A0A087XX41_POEFO Loading...

GATA binding protein 6

AlphaFold DB , UniProt , Accession A0A087XX41, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 491 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M32.1Very low34.1Very low235 Ų235152.5 Ų152.5100%1.15882%0.824SS**  0131.60-55.2165-177.700107.4
2D33.1Very low34Very low137 Ų137153 Ų15373%0.73381%0.813SS**  cis-168.2151.9-35.4-137.8-48.5000107.6
3L36.8Very low33.9Very low167 Ų167159.5 Ų159.587%0.87482%0.819SS**  trans59.6156.4172.7-46.2177.2000116.2
4G34.4Very low33.5Very low65 Ų65157.9 Ų157.967%0.6781%0.806SS**  cis-170.9147.9-8.900000113.1
5E38Very low33.4Very low173 Ų173154.9 Ų154.981%0.80880%0.798SS**  trans30.6114.5137.8-59-160.1111.200119.9
6N40.2Very low33.2Very low150 Ų150153 Ų15380%0.80280%0.803SS**  90.6111.274.9-77.2-26.4000115
7S31.4Very low33.2Very low99 Ų99149.8 Ų149.869%0.69280%0.796SS**  trans-165.4144.5150.4-152.90000107.1
8W30.7Very low33.2Very low226 Ų226147.8 Ų147.886%0.85680%0.796SS**  cis-139.8134.728.1-8273.1000113.8
9S34.3Very low33.8Very low101 Ų101146.8 Ų146.871%0.70680%0.798SS**  trans46.4139.8130.973.20000124.2
10M32Very low33.7Very low182 Ų182143.4 Ų143.490%0.89780%0.799SS**  trans-76156.5170.7-64.1177.8167.200114.6
11V32.5Very low33.7Very low143 Ų143142.1 Ų142.187%0.86780%0.799SS**  trans-125.3130.31431740000109.3
12K32.9Very low34.4Very low158 Ų158137.4 Ų137.469%0.68779%0.786SS**  trans-93.7150.2-175.8-163.8-172-170.8-155.30110.5E14K12-E14 VanDerWaalsContact CD-OE1 3.28Å; K12-E14 WeakPolarHBondContact CD-OE1 3.28Å; K12-E14 WeakPolarHBondContact CE-OE1 3.02Å; K12-E14 IonicContact NZ-OE1 2.67Å; K12-E14 PolarHBondContact NZ-OE1 3.21Å; K12-E14 IonicContact NZ-OE2 3.64Å
13R31.8Very low34.5Very low237 Ų237135.1 Ų135.189%0.89479%0.787SS**  trans-140.2136.7159.6-166.1166.3-73.9143-2.4109.9
14E29.4Very low34.4Very low137 Ų137135.1 Ų135.164%0.6478%0.782SS**  trans-80.4167-164.4-66.7-68.6139.700114.3K12K12-E14 VanDerWaalsContact CD-OE1 3.28Å; K12-E14 WeakPolarHBondContact CD-OE1 3.28Å; K12-E14 WeakPolarHBondContact CE-OE1 3.02Å; K12-E14 IonicContact NZ-OE1 2.67Å; K12-E14 PolarHBondContact NZ-OE1 3.21Å; K12-E14 IonicContact NZ-OE2 3.64Å
15V31.8Very low34.2Very low114 Ų114140.8 Ų140.869%0.69179%0.791SS**  trans-95.5158.1175.2174.70000110.3
16S29.8Very low33.9Very low124 Ų124137.5 Ų137.587%0.86779%0.787SS**  trans-142.2148.3162.2-68.70000109.5
17S33.8Very low33.4Very low98 Ų98140.4 Ų140.469%0.68579%0.789SS**  trans-140.8161.5-155.4-58.70000113.9
18S32.2Very low33.6Very low115 Ų115143.8 Ų143.880%0.80480%0.798SS**  trans72.8163.4162-700000117.8
19P45.7Very low34.3Very low128 Ų128138.9 Ų138.983%0.83180%0.795SS**  cis-132.7175.5-17.629.7-9.6000115.2
20G30.8Very low34.1Very low79 Ų79138 Ų13881%0.81480%0.802SS**  trans111.9120.8135.300000119.2
21S33.9Very low34.1Very low116 Ų116136.5 Ų136.581%0.81180%0.798SS**  trans-105.6168.1156.9-53.90000109.9
22P47.2Very low34.2Very low136 Ų136134.4 Ų134.488%0.88379%0.789SS**  -130.7-171.3113.638.2-31.1000112.7
23A34.3Very low34Very low90 Ų90133 Ų13374%0.74480%0.8SS**  trans-144.5178.9-166.100000113.3
24E34.4Very low34.3Very low167 Ų167133 Ų13378%0.7880%0.799SS**  trans64.6124.3160.1-64.2-86.888.800118.6
25Q31.7Very low34.6Very low184 Ų184136.8 Ų136.886%0.8681%0.808SS**  trans-156135.5139.6-126.4163.571.100112.6
26S31.4Very low34.7Very low103 Ų103138.4 Ų138.472%0.7281%0.813SS**  trans-97.3152.7-171.8-52.40000112.2
27Y29.5Very low34.7Very low212 Ų212136 Ų13683%0.83181%0.807SS**  trans-128.9128.7170-89.3-90.9000111.8
28L34.6Very low35.3Very low170 Ų170137.7 Ų137.789%0.8982%0.816SS**  trans-139.8160.3164.1-82.2-176.6000108.6
29P46.9Very low35.7Very low123 Ų123138.6 Ų138.680%0.79982%0.817SS**  trans-91.8160.6-149.735-37.4000115.5
30G30Very low35.8Very low82 Ų82138 Ų13885%0.84581%0.813SS**  trans-114.8154.516200000111.2
31D32.5Very low36.9Very low151 Ų151140 Ų14081%0.80781%0.811SS**  trans-125.9159.5-172-161.9-33.1000110.8
32S32.7Very low37Very low99 Ų99140.3 Ų140.369%0.69281%0.814SS**  trans66.3107.5154.4-73.50000120.4
33S30.5Very low36.4Very low129 Ų129143.3 Ų143.390%0.90282%0.816SS**  -161.6156.3118-88.50000113.6
34R37.6Very low36.5Very low235 Ų235146.4 Ų146.489%0.88782%0.819SS**  trans-103152179.2-58.4176.2177.3-172.1-1.4111.8
35R34.5Very low36.4Very low218 Ų218145.8 Ų145.882%0.82382%0.821SS**  trans-176.9113.9142.2-96.9148.4-163-69.98.8106.9
36D34Very low36.6Very low148 Ų148140.5 Ų140.579%0.79181%0.809SS**  77.8118.492.2-65.5-27.3000112.3
37G30.2Very low36.9Very low72 Ų72144.4 Ų144.474%0.74282%0.821SS**  trans-142.2144.6175.900000110.7
38P46.9Very low37Very low134 Ų134137.4 Ų137.487%0.8781%0.813SS**  trans-86.9148.3-171.333.8-35.3000114.1
39T40.2Very low37.1Very low134 Ų134138.9 Ų138.982%0.82282%0.815SS**  trans-89.2161.8160.554.70000110.1
40P48.9Very low36.5Very low117 Ų117143.5 Ų143.576%0.7682%0.817SS**  -153.8-168.297.140.5-21.9000113.3
41P53.5Low36.9Very low120 Ų120150 Ų15078%0.77982%0.816SS**  cis-120.5-169.3-45.732.1-15.1000111.5
42S34.8Very low38.1Very low123 Ų123146.6 Ų146.686%0.8680%0.801SS**  trans-126.8144.6164.9-53.50000109.6
43E35.1Very low38.2Very low198 Ų198149.7 Ų149.793%0.92581%0.81SS**  trans-98.5152.1167.8-78.5-165.8119.800111.4
44L36.9Very low38.3Very low156 Ų156146.7 Ų146.782%0.81780%0.8SS**  trans-155.1118.8-177.6-133.8177.8000108.3
45D32.4Very low38.1Very low153 Ų153147.9 Ų147.982%0.81880%0.804SS**  trans162.7166.9140.8-89.6-16.2000112.1
46A35.8Very low38Very low73 Ų73142.8 Ų142.860%0.60380%0.802SS**  cis176.390.8-48.400000110.4
47L37.2Very low38Very low185 Ų185143.5 Ų143.597%0.96981%0.805SS**  trans-152132.2163.7-68.3178.5000109
48G32Very low38.3Very low65 Ų65147.8 Ų147.867%0.6781%0.805SS**  cis140.8109.4-17.900000113.7
49H36.6Very low38.4Very low201 Ų201147.1 Ų147.193%0.93180%0.801SS**  trans-162.9156.7161.1-107.335.1000113.2
50R34.5Very low38.2Very low221 Ų221150 Ų15083%0.83480%0.798SS**  trans-95.8171.3171.4-76.1-179.1170.1-107.19109.4
51R38.1Very low37.5Very low219 Ų219152.5 Ų152.583%0.82680%0.804SS**  cis-156.1177.742.1-115.1-155.6158.5-110.1-0112.6
52P58.3Low36.7Very low78 Ų78154.5 Ų154.551%0.50680%0.803SS.*  trans-106.3170-162.942.3-38.4000115.8
53D34.9Very low36.5Very low164 Ų164158.6 Ų158.688%0.87781%0.806SS**  173.8152.2129.9-84.2-20.6000108.3
54G31.3Very low36.3Very low66 Ų66152.1 Ų152.168%0.6879%0.792SS**  cis171.3165.1-9.300000112.1
55R33.3Very low36.3Very low261 Ų261153.4 Ų153.499%0.98579%0.793SS**  trans81.2166.3170.6-53.3-176.4-179.7-174.2-0.4118.2
56S32.8Very low36.4Very low110 Ų110155.1 Ų155.177%0.76980%0.796SS**  trans-167.3-176.8-155.6-174.20000111.4
57L33.7Very low36.3Very low163 Ų163155.2 Ų155.285%0.85380%0.804SS**  trans100.6123.2161.7-55-179.7000119.8
58H37Very low36.4Very low162 Ų162154.7 Ų154.775%0.7580%0.802SS**  trans-70.8164.1154.1-142.8-127.3000109.3
59P49.3Very low36.6Very low121 Ų121156 Ų15679%0.78681%0.807SS**  -153.7179.187.240.3-20.8000117.4
60Y35.7Very low36.8Very low193 Ų193151.1 Ų151.176%0.75780%0.801SS**  trans-73.3159.6172.3-130.3-115.2000113.3
61L33.5Very low36.8Very low171 Ų171147.5 Ų147.590%0.89580%0.804SS**  -179.4-171.5129.4-98.4170.3000114.5
62H37Very low37Very low161 Ų161142.2 Ų142.275%0.74581%0.807SS**  trans-151149.9-144.9-172.481.5000115
63F31.6Very low36Very low210 Ų210141.9 Ų141.992%0.92182%0.818SS**  trans-163.6174.5173.5-93.1-68.3000109.9
64G30Very low36.9Very low62 Ų62142.6 Ų142.664%0.63982%0.816SS**  cis-174.7-166.66.300000112.1
65H36.6Very low37.2Very low182 Ų182146.9 Ų146.984%0.84382%0.824SS**  trans-150.7176.9-172.7-112.1-22.9000116.5
66H36.3Very low37.6Very low190 Ų190141 Ų14188%0.8881%0.81SS**  trans79.2148.6175.8-48.6-84.9000118.2
67G33.7Very low38.9Very low75 Ų75140.5 Ų140.577%0.77380%0.804SS**  cis161139.5-18.700000118
68N38.1Very low39.3Very low174 Ų174139.5 Ų139.593%0.9380%0.799SS**  trans90.7158.7150.9-151.823.1000123.9
69A36.1Very low39.5Very low93 Ų93140.4 Ų140.477%0.76980%0.801SS**  trans91.4148.6162.100000122.1
70A40.3Very low39.4Very low98 Ų98140.2 Ų140.281%0.8180%0.798SS**  trans-165.6162.7-175.400000114.2
71T36.3Very low39.4Very low144 Ų144137 Ų13788%0.88379%0.793SS**  trans-162.1138.816841.20000115.5
72A41Very low40.3Very low108 Ų108135.5 Ų135.589%0.89379%0.786SS**  trans30.8155.114200000123.7
73G38.4Very low40.6Very low72 Ų72133.5 Ų133.574%0.74278%0.781SS**  cis-167.6-164.69.100000114.8
74E52.8Low41.2Very low179 Ų179131.5 Ų131.584%0.83677%0.774SS**  trans-83.6175.6-157.1-46.7-177.499.800114.7
75D37.3Very low41.6Very low156 Ų156130.7 Ų130.783%0.83477%0.765SS**  -157.5167.869.1-118.4-44.4000116.1
76I41.5Very low41.9Very low138 Ų138127.6 Ų127.671%0.70876%0.764SS**  trans-143.8158.2-159.1-90.8173.8000110.1
77P61.7Low42.1Very low98 Ų98127.5 Ų127.564%0.63676%0.761SS**  cis-119.5-130.81832.8-8.7000113.2
78L40.9Very low42.7Very low143 Ų143131.4 Ų131.475%0.74976%0.764SS**  cis-128-130.430.2-99.7170.3000114.6
79F41Very low42.7Very low180 Ų180129.8 Ų129.879%0.78976%0.76SS**  trans-158.2163.3-142.9-79.3166.9000112.4
80T47Very low42.6Very low117 Ų117132.8 Ų132.872%0.71876%0.762SS**  cis-127-148.6-13.251.70000108.6
81D36.1Very low42.3Very low125 Ų125133.9 Ų133.967%0.66876%0.764SS**  cis-152.2125.94.8-136.4-114.9000107.3
82L53.5Low42.3Very low140 Ų140131.7 Ų131.773%0.73376%0.761SS**  71.8123.988.3-123.771.5000114.8
83D41.9Very low41.7Very low119 Ų119129.9 Ų129.964%0.63675%0.752SS**  cis-153.7168.44.3-142.919.3000110.4
84Q44.8Very low41.5Very low169 Ų169130.8 Ų130.879%0.7975%0.753SS**  cis-134.9-115.3-0.7-161.2177.3101.100112.1
85G39.3Very low40.6Very low44 Ų44130.7 Ų130.745%0.45475%0.752SS.*  cis-158.2-48.98.300000114.8
86S41.3Very low40.4Very low117 Ų117133.1 Ų133.182%0.81876%0.755SS**  trans69.5171.7172.182.60000116.9
87K40.6Very low39.8Very low188 Ų188131 Ų13182%0.81776%0.758SS**  cis-154.21708.5-150.6171.7-179.6175.90113
88L46.1Very low38.6Very low158 Ų158131.7 Ų131.783%0.82777%0.766SS**  trans-118.8169.6172.6-64.5168.5000111.4
89V37.9Very low38.2Very low139 Ų139132.6 Ų132.684%0.84277%0.77SS**  trans-179.2165.6142.3139.40000112.8
90L35.9Very low38.1Very low156 Ų156131.9 Ų131.982%0.81777%0.774SS**  trans-109.3-175-177.2-6289.8000111
91S33.7Very low37.5Very low121 Ų121133.1 Ų133.185%0.84678%0.781SS**  cis-158.2-16019.5-162.10000112.5
92A35.6Very low37.6Very low99 Ų99133.7 Ų133.782%0.81878%0.784SS**  trans-121.9157.9-16600000116.6
93G28.1Very low37.1Very low70 Ų70132.8 Ų132.872%0.72279%0.787SS**  trans159.594.7158.700000119.6
94A34Very low37.4Very low91 Ų91130.7 Ų130.775%0.75279%0.786SS**  trans61.6167.7160.900000118
95H34.2Very low37.4Very low176 Ų176130.1 Ų130.182%0.81579%0.788SS**  cis-145.916212.7-38.9-105.3000113.9
96K32.7Very low38.1Very low207 Ų207135.5 Ų135.590%0.980%0.803SS**  trans54.4128.4151.9-78.6-172.6175.2-178.60123.1
97A30.5Very low38.2Very low93 Ų93139.8 Ų139.877%0.76980%0.803SS**  trans84.7100.6136.400000121.8
98S35.4Very low38.6Very low114 Ų114138.4 Ų138.480%0.79780%0.8SS**  45.8120.9129.2-172.60000121.3
99L33Very low38.5Very low162 Ų162137.3 Ų137.385%0.84880%0.799SS**  -151.8172.2120.1-107.1173.4000110.8
100L37.9Very low38.8Very low165 Ų165139.1 Ų139.186%0.86480%0.804SS**  trans-78.3155.9-169.1-69.6153.9000113.5
101V35.6Very low39.2Very low143 Ų143135.7 Ų135.787%0.86780%0.798SS**  trans-114.9130.1167.6177.50000108.4
102D38.1Very low39.4Very low137 Ų137138.2 Ų138.273%0.73380%0.8SS**  trans-99.4134.2-175.6-162.88.9000110.8A104D102-A104 VanDerWaalsContact C-N 3.27Å; D102-A104 PolarHBondContact O-N 2.63Å
103P42.7Very low39.4Very low121 Ų121138.6 Ų138.679%0.78680%0.803SS**THydrogen-bonded Turntrans-7611.9-167.2-20.235.2000118
104A47.3Very low39.7Very low75 Ų75140.1 Ų140.162%0.6281%0.809SS**THydrogen-bonded Turntrans-78.9-37.5-16200000116.4D102 M106D102-A104 VanDerWaalsContact C-N 3.27Å; D102-A104 PolarHBondContact O-N 2.63Å; A104-M106 PolarHBondContact O-N 3.16Å
105D46.5Very low39.8Very low156 Ų156139.8 Ų139.883%0.83481%0.806SS**G310 helixtrans-79-3.4-159.7-86.2-29.9000116.8Y107D105-Y107 VanDerWaalsContact C-N 3.3Å; D105-Y107 PolarHBondContact O-N 2.83Å
106M52.6Low39.8Very low158 Ų158140.2 Ų140.278%0.77881%0.808SS**G310 helixtrans-82.15.3-169.1-144.2-170.273.900115.7A104A104-M106 PolarHBondContact O-N 3.16Å
107Y44.6Very low39.8Very low206 Ų206135 Ų13581%0.80880%0.798SS**G310 helixtrans-131.910.5-169.6-93.3-76.8000116.9D105D105-Y107 VanDerWaalsContact C-N 3.3Å; D105-Y107 PolarHBondContact O-N 2.83Å
108Q47.8Very low39.9Very low160 Ų160139.5 Ų139.575%0.74880%0.803SS**SBendtrans-93.22.2-171.1-165.644.880.200115.9
109T44.8Very low39.9Very low134 Ų134141.3 Ų141.382%0.82281%0.809SS**SBendtrans-121.646.4-168.2-36.20000114.6
110L44.7Very low39.8Very low178 Ų178136.2 Ų136.293%0.93280%0.796SS**SBendtrans-15044.2170.4-146.475.5000115.3
111A43.4Very low39.5Very low84 Ų84139.4 Ų139.469%0.69480%0.798SS**  trans-144.3163.1170.400000111.4
112I37.9Very low39.2Very low174 Ų174139.5 Ų139.589%0.89279%0.793SS**  trans71.684.5176.7-44.8171.9000115.1
113A35.2Very low38.9Very low106 Ų106137.8 Ų137.888%0.87679%0.792SS**  trans-162.451.5156.900000112.4
114A35.2Very low38.6Very low103 Ų103137.4 Ų137.485%0.85179%0.793SS**  trans-151.674-17600000115
115A36.3Very low37.9Very low83 Ų83140.6 Ų140.669%0.68680%0.804SS**  trans-176.4135.8154.900000112.3
116Q34.7Very low37.5Very low186 Ų186138 Ų13887%0.86981%0.805SS**  trans62150.9145.7-63.7165.5700119.6
117S32.2Very low36.6Very low97 Ų97133.7 Ų133.768%0.67880%0.801SS**  cis-167.8135.5-20.550.80000113.9
118Q32.8Very low36.1Very low187 Ų187134.5 Ų134.587%0.87480%0.804SS**  trans62.6127.4145.3-67.1-171.4-6.100124.7
119T33.7Very low35.8Very low153 Ų153134.1 Ų134.194%0.93980%0.804SS**  trans-171.4162.1146.67.40000107.5
120G31.2Very low35.5Very low54 Ų54135.6 Ų135.656%0.55780%0.801SS**  cis163.2136.3-900000111.1
121Y32.8Very low35Very low232 Ų232132.9 Ų132.991%0.9180%0.797SS**  trans63.9147.3-175.8-64.3-85.7000116.1
122D29.3Very low34.7Very low145 Ų145134.2 Ų134.278%0.77580%0.801SS**  cis-153.6177.1-24.3-158.3-6.8000109.3
123S31.6Very low35.3Very low101 Ų101130.8 Ų130.871%0.70679%0.79SS**  trans-99.2153-169.9-52.80000114.8
124S35.4Very low35.3Very low114 Ų114133.2 Ų133.280%0.79779%0.788SS**  trans-178.9128.3134.6-86.70000116.3
125T33.9Very low35.2Very low141 Ų141133.9 Ų133.987%0.86579%0.787SS**  trans64.8127.8134.5-47.30000122.6
126A37.2Very low36Very low103 Ų103135.4 Ų135.485%0.85179%0.79SS**  trans-69.3166-174.600000118.6
127G33.9Very low36.2Very low66 Ų66133.3 Ų133.368%0.6879%0.789SS**  trans164.9118.2156.100000118.5
128Y33.6Very low36.4Very low224 Ų224138.7 Ų138.788%0.87880%0.796SS**  trans44.3104.8146.6-67.3-84.2000123.7
129M41.3Very low36.8Very low151 Ų151135.6 Ų135.674%0.74479%0.79SS**  62.2137.7113.2-80.5-64.9-17800125.4
130H40.1Very low37.3Very low166 Ų166133.2 Ų133.277%0.76978%0.777SS**  trans91.8139147.8-68.3-51000123.4
131S32.6Very low37.4Very low120 Ų120136.3 Ų136.384%0.83979%0.79SS**  trans84.1111.7153-60.10000121.5
132S37.3Very low37.6Very low112 Ų112130.1 Ų130.178%0.78378%0.781SS**  trans-98.5-172.9158.462.80000109.5
133P51.4Low38Very low102 Ų102134.2 Ų134.266%0.66279%0.785SS**  cis-133.5-161.9-5.542.6-24.7000113.9
134N34Very low38.1Very low157 Ų157135.9 Ų135.984%0.8479%0.791SS**  trans73.5120.5161.5-67.9-3.5000119.9
135S34.2Very low38Very low117 Ų117137.6 Ų137.682%0.81879%0.791SS**  trans-117.7121.8162.2177.40000109.3
136P52.4Low39.2Very low116 Ų116135.3 Ų135.375%0.75378%0.779SS**PPolyproline II helixtrans-87.314417433.3-32.3000112
137V39.8Very low39.1Very low141 Ų141138.3 Ų138.386%0.85578%0.777SS**PPolyproline II helixtrans-70.6137.6179.41760000111.3
138Y36.4Very low39.2Very low210 Ų210142.3 Ų142.382%0.82478%0.782SS**PPolyproline II helixtrans-76.7131.9-177.7-152.8-93.2000112.2
139V41.5Very low39.1Very low123 Ų123136.6 Ų136.675%0.74577%0.774SS**  trans-132.5116.8169.3-179.30000108.4
140P42.4Very low38.7Very low103 Ų103135.5 Ų135.567%0.66978%0.782SS**  trans-83143176.533.3-33.2000111.3
141S34.1Very low38.4Very low118 Ų118135.3 Ų135.383%0.82579%0.785SS**  trans-156.4154170.3-168.60000113
142S36.9Very low38.3Very low102 Ų102134.6 Ų134.671%0.71378%0.78SS**  trans74.2138164.7-162.60000120.4
143R38.3Very low38.1Very low231 Ų231138.5 Ų138.587%0.87278%0.779SS**  trans113.3131.8146.887.6-154.4156.1159.5-5.9115.6
144V33.5Very low37.6Very low137 Ų137138.2 Ų138.283%0.8377%0.771SS**  cis-143.5171.214.7-770000113.4
145N32.5Very low37.7Very low150 Ų150136.6 Ų136.680%0.80276%0.759SS**  trans-104.5-174.1162.8-144.726.3000108.4
146P60.6Low37.6Very low93 Ų93133.5 Ų133.560%0.60474%0.74SS**  cis-134.6-173.4-3.141.9-23000115.2
147M34.9Very low36.8Very low165 Ų165131.8 Ų131.881%0.81374%0.744SS**  165.1128.9122.1-88.5-147.5179.700117.3
148I36.3Very low36.5Very low151 Ų151129 Ų12977%0.77474%0.743SS**  trans55.4141.5153.417.1175.7000126.7
149S29.8Very low37Very low104 Ų104125 Ų12573%0.72775%0.746SS**  trans81.1109.3138.7-66.70000124
150S33.7Very low36.9Very low128 Ų128123.6 Ų123.690%0.89575%0.747SS**  -176.1168.7115.637.50000112.1
151L33.1Very low36.7Very low162 Ų162127.5 Ų127.585%0.84876%0.756SS**  trans-120.7138.2-165.4-80141.1000115
152S30.9Very low36.7Very low104 Ų104126.6 Ų126.673%0.72776%0.757SS**  trans36.3130130.8-48.80000124.5
153Y33.2Very low36.3Very low194 Ų194124.9 Ų124.976%0.76176%0.755SS**  -167.4111.9118.3-145.5-104.9000110.2
154L40.7Very low36.1Very low96 Ų96123.1 Ų123.150%0.50376%0.756SS.*  55.2119.697.4-68.3172.5000115.4
155Q36.7Very low36Very low124 Ų124121 Ų12158%0.57975%0.753SS**  85.5154.162.2-173.9162-66.800111.3V477 A478Q155-V477 PolarHBondContact NE2-O 3.08Å; Q155-A478 CarbonylContact C-O 3.04Å
156A32.2Very low36.1Very low52 Ų52121 Ų12143%0.4376%0.758SS.*  cis-124.1179.6-5.500000111.1A478 S479A156-A478 PolarHBondContact N-O 2.98Å; A156-S479 PolarHBondContact N-OG 2.83Å; A156-S479 VanDerWaalsContact N-OG 3.08Å; A156-S479 PolarHBondContact O-OG 3.07Å
157G35.7Very low34.7Very low80 Ų80122 Ų12283%0.82577%0.767SS**  cis106.5134.511.800000113
158G32.3Very low34.5Very low81 Ų81119.9 Ų119.984%0.83577%0.769SS**  trans156.6124.4171.500000116.6
159S47.3Very low34.5Very low126 Ų126121.1 Ų121.188%0.88177%0.771SS**  trans-162.2119173.159.40000113.4
160A40Very low34.7Very low94 Ų94122.1 Ų122.178%0.77778%0.778SS**  trans-159.4133.3164.600000108
161Q39Very low34.7Very low185 Ų185121.6 Ų121.686%0.86477%0.769SS**  77.5111.357.2-86.1-74.2-2.400114.8
162A32.3Very low34.7Very low100 Ų100126.2 Ų126.283%0.82678%0.775SS**  trans-161.8158.5162.600000108.2
163G30.2Very low34.9Very low66 Ų66126.5 Ų126.568%0.6878%0.777SS**  trans-173.6-165.3-179.700000115.9
164H33.5Very low34.9Very low193 Ų193126 Ų12689%0.89478%0.782SS**  trans89114.2176.9-58.5-80.5000119.6
165A31.7Very low34.3Very low92 Ų92127.2 Ų127.276%0.7680%0.798SS**  trans53.4131.8134.100000122.8
166V34.9Very low34.3Very low151 Ų151127.5 Ų127.592%0.91581%0.809SS**  -163.4167.6104.7-910000111.4
167S30.2Very low35.4Very low114 Ų114130.6 Ų130.680%0.79782%0.824SS**  trans-86.9158.7-172.5-44.70000115.3
168S31.7Very low35.2Very low120 Ų120135.6 Ų135.684%0.83983%0.826SS**  trans-175.5169.7130.337.80000112.2
169H35.2Very low35.6Very low178 Ų178137.1 Ų137.182%0.82482%0.824SS**  trans-98.7154.7-170.6-57.2-121.1000112.2
170S33.8Very low35.8Very low125 Ų125136.7 Ų136.787%0.87482%0.818SS**  -171.1149.3120.8-85.90000115.6
171V34.7Very low35.7Very low117 Ų117137.3 Ų137.371%0.70982%0.817SS**  trans-63.8149.9178.1-1630000112.6
172W33.1Very low35.6Very low259 Ų259132.8 Ų132.898%0.98181%0.806SS**  trans-157.3162.1131.3-107.711.7000113.4
173S33.6Very low35.9Very low110 Ų110138.5 Ų138.577%0.76981%0.808SS**  trans-124.9175.8-164.1-59.40000112.9
174Q33.3Very low36.1Very low183 Ų183140.8 Ų140.886%0.85581%0.813SS**  trans-61.6160.1-176.6-56.3171.3-0.400114.2
175S29.3Very low36.3Very low121 Ų121136.6 Ų136.685%0.84681%0.812SS**  -158.8134.7126.5-77.60000111.2
176T36.3Very low36.1Very low131 Ų131136 Ų13680%0.80481%0.814SS**  trans-102168.7154.559.90000107.7
177P55Low36.2Very low116 Ų116134.3 Ų134.375%0.75381%0.81SS**  -144.5-16580.834.9-11000111.2
178E30.8Very low37.2Very low185 Ų185133.6 Ų133.686%0.86480%0.802SS**  cis-139.3160.812.7-65.4177.3102.800112.7
179S40.9Very low37.3Very low114 Ų114135.6 Ų135.680%0.79780%0.798SS**  trans-111.5-178.5165.9-46.10000108.8
180P51.3Low37.3Very low116 Ų116132.5 Ų132.575%0.75379%0.792SS**  -134.3156.153.11413.4000114.7
181S39.3Very low37.3Very low107 Ų107132 Ų13275%0.74879%0.788SS**  76.3145.466.9117.30000114.3
182S36.8Very low37.3Very low90 Ų90131.5 Ų131.563%0.62979%0.79SS**  cis-162.6173.911.3-86.90000112.3
183Y39.2Very low37.4Very low221 Ų221129.3 Ų129.387%0.86778%0.781SS**  trans47.4156.4150.588.6-48.2000121.8
184S32.7Very low37.5Very low114 Ų114134.6 Ų134.680%0.79779%0.786SS**  cis-148.6-169.217.4-1580000113.9
185A37.6Very low37.5Very low104 Ų104134.9 Ų134.986%0.8679%0.787SS**  trans-106.4165.4-159.800000117.6
186G29.3Very low38.1Very low79 Ų79139.1 Ų139.181%0.81479%0.786SS**  trans178.1129.516600000114.9
187S36.5Very low38.7Very low117 Ų117138.4 Ų138.482%0.81878%0.783SS**  trans-162.1139.4171.6-175.50000109
188P51.7Low38.5Very low98 Ų98138.8 Ų138.864%0.63679%0.786SS**  -150.1-172.8104.926.8-2.7000115.3
189H33Very low39Very low162 Ų162135.4 Ų135.475%0.7578%0.783SS**  trans78115.9168.8-55.6-64.9000116.9
190T34.5Very low39.6Very low114 Ų114135.7 Ų135.770%0.69978%0.782SS**  cis97.398.942.660.80000115.5
191S35.4Very low39.5Very low114 Ų114136.1 Ų136.180%0.79779%0.785SS**  trans66.2152.7133.4-540000122.1
192S32.9Very low39.6Very low106 Ų106140.1 Ų140.174%0.74179%0.794SS**  trans73156171-66.10000116.3
193R36.1Very low39.7Very low213 Ų213143.6 Ų143.680%0.80481%0.805SS**  cis-164.3155.5-20.7170.5-177.7-62.2-147.62.4107.3H195R193-H195 PolarHBondContact O-N 2.91Å
194Y35.1Very low39.7Very low222 Ų222140.6 Ų140.687%0.87180%0.804SS**PPolyproline II helixtrans-53.2134176-66.3-88.8000113.4
195H33.2Very low39.7Very low189 Ų189137.6 Ų137.688%0.87579%0.792SS**PPolyproline II helixtrans-99.8132.8166-90.3-87.8000111.1R193R193-H195 PolarHBondContact O-N 2.91Å
196Y43.2Very low39.7Very low209 Ų209139.6 Ų139.682%0.8279%0.793SS**PPolyproline II helixtrans-102.3150.2161-90.9-99.6000109.2
197P48.3Very low40.8Very low116 Ų116140.6 Ų140.675%0.75379%0.785SS**PPolyproline II helixtrans-75.5144.1168.432.1-33.8000111.3
198P51.1Low40.8Very low125 Ų125145.2 Ų145.281%0.81279%0.785SS**PPolyproline II helixtrans-86.7154.8177.134.6-34.8000113.2
199S41Very low39.7Very low114 Ų114146.7 Ų146.780%0.79779%0.788SS**PPolyproline II helixtrans-74.1153.6169.6-56.10000112.2
200P52.9Low39.7Very low120 Ų120144 Ų14478%0.77979%0.787SS**PPolyproline II helixtrans-72.5154.9177.330.8-35.9000112.9
201P50.2Low39.6Very low125 Ų125143.7 Ų143.781%0.81279%0.789SS**PPolyproline II helixtrans-83.3153.5-176.333.8-36000113.7
202M40.7Very low39.7Very low190 Ų190148.3 Ų148.394%0.93679%0.791SS**PPolyproline II helixtrans-73.6135.3162-72.416155.700110
203N39.8Very low39.9Very low164 Ų164148.8 Ų148.888%0.87779%0.789SS**  trans-105.7143166.7-173.523.7000109.6
204N38.5Very low39.8Very low158 Ų158145 Ų14585%0.84579%0.785SS**  trans-150.4125.4-179.7-178.652.4000112.4
205G33.7Very low39.8Very low51 Ų51141.2 Ų141.253%0.52679%0.785SS.*  trans126.8162.3153.600000118
206T37Very low40.2Very low145 Ų145139.4 Ų139.489%0.8978%0.781SS**  trans88.1147.1172.679.70000115.5
207P51.2Low39.9Very low101 Ų101136.5 Ų136.566%0.65678%0.78SS**  -141.4-165.6-96.233.8-9.9000115
208R36.5Very low39.3Very low213 Ų213136.6 Ų136.680%0.80478%0.778SS**  trans79148.6168.8-63.3179.6-166.1140.33.3115.9
209D30.3Very low38.4Very low130 Ų130135.3 Ų135.370%0.69577%0.772SS**  cis-155.5155-6.7-111.1-31.5000111.5
210S33.2Very low37.9Very low106 Ų106135.3 Ų135.374%0.74177%0.772SS**  trans57.2148.4161-48.70000118.8
211S32.4Very low37Very low106 Ų106139.5 Ų139.574%0.74177%0.772SS**  cis-158.3146.127.1-47.80000114
212Y35.5Very low36.3Very low212 Ų212138.4 Ų138.483%0.83176%0.759SS**  trans54.7122.6140.9-90.9-104.7000125.3
213T38.6Very low36Very low115 Ų115136.7 Ų136.771%0.70675%0.749SS**  trans59.492.6139.751.40000123.2
214N32.6Very low35.7Very low134 Ų134139 Ų13972%0.71775%0.747SS**  26.9127102.3-170.617.1000120.3
215T36.4Very low35.4Very low142 Ų142135.2 Ų135.287%0.87175%0.745SS**  -159.1151.8126.315.10000111.5
216L40.1Very low35.6Very low151 Ų151141 Ų14179%0.79176%0.763SS**  trans-114.5145.2179.5-70.5163.5000111
217N37.5Very low35.5Very low148 Ų148139.9 Ų139.979%0.79176%0.761SS**  trans-175.1143.1140-99.9-4.2000109
218V35.5Very low35Very low118 Ų118145.5 Ų145.572%0.71577%0.769SS**  cis72.5126.543.1173.90000111
219S33.1Very low35.6Very low99 Ų99141 Ų14169%0.69277%0.768SS**  cis-166.4-177.7-8-105.90000110
220S31.2Very low36Very low113 Ų113141.4 Ų141.479%0.7977%0.769SS**  trans82.2130.4161.1-55.90000117.1
221R33.4Very low36Very low209 Ų209142.2 Ų142.279%0.78977%0.774SS**  cis106.9134.911.3-172.6-164.9149.3140.27.5113.2
222D35.5Very low35.8Very low102 Ų102141 Ų14155%0.54578%0.778SS.*  trans66.5157.9177.1-57.8-35000113.8
223Q33.7Very low35.7Very low154 Ų154135.2 Ų135.272%0.7278%0.775SS**  cis-147.6-179.48.1-152.5140.161.500113.8
224Y34.3Very low35.6Very low213 Ų213140.4 Ų140.484%0.83578%0.783SS**  trans-56.6156.4-168.3-48.3-72.2000118.4
225G32.5Very low35.6Very low78 Ų78138.9 Ų138.980%0.80479%0.789SS**  trans-173141.9162.900000112.9
226L38Very low35.5Very low173 Ų173138.2 Ų138.291%0.90678%0.78SS**  trans-117.3164.9-177.1-87.8166000112.6
227S34.4Very low35.5Very low120 Ų120136.5 Ų136.584%0.83978%0.778SS**  trans88.6137.415978.50000121.2
228R40Very low35Very low220 Ų220139.7 Ų139.783%0.8378%0.78SS**  trans-102152.8156-109.5-179.5169.8-153.8-1.4106.3
229P50.3Low35.1Very low119 Ų119138.6 Ų138.677%0.77378%0.778SS**  -129.1170.168.77.318.1000112.7
230L36.9Very low36.3Very low137 Ų137139 Ų13972%0.71778%0.778SS**  cis98.9118.234-156.386.2000114
231S33.4Very low36.6Very low123 Ų123144.2 Ų144.286%0.8678%0.782SS**  trans72.8134.1164.2-62.40000120.9
232G29.4Very low37.4Very low80 Ų80140.2 Ų140.283%0.82578%0.781SS**  trans167146.1172.900000110.2
233A33.5Very low37.4Very low91 Ų91139.6 Ų139.675%0.75279%0.789SS**  trans-152.8163.7-167.500000116.4
234Y35.6Very low38.3Very low225 Ų225137.8 Ų137.888%0.88279%0.791SS**  trans74.3129.4165.1-76.7-76.9000121.7
235A32.1Very low38.3Very low102 Ų102135.5 Ų135.584%0.84379%0.788SS**  -141.1141.9129.800000108.9
236N35.6Very low38.6Very low128 Ų128139 Ų13968%0.68479%0.787SS**  trans-107.5160.6174.8-162.77.4000107.7Y238N236-Y238 PolarHBondContact OD1-N 3.01Å
237P39.1Very low38.8Very low115 Ų115136 Ų13675%0.74778%0.778SS**  -158.2126.887.536.5-14.7000117.1
238Y28.5Very low39.2Very low214 Ų214135.6 Ų135.684%0.83978%0.776SS**  trans-166.4146.8130.3-125.8-85.7000113.1N236N236-Y238 PolarHBondContact OD1-N 3.01Å
239S36.4Very low39.6Very low95 Ų95130 Ų13066%0.66477%0.768SS**  trans178.2173.1177.7-92.40000109.7
240P58.3Low38.9Very low107 Ų107135.5 Ų135.570%0.69577%0.774SS**  cis-133.1-176.5-42.138.7-23.6000110.8
241Y37.4Very low38.8Very low224 Ų224134.9 Ų134.988%0.87878%0.776SS**  trans-147.7126.7156.8-105.7-83.1000111.6
242V49.8Very low38.7Very low125 Ų125133 Ų13376%0.75878%0.776SS**  trans27.9112.9166.6-65.90000119.1
243A35.5Very low38.8Very low88 Ų88132.8 Ų132.873%0.72777%0.773SS**  cis69.9151.640.900000114.6
244P53.2Low40Very low117 Ų117133.5 Ų133.576%0.7677%0.77SS**  cis-78.1-146.3-5.8-16.635.8000114
245Q34.6Very low40.1Very low164 Ų164132 Ų13277%0.76677%0.768SS**  cis-14718016.7-115.9-45.2-0.500112.6
246L38.7Very low40.1Very low151 Ų151133.8 Ų133.879%0.79176%0.764SS**  trans-136.8171-179.1-81.6169.5000111.3
247P43.1Very low40.4Very low110 Ų110134 Ų13471%0.71477%0.765SS**  cis-131.5168.713.141.8-26.1000117.8
248S42.8Very low40.6Very low112 Ų112134.1 Ų134.178%0.78376%0.764SS**  trans-124.6146.3148.4-66.40000108.6
249P46.8Very low41.4Very low103 Ų103132.9 Ų132.967%0.66977%0.768SS**  trans-142.3144.9133.518.14000115.5
250W35.7Very low41.8Very low235 Ų235135.1 Ų135.189%0.8977%0.772SS**  trans17.2152141.8-36.9102.5000121.3
251T35.9Very low41.2Very low124 Ų124138.6 Ų138.676%0.76178%0.778SS**  cis-174149.1-5.218.90000111
252G30.5Very low41.3Very low84 Ų84134.5 Ų134.587%0.86678%0.777SS**  trans77124.4136.700000120.5
253G32.4Very low41Very low74 Ų74136.4 Ų136.476%0.76378%0.782SS**  trans168.2129.2168.400000111.7
254P58.6Low41.1Very low106 Ų106140.9 Ų140.969%0.68879%0.788SS**  trans-96.7172.9-177.437.2-34.3000113.9
255F37Very low40.3Very low193 Ų193140.4 Ų140.485%0.84679%0.787SS**  trans70128.8-172-41.1-72.8000111.4
256D33.1Very low40.5Very low140 Ų140145 Ų14575%0.74980%0.797SS**  cis-150.5-169.143.4-138.7-63.2000114.8
257N40.9Very low40.5Very low133 Ų133141.7 Ų141.771%0.71180%0.799SS**  trans-50.7141.5-174.9-78.9-95.1000116.6
258T43.5Very low40.2Very low117 Ų117141 Ų14172%0.71880%0.803SS**  trans-146103.5153.8-68.80000111.7L260T258-L260 VanDerWaalsContact C-N 3.29Å; T258-L260 HydrophobicContact CG2-CB 3.93Å; T258-L260 PolarHBondContact O-N 3.03Å; T258-L260 VanDerWaalsContact O-N 3.16Å
259M45.8Very low40.5Very low188 Ų188141.7 Ų141.793%0.92681%0.805SS**  trans-8443.9-177-102.5-93.7-156.200113
260L44.6Very low40.9Very low142 Ų142144.8 Ų144.874%0.74382%0.815SS**  trans-143.740.2-157.6-118.8166.9000118.7T258T258-L260 VanDerWaalsContact C-N 3.29Å; T258-L260 HydrophobicContact CG2-CB 3.93Å; T258-L260 PolarHBondContact O-N 3.03Å; T258-L260 VanDerWaalsContact O-N 3.16Å
261H44.4Very low41.3Very low181 Ų181141.6 Ų141.684%0.83881%0.814SS**  trans-134.891.1167.8-77.4-69.7000113.6
262T39.7Very low41.9Very low138 Ų138147.9 Ų147.985%0.84782%0.823SS**SBendtrans-163.34.7161.5-2.20000116.8
263L45Very low42.2Very low165 Ų165146.1 Ų146.186%0.86481%0.806SS**  trans-127.851.2-174.3-76177.4000115.6
264Q37.9Very low42.9Very low182 Ų182148.7 Ų148.785%0.8581%0.809SS**  trans-141.4144.5151.1-92.898.69.500109
265S36.1Very low42.4Very low106 Ų106150.6 Ų150.674%0.74181%0.813SS**  cis-166.8104.3-9.340.10000112.9
266R37.7Very low43Very low261 Ų261143.3 Ų143.399%0.98579%0.792SS**  trans-156.7133155.6-66.9-168.2-179.7-177.9-0.6107.7
267G38.3Very low44Very low81 Ų81141.2 Ų141.284%0.83579%0.785SS**  cis167.3104-8.500000109.7
268A37.3Very low44.6Very low96 Ų96138.6 Ų138.679%0.79378%0.777SS**  trans-150.4157.3-175.800000110.6
269P48.7Very low45Very low126 Ų126138.3 Ų138.382%0.81877%0.771SS**  trans-83.4163.8-157.232.3-37000115.8
270L56.7Low45.5Very low168 Ų168134.7 Ų134.788%0.8875%0.754SS**  trans-74.1120.4179.1-58.7172.5000111.9
271I42.7Very low46Very low169 Ų169133.7 Ų133.787%0.86775%0.749SS**  trans-125.3117.1154.3-63.8-66.8000107.1
272R48.2Very low46.4Very low255 Ų255130.7 Ų130.796%0.96274%0.739SS**  trans-105.295-170.8-170.4-175.8-170.2-166.73.9110.4
273G37.8Very low47Very low48 Ų48129.2 Ų129.250%0.49573%0.726SS.*  trans-127127.517500000111.1N275G273-N275 VanDerWaalsContact C-N 3.33Å; G273-N275 PolarHBondContact O-N 2.79Å
274P47.6Very low47.5Very low127 Ų127126.5 Ų126.583%0.82571%0.71SS**THydrogen-bonded Turntrans-67.7-24.2-171-24.235.2000116.1
275N48.1Very low48.6Very low146 Ų146119.9 Ų119.978%0.78169%0.687SS**THydrogen-bonded Turntrans-114.113.6-162.3-62.1-3.9000114.9G273G273-N275 VanDerWaalsContact C-N 3.33Å; G273-N275 PolarHBondContact O-N 2.79Å
276G48.4Very low50Low40 Ų40118 Ų11841%0.41267%0.666SS.*  trans-111.57.3-169.500000116.9
277V54.8Low51.7Low97 Ų97109.5 Ų109.559%0.58865%0.646SS**Hα-helixtrans-90.3-24.1-170.7-1670000112.7L281V277-L281 HydrophobicContact CG1-CD1 4.19Å; V277-L281 PolarHBondContact O-N 3.01Å
278S54.3Low54Low77 Ų77109.4 Ų109.454%0.53862%0.621SS.*Hα-helixtrans-58.4-55.1176.8310000112.5I280 L281 D282S278-I280 VanDerWaalsContact C-N 3.33Å; S278-I280 PolarHBondContact O-N 3.32Å; S278-L281 WeakPolarHBondContact O-CB 3.29Å; S278-L281 PolarHBondContact O-N 2.95Å; S278-L281 VanDerWaalsContact O-N 3.11Å; S278-D282 PolarHBondContact O-N 2.85Å; S278-D282 VanDerWaalsContact O-N 3.1Å
279D51Low56.6Low111 Ų111107.7 Ų107.759%0.59460%0.597SS**Hα-helixtrans-71.7-30.2-167.1-54.7-105.7000112D282 D283D279-D282 PolarHBondContact O-N 3.16Å; D279-D283 PolarHBondContact O-N 2.96Å
280I55.9Low58.8Low113 Ų113101.8 Ų101.858%0.57956%0.558SS**Hα-helixtrans-73.4-34.2173.9-59.2178.4000110.9S278 D282 M284S278-I280 VanDerWaalsContact C-N 3.33Å; S278-I280 PolarHBondContact O-N 3.32Å; I280-D282 VanDerWaalsContact C-N 3.33Å; I280-M284 WeakPolarHBondContact O-CB 3.49Å; I280-M284 VanDerWaalsContact O-CG 3.28Å; I280-M284 WeakPolarHBondContact O-CG 3.27Å; I280-M284 PolarHBondContact O-N 2.69Å; I280-M284 VanDerWaalsContact O-N 3.14Å
281L55.8Low60.4Low120 Ų12097.7 Ų97.763%0.62854%0.54SS*.Hα-helixtrans-67.3-34.9172.6-109.493.3000112.1V277 S278 A285V277-L281 HydrophobicContact CG1-CD1 4.19Å; V277-L281 PolarHBondContact O-N 3.01Å; S278-L281 WeakPolarHBondContact O-CB 3.29Å; S278-L281 PolarHBondContact O-N 2.95Å; S278-L281 VanDerWaalsContact O-N 3.11Å; L281-A285 PolarHBondContact O-N 3.28Å
282D53Low62.7Low118 Ų11891.7 Ų91.763%0.63151%0.509SS*.Hα-helixtrans-73.6-43.7-179.6-154.6-113.2000112.3S278 D279 I280 M284 A285 E286S278-D282 PolarHBondContact O-N 2.85Å; S278-D282 VanDerWaalsContact O-N 3.1Å; D279-D282 PolarHBondContact O-N 3.16Å; I280-D282 VanDerWaalsContact C-N 3.33Å; D282-M284 VanDerWaalsContact C-N 3.28Å; D282-M284 PolarHBondContact O-N 2.86Å; D282-A285 WeakPolarHBondContact O-CA 3.39Å; D282-A285 VanDerWaalsContact O-CB 3.31Å; D282-A285 WeakPolarHBondContact O-CB 3.43Å; D282-A285 PolarHBondContact O-N 3.21Å; D282-E286 PolarHBondContact O-N 3.37Å
283D51.6Low64.7Low108 Ų10880.6 Ų80.658%0.57847%0.471SS*.Hα-helixtrans-58.7-40.8170.3179.8-100.4000111.6D279 A285 E286 S287D279-D283 PolarHBondContact O-N 2.96Å; D283-A285 PolarHBondContact O-N 3.07Å; D283-E286 PolarHBondContact O-N 2.94Å; D283-S287 PolarHBondContact O-N 3.32Å
284M56.6Low67.1Low107 Ų10778.6 Ų78.653%0.52745%0.45SS..Hα-helixtrans-62.3-30.3171.9-75.1-168.58300112.5I280 D282 S287 R288I280-M284 WeakPolarHBondContact O-CB 3.49Å; I280-M284 VanDerWaalsContact O-CG 3.28Å; I280-M284 WeakPolarHBondContact O-CG 3.27Å; I280-M284 PolarHBondContact O-N 2.69Å; I280-M284 VanDerWaalsContact O-N 3.14Å; D282-M284 VanDerWaalsContact C-N 3.28Å; D282-M284 PolarHBondContact O-N 2.86Å; M284-S287 PolarHBondContact O-OG 2.97Å; M284-R288 VanDerWaalsContact C-NH2 3.28Å; M284-R288 VanDerWaalsContact O-CZ 3.26Å; M284-R288 PolarHBondContact O-NE 3.03Å; M284-R288 PolarHBondContact O-NH2 3.44Å
285A60.7Low69.1Low44 Ų4474.8 Ų74.836%0.36443%0.426SS..Hα-helixtrans-72.3-48.4174.200000111.5L281 D282 D283 S287 R288L281-A285 PolarHBondContact O-N 3.28Å; D282-A285 WeakPolarHBondContact O-CA 3.39Å; D282-A285 VanDerWaalsContact O-CB 3.31Å; D282-A285 WeakPolarHBondContact O-CB 3.43Å; D282-A285 PolarHBondContact O-N 3.21Å; D283-A285 PolarHBondContact O-N 3.07Å; A285-S287 PolarHBondContact O-N 2.83Å; A285-S287 VanDerWaalsContact O-N 3.13Å; A285-R288 PolarHBondContact O-N 3.29Å; A285-R288 VanDerWaalsContact O-N 3.12Å
286E64.8Low71.1Confident67 Ų6771 Ų7131%0.31341%0.405SS..Hα-helixtrans-60.3-21.1177.9-17759-15800113.2D282 D283 R288 I296D282-E286 PolarHBondContact O-N 3.37Å; D283-E286 PolarHBondContact O-N 2.94Å; E286-R288 PolarHBondContact O-N 3.29Å; E286-I296 VanDerWaalsContact OE2-CD1 3.26Å; E286-I296 WeakPolarHBondContact OE2-CD1 3.45Å
287S72.9Confident73.1Confident81 Ų8173.4 Ų73.457%0.56642%0.416SS*.THydrogen-bonded Turntrans-63.3-18.5173.776.60000115.2D283 M284 A285D283-S287 PolarHBondContact O-N 3.32Å; M284-S287 PolarHBondContact O-OG 2.97Å; A285-S287 PolarHBondContact O-N 2.83Å; A285-S287 VanDerWaalsContact O-N 3.13Å
288R87.1Confident74.8Confident80 Ų8070 Ų7030%0.30240%0.395SS..  trans-102.794.1-171.6-76.2163.4-98.4-170.9-6.8111.6M284 A285 E286 W301 F309M284-R288 VanDerWaalsContact C-NH2 3.28Å; M284-R288 VanDerWaalsContact O-CZ 3.26Å; M284-R288 PolarHBondContact O-NE 3.03Å; M284-R288 PolarHBondContact O-NH2 3.44Å; A285-R288 PolarHBondContact O-N 3.29Å; A285-R288 VanDerWaalsContact O-N 3.12Å; E286-R288 PolarHBondContact O-N 3.29Å; R288-W301 HydrophobicContact CB-CH2 4.2Å; R288-W301 HydrophobicContact CB-CZ2 3.74Å; R288-W301 WeakPolarHBondContact O-CH2 3.44Å; R288-W301 WeakPolarHBondContact O-CZ2 3.4Å; R288-F309 HydrophobicContact CG-CD1 4.41Å; R288-F309 HydrophobicContact CG-CD2 4.44Å; R288-F309 HydrophobicContact CG-CE1 4.22Å; R288-F309 HydrophobicContact CG-CE2 4.25Å; R288-F309 HydrophobicContact CG-CZ 4.12Å
289E92.6Very high76.5Confident60 Ų6072.2 Ų72.228%0.2841%0.408SS..  trans-97.1137.9166.871.1167.9-157.100112.6V291 I296 R333E289-V291 PolarHBondContact O-N 3.03Å; E289-I296 HydrophobicContact CB-CG2 4.45Å; E289-R333 IonicContact OE1-CZ 3.82Å; E289-R333 IonicContact OE1-NE 3.82Å; E289-R333 IonicContact OE1-NH2 3.58Å; E289-R333 PolarHBondContact OE1-NH2 2.7Å
290C93.3Very high78.5Confident1 Ų171 Ų711%0.00740%0.401CS..  trans-66119173.5170.30000111.3N292 C293 G294 S295 W301 F309 C311C290-N292 PolarHBondContact O-N 2.95Å; C290-C293 PolarHBondContact O-N 2.87Å; C290-G294 VanDerWaalsContact O-CA 3.23Å; C290-G294 WeakPolarHBondContact O-CA 3.41Å; C290-G294 PolarHBondContact O-N 3.11Å; C290-S295 PolarHBondContact N-O 3.02Å; C290-W301 HydrophobicContact CB-CH2 4.36Å; C290-W301 HydrophobicContact CB-CZ3 4.05Å; C290-F309 WeakPolarHBondContact CA-O 3.28Å; C290-C311 HydrophobicContact CB-CB 3.92Å; C290-C311 PolarHBondContact SG-N 3.24Å; C290-C311 VanDerWaalsContact SG-SG 3.66Å
291V91.9Very high80.3Confident83 Ų8369 Ų6950%0.50339%0.387SS..THydrogen-bonded Turntrans-63.6-18.8-174.2-60.20000115E289 H308 F309 L310E289-V291 PolarHBondContact O-N 3.03Å; V291-H308 HydrophobicContact CB-CB 4.47Å; V291-H308 HydrophobicContact CG1-CB 3.9Å; V291-H308 HydrophobicContact CG2-CB 3.74Å; V291-F309 PolarHBondContact N-O 2.89Å; V291-L310 HydrophobicContact CG2-CD2 3.65Å; V291-L310 HydrophobicContact CG2-CG 4.44Å
292N90.3Very high82.1Confident42 Ų4267.3 Ų67.323%0.22537%0.372CS..THydrogen-bonded Turntrans-87.4-39.8176.8171.2-94.4000113.7C290 L310 C314 R325C290-N292 PolarHBondContact O-N 2.95Å; N292-L310 HydrophobicContact CB-CD2 3.85Å; N292-C314 HydrophobicContact CB-CB 4.03Å; N292-C314 PolarHBondContact OD1-SG 3.23Å; N292-R325 PolarHBondContact ND2-N 3.44Å; N292-R325 PolarHBondContact ND2-O 3.25Å; N292-R325 WeakPolarHBondContact OD1-CB 3.23Å
293C89.6Confident84.1Confident22 Ų2269.3 Ų69.315%0.14937%0.371CS..THydrogen-bonded Turntrans-128.6-1.5-169.783.20000115C290 S295 L327 Q331C290-C293 PolarHBondContact O-N 2.87Å; C293-S295 PolarHBondContact O-N 2.84Å; C293-L327 HydrophobicContact CB-CD1 3.82Å; C293-L327 HydrophobicContact CB-CD2 4.03Å; C293-L327 HydrophobicContact CB-CG 4.36Å; C293-Q331 PolarHBondContact O-NE2 3.22Å; C293-Q331 PolarHBondContact O-OE1 2.67Å
294G88.9Confident85.8Confident6 Ų666.5 Ų66.56%0.06236%0.355CS..  trans51.934-178.700000114.8C290 Q331C290-G294 VanDerWaalsContact O-CA 3.23Å; C290-G294 WeakPolarHBondContact O-CA 3.41Å; C290-G294 PolarHBondContact O-N 3.11Å; G294-Q331 VanDerWaalsContact CA-NE2 3.31Å; G294-Q331 PolarHBondContact O-NE2 2.84Å; G294-Q331 VanDerWaalsContact O-NE2 3.07Å
295S89.9Confident87.3Confident47 Ų4765.8 Ų65.833%0.32938%0.376SS..  trans-75.1129.2166.5-160.40000108.9C290 C293 S297 W301C290-S295 PolarHBondContact N-O 3.02Å; C293-S295 PolarHBondContact O-N 2.84Å; S295-S297 PolarHBondContact OG-O 3.01Å; S295-W301 WeakPolarHBondContact O-CH2 3.4Å
296I90.6Very high88.7Confident66 Ų6668.8 Ų68.834%0.33839%0.39SS..SBendtrans-84.9-23.6172.753.9169.9000112.4E286 E289 W301E286-I296 VanDerWaalsContact OE2-CD1 3.26Å; E286-I296 WeakPolarHBondContact OE2-CD1 3.45Å; E289-I296 HydrophobicContact CB-CG2 4.45Å; I296-W301 WeakPolarHBondContact O-CZ2 3.31Å
297S88.9Confident89.9Confident91 Ų9167.2 Ų67.264%0.63639%0.392SS*.  trans-111.6145.4175177.40000111.3S295S295-S297 PolarHBondContact OG-O 3.01Å
298T91.5Very high90.8Very high25 Ų2567.7 Ų67.715%0.15338%0.384CS..  trans-163.3145.1172.3-169.60000110.5L300 W301 C311 N312T298-L300 WeakPolarHBondContact CG2-O 3.42Å; T298-L300 PolarHBondContact O-N 3.47Å; T298-L300 PolarHBondContact OG1-O 2.91Å; T298-W301 HydrophobicContact CG2-CD2 3.45Å; T298-W301 VanDerWaalsContact CG2-CD2 3.45Å; T298-W301 VanDerWaalsContact CG2-CE2 3.48Å; T298-W301 HydrophobicContact CG2-CE3 3.83Å; T298-W301 HydrophobicContact CG2-CG 3.81Å; T298-W301 HydrophobicContact CG2-CH2 4.22Å; T298-W301 HydrophobicContact CG2-CZ2 3.88Å; T298-W301 HydrophobicContact CG2-CZ3 4.2Å; T298-C311 HydrophobicContact CG2-CB 4.11Å; T298-C311 WeakPolarHBondContact OG1-CB 3.41Å; T298-N312 PolarHBondContact OG1-N 3.27Å
299P90.4Very high91.1Very high125 Ų12567 Ų6781%0.81238%0.384SS*.SBendtrans-68.6-15.2176.426.9-36.4000114.1
300L92.2Very high91.2Very high85 Ų8564.7 Ų64.745%0.44537%0.373SS..SBendtrans-154121.4171.7179.361.9000110.8T298 N312T298-L300 WeakPolarHBondContact CG2-O 3.42Å; T298-L300 PolarHBondContact O-N 3.47Å; T298-L300 PolarHBondContact OG1-O 2.91Å; L300-N312 HydrophobicContact CB-CB 4.11Å; L300-N312 WeakPolarHBondContact O-CA 3.46Å; L300-N312 WeakPolarHBondContact O-CB 3.49Å; L300-N312 PolarHBondContact O-N 3.34Å
301W94Very high91.3Very high72 Ų7265 Ų6527%0.27338%0.375SS..EExtended strand (participates in β ladder)trans-74.6132.2168.8-76.3111000110.9R288 C290 S295 I296 T298 F309R288-W301 HydrophobicContact CB-CH2 4.2Å; R288-W301 HydrophobicContact CB-CZ2 3.74Å; R288-W301 WeakPolarHBondContact O-CH2 3.44Å; R288-W301 WeakPolarHBondContact O-CZ2 3.4Å; C290-W301 HydrophobicContact CB-CH2 4.36Å; C290-W301 HydrophobicContact CB-CZ3 4.05Å; S295-W301 WeakPolarHBondContact O-CH2 3.4Å; I296-W301 WeakPolarHBondContact O-CZ2 3.31Å; T298-W301 HydrophobicContact CG2-CD2 3.45Å; T298-W301 VanDerWaalsContact CG2-CD2 3.45Å; T298-W301 VanDerWaalsContact CG2-CE2 3.48Å; T298-W301 HydrophobicContact CG2-CE3 3.83Å; T298-W301 HydrophobicContact CG2-CG 3.81Å; T298-W301 HydrophobicContact CG2-CH2 4.22Å; T298-W301 HydrophobicContact CG2-CZ2 3.88Å; T298-W301 HydrophobicContact CG2-CZ3 4.2Å; W301-F309 HydrophobicContact CE3-CB 3.96Å; W301-F309 HydrophobicContact CE3-CD1 4.38Å; W301-F309 HydrophobicContact CZ3-CB 3.94Å
302R94.1Very high91.4Very high84 Ų8462.9 Ų62.932%0.31736%0.361SS..EExtended strand (participates in β ladder)trans-116.2157.4172-62.9-177.2179-79.6-2.3109L310 N312R302-L310 HydrophobicContact CB-CB 4.48Å; R302-L310 PolarHBondContact N-O 3.21Å; R302-L310 PolarHBondContact O-N 3.31Å; R302-N312 VanDerWaalsContact CZ-OD1 3.27Å; R302-N312 PolarHBondContact NE-OD1 2.91Å; R302-N312 PolarHBondContact NH2-OD1 2.92Å
303R94.3Very high91.6Very high160 Ų16063 Ų6360%0.60437%0.368SS*.EExtended strand (participates in β ladder)trans-111.2148.4166-65.5-174.8-174.5-86.76110.2G307 H308 F309R303-G307 PolarHBondContact NH1-O 3.05Å; R303-H308 VanDerWaalsContact CA-O 3.27Å; R303-H308 WeakPolarHBondContact CA-O 3.35Å; R303-F309 VanDerWaalsContact NH1-CZ 3.35Å
304D88.3Confident91.8Very high48 Ų4862 Ų6226%0.25736%0.361SS..  trans-82.2174.7162.16820.8000111.3T306 G307 H308 L310D304-T306 PolarHBondContact O-N 3.12Å; D304-T306 VanDerWaalsContact O-N 3.07Å; D304-T306 VanDerWaalsContact OD1-CA 3.29Å; D304-T306 WeakPolarHBondContact OD1-CA 3.3Å; D304-T306 WeakPolarHBondContact OD1-CB 3.26Å; D304-T306 PolarHBondContact OD1-N 3.29Å; D304-T306 PolarHBondContact OD1-OG1 2.95Å; D304-T306 PolarHBondContact OD2-OG1 3.1Å; D304-G307 PolarHBondContact O-N 3.44Å; D304-G307 PolarHBondContact OD1-N 3.04Å; D304-H308 PolarHBondContact N-O 2.67Å; D304-H308 VanDerWaalsContact N-O 3.16Å; D304-H308 IonicContact OD1-CG 2.95Å; D304-H308 PolarHBondContact OD1-N 3.06Å; D304-H308 IonicContact OD1-ND1 2.63Å; D304-H308 PolarHBondContact OD1-ND1 2.73Å; D304-H308 WeakPolarHBondContact OD2-CB 3.37Å; D304-H308 IonicContact OD2-CG 3.28Å; D304-H308 IonicContact OD2-ND1 3.96Å; D304-H308 PolarHBondContact OD2-ND1 2.99Å; D304-L310 HydrophobicContact CB-CD1 4.04Å
305G87.8Confident92Very high93 Ų9362.2 Ų62.296%0.95936%0.364SS*.THydrogen-bonded Turntrans-66.7-2.5177.800000114.9
306T90.1Very high92.1Very high107 Ų10763.6 Ų63.666%0.65637%0.367SS*.THydrogen-bonded Turntrans-110.97.717441.30000112.2D304 H308D304-T306 PolarHBondContact O-N 3.12Å; D304-T306 VanDerWaalsContact O-N 3.07Å; D304-T306 VanDerWaalsContact OD1-CA 3.29Å; D304-T306 WeakPolarHBondContact OD1-CA 3.3Å; D304-T306 WeakPolarHBondContact OD1-CB 3.26Å; D304-T306 PolarHBondContact OD1-N 3.29Å; D304-T306 PolarHBondContact OD1-OG1 2.95Å; D304-T306 PolarHBondContact OD2-OG1 3.1Å; T306-H308 PolarHBondContact OG1-CE1 3.12Å; T306-H308 VanDerWaalsContact OG1-CE1 3.32Å; T306-H308 PolarHBondContact OG1-ND1 3.13Å
307G88.8Confident92.2Very high34 Ų3463.3 Ų63.335%0.35136%0.362SS..  trans87.3-6.7173.600000116.1R303 D304R303-G307 PolarHBondContact NH1-O 3.05Å; D304-G307 PolarHBondContact O-N 3.44Å; D304-G307 PolarHBondContact OD1-N 3.04Å
308H92.6Very high92.3Very high90 Ų9061.2 Ų61.242%0.41735%0.348SS..  trans-66.8145.8-177.2-53.6103.7000112.2V291 R303 D304 T306V291-H308 HydrophobicContact CB-CB 4.47Å; V291-H308 HydrophobicContact CG1-CB 3.9Å; V291-H308 HydrophobicContact CG2-CB 3.74Å; R303-H308 VanDerWaalsContact CA-O 3.27Å; R303-H308 WeakPolarHBondContact CA-O 3.35Å; D304-H308 PolarHBondContact N-O 2.67Å; D304-H308 VanDerWaalsContact N-O 3.16Å; D304-H308 IonicContact OD1-CG 2.95Å; D304-H308 PolarHBondContact OD1-N 3.06Å; D304-H308 IonicContact OD1-ND1 2.63Å; D304-H308 PolarHBondContact OD1-ND1 2.73Å; D304-H308 WeakPolarHBondContact OD2-CB 3.37Å; D304-H308 IonicContact OD2-CG 3.28Å; D304-H308 IonicContact OD2-ND1 3.96Å; D304-H308 PolarHBondContact OD2-ND1 2.99Å; T306-H308 PolarHBondContact OG1-CE1 3.12Å; T306-H308 VanDerWaalsContact OG1-CE1 3.32Å; T306-H308 PolarHBondContact OG1-ND1 3.13Å
309F94.2Very high92.3Very high65 Ų6568.9 Ų68.929%0.28538%0.379SS..EExtended strand (participates in β ladder)trans-74129.2175.4-64.5-80000111.8R288 C290 V291 W301 R303R288-F309 HydrophobicContact CG-CD1 4.41Å; R288-F309 HydrophobicContact CG-CD2 4.44Å; R288-F309 HydrophobicContact CG-CE1 4.22Å; R288-F309 HydrophobicContact CG-CE2 4.25Å; R288-F309 HydrophobicContact CG-CZ 4.12Å; C290-F309 WeakPolarHBondContact CA-O 3.28Å; V291-F309 PolarHBondContact N-O 2.89Å; W301-F309 HydrophobicContact CE3-CB 3.96Å; W301-F309 HydrophobicContact CE3-CD1 4.38Å; W301-F309 HydrophobicContact CZ3-CB 3.94Å; R303-F309 VanDerWaalsContact NH1-CZ 3.35Å
310L93.6Very high92.2Very high12 Ų1269.7 Ų69.76%0.06337%0.373CS..EExtended strand (participates in β ladder)trans-125.2137.6171.8-68.8175.5000109.5V291 N292 R302 D304 C314V291-L310 HydrophobicContact CG2-CD2 3.65Å; V291-L310 HydrophobicContact CG2-CG 4.44Å; N292-L310 HydrophobicContact CB-CD2 3.85Å; R302-L310 HydrophobicContact CB-CB 4.48Å; R302-L310 PolarHBondContact N-O 3.21Å; R302-L310 PolarHBondContact O-N 3.31Å; D304-L310 HydrophobicContact CB-CD1 4.04Å; L310-C314 HydrophobicContact CD2-CB 4.43Å
311C95.2Very high92.1Very high7 Ų769.2 Ų69.25%0.04737%0.371CS..EExtended strand (participates in β ladder)trans-68.2156.6169.973.40000110.7C290 T298 A313 C314 G315C290-C311 HydrophobicContact CB-CB 3.92Å; C290-C311 PolarHBondContact SG-N 3.24Å; C290-C311 VanDerWaalsContact SG-SG 3.66Å; T298-C311 HydrophobicContact CG2-CB 4.11Å; T298-C311 WeakPolarHBondContact OG1-CB 3.41Å; C311-A313 VanDerWaalsContact C-N 3.27Å; C311-A313 PolarHBondContact O-N 2.98Å; C311-A313 VanDerWaalsContact O-N 3.12Å; C311-C314 PolarHBondContact O-N 3.46Å; C311-C314 PolarHBondContact SG-SG 3.12Å; C311-G315 PolarHBondContact O-N 3.38Å
312N95Very high91.8Very high40 Ų4068.1 Ų68.121%0.21438%0.382CS..Hα-helixtrans-47.9-48.7-174-169.522.2000112.6T298 L300 R302 C314 L316T298-N312 PolarHBondContact OG1-N 3.27Å; L300-N312 HydrophobicContact CB-CB 4.11Å; L300-N312 WeakPolarHBondContact O-CA 3.46Å; L300-N312 WeakPolarHBondContact O-CB 3.49Å; L300-N312 PolarHBondContact O-N 3.34Å; R302-N312 VanDerWaalsContact CZ-OD1 3.27Å; R302-N312 PolarHBondContact NE-OD1 2.91Å; R302-N312 PolarHBondContact NH2-OD1 2.92Å; N312-C314 PolarHBondContact O-N 3.03Å; N312-L316 VanDerWaalsContact O-CB 3.3Å; N312-L316 WeakPolarHBondContact O-CB 3.43Å; N312-L316 VanDerWaalsContact O-CG 3.26Å; N312-L316 WeakPolarHBondContact O-CG 3.22Å; N312-L316 PolarHBondContact O-N 3.44Å; N312-L316 WeakPolarHBondContact OD1-CD1 3.07Å
313A92.9Very high91.5Very high44 Ų4469.2 Ų69.236%0.36439%0.394SS..Hα-helixtrans-64.5-35.6-179.500000114C311 Y317C311-A313 VanDerWaalsContact C-N 3.27Å; C311-A313 PolarHBondContact O-N 2.98Å; C311-A313 VanDerWaalsContact O-N 3.12Å; A313-Y317 VanDerWaalsContact O-CB 3.28Å; A313-Y317 WeakPolarHBondContact O-CB 3.46Å; A313-Y317 PolarHBondContact O-N 3.42Å; A313-Y317 VanDerWaalsContact O-N 3.1Å
314C93.7Very high91.1Very high1 Ų165.8 Ų65.81%0.00740%0.395CS..Hα-helixtrans-83-35.5-179.2-61.80000112.1N292 L310 C311 N312 S318N292-C314 HydrophobicContact CB-CB 4.03Å; N292-C314 PolarHBondContact OD1-SG 3.23Å; L310-C314 HydrophobicContact CD2-CB 4.43Å; C311-C314 PolarHBondContact O-N 3.46Å; C311-C314 PolarHBondContact SG-SG 3.12Å; N312-C314 PolarHBondContact O-N 3.03Å; C314-S318 VanDerWaalsContact O-CB 3.31Å; C314-S318 WeakPolarHBondContact O-CB 3.3Å; C314-S318 PolarHBondContact O-N 2.73Å
315G93.8Very high91Very high11 Ų1168.8 Ų68.811%0.11340%0.402CS..Hα-helixtrans-67.7-39.5172.300000112.6C311 K319C311-G315 PolarHBondContact O-N 3.38Å; G315-K319 WeakPolarHBondContact O-CB 3.28Å; G315-K319 PolarHBondContact O-N 3.28Å; G315-K319 VanDerWaalsContact O-N 3.07Å
316L92.5Very high90.8Very high76 Ų7668.2 Ų68.240%0.39838%0.382SS..Hα-helixtrans-62.5-52.6171.5-75.8171.2000111.3N312 S318 K319 M320N312-L316 VanDerWaalsContact O-CB 3.3Å; N312-L316 WeakPolarHBondContact O-CB 3.43Å; N312-L316 VanDerWaalsContact O-CG 3.26Å; N312-L316 WeakPolarHBondContact O-CG 3.22Å; N312-L316 PolarHBondContact O-N 3.44Å; N312-L316 WeakPolarHBondContact OD1-CD1 3.07Å; L316-S318 VanDerWaalsContact C-N 3.34Å; L316-S318 PolarHBondContact O-N 3.11Å; L316-K319 PolarHBondContact O-N 3.38Å; L316-M320 WeakPolarHBondContact O-CG 3.38Å; L316-M320 PolarHBondContact O-N 3.14Å
317Y92.7Very high90.3Very high59 Ų5966.5 Ų66.523%0.23137%0.368CS..Hα-helixtrans-56.1-46.9178.3-170.6-79.7000112A313 K319 M320 N321 L323 R325 P326A313-Y317 VanDerWaalsContact O-CB 3.28Å; A313-Y317 WeakPolarHBondContact O-CB 3.46Å; A313-Y317 PolarHBondContact O-N 3.42Å; A313-Y317 VanDerWaalsContact O-N 3.1Å; Y317-K319 PolarHBondContact O-N 3.1Å; Y317-M320 HydrophobicContact CD2-CE 3.95Å; Y317-M320 HydrophobicContact CG-CE 4.44Å; Y317-M320 PolarHBondContact O-N 3.35Å; Y317-N321 HydrophobicContact CD1-CB 4.12Å; Y317-N321 VanDerWaalsContact CD2-OD1 3.3Å; Y317-N321 WeakPolarHBondContact CD2-OD1 3.46Å; Y317-N321 HydrophobicContact CE1-CB 3.75Å; Y317-N321 WeakPolarHBondContact CE2-OD1 3.31Å; Y317-N321 WeakPolarHBondContact O-CB 3.05Å; Y317-N321 PolarHBondContact O-N 3.39Å; Y317-N321 PolarHBondContact O-OD1 3.3Å; Y317-L323 WeakPolarHBondContact CD1-O 3.37Å; Y317-R325 HydrophobicContact CD1-CB 3.69Å; Y317-R325 HydrophobicContact CD1-CG 4.09Å; Y317-R325 HydrophobicContact CD2-CB 4.47Å; Y317-R325 HydrophobicContact CD2-CG 3.97Å; Y317-R325 HydrophobicContact CE1-CB 4.29Å; Y317-R325 HydrophobicContact CE2-CG 4.44Å; Y317-R325 HydrophobicContact CG-CB 3.81Å; Y317-R325 HydrophobicContact CG-CG 3.78Å; Y317-P326 VanDerWaalsContact CZ-CD 3.47Å; Y317-P326 WeakPolarHBondContact OH-CD 3.44Å
318S91.3Very high89.7Confident48 Ų4872.9 Ų72.934%0.33639%0.393SS..Hα-helixtrans-65.1-27.1178.1-166.50000113.3C314 L316 G322 L323C314-S318 VanDerWaalsContact O-CB 3.31Å; C314-S318 WeakPolarHBondContact O-CB 3.3Å; C314-S318 PolarHBondContact O-N 2.73Å; L316-S318 VanDerWaalsContact C-N 3.34Å; L316-S318 PolarHBondContact O-N 3.11Å; S318-G322 WeakPolarHBondContact O-CA 3.49Å; S318-G322 PolarHBondContact O-N 3.39Å; S318-L323 WeakPolarHBondContact CA-O 3.37Å
319K90.6Very high88.6Confident185 Ų18577 Ų7780%0.80441%0.409SS*.Hα-helixtrans-77.2-40.8175.3-172.2177.9179.3-176.90112.4G315 L316 Y317G315-K319 WeakPolarHBondContact O-CB 3.28Å; G315-K319 PolarHBondContact O-N 3.28Å; G315-K319 VanDerWaalsContact O-N 3.07Å; L316-K319 PolarHBondContact O-N 3.38Å; Y317-K319 PolarHBondContact O-N 3.1Å
320M88.2Confident86.9Confident142 Ų14279.8 Ų79.870%0.743%0.434SS*.Hα-helixtrans-84.7-35-17866.4179.417300114L316 Y317L316-M320 WeakPolarHBondContact O-CG 3.38Å; L316-M320 PolarHBondContact O-N 3.14Å; Y317-M320 HydrophobicContact CD2-CE 3.95Å; Y317-M320 HydrophobicContact CG-CE 4.44Å; Y317-M320 PolarHBondContact O-N 3.35Å
321N90.7Very high85.2Confident75 Ų7582.4 Ų82.440%0.40145%0.446SS..Hα-helixtrans-98.2-10-178.1-63.5105.1000114Y317 L323Y317-N321 HydrophobicContact CD1-CB 4.12Å; Y317-N321 VanDerWaalsContact CD2-OD1 3.3Å; Y317-N321 WeakPolarHBondContact CD2-OD1 3.46Å; Y317-N321 HydrophobicContact CE1-CB 3.75Å; Y317-N321 WeakPolarHBondContact CE2-OD1 3.31Å; Y317-N321 WeakPolarHBondContact O-CB 3.05Å; Y317-N321 PolarHBondContact O-N 3.39Å; Y317-N321 PolarHBondContact O-OD1 3.3Å; N321-L323 PolarHBondContact O-N 3.06Å; N321-L323 VanDerWaalsContact O-N 3.11Å
322G88.3Confident83.4Confident49 Ų4991.4 Ų91.451%0.50548%0.484SS..SBendtrans6216.2-175.700000114.6S318S318-G322 WeakPolarHBondContact O-CA 3.49Å; S318-G322 PolarHBondContact O-N 3.39Å
323L88.1Confident81.6Confident107 Ų10796 Ų9656%0.5650%0.498SS*.SBendtrans-139150.8-172.9-68.3175.7000110.5Y317 S318 N321Y317-L323 WeakPolarHBondContact CD1-O 3.37Å; S318-L323 WeakPolarHBondContact CA-O 3.37Å; N321-L323 PolarHBondContact O-N 3.06Å; N321-L323 VanDerWaalsContact O-N 3.11Å
324S85.4Confident79.8Confident89 Ų8996.9 Ų96.962%0.62250%0.5SS*.PPolyproline II helixtrans-61.9133.2173.1540000111.4
325R86.6Confident78.1Confident110 Ų11098.6 Ų98.642%0.41551%0.512SS..PPolyproline II helixtrans-56.8127.3-179.8-168.4-178.4-176.8-150.12.6111.1N292 Y317 L327N292-R325 PolarHBondContact ND2-N 3.44Å; N292-R325 PolarHBondContact ND2-O 3.25Å; N292-R325 WeakPolarHBondContact OD1-CB 3.23Å; Y317-R325 HydrophobicContact CD1-CB 3.69Å; Y317-R325 HydrophobicContact CD1-CG 4.09Å; Y317-R325 HydrophobicContact CD2-CB 4.47Å; Y317-R325 HydrophobicContact CD2-CG 3.97Å; Y317-R325 HydrophobicContact CE1-CB 4.29Å; Y317-R325 HydrophobicContact CE2-CG 4.44Å; Y317-R325 HydrophobicContact CG-CB 3.81Å; Y317-R325 HydrophobicContact CG-CG 3.78Å; R325-L327 PolarHBondContact O-N 3.04Å
326P82.4Confident76.3Confident81 Ų81102.9 Ų102.953%0.52654%0.535SS..PPolyproline II helixtrans-73.5122.9177.428.5-33000110.3Y317 I328Y317-P326 VanDerWaalsContact CZ-CD 3.47Å; Y317-P326 WeakPolarHBondContact OH-CD 3.44Å; P326-I328 PolarHBondContact O-N 3.07Å
327L80.8Confident74.5Confident71 Ų71103.2 Ų103.237%0.37254%0.544SS..  trans-86.6103.3176.7-96.270.5000110.5C293 R325 K329 Q331C293-L327 HydrophobicContact CB-CD1 3.82Å; C293-L327 HydrophobicContact CB-CD2 4.03Å; C293-L327 HydrophobicContact CB-CG 4.36Å; R325-L327 PolarHBondContact O-N 3.04Å; L327-K329 PolarHBondContact O-N 3.33Å; L327-Q331 HydrophobicContact CD2-CB 3.96Å
328I74.4Confident72.9Confident169 Ų169108.9 Ų108.987%0.86757%0.565SS**SBendtrans-61.2-26.1179.9-61.5170.2000112.3P326P326-I328 PolarHBondContact O-N 3.07Å
329K69.7Low71.6Confident176 Ų176109.6 Ų109.677%0.76556%0.561SS**SBendtrans-114.3127.8169.1-70.2178.3178.5175.70109L327 Q331L327-K329 PolarHBondContact O-N 3.33Å; K329-Q331 PolarHBondContact O-N 2.92Å
330P58.4Low70.6Confident123 Ų123108 Ų10880%0.79956%0.559SS**  trans-63.4124.2178.126.4-33.6000109.5K332P330-K332 PolarHBondContact O-N 3.17Å
331Q58.4Low70.3Confident68 Ų68105.1 Ų105.132%0.31857%0.565SS.*  trans-65.3121.9-172.2-160.4-149.3-12.700111.2C293 G294 L327 K329 R333C293-Q331 PolarHBondContact O-NE2 3.22Å; C293-Q331 PolarHBondContact O-OE1 2.67Å; G294-Q331 VanDerWaalsContact CA-NE2 3.31Å; G294-Q331 PolarHBondContact O-NE2 2.84Å; G294-Q331 VanDerWaalsContact O-NE2 3.07Å; L327-Q331 HydrophobicContact CD2-CB 3.96Å; K329-Q331 PolarHBondContact O-N 2.92Å; Q331-R333 VanDerWaalsContact C-N 3.25Å; Q331-R333 PolarHBondContact O-N 3.07Å; Q331-R333 VanDerWaalsContact OE1-CG 3.31Å
332K57Low70.3Confident196 Ų196104.6 Ų104.685%0.85256%0.562SS**  trans-66.489.8153.7-71.7-175.2178.4-178.70107.3P330 T334P330-K332 PolarHBondContact O-N 3.17Å; K332-T334 PolarHBondContact O-N 2.92Å
333R57.8Low70.6Confident136 Ų136104.8 Ų104.851%0.51356%0.556SS.*  trans-54.9116173.8-79.9-170.276.2-163.85.1108.8E289 Q331 S335E289-R333 IonicContact OE1-CZ 3.82Å; E289-R333 IonicContact OE1-NE 3.82Å; E289-R333 IonicContact OE1-NH2 3.58Å; E289-R333 PolarHBondContact OE1-NH2 2.7Å; Q331-R333 VanDerWaalsContact C-N 3.25Å; Q331-R333 PolarHBondContact O-N 3.07Å; Q331-R333 VanDerWaalsContact OE1-CG 3.31Å; R333-S335 PolarHBondContact O-N 3.42Å; R333-S335 PolarHBondContact O-OG 3.4Å
334T55.7Low71Confident63 Ų6399.7 Ų99.739%0.38753%0.529SS..G310 helixtrans-59.9-11.7-170.859.30000113.6K332 T336 S337K332-T334 PolarHBondContact O-N 2.92Å; T334-T336 PolarHBondContact O-N 3.23Å; T334-S337 WeakPolarHBondContact O-CB 3.31Å; T334-S337 PolarHBondContact O-N 3.32Å
335S56.8Low71.5Confident37 Ų3797.5 Ų97.526%0.25952%0.517SS..G310 helixtrans-42.8-10167.276.30000117.4R333 R339R333-S335 PolarHBondContact O-N 3.42Å; R333-S335 PolarHBondContact O-OG 3.4Å; S335-R339 WeakPolarHBondContact O-CG 3.36Å; S335-R339 PolarHBondContact O-NE 3.45Å; S335-R339 PolarHBondContact OG-NH2 2.76Å
336T56.4Low71.9Confident100 Ų10094.2 Ų94.261%0.61351%0.507SS*.G310 helixtrans-81.1-28.6169.9-60.40000112.8T334 R339T334-T336 PolarHBondContact O-N 3.23Å; T336-R339 WeakPolarHBondContact O-CB 3.29Å; T336-R339 PolarHBondContact O-N 3.44Å
337S54.8Low72.6Confident83 Ų8390.5 Ų90.558%0.5848%0.483SS*.G310 helixtrans-62.5-47.7-178.5-163.70000111.4T334 R339 I340T334-S337 WeakPolarHBondContact O-CB 3.31Å; T334-S337 PolarHBondContact O-N 3.32Å; S337-R339 PolarHBondContact O-N 3.11Å; S337-I340 WeakPolarHBondContact O-CG1 3.39Å; S337-I340 PolarHBondContact O-N 2.74Å
338R58.8Low73.3Confident178 Ų17892.4 Ų92.467%0.67249%0.49SS*.G310 helixtrans-68.426.1169.9-68.2-167.2-87.8-175.5-11.6114.2
339R64.5Low74.2Confident64 Ų6485.3 Ų85.324%0.24246%0.455CS..G310 helixtrans-131.88175.1-41-165.2-155.4170.69114.9S335 T336 S337 G341 L342 T352 W355S335-R339 WeakPolarHBondContact O-CG 3.36Å; S335-R339 PolarHBondContact O-NE 3.45Å; S335-R339 PolarHBondContact OG-NH2 2.76Å; T336-R339 WeakPolarHBondContact O-CB 3.29Å; T336-R339 PolarHBondContact O-N 3.44Å; S337-R339 PolarHBondContact O-N 3.11Å; R339-G341 PolarHBondContact O-N 3.31Å; R339-L342 HydrophobicContact CB-CD1 4.16Å; R339-L342 PolarHBondContact O-N 3.5Å; R339-L342 VanDerWaalsContact O-N 3.09Å; R339-T352 PolarHBondContact NH1-O 3.24Å; R339-W355 VanDerWaalsContact CD-NE1 3.27Å
340I69.1Low75.3Confident152 Ų15280.5 Ų80.578%0.77944%0.443SS*.THydrogen-bonded Turntrans-55.2125.9168.3-63.3162.4000107.5S337S337-I340 WeakPolarHBondContact O-CG1 3.39Å; S337-I340 PolarHBondContact O-N 2.74Å
341G81.9Confident76.9Confident80 Ų8078.6 Ų78.683%0.82543%0.429SS*.THydrogen-bonded Turntrans89.5-13.7-176.900000117R339 S343R339-G341 PolarHBondContact O-N 3.31Å; G341-S343 PolarHBondContact O-N 3.29Å
342L90.4Very high78.5Confident64 Ų6476.3 Ų76.334%0.33542%0.42SS..  trans-78.1118.7175.7-83.5111.5000111.8R339 S350 W355 P363R339-L342 HydrophobicContact CB-CD1 4.16Å; R339-L342 PolarHBondContact O-N 3.5Å; R339-L342 VanDerWaalsContact O-N 3.09Å; L342-S350 VanDerWaalsContact O-CA 3.3Å; L342-S350 WeakPolarHBondContact O-CA 3.24Å; L342-S350 WeakPolarHBondContact O-CB 3.26Å; L342-W355 HydrophobicContact CB-CH2 4.39Å; L342-W355 HydrophobicContact CB-CZ2 3.83Å; L342-W355 WeakPolarHBondContact O-CZ2 3.29Å; L342-P363 HydrophobicContact CD2-CB 4.08Å
343S94.8Very high80.1Confident54 Ų5471.7 Ų71.738%0.37841%0.409SS..  trans-116.6163.3172.169.60000111.1G341 W355G341-S343 PolarHBondContact O-N 3.29Å; S343-W355 VanDerWaalsContact C-CH2 3.48Å
344C96.1Very high81.8Confident0 Ų069.3 Ų69.30%041%0.405CS..  trans-89.1118.2177.4175.70000110.5N346 C347 Q348 T349 W355 P363 C365C344-N346 PolarHBondContact O-N 3.39Å; C344-N346 VanDerWaalsContact O-N 3.12Å; C344-C347 PolarHBondContact O-N 2.9Å; C344-C347 VanDerWaalsContact O-N 3.1Å; C344-Q348 VanDerWaalsContact O-CA 3.27Å; C344-Q348 WeakPolarHBondContact O-CA 3.39Å; C344-Q348 PolarHBondContact O-N 2.9Å; C344-T349 WeakPolarHBondContact CB-O 3.28Å; C344-T349 PolarHBondContact N-O 3.37Å; C344-W355 HydrophobicContact CB-CH2 4.43Å; C344-W355 HydrophobicContact CB-CZ3 4.01Å; C344-P363 WeakPolarHBondContact CA-O 3.4Å; C344-C365 HydrophobicContact CB-CB 3.99Å; C344-C365 PolarHBondContact SG-N 3.26Å
345A96.4Very high83.6Confident43 Ų4368.5 Ų68.536%0.35540%0.395SS..THydrogen-bonded Turntrans-49.3-43.8-179.400000113.2E362 P363 V364A345-E362 HydrophobicContact CB-CB 4.23Å; A345-P363 PolarHBondContact N-O 3.22Å; A345-V364 HydrophobicContact CB-CG1 4.3Å
346N96.3Very high85.5Confident41 Ų4171 Ų7122%0.21940%0.399CS..THydrogen-bonded Turntrans-77.9-24.7-178.3165.6-103000115.8C344 C368 R379 L381C344-N346 PolarHBondContact O-N 3.39Å; C344-N346 VanDerWaalsContact O-N 3.12Å; N346-C368 HydrophobicContact CB-CB 4.28Å; N346-C368 WeakPolarHBondContact OD1-CB 3.44Å; N346-C368 PolarHBondContact OD1-SG 3.24Å; N346-R379 PolarHBondContact ND2-O 3.36Å; N346-L381 WeakPolarHBondContact O-CD2 3.31Å
347C95.6Very high87.4Confident3 Ų375.4 Ų75.42%0.0240%0.404CS..THydrogen-bonded Turntrans-145.210.7-172.181.20000116.3C344 T349 L381 K384C344-C347 PolarHBondContact O-N 2.9Å; C344-C347 VanDerWaalsContact O-N 3.1Å; C347-T349 PolarHBondContact O-N 3.41Å; C347-T349 PolarHBondContact O-OG1 3.41Å; C347-T349 PolarHBondContact SG-OG1 3.5Å; C347-T349 VanDerWaalsContact SG-OG1 3.37Å; C347-L381 HydrophobicContact CB-CD2 3.92Å; C347-K384 PolarHBondContact O-NZ 3.35Å
348Q95.1Very high89.2Confident111 Ų11173.7 Ų73.752%0.51939%0.389SS..  trans562.8177.6-53.57828.700115.9C344 S350C344-Q348 VanDerWaalsContact O-CA 3.27Å; C344-Q348 WeakPolarHBondContact O-CA 3.39Å; C344-Q348 PolarHBondContact O-N 2.9Å; Q348-S350 PolarHBondContact O-N 2.98Å
349T93.9Very high90.9Very high20 Ų2070 Ų7012%0.12340%0.397CS..  trans-67.4114.4179.3-61.70000111.6C344 C347 T351 W355 K384C344-T349 WeakPolarHBondContact CB-O 3.28Å; C344-T349 PolarHBondContact N-O 3.37Å; C347-T349 PolarHBondContact O-N 3.41Å; C347-T349 PolarHBondContact O-OG1 3.41Å; C347-T349 PolarHBondContact SG-OG1 3.5Å; C347-T349 VanDerWaalsContact SG-OG1 3.37Å; T349-T351 VanDerWaalsContact C-N 3.34Å; T349-T351 VanDerWaalsContact CG2-O 3.24Å; T349-T351 WeakPolarHBondContact CG2-O 3.44Å; T349-W355 WeakPolarHBondContact O-CH2 3.47Å; T349-K384 WeakPolarHBondContact OG1-CE 3.46Å
350S93.3Very high92.3Very high75 Ų7573.6 Ų73.652%0.52442%0.416SS..  trans-79.5-13.5175.4-340000113.9L342 Q348 W355L342-S350 VanDerWaalsContact O-CA 3.3Å; L342-S350 WeakPolarHBondContact O-CA 3.24Å; L342-S350 WeakPolarHBondContact O-CB 3.26Å; Q348-S350 PolarHBondContact O-N 2.98Å; S350-W355 WeakPolarHBondContact O-CZ2 3.1Å
351T91.4Very high93.5Very high82 Ų8267.7 Ų67.750%0.50339%0.392SS..  trans-106.4106.8-175.648.60000111.5T349T349-T351 VanDerWaalsContact C-N 3.34Å; T349-T351 VanDerWaalsContact CG2-O 3.24Å; T349-T351 WeakPolarHBondContact CG2-O 3.44Å
352T92.8Very high94.1Very high21 Ų2168.3 Ų68.313%0.12937%0.374CS..  trans-143.7149.7178-159.80000114.5R339 L354 W355 C365 N366R339-T352 PolarHBondContact NH1-O 3.24Å; T352-L354 VanDerWaalsContact C-N 3.32Å; T352-L354 WeakPolarHBondContact CG2-O 3.18Å; T352-W355 HydrophobicContact CG2-CD2 3.44Å; T352-W355 VanDerWaalsContact CG2-CD2 3.44Å; T352-W355 HydrophobicContact CG2-CE3 3.82Å; T352-W355 HydrophobicContact CG2-CG 3.82Å; T352-W355 HydrophobicContact CG2-CH2 4.3Å; T352-W355 HydrophobicContact CG2-CZ2 4Å; T352-W355 HydrophobicContact CG2-CZ3 4.23Å; T352-C365 HydrophobicContact CG2-CB 4.2Å; T352-C365 WeakPolarHBondContact OG1-CB 3.49Å; T352-N366 PolarHBondContact OG1-N 2.94Å
353T91.2Very high94.3Very high99 Ų9967.6 Ų67.661%0.60737%0.373SS*.SBendtrans-70.5-27.2179.552.10000113I388T353-I388 HydrophobicContact CG2-CG2 3.77Å
354L92.3Very high94.4Very high85 Ų8565.3 Ų65.345%0.44536%0.357SS..SBendtrans-152.9126.3175.8173.363.4000108.7T352 N366T352-L354 VanDerWaalsContact C-N 3.32Å; T352-L354 WeakPolarHBondContact CG2-O 3.18Å; L354-N366 HydrophobicContact CB-CB 4.1Å; L354-N366 WeakPolarHBondContact O-CA 3.29Å; L354-N366 VanDerWaalsContact O-CB 3.31Å; L354-N366 WeakPolarHBondContact O-CB 3.48Å; L354-N366 PolarHBondContact O-N 2.89Å
355W94.6Very high94.5Very high46 Ų4665.6 Ų65.617%0.17436%0.359CS..EExtended strand (participates in β ladder)trans-78.3143.8166.9-72.3114.8000109.9R339 L342 S343 C344 T349 S350 T352 P363 C365R339-W355 VanDerWaalsContact CD-NE1 3.27Å; L342-W355 HydrophobicContact CB-CH2 4.39Å; L342-W355 HydrophobicContact CB-CZ2 3.83Å; L342-W355 WeakPolarHBondContact O-CZ2 3.29Å; S343-W355 VanDerWaalsContact C-CH2 3.48Å; C344-W355 HydrophobicContact CB-CH2 4.43Å; C344-W355 HydrophobicContact CB-CZ3 4.01Å; T349-W355 WeakPolarHBondContact O-CH2 3.47Å; S350-W355 WeakPolarHBondContact O-CZ2 3.1Å; T352-W355 HydrophobicContact CG2-CD2 3.44Å; T352-W355 VanDerWaalsContact CG2-CD2 3.44Å; T352-W355 HydrophobicContact CG2-CE3 3.82Å; T352-W355 HydrophobicContact CG2-CG 3.82Å; T352-W355 HydrophobicContact CG2-CH2 4.3Å; T352-W355 HydrophobicContact CG2-CZ2 4Å; T352-W355 HydrophobicContact CG2-CZ3 4.23Å; W355-P363 HydrophobicContact CE3-CB 4.27Å; W355-P363 HydrophobicContact CZ3-CB 4.44Å; W355-C365 HydrophobicContact CZ3-CB 4.45Å
356R95.5Very high94.5Very high90 Ų9065.2 Ų65.234%0.3435%0.351SS..EExtended strand (participates in β ladder)trans-127.5172.1174.2-65.4-179.2176.9-80.5-6.2108.5V364 N366R356-V364 HydrophobicContact CB-CG2 3.9Å; R356-V364 PolarHBondContact N-O 2.85Å; R356-V364 PolarHBondContact O-N 3Å; R356-N366 PolarHBondContact NE-OD1 3.19Å; R356-N366 PolarHBondContact NH2-OD1 3.34Å
357R95.8Very high94.5Very high192 Ų19265.2 Ų65.273%0.72536%0.357SS*.EExtended strand (participates in β ladder)trans-110.1150.2163.9-63.3-179.5-174.9-95.68109.8G361 E362R357-G361 VanDerWaalsContact CD-O 3.29Å; R357-G361 WeakPolarHBondContact CD-O 3.41Å; R357-G361 WeakPolarHBondContact CG-O 3.44Å; R357-G361 PolarHBondContact NH1-O 3.04Å; R357-E362 VanDerWaalsContact CA-O 3.24Å; R357-E362 WeakPolarHBondContact CA-O 3.36Å
358N94.4Very high94.6Very high47 Ų4765.2 Ų65.225%0.25136%0.357SS..  trans-80.9-171.4163.458.8-6.9000110.2E360 G361 E362 V364N358-E360 WeakPolarHBondContact CB-OE2 3.39Å; N358-E360 PolarHBondContact ND2-OE2 2.88Å; N358-E360 PolarHBondContact O-N 2.88Å; N358-G361 PolarHBondContact O-N 3.02Å; N358-G361 PolarHBondContact OD1-N 3.12Å; N358-G361 VanDerWaalsContact OD1-N 3.11Å; N358-E362 PolarHBondContact N-O 2.75Å; N358-E362 PolarHBondContact ND2-OE2 2.95Å; N358-E362 WeakPolarHBondContact OD1-CA 3.48Å; N358-E362 VanDerWaalsContact OD1-CB 3.31Å; N358-E362 WeakPolarHBondContact OD1-CB 3.21Å; N358-E362 PolarHBondContact OD1-N 2.78Å; N358-E362 PolarHBondContact OD1-O 3.25Å; N358-V364 HydrophobicContact CB-CG1 4.1Å
359A93.9Very high94.7Very high101 Ų10160.8 Ų60.884%0.83534%0.341SS*.THydrogen-bonded Turntrans-69.4-27.6179.100000111.4G361A359-G361 PolarHBondContact O-N 3.32Å
360E93.9Very high94.8Very high140 Ų14063.8 Ų63.865%0.65436%0.356SS*.THydrogen-bonded Turntrans-78.1-8179-54.268.9-152.600112.2N358 E362N358-E360 WeakPolarHBondContact CB-OE2 3.39Å; N358-E360 PolarHBondContact ND2-OE2 2.88Å; N358-E360 PolarHBondContact O-N 2.88Å; E360-E362 HydrophobicContact CB-CG 4.22Å; E360-E362 PolarHBondContact O-N 3.06Å
361G93.7Very high95.1Very high27 Ų2762.6 Ų62.628%0.27834%0.34SS..  trans86.4-6.6176.700000115.7R357 N358 A359R357-G361 VanDerWaalsContact CD-O 3.29Å; R357-G361 WeakPolarHBondContact CD-O 3.41Å; R357-G361 WeakPolarHBondContact CG-O 3.44Å; R357-G361 PolarHBondContact NH1-O 3.04Å; N358-G361 PolarHBondContact O-N 3.02Å; N358-G361 PolarHBondContact OD1-N 3.12Å; N358-G361 VanDerWaalsContact OD1-N 3.11Å; A359-G361 PolarHBondContact O-N 3.32Å
362E94.8Very high95.3Very high93 Ų9361.3 Ų61.344%0.43533%0.332SS..  trans-66.9153.6180-50.9179.4111.600113.5A345 R357 N358 E360 V364A345-E362 HydrophobicContact CB-CB 4.23Å; R357-E362 VanDerWaalsContact CA-O 3.24Å; R357-E362 WeakPolarHBondContact CA-O 3.36Å; N358-E362 PolarHBondContact N-O 2.75Å; N358-E362 PolarHBondContact ND2-OE2 2.95Å; N358-E362 WeakPolarHBondContact OD1-CA 3.48Å; N358-E362 VanDerWaalsContact OD1-CB 3.31Å; N358-E362 WeakPolarHBondContact OD1-CB 3.21Å; N358-E362 PolarHBondContact OD1-N 2.78Å; N358-E362 PolarHBondContact OD1-O 3.25Å; E360-E362 HydrophobicContact CB-CG 4.22Å; E360-E362 PolarHBondContact O-N 3.06Å; E362-V364 PolarHBondContact O-N 3.12Å
363P95.7Very high95.5Very high49 Ų4969.3 Ų69.332%0.31837%0.365SS..EExtended strand (participates in β ladder)trans-69.8122.6176.328.7-34.5000112.7L342 C344 A345 W355L342-P363 HydrophobicContact CD2-CB 4.08Å; C344-P363 WeakPolarHBondContact CA-O 3.4Å; A345-P363 PolarHBondContact N-O 3.22Å; W355-P363 HydrophobicContact CE3-CB 4.27Å; W355-P363 HydrophobicContact CZ3-CB 4.44Å
364V96.6Very high95.8Very high7 Ų771 Ų714%0.04237%0.37CS..EExtended strand (participates in β ladder)trans-126.7145.6172-58.70000111.8A345 R356 N358 E362A345-V364 HydrophobicContact CB-CG1 4.3Å; R356-V364 HydrophobicContact CB-CG2 3.9Å; R356-V364 PolarHBondContact N-O 2.85Å; R356-V364 PolarHBondContact O-N 3Å; N358-V364 HydrophobicContact CB-CG1 4.1Å; E362-V364 PolarHBondContact O-N 3.12Å
365C96.8Very high96Very high5 Ų571.9 Ų71.93%0.03437%0.371CS..EExtended strand (participates in β ladder)trans-70.1157.4179.4900000111.7C344 T352 W355 A367 C368 G369C344-C365 HydrophobicContact CB-CB 3.99Å; C344-C365 PolarHBondContact SG-N 3.26Å; T352-C365 HydrophobicContact CG2-CB 4.2Å; T352-C365 WeakPolarHBondContact OG1-CB 3.49Å; W355-C365 HydrophobicContact CZ3-CB 4.45Å; C365-A367 PolarHBondContact O-N 2.89Å; C365-A367 VanDerWaalsContact O-N 3.11Å; C365-C368 PolarHBondContact O-N 2.79Å; C365-C368 VanDerWaalsContact O-N 3.11Å; C365-C368 PolarHBondContact SG-SG 3.35Å; C365-G369 PolarHBondContact O-N 2.82Å
366N97.3Very high96.1Very high36 Ų3672.8 Ų72.819%0.19340%0.395CS..Hα-helixtrans-53-38.1-177.7-175.757.6000113.6T352 L354 R356 L370T352-N366 PolarHBondContact OG1-N 2.94Å; L354-N366 HydrophobicContact CB-CB 4.1Å; L354-N366 WeakPolarHBondContact O-CA 3.29Å; L354-N366 VanDerWaalsContact O-CB 3.31Å; L354-N366 WeakPolarHBondContact O-CB 3.48Å; L354-N366 PolarHBondContact O-N 2.89Å; R356-N366 PolarHBondContact NE-OD1 3.19Å; R356-N366 PolarHBondContact NH2-OD1 3.34Å; N366-L370 WeakPolarHBondContact ND2-CD1 3.45Å; N366-L370 VanDerWaalsContact O-CB 3.29Å; N366-L370 WeakPolarHBondContact O-CB 3.34Å; N366-L370 WeakPolarHBondContact O-CD1 3.46Å; N366-L370 WeakPolarHBondContact O-CG 3.44Å; N366-L370 PolarHBondContact O-N 3.06Å; N366-L370 VanDerWaalsContact O-N 3.12Å
367A96.9Very high96.1Very high41 Ų4172 Ų7234%0.33940%0.4SS..Hα-helixtrans-71-38.7-17800000112.5C365 Y371C365-A367 PolarHBondContact O-N 2.89Å; C365-A367 VanDerWaalsContact O-N 3.11Å; A367-Y371 VanDerWaalsContact O-CB 3.31Å; A367-Y371 WeakPolarHBondContact O-CB 3.31Å; A367-Y371 PolarHBondContact O-N 2.82Å
368C97.3Very high96.1Very high3 Ų367.2 Ų67.22%0.0239%0.394CS..Hα-helixtrans-72.5-48.2179.2-56.80000111N346 C365 L370 Y371 T372 R379N346-C368 HydrophobicContact CB-CB 4.28Å; N346-C368 WeakPolarHBondContact OD1-CB 3.44Å; N346-C368 PolarHBondContact OD1-SG 3.24Å; C365-C368 PolarHBondContact O-N 2.79Å; C365-C368 VanDerWaalsContact O-N 3.11Å; C365-C368 PolarHBondContact SG-SG 3.35Å; C368-L370 VanDerWaalsContact C-N 3.27Å; C368-L370 PolarHBondContact O-N 2.98Å; C368-Y371 PolarHBondContact O-N 3.09Å; C368-Y371 VanDerWaalsContact O-N 3.12Å; C368-T372 PolarHBondContact O-N 2.76Å; C368-T372 PolarHBondContact O-OG1 3.06Å; C368-R379 HydrophobicContact CB-CB 4.43Å
369G96.9Very high96.2Very high18 Ų1867 Ų6719%0.18639%0.39CS..Hα-helixtrans-64.4-26.6177.600000114.3C365 K373C365-G369 PolarHBondContact O-N 2.82Å; G369-K373 WeakPolarHBondContact O-CB 3.3Å; G369-K373 PolarHBondContact O-N 3.12Å
370L96.8Very high96.3Very high83 Ų8364.9 Ų64.944%0.43537%0.367SS..Hα-helixtrans-77.5-39.3170.4-74.6173.9000112.6N366 C368 K373 L374N366-L370 WeakPolarHBondContact ND2-CD1 3.45Å; N366-L370 VanDerWaalsContact O-CB 3.29Å; N366-L370 WeakPolarHBondContact O-CB 3.34Å; N366-L370 WeakPolarHBondContact O-CD1 3.46Å; N366-L370 WeakPolarHBondContact O-CG 3.44Å; N366-L370 PolarHBondContact O-N 3.06Å; N366-L370 VanDerWaalsContact O-N 3.12Å; C368-L370 VanDerWaalsContact C-N 3.27Å; C368-L370 PolarHBondContact O-N 2.98Å; L370-K373 PolarHBondContact O-N 3.28Å; L370-L374 WeakPolarHBondContact O-CB 3.34Å; L370-L374 PolarHBondContact O-N 3.04Å; L370-L374 VanDerWaalsContact O-N 3.12Å
371Y97.8Very high96.4Very high50 Ų5063 Ų6320%0.19636%0.361CS..Hα-helixtrans-63.2-51.1178.6-176-86.6000111.2A367 C368 K373 L374 H375 V377 P378 R379 P380 M383A367-Y371 VanDerWaalsContact O-CB 3.31Å; A367-Y371 WeakPolarHBondContact O-CB 3.31Å; A367-Y371 PolarHBondContact O-N 2.82Å; C368-Y371 PolarHBondContact O-N 3.09Å; C368-Y371 VanDerWaalsContact O-N 3.12Å; Y371-K373 VanDerWaalsContact C-N 3.33Å; Y371-K373 PolarHBondContact O-N 3.38Å; Y371-L374 PolarHBondContact O-N 3.26Å; Y371-H375 AromaticContact CD2-CD2 3.46Å; Y371-H375 VanDerWaalsContact CD2-CD2 3.46Å; Y371-H375 WeakPolarHBondContact CD2-CD2 3.47Å; Y371-H375 AromaticContact CD2-NE2 3.9Å; Y371-H375 HydrophobicContact CE1-CB 4.24Å; Y371-H375 AromaticContact CE2-CD2 3.44Å; Y371-H375 VanDerWaalsContact CE2-CD2 3.44Å; Y371-H375 WeakPolarHBondContact CE2-CD2 3.48Å; Y371-H375 AromaticContact CE2-NE2 3.79Å; Y371-H375 AromaticContact CG-CD2 3.78Å; Y371-H375 AromaticContact CZ-CD2 3.76Å; Y371-H375 PolarHBondContact O-CD2 3.05Å; Y371-H375 VanDerWaalsContact O-CD2 3.32Å; Y371-H375 PolarHBondContact O-N 3.11Å; Y371-V377 HydrophobicContact CE1-CG2 3.99Å; Y371-P378 WeakPolarHBondContact CE1-O 3.24Å; Y371-R379 HydrophobicContact CD1-CB 3.65Å; Y371-R379 HydrophobicContact CD1-CG 4.16Å; Y371-R379 HydrophobicContact CD2-CG 4.22Å; Y371-R379 HydrophobicContact CE1-CB 4.25Å; Y371-R379 HydrophobicContact CG-CB 3.82Å; Y371-R379 HydrophobicContact CG-CG 3.94Å; Y371-P380 WeakPolarHBondContact OH-CD 3.27Å; Y371-M383 HydrophobicContact CE2-CE 4.41Å; Y371-M383 HydrophobicContact CE2-SD 3.87Å
372T97.2Very high96.4Very high55 Ų5566.8 Ų66.834%0.33739%0.389SS..Hα-helixtrans-66.1-33179.7-56.30000112.5C368 L374 G376 V377C368-T372 PolarHBondContact O-N 2.76Å; C368-T372 PolarHBondContact O-OG1 3.06Å; T372-L374 VanDerWaalsContact C-N 3.29Å; T372-L374 PolarHBondContact O-N 3.42Å; T372-G376 VanDerWaalsContact O-CA 3.29Å; T372-G376 WeakPolarHBondContact O-CA 3.47Å; T372-G376 PolarHBondContact O-N 3.11Å; T372-V377 VanDerWaalsContact CA-O 3.28Å; T372-V377 WeakPolarHBondContact CA-O 3.36Å; T372-V377 WeakPolarHBondContact CB-O 3.45Å; T372-V377 PolarHBondContact OG1-O 3.18Å
373K96.4Very high96.2Very high189 Ų18967.5 Ų67.582%0.82239%0.394SS*.Hα-helixtrans-67.5-26.3171.3-178.8161.8-178.21630113.6G369 L370 Y371G369-K373 WeakPolarHBondContact O-CB 3.3Å; G369-K373 PolarHBondContact O-N 3.12Å; L370-K373 PolarHBondContact O-N 3.28Å; Y371-K373 VanDerWaalsContact C-N 3.33Å; Y371-K373 PolarHBondContact O-N 3.38Å
374L97.3Very high96.1Very high135 Ų13568.6 Ų68.671%0.70739%0.394SS*.Hα-helixtrans-90.6-33.7-179.8-17760.1000113.3L370 Y371 T372L370-L374 WeakPolarHBondContact O-CB 3.34Å; L370-L374 PolarHBondContact O-N 3.04Å; L370-L374 VanDerWaalsContact O-N 3.12Å; Y371-L374 PolarHBondContact O-N 3.26Å; T372-L374 VanDerWaalsContact C-N 3.29Å; T372-L374 PolarHBondContact O-N 3.42Å
375H96.9Very high95.9Very high102 Ų10274.4 Ų74.447%0.47242%0.419SS..Hα-helixtrans-115.4-6.6-171.1-59.7-71.1000114.4Y371 V377Y371-H375 AromaticContact CD2-CD2 3.46Å; Y371-H375 VanDerWaalsContact CD2-CD2 3.46Å; Y371-H375 WeakPolarHBondContact CD2-CD2 3.47Å; Y371-H375 AromaticContact CD2-NE2 3.9Å; Y371-H375 HydrophobicContact CE1-CB 4.24Å; Y371-H375 AromaticContact CE2-CD2 3.44Å; Y371-H375 VanDerWaalsContact CE2-CD2 3.44Å; Y371-H375 WeakPolarHBondContact CE2-CD2 3.48Å; Y371-H375 AromaticContact CE2-NE2 3.79Å; Y371-H375 AromaticContact CG-CD2 3.78Å; Y371-H375 AromaticContact CZ-CD2 3.76Å; Y371-H375 PolarHBondContact O-CD2 3.05Å; Y371-H375 VanDerWaalsContact O-CD2 3.32Å; Y371-H375 PolarHBondContact O-N 3.11Å; H375-V377 HydrophobicContact CB-CG2 3.83Å; H375-V377 PolarHBondContact O-N 3.19Å
376G96Very high95.4Very high66 Ų6681.2 Ų81.268%0.6845%0.45SS*.SBendtrans73.4-15.2-175.900000115.3T372T372-G376 VanDerWaalsContact O-CA 3.29Å; T372-G376 WeakPolarHBondContact O-CA 3.47Å; T372-G376 PolarHBondContact O-N 3.11Å
377V96.1Very high94.9Very high74 Ų7481.6 Ų81.645%0.44846%0.462SS..SBendtrans-108.5156.3-174.7-72.80000113.4Y371 T372 H375Y371-V377 HydrophobicContact CE1-CG2 3.99Å; T372-V377 VanDerWaalsContact CA-O 3.28Å; T372-V377 WeakPolarHBondContact CA-O 3.36Å; T372-V377 WeakPolarHBondContact CB-O 3.45Å; T372-V377 PolarHBondContact OG1-O 3.18Å; H375-V377 HydrophobicContact CB-CG2 3.83Å; H375-V377 PolarHBondContact O-N 3.19Å
378P95.4Very high94.6Very high91 Ų9184 Ų8459%0.59147%0.469SS*.PPolyproline II helixtrans-59.8147.3171.525.2-35.1000111.6Y371Y371-P378 WeakPolarHBondContact CE1-O 3.24Å
379R96.9Very high94.1Very high43 Ų4389.8 Ų89.816%0.16250%0.495CS..PPolyproline II helixtrans-70.1126.2179.3-177175.1164.5-136.26.8110.4N346 C368 Y371 M383N346-R379 PolarHBondContact ND2-O 3.36Å; C368-R379 HydrophobicContact CB-CB 4.43Å; Y371-R379 HydrophobicContact CD1-CB 3.65Å; Y371-R379 HydrophobicContact CD1-CG 4.16Å; Y371-R379 HydrophobicContact CD2-CG 4.22Å; Y371-R379 HydrophobicContact CE1-CB 4.25Å; Y371-R379 HydrophobicContact CG-CB 3.82Å; Y371-R379 HydrophobicContact CG-CG 3.94Å; R379-M383 PolarHBondContact NH2-O 3.38Å
380P96.1Very high93.7Very high56 Ų5695.4 Ų95.436%0.36453%0.526SS..PPolyproline II helixtrans-68.7137.3178.927.2-34.1000110.9Y371 A382 M383Y371-P380 WeakPolarHBondContact OH-CD 3.27Å; P380-A382 PolarHBondContact O-N 3.12Å; P380-M383 HydrophobicContact CG-CB 4.47Å; P380-M383 HydrophobicContact CG-CG 3.95Å; P380-M383 HydrophobicContact CG-SD 3.78Å; P380-M383 PolarHBondContact O-N 2.74Å
381L94.8Very high93.1Very high101 Ų101101.7 Ų101.753%0.52954%0.544SS..G310 helixtrans-63.1-26.8-175.9-64.3179000113.1N346 C347 M383 K384N346-L381 WeakPolarHBondContact O-CD2 3.31Å; C347-L381 HydrophobicContact CB-CD2 3.92Å; L381-M383 PolarHBondContact O-N 3.1Å; L381-M383 VanDerWaalsContact O-N 3.14Å; L381-K384 WeakPolarHBondContact O-CB 3.09Å; L381-K384 PolarHBondContact O-N 3.36Å
382A93.7Very high92.3Very high105 Ų105109.5 Ų109.587%0.86858%0.579SS**G310 helixtrans-59.4-21.3172.200000113.8P380P380-A382 PolarHBondContact O-N 3.12Å
383M92Very high91.5Very high109 Ų109118.1 Ų118.154%0.53761%0.605SS.*G310 helixtrans-90.71.2173.2-64.2-177.280.900113.5Y371 R379 P380 L381Y371-M383 HydrophobicContact CE2-CE 4.41Å; Y371-M383 HydrophobicContact CE2-SD 3.87Å; R379-M383 PolarHBondContact NH2-O 3.38Å; P380-M383 HydrophobicContact CG-CB 4.47Å; P380-M383 HydrophobicContact CG-CG 3.95Å; P380-M383 HydrophobicContact CG-SD 3.78Å; P380-M383 PolarHBondContact O-N 2.74Å; L381-M383 PolarHBondContact O-N 3.1Å; L381-M383 VanDerWaalsContact O-N 3.14Å
384K92.5Very high90.7Very high71 Ų71118.5 Ų118.531%0.30961%0.607SS.*  trans-65.1140.6173.7-176.6175.8169.5171.90109.2C347 T349 L381C347-K384 PolarHBondContact O-NZ 3.35Å; T349-K384 WeakPolarHBondContact OG1-CE 3.46Å; L381-K384 WeakPolarHBondContact O-CB 3.09Å; L381-K384 PolarHBondContact O-N 3.36Å
385K92.4Very high89.4Confident129 Ų129117.7 Ų117.756%0.56161%0.609SS**  trans-128.7134.2169-179.3170.4179.8157.40108Q389K385-Q389 HydrophobicContact CD-CG 4.08Å
386E86.3Confident87.8Confident149 Ų149122.8 Ų122.870%0.69663%0.63SS**SBendtrans-69.6-41.4-173.6-153.753.2-144.100112.5
387G87.8Confident85.6Confident43 Ų43125.5 Ų125.544%0.44363%0.634SS.*SBendtrans-88.1129.5175.300000113.8Q389G387-Q389 PolarHBondContact O-N 3.22Å
388I89.4Confident83.7Confident93 Ų93129.5 Ų129.548%0.47765%0.652SS.*  trans-62.1115167.7-60178.3000109.2T353 T390T353-I388 HydrophobicContact CG2-CG2 3.77Å; I388-T390 PolarHBondContact O-N 3.37Å
389Q88.6Confident81.3Confident124 Ų124129.9 Ų129.958%0.57966%0.657SS**  trans-70.9121.2173.8-60-173.611.400110.7K385 G387K385-Q389 HydrophobicContact CD-CG 4.08Å; G387-Q389 PolarHBondContact O-N 3.22Å
390T87Confident79.1Confident135 Ų135135.2 Ų135.283%0.82868%0.681SS**  trans-78.4150.6167.557.60000110.1I388I388-T390 PolarHBondContact O-N 3.37Å
391R84.8Confident76.7Confident216 Ų216140.4 Ų140.482%0.81571%0.706SS**  trans-127.6131.7171.1-65.5-174-179.4-173.2-0.5108.3R393R391-R393 PolarHBondContact O-N 3.42Å
392K81.7Confident74.5Confident214 Ų214144.7 Ų144.793%0.9372%0.72SS**  trans-6596.1-179.9-171.7173.9-176.51770109.6K394K392-K394 PolarHBondContact O-N 2.84Å
393R79.5Confident72.2Confident235 Ų235143 Ų14389%0.88771%0.713SS**PPolyproline II helixtrans-65.3122.4173.3-77.4-178.5162.5178.3-5.7108.6R391R391-R393 PolarHBondContact O-N 3.42Å
394K79.8Confident69.6Low198 Ų198143.6 Ų143.686%0.86173%0.728SS**PPolyproline II helixtrans-56.9133.7161.1-66.8-175.5177.9-176.30107.4K392 K396K392-K394 PolarHBondContact O-N 2.84Å; K394-K396 PolarHBondContact O-N 2.89Å
395P70.9Confident67.1Low117 Ų117146.4 Ų146.476%0.7676%0.756SS**PPolyproline II helixtrans-59.7136.3175.825.7-33.3000109T397P395-T397 PolarHBondContact O-N 3.22Å
396K63.1Low64.4Low209 Ų209144 Ų14491%0.90977%0.768SS**  trans-69.7104.3171.2-79.9-168.7171.3-169.30108K394 L398K394-K396 PolarHBondContact O-N 2.89Å; K396-L398 PolarHBondContact O-N 2.98Å
397T49.6Very low62.3Low123 Ų123143.1 Ų143.176%0.75577%0.773SS**  trans-59.1106.4160.747.10000107.7P395 S399P395-T397 PolarHBondContact O-N 3.22Å; T397-S399 PolarHBondContact O-N 2.71Å
398L56.1Low59.9Low158 Ų158148.9 Ų148.983%0.82779%0.794SS**  trans-73.395.9174.5-17867.1000107.4K396 K400K396-L398 PolarHBondContact O-N 2.98Å; L398-K400 VanDerWaalsContact C-N 3.31Å; L398-K400 PolarHBondContact O-N 3.14Å
399S43.9Very low57.7Low99 Ų99152.2 Ų152.269%0.69281%0.812SS**  trans-61.789.7-179-570000110.8T397 N401T397-S399 PolarHBondContact O-N 2.71Å; S399-N401 VanDerWaalsContact C-N 3.32Å; S399-N401 PolarHBondContact O-N 2.93Å
400K51Low55.2Low156 Ų156152 Ų15268%0.67883%0.825SS**  trans-83.178-176.2-168.8170.5-175.5174.20109.2L398 K402L398-K400 VanDerWaalsContact C-N 3.31Å; L398-K400 PolarHBondContact O-N 3.14Å; K400-K402 VanDerWaalsContact C-N 3.3Å; K400-K402 PolarHBondContact O-N 3.15Å
401N45.8Very low53Low165 Ų165152 Ų15288%0.88282%0.824SS**  trans-63.391.8171.5-82.830.7000110.1S399S399-N401 VanDerWaalsContact C-N 3.32Å; S399-N401 PolarHBondContact O-N 2.93Å
402K49.4Very low50.5Low190 Ų190147.4 Ų147.483%0.82683%0.826SS**  trans-130.2120.5157-174.4152.6-176.1168.80106.6K400K400-K402 VanDerWaalsContact C-N 3.3Å; K400-K402 PolarHBondContact O-N 3.15Å
403G44.3Very low48.6Very low69 Ų69144.4 Ų144.471%0.71182%0.816SS**  trans-81.5174.3-165.700000115.3
404S37.3Very low46.7Very low123 Ų123139 Ų13986%0.8681%0.81SS**  trans81127.5166.9-57.20000119
405S40.8Very low45.1Very low129 Ų129135.8 Ų135.890%0.90281%0.809SS**  trans73.7115.5159.4-56.40000118.6
406G35.3Very low43.4Very low78 Ų78136.4 Ų136.480%0.80481%0.811SS**  trans146.979.4175.200000112.4
407T42Very low42.4Very low131 Ų131132.2 Ų132.280%0.80481%0.808SS**  trans-64.1133.6174.735.90000112.3
408N36.9Very low41.6Very low164 Ų164133.1 Ų133.188%0.87781%0.813SS**  trans-166.4150.8135.1-97.4-30.4000111.3
409N43.1Very low40.6Very low163 Ų163130.9 Ų130.987%0.87281%0.811SS**  trans-79.1133-170.7-75.7-20.9000113.5
410S37.1Very low40.3Very low121 Ų121132.1 Ų132.185%0.84682%0.82SS**  -177.9115.612732.90000110.4
411V40.9Very low39.5Very low133 Ų133129.5 Ų129.581%0.80682%0.821SS**  trans-96.3124.9166.9-158.10000107.5M413V411-M413 HydrophobicContact CG1-CG 4.18Å
412S32.4Very low38.9Very low121 Ų121129.6 Ų129.685%0.84682%0.822SS**  trans-116.1124.8169-172.40000108
413M40.6Very low38.3Very low150 Ų150125.5 Ų125.574%0.73982%0.817SS**  trans-128.8140.7-175.7-85.4-67-175.800111.3V411V411-M413 HydrophobicContact CG1-CG 4.18Å
414T40.9Very low38.1Very low121 Ų121131.1 Ų131.174%0.74283%0.825SS**  trans57.7125.1167.247.90000118.4
415P46Very low37.9Very low132 Ų132132.2 Ų132.286%0.85782%0.821SS**  trans-83.9126.8169.433.4-30.6000111.1
416T35.2Very low37.4Very low129 Ų129132 Ų13279%0.79182%0.818SS**  trans-113.4134.5164.4-62.30000108.8
417S41.2Very low37.4Very low122 Ų122132.8 Ų132.885%0.85381%0.811SS**  trans-77.3125.7-176.8-55.20000112.1
418T33.8Very low37.2Very low141 Ų141135.8 Ų135.887%0.86581%0.813SS**  trans-128.5124.7156.439.80000109.8
419S35.7Very low36.8Very low111 Ų111134.2 Ų134.278%0.77681%0.81SS**  trans-80.2126.4175.5470000110.7
420S35.8Very low36.3Very low125 Ų125131.9 Ų131.987%0.87481%0.806SS**  trans-91.8104.2161.356.10000109
421S35.8Very low36.2Very low101 Ų101131.8 Ų131.871%0.70681%0.805SS**  trans-69.5138.6177.8-53.30000111.6
422N33.5Very low36.5Very low167 Ų167131.5 Ų131.589%0.89381%0.806SS**  trans-127.3108.1152.2-88.2-8.5000107.5
423S35Very low36.4Very low104 Ų104131.8 Ų131.873%0.72781%0.808SS**  trans-67.1167.6150.348.80000108.6
424E41.2Very low36.1Very low188 Ų188129 Ų12988%0.87981%0.81SS**  cis-130.3176.125.4-68.9165.2104.600113.8
425D33.4Very low35.8Very low146 Ų146132.2 Ų132.278%0.78182%0.816SS**  trans-93.6153.9-162.7-154.3-35.3000113.3
426C30.3Very low35.1Very low124 Ų124132.1 Ų132.184%0.83881%0.812SS**  trans-151.3100.7161.6-173.30000110.6
427S35.7Very low34.9Very low95 Ų95131.5 Ų131.566%0.66481%0.813SS**  trans-160.3142.5170.9-86.90000107.7
428K36.2Very low34.4Very low193 Ų193129.3 Ų129.384%0.83981%0.81SS**  cis-155.1163.57.1-113.4167.6-178.3174.30107.9
429T29.1Very low34.4Very low132 Ų132129.5 Ų129.581%0.8181%0.811SS**  trans-135.5118.4156.3136.60000110.3
430S32.3Very low34.2Very low114 Ų114129 Ų12980%0.79781%0.807SS**  trans-170118.7170.6-650000105.7
431S35.5Very low34.2Very low118 Ų118127.9 Ų127.983%0.82580%0.799SS**  trans-89.5-173.6-166.1-40.10000112.1
432P48Very low34.2Very low127 Ų127128.4 Ų128.483%0.82580%0.803SS**  -116.9177.3-122.320.93.4000114.2
433S29.8Very low34.2Very low127 Ų127127.2 Ų127.289%0.88880%0.802SS**  trans-129.8143.6155.7-160.60000108.7
434A33Very low34.5Very low93 Ų93129.8 Ų129.877%0.76981%0.806SS**  trans-117.7143.2-163.300000112.8
435Q34.5Very low35Very low188 Ų188126.3 Ų126.388%0.87980%0.8SS**  trans-141.8132.8162.9-75.1-157.6-34.200111.6
436V31.4Very low35Very low129 Ų129123.6 Ų123.678%0.78280%0.798SS**  trans2.7142.5149-73.20000118.7
437S31.4Very low35.1Very low116 Ų116123.6 Ų123.681%0.81180%0.8SS**  cis-157169.51-81.90000107
438G30.4Very low34.9Very low76 Ų76122.9 Ų122.978%0.78481%0.807SS**  cis130.788.37.500000111.7
439V33.8Very low34.7Very low145 Ų145123.6 Ų123.688%0.87981%0.813SS**  trans-161.3147.8161.868.30000112.9
440S32.8Very low34.7Very low101 Ų101121.3 Ų121.371%0.70682%0.816SS**  trans-55.9168.7171.8-60.70000116.4
441S34.7Very low34.7Very low101 Ų101121.1 Ų121.171%0.70682%0.821SS**  cis-172.3158.7-14.3-93.90000110.9
442S35.5Very low34.3Very low113 Ų113119 Ų11979%0.7982%0.817SS**  trans66.6163.7163.5-50.70000116.4
443V35.2Very low33.6Very low142 Ų142119.4 Ų119.486%0.86182%0.823SS**  cis-143.6168.211.4-143.50000111.3
444L41.3Very low33.5Very low157 Ų157116.2 Ų116.282%0.82281%0.811SS**  trans-85.3-179.2164.3-70.7176000110.7
445P50.3Low33.5Very low115 Ų115118.1 Ų118.175%0.74782%0.819SS**  cis-146.9175.914.245.8-26.8000119.6
446A33.9Very low33.4Very low90 Ų90113 Ų11374%0.74481%0.808SS**  trans58.8171.1148.100000118.9
447S32.2Very low33.4Very low124 Ų124113.1 Ų113.187%0.86781%0.809SS**  cis-145.1162.2-0-49.60000109.4
448G32.1Very low33.3Very low79 Ų79116.9 Ų116.981%0.81481%0.811SS**  trans160.485166.300000116.2
449E31.2Very low33.2Very low209 Ų209122.7 Ų122.798%0.97781%0.81SS**  trans-90.6153.9172.9-65.5171.999.100111.9
450G30.1Very low33.7Very low84 Ų84121.7 Ų121.787%0.86681%0.807SS**  trans179.9100.5175.100000111.8
451A30.8Very low33.7Very low110 Ų110120.2 Ų120.291%0.90981%0.808SS**  trans-122.6149.9-169.700000113.7
452G28.2Very low33.7Very low72 Ų72122.9 Ų122.974%0.74281%0.809SS**  trans110.2133.2141.300000118.7
453S32.1Very low33.5Very low136 Ų136123 Ų12395%0.95180%0.8SS**  trans67.2146.9159.8-124.70000118.5
454G29.3Very low33.3Very low60 Ų60120.6 Ų120.662%0.61979%0.79SS**  cis157.8148.4-900000112.9
455S32.3Very low33.1Very low134 Ų134120.2 Ų120.294%0.93779%0.788SS**  trans66.6153.6174.1-81.50000117
456A31.6Very low32.2Very low80 Ų80123.7 Ų123.766%0.66179%0.788SS**  cis-154.3149.5-0.800000113.5
457V32Very low32.2Very low131 Ų131124 Ų12479%0.79478%0.78SS**  trans43.8121.8133.8-174.10000117.9
458K29.9Very low32.2Very low195 Ų195122.4 Ų122.485%0.84877%0.769SS**  -163.214770-160.8137.5178.2173.50115.7
459Y27.8Very low32.1Very low198 Ų198125.8 Ų125.878%0.77677%0.774SS**  trans-81.8175.2170.2-102.4-112.6000111.7
460P44.2Very low32.2Very low124 Ų124119 Ų11981%0.80576%0.761SS**  cis-139.9170.731.841.6-22000119.4
461G33Very low32.3Very low70 Ų70123 Ų12372%0.72276%0.761SS**  trans-177.655.7177.900000113.7
462Q34.4Very low32.3Very low158 Ų158124 Ų12474%0.73876%0.756SS**  trans-86159.3169.1-79178.2-86.200110.1
463D30.7Very low32.6Very low114 Ų114128.9 Ų128.961%0.6176%0.759SS**  cis-155.8146.8-3.9-118-33.9000108.9
464S32.9Very low32.8Very low93 Ų93126.8 Ų126.865%0.6575%0.745SS**  58.813998.3-61.50000116.6
465L37.1Very low33.1Very low149 Ų149127.9 Ų127.978%0.7874%0.743SS**  cis-142.8-135.25-124163.7000109.3
466Y30.3Very low33.2Very low188 Ų188127.8 Ų127.874%0.73773%0.732SS**  cis-154.9173.75.6-167.7-110.6000113.1
467T33.6Very low33.4Very low95 Ų95128.5 Ų128.558%0.58373%0.728SS**  trans-74.8175178.9-19.60000113.1
468S32.6Very low33.6Very low91 Ų91124.8 Ų124.864%0.63671%0.711SS**  cis-162.6175.135.1-57.50000115.3
469V30.7Very low34Very low151 Ų151119 Ų11992%0.91570%0.695SS**  trans-74165.9176-71.60000117.5
470G31.6Very low34.3Very low67 Ų67116.7 Ų116.769%0.69170%0.701SS**  trans156100.5143.700000123.6
471L32.8Very low34.1Very low168 Ų168122.6 Ų122.688%0.8871%0.707SS**  66.9149.6129.5-59.7173.8000126.9
472T31.6Very low34Very low130 Ų130122.9 Ų122.980%0.79871%0.71SS**  trans67.3139.7163.251.60000119.8
473Q34.5Very low34.3Very low174 Ų174123.7 Ų123.781%0.81371%0.714SS**  cis89137.924.9-170.1172.5-4.900113.7
474S35.8Very low35.6Very low93 Ų93122.6 Ų122.665%0.6571%0.713SS**  cis-153-175.419.1-128.70000109.6
475S36Very low35.9Very low83 Ų83129.3 Ų129.358%0.5873%0.725SS**  cis-169.7-175.5-22.742.30000110.2
476D34.3Very low36Very low131 Ų131126.7 Ų126.770%0.70172%0.717SS**  trans70.8143.4161.1-52.3-55.9000118.4
477V36.4Very low37Very low96 Ų96123.9 Ų123.958%0.58272%0.722SS**  cis-157.7-174.50.5-1090000107.2Q155Q155-V477 PolarHBondContact NE2-O 3.08Å
478A35.9Very low37.8Very low53 Ų53126.5 Ų126.544%0.43873%0.731SS.*  cis-156.4-155.8-20.400000106.5Q155 A156Q155-A478 CarbonylContact C-O 3.04Å; A156-A478 PolarHBondContact N-O 2.98Å
479S37.8Very low38.5Very low72 Ų72127 Ų12750%0.50374%0.741SS.*  trans-152.3155.3179.3-51.90000115.2A156A156-S479 PolarHBondContact N-OG 2.83Å; A156-S479 VanDerWaalsContact N-OG 3.08Å; A156-S479 PolarHBondContact O-OG 3.07Å
480V35Very low39.6Very low150 Ų150127.8 Ų127.891%0.90974%0.739SS**  trans-147.3161.2153172.80000110.6
481R38.7Very low40.1Very low248 Ų248133 Ų13394%0.93678%0.775SS**  trans-93.1162.2-168.9-46174.7-176.9-169.70115.3
482G30.3Very low40.5Very low76 Ų76131.2 Ų131.278%0.78477%0.77SS**  trans170.199.5155.500000117.3
483E42.5Very low41Very low176 Ų176131.3 Ų131.382%0.82277%0.769SS**  trans-161.1161.4175.2-93.2-76.5157.800106.4
484P56.7Low41.3Very low91 Ų91128.9 Ų128.959%0.59177%0.766SS**  cis-145.6-174.212.547.4-29.2000118.2
485W38.9Very low41.6Very low234 Ų234131 Ų13189%0.88677%0.773SS**  trans67.9160.7153.6-70.315.6000118.8
486C39.5Very low42Very low93 Ų93134 Ų13463%0.62879%0.785SS**  cis-161.5155.7-24.3-104.70000109.1
487P52.7Low42.5Very low129 Ų129134.2 Ų134.284%0.83879%0.791SS**  trans-81.1143.5175.932.9-34.1000113.2
488I50.1Low42.9Very low151 Ų151136.9 Ų136.977%0.77481%0.805SS**  trans-91.2143.5-179.2-71.6172.9000111.8L490I488-L490 HydrophobicContact CG2-CG 4.02Å
489A46.8Very low43.5Very low102 Ų102143.4 Ų143.484%0.84383%0.834SS**  trans-122.7143.1153.300000108.9
490L53Low44Very low166 Ų166149.3 Ų149.387%0.86986%0.861SS**  trans-114.4125.8-173.5-86.4158.5000111.2I488I488-L490 HydrophobicContact CG2-CG 4.02Å
491A43.3Very low44.8Very low176 Ų176149.3 Ų149.3100%1.45586%0.857SS**  trans1740143.800000109.4

Retrieved 491 of 491 residues in 72.5 ms (Link to these results)