.400115.2
3K47.4Very low58.2Low193 Ų193145.9 Ų145.984%0.83982%0.818SS**  cis64.485.111.2-152.4-170.5-170.4-1730116.7
4L56.8Low58Low150 Ų150144.5 Ų144.579%0.78582%0.818SS**  trans-173.4151.2148.4-81.1122.3000108.3
5Y61.9Low57.3Low211 Ų211144 Ų14483%0.82782%0.819SS**  cis-154.1167.3-32.2-127.2-94.4000106.9
6A47.9Very low57.3Low92 Ų92142.8 Ų142.876%0.7682%0.822SS**  trans-124.5151.4175.800000111.6
7E66.2Low56.9Low189 Ų189145.4 Ų145.488%0.88383%0.828SS**  trans-122.2123.5-174.1-107.5-92.7107.300110.6
8P66.5Low56.4Low101 Ų101142.6 Ų142.666%0.65683%0.825SS**PPolyproline II helixtrans-104150.6173.337.2-30.4000112.8
9P69.7Low56.1Low122 Ų122140.9 Ų140.979%0.79282%0.823SS**PPolyproline II helixtrans-74.4148.5177.531.1-35.1000113
10P70.9Confident56Low135 Ų135139.3 Ų139.388%0.87782%0.82SS**PPolyproline II helixtrans-76.8162.8-177.431.8-36.6000113.8
11S58.5Low55.5Low106 Ų106136.7 Ų136.774%0.74182%0.822SS**  trans-127.7154.3-172.662.40000114.7
12S51.5Low55.5Low114 Ų114129.7 Ų129.780%0.79781%0.808SS**  trans49.6124.6147.860.70000121.7
13A61.3Low55.4Low100 Ų100126.4 Ų126.483%0.82682%0.817SS**  trans-135.5155.715000000109.5
14P55.6Low55.4Low126 Ų126120.7 Ų120.782%0.81881%0.812SS**  trans-108.3177.9-147.440.6-36.7000117.1
15V47.4Very low55.7Low137 Ų137119.6 Ų119.683%0.8381%0.814SS**  trans-83.2157.5175.7-71.70000113.8
16S57.8Low55.9Low124 Ų124114.9 Ų114.987%0.86781%0.809SS**  trans-131.6148.3171.3-62.80000111
17M49.5Very low56.2Low188 Ų188116.2 Ų116.293%0.92681%0.813SS**  trans-115.5149-175.5-51.3-174.4-160.300113.7
18A47.9Very low55.5Low94 Ų94111.1 Ų111.178%0.77781%0.812SS**  trans178.9127.6144.300000108.2
19S51.4Low54.6Low111 Ų111110.5 Ų110.578%0.77682%0.824SS**  72.5130.670.7-145.60000113
20S53.3Low53.7Low109 Ų109108.5 Ų108.576%0.76283%0.825SS**  cis-176.1148.4-5.835.60000112.4
21G47.2Very low52.7Low85 Ų85106.3 Ų106.388%0.87683%0.827SS**  trans83.9158.7164.500000116.7
22G47.8Very low52.3Low79 Ų79105.1 Ų105.181%0.81483%0.831SS**  cis173147.1-8.100000113.6
23G46.8Very low52.2Low89 Ų89103.9 Ų103.992%0.91884%0.837SS**  trans79.6158179.200000115.1
24G46.9Very low51.8Low72 Ų72103 Ų10374%0.74284%0.837SS**  cis165.4121.2-5.500000111.1
25P63.3Low51.7Low127 Ų127101.1 Ų101.183%0.82584%0.841SS**  trans-108.4149.6-166.738.3-33.8000116.5
26P66Low51.9Low112 Ų11298.4 Ų98.473%0.72784%0.841SS**  trans-107.1146.1149.136-27.3000110.6
27S54.8Low51.7Low120 Ų12096.7 Ų96.784%0.83984%0.843SS**  cis81.7112.727.984.90000115.8
28G51.2Low51.7Low83 Ų8391.7 Ų91.786%0.85684%0.839SS**  trans136.7112.6156.900000118
29G48.5Very low51.7Low88 Ų8891.3 Ų91.391%0.90784%0.844SS**  trans79.1153.3158.200000118.1
30G49.6Very low51.6Low79 Ų7989.7 Ų89.781%0.81485%0.845SS**  cis164119.1-11.300000114.5
31G50.1Low52Low90 Ų9090.4 Ų90.493%0.92885%0.847SS**  trans78.4159.8175.900000115.4
32G50.2Low52.6Low80 Ų8091.8 Ų91.883%0.82584%0.841SS**  cis171.7131.6-9.200000113.2
33G50.6Low53.7Low89 Ų8993.9 Ų93.992%0.91884%0.84SS**  trans79.2158.4178.700000115.3
34G52.2Low54.1Low81 Ų8195.6 Ų95.684%0.83584%0.835SS**  cis171.4126.5-9.100000113.3
35G52.4Low54.2Low87 Ų8798.2 Ų98.290%0.89784%0.842SS**  trans80.2156.2177.800000115.4
36G53Low53.7Low80 Ų8099.7 Ų99.783%0.82584%0.843SS**  cis172.5132.8-8.900000113.3
37G52.2Low52.8Low88 Ų88102 Ų10291%0.90785%0.849SS**  trans75.1157.4179.100000114.8
38G49.2Very low52.7Low82 Ų82103.2 Ų103.285%0.84585%0.846SS**  cis-170.5140.5-7.900000109.6
39G48.2Very low52.8Low87 Ų87104.4 Ų104.490%0.89784%0.838SS**  trans-95.5162.9-170.400000115.5
40G49.3Very low52.7Low76 Ų76107.7 Ų107.778%0.78484%0.835SS**  trans-132.5136.5171.100000111.6
41P63.1Low52.8Low124 Ų124109.3 Ų109.381%0.80583%0.832SS**PPolyproline II helixtrans-97.7164-17037.7-36.6000115.1
42P59.4Low52.6Low115 Ų115111 Ų11175%0.74782%0.824SS**PPolyproline II helixtrans-82.8162.3168.735.2-35.3000113.2
43P71.3Confident52.4Low122 Ų122112.1 Ų112.179%0.79282%0.819SS**PPolyproline II helixtrans-81.1157-177.832.9-36.3000114.5
44P55.3Low52.1Low126 Ų126116 Ų11682%0.81882%0.819SS**PPolyproline II helixtrans-95.9163.2-173.437.9-36.8000115.3
45S48.1Very low51.7Low126 Ų126115.6 Ų115.688%0.88182%0.815SS**PPolyproline II helixtrans-85.1143172.2-52.40000112.4
46N52.6Low51.2Low159 Ų159115.3 Ų115.385%0.8581%0.812SS**PPolyproline II helixtrans-88.2138.1175.4-170.515000111.4
47N47.3Very low50.6Low159 Ų159117.3 Ų117.385%0.8581%0.813SS**  trans-152.4130.5172.1-137.4-3.1000110
48N52.6Low50.3Low146 Ų146121.9 Ų121.978%0.78181%0.813SS**  trans-114120.6-162.9-172.327.6000112.5
49P53.9Low50Low108 Ų108123.5 Ų123.570%0.70181%0.812SS**  trans-97.9144.4-179.936.4-32.4000113.7
50N46.2Very low49.9Very low158 Ų158124.6 Ų124.685%0.84580%0.803SS**  trans-154.8163.1159.8-125.1-2.2000109
51P52.6Low49.5Very low113 Ų113129.1 Ų129.173%0.73481%0.808SS**  -125.4-161.2-122.133.1-11.3000114.5
52T45.8Very low48.6Very low125 Ų125127.5 Ų127.577%0.76781%0.805SS**  trans-66163-16548.50000117.1
53S45.9Very low47.6Very low104 Ų104133.7 Ų133.773%0.72781%0.814SS**  trans62.7108144.859.90000119
54N43.1Very low45.9Very low170 Ų170132.8 Ų132.891%0.90981%0.81SS**  -151.3154.298.3-134.5-14.9000112.4
55G43.8Very low45.3Very low73 Ų73131.2 Ų131.275%0.75381%0.808SS**  trans-97.7138.8174.300000111.4
56G42.4Very low45Very low80 Ų80135.9 Ų135.983%0.82581%0.808SS**  trans-165.499.5179.100000112.5
57S41.3Very low44.5Very low123 Ų123133.1 Ų133.186%0.8680%0.797SS**  trans-90.3103.6175.4-177.70000110.7
58M45.7Very low44.4Very low184 Ų184134.4 Ų134.491%0.90680%0.8SS**  trans-152.4122.6154.2-77.8-155.6169.800110.4
59S42.1Very low44Very low116 Ų116134.2 Ų134.281%0.81180%0.799SS**  trans-71.1146.8152.6-48.30000108.1
60P46.3Very low43.3Very low109 Ų109134.7 Ų134.771%0.70881%0.805SS**  -154.1-166.189.937.7-17000114.9
61L41.9Very low43.1Very low172 Ų172136.2 Ų136.290%0.90181%0.809SS**  trans84.4144.8162.6-62.8164.5000118
62A42.5Very low42.6Very low90 Ų90134 Ų13474%0.74481%0.807SS**  trans-115.9-174.7-174.100000111.1
63R38.1Very low42.3Very low244 Ų244135.7 Ų135.792%0.92181%0.81SS**  trans86.1144.7-162.3-57.7167.4160.9-174.6-7.6111.8
64S37.6Very low42.4Very low104 Ų104136.9 Ų136.973%0.72782%0.816SS**  cis-118.81349-70.70000113.3
65A42.4Very low42.5Very low92 Ų92135.2 Ų135.276%0.7681%0.811SS**  trans-87.6131.6153.200000108.1
66Y41.9Very low42.6Very low224 Ų224135.2 Ų135.288%0.87881%0.812SS**  trans-86.4111176.720.5-91.7000109.8
67T41.5Very low42.4Very low101 Ų101135.4 Ų135.462%0.6281%0.814SS**  trans-142118171.1-64.90000108.7
68M44.4Very low42.6Very low187 Ų187138.6 Ų138.692%0.92182%0.817SS**  trans-130.880.1170-69.4-73.4-77.800104.8
69N44.2Very low42.4Very low141 Ų141135 Ų13575%0.75481%0.81SS**  50.5116.787.8-82.87.3000114
70S38.9Very low42.3Very low119 Ų119134.7 Ų134.783%0.83281%0.808SS**  trans-77.3133.5172.71770000111.6
71M43.8Very low42.3Very low190 Ų190136.1 Ų136.194%0.93682%0.815SS**  trans-150.6149.6153.6-68.3-162.1-63.700108
72G40.4Very low42.3Very low67 Ų67133.1 Ų133.169%0.69181%0.808SS**  cis163.540.2-2.400000115.7
73L39.6Very low42.4Very low159 Ų159134.4 Ų134.483%0.83281%0.809SS**  trans64.9176.3-176.2-48.1174.1000112.2
74P49.5Very low42.5Very low129 Ų129132.6 Ų132.684%0.83881%0.811SS**  cis-112.2169.143.339.7-33.1000115.5
75V45.1Very low42.5Very low135 Ų135132.2 Ų132.282%0.81881%0.814SS**  trans-97.1139.5170.9167.60000110.8
76G45Very low42.2Very low74 Ų74132.6 Ų132.676%0.76382%0.817SS**  trans-156148159.900000109.4
77G38Very low41.9Very low84 Ų84126.2 Ų126.287%0.86681%0.811SS**  cis138.650.45.900000111.9
78M45.8Very low41.8Very low189 Ų189127.9 Ų127.993%0.93182%0.821SS**  trans-138.315717562167.758.700111.6
79S41.5Very low41.5Very low109 Ų109128 Ų12876%0.76282%0.817SS**  trans-114.2141.2-147.552.30000115.3
80S39Very low41.2Very low110 Ų110127.5 Ų127.577%0.76982%0.824SS**  trans24.1106.9139.6-173.10000118.5
81V46.3Very low41.2Very low139 Ų139127.1 Ų127.184%0.84282%0.822SS**  trans-137.7135.7137.6-76.60000109.4
82S41.8Very low41.1Very low109 Ų109123 Ų12376%0.76281%0.811SS**  trans-155.9-178.9175.9-59.10000108
83P46Very low41.1Very low117 Ų117125.8 Ų125.876%0.7682%0.815SS**  -130.1160.2-89.636.9-20.4000113.2
84Q38.9Very low41.3Very low205 Ų205126.3 Ų126.396%0.95882%0.817SS**  trans-156.1165.4154.1-124.8162.6-4.800116
85A37.5Very low40.8Very low97 Ų97127.3 Ų127.380%0.80282%0.816SS**  trans-88.3162.3-165.600000114.1
86A37.1Very low40.7Very low99 Ų99125.1 Ų125.182%0.81881%0.807SS**  -154.7146.6125.800000109.2
87A35.5Very low40.4Very low91 Ų91126 Ų12675%0.75281%0.806SS**  trans-121.2127171.100000109
88T40.3Very low40.3Very low136 Ų136126.6 Ų126.683%0.83480%0.803SS**  trans-139.1127.9170.2-37.40000111.6
89F37Very low40Very low190 Ų190122 Ų12283%0.83380%0.796SS**  trans-70.5147.1-179.9-40.3-100.6000113
90S38.6Very low40.1Very low130 Ų130123.3 Ų123.391%0.90980%0.798SS**  trans-163.4160.6138.6-92.10000111.2
91S38.8Very low40Very low111 Ų111122.5 Ų122.578%0.77680%0.799SS**  trans-142.6177.5-163.659.40000112.8
92S41.6Very low39.6Very low103 Ų103120.9 Ų120.972%0.7279%0.793SS**  trans91.5160.1160.382.50000119.6
93V40.7Very low39.6Very low126 Ų126125 Ų12576%0.76480%0.803SS**  trans57.8122.7-179.1-51.90000116.8
94L43.5Very low39.1Very low169 Ų169125.2 Ų125.289%0.88581%0.807SS**  cis74.3102.826.9-52.5172.1000115.6
95D39.2Very low39.1Very low151 Ų151120.1 Ų120.181%0.80780%0.8SS**  trans-156145.6138.4-160.526.6000114.3
96S42.7Very low39.2Very low89 Ų89120.6 Ų120.662%0.62280%0.798SS**  trans20127.6149.5-62.80000122.1
97A38.9Very low39.4Very low91 Ų91125.3 Ų125.375%0.75281%0.805SS**  75.9112.374.100000113.1
98A36Very low39.6Very low97 Ų97126.6 Ų126.680%0.80281%0.809SS**  91.515967.400000113.3
99A39.9Very low39.6Very low94 Ų94124.4 Ų124.478%0.77780%0.804SS**  trans73.1152.4179.800000117.1
100V42Very low39.6Very low135 Ų135119.7 Ų119.782%0.81880%0.795SS**  cis-159166.8-31.5-91.20000109.8
101A38.8Very low39.7Very low94 Ų94121.5 Ų121.578%0.77779%0.791SS**  trans74.3135.5144.500000121.3
102S36.4Very low39.7Very low104 Ų104121.7 Ų121.773%0.72779%0.793SS**  trans-82.5150.1171.552.70000113.3
103M42.7Very low39.5Very low195 Ų195121.3 Ų121.396%0.96180%0.796SS**  trans-135.2141.6153.2-74.5-64.3167.500110.1
104S35.5Very low39.5Very low122 Ų122120.3 Ų120.385%0.85379%0.794SS**  trans-153.2107.7179.5161.30000109.8
105A39Very low39.4Very low98 Ų98120.5 Ų120.581%0.8179%0.792SS**  trans-149.6132.1170.800000112.6
106S38.9Very low39.5Very low108 Ų108120.5 Ų120.576%0.75579%0.792SS**  trans-28.9146166.252.40000119.5
107M41.3Very low39.4Very low198 Ų198121 Ų12198%0.97580%0.802SS**  trans-138165.4130.2-73.9-153.917000110.2
108S39.5Very low39.4Very low118 Ų118121.7 Ų121.783%0.82580%0.802SS**  trans-147.5169.9-166.5-172.80000111.7
109A39.8Very low39.8Very low90 Ų90126.4 Ų126.474%0.74481%0.809SS**  trans70.9149.8172.900000115.5
110S39Very low39.8Very low91 Ų91129.6 Ų129.664%0.63681%0.813SS**  cis-170.7-171-8.741.80000111.7
111M39.8Very low39.8Very low168 Ų168126.5 Ų126.583%0.82881%0.809SS**  trans101.7104.3151.1-45.4-159.9-170.500120.9
112S38.3Very low39.7Very low115 Ų115127.5 Ų127.580%0.80481%0.81SS**  66.3101.2125.2-53.20000124.1
113A38.6Very low40.1Very low95 Ų95132.2 Ų132.279%0.78582%0.823SS**  trans25.2141.5130.200000123.4
114S39.4Very low39.9Very low104 Ų104126.4 Ų126.473%0.72781%0.813SS**  169.2169.296.559.50000116.6
115M41.6Very low40.2Very low173 Ų173125.5 Ų125.585%0.85281%0.813SS**  trans7188.2156.9-55.8-66.3174.100122.8
116N40.7Very low40Very low151 Ų151125.8 Ų125.881%0.80782%0.816SS**  7.5132.6128.3-17934.3000121.9
117A41.7Very low39.9Very low101 Ų101125.4 Ų125.484%0.83582%0.819SS**  trans-153153.9140.600000111.2
118S38.4Very low40.2Very low105 Ų105124.2 Ų124.273%0.73481%0.813SS**  trans-137.7144.1-176175.70000112.1
119M44.5Very low40.3Very low195 Ų195125.8 Ų125.896%0.96181%0.812SS**  trans-144.7143.9160.5-77-159.2167.200111.7
120N39Very low40.3Very low162 Ų162125.8 Ų125.887%0.86681%0.807SS**  trans-145.1149.2176.7-17821.6000108
121G42.5Very low40.7Very low70 Ų70130.1 Ų130.172%0.72282%0.819SS**  trans-164.7137.2-179.100000113.2
122S37.6Very low40.8Very low114 Ų114126 Ų12680%0.79782%0.82SS**  trans-150.6137.7-177.457.60000112.5
123M44.7Very low41Very low203 Ų203123.8 Ų123.8100%182%0.815SS**  trans-176.8151.5170.5-100.1169.5-175.900107.1
124G38.6Very low41.2Very low73 Ų73127 Ų12775%0.75382%0.819SS**  cis175.1143.7-10.300000113.2
125A40.7Very low41.2Very low103 Ų103127.6 Ų127.685%0.85182%0.822SS**  trans51.7106.1154.100000124.2
126A35.8Very low41.4Very low105 Ų105126.5 Ų126.587%0.86882%0.816SS**  48.9135.8112.700000125.3
127A37.5Very low41.7Very low100 Ų100125.1 Ų125.183%0.82681%0.814SS**  trans153.2161.7142.800000111.6
128M46.1Very low42Very low172 Ų172125.5 Ų125.585%0.84781%0.807SS**  cis-169.6166.9-48.3-136.4174.1165.700109.5
129N42.5Very low42.2Very low151 Ų151125.8 Ų125.881%0.80781%0.81SS**  trans75.7156.8170.9-57.3-41.9000119.5
130S40.4Very low42.1Very low91 Ų91121.9 Ų121.964%0.63680%0.801SS**  cis-172.4161.4-32-166.10000111.9
131M47Very low42.5Very low182 Ų182122.4 Ų122.490%0.89780%0.801SS**  trans63.7149.2165.7-63.313773.500118.5
132G41Very low42.3Very low82 Ų82124.3 Ų124.385%0.84580%0.803SS**  cis121.9130.6-600000113.7
133G42.1Very low42.6Very low67 Ų67130 Ų13069%0.69181%0.809SS**  cis175.2-174.5-2.500000113.3
134N42.5Very low42.3Very low163 Ų163125.2 Ų125.287%0.87280%0.802SS**  trans74.5160.9174.6-46.3-1000114.7
135C39.4Very low42.4Very low117 Ų117127.4 Ų127.479%0.79181%0.806SS**  cis-160-177.19.760.20000110
136M47.8Very low42.8Very low149 Ų149131.6 Ų131.673%0.73481%0.81SS**  cis-166.5131.2-42.9-93.8-57.4-160.900111.6
137T46.7Very low43Very low123 Ų123129.9 Ų129.976%0.75580%0.802SS**  trans64.9165.914563.40000122.7
138P46.3Very low43.2Very low108 Ų108130.9 Ų130.970%0.70180%0.803SS**  cis-142.5-175.4-44.241-23.7000116.4
139S42.9Very low43.7Very low112 Ų112129 Ų12978%0.78380%0.803SS**  trans78.8110.3146.9-61.50000122.8
140S43.9Very low43.8Very low112 Ų112130.1 Ų130.178%0.78381%0.809SS**  -179129105.764.30000114.8
141M47.4Very low43.9Very low173 Ų173129.3 Ų129.385%0.85282%0.815SS**  trans37.9111.7143.9-53.6-177.982.600119.7
142S38.1Very low43.9Very low111 Ų111128.2 Ų128.278%0.77681%0.813SS**  90.492.463.9-70.10000115.8
143Y42.9Very low44.1Very low232 Ų232133.8 Ų133.891%0.9182%0.819SS**  trans-156.514713552.6-94000110.4
144A39.7Very low44.2Very low104 Ų104133.9 Ų133.986%0.8682%0.82SS**  trans-111.3137.6-17900000110.8
145S40.1Very low44.1Very low119 Ų119130.1 Ų130.183%0.83282%0.82SS**  trans-145.9144.5161.7-165.80000110.7
146M49.8Very low44.6Very low191 Ų191130.8 Ų130.894%0.94182%0.824SS**  trans-78.5153.8-175.1-47.5175-137.400109.2
147G39.2Very low44.4Very low69 Ų69132.6 Ų132.671%0.71183%0.833SS**  cis140.8102.67.600000108.5
148S42Very low44.3Very low120 Ų120130.5 Ų130.584%0.83983%0.829SS**  trans-133.5127.8-175.6-66.80000111.6
149P56.1Low44.3Very low132 Ų132133.6 Ų133.686%0.85784%0.836SS**  trans-96.3112.3170.433.3-27.7000111
150L44Very low44.3Very low175 Ų175134.6 Ų134.692%0.91684%0.842SS**  trans-102.6107.7170.2-173.577.9000110.6
151G44Very low44.2Very low74 Ų74134.3 Ų134.376%0.76385%0.847SS**  trans72.2115.7153.300000118.2
152N46.5Very low43.9Very low160 Ų160130.3 Ų130.386%0.85684%0.842SS**  trans-147117.4144.1-16728.2000109.8
153M45.7Very low44.1Very low199 Ų199129.8 Ų129.898%0.9884%0.838SS**  trans-156.589.4169.8-164175.9-167.600110.4
154G43.9Very low44.4Very low68 Ų68126.6 Ų126.670%0.70183%0.833SS**  trans-169.8129.517400000111
155G40.7Very low44.5Very low85 Ų85127.3 Ų127.388%0.87683%0.832SS**  trans85.790.6170.300000116.3
156C48.5Very low44.8Very low131 Ų131126 Ų12689%0.88583%0.828SS**  trans-137.3101146.455.40000109.5
157M43.9Very low44.4Very low186 Ų186122 Ų12292%0.91683%0.826SS**  trans-134.8139.5171.3-99-83.8-95.800106.8
158A44.4Very low44.6Very low80 Ų80122.2 Ų122.266%0.66183%0.828SS**  trans62.2119.4-175.200000115.9
159M46Very low44.9Very low173 Ų173125 Ų12585%0.85283%0.832SS**  175.1119.4105.4-77.7-40.9164.600109.6
160S42.7Very low44.3Very low132 Ų132123.6 Ų123.692%0.92383%0.826SS**  trans167.3126145.7-80.20000110.1
161A41.7Very low44.3Very low106 Ų106118.7 Ų118.788%0.87682%0.817SS**  trans-141.5119174.300000110.8
162A42.1Very low44.4Very low90 Ų90119.7 Ų119.774%0.74481%0.809SS**  trans-157133.3163.400000105.8
163S41.4Very low44.5Very low99 Ų99122.6 Ų122.669%0.69281%0.809SS**  cis71.6129.447.9-53.60000111.1
164M49.3Very low44.3Very low166 Ų166116.5 Ų116.582%0.81880%0.797SS**  cis-149.1173.920.9-54.4-86.9-179.400112.3
165S41.5Very low44.3Very low119 Ų119118.4 Ų118.483%0.83281%0.806SS**  trans73.6154.8146.3-61.10000121.3
166A46.5Very low44.6Very low90 Ų90122.9 Ų122.974%0.74481%0.806SS**  cis-170.4160.8-24.600000111.6
167A42.8Very low44.9Very low109 Ų109122.6 Ų122.690%0.90180%0.803SS**  trans64.5137.8175.300000116.8
168G42.6Very low45.3Very low73 Ų73119.8 Ų119.875%0.75380%0.799SS**  cis-160.2-160.8-2.400000109.9
169L49.1Very low45.1Very low177 Ų177119.1 Ų119.193%0.92780%0.799SS**  cis-160.6-153.7-4.5-131.4176.1000109.9
170S43Very low45.2Very low104 Ų104116.5 Ų116.573%0.72780%0.798SS**  trans-66.1156.8176.9-162.60000113.3
171G44Very low45.2Very low71 Ų71120.5 Ų120.573%0.73279%0.793SS**  cis142.4171.210.300000108.8
172T46.1Very low45.1Very low95 Ų95124 Ų12458%0.58379%0.791SS**  cis-163.2155.1-3.5-41.40000108.3
173Y48Very low45.1Very low222 Ų222127.1 Ų127.187%0.87179%0.792SS**  trans52.3150.3165.852.5-115000120.2
174G42.7Very low44.9Very low70 Ų70129.7 Ų129.772%0.72279%0.794SS**  cis172.2169.8-7.200000112.9
175A43.2Very low44.6Very low109 Ų109128.5 Ų128.590%0.90180%0.796SS**  trans70.8157.2171.400000119.9
176M47.4Very low44.6Very low178 Ų178126.1 Ų126.188%0.87779%0.79SS**  trans-122.3172.2178.4-63.2-177.1165.500110.3
177P55.2Low44.6Very low126 Ų126127.7 Ų127.782%0.81880%0.796SS**  -1471699539.2-23.7000115.5
178P51.2Low44.8Very low127 Ų127128.5 Ų128.583%0.82579%0.792SS**  trans-107.2158.1177.639.3-32.7000114.7
179G39.9Very low45Very low65 Ų65132 Ų13267%0.6779%0.793SS**  trans143.1152.8155.600000116.8
180S48.4Very low45.2Very low119 Ų119129.2 Ų129.283%0.83279%0.789SS**  trans65.8154175.279.70000116.6
181R42.5Very low45.5Very low215 Ų215132.7 Ų132.781%0.81180%0.798SS**  cis-165.9166.8-33.8-118.2174.9-175.5153.70.8107
182E39.2Very low45.6Very low180 Ų180132.7 Ų132.784%0.84180%0.798SS**  trans61.9172.4161.9-69.3159.8156.700116
183M43.8Very low45.8Very low155 Ų155138.8 Ų138.876%0.76481%0.81SS**  cis-150.2152.2-48.8179.559.3178.600107.7
184E35.6Very low45.5Very low154 Ų154134.2 Ų134.272%0.7281%0.811SS**  trans-22.1126.5173.7-177.8-178.1-172.100118.6
185T44.7Very low46Very low140 Ų140141.1 Ų141.186%0.85982%0.815SS**  -171.9135.3129.213.50000115.1
186G41.7Very low46.7Very low70 Ų70141.2 Ų141.272%0.72280%0.804SS**  trans72.296.7138.500000122
187S46Very low46.8Very low123 Ų123140.2 Ų140.286%0.8680%0.803SS**  trans-168.3112139.3-89.30000113.3
188P47.4Very low47.1Very low126 Ų126141.5 Ų141.582%0.81880%0.795SS**  trans-101.193.318035.7-30.2000113
189N46.2Very low46.9Very low145 Ų145141.4 Ų141.478%0.77580%0.795SS**  trans-166.8117.8156.3-116.8-32.3000113.9
190S51.9Low47.6Very low120 Ų120142.4 Ų142.484%0.83979%0.788SS**  trans-16782.6165.5-81.90000111G192S190-G192 PolarHBondContact O-N 3.27Å
191L50.7Low47.8Very low177 Ų177142.4 Ų142.493%0.92778%0.783SS**  trans-67.4100.2177.4-69.7163.3000110.7
192G46.7Very low47.9Very low70 Ų70140.3 Ų140.372%0.72278%0.776SS**  trans-1189.3-156.200000119.4S190S190-G192 PolarHBondContact O-N 3.27Å
193R49.6Very low48.6Very low223 Ų223141.5 Ų141.584%0.84277%0.773SS**  trans56.498177.3-67.6176.8162.6173.6-5.6116.6R195R193-R195 PolarHBondContact O-N 3.21Å
194S40.8Very low49.1Very low127 Ų127143.1 Ų143.189%0.88877%0.771SS**  trans-56.8127.2152.3177.70000109.8
195R54.8Low49.8Very low215 Ų215140.9 Ų140.981%0.81177%0.772SS**  trans-122.492.8177.9-178.7-176.7-86.1152-9.6109.6R193 D197R193-R195 PolarHBondContact O-N 3.21Å; R195-D197 PolarHBondContact O-N 3.44Å
196V56.1Low50.4Low110 Ų110140.9 Ų140.967%0.66776%0.757SS**  trans-19.2116.3171.2-178.90000114.3
197D49.6Very low51.5Low158 Ų158140.4 Ų140.485%0.84574%0.74SS**  trans-58136170.7-81-76.9000112.5R195R195-D197 PolarHBondContact O-N 3.44Å
198K61.5Low53.1Low153 Ų153140.9 Ų140.967%0.66573%0.729SS**  trans-141.6129.3172.2-157.571.567.5-175.50107.2T200K198-T200 PolarHBondContact O-N 2.83Å
199P47.3Very low55.1Low125 Ų125136.9 Ų136.981%0.81271%0.706SS**  trans-7193.8-165.426.3-35.3000112.4
200T55.5Low57.2Low85 Ų85136.3 Ų136.352%0.52170%0.697SS.*  trans-94.7-9.2-178.5530000114.3K198 Y202 R203K198-T200 PolarHBondContact O-N 2.83Å; T200-Y202 VanDerWaalsContact C-N 3.34Å; T200-Y202 PolarHBondContact O-N 2.77Å; T200-R203 WeakPolarHBondContact O-CB 3.49Å; T200-R203 PolarHBondContact O-N 3.41Å
201T51.9Low59.1Low120 Ų120131.2 Ų131.274%0.73666%0.661SS**G310 helixtrans-59.4-39.3-172.7-44.70000113.3R203T201-R203 PolarHBondContact O-N 3.47Å
202Y45.8Very low61Low171 Ų171127.9 Ų127.967%0.67165%0.65SS**G310 helixtrans-67.4-19.1179.7-158.9-97.1000113.6T200 R204 Y206T200-Y202 VanDerWaalsContact C-N 3.34Å; T200-Y202 PolarHBondContact O-N 2.77Å; Y202-R204 PolarHBondContact O-N 3.25Å; Y202-Y206 HydrophobicContact CD1-CD2 4.32Å; Y202-Y206 HydrophobicContact CD1-CE2 4.27Å; Y202-Y206 AromaticContact CE1-CD2 3.9Å; Y202-Y206 HydrophobicContact CE1-CD2 3.9Å; Y202-Y206 AromaticContact CE1-CE2 3.49Å; Y202-Y206 HydrophobicContact CE1-CE2 3.49Å; Y202-Y206 VanDerWaalsContact CE1-CE2 3.49Å; Y202-Y206 HydrophobicContact CE2-CE2 4.18Å; Y202-Y206 AromaticContact CZ-CE2 3.44Å; Y202-Y206 VanDerWaalsContact CZ-CE2 3.44Å; Y202-Y206 WeakPolarHBondContact OH-CE2 3.49Å; Y202-Y206 PolarHBondContact OH-OH 3.45Å; Y202-Y206 VanDerWaalsContact OH-OH 3.07Å
203R52.6Low63.2Low205 Ų205128.3 Ų128.377%0.77463%0.63SS**G310 helixtrans-76.2-16-175.9-107.6-74.4-172162.52.9114.3T200 T201T200-R203 WeakPolarHBondContact O-CB 3.49Å; T200-R203 PolarHBondContact O-N 3.41Å; T201-R203 PolarHBondContact O-N 3.47Å
204R53.7Low65.3Low189 Ų189119.7 Ų119.771%0.71360%0.604SS**THydrogen-bonded Turntrans-86.3-40.4-170.8-69.7-174.9-177.1154.75114.6Y202 Y206 T207Y202-R204 PolarHBondContact O-N 3.25Å; R204-Y206 VanDerWaalsContact C-N 3.34Å; R204-Y206 PolarHBondContact O-N 3.47Å; R204-T207 PolarHBondContact O-OG1 3.33Å; R204-T207 VanDerWaalsContact O-OG1 3.08Å
205S51.5Low67.9Low107 Ų107116.7 Ų116.775%0.74857%0.574SS**THydrogen-bonded Turntrans-74.7-22.1-175.6-49.30000114.1
206Y56.7Low69.8Low140 Ų140108.1 Ų108.155%0.54954%0.544SS..THydrogen-bonded Turntrans-86.2-5.5-178.2-81.2-87.9000114.9Y202 R204 H208 A209Y202-Y206 HydrophobicContact CD1-CD2 4.32Å; Y202-Y206 HydrophobicContact CD1-CE2 4.27Å; Y202-Y206 AromaticContact CE1-CD2 3.9Å; Y202-Y206 HydrophobicContact CE1-CD2 3.9Å; Y202-Y206 AromaticContact CE1-CE2 3.49Å; Y202-Y206 HydrophobicContact CE1-CE2 3.49Å; Y202-Y206 VanDerWaalsContact CE1-CE2 3.49Å; Y202-Y206 HydrophobicContact CE2-CE2 4.18Å; Y202-Y206 AromaticContact CZ-CE2 3.44Å; Y202-Y206 VanDerWaalsContact CZ-CE2 3.44Å; Y202-Y206 WeakPolarHBondContact OH-CE2 3.49Å; Y202-Y206 PolarHBondContact OH-OH 3.45Å; Y202-Y206 VanDerWaalsContact OH-OH 3.07Å; R204-Y206 VanDerWaalsContact C-N 3.34Å; R204-Y206 PolarHBondContact O-N 3.47Å; Y206-H208 PolarHBondContact O-N 3.14Å; Y206-A209 HydrophobicContact CD1-CB 4.12Å; Y206-A209 PolarHBondContact O-N 3.19Å
207T65.1Low71.6Confident59 Ų59103 Ų10336%0.36251%0.513SS..THydrogen-bonded Turntrans-62.5-29.1-176.254.10000113.9R204 P245R204-T207 PolarHBondContact O-OG1 3.33Å; R204-T207 VanDerWaalsContact O-OG1 3.08Å; T207-P245 WeakPolarHBondContact O-CD 3.34Å
208H79.3Confident73.8Confident134 Ų13495.6 Ų95.662%0.6247%0.473SS*.THydrogen-bonded Turntrans-105.21.1179.2-60-75.1000113.3Y206 F246Y206-H208 PolarHBondContact O-N 3.14Å; H208-F246 WeakPolarHBondContact O-CD2 3.47Å
209A88.9Confident75.5Confident41 Ų4188.3 Ų88.334%0.33944%0.442SS..SBendtrans-80.3151.3173.400000110.8Y206 P211 F246Y206-A209 HydrophobicContact CD1-CB 4.12Å; Y206-A209 PolarHBondContact O-N 3.19Å; A209-P211 VanDerWaalsContact O-CD 3.31Å; A209-P211 WeakPolarHBondContact O-CD 3.48Å; A209-F246 WeakPolarHBondContact O-CB 3.08Å
210K92.1Very high77.7Confident133 Ų13382.4 Ų82.458%0.57840%0.403SS*.PPolyproline II helixtrans-64.4122.1173.4-177.2178.8175.6-173.40109.8F246K210-F246 HydrophobicContact CB-CD1 4.17Å; K210-F246 HydrophobicContact CB-CD2 4.28Å; K210-F246 HydrophobicContact CB-CE1 3.79Å; K210-F246 HydrophobicContact CB-CE2 3.9Å; K210-F246 HydrophobicContact CB-CG 4.42Å; K210-F246 HydrophobicContact CB-CZ 3.64Å; K210-F246 HydrophobicContact CD-CE1 4.24Å; K210-F246 HydrophobicContact CD-CZ 4.21Å; K210-F246 HydrophobicContact CG-CD1 4.22Å; K210-F246 HydrophobicContact CG-CE1 3.65Å; K210-F246 HydrophobicContact CG-CZ 3.89Å
211P91.9Very high79.6Confident14 Ų1479.2 Ų79.29%0.09138%0.383CS..PPolyproline II helixtrans-63.6145.9178.1-21.933.3000112.2A209 Y213 F244 Y247A209-P211 VanDerWaalsContact O-CD 3.31Å; A209-P211 WeakPolarHBondContact O-CD 3.48Å; P211-Y213 HydrophobicContact CB-CD2 3.68Å; P211-Y213 HydrophobicContact CB-CE2 4.3Å; P211-Y213 PolarHBondContact O-N 3.06Å; P211-F244 HydrophobicContact CB-CD1 4Å; P211-F244 HydrophobicContact CB-CE1 4.03Å; P211-F244 HydrophobicContact CB-CG 4.35Å; P211-F244 HydrophobicContact CB-CZ 4.42Å; P211-F244 HydrophobicContact CG-CB 3.77Å; P211-F244 HydrophobicContact CG-CD1 3.36Å; P211-F244 HydrophobicContact CG-CD2 4.15Å; P211-F244 HydrophobicContact CG-CE1 3.93Å; P211-F244 HydrophobicContact CG-CG 3.49Å; P211-F244 VanDerWaalsContact CG-CG 3.49Å; P211-Y247 HydrophobicContact CG-CE2 4.01Å
212P90.2Very high81.7Confident107 Ų10773.5 Ų73.570%0.69535%0.348SS*.SBendtrans-76.834.4-179.834.4-37.7000113.4
213Y92.4Very high84.1Confident78 Ų7865.4 Ų65.431%0.30632%0.316SS..  trans-112143-175.6-61.1-53000111.4P211 L218 M221 F244P211-Y213 HydrophobicContact CB-CD2 3.68Å; P211-Y213 HydrophobicContact CB-CE2 4.3Å; P211-Y213 PolarHBondContact O-N 3.06Å; Y213-L218 HydrophobicContact CD2-CD2 4.43Å; Y213-M221 HydrophobicContact CD2-CE 3.95Å; Y213-M221 HydrophobicContact CE2-CE 4.33Å; Y213-M221 HydrophobicContact CG-CE 4.09Å; Y213-F244 HydrophobicContact CD2-CE1 4.24Å; Y213-F244 HydrophobicContact CD2-CE2 4.19Å; Y213-F244 AromaticContact CD2-CZ 3.64Å; Y213-F244 HydrophobicContact CD2-CZ 3.64Å; Y213-F244 AromaticContact CE2-CE1 3.99Å; Y213-F244 HydrophobicContact CE2-CE1 3.99Å; Y213-F244 AromaticContact CE2-CZ 3.56Å; Y213-F244 HydrophobicContact CE2-CZ 3.56Å
214S93.8Very high86Confident43 Ų4357.6 Ų57.630%0.30129%0.288SS..  trans-75.9159.5172.883.70000111.2I216 S217 L218S214-I216 PolarHBondContact O-N 2.99Å; S214-I216 PolarHBondContact OG-N 2.72Å; S214-S217 PolarHBondContact N-OG 3.07Å; S214-S217 WeakPolarHBondContact O-CA 3.42Å; S214-S217 VanDerWaalsContact O-CB 3.29Å; S214-S217 WeakPolarHBondContact O-CB 3.41Å; S214-S217 PolarHBondContact O-N 2.76Å; S214-S217 PolarHBondContact OG-N 3.15Å; S214-S217 VanDerWaalsContact OG-N 3.14Å; S214-S217 PolarHBondContact OG-OG 2.99Å; S214-L218 WeakPolarHBondContact O-CG 3.43Å; S214-L218 PolarHBondContact O-N 3.09Å
215Y96.2Very high87.9Confident64 Ų6454 Ų5425%0.25128%0.283SS..Hα-helixtrans-58.5-34.4174.3-63.9-60.6000112.7L218 I219 Y247 W254 I258 S261Y215-L218 HydrophobicContact CD1-CD1 4.15Å; Y215-L218 PolarHBondContact O-N 2.9Å; Y215-I219 WeakPolarHBondContact O-CD1 3.26Å; Y215-I219 WeakPolarHBondContact O-CG1 3.46Å; Y215-I219 PolarHBondContact O-N 2.91Å; Y215-I219 VanDerWaalsContact O-N 3.08Å; Y215-Y247 HydrophobicContact CE1-CE1 4.47Å; Y215-W254 HydrophobicContact CE1-CB 4.28Å; Y215-I258 HydrophobicContact CD1-CD1 3.99Å; Y215-S261 WeakPolarHBondContact CB-OG 3.46Å
216I94Very high90Very high35 Ų3550.6 Ų50.618%0.17926%0.257CS..Hα-helixtrans-59.3-50.4172.3-55.2176.5000109.3S214 L218 I219 T220 N265 F268 F294S214-I216 PolarHBondContact O-N 2.99Å; S214-I216 PolarHBondContact OG-N 2.72Å; I216-L218 VanDerWaalsContact C-N 3.34Å; I216-L218 PolarHBondContact O-N 2.93Å; I216-I219 PolarHBondContact O-N 3.01Å; I216-T220 WeakPolarHBondContact O-CB 3.46Å; I216-T220 PolarHBondContact O-N 3.39Å; I216-T220 PolarHBondContact O-OG1 2.78Å; I216-N265 WeakPolarHBondContact CD1-OD1 3.44Å; I216-F268 HydrophobicContact CB-CE2 4.37Å; I216-F268 HydrophobicContact CB-CZ 4.31Å; I216-F268 HydrophobicContact CG1-CE2 4.41Å; I216-F268 HydrophobicContact CG2-CE2 3.96Å; I216-F268 HydrophobicContact CG2-CZ 3.68Å; I216-F294 HydrophobicContact CG2-CE1 3.84Å; I216-F294 HydrophobicContact CG2-CZ 3.69Å
217S93.5Very high91.9Very high3 Ų349.7 Ų49.72%0.02127%0.268CS..Hα-helixtrans-59.2-41.6179.9-39.40000112.7S214 T220 M221 Y299S214-S217 PolarHBondContact N-OG 3.07Å; S214-S217 WeakPolarHBondContact O-CA 3.42Å; S214-S217 VanDerWaalsContact O-CB 3.29Å; S214-S217 WeakPolarHBondContact O-CB 3.41Å; S214-S217 PolarHBondContact O-N 2.76Å; S214-S217 PolarHBondContact OG-N 3.15Å; S214-S217 VanDerWaalsContact OG-N 3.14Å; S214-S217 PolarHBondContact OG-OG 2.99Å; S217-T220 PolarHBondContact O-N 3.41Å; S217-M221 WeakPolarHBondContact O-CG 3.43Å; S217-M221 PolarHBondContact O-N 3.37Å; S217-Y299 VanDerWaalsContact CB-O 3.24Å; S217-Y299 WeakPolarHBondContact CB-O 3.43Å; S217-Y299 PolarHBondContact OG-O 3.42Å
218L95.6Very high93.3Very high2 Ų251 Ų511%0.0128%0.276CS..Hα-helixtrans-63.3-44.5177.1-67.2174.1000112Y213 S214 Y215 I216 M221 A222 I240 F244 Y247Y213-L218 HydrophobicContact CD2-CD2 4.43Å; S214-L218 WeakPolarHBondContact O-CG 3.43Å; S214-L218 PolarHBondContact O-N 3.09Å; Y215-L218 HydrophobicContact CD1-CD1 4.15Å; Y215-L218 PolarHBondContact O-N 2.9Å; I216-L218 VanDerWaalsContact C-N 3.34Å; I216-L218 PolarHBondContact O-N 2.93Å; L218-M221 HydrophobicContact CD2-CE 3.89Å; L218-A222 PolarHBondContact O-N 3.12Å; L218-A222 VanDerWaalsContact O-N 3.15Å; L218-I240 HydrophobicContact CB-CD1 3.86Å; L218-I240 HydrophobicContact CB-CG1 4.17Å; L218-I240 HydrophobicContact CD1-CG2 4.45Å; L218-F244 HydrophobicContact CD2-CD2 3.72Å; L218-F244 HydrophobicContact CD2-CE2 3.46Å; L218-F244 VanDerWaalsContact CD2-CE2 3.46Å; L218-F244 HydrophobicContact CD2-CZ 4.46Å; L218-Y247 HydrophobicContact CD1-CE2 3.84Å
219I96.7Very high94.1Very high0 Ų051.5 Ų51.50%027%0.273CS..Hα-helixtrans-66.2-45.3177.3-63.8160000110.4Y215 I216 M221 A222 I223 I236 I258 L262 F268Y215-I219 WeakPolarHBondContact O-CD1 3.26Å; Y215-I219 WeakPolarHBondContact O-CG1 3.46Å; Y215-I219 PolarHBondContact O-N 2.91Å; Y215-I219 VanDerWaalsContact O-N 3.08Å; I216-I219 PolarHBondContact O-N 3.01Å; I219-M221 PolarHBondContact O-N 3.24Å; I219-A222 WeakPolarHBondContact O-CB 3.26Å; I219-A222 PolarHBondContact O-N 3.08Å; I219-I223 HydrophobicContact CG2-CD1 3.71Å; I219-I223 HydrophobicContact CG2-CG1 4.35Å; I219-I223 WeakPolarHBondContact O-CG1 3.34Å; I219-I223 PolarHBondContact O-N 2.89Å; I219-I236 HydrophobicContact CG1-CG2 4.14Å; I219-I236 HydrophobicContact CG2-CD1 4.34Å; I219-I258 HydrophobicContact CD1-CD1 3.97Å; I219-I258 HydrophobicContact CD1-CG2 4.21Å; I219-I258 HydrophobicContact CG1-CD1 3.73Å; I219-I258 HydrophobicContact CG1-CG2 4.26Å; I219-L262 HydrophobicContact CD1-CD2 4.01Å; I219-L262 HydrophobicContact CD1-CG 3.99Å; I219-L262 HydrophobicContact CG1-CD2 4.48Å; I219-L262 HydrophobicContact CG2-CD2 3.7Å; I219-F268 HydrophobicContact CB-CE1 3.91Å; I219-F268 HydrophobicContact CB-CE2 4.3Å; I219-F268 HydrophobicContact CB-CZ 3.65Å; I219-F268 HydrophobicContact CD1-CE2 3.91Å; I219-F268 HydrophobicContact CD1-CZ 4.14Å; I219-F268 HydrophobicContact CG2-CD1 3.79Å; I219-F268 HydrophobicContact CG2-CE1 3.34Å; I219-F268 HydrophobicContact CG2-CE2 4.2Å; I219-F268 HydrophobicContact CG2-CG 4.4Å; I219-F268 HydrophobicContact CG2-CZ 3.57Å
220T94.6Very high94.4Very high0 Ų052.5 Ų52.50%027%0.271CS..Hα-helixtrans-58-47.5177.5-61.40000111.2I216 S217 A222 I223 Q224 L286 F294I216-T220 WeakPolarHBondContact O-CB 3.46Å; I216-T220 PolarHBondContact O-N 3.39Å; I216-T220 PolarHBondContact O-OG1 2.78Å; S217-T220 PolarHBondContact O-N 3.41Å; T220-A222 VanDerWaalsContact C-N 3.32Å; T220-A222 PolarHBondContact O-N 3.04Å; T220-I223 PolarHBondContact O-N 3.09Å; T220-Q224 HydrophobicContact CG2-CG 4.21Å; T220-Q224 WeakPolarHBondContact O-CB 3.44Å; T220-Q224 WeakPolarHBondContact O-CG 3.2Å; T220-Q224 PolarHBondContact O-N 3.34Å; T220-L286 HydrophobicContact CG2-CD1 4.02Å; T220-L286 HydrophobicContact CG2-CD2 4.22Å; T220-F294 HydrophobicContact CG2-CB 3.66Å; T220-F294 HydrophobicContact CG2-CD1 3.77Å; T220-F294 HydrophobicContact CG2-CD2 3.65Å; T220-F294 HydrophobicContact CG2-CE1 4.22Å; T220-F294 HydrophobicContact CG2-CE2 4.12Å; T220-F294 HydrophobicContact CG2-CG 3.44Å; T220-F294 VanDerWaalsContact CG2-CG 3.44Å; T220-F294 HydrophobicContact CG2-CZ 4.37Å; T220-F294 WeakPolarHBondContact OG1-CE1 3.41Å; T220-F294 VanDerWaalsContact OG1-CZ 3.31Å; T220-F294 WeakPolarHBondContact OG1-CZ 3.47Å
221M94.3Very high94.7Very high18 Ų1846.6 Ų46.69%0.08925%0.245CC..Hα-helixtrans-57.9-43.9175.8-75.3-173.8-68.500111.6Y213 S217 L218 I219 Q224 N225 F239 F244 Y299Y213-M221 HydrophobicContact CD2-CE 3.95Å; Y213-M221 HydrophobicContact CE2-CE 4.33Å; Y213-M221 HydrophobicContact CG-CE 4.09Å; S217-M221 WeakPolarHBondContact O-CG 3.43Å; S217-M221 PolarHBondContact O-N 3.37Å; L218-M221 HydrophobicContact CD2-CE 3.89Å; I219-M221 PolarHBondContact O-N 3.24Å; M221-Q224 PolarHBondContact O-N 3.21Å; M221-N225 WeakPolarHBondContact O-CB 3.09Å; M221-N225 PolarHBondContact O-N 3.49Å; M221-N225 PolarHBondContact O-ND2 3.1Å; M221-F239 HydrophobicContact CB-CE1 4.08Å; M221-F239 HydrophobicContact CB-CZ 4.4Å; M221-F244 HydrophobicContact CE-CE2 4.05Å; M221-F244 HydrophobicContact CE-CZ 4.27Å; M221-Y299 HydrophobicContact CG-CD1 3.74Å; M221-Y299 HydrophobicContact CG-CE1 3.36Å; M221-Y299 HydrophobicContact SD-CD1 4.19Å; M221-Y299 HydrophobicContact SD-CE1 4.21Å; M221-Y299 HydrophobicContact SD-CG 4.43Å
222A96.6Very high95Very high1 Ų146.4 Ų46.41%0.00824%0.244CC..Hα-helixtrans-59.6-49.9177.700000111.8L218 I219 T220 Q224 N225 N226 L231 F239L218-A222 PolarHBondContact O-N 3.12Å; L218-A222 VanDerWaalsContact O-N 3.15Å; I219-A222 WeakPolarHBondContact O-CB 3.26Å; I219-A222 PolarHBondContact O-N 3.08Å; T220-A222 VanDerWaalsContact C-N 3.32Å; T220-A222 PolarHBondContact O-N 3.04Å; A222-Q224 PolarHBondContact O-N 3.2Å; A222-N225 PolarHBondContact O-N 2.7Å; A222-N226 PolarHBondContact O-N 3.47Å; A222-L231 VanDerWaalsContact C-CD1 3.49Å; A222-L231 HydrophobicContact CB-CD1 3.65Å; A222-L231 WeakPolarHBondContact O-CD1 3.41Å; A222-F239 VanDerWaalsContact CA-CE1 3.49Å; A222-F239 HydrophobicContact CB-CB 4.09Å; A222-F239 HydrophobicContact CB-CD1 3.39Å; A222-F239 HydrophobicContact CB-CD2 4.41Å; A222-F239 HydrophobicContact CB-CE1 3.87Å; A222-F239 HydrophobicContact CB-CG 3.7Å
223I95.7Very high95.4Very high1 Ų143.7 Ų43.71%0.00522%0.223CC..Hα-helixtrans-66.7-37.7-178.7-64.2173000111.7I219 T220 N226 R229 F268 L286I219-I223 HydrophobicContact CG2-CD1 3.71Å; I219-I223 HydrophobicContact CG2-CG1 4.35Å; I219-I223 WeakPolarHBondContact O-CG1 3.34Å; I219-I223 PolarHBondContact O-N 2.89Å; T220-I223 PolarHBondContact O-N 3.09Å; I223-N226 PolarHBondContact O-N 3.41Å; I223-R229 WeakPolarHBondContact CG2-O 3.32Å; I223-F268 HydrophobicContact CD1-CD1 4.16Å; I223-F268 HydrophobicContact CD1-CE1 4.38Å; I223-L286 HydrophobicContact CB-CD1 4.42Å; I223-L286 HydrophobicContact CB-CG 4.41Å; I223-L286 HydrophobicContact CD1-CG 4.44Å; I223-L286 HydrophobicContact CG2-CD1 4.11Å; I223-L286 HydrophobicContact CG2-CG 4Å
224Q93.2Very high95.6Very high40 Ų4043.1 Ų43.119%0.18723%0.231CC..Hα-helixtrans-69.5-31.6177.5-75.5173.9-36.300113.4T220 M221 A222 N226 L286 Y299T220-Q224 HydrophobicContact CG2-CG 4.21Å; T220-Q224 WeakPolarHBondContact O-CB 3.44Å; T220-Q224 WeakPolarHBondContact O-CG 3.2Å; T220-Q224 PolarHBondContact O-N 3.34Å; M221-Q224 PolarHBondContact O-N 3.21Å; A222-Q224 PolarHBondContact O-N 3.2Å; Q224-N226 VanDerWaalsContact C-N 3.34Å; Q224-L286 HydrophobicContact CG-CD1 4Å; Q224-Y299 PolarHBondContact OE1-OH 3.28Å
225N94.2Very high95.8Very high113 Ų11345.1 Ų45.160%0.60424%0.235SC*.Hα-helixtrans-79.3-14.9177.9-81.5-98.2000113.1M221 A222 F239M221-N225 WeakPolarHBondContact O-CB 3.09Å; M221-N225 PolarHBondContact O-N 3.49Å; M221-N225 PolarHBondContact O-ND2 3.1Å; A222-N225 PolarHBondContact O-N 2.7Å; N225-F239 HydrophobicContact CB-CE2 3.62Å; N225-F239 HydrophobicContact CB-CZ 4.01Å
226N95.7Very high95.9Very high36 Ų3642 Ų4219%0.19322%0.223CC..SBendtrans-82.8130.7173.6-173.3-74.9000111A222 I223 Q224 T228 R229 M230 L231A222-N226 PolarHBondContact O-N 3.47Å; I223-N226 PolarHBondContact O-N 3.41Å; Q224-N226 VanDerWaalsContact C-N 3.34Å; N226-T228 VanDerWaalsContact C-N 3.26Å; N226-T228 PolarHBondContact O-N 3.13Å; N226-T228 WeakPolarHBondContact OD1-CA 3.28Å; N226-T228 WeakPolarHBondContact OD1-CB 3.31Å; N226-T228 PolarHBondContact OD1-N 2.92Å; N226-T228 PolarHBondContact OD1-OG1 3.12Å; N226-R229 PolarHBondContact O-N 3.12Å; N226-M230 PolarHBondContact OD1-O 2.92Å; N226-L231 HydrophobicContact CB-CD2 3.75Å; N226-L231 HydrophobicContact CB-CG 3.97Å; N226-L231 WeakPolarHBondContact ND2-CD2 3.33Å
227P96.1Very high96.1Very high122 Ų12241.8 Ų41.879%0.79222%0.22SC*.THydrogen-bonded Turntrans-63.7-26.8-177.525.4-35.1000113.9R229P227-R229 VanDerWaalsContact C-N 3.28Å; P227-R229 PolarHBondContact O-N 3.24Å
228T95.4Very high96.4Very high86 Ų8646.7 Ų46.753%0.52824%0.243SC..THydrogen-bonded Turntrans-83.7-1.5176.471.90000113.5N226 M230N226-T228 VanDerWaalsContact C-N 3.26Å; N226-T228 PolarHBondContact O-N 3.13Å; N226-T228 WeakPolarHBondContact OD1-CA 3.28Å; N226-T228 WeakPolarHBondContact OD1-CB 3.31Å; N226-T228 PolarHBondContact OD1-N 2.92Å; N226-T228 PolarHBondContact OD1-OG1 3.12Å; T228-M230 PolarHBondContact O-N 3.25Å; T228-M230 VanDerWaalsContact O-N 3.12Å; T228-M230 WeakPolarHBondContact OG1-CG 3.4Å; T228-M230 PolarHBondContact OG1-O 3.13Å
229R95.1Very high96.5Very high145 Ų14548.9 Ų48.955%0.54725%0.253SS..SBendtrans52.328-175.5-59-60.9-172.7101.60.3114.2I223 N226 P227 T285I223-R229 WeakPolarHBondContact CG2-O 3.32Å; N226-R229 PolarHBondContact O-N 3.12Å; P227-R229 VanDerWaalsContact C-N 3.28Å; P227-R229 PolarHBondContact O-N 3.24Å; R229-T285 WeakPolarHBondContact O-CB 3.33Å; R229-T285 PolarHBondContact O-OG1 3.39Å
230M96.1Very high96.5Very high61 Ų6149 Ų4930%0.325%0.253SS..EExtended strand (participates in β ladder)trans-144.8151.9171.465.4-175.579.600111N226 T228 F283 W284N226-M230 PolarHBondContact OD1-O 2.92Å; T228-M230 PolarHBondContact O-N 3.25Å; T228-M230 VanDerWaalsContact O-N 3.12Å; T228-M230 WeakPolarHBondContact OG1-CG 3.4Å; T228-M230 PolarHBondContact OG1-O 3.13Å; M230-F283 HydrophobicContact CB-CB 4.35Å; M230-F283 HydrophobicContact CG-CB 4.42Å; M230-F283 HydrophobicContact CG-CD1 4.13Å; M230-F283 HydrophobicContact CG-CG 4.36Å; M230-F283 HydrophobicContact SD-CB 4.13Å; M230-F283 HydrophobicContact SD-CD1 4.28Å; M230-F283 HydrophobicContact SD-CD2 4.33Å; M230-F283 HydrophobicContact SD-CG 4.01Å; M230-W284 CarbonylContact C-O 3.58Å; M230-W284 VanDerWaalsContact CA-O 3.26Å; M230-W284 WeakPolarHBondContact CA-O 3.39Å
231L97.8Very high96.6Very high9 Ų949.7 Ų49.75%0.04726%0.257CS..EExtended strand (participates in β ladder)trans-144.1149.8177.6-74.5-178.3000111.4A222 N226 E235 I236 F283 W284A222-L231 VanDerWaalsContact C-CD1 3.49Å; A222-L231 HydrophobicContact CB-CD1 3.65Å; A222-L231 WeakPolarHBondContact O-CD1 3.41Å; N226-L231 HydrophobicContact CB-CD2 3.75Å; N226-L231 HydrophobicContact CB-CG 3.97Å; N226-L231 WeakPolarHBondContact ND2-CD2 3.33Å; L231-E235 HydrophobicContact CB-CB 4.38Å; L231-E235 HydrophobicContact CD2-CB 3.81Å; L231-E235 HydrophobicContact CG-CB 4.5Å; L231-I236 HydrophobicContact CB-CD1 4.28Å; L231-I236 HydrophobicContact CB-CG1 3.79Å; L231-I236 HydrophobicContact CD1-CG1 3.97Å; L231-F283 CarbonylContact O-C 3.6Å; L231-W284 PolarHBondContact N-O 3.34Å; L231-W284 PolarHBondContact O-N 3.28Å
232T97.8Very high96.7Very high10 Ų1054.1 Ų54.16%0.06128%0.28CS..EExtended strand (participates in β ladder)trans-75.8161.7165.769.10000111.1S234 E235 I236 F283T232-S234 PolarHBondContact O-N 3.03Å; T232-E235 WeakPolarHBondContact CA-OE2 3.42Å; T232-E235 WeakPolarHBondContact CB-OE2 3.25Å; T232-E235 VanDerWaalsContact CG2-OE2 3.24Å; T232-E235 WeakPolarHBondContact CG2-OE2 3.45Å; T232-E235 PolarHBondContact N-OE2 2.89Å; T232-E235 PolarHBondContact O-N 2.72Å; T232-E235 PolarHBondContact OG1-N 3.14Å; T232-E235 PolarHBondContact OG1-OE2 3.35Å; T232-I236 WeakPolarHBondContact O-CG1 3.38Å; T232-I236 PolarHBondContact O-N 3.47Å; T232-I236 VanDerWaalsContact O-N 3.13Å; T232-F283 HydrophobicContact CG2-CD1 3.77Å; T232-F283 HydrophobicContact CG2-CE1 3.72Å; T232-F283 HydrophobicContact CG2-CZ 4.48Å
233L98.1Very high96.6Very high50 Ų5058 Ų5826%0.26230%0.301SS..Hα-helixtrans-53.5-36.9174.5-179.963.2000112.9Y237 I258 R259 L262L233-Y237 HydrophobicContact CD1-CD1 4.36Å; L233-Y237 HydrophobicContact CD1-CE1 3.54Å; L233-Y237 HydrophobicContact CG-CE1 3.98Å; L233-Y237 HydrophobicContact CG-CE2 4.16Å; L233-Y237 WeakPolarHBondContact O-CD1 3.31Å; L233-Y237 PolarHBondContact O-N 3.39Å; L233-I258 HydrophobicContact CD1-CG2 4.07Å; L233-R259 HydrophobicContact CD1-CG 4.13Å; L233-R259 HydrophobicContact CD2-CG 4.04Å; L233-L262 HydrophobicContact CD1-CD1 3.62Å
234S97.8Very high96.6Very high66 Ų6659.7 Ų59.746%0.46231%0.308SS..Hα-helixtrans-67.6-43179.4-56.20000112.3T232 Y237 Q238T232-S234 PolarHBondContact O-N 3.03Å; S234-Y237 WeakPolarHBondContact O-CB 3.39Å; S234-Y237 PolarHBondContact O-N 3.45Å; S234-Q238 PolarHBondContact O-N 2.87Å
235E98.1Very high96.6Very high85 Ų8559.3 Ų59.340%0.39731%0.309SS..Hα-helixtrans-70.3-34.9-179.3-66.3155.1127.500111.6L231 T232 Y237 Q238 F239L231-E235 HydrophobicContact CB-CB 4.38Å; L231-E235 HydrophobicContact CD2-CB 3.81Å; L231-E235 HydrophobicContact CG-CB 4.5Å; T232-E235 WeakPolarHBondContact CA-OE2 3.42Å; T232-E235 WeakPolarHBondContact CB-OE2 3.25Å; T232-E235 VanDerWaalsContact CG2-OE2 3.24Å; T232-E235 WeakPolarHBondContact CG2-OE2 3.45Å; T232-E235 PolarHBondContact N-OE2 2.89Å; T232-E235 PolarHBondContact O-N 2.72Å; T232-E235 PolarHBondContact OG1-N 3.14Å; T232-E235 PolarHBondContact OG1-OE2 3.35Å; E235-Y237 VanDerWaalsContact C-N 3.28Å; E235-Y237 PolarHBondContact O-N 3.13Å; E235-Q238 PolarHBondContact O-N 3.24Å; E235-F239 WeakPolarHBondContact O-CB 3.39Å; E235-F239 PolarHBondContact O-N 2.89Å
236I98.4Very high96.7Very high0 Ų057.5 Ų57.50%030%0.296CS..Hα-helixtrans-59.2-40.3171.4-65.8166000110.7I219 L231 T232 I240 I258 L262 W284I219-I236 HydrophobicContact CG1-CG2 4.14Å; I219-I236 HydrophobicContact CG2-CD1 4.34Å; L231-I236 HydrophobicContact CB-CD1 4.28Å; L231-I236 HydrophobicContact CB-CG1 3.79Å; L231-I236 HydrophobicContact CD1-CG1 3.97Å; T232-I236 WeakPolarHBondContact O-CG1 3.38Å; T232-I236 PolarHBondContact O-N 3.47Å; T232-I236 VanDerWaalsContact O-N 3.13Å; I236-I240 HydrophobicContact CG2-CD1 3.92Å; I236-I240 WeakPolarHBondContact O-CD1 3.24Å; I236-I240 VanDerWaalsContact O-CG1 3.26Å; I236-I240 WeakPolarHBondContact O-CG1 3.34Å; I236-I240 PolarHBondContact O-N 2.94Å; I236-I258 HydrophobicContact CG2-CG2 3.91Å; I236-L262 HydrophobicContact CD1-CD1 4.23Å; I236-L262 HydrophobicContact CD1-CD2 4.24Å; I236-W284 HydrophobicContact CD1-CB 4.33Å
237Y98.3Very high96.8Very high29 Ų2956 Ų5611%0.11429%0.288CS..Hα-helixtrans-64.1-45.9175.7-61.6-19.8000112.1L233 S234 E235 I240 M241 W254 Q255 I258 R259L233-Y237 HydrophobicContact CD1-CD1 4.36Å; L233-Y237 HydrophobicContact CD1-CE1 3.54Å; L233-Y237 HydrophobicContact CG-CE1 3.98Å; L233-Y237 HydrophobicContact CG-CE2 4.16Å; L233-Y237 WeakPolarHBondContact O-CD1 3.31Å; L233-Y237 PolarHBondContact O-N 3.39Å; S234-Y237 WeakPolarHBondContact O-CB 3.39Å; S234-Y237 PolarHBondContact O-N 3.45Å; E235-Y237 VanDerWaalsContact C-N 3.28Å; E235-Y237 PolarHBondContact O-N 3.13Å; Y237-I240 PolarHBondContact O-N 2.8Å; Y237-M241 WeakPolarHBondContact O-CG 3.41Å; Y237-M241 PolarHBondContact O-N 3.46Å; Y237-M241 VanDerWaalsContact O-N 3.12Å; Y237-W254 HydrophobicContact CD1-CH2 4.22Å; Y237-W254 AromaticContact CD1-CZ3 3.9Å; Y237-W254 HydrophobicContact CD1-CZ3 3.9Å; Y237-W254 HydrophobicContact CG-CH2 4.29Å; Y237-W254 HydrophobicContact CG-CZ3 4.43Å; Y237-Q255 HydrophobicContact CD1-CB 4.49Å; Y237-Q255 HydrophobicContact CD1-CG 3.86Å; Y237-Q255 HydrophobicContact CD2-CG 4.13Å; Y237-Q255 HydrophobicContact CE1-CB 3.82Å; Y237-Q255 HydrophobicContact CE1-CG 3.68Å; Y237-Q255 HydrophobicContact CE2-CB 4.32Å; Y237-Q255 HydrophobicContact CE2-CG 3.98Å; Y237-Q255 HydrophobicContact CG-CG 4.08Å; Y237-I258 HydrophobicContact CD1-CG2 4.35Å; Y237-I258 HydrophobicContact CE1-CB 4.14Å; Y237-I258 HydrophobicContact CE1-CG2 4.01Å; Y237-R259 WeakPolarHBondContact OH-CG 3.48Å; Y237-R259 PolarHBondContact OH-NH1 3.06Å
238Q98Very high96.8Very high107 Ų10756.1 Ų56.150%0.527%0.272SS..Hα-helixtrans-63.8-50.6-179.3-59-62.311.700111.1S234 E235 I240 M241 D242S234-Q238 PolarHBondContact O-N 2.87Å; E235-Q238 PolarHBondContact O-N 3.24Å; Q238-I240 PolarHBondContact O-N 3.49Å; Q238-I240 VanDerWaalsContact O-N 3.13Å; Q238-M241 CarbonylContact O-C 3.57Å; Q238-M241 PolarHBondContact O-N 3.34Å; Q238-D242 WeakPolarHBondContact O-CB 3.35Å; Q238-D242 PolarHBondContact O-N 2.88Å
239F98Very high96.7Very high48 Ų4858.5 Ų58.521%0.21128%0.278CS..Hα-helixtrans-51-42.7177.8-179.5-86.7000112.8M221 A222 N225 E235 L243M221-F239 HydrophobicContact CB-CE1 4.08Å; M221-F239 HydrophobicContact CB-CZ 4.4Å; A222-F239 VanDerWaalsContact CA-CE1 3.49Å; A222-F239 HydrophobicContact CB-CB 4.09Å; A222-F239 HydrophobicContact CB-CD1 3.39Å; A222-F239 HydrophobicContact CB-CD2 4.41Å; A222-F239 HydrophobicContact CB-CE1 3.87Å; A222-F239 HydrophobicContact CB-CG 3.7Å; N225-F239 HydrophobicContact CB-CE2 3.62Å; N225-F239 HydrophobicContact CB-CZ 4.01Å; E235-F239 WeakPolarHBondContact O-CB 3.39Å; E235-F239 PolarHBondContact O-N 2.89Å; F239-L243 HydrophobicContact CE1-CD2 3.71Å; F239-L243 HydrophobicContact CZ-CD2 3.9Å; F239-L243 VanDerWaalsContact O-CB 3.24Å; F239-L243 WeakPolarHBondContact O-CB 3.48Å; F239-L243 PolarHBondContact O-N 3.08Å
240I97.6Very high96.6Very high1 Ų157.6 Ų57.61%0.00528%0.284CS..Hα-helixtrans-69.2-39.8178.8-68.1171.1000111.6L218 I236 Y237 Q238 F244 Y247 W254 I258L218-I240 HydrophobicContact CB-CD1 3.86Å; L218-I240 HydrophobicContact CB-CG1 4.17Å; L218-I240 HydrophobicContact CD1-CG2 4.45Å; I236-I240 HydrophobicContact CG2-CD1 3.92Å; I236-I240 WeakPolarHBondContact O-CD1 3.24Å; I236-I240 VanDerWaalsContact O-CG1 3.26Å; I236-I240 WeakPolarHBondContact O-CG1 3.34Å; I236-I240 PolarHBondContact O-N 2.94Å; Y237-I240 PolarHBondContact O-N 2.8Å; Q238-I240 PolarHBondContact O-N 3.49Å; Q238-I240 VanDerWaalsContact O-N 3.13Å; I240-F244 WeakPolarHBondContact O-CB 3.49Å; I240-F244 PolarHBondContact O-N 3.29Å; I240-Y247 HydrophobicContact CG2-CD2 3.41Å; I240-Y247 VanDerWaalsContact CG2-CD2 3.41Å; I240-Y247 HydrophobicContact CG2-CE2 4.08Å; I240-Y247 HydrophobicContact CG2-CG 3.74Å; I240-W254 HydrophobicContact CG2-CZ3 4.29Å; I240-I258 HydrophobicContact CD1-CD1 3.55Å; I240-I258 HydrophobicContact CD1-CG1 4.14Å
241M96.4Very high96.6Very high16 Ų1658.4 Ų58.48%0.07929%0.287CS..Hα-helixtrans-73.8-29.5178-70.7-170.4-60.400113.4Y237 Q238 R248 Q251 W254Y237-M241 WeakPolarHBondContact O-CG 3.41Å; Y237-M241 PolarHBondContact O-N 3.46Å; Y237-M241 VanDerWaalsContact O-N 3.12Å; Q238-M241 CarbonylContact O-C 3.57Å; Q238-M241 PolarHBondContact O-N 3.34Å; M241-R248 HydrophobicContact CB-CG 4.05Å; M241-R248 HydrophobicContact CG-CG 4.34Å; M241-R248 VanDerWaalsContact O-CZ 3.3Å; M241-R248 PolarHBondContact O-NE 3.33Å; M241-R248 PolarHBondContact O-NH2 2.84Å; M241-Q251 HydrophobicContact SD-CG 4.32Å; M241-W254 HydrophobicContact CG-CH2 3.91Å; M241-W254 HydrophobicContact CG-CZ2 3.65Å; M241-W254 HydrophobicContact SD-CH2 4.28Å; M241-W254 HydrophobicContact SD-CZ2 3.79Å
242D96.5Very high96.6Very high110 Ų11064.4 Ų64.459%0.58831%0.314SS*.Hα-helixtrans-74-49.2176.4-68.9-31.7000110.9Q238Q238-D242 WeakPolarHBondContact O-CB 3.35Å; Q238-D242 PolarHBondContact O-N 2.88Å
243L95.2Very high96.5Very high84 Ų8473.5 Ų73.544%0.4435%0.348SS..Hα-helixtrans-72.1-33.1-179.2-174.359.4000113.3F239F239-L243 HydrophobicContact CE1-CD2 3.71Å; F239-L243 HydrophobicContact CZ-CD2 3.9Å; F239-L243 VanDerWaalsContact O-CB 3.24Å; F239-L243 WeakPolarHBondContact O-CB 3.48Å; F239-L243 PolarHBondContact O-N 3.08Å
244F94.8Very high96.5Very high36 Ų3671.7 Ų71.716%0.15834%0.337CS..  trans-134.389.5-174.8-58.6-63.7000111.9P211 Y213 L218 M221 I240 F246 Y247P211-F244 HydrophobicContact CB-CD1 4Å; P211-F244 HydrophobicContact CB-CE1 4.03Å; P211-F244 HydrophobicContact CB-CG 4.35Å; P211-F244 HydrophobicContact CB-CZ 4.42Å; P211-F244 HydrophobicContact CG-CB 3.77Å; P211-F244 HydrophobicContact CG-CD1 3.36Å; P211-F244 HydrophobicContact CG-CD2 4.15Å; P211-F244 HydrophobicContact CG-CE1 3.93Å; P211-F244 HydrophobicContact CG-CG 3.49Å; P211-F244 VanDerWaalsContact CG-CG 3.49Å; Y213-F244 HydrophobicContact CD2-CE1 4.24Å; Y213-F244 HydrophobicContact CD2-CE2 4.19Å; Y213-F244 AromaticContact CD2-CZ 3.64Å; Y213-F244 HydrophobicContact CD2-CZ 3.64Å; Y213-F244 AromaticContact CE2-CE1 3.99Å; Y213-F244 HydrophobicContact CE2-CE1 3.99Å; Y213-F244 AromaticContact CE2-CZ 3.56Å; Y213-F244 HydrophobicContact CE2-CZ 3.56Å; L218-F244 HydrophobicContact CD2-CD2 3.72Å; L218-F244 HydrophobicContact CD2-CE2 3.46Å; L218-F244 VanDerWaalsContact CD2-CE2 3.46Å; L218-F244 HydrophobicContact CD2-CZ 4.46Å; M221-F244 HydrophobicContact CE-CE2 4.05Å; M221-F244 HydrophobicContact CE-CZ 4.27Å; I240-F244 WeakPolarHBondContact O-CB 3.49Å; I240-F244 PolarHBondContact O-N 3.29Å; F244-F246 PolarHBondContact O-N 3.43Å; F244-Y247 HydrophobicContact CB-CD2 3.85Å; F244-Y247 HydrophobicContact CB-CE2 4.26Å; F244-Y247 PolarHBondContact O-N 3.47Å
245P94.2Very high96.5Very high32 Ų3269.8 Ų69.821%0.20832%0.321CS..G310 helixtrans-53.6-24.3-176.2-29.936000116.3T207 Y247 R248T207-P245 WeakPolarHBondContact O-CD 3.34Å; P245-Y247 PolarHBondContact O-N 3.04Å; P245-R248 WeakPolarHBondContact O-CB 3.49Å; P245-R248 WeakPolarHBondContact O-CG 3.09Å; P245-R248 PolarHBondContact O-N 2.87Å
246F95.6Very high96.5Very high74 Ų7469.8 Ų69.833%0.32532%0.324SS..G310 helixtrans-45.4-41.5168.8171.7-100.3000113.4H208 A209 K210 F244 R248H208-F246 WeakPolarHBondContact O-CD2 3.47Å; A209-F246 WeakPolarHBondContact O-CB 3.08Å; K210-F246 HydrophobicContact CB-CD1 4.17Å; K210-F246 HydrophobicContact CB-CD2 4.28Å; K210-F246 HydrophobicContact CB-CE1 3.79Å; K210-F246 HydrophobicContact CB-CE2 3.9Å; K210-F246 HydrophobicContact CB-CG 4.42Å; K210-F246 HydrophobicContact CB-CZ 3.64Å; K210-F246 HydrophobicContact CD-CE1 4.24Å; K210-F246 HydrophobicContact CD-CZ 4.21Å; K210-F246 HydrophobicContact CG-CD1 4.22Å; K210-F246 HydrophobicContact CG-CE1 3.65Å; K210-F246 HydrophobicContact CG-CZ 3.89Å; F244-F246 PolarHBondContact O-N 3.43Å; F246-R248 VanDerWaalsContact C-N 3.26Å; F246-R248 PolarHBondContact O-N 3.25Å
247Y96.7Very high96.5Very high4 Ų471 Ų712%0.01633%0.333CS..G310 helixtrans-790.5-176.9-67.5-67.4000114.3P211 Y215 L218 I240 F244 P245 Q249 W254P211-Y247 HydrophobicContact CG-CE2 4.01Å; Y215-Y247 HydrophobicContact CE1-CE1 4.47Å; L218-Y247 HydrophobicContact CD1-CE2 3.84Å; I240-Y247 HydrophobicContact CG2-CD2 3.41Å; I240-Y247 VanDerWaalsContact CG2-CD2 3.41Å; I240-Y247 HydrophobicContact CG2-CE2 4.08Å; I240-Y247 HydrophobicContact CG2-CG 3.74Å; F244-Y247 HydrophobicContact CB-CD2 3.85Å; F244-Y247 HydrophobicContact CB-CE2 4.26Å; F244-Y247 PolarHBondContact O-N 3.47Å; P245-Y247 PolarHBondContact O-N 3.04Å; Y247-Q249 PolarHBondContact O-N 3.49Å; Y247-W254 HydrophobicContact CD1-CB 4.05Å; Y247-W254 AromaticContact CD1-CD1 3.78Å; Y247-W254 AromaticContact CD1-CD2 3.93Å; Y247-W254 HydrophobicContact CD1-CD2 3.93Å; Y247-W254 AromaticContact CD1-CG 3.65Å; Y247-W254 HydrophobicContact CD1-CG 3.65Å; Y247-W254 HydrophobicContact CE1-CB 4.25Å; Y247-W254 HydrophobicContact CE1-CG 4.34Å; Y247-W254 HydrophobicContact CG-CD2 4.42Å; Y247-W254 VanDerWaalsContact O-CZ2 3.24Å; Y247-W254 WeakPolarHBondContact O-CZ2 3.46Å; Y247-W254 PolarHBondContact O-NE1 3.43Å
248R96.2Very high96.5Very high126 Ų12669.7 Ų69.748%0.47533%0.327SS..G310 helixtrans-68.9-25.7175.4-65.3174.4-170.9-175.20.9112.4M241 P245 F246 Q251M241-R248 HydrophobicContact CB-CG 4.05Å; M241-R248 HydrophobicContact CG-CG 4.34Å; M241-R248 VanDerWaalsContact O-CZ 3.3Å; M241-R248 PolarHBondContact O-NE 3.33Å; M241-R248 PolarHBondContact O-NH2 2.84Å; P245-R248 WeakPolarHBondContact O-CB 3.49Å; P245-R248 WeakPolarHBondContact O-CG 3.09Å; P245-R248 PolarHBondContact O-N 2.87Å; F246-R248 VanDerWaalsContact C-N 3.26Å; F246-R248 PolarHBondContact O-N 3.25Å; R248-Q251 WeakPolarHBondContact O-CG 3.35Å; R248-Q251 PolarHBondContact O-NE2 3.46Å
249Q93.5Very high96.5Very high136 Ų13668.3 Ų68.364%0.63632%0.317SS*.SBendtrans-90.7162.3177.2-59.1179.65.600112Y247 Q251 W254Y247-Q249 PolarHBondContact O-N 3.49Å; Q249-Q251 PolarHBondContact O-N 3.49Å; Q249-Q251 VanDerWaalsContact O-N 3.11Å; Q249-W254 PolarHBondContact O-NE1 3.47Å
250N92.8Very high96.5Very high126 Ų12670 Ų7067%0.67433%0.326SS*.SBendtrans52.834.7171.1-68.7-70.1000114.9Q252 R253N250-Q252 PolarHBondContact O-N 3.05Å; N250-R253 PolarHBondContact O-N 3.41Å; N250-R253 VanDerWaalsContact O-N 3.07Å
251Q96.5Very high96.5Very high78 Ų7870.1 Ų70.136%0.36433%0.327SS..Hα-helixtrans-53.1-46-163.7-68.7-169.825.300114.7M241 R248 Q249 R253 W254 Q255M241-Q251 HydrophobicContact SD-CG 4.32Å; R248-Q251 WeakPolarHBondContact O-CG 3.35Å; R248-Q251 PolarHBondContact O-NE2 3.46Å; Q249-Q251 PolarHBondContact O-N 3.49Å; Q249-Q251 VanDerWaalsContact O-N 3.11Å; Q251-R253 PolarHBondContact O-N 3.18Å; Q251-R253 VanDerWaalsContact O-N 3.1Å; Q251-W254 HydrophobicContact CG-CZ2 4.25Å; Q251-W254 PolarHBondContact O-N 2.8Å; Q251-Q255 VanDerWaalsContact O-CB 3.24Å; Q251-Q255 WeakPolarHBondContact O-CB 3.44Å; Q251-Q255 VanDerWaalsContact O-CG 3.25Å; Q251-Q255 WeakPolarHBondContact O-CG 3.48Å; Q251-Q255 PolarHBondContact O-N 3.07Å; Q251-Q255 VanDerWaalsContact OE1-NE2 3.1Å
252Q97.5Very high96.6Very high134 Ų13469.5 Ų69.563%0.62632%0.324SS*.Hα-helixtrans-55.6-34.1-178178.864.6-4300113.2N250 N256 R259N250-Q252 PolarHBondContact O-N 3.05Å; Q252-N256 WeakPolarHBondContact O-CB 3.03Å; Q252-N256 PolarHBondContact O-N 2.77Å; Q252-N256 VanDerWaalsContact O-N 3.13Å; Q252-R259 VanDerWaalsContact OE1-NH2 3.09Å
253R96.7Very high96.5Very high202 Ų20268.2 Ų68.276%0.76232%0.324SS*.Hα-helixtrans-69.2-53-178.7-173.1-179.9-68.1-86.12.9111.8N250 Q251 N256 S257N250-R253 PolarHBondContact O-N 3.41Å; N250-R253 VanDerWaalsContact O-N 3.07Å; Q251-R253 PolarHBondContact O-N 3.18Å; Q251-R253 VanDerWaalsContact O-N 3.1Å; R253-N256 PolarHBondContact O-N 3.16Å; R253-S257 PolarHBondContact O-N 2.88Å
254W97.6Very high96.4Very high11 Ų1169.9 Ų69.94%0.04233%0.328CS..Hα-helixtrans-82-20.9-178.471.7-103000113Y215 Y237 I240 M241 Y247 Q249 Q251 N256 S257 I258Y215-W254 HydrophobicContact CE1-CB 4.28Å; Y237-W254 HydrophobicContact CD1-CH2 4.22Å; Y237-W254 AromaticContact CD1-CZ3 3.9Å; Y237-W254 HydrophobicContact CD1-CZ3 3.9Å; Y237-W254 HydrophobicContact CG-CH2 4.29Å; Y237-W254 HydrophobicContact CG-CZ3 4.43Å; I240-W254 HydrophobicContact CG2-CZ3 4.29Å; M241-W254 HydrophobicContact CG-CH2 3.91Å; M241-W254 HydrophobicContact CG-CZ2 3.65Å; M241-W254 HydrophobicContact SD-CH2 4.28Å; M241-W254 HydrophobicContact SD-CZ2 3.79Å; Y247-W254 HydrophobicContact CD1-CB 4.05Å; Y247-W254 AromaticContact CD1-CD1 3.78Å; Y247-W254 AromaticContact CD1-CD2 3.93Å; Y247-W254 HydrophobicContact CD1-CD2 3.93Å; Y247-W254 AromaticContact CD1-CG 3.65Å; Y247-W254 HydrophobicContact CD1-CG 3.65Å; Y247-W254 HydrophobicContact CE1-CB 4.25Å; Y247-W254 HydrophobicContact CE1-CG 4.34Å; Y247-W254 HydrophobicContact CG-CD2 4.42Å; Y247-W254 VanDerWaalsContact O-CZ2 3.24Å; Y247-W254 WeakPolarHBondContact O-CZ2 3.46Å; Y247-W254 PolarHBondContact O-NE1 3.43Å; Q249-W254 PolarHBondContact O-NE1 3.47Å; Q251-W254 HydrophobicContact CG-CZ2 4.25Å; Q251-W254 PolarHBondContact O-N 2.8Å; W254-N256 VanDerWaalsContact C-N 3.33Å; W254-S257 CarbonylContact O-C 3.48Å; W254-S257 WeakPolarHBondContact O-CA 3.49Å; W254-S257 PolarHBondContact O-N 3.28Å; W254-I258 HydrophobicContact CE3-CG1 3.91Å; W254-I258 HydrophobicContact CZ3-CG1 4.09Å; W254-I258 WeakPolarHBondContact O-CG1 3.36Å; W254-I258 PolarHBondContact O-N 3.24Å
255Q98.4Very high96.3Very high26 Ų2669 Ų6912%0.12132%0.324CS..Hα-helixtrans-69.5-34.2168.8-71.3180500110.7Y237 Q251 S257 I258 R259Y237-Q255 HydrophobicContact CD1-CB 4.49Å; Y237-Q255 HydrophobicContact CD1-CG 3.86Å; Y237-Q255 HydrophobicContact CD2-CG 4.13Å; Y237-Q255 HydrophobicContact CE1-CB 3.82Å; Y237-Q255 HydrophobicContact CE1-CG 3.68Å; Y237-Q255 HydrophobicContact CE2-CB 4.32Å; Y237-Q255 HydrophobicContact CE2-CG 3.98Å; Y237-Q255 HydrophobicContact CG-CG 4.08Å; Q251-Q255 VanDerWaalsContact O-CB 3.24Å; Q251-Q255 WeakPolarHBondContact O-CB 3.44Å; Q251-Q255 VanDerWaalsContact O-CG 3.25Å; Q251-Q255 WeakPolarHBondContact O-CG 3.48Å; Q251-Q255 PolarHBondContact O-N 3.07Å; Q251-Q255 VanDerWaalsContact OE1-NE2 3.1Å; Q255-S257 VanDerWaalsContact C-N 3.33Å; Q255-I258 PolarHBondContact O-N 3.08Å; Q255-R259 WeakPolarHBondContact O-CG 3.48Å; Q255-R259 PolarHBondContact O-N 3.38Å
256N98.3Very high96.2Very high86 Ų8667.7 Ų67.746%0.4632%0.315SS..Hα-helixtrans-63.6-42.3166-147.748.4000111.3Q252 R253 W254 I258 R259 H260Q252-N256 WeakPolarHBondContact O-CB 3.03Å; Q252-N256 PolarHBondContact O-N 2.77Å; Q252-N256 VanDerWaalsContact O-N 3.13Å; R253-N256 PolarHBondContact O-N 3.16Å; W254-N256 VanDerWaalsContact C-N 3.33Å; N256-I258 VanDerWaalsContact C-N 3.32Å; N256-I258 PolarHBondContact O-N 2.72Å; N256-R259 PolarHBondContact O-N 3.14Å; N256-R259 PolarHBondContact OD1-NE 2.72Å; N256-R259 PolarHBondContact OD1-NH2 3.35Å; N256-H260 PolarHBondContact O-CD2 3.37Å; N256-H260 VanDerWaalsContact O-CD2 3.23Å; N256-H260 PolarHBondContact O-N 3.39Å
257S97.9Very high96.1Very high26 Ų2664.2 Ų64.218%0.18230%0.3CS..Hα-helixtrans-28-62.8157.8-18.10000114.6R253 W254 Q255 H260 S261R253-S257 PolarHBondContact O-N 2.88Å; W254-S257 CarbonylContact O-C 3.48Å; W254-S257 WeakPolarHBondContact O-CA 3.49Å; W254-S257 PolarHBondContact O-N 3.28Å; Q255-S257 VanDerWaalsContact C-N 3.33Å; S257-H260 VanDerWaalsContact CB-CD2 3.49Å; S257-H260 WeakPolarHBondContact CB-CD2 3.33Å; S257-H260 WeakPolarHBondContact CB-NE2 3.45Å; S257-H260 PolarHBondContact O-CD2 3.15Å; S257-H260 PolarHBondContact O-NE2 2.9Å; S257-H260 PolarHBondContact OG-CD2 3.23Å; S257-H260 PolarHBondContact OG-NE2 2.65Å; S257-S261 WeakPolarHBondContact O-CB 3.22Å; S257-S261 PolarHBondContact O-N 3.44Å; S257-S261 PolarHBondContact O-OG 3.07Å
258I98.3Very high96Very high0 Ų064.4 Ų64.40%030%0.301CS..Hα-helixtrans-74.2-45.4-176.2-64.4-66.6000112Y215 I219 L233 I236 Y237 I240 W254 Q255 N256 H260 S261 L262Y215-I258 HydrophobicContact CD1-CD1 3.99Å; I219-I258 HydrophobicContact CD1-CD1 3.97Å; I219-I258 HydrophobicContact CD1-CG2 4.21Å; I219-I258 HydrophobicContact CG1-CD1 3.73Å; I219-I258 HydrophobicContact CG1-CG2 4.26Å; L233-I258 HydrophobicContact CD1-CG2 4.07Å; I236-I258 HydrophobicContact CG2-CG2 3.91Å; Y237-I258 HydrophobicContact CD1-CG2 4.35Å; Y237-I258 HydrophobicContact CE1-CB 4.14Å; Y237-I258 HydrophobicContact CE1-CG2 4.01Å; I240-I258 HydrophobicContact CD1-CD1 3.55Å; I240-I258 HydrophobicContact CD1-CG1 4.14Å; W254-I258 HydrophobicContact CE3-CG1 3.91Å; W254-I258 HydrophobicContact CZ3-CG1 4.09Å; W254-I258 WeakPolarHBondContact O-CG1 3.36Å; W254-I258 PolarHBondContact O-N 3.24Å; Q255-I258 PolarHBondContact O-N 3.08Å; N256-I258 VanDerWaalsContact C-N 3.32Å; N256-I258 PolarHBondContact O-N 2.72Å; I258-H260 PolarHBondContact O-N 3.47Å; I258-S261 WeakPolarHBondContact O-CB 3.47Å; I258-S261 PolarHBondContact O-N 3.1Å; I258-L262 HydrophobicContact CG2-CD1 3.91Å; I258-L262 HydrophobicContact CG2-CG 4.38Å; I258-L262 WeakPolarHBondContact O-CG 3.15Å; I258-L262 PolarHBondContact O-N 3.13Å
259R98.5Very high96Very high78 Ų7860.5 Ų60.529%0.29429%0.292SS..Hα-helixtrans-57.2-46.5-179.6-73-175.5-57.4-102.713.6112.3L233 Y237 Q252 Q255 N256 S261 S263L233-R259 HydrophobicContact CD1-CG 4.13Å; L233-R259 HydrophobicContact CD2-CG 4.04Å; Y237-R259 WeakPolarHBondContact OH-CG 3.48Å; Y237-R259 PolarHBondContact OH-NH1 3.06Å; Q252-R259 VanDerWaalsContact OE1-NH2 3.09Å; Q255-R259 WeakPolarHBondContact O-CG 3.48Å; Q255-R259 PolarHBondContact O-N 3.38Å; N256-R259 PolarHBondContact O-N 3.14Å; N256-R259 PolarHBondContact OD1-NE 2.72Å; N256-R259 PolarHBondContact OD1-NH2 3.35Å; R259-S261 VanDerWaalsContact C-N 3.32Å; R259-S263 PolarHBondContact O-N 3.19Å; R259-S263 PolarHBondContact O-OG 3.11Å
260H97.9Very high96.2Very high84 Ų8460.4 Ų60.439%0.38929%0.289SS..Hα-helixtrans-70.6-30.5176.385.166.4000111.9N256 S257 I258 S263 F264N256-H260 PolarHBondContact O-CD2 3.37Å; N256-H260 VanDerWaalsContact O-CD2 3.23Å; N256-H260 PolarHBondContact O-N 3.39Å; S257-H260 VanDerWaalsContact CB-CD2 3.49Å; S257-H260 WeakPolarHBondContact CB-CD2 3.33Å; S257-H260 WeakPolarHBondContact CB-NE2 3.45Å; S257-H260 PolarHBondContact O-CD2 3.15Å; S257-H260 PolarHBondContact O-NE2 2.9Å; S257-H260 PolarHBondContact OG-CD2 3.23Å; S257-H260 PolarHBondContact OG-NE2 2.65Å; I258-H260 PolarHBondContact O-N 3.47Å; H260-S263 PolarHBondContact O-OG 2.61Å; H260-F264 WeakPolarHBondContact O-CB 3.49Å; H260-F264 PolarHBondContact O-N 3.45Å
261S97Very high96.3Very high4 Ų457.2 Ų57.23%0.02827%0.271CS..Hα-helixtrans-68.7-36.9-179.5-66.20000111.9Y215 S257 I258 R259 N265 F268Y215-S261 WeakPolarHBondContact CB-OG 3.46Å; S257-S261 WeakPolarHBondContact O-CB 3.22Å; S257-S261 PolarHBondContact O-N 3.44Å; S257-S261 PolarHBondContact O-OG 3.07Å; I258-S261 WeakPolarHBondContact O-CB 3.47Å; I258-S261 PolarHBondContact O-N 3.1Å; R259-S261 VanDerWaalsContact C-N 3.32Å; S261-N265 WeakPolarHBondContact O-CB 3.27Å; S261-N265 PolarHBondContact O-N 3.39Å; S261-N265 PolarHBondContact O-ND2 3.37Å; S261-F268 WeakPolarHBondContact O-CD2 3.29Å
262L97.7Very high96.2Very high3 Ų358.3 Ų58.32%0.01629%0.285CS..Hα-helixtrans-67.6-42.6175.2-71.4167.4000112.7I219 L233 I236 I258 F268 W284I219-L262 HydrophobicContact CD1-CD2 4.01Å; I219-L262 HydrophobicContact CD1-CG 3.99Å; I219-L262 HydrophobicContact CG1-CD2 4.48Å; I219-L262 HydrophobicContact CG2-CD2 3.7Å; L233-L262 HydrophobicContact CD1-CD1 3.62Å; I236-L262 HydrophobicContact CD1-CD1 4.23Å; I236-L262 HydrophobicContact CD1-CD2 4.24Å; I258-L262 HydrophobicContact CG2-CD1 3.91Å; I258-L262 HydrophobicContact CG2-CG 4.38Å; I258-L262 WeakPolarHBondContact O-CG 3.15Å; I258-L262 PolarHBondContact O-N 3.13Å; L262-F268 HydrophobicContact CD2-CB 4.1Å; L262-F268 HydrophobicContact CD2-CD1 4.47Å; L262-F268 HydrophobicContact CD2-CD2 4.22Å; L262-F268 HydrophobicContact CD2-CG 4.01Å; L262-W284 HydrophobicContact CB-CD2 4.15Å; L262-W284 HydrophobicContact CB-CE3 4.01Å; L262-W284 HydrophobicContact CB-CH2 3.84Å; L262-W284 HydrophobicContact CB-CZ2 3.99Å; L262-W284 HydrophobicContact CB-CZ3 3.85Å; L262-W284 HydrophobicContact CD1-CD2 4.22Å; L262-W284 HydrophobicContact CD1-CG 4.3Å; L262-W284 HydrophobicContact CD2-CB 4.15Å; L262-W284 HydrophobicContact CD2-CD2 3.86Å; L262-W284 HydrophobicContact CD2-CE3 3.94Å; L262-W284 HydrophobicContact CD2-CG 3.96Å; L262-W284 HydrophobicContact CG-CD2 4.3Å; L262-W284 HydrophobicContact CG-CE3 4.48Å; L262-W284 VanDerWaalsContact O-CZ3 3.3Å; L262-W284 WeakPolarHBondContact O-CZ3 3.39Å
263S96.2Very high96Very high83 Ų8355.6 Ų55.658%0.5827%0.269SS*.Hα-helixtrans-79.3-30.2-179.657.60000114.1R259 H260R259-S263 PolarHBondContact O-N 3.19Å; R259-S263 PolarHBondContact O-OG 3.11Å; H260-S263 PolarHBondContact O-OG 2.61Å
264F93Very high95.8Very high119 Ų11949.6 Ų49.652%0.52226%0.255SS..Hα-helixtrans-83.5-32.4-175.8-177.7-104000114.2H260 R305H260-F264 WeakPolarHBondContact O-CB 3.49Å; H260-F264 PolarHBondContact O-N 3.45Å; F264-R305 VanDerWaalsContact CE1-CZ 3.46Å; F264-R305 VanDerWaalsContact CE1-NH2 3.33Å; F264-R305 VanDerWaalsContact CZ-NH1 3.29Å; F264-R305 PolarHBondContact O-NH2 3.39Å
265N92.8Very high95.3Very high17 Ų1754.9 Ų54.99%0.09129%0.29CS..  trans-98.8121.9-172.7-63.7-77.8000111.5I216 S261 C267 F268I216-N265 WeakPolarHBondContact CD1-OD1 3.44Å; S261-N265 WeakPolarHBondContact O-CB 3.27Å; S261-N265 PolarHBondContact O-N 3.39Å; S261-N265 PolarHBondContact O-ND2 3.37Å; N265-C267 PolarHBondContact O-N 3.36Å; N265-F268 HydrophobicContact CB-CD2 3.99Å; N265-F268 HydrophobicContact CB-CE2 4.22Å; N265-F268 PolarHBondContact O-N 3.23Å
266D91.8Very high94.8Very high4 Ų459.6 Ų59.62%0.02132%0.317CS..THydrogen-bonded Turntrans-67.4-10.2-175.7-59.8-32.2000113.8F268 F306 D308 K311 R315D266-F268 PolarHBondContact O-N 3.28Å; D266-F306 HydrophobicContact CB-CD1 4.03Å; D266-F306 HydrophobicContact CB-CE1 4.18Å; D266-F306 WeakPolarHBondContact O-CE1 3.35Å; D266-D308 HydrophobicContact CB-CB 4.03Å; D266-K311 WeakPolarHBondContact OD1-CD 3.39Å; D266-K311 VanDerWaalsContact OD1-CE 3.3Å; D266-K311 WeakPolarHBondContact OD1-CE 3.35Å; D266-K311 IonicContact OD1-NZ 3.81Å; D266-K311 PolarHBondContact OD1-NZ 3.46Å; D266-R315 VanDerWaalsContact CG-NH2 3.31Å; D266-R315 IonicContact OD1-CZ 3.39Å; D266-R315 IonicContact OD1-NH1 2.78Å; D266-R315 IonicContact OD1-NH2 3.07Å; D266-R315 PolarHBondContact OD1-NH2 2.81Å; D266-R315 IonicContact OD2-CZ 3.64Å; D266-R315 IonicContact OD2-NH1 2.75Å; D266-R315 PolarHBondContact OD2-NH1 3.02Å; D266-R315 IonicContact OD2-NH2 2.65Å; D266-R315 PolarHBondContact OD2-NH2 3.26Å; D266-R315 VanDerWaalsContact OD2-NH2 3.07Å
267C92.8Very high94.1Very high1 Ų162.9 Ų62.91%0.00733%0.327CS..THydrogen-bonded Turntrans-74.2-7.1171.260.20000113.8N265 L286 H287 F306N265-C267 PolarHBondContact O-N 3.36Å; C267-L286 CarbonylContact O-C 3.58Å; C267-L286 WeakPolarHBondContact O-CA 3.31Å; C267-H287 PolarHBondContact O-N 3.03Å; C267-F306 HydrophobicContact CB-CB 4.27Å; C267-F306 HydrophobicContact CB-CD1 3.83Å; C267-F306 HydrophobicContact CB-CE1 4.47Å; C267-F306 HydrophobicContact CB-CG 4.11Å
268F95.4Very high93.4Very high8 Ų867.4 Ų67.44%0.03536%0.355CS..EExtended strand (participates in β ladder)trans-111.5118.6175-57.7-54.4000110.8I216 I219 I223 S261 L262 N265 D266 W284 T285 L286I216-F268 HydrophobicContact CB-CE2 4.37Å; I216-F268 HydrophobicContact CB-CZ 4.31Å; I216-F268 HydrophobicContact CG1-CE2 4.41Å; I216-F268 HydrophobicContact CG2-CE2 3.96Å; I216-F268 HydrophobicContact CG2-CZ 3.68Å; I219-F268 HydrophobicContact CB-CE1 3.91Å; I219-F268 HydrophobicContact CB-CE2 4.3Å; I219-F268 HydrophobicContact CB-CZ 3.65Å; I219-F268 HydrophobicContact CD1-CE2 3.91Å; I219-F268 HydrophobicContact CD1-CZ 4.14Å; I219-F268 HydrophobicContact CG2-CD1 3.79Å; I219-F268 HydrophobicContact CG2-CE1 3.34Å; I219-F268 HydrophobicContact CG2-CE2 4.2Å; I219-F268 HydrophobicContact CG2-CG 4.4Å; I219-F268 HydrophobicContact CG2-CZ 3.57Å; I223-F268 HydrophobicContact CD1-CD1 4.16Å; I223-F268 HydrophobicContact CD1-CE1 4.38Å; S261-F268 WeakPolarHBondContact O-CD2 3.29Å; L262-F268 HydrophobicContact CD2-CB 4.1Å; L262-F268 HydrophobicContact CD2-CD1 4.47Å; L262-F268 HydrophobicContact CD2-CD2 4.22Å; L262-F268 HydrophobicContact CD2-CG 4.01Å; N265-F268 HydrophobicContact CB-CD2 3.99Å; N265-F268 HydrophobicContact CB-CE2 4.22Å; N265-F268 PolarHBondContact O-N 3.23Å; D266-F268 PolarHBondContact O-N 3.28Å; F268-W284 HydrophobicContact CB-CE3 4.17Å; F268-W284 HydrophobicContact CB-CZ3 4.49Å; F268-T285 WeakPolarHBondContact CA-O 3.44Å; F268-L286 HydrophobicContact CD1-CD2 3.98Å; F268-L286 HydrophobicContact CE1-CD2 3.68Å
269V95.7Very high93.1Very high45 Ų4569.5 Ų69.527%0.27338%0.377SS..EExtended strand (participates in β ladder)trans-104.7128.2-177.2-174.70000109.4I271 W284 T285 H287V269-I271 HydrophobicContact CG1-CD1 3.79Å; V269-W284 WeakPolarHBondContact O-CA 3.24Å; V269-T285 HydrophobicContact CB-CG2 3.99Å; V269-T285 PolarHBondContact N-O 2.96Å; V269-T285 PolarHBondContact O-N 3.3Å; V269-H287 HydrophobicContact CG2-CB 3.96Å
270K97.2Very high92.7Very high134 Ų13474.6 Ų74.658%0.58340%0.402SS*.EExtended strand (participates in β ladder)trans-86.1116.2177.2-178.4-169.1171.2-167.30109.6S282 W284K270-S282 WeakPolarHBondContact CE-OG 3.25Å; K270-W284 HydrophobicContact CB-CD2 4.46Å; K270-W284 HydrophobicContact CB-CE3 4.05Å; K270-W284 HydrophobicContact CB-CH2 3.94Å; K270-W284 HydrophobicContact CB-CZ2 4.34Å; K270-W284 HydrophobicContact CB-CZ3 3.78Å; K270-W284 HydrophobicContact CG-CH2 4.32Å; K270-W284 HydrophobicContact CG-CZ2 4.28Å
271I95.7Very high92.5Very high59 Ų5973.1 Ų73.130%0.30341%0.409SS..EExtended strand (participates in β ladder)trans-105.5126.1-179.7-54.3-60.9000109.5V269 S282 F283 T285V269-I271 HydrophobicContact CG1-CD1 3.79Å; I271-S282 WeakPolarHBondContact O-CB 3.43Å; I271-F283 HydrophobicContact CB-CB 4.21Å; I271-F283 PolarHBondContact N-O 3.18Å; I271-F283 PolarHBondContact O-N 3.06Å; I271-T285 HydrophobicContact CD1-CG2 4.11Å; I271-T285 HydrophobicContact CG1-CG2 3.76Å
272P94.5Very high92.5Very high100 Ų10074.1 Ų74.165%0.64942%0.416SS*.PPolyproline II helixtrans-64.7154.8174.728.8-34.5000111.2
273R93.8Very high92.5Very high78 Ų7876.6 Ų76.629%0.29443%0.426SS..PPolyproline II helixtrans-75.6151.9168-66.2-177.6-179-106.72.4109.4G279 K280 G281 F283R273-G279 WeakPolarHBondContact CD-O 3.4Å; R273-G279 PolarHBondContact NE-O 3.29Å; R273-K280 PolarHBondContact NH2-O 2.97Å; R273-G281 WeakPolarHBondContact CD-O 3.21Å; R273-G281 PolarHBondContact NE-O 3.02Å; R273-F283 HydrophobicContact CG-CD2 4.16Å; R273-F283 HydrophobicContact CG-CE2 3.97Å
274T90.8Very high92.5Very high76 Ų7674.5 Ų74.547%0.46641%0.406SS..PPolyproline II helixtrans-69.5149.116672.20000109.7D276 K277T274-D276 WeakPolarHBondContact CB-OD2 3.43Å; T274-D276 PolarHBondContact O-N 3.44Å; T274-D276 PolarHBondContact OG1-OD2 2.7Å; T274-K277 PolarHBondContact O-N 2.92Å
275P87.8Confident92.7Very high121 Ų12170.2 Ų70.279%0.78639%0.39SS*.THydrogen-bonded Turntrans-62.8-27.7-176.725.6-34.8000112.9K277P275-K277 PolarHBondContact O-N 2.99Å
276D88.8Confident92.8Very high126 Ų12670.6 Ų70.667%0.67439%0.391SS*.THydrogen-bonded Turntrans-69.3-13.6-179.1-8.1-91.5000113.3T274 P278T274-D276 WeakPolarHBondContact CB-OD2 3.43Å; T274-D276 PolarHBondContact O-N 3.44Å; T274-D276 PolarHBondContact OG1-OD2 2.7Å; D276-P278 VanDerWaalsContact C-CD 3.46Å; D276-P278 WeakPolarHBondContact O-CD 3.43Å
277K82.1Confident92.8Very high155 Ų15571.8 Ų71.867%0.67440%0.397SS*.SBendtrans-125.967.9-179.6-69.5-177.9179.4174.30110.9T274 P275 G279T274-K277 PolarHBondContact O-N 2.92Å; P275-K277 PolarHBondContact O-N 2.99Å; K277-G279 PolarHBondContact O-N 3.19Å
278P84.5Confident92.7Very high120 Ų12076.4 Ų76.478%0.77943%0.427SS*.  trans-57.1130.8178.525-34.6000110.5D276D276-P278 VanDerWaalsContact C-CD 3.46Å; D276-P278 WeakPolarHBondContact O-CD 3.43Å
279G90.5Very high92.2Very high44 Ų4481 Ų8145%0.45445%0.452SS..  trans-174.3160.9-175.800000113R273 K277 G281R273-G279 WeakPolarHBondContact CD-O 3.4Å; R273-G279 PolarHBondContact NE-O 3.29Å; K277-G279 PolarHBondContact O-N 3.19Å; G279-G281 PolarHBondContact O-N 3.05Å
280K91.5Very high91.5Very high186 Ų18678.8 Ų78.881%0.80944%0.439SS*.SBendtrans-69.9125.9-171.9-169.5171.1-176.61730112R273R273-K280 PolarHBondContact NH2-O 2.97Å
281G93.5Very high90.3Very high52 Ų5273.5 Ų73.554%0.53642%0.422SS..SBendtrans68.8-178.9172.700000115R273 G279R273-G281 WeakPolarHBondContact CD-O 3.21Å; R273-G281 PolarHBondContact NE-O 3.02Å; G279-G281 PolarHBondContact O-N 3.05Å
282S96.3Very high89Confident26 Ų2675.8 Ų75.818%0.18244%0.435CS..  trans-94.8160.7-179.8-59.20000112.3K270 I271K270-S282 WeakPolarHBondContact CE-OG 3.25Å; I271-S282 WeakPolarHBondContact O-CB 3.43Å
283F97.2Very high87.8Confident54 Ų5475 Ų7524%0.23742%0.424CS..EExtended strand (participates in β ladder)trans-77154.3163-69-73.4000110.1M230 L231 T232 I271 R273M230-F283 HydrophobicContact CB-CB 4.35Å; M230-F283 HydrophobicContact CG-CB 4.42Å; M230-F283 HydrophobicContact CG-CD1 4.13Å; M230-F283 HydrophobicContact CG-CG 4.36Å; M230-F283 HydrophobicContact SD-CB 4.13Å; M230-F283 HydrophobicContact SD-CD1 4.28Å; M230-F283 HydrophobicContact SD-CD2 4.33Å; M230-F283 HydrophobicContact SD-CG 4.01Å; L231-F283 CarbonylContact O-C 3.6Å; T232-F283 HydrophobicContact CG2-CD1 3.77Å; T232-F283 HydrophobicContact CG2-CE1 3.72Å; T232-F283 HydrophobicContact CG2-CZ 4.48Å; I271-F283 HydrophobicContact CB-CB 4.21Å; I271-F283 PolarHBondContact N-O 3.18Å; I271-F283 PolarHBondContact O-N 3.06Å; R273-F283 HydrophobicContact CG-CD2 4.16Å; R273-F283 HydrophobicContact CG-CE2 3.97Å
284W97.9Very high86.7Confident39 Ų3971.4 Ų71.415%0.14841%0.41CS..EExtended strand (participates in β ladder)trans-125.5132.2173-66.390.8000108.8M230 L231 I236 L262 F268 V269 K270M230-W284 CarbonylContact C-O 3.58Å; M230-W284 VanDerWaalsContact CA-O 3.26Å; M230-W284 WeakPolarHBondContact CA-O 3.39Å; L231-W284 PolarHBondContact N-O 3.34Å; L231-W284 PolarHBondContact O-N 3.28Å; I236-W284 HydrophobicContact CD1-CB 4.33Å; L262-W284 HydrophobicContact CB-CD2 4.15Å; L262-W284 HydrophobicContact CB-CE3 4.01Å; L262-W284 HydrophobicContact CB-CH2 3.84Å; L262-W284 HydrophobicContact CB-CZ2 3.99Å; L262-W284 HydrophobicContact CB-CZ3 3.85Å; L262-W284 HydrophobicContact CD1-CD2 4.22Å; L262-W284 HydrophobicContact CD1-CG 4.3Å; L262-W284 HydrophobicContact CD2-CB 4.15Å; L262-W284 HydrophobicContact CD2-CD2 3.86Å; L262-W284 HydrophobicContact CD2-CE3 3.94Å; L262-W284 HydrophobicContact CD2-CG 3.96Å; L262-W284 HydrophobicContact CG-CD2 4.3Å; L262-W284 HydrophobicContact CG-CE3 4.48Å; L262-W284 VanDerWaalsContact O-CZ3 3.3Å; L262-W284 WeakPolarHBondContact O-CZ3 3.39Å; F268-W284 HydrophobicContact CB-CE3 4.17Å; F268-W284 HydrophobicContact CB-CZ3 4.49Å; V269-W284 WeakPolarHBondContact O-CA 3.24Å; K270-W284 HydrophobicContact CB-CD2 4.46Å; K270-W284 HydrophobicContact CB-CE3 4.05Å; K270-W284 HydrophobicContact CB-CH2 3.94Å; K270-W284 HydrophobicContact CB-CZ2 4.34Å; K270-W284 HydrophobicContact CB-CZ3 3.78Å; K270-W284 HydrophobicContact CG-CH2 4.32Å; K270-W284 HydrophobicContact CG-CZ2 4.28Å
285T96.6Very high85.4Confident30 Ų3074.2 Ų74.218%0.18442%0.418CS..EExtended strand (participates in β ladder)trans-128.6172175.7-169.30000110.3R229 F268 V269 I271R229-T285 WeakPolarHBondContact O-CB 3.33Å; R229-T285 PolarHBondContact O-OG1 3.39Å; F268-T285 WeakPolarHBondContact CA-O 3.44Å; V269-T285 HydrophobicContact CB-CG2 3.99Å; V269-T285 PolarHBondContact N-O 2.96Å; V269-T285 PolarHBondContact O-N 3.3Å; I271-T285 HydrophobicContact CD1-CG2 4.11Å; I271-T285 HydrophobicContact CG1-CG2 3.76Å
286L94.4Very high84.2Confident24 Ų2475.4 Ų75.413%0.12642%0.418CS..EExtended strand (participates in β ladder)trans-82.9141.9172.1-71.9163000109.5T220 I223 Q224 C267 F268 F294T220-L286 HydrophobicContact CG2-CD1 4.02Å; T220-L286 HydrophobicContact CG2-CD2 4.22Å; I223-L286 HydrophobicContact CB-CD1 4.42Å; I223-L286 HydrophobicContact CB-CG 4.41Å; I223-L286 HydrophobicContact CD1-CG 4.44Å; I223-L286 HydrophobicContact CG2-CD1 4.11Å; I223-L286 HydrophobicContact CG2-CG 4Å; Q224-L286 HydrophobicContact CG-CD1 4Å; C267-L286 CarbonylContact O-C 3.58Å; C267-L286 WeakPolarHBondContact O-CA 3.31Å; F268-L286 HydrophobicContact CD1-CD2 3.98Å; F268-L286 HydrophobicContact CE1-CD2 3.68Å; L286-F294 HydrophobicContact CD2-CD2 4.43Å; L286-F294 HydrophobicContact CD2-CE2 4.01Å
287H92.6Very high82.9Confident29 Ų2971.3 Ų71.313%0.13441%0.405CS..  trans-61.2135.6167.4-161.5-81.5000108.8C267 V269 D289 S290 F306 D308C267-H287 PolarHBondContact O-N 3.03Å; V269-H287 HydrophobicContact CG2-CB 3.96Å; H287-D289 IonicContact CE1-OD2 2.71Å; H287-D289 PolarHBondContact CE1-OD2 3.44Å; H287-D289 IonicContact ND1-OD2 3.94Å; H287-D289 PolarHBondContact ND1-OD2 3.08Å; H287-D289 PolarHBondContact O-N 2.69Å; H287-S290 PolarHBondContact N-OG 2.76Å; H287-S290 WeakPolarHBondContact O-CB 3.44Å; H287-S290 PolarHBondContact O-N 2.98Å; H287-S290 PolarHBondContact O-OG 3.32Å; H287-F306 HydrophobicContact CB-CE1 4.03Å; H287-F306 HydrophobicContact CB-CZ 4.01Å; H287-F306 AromaticContact CG-CE1 3.97Å; H287-F306 AromaticContact CG-CZ 3.75Å; H287-F306 AromaticContact ND1-CZ 3.56Å; H287-D308 IonicContact NE2-OD2 3.2Å
288P89.1Confident82Confident99 Ų9966.9 Ų66.964%0.64339%0.393SS*.G310 helixtrans-50.3-55.1-176.816.9-31.4000112S290 G291P288-S290 PolarHBondContact O-N 3.27Å; P288-G291 PolarHBondContact O-N 2.84Å
289D84.8Confident81.2Confident103 Ų10363.8 Ų63.855%0.55137%0.366SS*.G310 helixtrans-68.2-4.9-178.6-32.3-44.5000114.2H287 F306H287-D289 IonicContact CE1-OD2 2.71Å; H287-D289 PolarHBondContact CE1-OD2 3.44Å; H287-D289 IonicContact ND1-OD2 3.94Å; H287-D289 PolarHBondContact ND1-OD2 3.08Å; H287-D289 PolarHBondContact O-N 2.69Å; D289-F306 HydrophobicContact CB-CE2 4.18Å; D289-F306 HydrophobicContact CB-CZ 4.49Å
290S82.8Confident80.1Confident0 Ų067.1 Ų67.10%037%0.373CS..G310 helixtrans-89.5-14.1172.379.20000113.2H287 P288 N292 M293 F294H287-S290 PolarHBondContact N-OG 2.76Å; H287-S290 WeakPolarHBondContact O-CB 3.44Å; H287-S290 PolarHBondContact O-N 2.98Å; H287-S290 PolarHBondContact O-OG 3.32Å; P288-S290 PolarHBondContact O-N 3.27Å; S290-N292 PolarHBondContact O-N 3.4Å; S290-M293 WeakPolarHBondContact O-CB 3.42Å; S290-M293 PolarHBondContact O-N 3.07Å; S290-F294 WeakPolarHBondContact O-CD2 3.24Å
291G70.9Confident78.7Confident23 Ų2369.5 Ų69.524%0.23738%0.377CS..THydrogen-bonded Turntrans-58.6-50.6-174.100000113.5P288 M293 F294 E295P288-G291 PolarHBondContact O-N 2.84Å; G291-M293 PolarHBondContact O-N 3.03Å; G291-M293 VanDerWaalsContact O-N 3.09Å; G291-F294 PolarHBondContact O-N 2.88Å; G291-E295 PolarHBondContact O-N 3Å
292N69.1Low77.5Confident107 Ų10769.7 Ų69.757%0.57236%0.361SS*.Hα-helixtrans-63.1-20-178.7-50.1106.2000112.9S290 F294 E295S290-N292 PolarHBondContact O-N 3.4Å; N292-F294 PolarHBondContact O-N 3.23Å; N292-E295 PolarHBondContact ND2-OE2 3.08Å
293M68.7Low76Confident84 Ų8478.4 Ų78.441%0.41440%0.399SS..Hα-helixtrans-75-2.7176.3-54.1-167.2175.700114.2S290 G291 F306S290-M293 WeakPolarHBondContact O-CB 3.42Å; S290-M293 PolarHBondContact O-N 3.07Å; G291-M293 PolarHBondContact O-N 3.03Å; G291-M293 VanDerWaalsContact O-N 3.09Å; M293-F306 HydrophobicContact CE-CD2 3.72Å; M293-F306 HydrophobicContact CE-CE2 4.48Å; M293-F306 HydrophobicContact SD-CB 4.04Å; M293-F306 HydrophobicContact SD-CD2 3.84Å; M293-F306 HydrophobicContact SD-CG 4.42Å
294F69.9Low74.8Confident1 Ų184.7 Ų84.70%0.00443%0.426CS..Hα-helixtrans-128.5-18.3178.6-56.6-73.7000113.4I216 T220 L286 S290 G291 N292 N296 G297I216-F294 HydrophobicContact CG2-CE1 3.84Å; I216-F294 HydrophobicContact CG2-CZ 3.69Å; T220-F294 HydrophobicContact CG2-CB 3.66Å; T220-F294 HydrophobicContact CG2-CD1 3.77Å; T220-F294 HydrophobicContact CG2-CD2 3.65Å; T220-F294 HydrophobicContact CG2-CE1 4.22Å; T220-F294 HydrophobicContact CG2-CE2 4.12Å; T220-F294 HydrophobicContact CG2-CG 3.44Å; T220-F294 VanDerWaalsContact CG2-CG 3.44Å; T220-F294 HydrophobicContact CG2-CZ 4.37Å; T220-F294 WeakPolarHBondContact OG1-CE1 3.41Å; T220-F294 VanDerWaalsContact OG1-CZ 3.31Å; T220-F294 WeakPolarHBondContact OG1-CZ 3.47Å; L286-F294 HydrophobicContact CD2-CD2 4.43Å; L286-F294 HydrophobicContact CD2-CE2 4.01Å; S290-F294 WeakPolarHBondContact O-CD2 3.24Å; G291-F294 PolarHBondContact O-N 2.88Å; N292-F294 PolarHBondContact O-N 3.23Å; F294-N296 PolarHBondContact O-N 3.37Å; F294-G297 PolarHBondContact O-N 3.27Å; F294-G297 VanDerWaalsContact O-N 3.1Å
295E65.5Low73.9Confident135 Ų13588 Ų8863%0.63144%0.439SS*.Hα-helixtrans-60.6-40.6-175-169.3159.1-141.200113G291 N292 G297G291-E295 PolarHBondContact O-N 3Å; N292-E295 PolarHBondContact ND2-OE2 3.08Å; E295-G297 PolarHBondContact O-N 3.41Å
296N62Low73Confident147 Ų14787.3 Ų87.379%0.78643%0.433SS*.THydrogen-bonded Turntrans-73.221.5173.9-54.480.8000114.2F294 C298F294-N296 PolarHBondContact O-N 3.37Å; N296-C298 VanDerWaalsContact C-N 3.28Å; N296-C298 PolarHBondContact O-N 2.95Å
297G61.4Low72.3Confident40 Ų4091.7 Ų91.741%0.41245%0.451SS..  trans69.915.9175.900000115.5F294 E295 Y299F294-G297 PolarHBondContact O-N 3.27Å; F294-G297 VanDerWaalsContact O-N 3.1Å; E295-G297 PolarHBondContact O-N 3.41Å; G297-Y299 WeakPolarHBondContact O-CD2 3.26Å; G297-Y299 PolarHBondContact O-N 3.07Å
298C63.5Low71.8Confident62 Ų6291.9 Ų91.942%0.41945%0.453SS..  trans-75.966.9-178.2-162.70000112.3N296 L300N296-C298 VanDerWaalsContact C-N 3.28Å; N296-C298 PolarHBondContact O-N 2.95Å; C298-L300 VanDerWaalsContact C-N 3.26Å; C298-L300 PolarHBondContact O-N 3.11Å
299Y67.9Low71.6Confident55 Ų5595.3 Ų95.322%0.21646%0.461CS..  trans-81.8-0.4176.5-59.2-68.9000113.5S217 M221 Q224 G297S217-Y299 VanDerWaalsContact CB-O 3.24Å; S217-Y299 WeakPolarHBondContact CB-O 3.43Å; S217-Y299 PolarHBondContact OG-O 3.42Å; M221-Y299 HydrophobicContact CG-CD1 3.74Å; M221-Y299 HydrophobicContact CG-CE1 3.36Å; M221-Y299 HydrophobicContact SD-CD1 4.19Å; M221-Y299 HydrophobicContact SD-CE1 4.21Å; M221-Y299 HydrophobicContact SD-CG 4.43Å; Q224-Y299 PolarHBondContact OE1-OH 3.28Å; G297-Y299 WeakPolarHBondContact O-CD2 3.26Å; G297-Y299 PolarHBondContact O-N 3.07Å
300L66.5Low71.5Confident113 Ų11397 Ų9759%0.59246%0.463SS*.SBendtrans-83178.3172.3-10062.7000111.8C298 R302C298-L300 VanDerWaalsContact C-N 3.26Å; C298-L300 PolarHBondContact O-N 3.11Å; L300-R302 PolarHBondContact O-N 3.33Å
301R62.8Low71.4Confident236 Ų236100.5 Ų100.589%0.89148%0.479SS*.  trans-70.7101.8-175.3-173.1177.371.8114.3-2.5111.6
302R68.7Low72Confident56 Ų56101.1 Ų101.121%0.21148%0.475CS..  trans-57.5143.8172.6-61.1-175.9-63.3-178.1-0112.1L300L300-R302 PolarHBondContact O-N 3.33Å
303Q63.1Low72.8Confident209 Ų20998.7 Ų98.798%0.97747%0.47SS*.SBendtrans-82.1-30.5-179.3-174.2172.2-10.600113.7
304K73.5Confident73.6Confident186 Ų18698.5 Ų98.581%0.80947%0.47SS*.SBendtrans-110138.2174.9-167.6175.8-179.5-177.50110.1
305R77.3Confident74.3Confident109 Ų109103 Ų10341%0.41149%0.487SS..  trans-82.7134.7174.2-179.7178.4177-176.32109.6F264 K307F264-R305 VanDerWaalsContact CE1-CZ 3.46Å; F264-R305 VanDerWaalsContact CE1-NH2 3.33Å; F264-R305 VanDerWaalsContact CZ-NH1 3.29Å; F264-R305 PolarHBondContact O-NH2 3.39Å; R305-K307 PolarHBondContact O-N 2.93Å
306F78.9Confident75.2Confident15 Ų15102.9 Ų102.97%0.06649%0.487CS..  trans-64.4127.7166.7178.6-89.7000109.6D266 C267 H287 D289 M293 D308D266-F306 HydrophobicContact CB-CD1 4.03Å; D266-F306 HydrophobicContact CB-CE1 4.18Å; D266-F306 WeakPolarHBondContact O-CE1 3.35Å; C267-F306 HydrophobicContact CB-CB 4.27Å; C267-F306 HydrophobicContact CB-CD1 3.83Å; C267-F306 HydrophobicContact CB-CE1 4.47Å; C267-F306 HydrophobicContact CB-CG 4.11Å; H287-F306 HydrophobicContact CB-CE1 4.03Å; H287-F306 HydrophobicContact CB-CZ 4.01Å; H287-F306 AromaticContact CG-CE1 3.97Å; H287-F306 AromaticContact CG-CZ 3.75Å; H287-F306 AromaticContact ND1-CZ 3.56Å; D289-F306 HydrophobicContact CB-CE2 4.18Å; D289-F306 HydrophobicContact CB-CZ 4.49Å; M293-F306 HydrophobicContact CE-CD2 3.72Å; M293-F306 HydrophobicContact CE-CE2 4.48Å; M293-F306 HydrophobicContact SD-CB 4.04Å; M293-F306 HydrophobicContact SD-CD2 3.84Å; M293-F306 HydrophobicContact SD-CG 4.42Å; F306-D308 HydrophobicContact CE1-CB 4.18Å
307K80.2Confident76.2Confident116 Ų116102.5 Ų102.550%0.50448%0.484SS..  trans-118.7135.4167.8-70.2-172.8174.7-170.30107.4R305 E312R305-K307 PolarHBondContact O-N 2.93Å; K307-E312 HydrophobicContact CD-CG 4.41Å; K307-E312 WeakPolarHBondContact CE-OE1 3.43Å; K307-E312 IonicContact NZ-OE1 3.01Å; K307-E312 PolarHBondContact NZ-OE1 2.78Å
308D81.2Confident77Confident33 Ų33107.6 Ų107.618%0.17650%0.497CS..  trans-80118.9164.4162.9-1.6000107.3D266 H287 F306 K310 K311 E312D266-D308 HydrophobicContact CB-CB 4.03Å; H287-D308 IonicContact NE2-OD2 3.2Å; F306-D308 HydrophobicContact CE1-CB 4.18Å; D308-K310 VanDerWaalsContact C-N 3.34Å; D308-K310 PolarHBondContact O-N 3.21Å; D308-K310 WeakPolarHBondContact OD1-CA 3.3Å; D308-K310 WeakPolarHBondContact OD1-CB 3.44Å; D308-K310 PolarHBondContact OD1-N 3.2Å; D308-K311 HydrophobicContact CB-CB 3.9Å; D308-K311 VanDerWaalsContact CG-CB 3.47Å; D308-K311 PolarHBondContact O-N 2.91Å; D308-K311 PolarHBondContact OD1-N 3.08Å; D308-K311 VanDerWaalsContact OD2-CB 3.26Å; D308-K311 WeakPolarHBondContact OD2-CB 3.42Å; D308-E312 WeakPolarHBondContact O-CB 3.26Å; D308-E312 PolarHBondContact O-N 3.32Å
309E84.1Confident77.7Confident171 Ų171112.6 Ų112.680%0.79951%0.511SS*.Hα-helixtrans-67-33.9-175.6-60.8-170.8156.500112.5E312 A313E309-E312 PolarHBondContact O-N 2.89Å; E309-A313 WeakPolarHBondContact O-CB 3.3Å; E309-A313 PolarHBondContact O-N 2.87Å
310K82.9Confident77.5Confident139 Ų139113.4 Ų113.460%0.60453%0.525SS*.Hα-helixtrans-66.6-43.1176.2-177.5174.3-177.2169.20110.6D308 A313 I314D308-K310 VanDerWaalsContact C-N 3.34Å; D308-K310 PolarHBondContact O-N 3.21Å; D308-K310 WeakPolarHBondContact OD1-CA 3.3Å; D308-K310 WeakPolarHBondContact OD1-CB 3.44Å; D308-K310 PolarHBondContact OD1-N 3.2Å; K310-A313 PolarHBondContact O-N 2.86Å; K310-I314 WeakPolarHBondContact O-CG1 3.35Å; K310-I314 PolarHBondContact O-N 3.47Å; K310-I314 VanDerWaalsContact O-N 3.17Å
311K81.7Confident77.3Confident73 Ų73113.8 Ų113.832%0.31753%0.534SS..Hα-helixtrans-70-31.5175.6-168.6176.9-175.8-170.60112.4D266 D308 R315D266-K311 WeakPolarHBondContact OD1-CD 3.39Å; D266-K311 VanDerWaalsContact OD1-CE 3.3Å; D266-K311 WeakPolarHBondContact OD1-CE 3.35Å; D266-K311 IonicContact OD1-NZ 3.81Å; D266-K311 PolarHBondContact OD1-NZ 3.46Å; D308-K311 HydrophobicContact CB-CB 3.9Å; D308-K311 VanDerWaalsContact CG-CB 3.47Å; D308-K311 PolarHBondContact O-N 2.91Å; D308-K311 PolarHBondContact OD1-N 3.08Å; D308-K311 VanDerWaalsContact OD2-CB 3.26Å; D308-K311 WeakPolarHBondContact OD2-CB 3.42Å; K311-R315 VanDerWaalsContact O-CG 3.27Å; K311-R315 WeakPolarHBondContact O-CG 3.37Å; K311-R315 PolarHBondContact O-N 3.37Å; K311-R315 VanDerWaalsContact O-N 3.08Å
312E83.1Confident77.1Confident36 Ų36106.5 Ų106.517%0.16852%0.519CS..Hα-helixtrans-71.4-40.1173.5-160.577.5158.500112.4K307 D308 E309 I314 R315 Q316K307-E312 HydrophobicContact CD-CG 4.41Å; K307-E312 WeakPolarHBondContact CE-OE1 3.43Å; K307-E312 IonicContact NZ-OE1 3.01Å; K307-E312 PolarHBondContact NZ-OE1 2.78Å; D308-E312 WeakPolarHBondContact O-CB 3.26Å; D308-E312 PolarHBondContact O-N 3.32Å; E309-E312 PolarHBondContact O-N 2.89Å; E312-I314 VanDerWaalsContact C-N 3.34Å; E312-I314 PolarHBondContact O-N 2.75Å; E312-R315 WeakPolarHBondContact O-CB 3.33Å; E312-R315 PolarHBondContact O-N 3.49Å; E312-R315 WeakPolarHBondContact OE2-CD 3.39Å; E312-R315 IonicContact OE2-CZ 2.76Å; E312-R315 IonicContact OE2-NE 3.87Å; E312-R315 IonicContact OE2-NH1 3.75Å; E312-R315 PolarHBondContact OE2-NH1 3.24Å; E312-Q316 WeakPolarHBondContact O-CG 3.48Å; E312-Q316 PolarHBondContact O-N 3.1Å
313A85.8Confident76.3Confident57 Ų57112.9 Ų112.947%0.47155%0.551SS.*Hα-helixtrans-59.8-43.4173.700000111.7E309 K310 Q316 L317E309-A313 WeakPolarHBondContact O-CB 3.3Å; E309-A313 PolarHBondContact O-N 2.87Å; K310-A313 PolarHBondContact O-N 2.86Å; A313-Q316 PolarHBondContact O-N 3.42Å; A313-L317 PolarHBondContact O-N 2.95Å
314I85.6Confident75.7Confident80 Ų80107.7 Ų107.741%0.4154%0.538SS..Hα-helixtrans-61.8-43.8174.1-67.4164.6000111.2K310 E312 Q316 L317 H318K310-I314 WeakPolarHBondContact O-CG1 3.35Å; K310-I314 PolarHBondContact O-N 3.47Å; K310-I314 VanDerWaalsContact O-N 3.17Å; E312-I314 VanDerWaalsContact C-N 3.34Å; E312-I314 PolarHBondContact O-N 2.75Å; I314-Q316 VanDerWaalsContact C-N 3.29Å; I314-Q316 PolarHBondContact O-N 3.09Å; I314-L317 PolarHBondContact O-N 3.29Å; I314-H318 PolarHBondContact O-CD2 3.05Å; I314-H318 PolarHBondContact O-N 3.32Å; I314-H318 VanDerWaalsContact O-N 3.11Å
315R85.2Confident74.2Confident95 Ų95103.3 Ų103.336%0.35853%0.531SS..Hα-helixtrans-60.4-37174.5-73.2163.1178.4149.72.9112.8D266 K311 E312 K319D266-R315 VanDerWaalsContact CG-NH2 3.31Å; D266-R315 IonicContact OD1-CZ 3.39Å; D266-R315 IonicContact OD1-NH1 2.78Å; D266-R315 IonicContact OD1-NH2 3.07Å; D266-R315 PolarHBondContact OD1-NH2 2.81Å; D266-R315 IonicContact OD2-CZ 3.64Å; D266-R315 IonicContact OD2-NH1 2.75Å; D266-R315 PolarHBondContact OD2-NH1 3.02Å; D266-R315 IonicContact OD2-NH2 2.65Å; D266-R315 PolarHBondContact OD2-NH2 3.26Å; D266-R315 VanDerWaalsContact OD2-NH2 3.07Å; K311-R315 VanDerWaalsContact O-CG 3.27Å; K311-R315 WeakPolarHBondContact O-CG 3.37Å; K311-R315 PolarHBondContact O-N 3.37Å; K311-R315 VanDerWaalsContact O-N 3.08Å; E312-R315 WeakPolarHBondContact O-CB 3.33Å; E312-R315 PolarHBondContact O-N 3.49Å; E312-R315 WeakPolarHBondContact OE2-CD 3.39Å; E312-R315 IonicContact OE2-CZ 2.76Å; E312-R315 IonicContact OE2-NE 3.87Å; E312-R315 IonicContact OE2-NH1 3.75Å; E312-R315 PolarHBondContact OE2-NH1 3.24Å; R315-K319 WeakPolarHBondContact O-CB 3.47Å; R315-K319 PolarHBondContact O-N 3.26Å
316Q83.3Confident72.9Confident133 Ų133106 Ų10662%0.62155%0.552SS**Hα-helixtrans-71.2-41.6177.6-71.3175.435.400111.5E312 A313 I314 H318 K319E312-Q316 WeakPolarHBondContact O-CG 3.48Å; E312-Q316 PolarHBondContact O-N 3.1Å; A313-Q316 PolarHBondContact O-N 3.42Å; I314-Q316 VanDerWaalsContact C-N 3.29Å; I314-Q316 PolarHBondContact O-N 3.09Å; Q316-H318 VanDerWaalsContact C-N 3.34Å; Q316-H318 PolarHBondContact O-N 2.85Å; Q316-K319 WeakPolarHBondContact O-CB 3.33Å; Q316-K319 PolarHBondContact O-N 2.92Å
317L84.1Confident71.2Confident138 Ų138114.1 Ų114.172%0.72359%0.59SS**Hα-helixtrans-61.2-40.4176.5-175.263.6000112.4A313 I314 K319A313-L317 PolarHBondContact O-N 2.95Å; I314-L317 PolarHBondContact O-N 3.29Å; L317-K319 PolarHBondContact O-N 2.93Å
318H78.4Confident69.9Low148 Ų148112 Ų11269%0.68560%0.595SS**THydrogen-bonded Turntrans-77.3-4.1173.9-66.1-61.9000114.1I314 Q316 S320I314-H318 PolarHBondContact O-CD2 3.05Å; I314-H318 PolarHBondContact O-N 3.32Å; I314-H318 VanDerWaalsContact O-N 3.11Å; Q316-H318 VanDerWaalsContact C-N 3.34Å; Q316-H318 PolarHBondContact O-N 2.85Å; H318-S320 VanDerWaalsContact C-N 3.33Å; H318-S320 PolarHBondContact O-N 2.8Å; H318-S320 VanDerWaalsContact O-N 3.16Å
319K77.2Confident68.3Low166 Ų166117 Ų11772%0.72263%0.627SS**SBendtrans-88.674.2175.5-171.560.3175.7172.80109.4R315 Q316 L317R315-K319 WeakPolarHBondContact O-CB 3.47Å; R315-K319 PolarHBondContact O-N 3.26Å; Q316-K319 WeakPolarHBondContact O-CB 3.33Å; Q316-K319 PolarHBondContact O-N 2.92Å; L317-K319 PolarHBondContact O-N 2.93Å
320S63.2Low66.3Low72 Ų72114.5 Ų114.550%0.50363%0.628SS.*  trans-48.4133.4176.155.50000111.3H318 S322H318-S320 VanDerWaalsContact C-N 3.33Å; H318-S320 PolarHBondContact O-N 2.8Å; H318-S320 VanDerWaalsContact O-N 3.16Å; S320-S322 PolarHBondContact O-N 3.37Å; S320-S322 PolarHBondContact O-OG 2.97Å; S320-S322 PolarHBondContact OG-OG 2.95Å; S320-S322 VanDerWaalsContact OG-OG 3.08Å
321P62.2Low65.2Low122 Ų122113.7 Ų113.779%0.79264%0.637SS**  trans-77.554.2-178.432.5-36.5000111.8H323P321-H323 PolarHBondContact O-N 3.29Å
322S58.7Low63.5Low82 Ų82113.9 Ų113.957%0.57366%0.66SS**  trans-104.361.4-170.856.50000111.7S320S320-S322 PolarHBondContact O-N 3.37Å; S320-S322 PolarHBondContact O-OG 2.97Å; S320-S322 PolarHBondContact OG-OG 2.95Å; S320-S322 VanDerWaalsContact OG-OG 3.08Å
323H53.5Low61.7Low190 Ų190121 Ų12188%0.8869%0.69SS**SBendtrans-177.3-1.9148.4-115.8-72000116.8P321 S325P321-H323 PolarHBondContact O-N 3.29Å; H323-S325 PolarHBondContact O-N 3Å; H323-S325 VanDerWaalsContact O-N 3.08Å
324S50.1Low60Low101 Ų101128.1 Ų128.171%0.70671%0.71SS**  trans-74.898.5178.251.50000111.5
325S41.7Very low58Low93 Ų93130.7 Ų130.765%0.6573%0.725SS**  trans-59.8141.4173.8-173.30000111.8H323 E327H323-S325 PolarHBondContact O-N 3Å; H323-S325 VanDerWaalsContact O-N 3.08Å; S325-E327 PolarHBondContact OG-N 3.13Å
326L50.9Low56.4Low165 Ų165135.3 Ų135.386%0.86475%0.75SS**  trans-120.970.3163.3-76.1179.1000109.6A328L326-A328 PolarHBondContact O-N 3.29Å; L326-A328 VanDerWaalsContact O-N 3.13Å
327E41.6Very low54.6Low186 Ų186137.3 Ų137.387%0.86976%0.76SS**  trans-74.688.5164.2-173176.416600108.8S325S325-E327 PolarHBondContact OG-N 3.13Å
328A52.8Low52.7Low72 Ų72137.4 Ų137.460%0.59576%0.761SS**  trans-143.979.9-173.300000113.1L326L326-A328 PolarHBondContact O-N 3.29Å; L326-A328 VanDerWaalsContact O-N 3.13Å
329T48.5Very low51.2Low139 Ų139133.6 Ų133.685%0.85375%0.751SS**  trans37.6112.4148.5530000120
330S42.1Very low50.1Low118 Ų118133.4 Ų133.483%0.82575%0.752SS**PPolyproline II helixtrans-76.2135.4162.1-174.70000111.8
331P58.7Low49.4Very low121 Ų121138.4 Ų138.479%0.78677%0.767SS**PPolyproline II helixtrans-82.8142176.732.9-33.7000112.8
332G46.1Very low48.5Very low77 Ų77140.3 Ų140.379%0.79477%0.767SS**PPolyproline II helixtrans-88.2168-17400000116.4
333K45.7Very low47.9Very low187 Ų187145.1 Ų145.181%0.81378%0.781SS**PPolyproline II helixtrans-50.3150.5178.3-53.9173.7179.3-177.70114.5
334K50.3Low47.5Very low206 Ų206143.4 Ų143.490%0.89677%0.773SS**  trans-142.8151.3142.8-78-162.4175.6-176.50110
335D44.9Very low47.3Very low133 Ų133146.6 Ų146.671%0.71178%0.776SS**  trans-111.6149.6-160.5-40-95000112.1
336H50.9Low47.4Very low192 Ų192149.3 Ų149.389%0.88978%0.778SS**  trans-152.4132.7156-125.449.5000112.3
337E44.4Very low47.1Very low176 Ų176150 Ų15082%0.82278%0.777SS**  trans-86.3174.1167.4-60163.5126.700107.3
338D45.1Very low46.8Very low139 Ų139146.4 Ų146.474%0.74377%0.772SS**  cis-160.3165.218.6-160.4-15.9000111
339S47.2Very low46.3Very low68 Ų68153.8 Ų153.848%0.47678%0.784SS.*  trans64.5112.9143.2-77.40000123.7
340H53Low46.1Very low163 Ų163154.2 Ų154.276%0.75578%0.78SS**  76.3147.4129.3-59.9-18.5000119.4
341H48.4Very low46Very low177 Ų177154.4 Ų154.482%0.81977%0.772SS**  cis-149.4176.77.6-131.253.3000111.4
342M44.8Very low45.5Very low161 Ų161155.4 Ų155.479%0.79377%0.766SS**  trans-99.3148.9-170.5-74.4-80.4171.400115.7
343H45.1Very low45.5Very low184 Ų184158.8 Ų158.885%0.85276%0.761SS**  -179.3166.6121.2-10180.7000115.3
344H44.4Very low45.2Very low154 Ų154156.9 Ų156.971%0.71376%0.755SS**  trans-89.5153.3-178.3-53.2-41.5000114.2
345H46.4Very low44.8Very low168 Ų168153.9 Ų153.978%0.77874%0.744SS**  179164.4100.1-105-75.2000115.9
346H43.5Very low44.8Very low149 Ų149154.3 Ų154.369%0.6974%0.741SS**  trans-51.6148.2177.5-65.9-154.2000115.7
347H45.6Very low44.4Very low181 Ų181153.2 Ų153.284%0.83873%0.734SS**  178.7148.695.4-100.3-74.9000113.7
348S36Very low44.1Very low110 Ų110152.6 Ų152.677%0.76973%0.731SS**  trans-86.4151.7174.4-33.10000112.9
349R41.3Very low44.1Very low227 Ų227150.8 Ų150.886%0.85774%0.735SS**  trans-174.8138.9140.5-103.5158.2-177.1170.21.8112.3
350L44.2Very low43.6Very low147 Ų147151.7 Ų151.777%0.7776%0.755SS**  trans37.2152.5133-56.7170.6000120.7
351D39.9Very low42.9Very low122 Ų122148 Ų14865%0.65276%0.761SS**  cis-178.5177.3-26-151.2-49.4000106.2
352H48.7Very low42.5Very low143 Ų143144.9 Ų144.966%0.66277%0.766SS**  trans73.6119.6151.9-82.531.8000122.3
353H45.1Very low42.2Very low148 Ų148142.3 Ų142.369%0.68576%0.764SS**  95.292.4125.3-79.149.3000123
354Q39.7Very low42.1Very low147 Ų147141.8 Ų141.869%0.68777%0.766SS**  63.2134.2102-142.285.6-2.500122.9
355H42.8Very low41.8Very low142 Ų142139 Ų13966%0.65777%0.77SS**  trans91117143.1-86.8-44.9000124.4
356H45Very low41.5Very low142 Ų142134.2 Ų134.266%0.65777%0.765SS**  107.9130.5118.2-94.9-49.4000123
357K41.5Very low41.4Very low169 Ų169134 Ų13474%0.73577%0.774SS**  trans75.6153.9146.8-71.1-174.6174.8-176.90120
358E38.6Very low41.1Very low164 Ų164133.2 Ų133.277%0.76678%0.776SS**  cis-169.1161.2-39.5-131.6170-179.900111.5
359A45Very low41.3Very low100 Ų100134.4 Ų134.483%0.82678%0.778SS**  trans64.6132.815300000122.5
360G37.2Very low41.2Very low87 Ų87131.9 Ų131.990%0.89778%0.781SS**  trans95.7123.215200000117.2
361G37.5Very low40.8Very low85 Ų85130.5 Ų130.588%0.87678%0.784SS**  cis142.696.8-11.900000114.3
362A40.6Very low40.8Very low112 Ų112129.5 Ų129.593%0.92679%0.792SS**  trans-152.3150.9166.300000110.2
363S37.3Very low40.5Very low107 Ų107126 Ų12675%0.74879%0.788SS**  trans-125.3140.7-169.4-179.20000113
364I43.3Very low40.7Very low174 Ų174126.6 Ų126.689%0.89279%0.791SS**  trans-131.3121.7156.7-59.9-178.4000106.6
365A38.3Very low41.2Very low96 Ų96123.9 Ų123.979%0.79379%0.788SS**  trans-96.8137.4-174.100000112.1
366G40Very low41.6Very low66 Ų66125.1 Ų125.168%0.6879%0.792SS**  trans-157.263.2-174.100000113.8
367V42.1Very low41.8Very low146 Ų146123.2 Ų123.289%0.88579%0.786SS**  trans31105.9162.1-71.10000118.8
368N39.3Very low42.7Very low164 Ų164118 Ų11888%0.87778%0.775SS**  trans-134.8105.2162.4-151.410.8000110
369V40.2Very low43.4Very low134 Ų134117.5 Ų117.581%0.81277%0.773SS**  trans-141.489.5-176.3-177.70000109.8
370L39.5Very low44Very low174 Ų174115.2 Ų115.291%0.91175%0.754SS**  trans-16560.2169.7-111.7169.4000111.3
371S34.4Very low45Very low119 Ų119117 Ų11783%0.83274%0.742SS**  trans-152.270.7-179.3178.90000112.9
372A40.1Very low46.3Very low101 Ų101115.8 Ų115.884%0.83572%0.724SS**SBendtrans-153.4-5.6176.700000116.6
373A42.8Very low47.2Very low70 Ų70116.8 Ų116.858%0.57971%0.711SS**  trans-93.1-23.1-164.200000116.2S375A373-S375 PolarHBondContact O-N 3.04Å; A373-S375 VanDerWaalsContact O-N 3.1Å
374H49.4Very low48Very low159 Ų159115.9 Ų115.974%0.73670%0.698SS**THydrogen-bonded Turntrans-80.99.3-153.1-71.6-78.6000117.9
375S51.5Low48.7Very low91 Ų91113.8 Ų113.864%0.63668%0.684SS**THydrogen-bonded Turntrans-84.7-25.4-17859.60000115A373A373-S375 PolarHBondContact O-N 3.04Å; A373-S375 VanDerWaalsContact O-N 3.1Å
376K49.3Very low49.5Very low167 Ų167112 Ų11273%0.72667%0.669SS**Hα-helixtrans-90.3-24.5-170.4-65.3-174.4178.9-178.70114.7A378K376-A378 VanDerWaalsContact C-N 3.29Å; K376-A378 PolarHBondContact O-N 3.16Å
377D51.2Low50.1Low102 Ų102114 Ų11455%0.54566%0.664SS.*Hα-helixtrans-75-20.3178.2-59.3-62.1000112.8A380 L381D377-A380 PolarHBondContact O-N 2.71Å; D377-L381 PolarHBondContact O-N 3.03Å
378A58.5Low50.5Low61 Ų61109.9 Ų109.950%0.50465%0.645SS.*Hα-helixtrans-65.1-46.1179.800000112.6K376 A380 L381 A382K376-A378 VanDerWaalsContact C-N 3.29Å; K376-A378 PolarHBondContact O-N 3.16Å; A378-A380 VanDerWaalsContact C-N 3.35Å; A378-L381 PolarHBondContact O-N 3.05Å; A378-A382 PolarHBondContact O-N 2.97Å
379E54.7Low50.9Low153 Ų153109 Ų10972%0.71564%0.636SS**Hα-helixtrans-64.7-39175.1-73.7-173.6104.200111.8L381 A382 M383E379-L381 VanDerWaalsContact C-N 3.3Å; E379-L381 PolarHBondContact O-N 3.17Å; E379-A382 PolarHBondContact O-N 3.46Å; E379-M383 WeakPolarHBondContact O-CB 3.38Å; E379-M383 PolarHBondContact O-N 3.39Å
380A56.2Low51.3Low52 Ų52108.2 Ų108.243%0.4363%0.626SS.*Hα-helixtrans-64.3-34.1178.300000112.7D377 A378 L384D377-A380 PolarHBondContact O-N 2.71Å; A378-A380 VanDerWaalsContact C-N 3.35Å; A380-L384 PolarHBondContact O-N 2.99Å
381L60Low51.5Low123 Ų123104.9 Ų104.964%0.64462%0.617SS**Hα-helixtrans-73.3-44.8172-82165.7000112.3D377 A378 E379 M383 L384 H385D377-L381 PolarHBondContact O-N 3.03Å; A378-L381 PolarHBondContact O-N 3.05Å; E379-L381 VanDerWaalsContact C-N 3.3Å; E379-L381 PolarHBondContact O-N 3.17Å; L381-M383 VanDerWaalsContact C-N 3.32Å; L381-M383 PolarHBondContact O-N 2.92Å; L381-L384 WeakPolarHBondContact O-CB 3.19Å; L381-L384 PolarHBondContact O-N 2.89Å; L381-L384 VanDerWaalsContact O-N 3.15Å; L381-H385 PolarHBondContact O-N 3.29Å
382A64.6Low52.1Low61 Ų61106.4 Ų106.450%0.50462%0.615SS.*Hα-helixtrans-58.6-43.2177.600000111.9A378 E379 L384 H385 A386A378-A382 PolarHBondContact O-N 2.97Å; E379-A382 PolarHBondContact O-N 3.46Å; A382-L384 VanDerWaalsContact C-N 3.32Å; A382-L384 PolarHBondContact O-N 3.15Å; A382-H385 WeakPolarHBondContact O-CB 3.44Å; A382-H385 PolarHBondContact O-N 3.17Å; A382-H385 VanDerWaalsContact O-N 3.14Å; A382-A386 PolarHBondContact O-N 2.9Å
383M57.8Low52.4Low132 Ų132105.8 Ų105.865%0.6560%0.604SS**Hα-helixtrans-70.6-25.6179-16516560.300113E379 L381 N387E379-M383 WeakPolarHBondContact O-CB 3.38Å; E379-M383 PolarHBondContact O-N 3.39Å; L381-M383 VanDerWaalsContact C-N 3.32Å; L381-M383 PolarHBondContact O-N 2.92Å; M383-N387 PolarHBondContact O-ND2 3.49Å
384L55.2Low52.4Low88 Ų88110.2 Ų110.246%0.46161%0.613SS.*Hα-helixtrans-72-38167.9-91.1165.2000112.2A380 L381 A382 N387 A388A380-L384 PolarHBondContact O-N 2.99Å; L381-L384 WeakPolarHBondContact O-CB 3.19Å; L381-L384 PolarHBondContact O-N 2.89Å; L381-L384 VanDerWaalsContact O-N 3.15Å; A382-L384 VanDerWaalsContact C-N 3.32Å; A382-L384 PolarHBondContact O-N 3.15Å; L384-N387 PolarHBondContact O-N 3.2Å; L384-A388 PolarHBondContact O-N 2.97Å
385H57.5Low51.8Low131 Ų131110.7 Ų110.761%0.60662%0.616SS**Hα-helixtrans-66.1-43.6178.3-136.9-120.2000111.8L381 A382 N387 A388 E389L381-H385 PolarHBondContact O-N 3.29Å; A382-H385 WeakPolarHBondContact O-CB 3.44Å; A382-H385 PolarHBondContact O-N 3.17Å; A382-H385 VanDerWaalsContact O-N 3.14Å; H385-N387 VanDerWaalsContact C-N 3.25Å; H385-N387 PolarHBondContact O-N 3.38Å; H385-A388 WeakPolarHBondContact O-CB 3.47Å; H385-A388 PolarHBondContact O-N 3.06Å; H385-E389 PolarHBondContact O-N 3.4Å
386A56.3Low51.5Low58 Ų58112.4 Ų112.448%0.47962%0.624SS.*Hα-helixtrans-58.9-33.8176.100000113.4A382 A388 L390A382-A386 PolarHBondContact O-N 2.9Å; A386-A388 VanDerWaalsContact C-N 3.31Å; A386-A388 PolarHBondContact O-N 3.01Å; A386-L390 PolarHBondContact O-N 3Å
387N52.1Low51.1Low109 Ų109113 Ų11358%0.58363%0.63SS**Hα-helixtrans-73-20.4175.5-83.3-83.2000113.4M383 L384 H385M383-N387 PolarHBondContact O-ND2 3.49Å; L384-N387 PolarHBondContact O-N 3.2Å; H385-N387 VanDerWaalsContact C-N 3.25Å; H385-N387 PolarHBondContact O-N 3.38Å
388A49.8Very low50.6Low59 Ų59115 Ų11549%0.48864%0.636SS.*Hα-helixtrans-76.8-44.5172.800000111.3L384 H385 A386 C391L384-A388 PolarHBondContact O-N 2.97Å; H385-A388 WeakPolarHBondContact O-CB 3.47Å; H385-A388 PolarHBondContact O-N 3.06Å; A386-A388 VanDerWaalsContact C-N 3.31Å; A386-A388 PolarHBondContact O-N 3.01Å; A388-C391 WeakPolarHBondContact O-CB 3.43Å; A388-C391 PolarHBondContact O-N 2.66Å
389E48.9Very low49.8Very low144 Ų144118.1 Ų118.167%0.67365%0.648SS**Hα-helixtrans-67.5-38.8179.8-65.2-158.9111.300112.9H385 C391 L392 S393H385-E389 PolarHBondContact O-N 3.4Å; E389-C391 PolarHBondContact O-N 2.94Å; E389-C391 VanDerWaalsContact O-N 3.14Å; E389-L392 PolarHBondContact O-N 3.33Å; E389-S393 PolarHBondContact O-N 3.5Å
390L48Very low49.1Very low118 Ų118115.9 Ų115.962%0.61865%0.646SS**Hα-helixtrans-65.5-17177.3-156.574.1000113.4A386A386-L390 PolarHBondContact O-N 3Å
391C44.1Very low48.5Very low105 Ų105119.6 Ų119.671%0.70966%0.664SS**Hα-helixtrans-84.5-19.7173.3-162.50000112.7A388 E389A388-C391 WeakPolarHBondContact O-CB 3.43Å; A388-C391 PolarHBondContact O-N 2.66Å; E389-C391 PolarHBondContact O-N 2.94Å; E389-C391 VanDerWaalsContact O-N 3.14Å
392L45.4Very low47.7Very low151 Ų151122.6 Ų122.679%0.79168%0.675SS**Hα-helixtrans-94.9-18.5-176.7-138.172000113.5E389E389-L392 PolarHBondContact O-N 3.33Å
393S46.1Very low46.9Very low87 Ų87128 Ų12861%0.60869%0.689SS**SBendtrans-81.8-5.1-178.859.90000115.2E389E389-S393 PolarHBondContact O-N 3.5Å
394Q44Very low46.4Very low163 Ų163130.3 Ų130.376%0.76270%0.698SS**  trans-108.764.6178.8-73-17770.900112.5
395Q36.4Very low46.1Very low170 Ų170134.4 Ų134.479%0.79471%0.714SS**  trans-123.9107.5166-169.6173.297.400110.3
396P44.4Very low45.5Very low126 Ų126135.3 Ų135.382%0.81872%0.719SS**  trans-61.5140.2174.2-23.935.1000112.1
397Q41.6Very low45.2Very low180 Ų180138.8 Ų138.884%0.84173%0.725SS**  trans-75.1143.7-174.8-78.7-72.9-5.600113.7
398H41Very low45.1Very low145 Ų145140.7 Ų140.767%0.67173%0.73SS**  trans59.798.2142.4-169.7-79.6000120.1
399V41.8Very low45Very low126 Ų126143.6 Ų143.676%0.76473%0.733SS**  -157.4121.3118.1-98.80000110.6
400P40Very low45.3Very low105 Ų105141.9 Ų141.968%0.68273%0.728SS**  trans-94.9106.2176.133.4-29.8000112.3
401T43.8Very low45.6Very low130 Ų130141.3 Ų141.380%0.79872%0.722SS**  trans-109.2116.1168.340.40000111.3H403T401-H403 PolarHBondContact O-N 3.19Å; T401-H403 VanDerWaalsContact O-N 3.15Å
402H43.1Very low46.1Very low187 Ų187143.7 Ų143.787%0.86672%0.723SS**  trans-58.7112.4175.3-82.6-119.5000111
403H47.2Very low46.6Very low174 Ų174142 Ų14281%0.80671%0.711SS**  trans-155.4-8.7163.5-109.275.1000115.9T401 H405T401-H403 PolarHBondContact O-N 3.19Å; T401-H403 VanDerWaalsContact O-N 3.15Å; H403-H405 PolarHBondContact O-N 3.21Å
404H48.5Very low46.9Very low181 Ų181143.6 Ų143.684%0.83871%0.709SS**THydrogen-bonded Turntrans-88.66-163.4-140.282.6000116.9
405H47.3Very low47.5Very low174 Ų174140.5 Ų140.581%0.80670%0.697SS**THydrogen-bonded Turntrans-85.2-16.7-173.9-136.686.1000114.5H403H403-H405 PolarHBondContact O-N 3.21Å
406Q45.2Very low48.9Very low149 Ų149136.2 Ų136.270%0.69669%0.686SS**Hα-helixtrans-81.1-29.9-170.7-131.9173.89.300114.1H408Q406-H408 PolarHBondContact O-N 2.96Å
407H49.5Very low49.5Very low131 Ų131132.1 Ų132.161%0.60666%0.663SS**Hα-helixtrans-77.6-21.1-169.5-161.4-59.6000114
408H50.9Low50.2Low150 Ų150128.7 Ų128.769%0.69465%0.648SS**Hα-helixtrans-85.8-32.2-179.9-144.536.5000112.6Q406 Q411 Q412Q406-H408 PolarHBondContact O-N 2.96Å; H408-Q411 PolarHBondContact O-N 3.12Å; H408-Q412 PolarHBondContact O-N 3.18Å
409Q48.8Very low50.8Low119 Ų119128.6 Ų128.656%0.55665%0.649SS**Hα-helixtrans-62-46.9175-172.9170-0.500111.2Q411 Q412 E413Q409-Q411 VanDerWaalsContact C-N 3.32Å; Q409-Q411 PolarHBondContact O-N 3.44Å; Q409-Q412 PolarHBondContact O-N 3.22Å; Q409-E413 WeakPolarHBondContact O-CB 3.45Å; Q409-E413 PolarHBondContact O-N 3.27Å
410L53.4Low51.5Low109 Ų109125.5 Ų125.557%0.57164%0.637SS**Hα-helixtrans-56-39.9179.7-72.9170.2000113.5Q412 E413 E414L410-Q412 PolarHBondContact O-N 3.2Å; L410-E413 PolarHBondContact O-N 3.27Å; L410-E414 VanDerWaalsContact O-CB 3.25Å; L410-E414 WeakPolarHBondContact O-CB 3.24Å; L410-E414 PolarHBondContact O-N 3.25Å
411Q55.9Low51.8Low106 Ų106126.7 Ų126.750%0.49564%0.638SS.*Hα-helixtrans-70.7-29.5178.1-77.2-171.7-33.200113.6H408 Q409 L415H408-Q411 PolarHBondContact O-N 3.12Å; Q409-Q411 VanDerWaalsContact C-N 3.32Å; Q409-Q411 PolarHBondContact O-N 3.44Å; Q411-L415 WeakPolarHBondContact O-CB 3.49Å; Q411-L415 PolarHBondContact O-N 3.41Å
412Q54.7Low51.9Low155 Ų155131 Ų13172%0.72464%0.64SS**Hα-helixtrans-78.2-37.1174.9-166.416930.600111.1H408 Q409 L410 L415 S416H408-Q412 PolarHBondContact O-N 3.18Å; Q409-Q412 PolarHBondContact O-N 3.22Å; L410-Q412 PolarHBondContact O-N 3.2Å; Q412-L415 PolarHBondContact O-N 3.23Å; Q412-S416 WeakPolarHBondContact O-CB 3.36Å; Q412-S416 PolarHBondContact O-N 3.13Å
413E55Low51.7Low114 Ų114127.5 Ų127.553%0.53364%0.635SS.*Hα-helixtrans-71.2-40178.4-153.9165.9122.200111.8Q409 L410 S416 A417Q409-E413 WeakPolarHBondContact O-CB 3.45Å; Q409-E413 PolarHBondContact O-N 3.27Å; L410-E413 PolarHBondContact O-N 3.27Å; E413-S416 PolarHBondContact O-N 2.94Å; E413-A417 VanDerWaalsContact O-CB 3.31Å; E413-A417 WeakPolarHBondContact O-CB 3.37Å; E413-A417 PolarHBondContact O-N 3.39Å
414E53Low51.3Low122 Ų122126.9 Ų126.957%0.5763%0.632SS**Hα-helixtrans-64.1-40.8173-159.2-164.2158.200111.4L410 A417 M418L410-E414 VanDerWaalsContact O-CB 3.25Å; L410-E414 WeakPolarHBondContact O-CB 3.24Å; L410-E414 PolarHBondContact O-N 3.25Å; E414-A417 PolarHBondContact O-N 2.89Å; E414-M418 HydrophobicContact CB-CE 4.32Å; E414-M418 HydrophobicContact CG-CE 3.72Å; E414-M418 WeakPolarHBondContact O-CB 3.26Å; E414-M418 WeakPolarHBondContact O-CG 3.35Å; E414-M418 PolarHBondContact O-N 3.36Å
415L56.4Low50.9Low97 Ų97124.1 Ų124.151%0.50863%0.63SS.*Hα-helixtrans-64.7-38.1173-94.6164.9000112.6Q411 Q412 M419Q411-L415 WeakPolarHBondContact O-CB 3.49Å; Q411-L415 PolarHBondContact O-N 3.41Å; Q412-L415 PolarHBondContact O-N 3.23Å; L415-M419 HydrophobicContact CD2-CE 4.25Å; L415-M419 WeakPolarHBondContact O-CG 3.47Å; L415-M419 PolarHBondContact O-N 3.05Å
416S65.1Low50.2Low80 Ų80120.3 Ų120.356%0.55962%0.623SS**Hα-helixtrans-69.1-43.3176.2-1570000111.3Q412 E413 M418 M419 A420Q412-S416 WeakPolarHBondContact O-CB 3.36Å; Q412-S416 PolarHBondContact O-N 3.13Å; E413-S416 PolarHBondContact O-N 2.94Å; S416-M418 VanDerWaalsContact C-N 3.35Å; S416-M418 PolarHBondContact O-N 2.82Å; S416-M419 PolarHBondContact O-N 2.97Å; S416-A420 PolarHBondContact O-N 2.94Å
417A58Low50Low40 Ų40120.2 Ų120.233%0.33163%0.627SS.*Hα-helixtrans-63.4-37.3174.700000112.4E413 E414 M419 A420 N421E413-A417 VanDerWaalsContact O-CB 3.31Å; E413-A417 WeakPolarHBondContact O-CB 3.37Å; E413-A417 PolarHBondContact O-N 3.39Å; E414-A417 PolarHBondContact O-N 2.89Å; A417-M419 PolarHBondContact O-N 3.49Å; A417-A420 PolarHBondContact O-N 3.45Å; A417-N421 VanDerWaalsContact O-CB 3.28Å; A417-N421 WeakPolarHBondContact O-CB 3.2Å; A417-N421 PolarHBondContact O-N 3.34Å
418M55.5Low49.6Very low108 Ų108119.3 Ų119.353%0.53263%0.625SS.*Hα-helixtrans-63-22.9171.7-81.8-172.9-109.200113.6E414 S416E414-M418 HydrophobicContact CB-CE 4.32Å; E414-M418 HydrophobicContact CG-CE 3.72Å; E414-M418 WeakPolarHBondContact O-CB 3.26Å; E414-M418 WeakPolarHBondContact O-CG 3.35Å; E414-M418 PolarHBondContact O-N 3.36Å; S416-M418 VanDerWaalsContact C-N 3.35Å; S416-M418 PolarHBondContact O-N 2.82Å
419M54.2Low49Very low143 Ų143119.3 Ų119.370%0.70464%0.635SS**Hα-helixtrans-91.7-36.2174.4-63.6-177.4-155.100112.2L415 S416 A417L415-M419 HydrophobicContact CD2-CE 4.25Å; L415-M419 WeakPolarHBondContact O-CG 3.47Å; L415-M419 PolarHBondContact O-N 3.05Å; S416-M419 PolarHBondContact O-N 2.97Å; A417-M419 PolarHBondContact O-N 3.49Å
420A56.1Low48.4Very low62 Ų62120.3 Ų120.351%0.51265%0.645SS.*Hα-helixtrans-72.4-43.6178.500000113.2S416 A417 R422 C423S416-A420 PolarHBondContact O-N 2.94Å; A417-A420 PolarHBondContact O-N 3.45Å; A420-R422 PolarHBondContact O-N 3.44Å; A420-C423 PolarHBondContact O-N 2.79Å
421N47.1Very low47.6Very low129 Ų129125.3 Ų125.369%0.6966%0.658SS**THydrogen-bonded Turntrans-78.326.6-172.2-66.1-14.7000114.3A417A417-N421 VanDerWaalsContact O-CB 3.28Å; A417-N421 WeakPolarHBondContact O-CB 3.2Å; A417-N421 PolarHBondContact O-N 3.34Å
422R46.3Very low46.7Very low222 Ų222128.9 Ų128.984%0.83867%0.674SS**THydrogen-bonded Turntrans-105.2-1.5168.4-88.6-174.7172.1-104.4-4.7114.3A420A420-R422 PolarHBondContact O-N 3.44Å
423C38.6Very low45.8Very low112 Ų112126.9 Ų126.976%0.75768%0.677SS**  trans-113.185.2174.8-67.60000110.8A420 P425A420-C423 PolarHBondContact O-N 2.79Å; C423-P425 WeakPolarHBondContact O-CD 3.45Å
424H38.5Very low44.9Very low162 Ų162125.8 Ų125.875%0.7568%0.682SS**  trans-78.2113.9171.3-113.7-82.1000110.1S426H424-S426 VanDerWaalsContact C-N 3.3Å; H424-S426 PolarHBondContact O-N 3.32Å
425P38.8Very low44.4Very low123 Ų123128.3 Ų128.380%0.79970%0.696SS**SBendtrans-94.247.3-174.239-34.2000111.4C423C423-P425 WeakPolarHBondContact O-CD 3.45Å
426S33.9Very low43.7Very low94 Ų94132.4 Ų132.466%0.65771%0.712SS**  trans-152.120.5-169-46.20000115.4H424H424-S426 VanDerWaalsContact C-N 3.3Å; H424-S426 PolarHBondContact O-N 3.32Å
427L40.4Very low42.5Very low147 Ų147133.5 Ų133.577%0.7772%0.717SS**SBendtrans-102.8110.5169.5-76.3-177.5000111.6
428I41Very low41.6Very low111 Ų111139.8 Ų139.857%0.56974%0.744SS**  trans72.567.6147.2-50.3170.3000113.7D430 Y431I428-D430 HydrophobicContact CG2-CB 3.68Å; I428-D430 PolarHBondContact O-N 3.31Å; I428-Y431 HydrophobicContact CG2-CD2 4.01Å
429T37.9Very low41Very low150 Ų150142.9 Ų142.992%0.9276%0.755SS**SBendtrans-65.861.7145.1-50.80000109.4
430D36.6Very low40.3Very low141 Ų141143.8 Ų143.875%0.75476%0.757SS**  trans-158.227.4-175.2-107.7-33000112.9I428I428-D430 HydrophobicContact CG2-CB 3.68Å; I428-D430 PolarHBondContact O-N 3.31Å
431Y36.1Very low39.5Very low214 Ų214149.1 Ų149.184%0.83977%0.772SS**  trans-135.355.6169.8-98.6-82.1000111.5I428I428-Y431 HydrophobicContact CG2-CD2 4.01Å
432H38Very low39.5Very low181 Ų181148.1 Ų148.184%0.83877%0.772SS**  trans-106.5142.2166.4-158.5-114.7000108.6
433S34.5Very low39.9Very low112 Ų112143.9 Ų143.978%0.78378%0.776SS**SBendtrans77.555.4-179-49.20000118.2
434S36.2Very low40.7Very low91 Ų91141.1 Ų141.164%0.63677%0.767SS**  trans-161.7160.5137.552.70000112.4
435M42.4Very low41.4Very low175 Ų175140.9 Ų140.986%0.86276%0.761SS**  trans71.961.9171.5-47.8-50.5169.400119.1
436H42.3Very low42.8Very low184 Ų184138.1 Ų138.185%0.85274%0.742SS**  trans-75165.3139.8-94.2-103000110.1
437P40.9Very low44.3Very low102 Ų102139.1 Ų139.166%0.66275%0.746SS**  cis-141131-21.533.6-13.5000115.7
438L37.5Very low45.8Very low173 Ų173135 Ų13591%0.90673%0.73SS**  trans-142.1124.2158.6-76.4169.8000106.3
439K42.6Very low47.3Very low173 Ų173131.2 Ų131.275%0.75271%0.713SS**  cis63.5113.220.4-147.5175.1-179.3-176.50111.3
440Q40.3Very low49.1Very low161 Ų161128.8 Ų128.875%0.75269%0.691SS**  cis-151.8143.618.8-155.7161.4-48.600111.3
441E39Very low51Low175 Ų175125.9 Ų125.982%0.81868%0.68SS**  trans-67.9129.4175.9-80.5-67107.900112.2S443E441-S443 PolarHBondContact O-N 3.39Å
442P48.1Very low52.9Low108 Ų108124.8 Ų124.870%0.70168%0.68SS**  trans-83.297.5173.932-31.8000111G444P442-G444 PolarHBondContact O-N 2.85Å
443S53.5Low54.8Low132 Ų132116.9 Ų116.992%0.92365%0.645SS**THydrogen-bonded Turntrans-63.786.9175.757.60000112.3E441E441-S443 PolarHBondContact O-N 3.39Å
444G55.3Low56.9Low55 Ų55117 Ų11757%0.56764%0.636SS**THydrogen-bonded Turntrans-170.7-1.7179.700000116.7P442 T446P442-G444 PolarHBondContact O-N 2.85Å; G444-T446 PolarHBondContact O-N 2.95Å
445Y53.7Low58.9Low157 Ų157116 Ų11662%0.61662%0.623SS**  trans-82.4103.2-178.8-133.2-68.7000111.5H450Y445-H450 HydrophobicContact CE1-CB 4.45Å; Y445-H450 AromaticContact CE1-CE1 3.55Å; Y445-H450 AromaticContact CE1-CG 3.71Å; Y445-H450 AromaticContact CE1-ND1 3.42Å; Y445-H450 WeakPolarHBondContact CE1-ND1 3Å; Y445-H450 AromaticContact CE1-NE2 3.91Å; Y445-H450 AromaticContact CZ-ND1 3.78Å; Y445-H450 PolarHBondContact OH-ND1 3.19Å
446T69.3Low60.4Low65 Ų65115.1 Ų115.140%0.39961%0.61SS.*  trans-109.8160.9173.965.30000110.1G444 S448 S449G444-T446 PolarHBondContact O-N 2.95Å; T446-S448 PolarHBondContact O-N 2.58Å; T446-S448 PolarHBondContact OG1-N 3.17Å; T446-S448 PolarHBondContact OG1-OG 3.28Å; T446-S449 PolarHBondContact N-OG 3.14Å; T446-S449 PolarHBondContact O-N 2.75Å; T446-S449 PolarHBondContact O-OG 3.44Å; T446-S449 PolarHBondContact OG1-N 3.49Å
447P64.4Low61.8Low115 Ų115112.8 Ų112.875%0.74760%0.603SS**THydrogen-bonded Turntrans-56.3-19.8171.2-27.236.4000113.9S453P447-S453 VanDerWaalsContact O-CB 3.26Å; P447-S453 WeakPolarHBondContact O-CB 3.19Å; P447-S453 PolarHBondContact O-OG 2.76Å
448S71.6Confident63.3Low61 Ų61111 Ų11143%0.42759%0.587SS.*THydrogen-bonded Turntrans-77.9-23.1174.181.90000114.3T446 S453T446-S448 PolarHBondContact O-N 2.58Å; T446-S448 PolarHBondContact OG1-N 3.17Å; T446-S448 PolarHBondContact OG1-OG 3.28Å; S448-S453 WeakPolarHBondContact CA-OG 3.33Å; S448-S453 WeakPolarHBondContact O-CB 3.24Å
449S73.3Confident64.9Low31 Ų31106.4 Ų106.422%0.21757%0.568CS.*THydrogen-bonded Turntrans-92-14-174.564.50000114.3T446 R456T446-S449 PolarHBondContact N-OG 3.14Å; T446-S449 PolarHBondContact O-N 2.75Å; T446-S449 PolarHBondContact O-OG 3.44Å; T446-S449 PolarHBondContact OG1-N 3.49Å; S449-R456 PolarHBondContact O-NE 2.96Å; S449-R456 PolarHBondContact O-NH2 3.25Å
450H74.6Confident66Low98 Ų98104.2 Ų104.245%0.45457%0.569SS.*SBendtrans-52.7146.9173.7-98.4-52.5000112.3Y445 F452 S453 R456Y445-H450 HydrophobicContact CE1-CB 4.45Å; Y445-H450 AromaticContact CE1-CE1 3.55Å; Y445-H450 AromaticContact CE1-CG 3.71Å; Y445-H450 AromaticContact CE1-ND1 3.42Å; Y445-H450 WeakPolarHBondContact CE1-ND1 3Å; Y445-H450 AromaticContact CE1-NE2 3.91Å; Y445-H450 AromaticContact CZ-ND1 3.78Å; Y445-H450 PolarHBondContact OH-ND1 3.19Å; H450-F452 PolarHBondContact O-N 3.43Å; H450-S453 WeakPolarHBondContact O-CB 3.45Å; H450-S453 PolarHBondContact O-N 3.38Å; H450-S453 VanDerWaalsContact O-N 3.12Å; H450-R456 WeakPolarHBondContact O-CD 3.49Å; H450-R456 PolarHBondContact O-NE 3.43Å; H450-R456 VanDerWaalsContact O-NE 3.12Å
451P76.9Confident67.1Low81 Ų81103.1 Ų103.153%0.52656%0.564SS.*THydrogen-bonded Turntrans-65.3-22.9179.826.3-34.3000113.5
452F75.8Confident68.2Low191 Ų19196 Ų9684%0.83853%0.534SS*.THydrogen-bonded Turntrans-103.414.2176.4-54.6-66.2000113.4H450 I454H450-F452 PolarHBondContact O-N 3.43Å; F452-I454 PolarHBondContact O-N 3.4Å
453S78.7Confident68.8Low14 Ų1495.7 Ų95.710%0.09852%0.522CS..  trans-69.1131.5178.9-167.80000111.1P447 S448 H450 N455 R456P447-S453 VanDerWaalsContact O-CB 3.26Å; P447-S453 WeakPolarHBondContact O-CB 3.19Å; P447-S453 PolarHBondContact O-OG 2.76Å; S448-S453 WeakPolarHBondContact CA-OG 3.33Å; S448-S453 WeakPolarHBondContact O-CB 3.24Å; H450-S453 WeakPolarHBondContact O-CB 3.45Å; H450-S453 PolarHBondContact O-N 3.38Å; H450-S453 VanDerWaalsContact O-N 3.12Å; S453-N455 PolarHBondContact O-N 3Å; S453-N455 VanDerWaalsContact O-N 3.13Å; S453-R456 WeakPolarHBondContact O-CB 3.24Å; S453-R456 PolarHBondContact O-N 2.83Å
454I78.4Confident69.2Low116 Ų11692.4 Ų92.460%0.59550%0.502SS*.G310 helixtrans-62.2-24.3-177.9-158.4159.9000112.3F452 R456 L457 L458F452-I454 PolarHBondContact O-N 3.4Å; I454-R456 PolarHBondContact O-N 3.37Å; I454-R456 VanDerWaalsContact O-N 3.13Å; I454-L457 PolarHBondContact O-N 3Å; I454-L458 PolarHBondContact O-N 3.14Å
455N77.7Confident69.5Low70 Ų7095 Ų9537%0.37450%0.503SS..G310 helixtrans-68-6.6173.8-61.933.4000113.6S453 K463S453-N455 PolarHBondContact O-N 3Å; S453-N455 VanDerWaalsContact O-N 3.13Å; N455-K463 PolarHBondContact O-NZ 3.5Å
456R73.7Confident70Confident156 Ų15691.8 Ų91.859%0.58950%0.496SS*.G310 helixtrans-98.1-16.1166.7-65.5-175.5-179.8-103.57.9113.6S449 H450 S453 I454S449-R456 PolarHBondContact O-NE 2.96Å; S449-R456 PolarHBondContact O-NH2 3.25Å; H450-R456 WeakPolarHBondContact O-CD 3.49Å; H450-R456 PolarHBondContact O-NE 3.43Å; H450-R456 VanDerWaalsContact O-NE 3.12Å; S453-R456 WeakPolarHBondContact O-CB 3.24Å; S453-R456 PolarHBondContact O-N 2.83Å; I454-R456 PolarHBondContact O-N 3.37Å; I454-R456 VanDerWaalsContact O-N 3.13Å
457L72.5Confident69.8Low134 Ų13496 Ų9670%0.70251%0.509SS*.THydrogen-bonded Turntrans-94.8-18-176.9-61.7176.4000113.1I454I454-L457 PolarHBondContact O-N 3Å
458L73.5Confident69.8Low64 Ų6497.2 Ų97.234%0.33551%0.506SS..SBendtrans-77.5129.7176.3-73.7169.7000111.4I454 I466I454-L458 PolarHBondContact O-N 3.14Å; L458-I466 HydrophobicContact CD1-CD1 4.49Å
459P70.9Confident69.4Low77 Ų77102 Ų10250%0.552%0.516SS..  trans-55.6150.1172.3-25.935.5000112.7E461 S462 K463P459-E461 VanDerWaalsContact C-N 3.26Å; P459-E461 HydrophobicContact CB-CG 4.47Å; P459-E461 WeakPolarHBondContact CB-OE1 3.42Å; P459-E461 PolarHBondContact O-N 2.99Å; P459-S462 PolarHBondContact O-N 3.15Å; P459-S462 VanDerWaalsContact O-N 3.14Å; P459-S462 PolarHBondContact O-OG 3.36Å; P459-K463 PolarHBondContact O-N 2.81Å
460T66.1Low69Low127 Ų127105.5 Ų105.578%0.77953%0.532SS*.THydrogen-bonded Turntrans-60.9-31-170.834.70000113.9K463T460-K463 WeakPolarHBondContact O-CB 3.38Å; T460-K463 PolarHBondContact O-N 2.66Å
461E61.7Low68.3Low138 Ų138107.1 Ų107.165%0.64554%0.541SS*.THydrogen-bonded Turntrans-62.4-49.6174.552.5-92.781.100112P459 K463 A464P459-E461 VanDerWaalsContact C-N 3.26Å; P459-E461 HydrophobicContact CB-CG 4.47Å; P459-E461 WeakPolarHBondContact CB-OE1 3.42Å; P459-E461 PolarHBondContact O-N 2.99Å; E461-K463 PolarHBondContact O-N 3.12Å; E461-A464 PolarHBondContact O-N 3Å; E461-A464 VanDerWaalsContact O-N 3.1Å
462S63.1Low67.6Low27 Ų27106.6 Ų106.619%0.18954%0.54CS..Hα-helixtrans-62.9-19.1-178.667.60000113.7P459 A464 D465 I466P459-S462 PolarHBondContact O-N 3.15Å; P459-S462 VanDerWaalsContact O-N 3.14Å; P459-S462 PolarHBondContact O-OG 3.36Å; S462-A464 PolarHBondContact O-N 2.83Å; S462-D465 PolarHBondContact O-N 2.65Å; S462-I466 WeakPolarHBondContact O-CD1 3.41Å; S462-I466 PolarHBondContact O-N 3.23Å; S462-I466 VanDerWaalsContact O-N 3.09Å
463K59.5Low66.8Low101 Ų101102.2 Ų102.244%0.43952%0.522SS..Hα-helixtrans-73.2-15.7179.6-154.7161.8-177.51650113.2N455 P459 T460 E461N455-K463 PolarHBondContact O-NZ 3.5Å; P459-K463 PolarHBondContact O-N 2.81Å; T460-K463 WeakPolarHBondContact O-CB 3.38Å; T460-K463 PolarHBondContact O-N 2.66Å; E461-K463 PolarHBondContact O-N 3.12Å
464A63.6Low65.7Low62 Ų62110.1 Ų110.151%0.51255%0.551SS.*Hα-helixtrans-79.5-48.816800000111.3E461 S462 I466 K467 M468E461-A464 PolarHBondContact O-N 3Å; E461-A464 VanDerWaalsContact O-N 3.1Å; S462-A464 PolarHBondContact O-N 2.83Å; A464-I466 PolarHBondContact O-N 3.04Å; A464-K467 WeakPolarHBondContact O-CB 3.46Å; A464-K467 PolarHBondContact O-N 2.97Å; A464-K467 VanDerWaalsContact O-N 3.08Å; A464-M468 PolarHBondContact O-N 3.39Å
465D61.7Low64.6Low110 Ų110108.5 Ų108.559%0.58856%0.555SS**Hα-helixtrans-58.3-44.3178.5-83.1-58000112.8S462 K467 M468 Y469S462-D465 PolarHBondContact O-N 2.65Å; D465-K467 PolarHBondContact O-N 3.3Å; D465-M468 WeakPolarHBondContact O-CB 3.38Å; D465-M468 PolarHBondContact O-N 2.92Å; D465-M468 VanDerWaalsContact O-N 3.15Å; D465-Y469 PolarHBondContact O-N 3.4Å
466I63.3Low63.2Low89 Ų89108 Ų10846%0.45657%0.566SS.*Hα-helixtrans-58.3-36.9177-88.771.9000111.3L458 S462 A464 D470L458-I466 HydrophobicContact CD1-CD1 4.49Å; S462-I466 WeakPolarHBondContact O-CD1 3.41Å; S462-I466 PolarHBondContact O-N 3.23Å; S462-I466 VanDerWaalsContact O-N 3.09Å; A464-I466 PolarHBondContact O-N 3.04Å; I466-D470 WeakPolarHBondContact O-CB 3.38Å; I466-D470 PolarHBondContact O-N 3.36Å; I466-D470 VanDerWaalsContact O-N 3.09Å
467K64.6Low61.9Low154 Ų154110.1 Ų110.167%0.6758%0.575SS**Hα-helixtrans-73.6-37.5176.5-80.7-171.4168.2-168.20113.2A464 D465 Y469 M471A464-K467 WeakPolarHBondContact O-CB 3.46Å; A464-K467 PolarHBondContact O-N 2.97Å; A464-K467 VanDerWaalsContact O-N 3.08Å; D465-K467 PolarHBondContact O-N 3.3Å; K467-Y469 VanDerWaalsContact C-N 3.3Å; K467-M471 PolarHBondContact O-N 3.4Å; K467-M471 VanDerWaalsContact O-N 3.07Å
468M65.9Low60.7Low140 Ų140111.3 Ų111.369%0.6958%0.582SS**Hα-helixtrans-60.9-41.3172.5-80-84-78.500111.2A464 D465 S472A464-M468 PolarHBondContact O-N 3.39Å; D465-M468 WeakPolarHBondContact O-CB 3.38Å; D465-M468 PolarHBondContact O-N 2.92Å; D465-M468 VanDerWaalsContact O-N 3.15Å; M468-S472 WeakPolarHBondContact O-CB 3.45Å; M468-S472 PolarHBondContact O-N 3.47Å; M468-S472 PolarHBondContact O-OG 3.1Å
469Y61.8Low59.5Low162 Ų162112.4 Ų112.464%0.63560%0.601SS**Hα-helixtrans-69.1-42.5178.9-137.1-90.6000112.5D465 K467 S472 Q473D465-Y469 PolarHBondContact O-N 3.4Å; K467-Y469 VanDerWaalsContact C-N 3.3Å; Y469-S472 WeakPolarHBondContact CA-OG 3.07Å; Y469-S472 PolarHBondContact O-OG 3.05Å; Y469-S472 VanDerWaalsContact O-OG 3.12Å; Y469-Q473 HydrophobicContact CD1-CG 4.26Å; Y469-Q473 HydrophobicContact CE1-CG 4.44Å; Y469-Q473 VanDerWaalsContact O-CG 3.26Å; Y469-Q473 WeakPolarHBondContact O-CG 3.47Å; Y469-Q473 PolarHBondContact O-N 3.2Å
470D64.8Low58.1Low104 Ų104116.3 Ų116.356%0.55662%0.617SS**Hα-helixtrans-65.8-43.4178.9-162.532.3000112I466 Y474I466-D470 WeakPolarHBondContact O-CB 3.38Å; I466-D470 PolarHBondContact O-N 3.36Å; I466-D470 VanDerWaalsContact O-N 3.09Å; D470-Y474 PolarHBondContact O-N 2.82Å
471M60.3Low56.9Low133 Ų133116 Ų11666%0.65562%0.619SS**Hα-helixtrans-69.6-37.3177.2-81.5-87.375.500113.9K467 Y474 A475K467-M471 PolarHBondContact O-N 3.4Å; K467-M471 VanDerWaalsContact O-N 3.07Å; M471-Y474 PolarHBondContact O-N 3.35Å; M471-A475 PolarHBondContact O-N 3.23Å; M471-A475 VanDerWaalsContact O-N 3.14Å
472S61.7Low56.1Low70 Ų70115.9 Ų115.949%0.4963%0.631SS.*Hα-helixtrans-69.4-33.9178.951.20000112.8M468 Y469M468-S472 WeakPolarHBondContact O-CB 3.45Å; M468-S472 PolarHBondContact O-N 3.47Å; M468-S472 PolarHBondContact O-OG 3.1Å; Y469-S472 WeakPolarHBondContact CA-OG 3.07Å; Y469-S472 PolarHBondContact O-OG 3.05Å; Y469-S472 VanDerWaalsContact O-OG 3.12Å
473Q59.4Low54.8Low99 Ų99122.8 Ų122.846%0.46366%0.664SS.*Hα-helixtrans-68-39.3174.4-67.4-67.7-16.800112.3Y469 G476Y469-Q473 HydrophobicContact CD1-CG 4.26Å; Y469-Q473 HydrophobicContact CE1-CG 4.44Å; Y469-Q473 VanDerWaalsContact O-CG 3.26Å; Y469-Q473 WeakPolarHBondContact O-CG 3.47Å; Y469-Q473 PolarHBondContact O-N 3.2Å; Q473-G476 PolarHBondContact O-N 3.24Å
474Y54.8Low53.9Low179 Ų179124.2 Ų124.270%0.70268%0.682SS**Hα-helixtrans-72.5-28.9177.8-101.4-81.3000114.2D470 M471 G476D470-Y474 PolarHBondContact O-N 2.82Å; M471-Y474 PolarHBondContact O-N 3.35Å; Y474-G476 VanDerWaalsContact C-N 3.3Å; Y474-G476 PolarHBondContact O-N 3.25Å
475A55.6Low52.6Low82 Ų82128.7 Ų128.768%0.67870%0.697SS**Hα-helixtrans-67-29175.700000113.2M471M471-A475 PolarHBondContact O-N 3.23Å; M471-A475 VanDerWaalsContact O-N 3.14Å
476G49.8Very low51.6Low59 Ų59128 Ų12861%0.60870%0.701SS**Hα-helixtrans-77.2-21.8-172.600000116.2Q473 Y474Q473-G476 PolarHBondContact O-N 3.24Å; Y474-G476 VanDerWaalsContact C-N 3.3Å; Y474-G476 PolarHBondContact O-N 3.25Å
477Y45.9Very low50.3Low201 Ų201132.7 Ų132.779%0.78872%0.721SS**SBendtrans-96.5-12.1-169.3-90.5-84.6000115.7A479Y477-A479 VanDerWaalsContact C-N 3.29Å; Y477-A479 PolarHBondContact O-N 2.67Å
478N47.7Very low49.1Very low159 Ų159129.5 Ų129.585%0.8572%0.723SS**THydrogen-bonded Turntrans-89.219.4-165.7-140.228.6000114.8
479A47.5Very low47.8Very low87 Ų87127.1 Ų127.172%0.71973%0.725SS**THydrogen-bonded Turntrans-107.3-1.8-168.700000115.2Y477Y477-A479 VanDerWaalsContact C-N 3.29Å; Y477-A479 PolarHBondContact O-N 2.67Å
480L41.7Very low46.8Very low160 Ų160127.8 Ų127.884%0.83874%0.739SS**  trans-134.1106.7-175.3-66.8174.1000111.9
481S40.6Very low45.6Very low119 Ų119125.9 Ų125.983%0.83274%0.744SS**  trans-154.9113.4169.1-77.20000110
482P44Very low44.7Very low136 Ų136128.4 Ų128.488%0.88375%0.754SS**  trans-72.1156.2179.8-20.133.7000114.2
483L37.2Very low43.7Very low172 Ų172131.4 Ų131.490%0.90177%0.765SS**  trans-88.6137.4179.2-72.3156.4000113.1
484T40.1Very low42.9Very low132 Ų132130.7 Ų130.781%0.8177%0.771SS**  trans-145.7110.7156.156.50000108.3
485N36.9Very low42.3Very low155 Ų155131.8 Ų131.883%0.82978%0.775SS**  51.4130.995.8-10718.2000115.1
486S39.5Very low41.6Very low96 Ų96137.8 Ų137.867%0.67178%0.782SS**  cis-167.2141.70.414.20000114.6
487H36.8Very low41.4Very low188 Ų188143.2 Ų143.287%0.8779%0.791SS**  trans71.3150.9135.2-152.5-96.8000123.2
488A38.3Very low41.2Very low87 Ų87138.6 Ų138.672%0.71979%0.788SS**  trans71.7136.5175.200000117.1
489A39.1Very low41.1Very low89 Ų89138.1 Ų138.174%0.73679%0.785SS**  cis-150.2159.9-1.800000113.6
490L41Very low40.8Very low177 Ų177136.7 Ų136.793%0.92778%0.779SS**  trans11.6138.3150.1-53.8169000119.5
491G39.9Very low40.9Very low64 Ų64139.2 Ų139.266%0.6678%0.779SS**  cis170.4-166.12.900000112.5
492Q40.9Very low41.1Very low185 Ų185141.8 Ų141.886%0.86478%0.777SS**  trans67.8149.6-174-48.9-151.5-84.800114.8
493D40.7Very low41.2Very low133 Ų133139.1 Ų139.171%0.71177%0.767SS**  cis164.5150.8-17.5-88.2-46.9000102.9
494S44Very low42.1Very low85 Ų85136.4 Ų136.459%0.59476%0.76SS**  cis-167.6177.7-21-171.40000108.7
495Y40.3Very low42.5Very low201 Ų201135.1 Ų135.179%0.78876%0.762SS**  trans70.5131.9177.3-55.5-85.2000117
496Y41.8Very low43.2Very low209 Ų209131.1 Ų131.182%0.8276%0.758SS**  66.7142.253.9-80.9-78.6000113.9
497Q45.1Very low43.8Very low172 Ų172133.6 Ų133.680%0.80477%0.769SS**  cis-125-130.210.6-165.8144.5-4.700115.6
498S41.9Very low44.7Very low104 Ų104131.3 Ų131.373%0.72777%0.768SS**  trans-169.7-172.1-153.9-165.20000115.2
499L46.2Very low45.6Very low149 Ų149132.4 Ų132.478%0.7877%0.771SS**  trans86.6145.3179.3-53.2172.2000115.9
500G41.9Very low46.3Very low58 Ų58140.1 Ų140.160%0.59880%0.799SS**  cis168.1167.3-8.200000113
501Y43.8Very low46.6Very low213 Ų213138.3 Ų138.384%0.83579%0.792SS**  trans51.5138.4165.5-51.5-86.5000118.3
502H44.2Very low46.9Very low172 Ų172142.2 Ų142.280%0.79680%0.799SS**  cis-170.216347.8-145.8-72.8000111
503A46.1Very low47.3Very low81 Ų81139.8 Ų139.867%0.66980%0.796SS**  trans-136.9158.1158.200000108.4
504P55.1Low47.7Very low114 Ų114140.2 Ų140.274%0.7480%0.801SS**  -161.6167.210041.9-22.2000118.7
505A49.3Very low47.9Very low105 Ų105143.7 Ų143.787%0.86881%0.813SS**  trans55.7144.8136.600000125.2
506G51Low48.4Very low71 Ų71139.9 Ų139.973%0.73282%0.815SS**  trans109.4142.7155.200000115.9
507T51.7Low48.9Very low149 Ų149134.9 Ų134.991%0.91482%0.815SS**  cis-154.6163.7-11.141.60000110
508T55.7Low49.2Very low139 Ų139132.1 Ų132.185%0.85382%0.816SS**  trans-93.5147-179.352.40000114.5
509S57.5Low49.8Very low111 Ų111134.4 Ų134.478%0.77682%0.823SS**  trans-168.8141.1147.5600000113.7
510L54.7Low50.1Low251 Ų251133.1 Ų133.1100%1.31483%0.827SS**  trans78.60178.1-63.1170.9000116.4

Retrieved 510 of 510 residues in 86 ms (Link to these results)