A0A087YB36_POEFO Loading...

Polyadenylate-binding protein-interacting protein 1

AlphaFold DB , UniProt , Accession A0A087YB36, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 452 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
1M31.8Very low34Very low234 Ų234145.9 Ų145.9100%1.15381%0.814SS**  0127.10-71.2170.5172.900106.6
2N32.9Very low33.6Very low141 Ų141140.3 Ų140.375%0.75481%0.813SS**  trans34.3116.5162.3-55.534.6000118.4
3E36.1Very low33.7Very low164 Ų164149.3 Ų149.377%0.76683%0.825SS**  73.3138.264.4-75.7-163.4-118.300113.9
4N34.2Very low33.7Very low112 Ų112147.4 Ų147.460%0.59983%0.827SS**  cis-159.5-167.1-7.1-135-30000111.1
5F33.2Very low33.7Very low196 Ų196154.7 Ų154.786%0.8684%0.837SS**  trans101.6143164.6-69.1-77.4000118.8
6D35.1Very low33.3Very low124 Ų124150.1 Ų150.166%0.66384%0.837SS**  -154.7175.6-71.6-139.8-45.4000109.6
7R33.7Very low33Very low221 Ų221147.1 Ų147.183%0.83484%0.835SS**  trans-59.6157179.8-70.8174.4156.698.2-6.7115.9
8A37Very low34.1Very low94 Ų94145.9 Ų145.978%0.77784%0.835SS**  trans-80.8156.1152.500000112.1
9P41.2Very low33.8Very low132 Ų132143.8 Ų143.886%0.85784%0.837SS**  trans-128.4172141.737.7-27.7000112.1
10G29.2Very low33.5Very low70 Ų70144.3 Ų144.372%0.72284%0.836SS**  trans-140.8-142.4177.500000112.8
11A29.7Very low34.3Very low117 Ų117142.5 Ų142.597%0.96783%0.829SS**  trans76.9146.4-177.700000116.7
12G29.6Very low34.1Very low78 Ų78135.6 Ų135.680%0.80481%0.809SS**  trans158.761.1-178.500000115.2
13R34.9Very low33.9Very low258 Ų258137 Ų13797%0.97482%0.816SS**  trans-84138.8164.8-80.7-178171.9178-3.6109.7
14S33.1Very low33.7Very low122 Ų122133 Ų13385%0.85381%0.811SS**  trans-143.2149.4161.949.20000110.9
15R33.8Very low33.5Very low258 Ų258133.5 Ų133.597%0.97482%0.817SS**  trans-89.6157.6-177.1-69.3171.1165.2167.3-8.5111
16G27.7Very low33.4Very low81 Ų81131.9 Ų131.984%0.83582%0.818SS**  trans-147.5117.3167.300000112.3
17A28.6Very low33.2Very low98 Ų98130.3 Ų130.381%0.8182%0.822SS**  trans-176161.2170.600000108.4
18P51.7Low33.1Very low127 Ų127131.5 Ų131.583%0.82583%0.827SS**  cis-130.9165.7-39.538-24.8000112.2
19A28.6Very low32.8Very low106 Ų106134.6 Ų134.688%0.87683%0.83SS**  trans-166.6145.3156.300000111.4
20D28Very low32.3Very low153 Ų153132.1 Ų132.182%0.81883%0.828SS**  trans-144.5-177.3-179.8-150.414.4000106.8
21P50Low32.3Very low106 Ų106136 Ų13669%0.68883%0.833SS**  cis-121.9171.9-37.436.8-24.6000112.4
22A27.4Very low32.4Very low89 Ų89134 Ų13474%0.73682%0.816SS**  trans-171.7129.714800000114.8
23L30.1Very low32.4Very low171 Ų171140.1 Ų140.190%0.89582%0.82SS**  trans46.2139133.4-58.8175.8000120.6
24A30.3Very low32.1Very low80 Ų80132.3 Ų132.366%0.66181%0.811SS**  cis-169.7158.14.700000113.2
25V29.9Very low31.9Very low122 Ų122131.3 Ų131.374%0.73980%0.804SS**  trans53.9112.8144177.60000119
26N30.9Very low31.7Very low163 Ų163124.7 Ų124.787%0.87279%0.792SS**  -159.9151.5106.2-106.1-71.6000111.7
27A31.3Very low31.8Very low91 Ų91127.6 Ų127.675%0.75279%0.788SS**  trans-117.8154.5-174.600000112.1
28R31.3Very low31.8Very low246 Ų246130.8 Ų130.893%0.92879%0.791SS**  trans-159.592.8154.9-114.3169.6-168.4-168.71.8112.8
29D30.9Very low30.8Very low159 Ų159132.6 Ų132.685%0.8579%0.789SS**  19.1139128.2-154.61.9000119.8
30G31.1Very low31Very low79 Ų79139.4 Ų139.481%0.81479%0.792SS**  trans170.259-176.200000115
31D28.7Very low31.3Very low152 Ų152141 Ų14181%0.81379%0.794SS**  trans-84.9141.3-178.3-179.324.2000114.1
32A32Very low30.7Very low74 Ų74141.8 Ų141.861%0.61280%0.799SS**  trans168.2116.9135.100000114.9
33K30.8Very low31.1Very low207 Ų207145.8 Ų145.890%0.981%0.807SS**  trans61.3150.4148.4-59.2171.7-177.5175.10117.9
34A28.1Very low31.5Very low95 Ų95149.4 Ų149.479%0.78581%0.809SS**  cis-169.1-178.1-19.600000105.7
35S28.5Very low31.9Very low100 Ų100154.1 Ų154.170%0.69982%0.817SS**  cis-158.1124.89.7-165.10000112.3
36V30.1Very low32Very low120 Ų120154.3 Ų154.373%0.72782%0.821SS**  trans47.4127.9131.7-1760000121.1
37L28.5Very low32.3Very low142 Ų142158.1 Ų158.174%0.74382%0.823SS**  trans64.8124.1160.4-78.5165.4000119
38N29.1Very low32.4Very low165 Ų165159.6 Ų159.688%0.88283%0.828SS**  trans-139.3145.2134.4-144-5000109.5
39Q31.2Very low32.6Very low164 Ų164153.7 Ų153.777%0.76682%0.819SS**  trans-91.7157.7-176.3-64-177.64.300111.1
40R32.3Very low32.8Very low250 Ų250150.7 Ų150.794%0.94381%0.808SS**  trans-81115.8176.5-75.7175.9166.4160.9-6.9110.4
41E34.2Very low33.1Very low185 Ų185153.1 Ų153.186%0.86481%0.81SS**PPolyproline II helixtrans-83.6143158.2-69.3-167.5131.100110.1
42P38.5Very low33.3Very low123 Ų123154.9 Ų154.980%0.79981%0.811SS**PPolyproline II helixtrans-68.2143.4174.5-20.833.7000113.2
43L34.5Very low33.5Very low173 Ų173157 Ų15791%0.90682%0.818SS**PPolyproline II helixtrans-66.4140.3176.4-67.4166.3000111.4
44R38.9Very low33.5Very low247 Ų247156.3 Ų156.393%0.93282%0.818SS**PPolyproline II helixtrans-73.4135.9176.5-67.2-176.9-179.4178.51.1111.2
45Q38.5Very low33.5Very low179 Ų179157.1 Ų157.184%0.83682%0.818SS**PPolyproline II helixtrans-67.2147.8167.9-69.2176.2-17.300111.5
46P32.3Very low33.5Very low126 Ų126157.9 Ų157.982%0.81882%0.823SS**PPolyproline II helixtrans-70.7139174.730.3-34.4000111.3
47R37.5Very low33.7Very low244 Ų244159.8 Ų159.892%0.92183%0.827SS**  trans-96.7113.9173.1-78.9-176.8168.5-177.5-5.2110.8
48S32.6Very low33.7Very low121 Ų121161 Ų16185%0.84684%0.835SS**  trans-90.5122162.9450000110
49V35.9Very low33.8Very low122 Ų122156.9 Ų156.974%0.73982%0.824SS**  trans-143.9122.7171.1-177.80000108.5
50P35.6Very low33.7Very low96 Ų96155.8 Ų155.862%0.62383%0.828SS**PPolyproline II helixtrans-81.9146.8172.833.5-33.5000111.3
51P37.6Very low33.6Very low130 Ų130149 Ų14984%0.84483%0.826SS**PPolyproline II helixtrans-81.4123.8175.431.6-32.3000111.8
52F33.4Very low33.3Very low190 Ų190144 Ų14483%0.83382%0.824SS**PPolyproline II helixtrans-84.4150.4162.1-82.4-88.5000110.6
53P35.9Very low32.8Very low118 Ų118146.2 Ų146.277%0.76683%0.828SS**PPolyproline II helixtrans-85.6117.718032.4-32.4000112.2S55P53-S55 PolarHBondContact O-N 3.28Å
54E30.5Very low33.2Very low193 Ų193144 Ų14490%0.90282%0.824SS**  trans-83.8105.6170.7-72.6-165.1141.800111.9
55S27.3Very low32.5Very low112 Ų112135.8 Ų135.878%0.78382%0.817SS**  trans-78.7130.2155.958.70000109.7P53P53-S55 PolarHBondContact O-N 3.28Å
56S29.7Very low32Very low116 Ų116131.1 Ų131.181%0.81182%0.817SS**  trans-145.5124.8167.5-89.80000112.7
57I32.8Very low31.8Very low159 Ų159132 Ų13282%0.81582%0.815SS**  trans-102.3132.9173.8-56.3161.7000106.8
58N29.8Very low31.5Very low168 Ų168123.4 Ų123.490%0.89879%0.792SS**  trans-169.7167.8144.2-102.5-38.7000112.2
59A30.1Very low31.4Very low79 Ų79127.9 Ų127.965%0.65379%0.79SS**  trans-138.7173.8-163.900000114.5
60T29.4Very low31.2Very low140 Ų140127.9 Ų127.986%0.85979%0.79SS**  trans79.8139.2158.259.50000122
61A30.3Very low30.9Very low108 Ų108131.3 Ų131.389%0.89380%0.802SS**  trans77.8125.4154.200000120.4
62G27.6Very low30.4Very low80 Ų80128.3 Ų128.383%0.82580%0.796SS**  trans156.259.1169.800000118.2
63L29.7Very low30.6Very low169 Ų169124.7 Ų124.789%0.88579%0.794SS**  trans-101.9169.5162.3-83.4174000109.5
64P41.3Very low31Very low127 Ų127123.9 Ų123.983%0.82579%0.789SS**  cis-133.4-169.813.942.8-25.4000115.1
65G25.8Very low31Very low75 Ų75121.5 Ų121.577%0.77378%0.781SS**  trans-168.2-29.4173.700000122.9
66G26.3Very low31.3Very low81 Ų81123.5 Ų123.584%0.83578%0.778SS**  trans70.1175.6175.500000117.3
67D28.8Very low31.3Very low145 Ų145122.5 Ų122.578%0.77577%0.771SS**  cis-164.3164.4-17.6-175.932.7000110.9
68S30.7Very low31.1Very low63 Ų63120.9 Ų120.944%0.44177%0.769SS.*  trans71.1146.5164.1-67.20000117.5
69R31.4Very low31.2Very low214 Ų214118.4 Ų118.481%0.80876%0.764SS**  cis-165.3159.5-4.5-105.2166.1-122.9160.911.8105.3
70T30.9Very low31.8Very low122 Ų122120.7 Ų120.775%0.74877%0.772SS**  cis-156.1-166.410.6-6.40000106.5
71L30Very low31.7Very low168 Ų168116.6 Ų116.688%0.8876%0.758SS**  cis-161.31677.8-135.8172000108.2
72G27.7Very low31.6Very low68 Ų68123.1 Ų123.170%0.70176%0.762SS**  trans12389.5151.800000118
73S36.1Very low31.7Very low114 Ų114123.4 Ų123.480%0.79776%0.756SS**  trans-70179.6168-128.90000112.5
74P44.4Very low31.8Very low101 Ų101121.3 Ų121.366%0.65676%0.755SS**  cis-142.1148.24.224.21.5000119.5
75L31.6Very low31.4Very low142 Ų142121.5 Ų121.574%0.74375%0.754SS**  trans62.4152.9139.5-52.6171000119.3
76Q33.6Very low32.3Very low155 Ų155123.7 Ų123.772%0.72475%0.754SS**  cis-159.9133.8-9.5-118.2171.8-23.300109
77S28.7Very low32.4Very low95 Ų95131.4 Ų131.466%0.66476%0.759SS**  59.8147.7102.781.30000116.9
78V28.9Very low32.4Very low125 Ų125128 Ų12876%0.75876%0.757SS**  cis-148.9156.233.6178.60000111.3
79S31.9Very low32.5Very low116 Ų116130.3 Ų130.381%0.81177%0.773SS**  trans-122.9144.2160.6-49.90000110.7
80P43.1Very low32.5Very low126 Ų126126.3 Ų126.382%0.81877%0.768SS**  -144.5175.5116.337.3-22.3000112.4
81G26.6Very low32.7Very low55 Ų55126.3 Ų126.357%0.56776%0.763SS**  cis136.7110.3-5.800000113.2
82Y29.3Very low33.5Very low245 Ų245124.5 Ų124.596%0.96176%0.759SS**  trans68.1153.1175.4-47-82.1000115.5
83A29.9Very low34.1Very low85 Ų85128.4 Ų128.470%0.70276%0.764SS**  cis-156.3160.815.600000114.8
84S30.6Very low34.5Very low125 Ų125128.5 Ų128.587%0.87477%0.765SS**  trans65.2140.1144.7-58.90000123.5
85V33.8Very low34.4Very low132 Ų132130.4 Ų130.480%0.877%0.774SS**  trans-93.9158.6175.6-154.70000110.6
86P43.2Very low35.4Very low120 Ų120129.2 Ų129.278%0.77977%0.773SS**  -148.6128.4107.535.1-17.5000117.3
87R30.1Very low36.2Very low244 Ų244133.3 Ų133.392%0.92178%0.781SS**  53.5109.6127.9-165.5-174-127-140.82.3120.1
88G28.8Very low37.1Very low73 Ų73135.5 Ų135.575%0.75379%0.791SS**  trans178.7102.815700000116.5
89S31.1Very low37.9Very low111 Ų111134.7 Ų134.778%0.77679%0.791SS**  trans49.8125.5153.2-163.60000121.7
90N33.1Very low39.1Very low130 Ų130136 Ų13670%0.69580%0.795SS**  trans14.3143.8132-62.453.4000119.6
91D35Very low39.5Very low122 Ų122137.4 Ų137.465%0.65279%0.794SS**  cis-159.4173.415.8-132-47.7000114.2D93D91-D93 PolarHBondContact O-N 3.22Å
92V46.1Very low41Very low131 Ų131138.9 Ų138.979%0.79480%0.796SS**  trans296.9169.1-74.20000120.5
93D41.4Very low42.3Very low149 Ų149132.4 Ų132.480%0.79779%0.793SS**  trans-163.579142-146.8-12.5000114.2D91D91-D93 PolarHBondContact O-N 3.22Å
94S42.7Very low43.4Very low117 Ų117133.4 Ų133.482%0.81880%0.795SS**  trans-151.127.7177.585.30000116.6
95V44.1Very low44.7Very low140 Ų140130.6 Ų130.685%0.84878%0.779SS**SBendtrans-118.730.3176.8-161.40000111.6
96V50.7Low45.9Very low118 Ų118130.4 Ų130.472%0.71578%0.781SS**  trans-136.279.1174.8-1700000111
97R51.4Low46.5Very low240 Ų240133 Ų13391%0.90678%0.782SS**SBendtrans174.983.5150.3-98.6157.3-173.4-171.33.4113.8
98T48.4Very low47.6Very low141 Ų141130.5 Ų130.587%0.86578%0.778SS**  trans-161.818.6149.514.20000114.5T100T98-T100 PolarHBondContact O-N 3.28Å
99S45.2Very low48.5Very low108 Ų108132 Ų13276%0.75577%0.773SS**  trans-81.6107.9176.6-56.30000111.6L101S99-L101 PolarHBondContact O-N 2.77Å; S99-L101 VanDerWaalsContact O-N 3.13Å
100T57.4Low49Very low145 Ų145131.4 Ų131.489%0.8977%0.766SS**  trans-85.450.2171.955.20000111.7T98T98-T100 PolarHBondContact O-N 3.28Å
101L51.3Low49.5Very low154 Ų154135.8 Ų135.881%0.80678%0.78SS**  trans-106.6129.1175.4-62.9178.6000109S99S99-L101 PolarHBondContact O-N 2.77Å; S99-L101 VanDerWaalsContact O-N 3.13Å
102S56.9Low50.2Low86 Ų86133 Ų13360%0.60178%0.78SS**  trans-77.7128.5179.2-1770000110.6S104 A105S102-S104 PolarHBondContact O-N 3.05Å; S102-S104 PolarHBondContact OG-N 3.38Å; S102-A105 PolarHBondContact O-N 3.47Å
103A56.5Low49.8Very low110 Ų110135.7 Ų135.791%0.90979%0.786SS**THydrogen-bonded Turntrans-72.119.2170.100000113.3
104S54.2Low49.4Very low105 Ų105132.4 Ų132.473%0.73479%0.787SS**THydrogen-bonded Turntrans-13823.5179.9-470000111.7S102S102-S104 PolarHBondContact O-N 3.05Å; S102-S104 PolarHBondContact OG-N 3.38Å
105A58.2Low49Very low66 Ų66132 Ų13255%0.54578%0.784SS.*PPolyproline II helixtrans-66.9138.4168.500000109.7S102 E107S102-A105 PolarHBondContact O-N 3.47Å; A105-E107 PolarHBondContact O-N 2.64Å
106P57.7Low49.2Very low128 Ų128135.9 Ų135.983%0.83179%0.785SS**PPolyproline II helixtrans-60128.1165.4-18.932000109F108P106-F108 PolarHBondContact O-N 2.7Å
107E57.3Low48.6Very low175 Ų175138.2 Ų138.282%0.81879%0.789SS**PPolyproline II helixtrans-67.9127.5178.7-69.2-174.3130.800110.4A105 V109A105-E107 PolarHBondContact O-N 2.64Å; E107-V109 HydrophobicContact CB-CG2 4.11Å; E107-V109 PolarHBondContact O-N 3Å
108F52.4Low48.4Very low191 Ų191136.3 Ų136.384%0.83879%0.79SS**  trans-76.9104.9162.4-176.2-89.2000107.1P106 P110P106-F108 PolarHBondContact O-N 2.7Å; F108-P110 HydrophobicContact CD1-CG 4.43Å; F108-P110 HydrophobicContact CE1-CG 4.47Å; F108-P110 WeakPolarHBondContact O-CD 3.35Å
109V48.2Very low47.9Very low104 Ų104137.6 Ų137.663%0.6379%0.791SS**  trans-95.3110.4-178.4-172.60000109E107 F111E107-V109 HydrophobicContact CB-CG2 4.11Å; E107-V109 PolarHBondContact O-N 3Å; V109-F111 PolarHBondContact O-N 3.41Å
110P40.5Very low47.6Very low99 Ų99135.2 Ų135.264%0.64378%0.783SS**  trans-68.7121.1171.8-14.530.8000109.1F108 G112F108-P110 HydrophobicContact CD1-CG 4.43Å; F108-P110 HydrophobicContact CE1-CG 4.47Å; F108-P110 WeakPolarHBondContact O-CD 3.35Å; P110-G112 PolarHBondContact O-N 3.28Å
111F43.3Very low47Very low223 Ų223139.4 Ų139.498%0.97878%0.784SS**SBendtrans-69.1101.1173.4-120.7-89.4000108.8V109V109-F111 PolarHBondContact O-N 3.41Å
112G50.6Low46.6Very low63 Ų63143.1 Ų143.165%0.64979%0.789SS**  trans162.126.8-177.800000119.7P110P110-G112 PolarHBondContact O-N 3.28Å
113M36.5Very low46.4Very low187 Ų187146.7 Ų146.792%0.92180%0.802SS**  trans-146.8103.9162.4-129.5101.7-156.100110.9
114G34.8Very low45.7Very low81 Ų81149.1 Ų149.184%0.83580%0.799SS**PPolyproline II helixtrans-71.912917600000111.4
115S33.8Very low45.6Very low108 Ų108150.2 Ų150.276%0.75580%0.797SS**PPolyproline II helixtrans-66129.3163.649.50000109.3E117S115-E117 PolarHBondContact O-N 3.07Å
116Y47.3Very low45.1Very low221 Ų221153.8 Ų153.887%0.86781%0.807SS**PPolyproline II helixtrans-67.2120.2172.461-80.4000109.3
117E38.8Very low44.8Very low168 Ų168153.4 Ų153.479%0.78581%0.807SS**  trans-121129.6160-72.3-160.3135.500108.5S115 L119S115-E117 PolarHBondContact O-N 3.07Å; E117-L119 VanDerWaalsContact C-N 3.34Å; E117-L119 PolarHBondContact O-N 3.4Å
118E48Very low44.5Very low199 Ų199156.3 Ų156.393%0.9381%0.812SS**  trans-79.879.1-170.4-168.7178.9159.800110.6
119L38Very low44.6Very low168 Ų168152.8 Ų152.888%0.8881%0.811SS**  trans-78125.2173.7-90.5162.5000110.9E117E117-L119 VanDerWaalsContact C-N 3.34Å; E117-L119 PolarHBondContact O-N 3.4Å
120G38.1Very low44.6Very low58 Ų58157 Ų15760%0.59882%0.824SS**  trans-72.9152-168.600000114.9Y122G120-Y122 PolarHBondContact O-N 3.47Å; G120-Y122 VanDerWaalsContact O-N 3.17Å
121Y45.6Very low45Very low234 Ų234157.7 Ų157.792%0.91883%0.831SS**  trans-48.1114175.7-71.1-100.4000113.3
122Y42.1Very low45.4Very low231 Ų231158.1 Ų158.191%0.90683%0.828SS**  trans-130.7135.5145.5-78.1-78.5000109.1G120G120-Y122 PolarHBondContact O-N 3.47Å; G120-Y122 VanDerWaalsContact O-N 3.17Å
123D51.7Low45.5Very low162 Ų162165.6 Ų165.687%0.86684%0.838SS**  trans-87.2109.2-179.5178.333.3000108.4
124D41.7Very low46.5Very low161 Ų161161.6 Ų161.686%0.86183%0.829SS**  trans-150.9143.5164.5-128.4-29.7000109.8
125N52.5Low48Very low127 Ų127165.6 Ų165.668%0.67983%0.831SS**  trans-96.4171.3-164.5-169.548000113
126D48.4Very low50.2Low142 Ų142163 Ų16376%0.75981%0.812SS**  trans6857.6164.9-57.3-47.9000118.4
127S50.8Low52.3Low119 Ų119154.7 Ų154.783%0.83279%0.787SS**  trans-159.284146.6-1650000113.3
128Y51.8Low54.9Low236 Ų236147.1 Ų147.193%0.92575%0.752SS**  trans-150.851.6179-148.7-91.7000114.4
129S53.8Low57.1Low117 Ų117139 Ų13982%0.81872%0.719SS**SBendtrans-156.625.8174.8-165.90000116.5
130E49.1Very low59.7Low193 Ų193135 Ų13590%0.90270%0.698SS**SBendtrans-144.747-172.8-142155.4-137.700114.2
131S47.7Very low62.3Low113 Ų113133 Ų13379%0.7967%0.674SS**SBendtrans-146.630.4-179.3-1510000114.4
132Y51.3Low64.6Low233 Ų233121.8 Ų121.891%0.91463%0.63SS**  trans-128.9-2178.4-99.8-79.8000115.3S134Y132-S134 PolarHBondContact O-N 2.71Å
133Y54Low67.1Low220 Ų220113.4 Ų113.486%0.86360%0.603SS**  trans-83.5111.6162.4-65.4-71.6000108.1D135Y133-D135 PolarHBondContact O-N 3.16Å
134S57.9Low69Low103 Ų103110.9 Ų110.972%0.7259%0.59SS**  trans-62.4130159.9-173.10000107.4Y132 S136Y132-S134 PolarHBondContact O-N 2.71Å; S134-S136 PolarHBondContact O-N 3.01Å
135D65.1Low71.5Confident164 Ų164103.9 Ų103.988%0.87755%0.552SS**  trans-75.675.9174.7-164.628.9000108.2Y133 S137Y133-D135 PolarHBondContact O-N 3.16Å; D135-S137 PolarHBondContact O-N 3.39Å
136S81.3Confident73.6Confident53 Ų5397.8 Ų97.837%0.37152%0.519SS..  trans-55.7130.3-179.7-68.10000109.8S134 W170S134-S136 PolarHBondContact O-N 3.01Å; S136-W170 WeakPolarHBondContact O-CH2 3.32Å; S136-W170 WeakPolarHBondContact O-CZ3 3.1Å
137S91.4Very high75.7Confident48 Ų4893.2 Ų93.234%0.33650%0.501SS..  trans-82.3163.8177.7740000111.7D135 A139 D140 T141D135-S137 PolarHBondContact O-N 3.39Å; S137-A139 PolarHBondContact O-N 2.91Å; S137-A139 PolarHBondContact OG-N 3.36Å; S137-D140 VanDerWaalsContact CB-OD2 3.26Å; S137-D140 WeakPolarHBondContact CB-OD2 3.4Å; S137-D140 PolarHBondContact N-OD2 2.92Å; S137-D140 PolarHBondContact O-N 2.96Å; S137-D140 VanDerWaalsContact O-N 3.13Å; S137-D140 PolarHBondContact OG-N 3.47Å; S137-D140 VanDerWaalsContact OG-N 3.15Å; S137-D140 PolarHBondContact OG-OD2 3.06Å; S137-T141 PolarHBondContact O-N 3.39Å; S137-T141 PolarHBondContact O-OG1 2.93Å
138L92.5Very high77.8Confident9 Ų991.2 Ų91.25%0.04748%0.478CS..Hα-helixtrans-55.1-35.3169.3179.463.2000111.2V142 L167 W170 V171 L176 E179 L183L138-V142 HydrophobicContact CD1-CG2 3.82Å; L138-V142 HydrophobicContact CG-CG2 4.21Å; L138-V142 WeakPolarHBondContact O-CB 3.49Å; L138-V142 WeakPolarHBondContact O-CG2 3.4Å; L138-V142 PolarHBondContact O-N 3.22Å; L138-L167 HydrophobicContact CD1-CD2 4.1Å; L138-W170 HydrophobicContact CB-CE3 4.36Å; L138-W170 HydrophobicContact CD1-CB 4.42Å; L138-V171 HydrophobicContact CD1-CG2 4.01Å; L138-V171 HydrophobicContact CD2-CG2 4.08Å; L138-L176 HydrophobicContact CD2-CB 4.15Å; L138-L176 HydrophobicContact CD2-CD2 3.88Å; L138-E179 HydrophobicContact CD2-CB 4.38Å; L138-E179 HydrophobicContact CD2-CG 4.44Å; L138-L183 HydrophobicContact CG-CD1 4.36Å
139A93.8Very high79.8Confident28 Ų2880 Ų8023%0.23143%0.434CS..Hα-helixtrans-68.5-36.8178.400000113.3S137 T143 L183S137-A139 PolarHBondContact O-N 2.91Å; S137-A139 PolarHBondContact OG-N 3.36Å; A139-T143 VanDerWaalsContact O-CB 3.27Å; A139-T143 WeakPolarHBondContact O-CB 3.34Å; A139-T143 PolarHBondContact O-N 3.42Å; A139-T143 PolarHBondContact O-OG1 2.94Å; A139-L183 HydrophobicContact CB-CD1 4.17Å; A139-L183 HydrophobicContact CB-CD2 3.84Å
140D92.6Very high81.7Confident83 Ų8376.4 Ų76.444%0.44441%0.409SS..Hα-helixtrans-68.4-55.1175.1-54.1-56.1000109.5S137 V142 T143 D144S137-D140 VanDerWaalsContact CB-OD2 3.26Å; S137-D140 WeakPolarHBondContact CB-OD2 3.4Å; S137-D140 PolarHBondContact N-OD2 2.92Å; S137-D140 PolarHBondContact O-N 2.96Å; S137-D140 VanDerWaalsContact O-N 3.13Å; S137-D140 PolarHBondContact OG-N 3.47Å; S137-D140 VanDerWaalsContact OG-N 3.15Å; S137-D140 PolarHBondContact OG-OD2 3.06Å; D140-V142 VanDerWaalsContact C-N 3.29Å; D140-V142 PolarHBondContact O-N 3.03Å; D140-T143 WeakPolarHBondContact O-CA 3.44Å; D140-T143 WeakPolarHBondContact O-CB 3.33Å; D140-T143 PolarHBondContact O-N 3.07Å; D140-D144 PolarHBondContact O-N 3.11Å
141T92.3Very high83.9Confident16 Ų1671.8 Ų71.810%0.09840%0.398CS..Hα-helixtrans-54.3-42.6178.8-58.10000112.7S137 F145 M166S137-T141 PolarHBondContact O-N 3.39Å; S137-T141 PolarHBondContact O-OG1 2.93Å; T141-F145 WeakPolarHBondContact O-CD1 3.38Å; T141-F145 PolarHBondContact O-N 3.21Å; T141-M166 HydrophobicContact CG2-CE 3.46Å; T141-M166 VanDerWaalsContact CG2-CE 3.46Å; T141-M166 HydrophobicContact CG2-CG 4.39Å; T141-M166 HydrophobicContact CG2-SD 3.49Å; T141-M166 WeakPolarHBondContact CG2-SD 3.26Å
142V94.6Very high86Confident0 Ų068.7 Ų68.70%038%0.377CS..Hα-helixtrans-71.4-34.7176.2172.50000111.9L138 D140 F145 L146 L167 L180 L183 I184L138-V142 HydrophobicContact CD1-CG2 3.82Å; L138-V142 HydrophobicContact CG-CG2 4.21Å; L138-V142 WeakPolarHBondContact O-CB 3.49Å; L138-V142 WeakPolarHBondContact O-CG2 3.4Å; L138-V142 PolarHBondContact O-N 3.22Å; D140-V142 VanDerWaalsContact C-N 3.29Å; D140-V142 PolarHBondContact O-N 3.03Å; V142-F145 HydrophobicContact CB-CE1 4.08Å; V142-F145 HydrophobicContact CB-CZ 4.18Å; V142-F145 HydrophobicContact CG1-CE1 4.42Å; V142-F145 HydrophobicContact CG1-CZ 4.02Å; V142-F145 HydrophobicContact CG2-CE1 3.73Å; V142-F145 HydrophobicContact CG2-CZ 3.93Å; V142-L146 HydrophobicContact CG1-CD1 3.54Å; V142-L146 HydrophobicContact CG1-CG 4.26Å; V142-L146 VanDerWaalsContact O-CB 3.29Å; V142-L146 WeakPolarHBondContact O-CB 3.47Å; V142-L146 VanDerWaalsContact O-CD1 3.29Å; V142-L146 WeakPolarHBondContact O-CD1 3.49Å; V142-L146 WeakPolarHBondContact O-CG 3.26Å; V142-L146 PolarHBondContact O-N 3.49Å; V142-L167 HydrophobicContact CG2-CD2 4.06Å; V142-L180 HydrophobicContact CG1-CD1 4.41Å; V142-L180 HydrophobicContact CG2-CD1 3.61Å; V142-L183 HydrophobicContact CB-CB 4.47Å; V142-L183 HydrophobicContact CB-CD1 4.13Å; V142-L183 HydrophobicContact CG1-CB 3.72Å; V142-L183 HydrophobicContact CG1-CD1 4.27Å; V142-L183 HydrophobicContact CG2-CD1 4.27Å; V142-I184 HydrophobicContact CG1-CG1 4.18Å
143T93.9Very high88Confident54 Ų5461 Ų6133%0.33136%0.355SS..Hα-helixtrans-66.6-41.9175.4-63.70000111.3A139 D140 L146 A147A139-T143 VanDerWaalsContact O-CB 3.27Å; A139-T143 WeakPolarHBondContact O-CB 3.34Å; A139-T143 PolarHBondContact O-N 3.42Å; A139-T143 PolarHBondContact O-OG1 2.94Å; D140-T143 WeakPolarHBondContact O-CA 3.44Å; D140-T143 WeakPolarHBondContact O-CB 3.33Å; D140-T143 PolarHBondContact O-N 3.07Å; T143-L146 PolarHBondContact O-N 2.94Å; T143-A147 WeakPolarHBondContact O-CB 3.43Å; T143-A147 PolarHBondContact O-N 2.59Å
144D93.4Very high89.9Confident110 Ų11053.4 Ų53.459%0.58834%0.344SS*.Hα-helixtrans-64.1-51.4-178.6-71.2-22.7000112.2D140 L146 A147 H148D140-D144 PolarHBondContact O-N 3.11Å; D144-L146 VanDerWaalsContact C-N 3.3Å; D144-L146 PolarHBondContact O-N 2.92Å; D144-A147 PolarHBondContact O-N 2.94Å; D144-H148 PolarHBondContact O-N 3Å
145F94.2Very high91.7Very high13 Ų1349.6 Ų49.66%0.05732%0.318CS..Hα-helixtrans-69-28.6179.776.3-117.2000112.8T141 V142 L149 I163 M166 L167 L201T141-F145 WeakPolarHBondContact O-CD1 3.38Å; T141-F145 PolarHBondContact O-N 3.21Å; V142-F145 HydrophobicContact CB-CE1 4.08Å; V142-F145 HydrophobicContact CB-CZ 4.18Å; V142-F145 HydrophobicContact CG1-CE1 4.42Å; V142-F145 HydrophobicContact CG1-CZ 4.02Å; V142-F145 HydrophobicContact CG2-CE1 3.73Å; V142-F145 HydrophobicContact CG2-CZ 3.93Å; F145-L149 HydrophobicContact CD2-CD1 4.36Å; F145-L149 WeakPolarHBondContact O-CB 3.23Å; F145-L149 VanDerWaalsContact O-CG 3.31Å; F145-L149 WeakPolarHBondContact O-CG 3.32Å; F145-L149 PolarHBondContact O-N 2.99Å; F145-I163 HydrophobicContact CB-CD1 3.87Å; F145-I163 HydrophobicContact CB-CG1 3.96Å; F145-I163 HydrophobicContact CD1-CG1 4.44Å; F145-I163 HydrophobicContact CD1-CG2 3.91Å; F145-I163 HydrophobicContact CD2-CD1 3.94Å; F145-I163 HydrophobicContact CD2-CG1 4.3Å; F145-I163 HydrophobicContact CD2-CG2 3.75Å; F145-I163 HydrophobicContact CE1-CG2 3.8Å; F145-I163 HydrophobicContact CE2-CG2 3.69Å; F145-I163 HydrophobicContact CG-CD1 4.03Å; F145-I163 HydrophobicContact CG-CG1 4.02Å; F145-I163 HydrophobicContact CG-CG2 3.91Å; F145-I163 HydrophobicContact CZ-CG2 3.72Å; F145-M166 HydrophobicContact CD1-CE 3.91Å; F145-M166 HydrophobicContact CE1-CE 4.45Å; F145-L167 HydrophobicContact CE1-CD1 4.18Å; F145-L167 HydrophobicContact CE1-CD2 4.03Å; F145-L167 HydrophobicContact CE1-CG 4.19Å; F145-L167 HydrophobicContact CZ-CD1 3.88Å; F145-L167 HydrophobicContact CZ-CD2 4.31Å; F145-L167 HydrophobicContact CZ-CG 4.39Å; F145-L201 HydrophobicContact CE2-CD2 3.96Å
146L94.7Very high93.1Very high0 Ų042.2 Ų42.20%028%0.278CS..Hα-helixtrans-73-34.5173.9-67.4173.9000112V142 T143 D144 S150 I184 Q187 F194 L201V142-L146 HydrophobicContact CG1-CD1 3.54Å; V142-L146 HydrophobicContact CG1-CG 4.26Å; V142-L146 VanDerWaalsContact O-CB 3.29Å; V142-L146 WeakPolarHBondContact O-CB 3.47Å; V142-L146 VanDerWaalsContact O-CD1 3.29Å; V142-L146 WeakPolarHBondContact O-CD1 3.49Å; V142-L146 WeakPolarHBondContact O-CG 3.26Å; V142-L146 PolarHBondContact O-N 3.49Å; T143-L146 PolarHBondContact O-N 2.94Å; D144-L146 VanDerWaalsContact C-N 3.3Å; D144-L146 PolarHBondContact O-N 2.92Å; L146-S150 VanDerWaalsContact O-CB 3.27Å; L146-S150 WeakPolarHBondContact O-CB 3.48Å; L146-S150 PolarHBondContact O-N 3.36Å; L146-I184 HydrophobicContact CD1-CG1 4.2Å; L146-Q187 HydrophobicContact CD1-CB 3.76Å; L146-Q187 HydrophobicContact CD1-CG 3.79Å; L146-F194 HydrophobicContact CB-CZ 4.48Å; L146-F194 HydrophobicContact CD2-CE1 3.82Å; L146-F194 HydrophobicContact CD2-CZ 3.64Å; L146-L201 HydrophobicContact CD2-CD2 3.51Å
147A93.5Very high93.8Very high46 Ų4644.4 Ų44.438%0.3828%0.282SS..Hα-helixtrans-67.3-40.4172.200000111.7T143 D144 S150 S151T143-A147 WeakPolarHBondContact O-CB 3.43Å; T143-A147 PolarHBondContact O-N 2.59Å; D144-A147 PolarHBondContact O-N 2.94Å; A147-S150 PolarHBondContact O-N 3.18Å; A147-S151 WeakPolarHBondContact O-CB 3.44Å; A147-S151 PolarHBondContact O-N 3.22Å; A147-S151 PolarHBondContact O-OG 3.13Å
148H94.3Very high93.9Very high76 Ų7651.1 Ų51.135%0.35230%0.302SS..Hα-helixtrans-61.2-55.1171.8173.758000111.7D144 S150 S151 S152 S155 D159D144-H148 PolarHBondContact O-N 3Å; H148-S150 PolarHBondContact O-N 2.91Å; H148-S150 VanDerWaalsContact O-N 3.12Å; H148-S151 CarbonylContact O-C 3.52Å; H148-S151 WeakPolarHBondContact O-CA 3.42Å; H148-S151 PolarHBondContact O-N 2.95Å; H148-S152 PolarHBondContact O-N 2.92Å; H148-S155 PolarHBondContact NE2-OG 3Å; H148-D159 IonicContact CD2-OD2 2.73Å; H148-D159 PolarHBondContact CD2-OD2 2.81Å; H148-D159 VanDerWaalsContact CD2-OD2 3.32Å; H148-D159 IonicContact CE1-OD2 3.07Å; H148-D159 IonicContact NE2-OD1 3.79Å; H148-D159 IonicContact NE2-OD2 3.25Å; H148-D159 PolarHBondContact NE2-OD2 2.82Å
149L94.9Very high94.1Very high0 Ų052.3 Ų52.30%031%0.308CS..Hα-helixtrans-61.2-22.4176.6-71.8178.7000113.7F145 P153 F156 D159 I163 F194 T197F145-L149 HydrophobicContact CD2-CD1 4.36Å; F145-L149 WeakPolarHBondContact O-CB 3.23Å; F145-L149 VanDerWaalsContact O-CG 3.31Å; F145-L149 WeakPolarHBondContact O-CG 3.32Å; F145-L149 PolarHBondContact O-N 2.99Å; L149-P153 WeakPolarHBondContact O-CA 3.3Å; L149-F156 HydrophobicContact CD1-CD2 4.27Å; L149-F156 HydrophobicContact CD2-CB 4.16Å; L149-F156 HydrophobicContact CD2-CD2 4.12Å; L149-D159 HydrophobicContact CD2-CB 4.28Å; L149-I163 HydrophobicContact CD1-CD1 3.83Å; L149-I163 HydrophobicContact CD2-CD1 4.42Å; L149-I163 HydrophobicContact CG-CD1 4.13Å; L149-F194 HydrophobicContact CB-CE2 3.86Å; L149-F194 HydrophobicContact CB-CZ 4.28Å; L149-T197 HydrophobicContact CB-CG2 4.19Å
150S93.5Very high94.2Very high42 Ų4251.2 Ų51.229%0.29430%0.298SS..Hα-helixtrans-82.3-22172.2-173.20000113.9L146 A147 H148 I191L146-S150 VanDerWaalsContact O-CB 3.27Å; L146-S150 WeakPolarHBondContact O-CB 3.48Å; L146-S150 PolarHBondContact O-N 3.36Å; A147-S150 PolarHBondContact O-N 3.18Å; H148-S150 PolarHBondContact O-N 2.91Å; H148-S150 VanDerWaalsContact O-N 3.12Å; S150-I191 VanDerWaalsContact OG-CG2 3.3Å; S150-I191 WeakPolarHBondContact OG-CG2 3.32Å
151S94.1Very high94.3Very high96 Ų9653.8 Ų53.867%0.67131%0.308SS*.Hα-helixtrans-90.4-34.6176.8-54.40000111.1A147 H148 P153A147-S151 WeakPolarHBondContact O-CB 3.44Å; A147-S151 PolarHBondContact O-N 3.22Å; A147-S151 PolarHBondContact O-OG 3.13Å; H148-S151 CarbonylContact O-C 3.52Å; H148-S151 WeakPolarHBondContact O-CA 3.42Å; H148-S151 PolarHBondContact O-N 2.95Å; S151-P153 VanDerWaalsContact C-CD 3.45Å; S151-P153 WeakPolarHBondContact O-CD 3.48Å
152S93.8Very high94.5Very high49 Ų4960.3 Ų60.334%0.34334%0.337SS..  trans-125.958.9-173.5-55.70000111.2H148 G154 S155H148-S152 PolarHBondContact O-N 2.92Å; S152-G154 PolarHBondContact O-N 3.29Å; S152-S155 WeakPolarHBondContact CB-OG 3.48Å; S152-S155 PolarHBondContact O-N 2.79Å; S152-S155 PolarHBondContact O-OG 2.65Å
153P92.4Very high94.5Very high70 Ų7060.7 Ų60.746%0.45534%0.339SS..THydrogen-bonded Turntrans-62.8-12.9-174.626.3-36000114.8L149 S151L149-P153 WeakPolarHBondContact O-CA 3.3Å; S151-P153 VanDerWaalsContact C-CD 3.45Å; S151-P153 WeakPolarHBondContact O-CD 3.48Å
154G93.4Very high94.6Very high62 Ų6258.4 Ų58.464%0.63933%0.325SS*.THydrogen-bonded Turntrans-91.51.4174.200000115.6S152S152-G154 PolarHBondContact O-N 3.29Å
155S95.1Very high94.7Very high23 Ų2357.1 Ų57.116%0.16132%0.324CS..SBendtrans-93.9-4168.760.80000113H148 S152 E157 Y158 D159H148-S155 PolarHBondContact NE2-OG 3Å; S152-S155 WeakPolarHBondContact CB-OG 3.48Å; S152-S155 PolarHBondContact O-N 2.79Å; S152-S155 PolarHBondContact O-OG 2.65Å; S155-E157 PolarHBondContact O-N 2.62Å; S155-E157 VanDerWaalsContact O-N 3.13Å; S155-Y158 PolarHBondContact O-N 2.77Å; S155-D159 WeakPolarHBondContact CB-OD2 3.46Å; S155-D159 VanDerWaalsContact O-CG 3.24Å; S155-D159 PolarHBondContact O-N 3.29Å; S155-D159 PolarHBondContact OG-OD2 2.93Å
156F96Very high94.7Very high9 Ų959.3 Ų59.34%0.03934%0.336CS..Hα-helixtrans-49-42.8-178.1179.7-84.6000113.2L149 Y158 V160 T197 R200 L201L149-F156 HydrophobicContact CD1-CD2 4.27Å; L149-F156 HydrophobicContact CD2-CB 4.16Å; L149-F156 HydrophobicContact CD2-CD2 4.12Å; F156-Y158 PolarHBondContact O-N 3.02Å; F156-V160 HydrophobicContact CE1-CB 4.3Å; F156-V160 HydrophobicContact CE1-CG1 4.29Å; F156-V160 HydrophobicContact CE1-CG2 4.29Å; F156-V160 HydrophobicContact CE2-CG2 4.18Å; F156-V160 HydrophobicContact CZ-CB 4.28Å; F156-V160 HydrophobicContact CZ-CG2 3.86Å; F156-V160 WeakPolarHBondContact O-CB 3.38Å; F156-V160 VanDerWaalsContact O-CG1 3.22Å; F156-V160 WeakPolarHBondContact O-CG1 3.44Å; F156-V160 PolarHBondContact O-N 3.01Å; F156-V160 VanDerWaalsContact O-N 3.12Å; F156-T197 HydrophobicContact CD2-CG2 3.96Å; F156-R200 VanDerWaalsContact CD1-CZ 3.48Å; F156-R200 HydrophobicContact CE1-CB 4.25Å; F156-R200 HydrophobicContact CE2-CB 4.01Å; F156-R200 HydrophobicContact CZ-CB 3.73Å; F156-L201 HydrophobicContact CE2-CB 4.08Å; F156-L201 HydrophobicContact CE2-CD1 4.43Å
157E94.8Very high94.7Very high99 Ų9959.3 Ų59.346%0.46334%0.336SS..Hα-helixtrans-59.6-26.9179.5-75.862.5-147.900113.9S155 R200S155-E157 PolarHBondContact O-N 2.62Å; S155-E157 VanDerWaalsContact O-N 3.13Å; E157-R200 IonicContact OE1-CZ 3.76Å; E157-R200 IonicContact OE1-NH1 2.76Å; E157-R200 PolarHBondContact OE1-NH1 2.83Å; E157-R200 IonicContact OE1-NH2 2.74Å; E157-R200 PolarHBondContact OE1-NH2 2.81Å; E157-R200 IonicContact OE2-NH1 3.68Å
158Y94.3Very high94.8Very high189 Ų18959.7 Ų59.774%0.74133%0.331SS*.Hα-helixtrans-98.3-47179.6-51.6-80.5000111S155 F156 V160S155-Y158 PolarHBondContact O-N 2.77Å; F156-Y158 PolarHBondContact O-N 3.02Å; Y158-V160 VanDerWaalsContact C-N 3.35Å; Y158-V160 PolarHBondContact O-N 3.05Å
159D95.9Very high94.7Very high33 Ų3359.9 Ų59.918%0.17634%0.341CS..Hα-helixtrans-70.3-29.5-172.9-51.8-30.9000113H148 L149 S155 E161 E162 I163H148-D159 IonicContact CD2-OD2 2.73Å; H148-D159 PolarHBondContact CD2-OD2 2.81Å; H148-D159 VanDerWaalsContact CD2-OD2 3.32Å; H148-D159 IonicContact CE1-OD2 3.07Å; H148-D159 IonicContact NE2-OD1 3.79Å; H148-D159 IonicContact NE2-OD2 3.25Å; H148-D159 PolarHBondContact NE2-OD2 2.82Å; L149-D159 HydrophobicContact CD2-CB 4.28Å; S155-D159 WeakPolarHBondContact CB-OD2 3.46Å; S155-D159 VanDerWaalsContact O-CG 3.24Å; S155-D159 PolarHBondContact O-N 3.29Å; S155-D159 PolarHBondContact OG-OD2 2.93Å; D159-E161 VanDerWaalsContact C-N 3.26Å; D159-E161 PolarHBondContact O-N 3Å; D159-E162 PolarHBondContact O-N 3.27Å; D159-I163 HydrophobicContact CB-CD1 3.8Å; D159-I163 HydrophobicContact CB-CG1 4.49Å; D159-I163 WeakPolarHBondContact O-CB 3.5Å; D159-I163 VanDerWaalsContact O-CG1 3.27Å; D159-I163 WeakPolarHBondContact O-CG1 3.2Å; D159-I163 PolarHBondContact O-N 3.2Å
160V96.4Very high94.5Very high5 Ų564.6 Ų64.63%0.0336%0.359CS..Hα-helixtrans-66-27-168.574.20000113.3F156 Y158 T164 L201 Y204F156-V160 HydrophobicContact CE1-CB 4.3Å; F156-V160 HydrophobicContact CE1-CG1 4.29Å; F156-V160 HydrophobicContact CE1-CG2 4.29Å; F156-V160 HydrophobicContact CE2-CG2 4.18Å; F156-V160 HydrophobicContact CZ-CB 4.28Å; F156-V160 HydrophobicContact CZ-CG2 3.86Å; F156-V160 WeakPolarHBondContact O-CB 3.38Å; F156-V160 VanDerWaalsContact O-CG1 3.22Å; F156-V160 WeakPolarHBondContact O-CG1 3.44Å; F156-V160 PolarHBondContact O-N 3.01Å; F156-V160 VanDerWaalsContact O-N 3.12Å; Y158-V160 VanDerWaalsContact C-N 3.35Å; Y158-V160 PolarHBondContact O-N 3.05Å; V160-T164 WeakPolarHBondContact O-CB 3.47Å; V160-T164 PolarHBondContact O-N 3.01Å; V160-T164 PolarHBondContact O-OG1 3.38Å; V160-L201 HydrophobicContact CG2-CD1 4.13Å; V160-Y204 HydrophobicContact CG1-CD2 4.13Å; V160-Y204 HydrophobicContact CG1-CE1 4.31Å; V160-Y204 HydrophobicContact CG1-CE2 3.83Å; V160-Y204 HydrophobicContact CG2-CD1 3.46Å; V160-Y204 VanDerWaalsContact CG2-CD1 3.46Å; V160-Y204 HydrophobicContact CG2-CD2 4.04Å; V160-Y204 HydrophobicContact CG2-CE1 3.8Å; V160-Y204 HydrophobicContact CG2-CE2 4.35Å; V160-Y204 HydrophobicContact CG2-CG 3.58Å
161E95.8Very high94.5Very high137 Ų13762.8 Ų62.864%0.6435%0.346SS*.Hα-helixtrans-70.7-46.5174.3-61.5-153.9157.100111.5D159 T164 S165D159-E161 VanDerWaalsContact C-N 3.26Å; D159-E161 PolarHBondContact O-N 3Å; E161-T164 PolarHBondContact O-N 2.95Å; E161-S165 WeakPolarHBondContact O-CB 3.42Å; E161-S165 PolarHBondContact O-N 3.1Å
162E95.3Very high94.4Very high153 Ų15362.5 Ų62.572%0.71534%0.341SS*.Hα-helixtrans-64.7-48.1177.2-176.2172.3-179.600111.3D159 T164 S165 M166D159-E162 PolarHBondContact O-N 3.27Å; E162-T164 VanDerWaalsContact C-N 3.26Å; E162-T164 PolarHBondContact O-N 3.46Å; E162-S165 WeakPolarHBondContact O-CB 3.4Å; E162-S165 PolarHBondContact O-N 3.4Å; E162-S165 VanDerWaalsContact O-N 3.11Å; E162-M166 WeakPolarHBondContact O-CB 3.4Å; E162-M166 PolarHBondContact O-N 3.19Å
163I95.5Very high94.4Very high9 Ų962.8 Ų62.85%0.04634%0.341CS..Hα-helixtrans-53.7-44.9174.5-69.8166.9000110.5F145 L149 D159 L167F145-I163 HydrophobicContact CB-CD1 3.87Å; F145-I163 HydrophobicContact CB-CG1 3.96Å; F145-I163 HydrophobicContact CD1-CG1 4.44Å; F145-I163 HydrophobicContact CD1-CG2 3.91Å; F145-I163 HydrophobicContact CD2-CD1 3.94Å; F145-I163 HydrophobicContact CD2-CG1 4.3Å; F145-I163 HydrophobicContact CD2-CG2 3.75Å; F145-I163 HydrophobicContact CE1-CG2 3.8Å; F145-I163 HydrophobicContact CE2-CG2 3.69Å; F145-I163 HydrophobicContact CG-CD1 4.03Å; F145-I163 HydrophobicContact CG-CG1 4.02Å; F145-I163 HydrophobicContact CG-CG2 3.91Å; F145-I163 HydrophobicContact CZ-CG2 3.72Å; L149-I163 HydrophobicContact CD1-CD1 3.83Å; L149-I163 HydrophobicContact CD2-CD1 4.42Å; L149-I163 HydrophobicContact CG-CD1 4.13Å; D159-I163 HydrophobicContact CB-CD1 3.8Å; D159-I163 HydrophobicContact CB-CG1 4.49Å; D159-I163 WeakPolarHBondContact O-CB 3.5Å; D159-I163 VanDerWaalsContact O-CG1 3.27Å; D159-I163 WeakPolarHBondContact O-CG1 3.2Å; D159-I163 PolarHBondContact O-N 3.2Å; I163-L167 HydrophobicContact CG2-CD1 3.95Å; I163-L167 HydrophobicContact CG2-CG 4.48Å; I163-L167 WeakPolarHBondContact O-CB 3.48Å; I163-L167 VanDerWaalsContact O-CG 3.24Å; I163-L167 WeakPolarHBondContact O-CG 3.48Å; I163-L167 PolarHBondContact O-N 3.01Å
164T96.1Very high94.5Very high5 Ų562.2 Ų62.23%0.03133%0.332CS..Hα-helixtrans-75.2-30.3-178.8-54.30000112.6V160 E161 E162 N168 Y204 L205 H208 L209V160-T164 WeakPolarHBondContact O-CB 3.47Å; V160-T164 PolarHBondContact O-N 3.01Å; V160-T164 PolarHBondContact O-OG1 3.38Å; E161-T164 PolarHBondContact O-N 2.95Å; E162-T164 VanDerWaalsContact C-N 3.26Å; E162-T164 PolarHBondContact O-N 3.46Å; T164-N168 WeakPolarHBondContact O-CB 3.11Å; T164-N168 PolarHBondContact O-N 2.83Å; T164-N168 PolarHBondContact O-ND2 3.49Å; T164-Y204 HydrophobicContact CG2-CE1 4.14Å; T164-Y204 WeakPolarHBondContact OG1-CD1 3.27Å; T164-Y204 VanDerWaalsContact OG1-CE1 3.28Å; T164-Y204 WeakPolarHBondContact OG1-CE1 3.29Å; T164-L205 HydrophobicContact CG2-CD2 3.94Å; T164-L205 WeakPolarHBondContact OG1-CD2 3.4Å; T164-H208 HydrophobicContact CG2-CB 3.73Å; T164-L209 HydrophobicContact CG2-CD2 4.42Å
165S94.9Very high94.5Very high83 Ų8364.6 Ų64.658%0.5833%0.326SS*.Hα-helixtrans-64.6-46.4172.5-1650000111.2E161 E162 N168 S169E161-S165 WeakPolarHBondContact O-CB 3.42Å; E161-S165 PolarHBondContact O-N 3.1Å; E162-S165 WeakPolarHBondContact O-CB 3.4Å; E162-S165 PolarHBondContact O-N 3.4Å; E162-S165 VanDerWaalsContact O-N 3.11Å; S165-N168 PolarHBondContact O-N 3.17Å; S165-S169 PolarHBondContact O-N 2.89Å
166M94.2Very high94.5Very high59 Ų5965.8 Ų65.829%0.29133%0.33SS..Hα-helixtrans-61.4-49.1172.9179.4173.760.100111.8T141 F145 E162 N168 S169 W170T141-M166 HydrophobicContact CG2-CE 3.46Å; T141-M166 VanDerWaalsContact CG2-CE 3.46Å; T141-M166 HydrophobicContact CG2-CG 4.39Å; T141-M166 HydrophobicContact CG2-SD 3.49Å; T141-M166 WeakPolarHBondContact CG2-SD 3.26Å; F145-M166 HydrophobicContact CD1-CE 3.91Å; F145-M166 HydrophobicContact CE1-CE 4.45Å; E162-M166 WeakPolarHBondContact O-CB 3.4Å; E162-M166 PolarHBondContact O-N 3.19Å; M166-N168 PolarHBondContact O-N 3.14Å; M166-S169 PolarHBondContact O-N 3.14Å; M166-S169 VanDerWaalsContact O-N 3.08Å; M166-S169 PolarHBondContact O-OG 3.18Å; M166-W170 PolarHBondContact O-N 3.28Å
167L95.5Very high94.5Very high1 Ų165.3 Ų65.31%0.00533%0.329CS..Hα-helixtrans-59.8-34177.5-73.7173.2000112.7L138 V142 F145 I163 S169 V171 L180 L205 L209L138-L167 HydrophobicContact CD1-CD2 4.1Å; V142-L167 HydrophobicContact CG2-CD2 4.06Å; F145-L167 HydrophobicContact CE1-CD1 4.18Å; F145-L167 HydrophobicContact CE1-CD2 4.03Å; F145-L167 HydrophobicContact CE1-CG 4.19Å; F145-L167 HydrophobicContact CZ-CD1 3.88Å; F145-L167 HydrophobicContact CZ-CD2 4.31Å; F145-L167 HydrophobicContact CZ-CG 4.39Å; I163-L167 HydrophobicContact CG2-CD1 3.95Å; I163-L167 HydrophobicContact CG2-CG 4.48Å; I163-L167 WeakPolarHBondContact O-CB 3.48Å; I163-L167 VanDerWaalsContact O-CG 3.24Å; I163-L167 WeakPolarHBondContact O-CG 3.48Å; I163-L167 PolarHBondContact O-N 3.01Å; L167-S169 VanDerWaalsContact C-N 3.34Å; L167-S169 PolarHBondContact O-N 3.05Å; L167-V171 HydrophobicContact CD2-CG2 4.35Å; L167-V171 VanDerWaalsContact O-CB 3.24Å; L167-V171 WeakPolarHBondContact O-CB 3.22Å; L167-V171 WeakPolarHBondContact O-CG2 3.31Å; L167-V171 PolarHBondContact O-N 3.24Å; L167-L180 HydrophobicContact CD1-CD1 4.14Å; L167-L180 HydrophobicContact CD1-CD2 4.2Å; L167-L180 HydrophobicContact CD2-CD1 3.51Å; L167-L180 HydrophobicContact CD2-CD2 4.14Å; L167-L180 HydrophobicContact CD2-CG 4.46Å; L167-L180 HydrophobicContact CG-CD1 4.47Å; L167-L205 HydrophobicContact CD1-CD1 4.07Å; L167-L205 HydrophobicContact CD1-CD2 3.75Å; L167-L209 HydrophobicContact CB-CD2 3.97Å
168N94.6Very high94.5Very high53 Ų5364.5 Ų64.528%0.28332%0.324SS..Hα-helixtrans-71.6-21.9176.9-83.8-54.1000114.3T164 S165 M166 H208 L209 A210T164-N168 WeakPolarHBondContact O-CB 3.11Å; T164-N168 PolarHBondContact O-N 2.83Å; T164-N168 PolarHBondContact O-ND2 3.49Å; S165-N168 PolarHBondContact O-N 3.17Å; M166-N168 PolarHBondContact O-N 3.14Å; N168-H208 PolarHBondContact ND2-O 2.9Å; N168-L209 WeakPolarHBondContact OD1-CA 3.36Å; N168-A210 WeakPolarHBondContact OD1-CB 3.21Å; N168-A210 PolarHBondContact OD1-N 3.43Å
169S92.3Very high94.6Very high81 Ų8159.2 Ų59.257%0.56631%0.306SS*.Hα-helixtrans-87.9-27174.162.10000113.1S165 M166 L167S165-S169 PolarHBondContact O-N 2.89Å; M166-S169 PolarHBondContact O-N 3.14Å; M166-S169 VanDerWaalsContact O-N 3.08Å; M166-S169 PolarHBondContact O-OG 3.18Å; L167-S169 VanDerWaalsContact C-N 3.34Å; L167-S169 PolarHBondContact O-N 3.05Å
170W90.6Very high94.7Very high98 Ų9857.7 Ų57.737%0.37130%0.297SS..Hα-helixtrans-86-49.4177-70.656.1000112.5S136 L138 M166 T172 L176S136-W170 WeakPolarHBondContact O-CH2 3.32Å; S136-W170 WeakPolarHBondContact O-CZ3 3.1Å; L138-W170 HydrophobicContact CB-CE3 4.36Å; L138-W170 HydrophobicContact CD1-CB 4.42Å; M166-W170 PolarHBondContact O-N 3.28Å; W170-T172 VanDerWaalsContact C-N 3.31Å; W170-T172 PolarHBondContact O-N 2.9Å; W170-T172 PolarHBondContact O-OG1 3.4Å; W170-L176 WeakPolarHBondContact O-CD1 3.49Å
171V93.5Very high94.8Very high4 Ų457.6 Ų57.62%0.02430%0.297CS..  trans-82.877.2-170.7-176.20000110.6L138 L167 L176 L177 L180 L211L138-V171 HydrophobicContact CD1-CG2 4.01Å; L138-V171 HydrophobicContact CD2-CG2 4.08Å; L167-V171 HydrophobicContact CD2-CG2 4.35Å; L167-V171 VanDerWaalsContact O-CB 3.24Å; L167-V171 WeakPolarHBondContact O-CB 3.22Å; L167-V171 WeakPolarHBondContact O-CG2 3.31Å; L167-V171 PolarHBondContact O-N 3.24Å; V171-L176 HydrophobicContact CG1-CB 4.14Å; V171-L177 HydrophobicContact CG1-CB 3.81Å; V171-L177 HydrophobicContact CG1-CD1 3.91Å; V171-L177 HydrophobicContact CG1-CG 4.48Å; V171-L180 HydrophobicContact CG2-CB 4.43Å; V171-L180 HydrophobicContact CG2-CD2 4.17Å; V171-L211 HydrophobicContact CG1-CD2 4.29Å; V171-L211 WeakPolarHBondContact O-CD2 3.32Å
172T92.8Very high94.9Very high91 Ų9154.7 Ų54.756%0.55828%0.283SS*.  trans-100.5-11.3-175.554.10000113.9W170W170-T172 VanDerWaalsContact C-N 3.31Å; W170-T172 PolarHBondContact O-N 2.9Å; W170-T172 PolarHBondContact O-OG1 3.4Å
173T93.2Very high94.9Very high55 Ų5548.9 Ų48.934%0.33726%0.257SS..SBendtrans-122.4159.8-178.8690000112.3E175 L176 L177 L211T173-E175 PolarHBondContact O-N 3.2Å; T173-L176 HydrophobicContact CG2-CD1 4.48Å; T173-L176 PolarHBondContact O-N 3.47Å; T173-L176 WeakPolarHBondContact OG1-CD1 3.46Å; T173-L176 VanDerWaalsContact OG1-CG 3.3Å; T173-L176 WeakPolarHBondContact OG1-CG 3.34Å; T173-L176 PolarHBondContact OG1-N 3.12Å; T173-L177 PolarHBondContact O-N 2.82Å; T173-L177 VanDerWaalsContact O-N 3.11Å; T173-L211 VanDerWaalsContact O-CD2 3.24Å; T173-L211 WeakPolarHBondContact O-CD2 3.38Å
174E93.4Very high95Very high58 Ų5848.5 Ų48.527%0.27126%0.255SS..Hα-helixtrans-64-30.6176.3-173-177.6124.600111.7L177 K178 P213 S215E174-L177 PolarHBondContact O-N 3.18Å; E174-K178 WeakPolarHBondContact O-CD 3.43Å; E174-K178 VanDerWaalsContact O-CG 3.31Å; E174-K178 WeakPolarHBondContact O-CG 3.48Å; E174-K178 PolarHBondContact O-N 3.21Å; E174-K178 WeakPolarHBondContact OE1-CE 3.48Å; E174-K178 IonicContact OE1-NZ 2.99Å; E174-K178 PolarHBondContact OE1-NZ 3.08Å; E174-P213 HydrophobicContact CB-CB 4.47Å; E174-P213 HydrophobicContact CB-CG 4.4Å; E174-P213 HydrophobicContact CG-CB 4.38Å; E174-P213 HydrophobicContact CG-CG 4.07Å; E174-S215 PolarHBondContact OE1-OG 3.35Å; E174-S215 WeakPolarHBondContact OE2-CB 3.44Å; E174-S215 PolarHBondContact OE2-OG 2.92Å
175E94.3Very high95.1Very high111 Ų11148.3 Ų48.352%0.51925%0.254SS..Hα-helixtrans-67.4-50.1179.1-70.951.9-114.500110.5T173 L177 K178 E179T173-E175 PolarHBondContact O-N 3.2Å; E175-L177 PolarHBondContact O-N 3.16Å; E175-K178 WeakPolarHBondContact O-CB 3.46Å; E175-K178 PolarHBondContact O-N 3.04Å; E175-K178 IonicContact OE1-NZ 3.27Å; E175-K178 PolarHBondContact OE1-NZ 3.02Å; E175-E179 PolarHBondContact O-N 3.41Å
176L94.8Very high95.1Very high48 Ų4847.3 Ų47.325%0.25124%0.244SC..Hα-helixtrans-64.4-30175.5-66.3169.1000111.9L138 W170 V171 T173 E179 L180L138-L176 HydrophobicContact CD2-CB 4.15Å; L138-L176 HydrophobicContact CD2-CD2 3.88Å; W170-L176 WeakPolarHBondContact O-CD1 3.49Å; V171-L176 HydrophobicContact CG1-CB 4.14Å; T173-L176 HydrophobicContact CG2-CD1 4.48Å; T173-L176 PolarHBondContact O-N 3.47Å; T173-L176 WeakPolarHBondContact OG1-CD1 3.46Å; T173-L176 VanDerWaalsContact OG1-CG 3.3Å; T173-L176 WeakPolarHBondContact OG1-CG 3.34Å; T173-L176 PolarHBondContact OG1-N 3.12Å; L176-E179 PolarHBondContact O-N 3.25Å; L176-L180 WeakPolarHBondContact O-CB 3.46Å; L176-L180 PolarHBondContact O-N 2.88Å
177L96.3Very high95Very high0 Ų046.6 Ų46.60%024%0.24CC..Hα-helixtrans-71.3-35.6175.6-172.663.5000112.4V171 T173 E174 E175 V181 L209 L211 P213 F218 L221V171-L177 HydrophobicContact CG1-CB 3.81Å; V171-L177 HydrophobicContact CG1-CD1 3.91Å; V171-L177 HydrophobicContact CG1-CG 4.48Å; T173-L177 PolarHBondContact O-N 2.82Å; T173-L177 VanDerWaalsContact O-N 3.11Å; E174-L177 PolarHBondContact O-N 3.18Å; E175-L177 PolarHBondContact O-N 3.16Å; L177-V181 WeakPolarHBondContact O-CG2 3.44Å; L177-V181 PolarHBondContact O-N 3.37Å; L177-L209 HydrophobicContact CD1-CD1 4.12Å; L177-L211 HydrophobicContact CB-CD2 4.13Å; L177-L211 HydrophobicContact CD2-CD2 4.25Å; L177-P213 HydrophobicContact CD2-CG 4.03Å; L177-F218 HydrophobicContact CD1-CB 4.32Å; L177-F218 HydrophobicContact CD1-CD2 4.21Å; L177-L221 HydrophobicContact CB-CD1 4.41Å; L177-L221 HydrophobicContact CD2-CD1 3.71Å; L177-L221 HydrophobicContact CG-CD1 3.76Å
178K95.8Very high95Very high82 Ų8246.6 Ų46.636%0.35724%0.24SC..Hα-helixtrans-67.5-41.5171-66.9156.1-173.6151.80110.8E174 E175 V181 E182 L221E174-K178 WeakPolarHBondContact O-CD 3.43Å; E174-K178 VanDerWaalsContact O-CG 3.31Å; E174-K178 WeakPolarHBondContact O-CG 3.48Å; E174-K178 PolarHBondContact O-N 3.21Å; E174-K178 WeakPolarHBondContact OE1-CE 3.48Å; E174-K178 IonicContact OE1-NZ 2.99Å; E174-K178 PolarHBondContact OE1-NZ 3.08Å; E175-K178 WeakPolarHBondContact O-CB 3.46Å; E175-K178 PolarHBondContact O-N 3.04Å; E175-K178 IonicContact OE1-NZ 3.27Å; E175-K178 PolarHBondContact OE1-NZ 3.02Å; K178-V181 PolarHBondContact O-N 2.93Å; K178-E182 PolarHBondContact O-N 3.11Å; K178-L221 HydrophobicContact CG-CD1 4.37Å; K178-L221 HydrophobicContact CG-CD2 4.38Å
179E96.5Very high94.9Very high78 Ų7845.1 Ų45.136%0.36423%0.233SC..Hα-helixtrans-61.7-48.7177.3-168.2-179.1152.700111.6L138 E175 L176 V181 E182 L183L138-E179 HydrophobicContact CD2-CB 4.38Å; L138-E179 HydrophobicContact CD2-CG 4.44Å; E175-E179 PolarHBondContact O-N 3.41Å; L176-E179 PolarHBondContact O-N 3.25Å; E179-V181 VanDerWaalsContact C-N 3.29Å; E179-V181 PolarHBondContact O-N 3.36Å; E179-E182 PolarHBondContact O-N 2.75Å; E179-E182 VanDerWaalsContact O-N 3.1Å; E179-L183 HydrophobicContact CG-CD1 3.97Å; E179-L183 HydrophobicContact CG-CG 4.47Å; E179-L183 VanDerWaalsContact O-CG 3.3Å; E179-L183 WeakPolarHBondContact O-CG 3.18Å; E179-L183 PolarHBondContact O-N 3.15Å
180L97.3Very high94.9Very high0 Ų044.3 Ų44.30%023%0.231CC..Hα-helixtrans-54.8-43.6174.2179.564.8000112.2V142 L167 V171 L176 I184 L209 F218V142-L180 HydrophobicContact CG1-CD1 4.41Å; V142-L180 HydrophobicContact CG2-CD1 3.61Å; L167-L180 HydrophobicContact CD1-CD1 4.14Å; L167-L180 HydrophobicContact CD1-CD2 4.2Å; L167-L180 HydrophobicContact CD2-CD1 3.51Å; L167-L180 HydrophobicContact CD2-CD2 4.14Å; L167-L180 HydrophobicContact CD2-CG 4.46Å; L167-L180 HydrophobicContact CG-CD1 4.47Å; V171-L180 HydrophobicContact CG2-CB 4.43Å; V171-L180 HydrophobicContact CG2-CD2 4.17Å; L176-L180 WeakPolarHBondContact O-CB 3.46Å; L176-L180 PolarHBondContact O-N 2.88Å; L180-I184 HydrophobicContact CD1-CD1 3.64Å; L180-I184 HydrophobicContact CD1-CG1 4.13Å; L180-I184 HydrophobicContact CG-CD1 3.91Å; L180-I184 WeakPolarHBondContact O-CB 3.45Å; L180-I184 WeakPolarHBondContact O-CG1 3.48Å; L180-I184 PolarHBondContact O-N 3.05Å; L180-L209 HydrophobicContact CD2-CD1 3.82Å; L180-F218 HydrophobicContact CD2-CD2 4.32Å; L180-F218 HydrophobicContact CD2-CE2 4.16Å; L180-F218 HydrophobicContact CG-CE2 4.27Å
181V97.6Very high94.8Very high4 Ų441.3 Ų41.32%0.02422%0.222CC..Hα-helixtrans-64.2-42.3177.2166.50000111.4L177 K178 E179 F185 F218 L221 L222 R225L177-V181 WeakPolarHBondContact O-CG2 3.44Å; L177-V181 PolarHBondContact O-N 3.37Å; K178-V181 PolarHBondContact O-N 2.93Å; E179-V181 VanDerWaalsContact C-N 3.29Å; E179-V181 PolarHBondContact O-N 3.36Å; V181-F185 WeakPolarHBondContact O-CB 3.02Å; V181-F185 PolarHBondContact O-N 3.27Å; V181-F218 HydrophobicContact CG2-CD2 3.52Å; V181-F218 HydrophobicContact CG2-CE2 3.53Å; V181-F218 HydrophobicContact CG2-CG 4.27Å; V181-F218 HydrophobicContact CG2-CZ 4.28Å; V181-L221 HydrophobicContact CG1-CB 4.49Å; V181-L221 HydrophobicContact CG2-CB 4.04Å; V181-L222 HydrophobicContact CG1-CB 4.31Å; V181-L222 HydrophobicContact CG1-CD1 4.43Å; V181-R225 HydrophobicContact CG1-CB 4.07Å
182E97.5Very high94.3Very high75 Ų7545.9 Ų45.935%0.3525%0.252SS..Hα-helixtrans-65.8-43.4178.1-168.563.8-140.900111.9K178 E179 T186 R225K178-E182 PolarHBondContact O-N 3.11Å; E179-E182 PolarHBondContact O-N 2.75Å; E179-E182 VanDerWaalsContact O-N 3.1Å; E182-T186 WeakPolarHBondContact O-CB 3.46Å; E182-T186 PolarHBondContact O-N 3.48Å; E182-T186 PolarHBondContact O-OG1 2.56Å; E182-R225 IonicContact OE1-CZ 2.79Å; E182-R225 VanDerWaalsContact OE1-CZ 3.25Å; E182-R225 IonicContact OE1-NE 2.73Å; E182-R225 PolarHBondContact OE1-NE 3.36Å; E182-R225 IonicContact OE1-NH2 2.73Å; E182-R225 PolarHBondContact OE1-NH2 2.97Å; E182-R225 WeakPolarHBondContact OE2-CD 3.46Å; E182-R225 IonicContact OE2-CZ 2.79Å; E182-R225 IonicContact OE2-NE 2.68Å; E182-R225 PolarHBondContact OE2-NE 3.46Å
183L96.9Very high94.1Very high31 Ų3149.1 Ų49.116%0.16227%0.266CS..Hα-helixtrans-61.7-53.1178.3-70.3163.4000111.1L138 A139 V142 E179 F185 T186 Q187L138-L183 HydrophobicContact CG-CD1 4.36Å; A139-L183 HydrophobicContact CB-CD1 4.17Å; A139-L183 HydrophobicContact CB-CD2 3.84Å; V142-L183 HydrophobicContact CB-CB 4.47Å; V142-L183 HydrophobicContact CB-CD1 4.13Å; V142-L183 HydrophobicContact CG1-CB 3.72Å; V142-L183 HydrophobicContact CG1-CD1 4.27Å; V142-L183 HydrophobicContact CG2-CD1 4.27Å; E179-L183 HydrophobicContact CG-CD1 3.97Å; E179-L183 HydrophobicContact CG-CG 4.47Å; E179-L183 VanDerWaalsContact O-CG 3.3Å; E179-L183 WeakPolarHBondContact O-CG 3.18Å; E179-L183 PolarHBondContact O-N 3.15Å; L183-F185 PolarHBondContact O-N 3.35Å; L183-T186 PolarHBondContact O-N 3.46Å; L183-Q187 WeakPolarHBondContact O-CG 3.46Å; L183-Q187 PolarHBondContact O-N 3.49Å
184I97.1Very high94.1Very high1 Ų146.7 Ų46.71%0.00525%0.25CS..Hα-helixtrans-63.3-42.2179.5-67.5175.4000110.9V142 L146 L180 S188 L201 L205 F218V142-I184 HydrophobicContact CG1-CG1 4.18Å; L146-I184 HydrophobicContact CD1-CG1 4.2Å; L180-I184 HydrophobicContact CD1-CD1 3.64Å; L180-I184 HydrophobicContact CD1-CG1 4.13Å; L180-I184 HydrophobicContact CG-CD1 3.91Å; L180-I184 WeakPolarHBondContact O-CB 3.45Å; L180-I184 WeakPolarHBondContact O-CG1 3.48Å; L180-I184 PolarHBondContact O-N 3.05Å; I184-S188 WeakPolarHBondContact O-CB 3.4Å; I184-S188 PolarHBondContact O-N 2.89Å; I184-S188 PolarHBondContact O-OG 2.99Å; I184-L201 HydrophobicContact CD1-CD2 4.02Å; I184-L201 HydrophobicContact CG1-CD2 4.39Å; I184-L201 HydrophobicContact CG2-CD2 4.34Å; I184-L205 HydrophobicContact CD1-CD1 3.34Å; I184-F218 HydrophobicContact CD1-CE2 4.28Å; I184-F218 HydrophobicContact CD1-CZ 4.27Å
185F97.6Very high94.2Very high2 Ų244.7 Ų44.71%0.00924%0.243CC..Hα-helixtrans-62.8-45.3177178.2-89.7000112.1V181 L183 S188 T189 L222 R225 E229 F250 F253V181-F185 WeakPolarHBondContact O-CB 3.02Å; V181-F185 PolarHBondContact O-N 3.27Å; L183-F185 PolarHBondContact O-N 3.35Å; F185-S188 PolarHBondContact O-N 3.35Å; F185-T189 HydrophobicContact CE1-CG2 4.49Å; F185-T189 HydrophobicContact CZ-CG2 4.31Å; F185-T189 PolarHBondContact O-N 2.94Å; F185-T189 PolarHBondContact O-OG1 3.18Å; F185-L222 HydrophobicContact CD2-CD1 4.44Å; F185-R225 HydrophobicContact CB-CG 4.18Å; F185-R225 HydrophobicContact CD1-CG 3.96Å; F185-R225 HydrophobicContact CD2-CG 4.06Å; F185-R225 HydrophobicContact CE1-CG 4.41Å; F185-R225 VanDerWaalsContact CE1-NH1 3.28Å; F185-R225 HydrophobicContact CE2-CG 4.49Å; F185-R225 HydrophobicContact CG-CG 3.79Å; F185-E229 HydrophobicContact CE1-CG 4.42Å; F185-E229 HydrophobicContact CZ-CB 3.9Å; F185-E229 HydrophobicContact CZ-CG 4.01Å; F185-F250 AromaticContact CE2-CD2 3.92Å; F185-F250 HydrophobicContact CE2-CD2 3.92Å; F185-F250 AromaticContact CE2-CE2 3.97Å; F185-F250 HydrophobicContact CE2-CE2 3.97Å; F185-F250 AromaticContact CZ-CD2 3.63Å; F185-F250 HydrophobicContact CZ-CD2 3.63Å; F185-F250 AromaticContact CZ-CE2 3.92Å; F185-F250 HydrophobicContact CZ-CE2 3.92Å; F185-F253 HydrophobicContact CD2-CD1 4.36Å; F185-F253 AromaticContact CD2-CE1 3.76Å; F185-F253 HydrophobicContact CD2-CE1 3.76Å; F185-F253 HydrophobicContact CE2-CD1 4.19Å; F185-F253 AromaticContact CE2-CE1 3.97Å; F185-F253 HydrophobicContact CE2-CE1 3.97Å
186T95.2Very high94.3Very high62 Ų6244.8 Ų44.838%0.3824%0.24SC..Hα-helixtrans-63-48.2-179.7-63.30000110.8E182 L183 T189 A190E182-T186 WeakPolarHBondContact O-CB 3.46Å; E182-T186 PolarHBondContact O-N 3.48Å; E182-T186 PolarHBondContact O-OG1 2.56Å; L183-T186 PolarHBondContact O-N 3.46Å; T186-T189 PolarHBondContact O-N 2.9Å; T186-T189 PolarHBondContact O-OG1 3.24Å; T186-A190 WeakPolarHBondContact O-CB 3.41Å; T186-A190 PolarHBondContact O-N 3.09Å
187Q93Very high94.3Very high44 Ų4442.9 Ų42.921%0.20623%0.23CC..Hα-helixtrans-67.6-39.3178.4-64.1-67.721.400112.1L146 L183 T189 A190 I191L146-Q187 HydrophobicContact CD1-CB 3.76Å; L146-Q187 HydrophobicContact CD1-CG 3.79Å; L183-Q187 WeakPolarHBondContact O-CG 3.46Å; L183-Q187 PolarHBondContact O-N 3.49Å; Q187-T189 PolarHBondContact O-N 3.18Å; Q187-T189 VanDerWaalsContact O-N 3.12Å; Q187-A190 PolarHBondContact O-N 3.28Å; Q187-I191 HydrophobicContact CB-CD1 3.9Å; Q187-I191 HydrophobicContact CB-CG1 4.38Å; Q187-I191 HydrophobicContact CG-CD1 4.48Å; Q187-I191 WeakPolarHBondContact O-CB 3.45Å; Q187-I191 WeakPolarHBondContact O-CG1 3.41Å; Q187-I191 PolarHBondContact O-N 3.32Å
188S94.3Very high94.4Very high0 Ų042.9 Ų42.90%023%0.23CC..Hα-helixtrans-63.9-16.6176.9-57.60000114.7I184 F185 S195 G198 F253I184-S188 WeakPolarHBondContact O-CB 3.4Å; I184-S188 PolarHBondContact O-N 2.89Å; I184-S188 PolarHBondContact O-OG 2.99Å; F185-S188 PolarHBondContact O-N 3.35Å; S188-S195 PolarHBondContact O-OG 3.15Å; S188-G198 WeakPolarHBondContact OG-CA 3.45Å; S188-F253 VanDerWaalsContact CB-CE2 3.41Å
189T93.5Very high94.5Very high23 Ų2339 Ų3914%0.14121%0.213CC..Hα-helixtrans-110.9-14.617656.40000113.7F185 T186 Q187 S249 F250 F253F185-T189 HydrophobicContact CE1-CG2 4.49Å; F185-T189 HydrophobicContact CZ-CG2 4.31Å; F185-T189 PolarHBondContact O-N 2.94Å; F185-T189 PolarHBondContact O-OG1 3.18Å; T186-T189 PolarHBondContact O-N 2.9Å; T186-T189 PolarHBondContact O-OG1 3.24Å; Q187-T189 PolarHBondContact O-N 3.18Å; Q187-T189 VanDerWaalsContact O-N 3.12Å; T189-S249 WeakPolarHBondContact O-CB 3.38Å; T189-S249 PolarHBondContact O-OG 3.24Å; T189-F250 HydrophobicContact CG2-CB 4.33Å; T189-F253 HydrophobicContact CG2-CB 3.89Å; T189-F253 HydrophobicContact CG2-CD1 3.83Å; T189-F253 HydrophobicContact CG2-CG 3.99Å
190A91.8Very high94.5Very high64 Ų6438.2 Ų38.253%0.52921%0.207SC..Hα-helixtrans-93-42.5176.300000113.3T186 Q187T186-A190 WeakPolarHBondContact O-CB 3.41Å; T186-A190 PolarHBondContact O-N 3.09Å; Q187-A190 PolarHBondContact O-N 3.28Å
191I87.9Confident94.5Very high35 Ų3538.2 Ų38.218%0.17921%0.207CC..SBendtrans-78.2124.2-173.6-56.9175.7000110S150 Q187 F194S150-I191 VanDerWaalsContact OG-CG2 3.3Å; S150-I191 WeakPolarHBondContact OG-CG2 3.32Å; Q187-I191 HydrophobicContact CB-CD1 3.9Å; Q187-I191 HydrophobicContact CB-CG1 4.38Å; Q187-I191 HydrophobicContact CG-CD1 4.48Å; Q187-I191 WeakPolarHBondContact O-CB 3.45Å; Q187-I191 WeakPolarHBondContact O-CG1 3.41Å; Q187-I191 PolarHBondContact O-N 3.32Å; I191-F194 HydrophobicContact CB-CB 3.77Å; I191-F194 HydrophobicContact CB-CG 4.36Å; I191-F194 HydrophobicContact CD1-CD1 4.44Å; I191-F194 HydrophobicContact CG2-CB 3.64Å; I191-F194 HydrophobicContact CG2-CG 4.32Å; I191-F194 PolarHBondContact O-N 3.4Å
192P84.7Confident94.5Very high99 Ų9938 Ų3864%0.64321%0.205SC*.THydrogen-bonded Turntrans-59.5139177.6-23.534.3000112.6F194P192-F194 PolarHBondContact O-N 2.88Å
193N87.6Confident94.4Very high160 Ų16035.9 Ų35.986%0.85620%0.196SC*.THydrogen-bonded Turntrans63.5-11.6178.8-47.1-37.7000116.3S195N193-S195 VanDerWaalsContact C-N 3.28Å; N193-S195 PolarHBondContact O-N 3.06Å
194F93.8Very high94.4Very high3 Ų336.4 Ų36.41%0.01320%0.197CC..THydrogen-bonded Turntrans-72.4-14.9-176.9-172.8-106.8000114.4L146 L149 I191 P192 Y196 T197 G198L146-F194 HydrophobicContact CB-CZ 4.48Å; L146-F194 HydrophobicContact CD2-CE1 3.82Å; L146-F194 HydrophobicContact CD2-CZ 3.64Å; L149-F194 HydrophobicContact CB-CE2 3.86Å; L149-F194 HydrophobicContact CB-CZ 4.28Å; I191-F194 HydrophobicContact CB-CB 3.77Å; I191-F194 HydrophobicContact CB-CG 4.36Å; I191-F194 HydrophobicContact CD1-CD1 4.44Å; I191-F194 HydrophobicContact CG2-CB 3.64Å; I191-F194 HydrophobicContact CG2-CG 4.32Å; I191-F194 PolarHBondContact O-N 3.4Å; P192-F194 PolarHBondContact O-N 2.88Å; F194-Y196 PolarHBondContact O-N 2.88Å; F194-T197 HydrophobicContact CD2-CG2 4.25Å; F194-T197 HydrophobicContact CE2-CG2 3.57Å; F194-T197 HydrophobicContact CZ-CG2 4.08Å; F194-T197 PolarHBondContact O-N 3.22Å; F194-G198 PolarHBondContact O-N 3.31Å
195S94.6Very high94.3Very high17 Ų1736.3 Ų36.312%0.11920%0.196CC..Hα-helixtrans-56-28.7-173.3-530000114.8S188 N193 A199S188-S195 PolarHBondContact O-OG 3.15Å; N193-S195 VanDerWaalsContact C-N 3.28Å; N193-S195 PolarHBondContact O-N 3.06Å; S195-A199 VanDerWaalsContact O-CB 3.31Å; S195-A199 WeakPolarHBondContact O-CB 3.45Å; S195-A199 PolarHBondContact O-N 3.4Å
196Y95.9Very high94.2Very high113 Ų11336.9 Ų36.944%0.44320%0.201SC..Hα-helixtrans-66.8-55.9170.9171.6-108.9000111.5F194 G198 A199 R200F194-Y196 PolarHBondContact O-N 2.88Å; Y196-G198 VanDerWaalsContact C-N 3.31Å; Y196-G198 PolarHBondContact O-N 3.07Å; Y196-A199 WeakPolarHBondContact O-CB 3.49Å; Y196-A199 PolarHBondContact O-N 3.36Å; Y196-R200 HydrophobicContact CE1-CG 4.32Å; Y196-R200 HydrophobicContact CE2-CG 4.25Å; Y196-R200 WeakPolarHBondContact O-CG 3.25Å; Y196-R200 PolarHBondContact O-N 3.21Å
197T96.6Very high94.1Very high8 Ų837.2 Ų37.25%0.04920%0.197CC..Hα-helixtrans-60-40.4178.3-47.40000111.8L149 F156 F194 A199 R200 L201L149-T197 HydrophobicContact CB-CG2 4.19Å; F156-T197 HydrophobicContact CD2-CG2 3.96Å; F194-T197 HydrophobicContact CD2-CG2 4.25Å; F194-T197 HydrophobicContact CE2-CG2 3.57Å; F194-T197 HydrophobicContact CZ-CG2 4.08Å; F194-T197 PolarHBondContact O-N 3.22Å; T197-A199 PolarHBondContact O-N 3.14Å; T197-R200 WeakPolarHBondContact O-CB 3.48Å; T197-R200 PolarHBondContact O-N 2.68Å; T197-L201 WeakPolarHBondContact O-CB 3.22Å; T197-L201 PolarHBondContact O-N 3.28Å
198G96.9Very high94.1Very high0 Ų039.6 Ų39.60%021%0.208CC..Hα-helixtrans-61.7-38.3172.600000113.1S188 F194 Y196 C202S188-G198 WeakPolarHBondContact OG-CA 3.45Å; F194-G198 PolarHBondContact O-N 3.31Å; Y196-G198 VanDerWaalsContact C-N 3.31Å; Y196-G198 PolarHBondContact O-N 3.07Å; G198-C202 WeakPolarHBondContact O-CB 3.48Å; G198-C202 PolarHBondContact O-N 3.46Å; G198-C202 PolarHBondContact O-SG 2.95Å
199A97.3Very high94.1Very high0 Ų040.7 Ų40.70%021%0.214CC..Hα-helixtrans-70.2-37.9174.100000112.7S195 Y196 T197 C202 N203 F253 E256 N260S195-A199 VanDerWaalsContact O-CB 3.31Å; S195-A199 WeakPolarHBondContact O-CB 3.45Å; S195-A199 PolarHBondContact O-N 3.4Å; Y196-A199 WeakPolarHBondContact O-CB 3.49Å; Y196-A199 PolarHBondContact O-N 3.36Å; T197-A199 PolarHBondContact O-N 3.14Å; A199-C202 PolarHBondContact O-N 3.41Å; A199-N203 PolarHBondContact O-N 3.09Å; A199-F253 HydrophobicContact CB-CE2 4.39Å; A199-E256 HydrophobicContact CB-CB 3.64Å; A199-N260 HydrophobicContact CB-CB 4.21Å
200R96.9Very high93.9Very high61 Ų6143.8 Ų43.823%0.2324%0.242CC..Hα-helixtrans-60-49.1171.1-65.5-173.173.7-166.13111.3F156 E157 Y196 T197 C202 N203 Y204F156-R200 VanDerWaalsContact CD1-CZ 3.48Å; F156-R200 HydrophobicContact CE1-CB 4.25Å; F156-R200 HydrophobicContact CE2-CB 4.01Å; F156-R200 HydrophobicContact CZ-CB 3.73Å; E157-R200 IonicContact OE1-CZ 3.76Å; E157-R200 IonicContact OE1-NH1 2.76Å; E157-R200 PolarHBondContact OE1-NH1 2.83Å; E157-R200 IonicContact OE1-NH2 2.74Å; E157-R200 PolarHBondContact OE1-NH2 2.81Å; E157-R200 IonicContact OE2-NH1 3.68Å; Y196-R200 HydrophobicContact CE1-CG 4.32Å; Y196-R200 HydrophobicContact CE2-CG 4.25Å; Y196-R200 WeakPolarHBondContact O-CG 3.25Å; Y196-R200 PolarHBondContact O-N 3.21Å; T197-R200 WeakPolarHBondContact O-CB 3.48Å; T197-R200 PolarHBondContact O-N 2.68Å; R200-C202 PolarHBondContact O-N 2.99Å; R200-N203 WeakPolarHBondContact O-CB 3.21Å; R200-N203 PolarHBondContact O-N 3.03Å; R200-N203 VanDerWaalsContact O-N 3.15Å; R200-Y204 PolarHBondContact O-N 3.37Å
201L97Very high93.7Very high0 Ų043 Ų430%023%0.229CC..Hα-helixtrans-59.4-45.9177-177.466.2000111.2F145 L146 F156 V160 I184 T197 N203 Y204 L205F145-L201 HydrophobicContact CE2-CD2 3.96Å; L146-L201 HydrophobicContact CD2-CD2 3.51Å; F156-L201 HydrophobicContact CE2-CB 4.08Å; F156-L201 HydrophobicContact CE2-CD1 4.43Å; V160-L201 HydrophobicContact CG2-CD1 4.13Å; I184-L201 HydrophobicContact CD1-CD2 4.02Å; I184-L201 HydrophobicContact CG1-CD2 4.39Å; I184-L201 HydrophobicContact CG2-CD2 4.34Å; T197-L201 WeakPolarHBondContact O-CB 3.22Å; T197-L201 PolarHBondContact O-N 3.28Å; L201-N203 VanDerWaalsContact C-N 3.28Å; L201-N203 PolarHBondContact O-N 3.45Å; L201-Y204 PolarHBondContact O-N 3.45Å; L201-Y204 VanDerWaalsContact O-N 3.15Å; L201-L205 HydrophobicContact CD1-CD1 3.96Å; L201-L205 HydrophobicContact CD1-CD2 4.46Å; L201-L205 HydrophobicContact CD1-CG 3.96Å; L201-L205 HydrophobicContact CD2-CD1 4.33Å; L201-L205 HydrophobicContact CG-CD1 3.81Å; L201-L205 HydrophobicContact CG-CG 4.18Å; L201-L205 WeakPolarHBondContact O-CB 3.28Å; L201-L205 WeakPolarHBondContact O-CG 3.31Å; L201-L205 PolarHBondContact O-N 2.73Å
202C97.5Very high93.7Very high0 Ų045.4 Ų45.40%025%0.248CC..Hα-helixtrans-56.5-40.9175-74.20000112.5G198 A199 R200 S206 F218 L222 L257G198-C202 WeakPolarHBondContact O-CB 3.48Å; G198-C202 PolarHBondContact O-N 3.46Å; G198-C202 PolarHBondContact O-SG 2.95Å; A199-C202 PolarHBondContact O-N 3.41Å; R200-C202 PolarHBondContact O-N 2.99Å; C202-S206 VanDerWaalsContact O-CB 3.31Å; C202-S206 WeakPolarHBondContact O-CB 3.41Å; C202-S206 PolarHBondContact O-N 3.23Å; C202-S206 VanDerWaalsContact O-N 3.16Å; C202-F218 HydrophobicContact CB-CE1 4.37Å; C202-L222 HydrophobicContact CB-CD2 3.58Å; C202-L257 HydrophobicContact CB-CD1 3.68Å
203N96.4Very high93.5Very high30 Ų3042 Ų4216%0.1623%0.226CC..Hα-helixtrans-67.5-43.3175.4-17549.5000112.2A199 R200 L201 S206 H207 N260 L261 E262A199-N203 PolarHBondContact O-N 3.09Å; R200-N203 WeakPolarHBondContact O-CB 3.21Å; R200-N203 PolarHBondContact O-N 3.03Å; R200-N203 VanDerWaalsContact O-N 3.15Å; L201-N203 VanDerWaalsContact C-N 3.28Å; L201-N203 PolarHBondContact O-N 3.45Å; N203-S206 PolarHBondContact O-N 3.09Å; N203-S206 PolarHBondContact O-OG 3.28Å; N203-H207 PolarHBondContact O-ND1 3.33Å; N203-H207 PolarHBondContact OD1-CE1 2.99Å; N203-N260 VanDerWaalsContact CB-O 3.32Å; N203-N260 WeakPolarHBondContact CB-O 3.39Å; N203-N260 PolarHBondContact ND2-O 3.1Å; N203-N260 PolarHBondContact OD1-O 2.93Å; N203-L261 HydrophobicContact CB-CD1 4.38Å; N203-E262 PolarHBondContact OD1-N 3.02Å
204Y96.3Very high93.1Very high42 Ų4244.1 Ų44.117%0.16523%0.231CC..Hα-helixtrans-62-55.1178.6-166.6-85.4000111.6V160 T164 R200 L201 S206 H207 H208V160-Y204 HydrophobicContact CG1-CD2 4.13Å; V160-Y204 HydrophobicContact CG1-CE1 4.31Å; V160-Y204 HydrophobicContact CG1-CE2 3.83Å; V160-Y204 HydrophobicContact CG2-CD1 3.46Å; V160-Y204 VanDerWaalsContact CG2-CD1 3.46Å; V160-Y204 HydrophobicContact CG2-CD2 4.04Å; V160-Y204 HydrophobicContact CG2-CE1 3.8Å; V160-Y204 HydrophobicContact CG2-CE2 4.35Å; V160-Y204 HydrophobicContact CG2-CG 3.58Å; T164-Y204 HydrophobicContact CG2-CE1 4.14Å; T164-Y204 WeakPolarHBondContact OG1-CD1 3.27Å; T164-Y204 VanDerWaalsContact OG1-CE1 3.28Å; T164-Y204 WeakPolarHBondContact OG1-CE1 3.29Å; R200-Y204 PolarHBondContact O-N 3.37Å; L201-Y204 PolarHBondContact O-N 3.45Å; L201-Y204 VanDerWaalsContact O-N 3.15Å; Y204-S206 PolarHBondContact O-N 2.95Å; Y204-S206 VanDerWaalsContact O-N 3.13Å; Y204-H207 PolarHBondContact O-N 3.15Å; Y204-H208 HydrophobicContact CD1-CB 3.91Å; Y204-H208 AromaticContact CD1-CD2 3.84Å; Y204-H208 AromaticContact CD1-CG 3.97Å; Y204-H208 AromaticContact CD2-CD2 3.93Å; Y204-H208 HydrophobicContact CE1-CB 3.55Å; Y204-H208 AromaticContact CE1-CD2 3.67Å; Y204-H208 AromaticContact CE1-CG 3.48Å; Y204-H208 VanDerWaalsContact CE1-CG 3.48Å; Y204-H208 AromaticContact CE1-ND1 3.99Å; Y204-H208 AromaticContact CE2-CD2 3.75Å; Y204-H208 AromaticContact CE2-NE2 3.69Å; Y204-H208 AromaticContact CG-CD2 3.97Å; Y204-H208 AromaticContact CZ-CD2 3.61Å; Y204-H208 AromaticContact CZ-CE1 3.8Å; Y204-H208 AromaticContact CZ-CG 3.62Å; Y204-H208 AromaticContact CZ-ND1 3.73Å; Y204-H208 AromaticContact CZ-NE2 3.79Å; Y204-H208 PolarHBondContact O-CD2 3.12Å; Y204-H208 PolarHBondContact O-N 2.78Å
205L96.4Very high92.1Very high0 Ų045.8 Ų45.80%024%0.243CC..Hα-helixtrans-60-28178.7-65.2178.9000112.7T164 L167 I184 L201 H207 L209 F218T164-L205 HydrophobicContact CG2-CD2 3.94Å; T164-L205 WeakPolarHBondContact OG1-CD2 3.4Å; L167-L205 HydrophobicContact CD1-CD1 4.07Å; L167-L205 HydrophobicContact CD1-CD2 3.75Å; I184-L205 HydrophobicContact CD1-CD1 3.34Å; L201-L205 HydrophobicContact CD1-CD1 3.96Å; L201-L205 HydrophobicContact CD1-CD2 4.46Å; L201-L205 HydrophobicContact CD1-CG 3.96Å; L201-L205 HydrophobicContact CD2-CD1 4.33Å; L201-L205 HydrophobicContact CG-CD1 3.81Å; L201-L205 HydrophobicContact CG-CG 4.18Å; L201-L205 WeakPolarHBondContact O-CB 3.28Å; L201-L205 WeakPolarHBondContact O-CG 3.31Å; L201-L205 PolarHBondContact O-N 2.73Å; L205-H207 PolarHBondContact O-N 3.13Å; L205-L209 HydrophobicContact CB-CD1 3.85Å; L205-L209 HydrophobicContact CB-CG 4.09Å; L205-L209 HydrophobicContact CD2-CD1 4.28Å; L205-L209 HydrophobicContact CD2-CD2 4.12Å; L205-L209 HydrophobicContact CD2-CG 3.98Å; L205-L209 HydrophobicContact CG-CD1 4.48Å; L205-L209 WeakPolarHBondContact O-CB 3.22Å; L205-L209 WeakPolarHBondContact O-CG 3.16Å; L205-L209 PolarHBondContact O-N 3.02Å; L205-F218 HydrophobicContact CB-CD1 4.06Å; L205-F218 HydrophobicContact CB-CD2 4.47Å; L205-F218 HydrophobicContact CB-CE1 3.89Å; L205-F218 HydrophobicContact CB-CE2 4.3Å; L205-F218 HydrophobicContact CB-CG 4.36Å; L205-F218 HydrophobicContact CB-CZ 4.02Å; L205-F218 HydrophobicContact CD1-CE2 4.14Å; L205-F218 HydrophobicContact CD1-CZ 4Å
206S94.8Very high91.6Very high14 Ų1445.2 Ų45.210%0.09824%0.24CC..Hα-helixtrans-66.4-15.217481.70000115.2C202 N203 Y204C202-S206 VanDerWaalsContact O-CB 3.31Å; C202-S206 WeakPolarHBondContact O-CB 3.41Å; C202-S206 PolarHBondContact O-N 3.23Å; C202-S206 VanDerWaalsContact O-N 3.16Å; N203-S206 PolarHBondContact O-N 3.09Å; N203-S206 PolarHBondContact O-OG 3.28Å; Y204-S206 PolarHBondContact O-N 2.95Å; Y204-S206 VanDerWaalsContact O-N 3.13Å
207H92.5Very high91.4Very high68 Ų6842.2 Ų42.232%0.31523%0.232SC..Hα-helixtrans-112-31.1177.3-65.691.3000113.3N203 Y204 L205 K264N203-H207 PolarHBondContact O-ND1 3.33Å; N203-H207 PolarHBondContact OD1-CE1 2.99Å; Y204-H207 PolarHBondContact O-N 3.15Å; L205-H207 PolarHBondContact O-N 3.13Å; H207-K264 PolarHBondContact CD2-NZ 2.88Å; H207-K264 PolarHBondContact CE1-NZ 3.4Å; H207-K264 PolarHBondContact NE2-NZ 3.35Å
208H94.1Very high91.3Very high94 Ų9442 Ų4244%0.43523%0.23SC..Hα-helixtrans-108.9-5-168.3-67-99.4000115.4T164 N168 Y204T164-H208 HydrophobicContact CG2-CB 3.73Å; N168-H208 PolarHBondContact ND2-O 2.9Å; Y204-H208 HydrophobicContact CD1-CB 3.91Å; Y204-H208 AromaticContact CD1-CD2 3.84Å; Y204-H208 AromaticContact CD1-CG 3.97Å; Y204-H208 AromaticContact CD2-CD2 3.93Å; Y204-H208 HydrophobicContact CE1-CB 3.55Å; Y204-H208 AromaticContact CE1-CD2 3.67Å; Y204-H208 AromaticContact CE1-CG 3.48Å; Y204-H208 VanDerWaalsContact CE1-CG 3.48Å; Y204-H208 AromaticContact CE1-ND1 3.99Å; Y204-H208 AromaticContact CE2-CD2 3.75Å; Y204-H208 AromaticContact CE2-NE2 3.69Å; Y204-H208 AromaticContact CG-CD2 3.97Å; Y204-H208 AromaticContact CZ-CD2 3.61Å; Y204-H208 AromaticContact CZ-CE1 3.8Å; Y204-H208 AromaticContact CZ-CG 3.62Å; Y204-H208 AromaticContact CZ-ND1 3.73Å; Y204-H208 AromaticContact CZ-NE2 3.79Å; Y204-H208 PolarHBondContact O-CD2 3.12Å; Y204-H208 PolarHBondContact O-N 2.78Å
209L93.7Very high91.2Very high24 Ų2444.4 Ų44.413%0.12624%0.239CC..  trans-78.8126.1167.2-71.9174.3000110.9T164 L167 N168 L177 L180 L205 F218T164-L209 HydrophobicContact CG2-CD2 4.42Å; L167-L209 HydrophobicContact CB-CD2 3.97Å; N168-L209 WeakPolarHBondContact OD1-CA 3.36Å; L177-L209 HydrophobicContact CD1-CD1 4.12Å; L180-L209 HydrophobicContact CD2-CD1 3.82Å; L205-L209 HydrophobicContact CB-CD1 3.85Å; L205-L209 HydrophobicContact CB-CG 4.09Å; L205-L209 HydrophobicContact CD2-CD1 4.28Å; L205-L209 HydrophobicContact CD2-CD2 4.12Å; L205-L209 HydrophobicContact CD2-CG 3.98Å; L205-L209 HydrophobicContact CG-CD1 4.48Å; L205-L209 WeakPolarHBondContact O-CB 3.22Å; L205-L209 WeakPolarHBondContact O-CG 3.16Å; L205-L209 PolarHBondContact O-N 3.02Å; L209-F218 HydrophobicContact CD1-CB 3.92Å; L209-F218 HydrophobicContact CD1-CD2 3.54Å; L209-F218 HydrophobicContact CD1-CE2 4.27Å; L209-F218 HydrophobicContact CD1-CG 3.84Å
210A88.9Confident91.1Very high87 Ų8751.4 Ų51.472%0.71927%0.265SS*.  trans-75-26.8-178.600000113.1N168 S212N168-A210 WeakPolarHBondContact OD1-CB 3.21Å; N168-A210 PolarHBondContact OD1-N 3.43Å; A210-S212 PolarHBondContact O-N 2.79Å
211L87.9Confident91Very high48 Ų4849.2 Ų49.225%0.25126%0.258SS..  trans-77.1108.8-177.7-169.374.6000111.6V171 T173 L177V171-L211 HydrophobicContact CG1-CD2 4.29Å; V171-L211 WeakPolarHBondContact O-CD2 3.32Å; T173-L211 VanDerWaalsContact O-CD2 3.24Å; T173-L211 WeakPolarHBondContact O-CD2 3.38Å; L177-L211 HydrophobicContact CB-CD2 4.13Å; L177-L211 HydrophobicContact CD2-CD2 4.25Å
212S87.1Confident91.1Very high85 Ų8549.2 Ų49.259%0.59426%0.258SS*.  trans-126.380.7177.3176.30000111.4A210A210-S212 PolarHBondContact O-N 2.79Å
213P82Confident91Very high28 Ų2850.6 Ų50.618%0.18227%0.266CS..  trans-71.8164.5179.731.4-33.8000112E174 L177 S215 G216E174-P213 HydrophobicContact CB-CB 4.47Å; E174-P213 HydrophobicContact CB-CG 4.4Å; E174-P213 HydrophobicContact CG-CB 4.38Å; E174-P213 HydrophobicContact CG-CG 4.07Å; L177-P213 HydrophobicContact CD2-CG 4.03Å; P213-S215 WeakPolarHBondContact CG-OG 3.48Å; P213-S215 PolarHBondContact O-N 3.17Å; P213-G216 WeakPolarHBondContact CD-O 3.49Å; P213-G216 WeakPolarHBondContact CG-O 3.41Å; P213-G216 PolarHBondContact O-N 3.47Å; P213-G216 VanDerWaalsContact O-N 3.12Å
214Q77.8Confident91Very high204 Ų20454.8 Ų54.895%0.95328%0.284SS*.SBendtrans-64.4-27.8-176.3-61.9-173.812.700113.5
215S74.1Confident91Very high39 Ų3954.9 Ų54.927%0.27328%0.284SS..SBendtrans-60.3-44.9171.649.20000112.3E174 P213 R220E174-S215 PolarHBondContact OE1-OG 3.35Å; E174-S215 WeakPolarHBondContact OE2-CB 3.44Å; E174-S215 PolarHBondContact OE2-OG 2.92Å; P213-S215 WeakPolarHBondContact CG-OG 3.48Å; P213-S215 PolarHBondContact O-N 3.17Å; S215-R220 PolarHBondContact O-NE 2.86Å; S215-R220 PolarHBondContact O-NH1 3.04Å
216G82.9Confident91.1Very high4 Ų455 Ų554%0.04129%0.285CS..  trans161.9145.3176.700000113.5P213P213-G216 WeakPolarHBondContact CD-O 3.49Å; P213-G216 WeakPolarHBondContact CG-O 3.41Å; P213-G216 PolarHBondContact O-N 3.47Å; P213-G216 VanDerWaalsContact O-N 3.12Å
217N92.1Very high91.2Very high51 Ų5157.3 Ų57.327%0.27329%0.294SS..  trans-69.3170165.970.1-5.7000111.5R219 R220 L221N217-R219 PolarHBondContact O-N 2.55Å; N217-R219 VanDerWaalsContact O-N 3.08Å; N217-R220 PolarHBondContact O-N 2.98Å; N217-R220 PolarHBondContact OD1-N 2.93Å; N217-L221 PolarHBondContact O-N 2.95Å
218F95.4Very high91.4Very high3 Ų357.3 Ų57.31%0.01330%0.299CS..Hα-helixtrans-42.8-46.7178.8-178.6-90.5000113.4L177 L180 V181 I184 C202 L205 L209 R220 L221 L222L177-F218 HydrophobicContact CD1-CB 4.32Å; L177-F218 HydrophobicContact CD1-CD2 4.21Å; L180-F218 HydrophobicContact CD2-CD2 4.32Å; L180-F218 HydrophobicContact CD2-CE2 4.16Å; L180-F218 HydrophobicContact CG-CE2 4.27Å; V181-F218 HydrophobicContact CG2-CD2 3.52Å; V181-F218 HydrophobicContact CG2-CE2 3.53Å; V181-F218 HydrophobicContact CG2-CG 4.27Å; V181-F218 HydrophobicContact CG2-CZ 4.28Å; I184-F218 HydrophobicContact CD1-CE2 4.28Å; I184-F218 HydrophobicContact CD1-CZ 4.27Å; C202-F218 HydrophobicContact CB-CE1 4.37Å; L205-F218 HydrophobicContact CB-CD1 4.06Å; L205-F218 HydrophobicContact CB-CD2 4.47Å; L205-F218 HydrophobicContact CB-CE1 3.89Å; L205-F218 HydrophobicContact CB-CE2 4.3Å; L205-F218 HydrophobicContact CB-CG 4.36Å; L205-F218 HydrophobicContact CB-CZ 4.02Å; L205-F218 HydrophobicContact CD1-CE2 4.14Å; L205-F218 HydrophobicContact CD1-CZ 4Å; L209-F218 HydrophobicContact CD1-CB 3.92Å; L209-F218 HydrophobicContact CD1-CD2 3.54Å; L209-F218 HydrophobicContact CD1-CE2 4.27Å; L209-F218 HydrophobicContact CD1-CG 3.84Å; F218-R220 PolarHBondContact O-N 3.34Å; F218-L221 PolarHBondContact O-N 3.04Å; F218-L222 HydrophobicContact CE1-CD2 4.1Å; F218-L222 WeakPolarHBondContact O-CB 3.3Å; F218-L222 PolarHBondContact O-N 2.9Å
219R95Very high91.6Very high51 Ų5155.4 Ų55.419%0.19229%0.29CS..Hα-helixtrans-58.6-42.8179.3-161.6169.863.5-154.6-5.6113.3N217 L223 L261 E262N217-R219 PolarHBondContact O-N 2.55Å; N217-R219 VanDerWaalsContact O-N 3.08Å; R219-L223 HydrophobicContact CG-CD1 4.31Å; R219-L223 WeakPolarHBondContact O-CB 3.27Å; R219-L223 VanDerWaalsContact O-CG 3.29Å; R219-L223 WeakPolarHBondContact O-CG 3.37Å; R219-L223 PolarHBondContact O-N 3.42Å; R219-L261 HydrophobicContact CG-CD1 4.19Å; R219-L261 HydrophobicContact CG-CD2 4.15Å; R219-L261 HydrophobicContact CG-CG 4.48Å; R219-E262 PolarHBondContact NH1-O 3.23Å; R219-E262 VanDerWaalsContact NH1-O 3.16Å
220R94Very high91.8Very high146 Ų14655.6 Ų55.655%0.55129%0.29SS*.Hα-helixtrans-69.2-41.5-179.4-177.5174176.5-169.71.4111.1S215 N217 F218 L223 Q224S215-R220 PolarHBondContact O-NE 2.86Å; S215-R220 PolarHBondContact O-NH1 3.04Å; N217-R220 PolarHBondContact O-N 2.98Å; N217-R220 PolarHBondContact OD1-N 2.93Å; F218-R220 PolarHBondContact O-N 3.34Å; R220-L223 PolarHBondContact O-N 2.8Å; R220-Q224 WeakPolarHBondContact O-CB 3.46Å; R220-Q224 PolarHBondContact O-N 3.02Å
221L96.1Very high92.2Very high15 Ų1556.6 Ų56.68%0.07928%0.279CS..Hα-helixtrans-66.7-42.2177.5-66.1171.9000111.4L177 K178 V181 N217 F218 Q224 R225L177-L221 HydrophobicContact CB-CD1 4.41Å; L177-L221 HydrophobicContact CD2-CD1 3.71Å; L177-L221 HydrophobicContact CG-CD1 3.76Å; K178-L221 HydrophobicContact CG-CD1 4.37Å; K178-L221 HydrophobicContact CG-CD2 4.38Å; V181-L221 HydrophobicContact CG1-CB 4.49Å; V181-L221 HydrophobicContact CG2-CB 4.04Å; N217-L221 PolarHBondContact O-N 2.95Å; F218-L221 PolarHBondContact O-N 3.04Å; L221-Q224 WeakPolarHBondContact O-CB 3.48Å; L221-Q224 PolarHBondContact O-N 3.2Å; L221-R225 PolarHBondContact O-N 3.48Å
222L97.3Very high92.6Very high0 Ų058.7 Ų58.70%029%0.288CS..Hα-helixtrans-60.1-47.2173.8178.265.4000112.3V181 F185 C202 F218 Q224 R225 C226 L257V181-L222 HydrophobicContact CG1-CB 4.31Å; V181-L222 HydrophobicContact CG1-CD1 4.43Å; F185-L222 HydrophobicContact CD2-CD1 4.44Å; C202-L222 HydrophobicContact CB-CD2 3.58Å; F218-L222 HydrophobicContact CE1-CD2 4.1Å; F218-L222 WeakPolarHBondContact O-CB 3.3Å; F218-L222 PolarHBondContact O-N 2.9Å; L222-Q224 VanDerWaalsContact C-N 3.31Å; L222-Q224 PolarHBondContact O-N 3.31Å; L222-R225 PolarHBondContact O-N 2.79Å; L222-C226 PolarHBondContact O-N 2.93Å; L222-C226 PolarHBondContact O-SG 3.31Å; L222-L257 HydrophobicContact CD2-CD1 3.91Å; L222-L257 HydrophobicContact CD2-CD2 4.09Å; L222-L257 HydrophobicContact CG-CD2 4.32Å
223L96.3Very high93.1Very high30 Ų3056.5 Ų56.516%0.15727%0.267CS..Hα-helixtrans-63.8-36.6176.8-71.6171.8000111.9R219 R220 C226 Q227 L261 I275 L276R219-L223 HydrophobicContact CG-CD1 4.31Å; R219-L223 WeakPolarHBondContact O-CB 3.27Å; R219-L223 VanDerWaalsContact O-CG 3.29Å; R219-L223 WeakPolarHBondContact O-CG 3.37Å; R219-L223 PolarHBondContact O-N 3.42Å; R220-L223 PolarHBondContact O-N 2.8Å; L223-C226 PolarHBondContact O-N 3.49Å; L223-Q227 WeakPolarHBondContact O-CB 3.28Å; L223-Q227 PolarHBondContact O-N 2.91Å; L223-L261 HydrophobicContact CD2-CD2 4.19Å; L223-I275 HydrophobicContact CD1-CG2 4.49Å; L223-I275 HydrophobicContact CD2-CG2 4.17Å; L223-L276 HydrophobicContact CD2-CD1 4.09Å; L223-L276 HydrophobicContact CD2-CD2 3.79Å; L223-L276 HydrophobicContact CD2-CG 3.93Å
224Q96.1Very high93.7Very high117 Ų11759.2 Ų59.255%0.54728%0.28SS..Hα-helixtrans-64.3-41.7172.4-179.3175.5-2300111.7R220 L221 L222 Q227 T228R220-Q224 WeakPolarHBondContact O-CB 3.46Å; R220-Q224 PolarHBondContact O-N 3.02Å; L221-Q224 WeakPolarHBondContact O-CB 3.48Å; L221-Q224 PolarHBondContact O-N 3.2Å; L222-Q224 VanDerWaalsContact C-N 3.31Å; L222-Q224 PolarHBondContact O-N 3.31Å; Q224-Q227 WeakPolarHBondContact O-CB 3.47Å; Q224-Q227 PolarHBondContact O-N 3.31Å; Q224-T228 PolarHBondContact O-N 2.91Å; Q224-T228 VanDerWaalsContact O-N 3.12Å; Q224-T228 PolarHBondContact O-OG1 3.47Å
225R96.8Very high94.6Very high44 Ų4454.1 Ų54.117%0.16626%0.263CS..Hα-helixtrans-65.8-38176.6-179.355-178.794.2-3.2112.8V181 E182 F185 L221 L222 T228 E229V181-R225 HydrophobicContact CG1-CB 4.07Å; E182-R225 IonicContact OE1-CZ 2.79Å; E182-R225 VanDerWaalsContact OE1-CZ 3.25Å; E182-R225 IonicContact OE1-NE 2.73Å; E182-R225 PolarHBondContact OE1-NE 3.36Å; E182-R225 IonicContact OE1-NH2 2.73Å; E182-R225 PolarHBondContact OE1-NH2 2.97Å; E182-R225 WeakPolarHBondContact OE2-CD 3.46Å; E182-R225 IonicContact OE2-CZ 2.79Å; E182-R225 IonicContact OE2-NE 2.68Å; E182-R225 PolarHBondContact OE2-NE 3.46Å; F185-R225 HydrophobicContact CB-CG 4.18Å; F185-R225 HydrophobicContact CD1-CG 3.96Å; F185-R225 HydrophobicContact CD2-CG 4.06Å; F185-R225 HydrophobicContact CE1-CG 4.41Å; F185-R225 VanDerWaalsContact CE1-NH1 3.28Å; F185-R225 HydrophobicContact CE2-CG 4.49Å; F185-R225 HydrophobicContact CG-CG 3.79Å; L221-R225 PolarHBondContact O-N 3.48Å; L222-R225 PolarHBondContact O-N 2.79Å; R225-T228 PolarHBondContact O-N 3.12Å; R225-E229 IonicContact CZ-OE2 3.65Å; R225-E229 IonicContact NH1-OE2 3.25Å; R225-E229 PolarHBondContact NH1-OE2 3.05Å; R225-E229 IonicContact NH2-OE2 2.89Å; R225-E229 PolarHBondContact NH2-OE2 3.45Å; R225-E229 PolarHBondContact O-N 2.9Å
226C97.8Very high95.6Very high4 Ų453 Ų533%0.02726%0.256CS..Hα-helixtrans-64.2-39.1172.6-64.10000112L222 L223 E229 Y230 F250 L254L222-C226 PolarHBondContact O-N 2.93Å; L222-C226 PolarHBondContact O-SG 3.31Å; L223-C226 PolarHBondContact O-N 3.49Å; C226-E229 PolarHBondContact O-N 2.89Å; C226-Y230 WeakPolarHBondContact O-CB 3.48Å; C226-Y230 PolarHBondContact O-N 3.09Å; C226-F250 HydrophobicContact CB-CE2 4.36Å; C226-F250 WeakPolarHBondContact O-CZ 3.48Å; C226-L254 HydrophobicContact CB-CD1 3.75Å
227Q97.5Very high96.2Very high61 Ų6153 Ų5329%0.28526%0.255SS..Hα-helixtrans-61-44.9176.2177.563.827.400111.5L223 Q224 E229 Y230 E231L223-Q227 WeakPolarHBondContact O-CB 3.28Å; L223-Q227 PolarHBondContact O-N 2.91Å; Q224-Q227 WeakPolarHBondContact O-CB 3.47Å; Q224-Q227 PolarHBondContact O-N 3.31Å; Q227-E229 VanDerWaalsContact C-N 3.31Å; Q227-E229 PolarHBondContact O-N 3.31Å; Q227-Y230 PolarHBondContact O-N 3.47Å; Q227-E231 PolarHBondContact NE2-OE1 3.43Å; Q227-E231 WeakPolarHBondContact O-CG 3.47Å; Q227-E231 PolarHBondContact O-N 3.45Å
228T97Very high96.2Very high69 Ų6959 Ų5942%0.42327%0.274SS..Hα-helixtrans-59.5-38177.4-56.80000112.7Q224 R225Q224-T228 PolarHBondContact O-N 2.91Å; Q224-T228 VanDerWaalsContact O-N 3.12Å; Q224-T228 PolarHBondContact O-OG1 3.47Å; R225-T228 PolarHBondContact O-N 3.12Å
229E97.3Very high96.1Very high53 Ų5360.5 Ų60.525%0.24829%0.29CS..Hα-helixtrans-73.9-41.9175.8-157.470.2-139.500111.9F185 R225 C226 Q227 E231 Q232 F250F185-E229 HydrophobicContact CE1-CG 4.42Å; F185-E229 HydrophobicContact CZ-CB 3.9Å; F185-E229 HydrophobicContact CZ-CG 4.01Å; R225-E229 IonicContact CZ-OE2 3.65Å; R225-E229 IonicContact NH1-OE2 3.25Å; R225-E229 PolarHBondContact NH1-OE2 3.05Å; R225-E229 IonicContact NH2-OE2 2.89Å; R225-E229 PolarHBondContact NH2-OE2 3.45Å; R225-E229 PolarHBondContact O-N 2.9Å; C226-E229 PolarHBondContact O-N 2.89Å; Q227-E229 VanDerWaalsContact C-N 3.31Å; Q227-E229 PolarHBondContact O-N 3.31Å; E229-E231 VanDerWaalsContact C-N 3.25Å; E229-E231 PolarHBondContact O-N 3.49Å; E229-Q232 WeakPolarHBondContact O-CB 3.43Å; E229-Q232 PolarHBondContact O-N 2.83Å; E229-F250 HydrophobicContact CB-CD1 4.38Å; E229-F250 HydrophobicContact CB-CD2 3.99Å; E229-F250 HydrophobicContact CB-CE1 4.17Å; E229-F250 HydrophobicContact CB-CE2 3.76Å; E229-F250 HydrophobicContact CB-CG 4.29Å; E229-F250 HydrophobicContact CB-CZ 3.86Å; E229-F250 HydrophobicContact CG-CB 4.26Å; E229-F250 HydrophobicContact CG-CD1 3.92Å; E229-F250 HydrophobicContact CG-CD2 3.78Å; E229-F250 HydrophobicContact CG-CE1 4.21Å; E229-F250 HydrophobicContact CG-CE2 4.08Å; E229-F250 HydrophobicContact CG-CG 3.69Å; E229-F250 HydrophobicContact CG-CZ 4.28Å
230Y98Very high96.2Very high29 Ų2960.8 Ų60.811%0.11430%0.299CS..Hα-helixtrans-59.5-32.5176.8159.3-88.4000112.9C226 Q227 Q232 R233 A279 D282 L283C226-Y230 WeakPolarHBondContact O-CB 3.48Å; C226-Y230 PolarHBondContact O-N 3.09Å; Q227-Y230 PolarHBondContact O-N 3.47Å; Y230-Q232 VanDerWaalsContact C-N 3.28Å; Y230-Q232 PolarHBondContact O-N 3.26Å; Y230-R233 WeakPolarHBondContact O-CB 3.09Å; Y230-R233 WeakPolarHBondContact O-CD 3.42Å; Y230-R233 WeakPolarHBondContact O-CG 2.91Å; Y230-R233 PolarHBondContact O-N 2.91Å; Y230-R233 PolarHBondContact O-NH1 3.41Å; Y230-R233 PolarHBondContact OH-NH2 2.96Å; Y230-A279 HydrophobicContact CD2-CB 3.9Å; Y230-A279 HydrophobicContact CE2-CB 3.99Å; Y230-D282 HydrophobicContact CE2-CB 3.99Å; Y230-D282 PolarHBondContact OH-OD2 3.44Å; Y230-L283 HydrophobicContact CD2-CD1 4.34Å; Y230-L283 HydrophobicContact CD2-CD2 4.17Å; Y230-L283 HydrophobicContact CD2-CG 4.08Å; Y230-L283 HydrophobicContact CE2-CG 4.47Å
231E97.8Very high96.2Very high107 Ų10758.1 Ų58.150%0.530%0.301SS..Hα-helixtrans-64.6-31.4174.6-76.4169.4-171.400112.4Q227 E229 R233Q227-E231 PolarHBondContact NE2-OE1 3.43Å; Q227-E231 WeakPolarHBondContact O-CG 3.47Å; Q227-E231 PolarHBondContact O-N 3.45Å; E229-E231 VanDerWaalsContact C-N 3.25Å; E229-E231 PolarHBondContact O-N 3.49Å; E231-R233 VanDerWaalsContact C-N 3.29Å; E231-R233 PolarHBondContact O-N 2.84Å
232Q96.1Very high96.1Very high93 Ų9363.1 Ų63.144%0.43532%0.324SS..THydrogen-bonded Turntrans-77.9-7.1178.5-55.7-53.6-35.300114.2E229 Y230 N234 V235 A236E229-Q232 WeakPolarHBondContact O-CB 3.43Å; E229-Q232 PolarHBondContact O-N 2.83Å; Y230-Q232 VanDerWaalsContact C-N 3.28Å; Y230-Q232 PolarHBondContact O-N 3.26Å; Q232-N234 PolarHBondContact O-N 2.99Å; Q232-V235 WeakPolarHBondContact O-CA 3.4Å; Q232-V235 WeakPolarHBondContact O-CB 3.18Å; Q232-V235 PolarHBondContact O-N 3.31Å; Q232-A236 PolarHBondContact O-N 3.47Å
233R96.9Very high96Very high39 Ų3964.6 Ų64.615%0.14734%0.336CS..Hα-helixtrans-49.5-39.5-173.172.2-172.7179-81.510114.6Y230 E231 V235 A236 I237 F247 L283 T286Y230-R233 WeakPolarHBondContact O-CB 3.09Å; Y230-R233 WeakPolarHBondContact O-CD 3.42Å; Y230-R233 WeakPolarHBondContact O-CG 2.91Å; Y230-R233 PolarHBondContact O-N 2.91Å; Y230-R233 PolarHBondContact O-NH1 3.41Å; Y230-R233 PolarHBondContact OH-NH2 2.96Å; E231-R233 VanDerWaalsContact C-N 3.29Å; E231-R233 PolarHBondContact O-N 2.84Å; R233-V235 VanDerWaalsContact C-N 3.31Å; R233-V235 PolarHBondContact O-N 3.29Å; R233-A236 PolarHBondContact O-N 2.83Å; R233-I237 VanDerWaalsContact O-CB 3.26Å; R233-I237 WeakPolarHBondContact O-CB 3.5Å; R233-I237 WeakPolarHBondContact O-CG2 3.22Å; R233-I237 PolarHBondContact O-N 3.29Å; R233-F247 HydrophobicContact CB-CD2 4.29Å; R233-F247 HydrophobicContact CB-CE2 3.4Å; R233-F247 VanDerWaalsContact CB-CE2 3.4Å; R233-F247 HydrophobicContact CB-CZ 3.88Å; R233-L283 HydrophobicContact CB-CD2 4Å; R233-T286 HydrophobicContact CB-CG2 4.4Å; R233-T286 HydrophobicContact CG-CG2 4.27Å
234N95.9Very high96Very high84 Ų8465.1 Ų65.145%0.44934%0.338SS..Hα-helixtrans-72.8-23.4-178.1-71.5-53.6000113.4Q232Q232-N234 PolarHBondContact O-N 2.99Å
235V96.1Very high96Very high98 Ų9866.6 Ų66.659%0.59434%0.342SS*.Hα-helixtrans-84-50.4171.7-176.50000109Q232 R233 I237 R238 G239Q232-V235 WeakPolarHBondContact O-CA 3.4Å; Q232-V235 WeakPolarHBondContact O-CB 3.18Å; Q232-V235 PolarHBondContact O-N 3.31Å; R233-V235 VanDerWaalsContact C-N 3.31Å; R233-V235 PolarHBondContact O-N 3.29Å; V235-I237 PolarHBondContact O-N 3.07Å; V235-R238 CarbonylContact O-C 3.6Å; V235-R238 WeakPolarHBondContact O-CA 3.24Å; V235-R238 PolarHBondContact O-N 3.02Å; V235-G239 PolarHBondContact O-N 3.15Å
236A95.8Very high95.9Very high16 Ų1671.8 Ų71.813%0.13237%0.366CS..Hα-helixtrans-64.8-37.4-17400000113.5Q232 R233 R238 G239 Q244 F247Q232-A236 PolarHBondContact O-N 3.47Å; R233-A236 PolarHBondContact O-N 2.83Å; A236-R238 PolarHBondContact O-N 3.29Å; A236-R238 VanDerWaalsContact O-N 3.12Å; A236-G239 PolarHBondContact O-N 2.93Å; A236-Q244 WeakPolarHBondContact O-CG 3.14Å; A236-F247 HydrophobicContact CB-CB 3.83Å; A236-F247 HydrophobicContact CB-CD2 4.16Å; A236-F247 HydrophobicContact CB-CG 4.1Å
237I95.1Very high95.9Very high3 Ų371.8 Ų71.82%0.01537%0.366CS..THydrogen-bonded Turntrans-60.7-20.9174.2-162.374.2000112.9R233 V235 Q244 F247 T286 L287 H290 N295R233-I237 VanDerWaalsContact O-CB 3.26Å; R233-I237 WeakPolarHBondContact O-CB 3.5Å; R233-I237 WeakPolarHBondContact O-CG2 3.22Å; R233-I237 PolarHBondContact O-N 3.29Å; V235-I237 PolarHBondContact O-N 3.07Å; I237-Q244 PolarHBondContact O-NE2 2.92Å; I237-F247 HydrophobicContact CD1-CD1 4.06Å; I237-F247 HydrophobicContact CD1-CE1 3.67Å; I237-T286 HydrophobicContact CB-CG2 4.14Å; I237-T286 HydrophobicContact CD1-CG2 4.43Å; I237-T286 HydrophobicContact CG1-CG2 4.14Å; I237-T286 HydrophobicContact CG2-CG2 4.1Å; I237-L287 HydrophobicContact CD1-CD2 3.8Å; I237-H290 HydrophobicContact CG1-CB 3.93Å; I237-N295 HydrophobicContact CD1-CB 4.5Å; I237-N295 VanDerWaalsContact CD1-ND2 3.34Å; I237-N295 WeakPolarHBondContact CD1-ND2 3.23Å; I237-N295 WeakPolarHBondContact CD1-OD1 3.22Å
238R92.2Very high95.9Very high178 Ų17870.2 Ų70.267%0.67236%0.358SS*.THydrogen-bonded Turntrans-112.88.4178.2-56.4-177.7180169.50.3113.2V235 A236 H290V235-R238 CarbonylContact O-C 3.6Å; V235-R238 WeakPolarHBondContact O-CA 3.24Å; V235-R238 PolarHBondContact O-N 3.02Å; A236-R238 PolarHBondContact O-N 3.29Å; A236-R238 VanDerWaalsContact O-N 3.12Å; R238-H290 PolarHBondContact NE-NE2 3.31Å; R238-H290 PolarHBondContact NH2-NE2 3.04Å
239G93.9Very high96Very high34 Ų3468.5 Ų68.535%0.35135%0.35SS..SBendtrans-78.6-166.3-179.300000113.1V235 A236V235-G239 PolarHBondContact O-N 3.15Å; A236-G239 PolarHBondContact O-N 2.93Å
240S96.1Very high96Very high57 Ų5766.1 Ų66.140%0.39934%0.338SS..  trans-66.9166.2170.976.90000111.6E242 A243 Q244S240-E242 WeakPolarHBondContact CB-OE2 3.5Å; S240-E242 PolarHBondContact O-N 3.09Å; S240-E242 VanDerWaalsContact O-N 3.15Å; S240-E242 PolarHBondContact OG-OE2 2.8Å; S240-A243 WeakPolarHBondContact O-CB 3.19Å; S240-A243 PolarHBondContact O-N 3.13Å; S240-A243 PolarHBondContact OG-N 3.27Å; S240-Q244 PolarHBondContact O-N 2.68Å
241P94.6Very high96Very high90 Ų9064.7 Ų64.758%0.58433%0.333SS*.Hα-helixtrans-55.4-31.5176.5-26.136.3000113.5K245P241-K245 VanDerWaalsContact O-CB 3.31Å; P241-K245 WeakPolarHBondContact O-CB 3.45Å; P241-K245 PolarHBondContact O-N 2.73Å
242E94.3Very high96Very high119 Ų11961.5 Ų61.556%0.55632%0.319SS*.Hα-helixtrans-72.4-39.7177.3-52.668.7-142.600111.4S240 K245 K246S240-E242 WeakPolarHBondContact CB-OE2 3.5Å; S240-E242 PolarHBondContact O-N 3.09Å; S240-E242 VanDerWaalsContact O-N 3.15Å; S240-E242 PolarHBondContact OG-OE2 2.8Å; E242-K245 PolarHBondContact O-N 2.65Å; E242-K246 WeakPolarHBondContact O-CG 3.49Å; E242-K246 PolarHBondContact O-N 3.45Å
243A95Very high96.1Very high32 Ų3257 Ų5726%0.26430%0.298SS..Hα-helixtrans-67.6-41.2174.100000111.5S240 K246 F247S240-A243 WeakPolarHBondContact O-CB 3.19Å; S240-A243 PolarHBondContact O-N 3.13Å; S240-A243 PolarHBondContact OG-N 3.27Å; A243-K246 PolarHBondContact O-N 2.79Å; A243-F247 WeakPolarHBondContact O-CB 3.41Å; A243-F247 PolarHBondContact O-N 2.79Å
244Q96.1Very high96.2Very high41 Ų4155.2 Ų55.219%0.19229%0.291CS..Hα-helixtrans-61.9-43.9172-72.7-177.4-21.700111.4A236 I237 S240 F247 H248A236-Q244 WeakPolarHBondContact O-CG 3.14Å; I237-Q244 PolarHBondContact O-NE2 2.92Å; S240-Q244 PolarHBondContact O-N 2.68Å; Q244-F247 WeakPolarHBondContact O-CB 3.3Å; Q244-F247 PolarHBondContact O-N 3.23Å; Q244-H248 PolarHBondContact O-CD2 3.27Å; Q244-H248 PolarHBondContact O-N 3.25Å; Q244-H248 PolarHBondContact O-ND1 3.47Å
245K95.4Very high96.3Very high147 Ų14751.2 Ų51.264%0.63927%0.27SS*.Hα-helixtrans-60.1-46.7175.8-176.7-176.1175.1-1720111.9P241 E242 F247 H248 S249P241-K245 VanDerWaalsContact O-CB 3.31Å; P241-K245 WeakPolarHBondContact O-CB 3.45Å; P241-K245 PolarHBondContact O-N 2.73Å; E242-K245 PolarHBondContact O-N 2.65Å; K245-F247 VanDerWaalsContact C-N 3.32Å; K245-F247 PolarHBondContact O-N 3.06Å; K245-H248 PolarHBondContact O-N 2.84Å; K245-S249 PolarHBondContact O-N 3.13Å; K245-S249 PolarHBondContact O-OG 2.85Å
246K95.9Very high96.4Very high154 Ų15448.1 Ų48.167%0.6725%0.249SC*.Hα-helixtrans-59-44174.8-76.8-172.1174.5-1660111.6E242 A243 H248 S249 F250E242-K246 WeakPolarHBondContact O-CG 3.49Å; E242-K246 PolarHBondContact O-N 3.45Å; A243-K246 PolarHBondContact O-N 2.79Å; K246-H248 PolarHBondContact O-N 3.08Å; K246-S249 PolarHBondContact O-N 3.12Å; K246-F250 PolarHBondContact O-N 2.85Å
247F97.4Very high96.5Very high3 Ų347.3 Ų47.31%0.01324%0.242CC..Hα-helixtrans-61.6-41.6175.8176.2-107.2000112.8R233 A236 I237 A243 Q244 K245 F250 V251 L283 T286 L287R233-F247 HydrophobicContact CB-CD2 4.29Å; R233-F247 HydrophobicContact CB-CE2 3.4Å; R233-F247 VanDerWaalsContact CB-CE2 3.4Å; R233-F247 HydrophobicContact CB-CZ 3.88Å; A236-F247 HydrophobicContact CB-CB 3.83Å; A236-F247 HydrophobicContact CB-CD2 4.16Å; A236-F247 HydrophobicContact CB-CG 4.1Å; I237-F247 HydrophobicContact CD1-CD1 4.06Å; I237-F247 HydrophobicContact CD1-CE1 3.67Å; A243-F247 WeakPolarHBondContact O-CB 3.41Å; A243-F247 PolarHBondContact O-N 2.79Å; Q244-F247 WeakPolarHBondContact O-CB 3.3Å; Q244-F247 PolarHBondContact O-N 3.23Å; K245-F247 VanDerWaalsContact C-N 3.32Å; K245-F247 PolarHBondContact O-N 3.06Å; F247-F250 HydrophobicContact CD2-CD1 4.37Å; F247-F250 HydrophobicContact CE2-CD1 4.48Å; F247-F250 PolarHBondContact O-N 3.37Å; F247-V251 HydrophobicContact CD1-CG2 4.21Å; F247-V251 HydrophobicContact CD2-CG2 4.2Å; F247-V251 HydrophobicContact CE1-CG2 3.76Å; F247-V251 HydrophobicContact CE2-CG2 3.75Å; F247-V251 HydrophobicContact CG-CG2 4.41Å; F247-V251 HydrophobicContact CZ-CG2 3.51Å; F247-V251 WeakPolarHBondContact O-CG2 3.31Å; F247-V251 PolarHBondContact O-N 2.66Å; F247-L283 HydrophobicContact CE2-CD2 3.53Å; F247-L283 HydrophobicContact CZ-CD2 3.57Å; F247-T286 HydrophobicContact CZ-CG2 4.46Å; F247-L287 HydrophobicContact CE1-CD2 3.88Å; F247-L287 HydrophobicContact CE1-CG 4.27Å
248H97.6Very high96.6Very high28 Ų2847.6 Ų47.613%0.1324%0.243CC..Hα-helixtrans-64-41.7175.1-61.1159.1000112.1Q244 K245 K246 V251 L252 N295 C298Q244-H248 PolarHBondContact O-CD2 3.27Å; Q244-H248 PolarHBondContact O-N 3.25Å; Q244-H248 PolarHBondContact O-ND1 3.47Å; K245-H248 PolarHBondContact O-N 2.84Å; K246-H248 PolarHBondContact O-N 3.08Å; H248-V251 PolarHBondContact O-N 2.73Å; H248-L252 WeakPolarHBondContact O-CG 3.42Å; H248-L252 PolarHBondContact O-N 3.02Å; H248-N295 PolarHBondContact CE1-OD1 3.39Å; H248-N295 PolarHBondContact NE2-OD1 2.97Å; H248-C298 HydrophobicContact CB-CB 4.21Å
249S97.4Very high96.8Very high34 Ų3440.9 Ų40.924%0.23822%0.22CC..Hα-helixtrans-61.4-44.8173.4-62.50000112T189 K245 K246 V251 L252 F253T189-S249 WeakPolarHBondContact O-CB 3.38Å; T189-S249 PolarHBondContact O-OG 3.24Å; K245-S249 PolarHBondContact O-N 3.13Å; K245-S249 PolarHBondContact O-OG 2.85Å; K246-S249 PolarHBondContact O-N 3.12Å; S249-V251 PolarHBondContact O-N 2.88Å; S249-L252 PolarHBondContact O-N 2.78Å; S249-F253 WeakPolarHBondContact O-CB 3.45Å; S249-F253 PolarHBondContact O-N 2.95Å
250F98Very high96.9Very high2 Ų241 Ų411%0.00921%0.213CC..Hα-helixtrans-59.4-45.1174.7166.4-110.6000112.3F185 T189 C226 E229 K246 F247 L252 F253 L254 L283F185-F250 AromaticContact CE2-CD2 3.92Å; F185-F250 HydrophobicContact CE2-CD2 3.92Å; F185-F250 AromaticContact CE2-CE2 3.97Å; F185-F250 HydrophobicContact CE2-CE2 3.97Å; F185-F250 AromaticContact CZ-CD2 3.63Å; F185-F250 HydrophobicContact CZ-CD2 3.63Å; F185-F250 AromaticContact CZ-CE2 3.92Å; F185-F250 HydrophobicContact CZ-CE2 3.92Å; T189-F250 HydrophobicContact CG2-CB 4.33Å; C226-F250 HydrophobicContact CB-CE2 4.36Å; C226-F250 WeakPolarHBondContact O-CZ 3.48Å; E229-F250 HydrophobicContact CB-CD1 4.38Å; E229-F250 HydrophobicContact CB-CD2 3.99Å; E229-F250 HydrophobicContact CB-CE1 4.17Å; E229-F250 HydrophobicContact CB-CE2 3.76Å; E229-F250 HydrophobicContact CB-CG 4.29Å; E229-F250 HydrophobicContact CB-CZ 3.86Å; E229-F250 HydrophobicContact CG-CB 4.26Å; E229-F250 HydrophobicContact CG-CD1 3.92Å; E229-F250 HydrophobicContact CG-CD2 3.78Å; E229-F250 HydrophobicContact CG-CE1 4.21Å; E229-F250 HydrophobicContact CG-CE2 4.08Å; E229-F250 HydrophobicContact CG-CG 3.69Å; E229-F250 HydrophobicContact CG-CZ 4.28Å; K246-F250 PolarHBondContact O-N 2.85Å; F247-F250 HydrophobicContact CD2-CD1 4.37Å; F247-F250 HydrophobicContact CE2-CD1 4.48Å; F247-F250 PolarHBondContact O-N 3.37Å; F250-L252 VanDerWaalsContact C-N 3.33Å; F250-L252 PolarHBondContact O-N 3.32Å; F250-F253 PolarHBondContact O-N 2.84Å; F250-L254 HydrophobicContact CE2-CD1 3.95Å; F250-L254 HydrophobicContact CZ-CD1 4.13Å; F250-L254 HydrophobicContact CZ-CD2 4.03Å; F250-L254 WeakPolarHBondContact O-CB 3.49Å; F250-L254 PolarHBondContact O-N 2.99Å; F250-L283 HydrophobicContact CE1-CD1 4.28Å; F250-L283 HydrophobicContact CE1-CD2 4.45Å
251V98.3Very high96.8Very high0 Ų038.3 Ų38.30%019%0.194CC..Hα-helixtrans-60.8-41.9178.7171.80000111.6F247 H248 S249 L254 G255 L283 L287 L302F247-V251 HydrophobicContact CD1-CG2 4.21Å; F247-V251 HydrophobicContact CD2-CG2 4.2Å; F247-V251 HydrophobicContact CE1-CG2 3.76Å; F247-V251 HydrophobicContact CE2-CG2 3.75Å; F247-V251 HydrophobicContact CG-CG2 4.41Å; F247-V251 HydrophobicContact CZ-CG2 3.51Å; F247-V251 WeakPolarHBondContact O-CG2 3.31Å; F247-V251 PolarHBondContact O-N 2.66Å; H248-V251 PolarHBondContact O-N 2.73Å; S249-V251 PolarHBondContact O-N 2.88Å; V251-L254 PolarHBondContact O-N 2.91Å; V251-G255 PolarHBondContact O-N 3.05Å; V251-G255 VanDerWaalsContact O-N 3.14Å; V251-L283 HydrophobicContact CG2-CB 4.42Å; V251-L283 HydrophobicContact CG2-CD1 4.31Å; V251-L283 HydrophobicContact CG2-CD2 4.05Å; V251-L283 HydrophobicContact CG2-CG 4.5Å; V251-L287 HydrophobicContact CG1-CD1 4.08Å; V251-L302 HydrophobicContact CG1-CB 4.47Å; V251-L302 HydrophobicContact CG1-CD2 3.58Å
252L98.2Very high96.7Very high39 Ų3937.1 Ų37.120%0.20418%0.181CC..Hα-helixtrans-71-42.7178-65.5174.8000111.7H248 S249 F250 L254 G255 E256 K301 L302H248-L252 WeakPolarHBondContact O-CG 3.42Å; H248-L252 PolarHBondContact O-N 3.02Å; S249-L252 PolarHBondContact O-N 2.78Å; F250-L252 VanDerWaalsContact C-N 3.33Å; F250-L252 PolarHBondContact O-N 3.32Å; L252-L254 VanDerWaalsContact C-N 3.31Å; L252-L254 PolarHBondContact O-N 3.38Å; L252-G255 WeakPolarHBondContact O-CA 3.19Å; L252-G255 PolarHBondContact O-N 3.04Å; L252-G255 VanDerWaalsContact O-N 3.07Å; L252-E256 PolarHBondContact O-N 2.75Å; L252-K301 HydrophobicContact CD1-CB 4.47Å; L252-K301 HydrophobicContact CD1-CD 4.06Å; L252-K301 HydrophobicContact CD2-CB 3.69Å; L252-L302 HydrophobicContact CD2-CB 4.18Å
253F98.4Very high96.3Very high0 Ų033.7 Ų33.70%017%0.166CC..Hα-helixtrans-58.9-39.6172.2172.4-109.3000112.6F185 S188 T189 A199 S249 F250 G255 E256 L257F185-F253 HydrophobicContact CD2-CD1 4.36Å; F185-F253 AromaticContact CD2-CE1 3.76Å; F185-F253 HydrophobicContact CD2-CE1 3.76Å; F185-F253 HydrophobicContact CE2-CD1 4.19Å; F185-F253 AromaticContact CE2-CE1 3.97Å; F185-F253 HydrophobicContact CE2-CE1 3.97Å; S188-F253 VanDerWaalsContact CB-CE2 3.41Å; T189-F253 HydrophobicContact CG2-CB 3.89Å; T189-F253 HydrophobicContact CG2-CD1 3.83Å; T189-F253 HydrophobicContact CG2-CG 3.99Å; A199-F253 HydrophobicContact CB-CE2 4.39Å; S249-F253 WeakPolarHBondContact O-CB 3.45Å; S249-F253 PolarHBondContact O-N 2.95Å; F250-F253 PolarHBondContact O-N 2.84Å; F253-G255 VanDerWaalsContact C-N 3.27Å; F253-G255 PolarHBondContact O-N 3.05Å; F253-E256 PolarHBondContact O-N 2.94Å; F253-L257 HydrophobicContact CE1-CD2 4.32Å; F253-L257 HydrophobicContact CZ-CD1 4.45Å; F253-L257 HydrophobicContact CZ-CD2 4.4Å; F253-L257 VanDerWaalsContact O-CB 3.28Å; F253-L257 WeakPolarHBondContact O-CB 3.31Å; F253-L257 PolarHBondContact O-N 3.26Å
254L98.2Very high95.7Very high1 Ų137.2 Ų37.21%0.00518%0.175CC..Hα-helixtrans-67.6-29.7176.1-15374.4000112.2C226 F250 V251 L252 L257 Y258 L276 A279 L280 L283C226-L254 HydrophobicContact CB-CD1 3.75Å; F250-L254 HydrophobicContact CE2-CD1 3.95Å; F250-L254 HydrophobicContact CZ-CD1 4.13Å; F250-L254 HydrophobicContact CZ-CD2 4.03Å; F250-L254 WeakPolarHBondContact O-CB 3.49Å; F250-L254 PolarHBondContact O-N 2.99Å; V251-L254 PolarHBondContact O-N 2.91Å; L252-L254 VanDerWaalsContact C-N 3.31Å; L252-L254 PolarHBondContact O-N 3.38Å; L254-L257 HydrophobicContact CD1-CD2 4.47Å; L254-Y258 WeakPolarHBondContact O-CB 3.48Å; L254-Y258 PolarHBondContact O-N 3.32Å; L254-L276 HydrophobicContact CD1-CD2 3.7Å; L254-L276 HydrophobicContact CD2-CD2 4.37Å; L254-L276 HydrophobicContact CG-CD2 4.04Å; L254-A279 HydrophobicContact CD2-CB 3.84Å; L254-L280 HydrophobicContact CB-CD2 4.16Å; L254-L280 HydrophobicContact CD2-CD2 4.27Å; L254-L280 HydrophobicContact CG-CD2 4.37Å; L254-L283 HydrophobicContact CD2-CD1 3.54Å
255G98.2Very high94.3Very high0 Ų038.8 Ų38.80%019%0.19CC..Hα-helixtrans-65.3-51.1170.600000112.1V251 L252 F253 L257 Y258 L259V251-G255 PolarHBondContact O-N 3.05Å; V251-G255 VanDerWaalsContact O-N 3.14Å; L252-G255 WeakPolarHBondContact O-CA 3.19Å; L252-G255 PolarHBondContact O-N 3.04Å; L252-G255 VanDerWaalsContact O-N 3.07Å; F253-G255 VanDerWaalsContact C-N 3.27Å; F253-G255 PolarHBondContact O-N 3.05Å; G255-L257 VanDerWaalsContact C-N 3.32Å; G255-L257 PolarHBondContact O-N 2.81Å; G255-Y258 PolarHBondContact O-N 3.01Å; G255-L259 PolarHBondContact O-N 3.38Å; G255-L259 VanDerWaalsContact O-N 3.14Å
256E97.9Very high93.2Very high32 Ų3235.8 Ų35.815%0.1520%0.201CC..Hα-helixtrans-59-43.3174.5-65.4-66.517800111.5A199 L252 F253 Y258 L259 N260 L305A199-E256 HydrophobicContact CB-CB 3.64Å; L252-E256 PolarHBondContact O-N 2.75Å; F253-E256 PolarHBondContact O-N 2.94Å; E256-Y258 PolarHBondContact O-N 2.86Å; E256-L259 PolarHBondContact O-N 3.03Å; E256-N260 WeakPolarHBondContact O-CB 3.44Å; E256-N260 PolarHBondContact O-N 2.91Å; E256-N260 PolarHBondContact O-ND2 2.89Å; E256-L305 HydrophobicContact CG-CD2 3.89Å; E256-L305 WeakPolarHBondContact OE1-CD1 3.42Å; E256-L305 WeakPolarHBondContact OE1-CD2 3.48Å
257L97.9Very high91.8Very high0 Ų038.9 Ų38.90%022%0.215CC..Hα-helixtrans-64.4-38.6178.3-168.668.5000111.7C202 L222 F253 L254 G255 L259 L261 L276C202-L257 HydrophobicContact CB-CD1 3.68Å; L222-L257 HydrophobicContact CD2-CD1 3.91Å; L222-L257 HydrophobicContact CD2-CD2 4.09Å; L222-L257 HydrophobicContact CG-CD2 4.32Å; F253-L257 HydrophobicContact CE1-CD2 4.32Å; F253-L257 HydrophobicContact CZ-CD1 4.45Å; F253-L257 HydrophobicContact CZ-CD2 4.4Å; F253-L257 VanDerWaalsContact O-CB 3.28Å; F253-L257 WeakPolarHBondContact O-CB 3.31Å; F253-L257 PolarHBondContact O-N 3.26Å; L254-L257 HydrophobicContact CD1-CD2 4.47Å; G255-L257 VanDerWaalsContact C-N 3.32Å; G255-L257 PolarHBondContact O-N 2.81Å; L257-L259 VanDerWaalsContact C-N 3.33Å; L257-L259 PolarHBondContact O-N 3.47Å; L257-L261 HydrophobicContact CD1-CB 3.97Å; L257-L261 HydrophobicContact CD1-CD1 4.47Å; L257-L261 HydrophobicContact CD1-CD2 4.13Å; L257-L261 HydrophobicContact CD1-CG 4.42Å; L257-L261 HydrophobicContact CD2-CD2 4.41Å; L257-L261 HydrophobicContact CG-CB 4.14Å; L257-L261 HydrophobicContact CG-CD2 4.09Å; L257-L261 WeakPolarHBondContact O-CB 3.37Å; L257-L261 PolarHBondContact O-N 3.37Å; L257-L276 HydrophobicContact CB-CD1 4.39Å; L257-L276 HydrophobicContact CD2-CD1 4.1Å; L257-L276 HydrophobicContact CG-CD1 4.04Å
258Y97.5Very high90.6Very high9 Ų945.8 Ų45.84%0.03525%0.247CC..Hα-helixtrans-64.2-36.1173.6173.7-109.7000112.9L254 G255 E256 R272 L276 L277 L280 I309 L310L254-Y258 WeakPolarHBondContact O-CB 3.48Å; L254-Y258 PolarHBondContact O-N 3.32Å; G255-Y258 PolarHBondContact O-N 3.01Å; E256-Y258 PolarHBondContact O-N 2.86Å; Y258-R272 HydrophobicContact CD2-CB 4.12Å; Y258-R272 HydrophobicContact CE2-CB 3.6Å; Y258-R272 HydrophobicContact CE2-CG 4.31Å; Y258-R272 WeakPolarHBondContact O-CD 3.46Å; Y258-R272 PolarHBondContact O-NE 3.46Å; Y258-L276 HydrophobicContact CD2-CB 3.94Å; Y258-L276 HydrophobicContact CG-CB 4.45Å; Y258-L277 HydrophobicContact CE2-CB 3.89Å; Y258-L277 HydrophobicContact CE2-CD1 4.43Å; Y258-L280 HydrophobicContact CD1-CD1 3.76Å; Y258-L280 HydrophobicContact CG-CD1 3.72Å; Y258-I309 HydrophobicContact CE1-CG2 3.9Å; Y258-L310 HydrophobicContact CD1-CD2 4.2Å; Y258-L310 HydrophobicContact CE1-CD2 3.77Å
259L96.5Very high89.5Confident36 Ų3648.4 Ų48.419%0.18827%0.274CS..Hα-helixtrans-71.3-42.4178.4-67.7-180000112.7G255 E256 L257 R272 L305 T306 I309G255-L259 PolarHBondContact O-N 3.38Å; G255-L259 VanDerWaalsContact O-N 3.14Å; E256-L259 PolarHBondContact O-N 3.03Å; L257-L259 VanDerWaalsContact C-N 3.33Å; L257-L259 PolarHBondContact O-N 3.47Å; L259-R272 PolarHBondContact O-NE 2.91Å; L259-R272 PolarHBondContact O-NH2 3Å; L259-R272 VanDerWaalsContact O-NH2 3.16Å; L259-L305 HydrophobicContact CD1-CD1 3.68Å; L259-L305 HydrophobicContact CD1-CG 3.79Å; L259-T306 HydrophobicContact CD1-CG2 4.17Å; L259-T306 HydrophobicContact CD2-CG2 4.37Å; L259-T306 HydrophobicContact CG-CG2 4.09Å; L259-I309 HydrophobicContact CD2-CB 4.17Å; L259-I309 HydrophobicContact CD2-CG1 3.81Å; L259-I309 HydrophobicContact CD2-CG2 4.38Å
260N96Very high88.7Confident36 Ų3650 Ų5019%0.19328%0.283CS..Hα-helixtrans-96-26.1-169.6-68.7-85.7000114.9A199 N203 E256 E262A199-N260 HydrophobicContact CB-CB 4.21Å; N203-N260 VanDerWaalsContact CB-O 3.32Å; N203-N260 WeakPolarHBondContact CB-O 3.39Å; N203-N260 PolarHBondContact ND2-O 3.1Å; N203-N260 PolarHBondContact OD1-O 2.93Å; E256-N260 WeakPolarHBondContact O-CB 3.44Å; E256-N260 PolarHBondContact O-N 2.91Å; E256-N260 PolarHBondContact O-ND2 2.89Å; N260-E262 PolarHBondContact O-N 3.24Å
261L94.8Very high88Confident2 Ų254.1 Ų54.11%0.0131%0.305CS..  trans-81.5108.2-173.7-173.565.2000112.3N203 R219 L223 L257N203-L261 HydrophobicContact CB-CD1 4.38Å; R219-L261 HydrophobicContact CG-CD1 4.19Å; R219-L261 HydrophobicContact CG-CD2 4.15Å; R219-L261 HydrophobicContact CG-CG 4.48Å; L223-L261 HydrophobicContact CD2-CD2 4.19Å; L257-L261 HydrophobicContact CD1-CB 3.97Å; L257-L261 HydrophobicContact CD1-CD1 4.47Å; L257-L261 HydrophobicContact CD1-CD2 4.13Å; L257-L261 HydrophobicContact CD1-CG 4.42Å; L257-L261 HydrophobicContact CD2-CD2 4.41Å; L257-L261 HydrophobicContact CG-CB 4.14Å; L257-L261 HydrophobicContact CG-CD2 4.09Å; L257-L261 WeakPolarHBondContact O-CB 3.37Å; L257-L261 PolarHBondContact O-N 3.37Å
262E90.9Very high87.6Confident65 Ų6558.7 Ų58.730%0.30432%0.322SS..  trans-86.1137.9180-61.3-170.1141.500113.1N203 R219 N260 K264 P270N203-E262 PolarHBondContact OD1-N 3.02Å; R219-E262 PolarHBondContact NH1-O 3.23Å; R219-E262 VanDerWaalsContact NH1-O 3.16Å; N260-E262 PolarHBondContact O-N 3.24Å; E262-K264 WeakPolarHBondContact OE2-CE 3.32Å; E262-K264 IonicContact OE2-NZ 2.73Å; E262-K264 PolarHBondContact OE2-NZ 3.42Å; E262-P270 HydrophobicContact CB-CB 3.97Å; E262-P270 HydrophobicContact CG-CB 4.05Å
263I87.2Confident87.1Confident47 Ų4756.9 Ų56.924%0.24131%0.313CS..BIsolated β-bridgetrans-112.892.2167.2-55.5-169.9000108.5N271 A273I263-N271 WeakPolarHBondContact CA-O 3.38Å; I263-N271 WeakPolarHBondContact CB-O 3.4Å; I263-N271 PolarHBondContact N-O 3.43Å; I263-N271 PolarHBondContact O-N 2.96Å; I263-A273 HydrophobicContact CD1-CB 3.81Å
264K81.1Confident86.6Confident106 Ų10661.7 Ų61.746%0.46134%0.339SS..  trans-72.2122.2167.6-62.3-178.8177.882.50109.2H207 E262 P270H207-K264 PolarHBondContact CD2-NZ 2.88Å; H207-K264 PolarHBondContact CE1-NZ 3.4Å; H207-K264 PolarHBondContact NE2-NZ 3.35Å; E262-K264 WeakPolarHBondContact OE2-CE 3.32Å; E262-K264 IonicContact OE2-NZ 2.73Å; E262-K264 PolarHBondContact OE2-NZ 3.42Å; K264-P270 HydrophobicContact CG-CB 4.11Å
265S67.9Low86.4Confident73 Ų7365.7 Ų65.751%0.5136%0.36SS..  trans-121.989.4-179-1710000110.1K267 E268S265-K267 PolarHBondContact O-N 3.06Å; S265-K267 VanDerWaalsContact O-N 3.1Å; S265-E268 PolarHBondContact O-N 2.9Å
266G72Confident86.3Confident84 Ų8466 Ų6687%0.86636%0.361SS*.THydrogen-bonded Turntrans62.7-111.1-178.700000112.9
267K65.9Low86.2Confident219 Ų21965.3 Ų65.395%0.95236%0.358SS*.THydrogen-bonded Turntrans-1061.4-177.7-68.2-171175.5-173.40114.2S265S265-K267 PolarHBondContact O-N 3.06Å; S265-K267 VanDerWaalsContact O-N 3.1Å
268E72.6Confident86.1Confident149 Ų14968.3 Ų68.370%0.69638%0.379SS*.SBendtrans-77.7156.3176.8-62.6-175.9162.200110.7S265S265-E268 PolarHBondContact O-N 2.9Å
269A75.6Confident86.1Confident83 Ų8368.2 Ų68.269%0.68638%0.381SS*.PPolyproline II helixtrans-57.8147.9172.100000110.4N271A269-N271 PolarHBondContact O-N 3.5Å; A269-N271 VanDerWaalsContact O-N 3.11Å
270P79.1Confident86.2Confident66 Ų6666.5 Ų66.543%0.42937%0.372SS..PPolyproline II helixtrans-55.9120178.622-32.4000110.6E262 K264E262-P270 HydrophobicContact CB-CB 3.97Å; E262-P270 HydrophobicContact CG-CB 4.05Å; K264-P270 HydrophobicContact CG-CB 4.11Å
271N84.8Confident86.3Confident90 Ų9066.5 Ų66.548%0.48137%0.37SS..BIsolated β-bridgetrans-96.2161.5175.4-168.825.7000110.3I263 A269I263-N271 WeakPolarHBondContact CA-O 3.38Å; I263-N271 WeakPolarHBondContact CB-O 3.4Å; I263-N271 PolarHBondContact N-O 3.43Å; I263-N271 PolarHBondContact O-N 2.96Å; A269-N271 PolarHBondContact O-N 3.5Å; A269-N271 VanDerWaalsContact O-N 3.11Å
272R88.8Confident86.4Confident95 Ų9568.1 Ų68.136%0.35838%0.379SS..PPolyproline II helixtrans-84164.2173.1-69.8-178.31689111.9111.3Y258 L259 D274Y258-R272 HydrophobicContact CD2-CB 4.12Å; Y258-R272 HydrophobicContact CE2-CB 3.6Å; Y258-R272 HydrophobicContact CE2-CG 4.31Å; Y258-R272 WeakPolarHBondContact O-CD 3.46Å; Y258-R272 PolarHBondContact O-NE 3.46Å; L259-R272 PolarHBondContact O-NE 2.91Å; L259-R272 PolarHBondContact O-NH2 3Å; L259-R272 VanDerWaalsContact O-NH2 3.16Å; R272-D274 PolarHBondContact O-N 2.95Å; R272-D274 VanDerWaalsContact O-N 3.16Å
273A88Confident86.8Confident1 Ų165 Ų651%0.00836%0.364CS..  trans-73.9101.9176.500000111.6I263 I275 L276 L277I263-A273 HydrophobicContact CD1-CB 3.81Å; A273-I275 HydrophobicContact CB-CG2 4.29Å; A273-I275 PolarHBondContact O-N 2.72Å; A273-I275 VanDerWaalsContact O-N 3.13Å; A273-L276 HydrophobicContact CB-CB 4.27Å; A273-L276 HydrophobicContact CB-CD1 3.93Å; A273-L276 HydrophobicContact CB-CG 3.81Å; A273-L276 WeakPolarHBondContact O-CA 3.4Å; A273-L276 WeakPolarHBondContact O-CB 3.26Å; A273-L276 PolarHBondContact O-N 2.92Å; A273-L277 PolarHBondContact O-N 3.19Å
274D88.6Confident87.3Confident102 Ų10262.8 Ų62.855%0.54535%0.353SS..Hα-helixtrans-56.4-29.6179.5-70.3-43.3000113.6R272 L276 L277 S278R272-D274 PolarHBondContact O-N 2.95Å; R272-D274 VanDerWaalsContact O-N 3.16Å; D274-L276 VanDerWaalsContact C-N 3.29Å; D274-L276 PolarHBondContact O-N 2.88Å; D274-L277 WeakPolarHBondContact O-CB 3.48Å; D274-L277 PolarHBondContact O-N 3.12Å; D274-S278 PolarHBondContact O-N 3.25Å; D274-S278 VanDerWaalsContact O-N 3.15Å; D274-S278 PolarHBondContact O-OG 3.32Å
275I92.6Very high88.1Confident85 Ų8561 Ų6144%0.43635%0.346SS..Hα-helixtrans-61.8-36.6173.5-170.7169000112.3L223 A273 S278 A279L223-I275 HydrophobicContact CD1-CG2 4.49Å; L223-I275 HydrophobicContact CD2-CG2 4.17Å; A273-I275 HydrophobicContact CB-CG2 4.29Å; A273-I275 PolarHBondContact O-N 2.72Å; A273-I275 VanDerWaalsContact O-N 3.13Å; I275-S278 PolarHBondContact O-N 3.36Å; I275-S278 PolarHBondContact O-OG 3.29Å; I275-A279 PolarHBondContact O-N 3.26Å
276L96.1Very high89.6Confident6 Ų658 Ų583%0.03133%0.325CS..Hα-helixtrans-72.8-34.3175.2-59.3-173.7000111.2L223 L254 L257 Y258 A273 D274 S278 A279 L280L223-L276 HydrophobicContact CD2-CD1 4.09Å; L223-L276 HydrophobicContact CD2-CD2 3.79Å; L223-L276 HydrophobicContact CD2-CG 3.93Å; L254-L276 HydrophobicContact CD1-CD2 3.7Å; L254-L276 HydrophobicContact CD2-CD2 4.37Å; L254-L276 HydrophobicContact CG-CD2 4.04Å; L257-L276 HydrophobicContact CB-CD1 4.39Å; L257-L276 HydrophobicContact CD2-CD1 4.1Å; L257-L276 HydrophobicContact CG-CD1 4.04Å; Y258-L276 HydrophobicContact CD2-CB 3.94Å; Y258-L276 HydrophobicContact CG-CB 4.45Å; A273-L276 HydrophobicContact CB-CB 4.27Å; A273-L276 HydrophobicContact CB-CD1 3.93Å; A273-L276 HydrophobicContact CB-CG 3.81Å; A273-L276 WeakPolarHBondContact O-CA 3.4Å; A273-L276 WeakPolarHBondContact O-CB 3.26Å; A273-L276 PolarHBondContact O-N 2.92Å; D274-L276 VanDerWaalsContact C-N 3.29Å; D274-L276 PolarHBondContact O-N 2.88Å; L276-S278 VanDerWaalsContact C-N 3.31Å; L276-S278 PolarHBondContact O-N 2.99Å; L276-A279 PolarHBondContact O-N 2.85Å; L276-A279 VanDerWaalsContact O-N 3.16Å; L276-L280 WeakPolarHBondContact O-CB 3.33Å; L276-L280 WeakPolarHBondContact O-CG 3.4Å; L276-L280 PolarHBondContact O-N 3.49Å
277L95.8Very high90.8Very high18 Ų1854 Ų549%0.09428%0.283CS..Hα-helixtrans-59.9-40173.8-179.860.5000112Y258 A273 D274 K281 L310 A313 W314Y258-L277 HydrophobicContact CE2-CB 3.89Å; Y258-L277 HydrophobicContact CE2-CD1 4.43Å; A273-L277 PolarHBondContact O-N 3.19Å; D274-L277 WeakPolarHBondContact O-CB 3.48Å; D274-L277 PolarHBondContact O-N 3.12Å; L277-K281 PolarHBondContact O-N 3.43Å; L277-L310 HydrophobicContact CD1-CD2 3.44Å; L277-L310 VanDerWaalsContact CD1-CD2 3.44Å; L277-A313 HydrophobicContact CD1-CB 4.09Å; L277-A313 HydrophobicContact CD2-CB 3.9Å; L277-W314 HydrophobicContact CD1-CZ2 4.22Å
278S95.7Very high92.3Very high62 Ų6243.6 Ų43.643%0.43424%0.238SC..Hα-helixtrans-69.2-42.9170.436.50000113.1D274 I275 L276 L280 K281 D282D274-S278 PolarHBondContact O-N 3.25Å; D274-S278 VanDerWaalsContact O-N 3.15Å; D274-S278 PolarHBondContact O-OG 3.32Å; I275-S278 PolarHBondContact O-N 3.36Å; I275-S278 PolarHBondContact O-OG 3.29Å; L276-S278 VanDerWaalsContact C-N 3.31Å; L276-S278 PolarHBondContact O-N 2.99Å; S278-L280 PolarHBondContact O-N 3.29Å; S278-K281 WeakPolarHBondContact O-CB 3.45Å; S278-K281 PolarHBondContact O-N 2.95Å; S278-D282 PolarHBondContact O-N 3.49Å
279A97.9Very high93.4Very high8 Ų839.6 Ų39.67%0.06623%0.227CC..Hα-helixtrans-62.9-42.6-178.800000112.1Y230 L254 I275 L276 K281 D282 L283Y230-A279 HydrophobicContact CD2-CB 3.9Å; Y230-A279 HydrophobicContact CE2-CB 3.99Å; L254-A279 HydrophobicContact CD2-CB 3.84Å; I275-A279 PolarHBondContact O-N 3.26Å; L276-A279 PolarHBondContact O-N 2.85Å; L276-A279 VanDerWaalsContact O-N 3.16Å; A279-K281 PolarHBondContact O-N 3.47Å; A279-D282 PolarHBondContact O-N 3.4Å; A279-L283 WeakPolarHBondContact O-CB 3.43Å; A279-L283 WeakPolarHBondContact O-CG 3.36Å; A279-L283 PolarHBondContact O-N 3.46Å
280L98.4Very high94.3Very high0 Ų037.7 Ų37.70%020%0.203CC..Hα-helixtrans-64.1-39.8178.5-70178.6000112.8L254 Y258 L276 S278 L283 L284 L302 L310L254-L280 HydrophobicContact CB-CD2 4.16Å; L254-L280 HydrophobicContact CD2-CD2 4.27Å; L254-L280 HydrophobicContact CG-CD2 4.37Å; Y258-L280 HydrophobicContact CD1-CD1 3.76Å; Y258-L280 HydrophobicContact CG-CD1 3.72Å; L276-L280 WeakPolarHBondContact O-CB 3.33Å; L276-L280 WeakPolarHBondContact O-CG 3.4Å; L276-L280 PolarHBondContact O-N 3.49Å; S278-L280 PolarHBondContact O-N 3.29Å; L280-L283 PolarHBondContact O-N 3.04Å; L280-L284 WeakPolarHBondContact O-CB 3.31Å; L280-L284 VanDerWaalsContact O-CG 3.3Å; L280-L284 WeakPolarHBondContact O-CG 3.46Å; L280-L284 PolarHBondContact O-N 3.23Å; L280-L302 HydrophobicContact CD2-CD1 4.05Å; L280-L302 HydrophobicContact CD2-CD2 3.94Å; L280-L310 HydrophobicContact CB-CD2 4.39Å; L280-L310 HydrophobicContact CD1-CD2 4.11Å
281K97.9Very high95Very high35 Ų3537 Ų3715%0.15220%0.199CC..Hα-helixtrans-55-54.5171.4176.6-71.9-152.8179.70110.3L277 S278 A279 L283 L284 E285 W314 H321L277-K281 PolarHBondContact O-N 3.43Å; S278-K281 WeakPolarHBondContact O-CB 3.45Å; S278-K281 PolarHBondContact O-N 2.95Å; A279-K281 PolarHBondContact O-N 3.47Å; K281-L283 VanDerWaalsContact C-N 3.33Å; K281-L283 PolarHBondContact O-N 3.41Å; K281-L284 PolarHBondContact O-N 2.85Å; K281-E285 HydrophobicContact CD-CG 4.4Å; K281-E285 WeakPolarHBondContact CD-OE1 2.99Å; K281-E285 WeakPolarHBondContact CE-OE1 3.49Å; K281-E285 IonicContact NZ-OE1 3.39Å; K281-E285 PolarHBondContact NZ-OE1 2.9Å; K281-E285 IonicContact NZ-OE2 2.76Å; K281-E285 PolarHBondContact NZ-OE2 2.9Å; K281-E285 PolarHBondContact O-N 2.87Å; K281-W314 HydrophobicContact CB-CH2 4.26Å; K281-W314 HydrophobicContact CB-CZ2 3.66Å; K281-W314 HydrophobicContact CG-CZ2 4.28Å; K281-H321 HydrophobicContact CG-CB 4.33Å
282D98.2Very high95.4Very high37 Ų3736.3 Ų36.320%0.19820%0.198CC..Hα-helixtrans-68.1-31.5-176.5-69.9-20000112.8Y230 S278 A279 T286Y230-D282 HydrophobicContact CE2-CB 3.99Å; Y230-D282 PolarHBondContact OH-OD2 3.44Å; S278-D282 PolarHBondContact O-N 3.49Å; A279-D282 PolarHBondContact O-N 3.4Å; D282-T286 WeakPolarHBondContact O-CB 3.47Å; D282-T286 PolarHBondContact O-N 2.78Å; D282-T286 PolarHBondContact O-OG1 3.45Å
283L98.6Very high95.8Very high0 Ų034.2 Ų34.20%019%0.194CC..Hα-helixtrans-69.6-39.9175.6-71.8167.4000111.5Y230 R233 F247 F250 V251 L254 A279 L280 K281 T286 L287Y230-L283 HydrophobicContact CD2-CD1 4.34Å; Y230-L283 HydrophobicContact CD2-CD2 4.17Å; Y230-L283 HydrophobicContact CD2-CG 4.08Å; Y230-L283 HydrophobicContact CE2-CG 4.47Å; R233-L283 HydrophobicContact CB-CD2 4Å; F247-L283 HydrophobicContact CE2-CD2 3.53Å; F247-L283 HydrophobicContact CZ-CD2 3.57Å; F250-L283 HydrophobicContact CE1-CD1 4.28Å; F250-L283 HydrophobicContact CE1-CD2 4.45Å; V251-L283 HydrophobicContact CG2-CB 4.42Å; V251-L283 HydrophobicContact CG2-CD1 4.31Å; V251-L283 HydrophobicContact CG2-CD2 4.05Å; V251-L283 HydrophobicContact CG2-CG 4.5Å; L254-L283 HydrophobicContact CD2-CD1 3.54Å; A279-L283 WeakPolarHBondContact O-CB 3.43Å; A279-L283 WeakPolarHBondContact O-CG 3.36Å; A279-L283 PolarHBondContact O-N 3.46Å; L280-L283 PolarHBondContact O-N 3.04Å; K281-L283 VanDerWaalsContact C-N 3.33Å; K281-L283 PolarHBondContact O-N 3.41Å; L283-T286 WeakPolarHBondContact O-CB 3.44Å; L283-T286 PolarHBondContact O-N 3.05Å; L283-L287 WeakPolarHBondContact O-CG 3.34Å; L283-L287 PolarHBondContact O-N 2.57Å
284L98.6Very high96.2Very high0 Ų036.4 Ų36.40%021%0.212CC..Hα-helixtrans-63.1-44.7172.9-73.7166.4000111.6L280 K281 T286 L287 L288 A299 L302 L303 L310 W314 L325L280-L284 WeakPolarHBondContact O-CB 3.31Å; L280-L284 VanDerWaalsContact O-CG 3.3Å; L280-L284 WeakPolarHBondContact O-CG 3.46Å; L280-L284 PolarHBondContact O-N 3.23Å; K281-L284 PolarHBondContact O-N 2.85Å; L284-T286 VanDerWaalsContact C-N 3.33Å; L284-T286 PolarHBondContact O-N 3.41Å; L284-L287 PolarHBondContact O-N 3.04Å; L284-L288 WeakPolarHBondContact O-CB 3.43Å; L284-L288 WeakPolarHBondContact O-CG 3.5Å; L284-L288 PolarHBondContact O-N 3.15Å; L284-A299 HydrophobicContact CD2-CB 4.24Å; L284-L302 HydrophobicContact CD1-CD2 4.19Å; L284-L302 HydrophobicContact CD2-CB 4.22Å; L284-L302 HydrophobicContact CD2-CD2 3.67Å; L284-L302 HydrophobicContact CD2-CG 4.1Å; L284-L302 HydrophobicContact CG-CD2 3.7Å; L284-L302 HydrophobicContact CG-CG 4.46Å; L284-L303 HydrophobicContact CD1-CD2 3.79Å; L284-L303 HydrophobicContact CD1-CG 4.1Å; L284-L303 HydrophobicContact CD2-CD1 4.05Å; L284-L303 HydrophobicContact CD2-CD2 4.4Å; L284-L303 HydrophobicContact CD2-CG 3.78Å; L284-L310 HydrophobicContact CD1-CD1 4.08Å; L284-W314 HydrophobicContact CD1-CH2 4.42Å; L284-L325 HydrophobicContact CB-CD1 4.21Å; L284-L325 HydrophobicContact CB-CD2 3.8Å; L284-L325 HydrophobicContact CD1-CD1 3.97Å
285E98.1Very high96.6Very high68 Ų6831.6 Ų31.632%0.31819%0.186SC..Hα-helixtrans-59.9-41.2171.5-73.4177.6175.500112.4K281 L287 L288 S289 L325K281-E285 HydrophobicContact CD-CG 4.4Å; K281-E285 WeakPolarHBondContact CD-OE1 2.99Å; K281-E285 WeakPolarHBondContact CE-OE1 3.49Å; K281-E285 IonicContact NZ-OE1 3.39Å; K281-E285 PolarHBondContact NZ-OE1 2.9Å; K281-E285 IonicContact NZ-OE2 2.76Å; K281-E285 PolarHBondContact NZ-OE2 2.9Å; K281-E285 PolarHBondContact O-N 2.87Å; E285-L287 VanDerWaalsContact C-N 3.35Å; E285-L287 PolarHBondContact O-N 3.29Å; E285-L288 PolarHBondContact O-N 2.97Å; E285-S289 WeakPolarHBondContact O-CB 3.1Å; E285-S289 PolarHBondContact O-N 3.16Å; E285-S289 PolarHBondContact O-OG 3.36Å; E285-L325 HydrophobicContact CG-CD2 4.07Å
286T98.2Very high96.8Very high11 Ų1127.5 Ų27.57%0.06717%0.165CC..Hα-helixtrans-62.2-42.1178.7-59.10000111.3R233 I237 F247 D282 L283 L284 H290R233-T286 HydrophobicContact CB-CG2 4.4Å; R233-T286 HydrophobicContact CG-CG2 4.27Å; I237-T286 HydrophobicContact CB-CG2 4.14Å; I237-T286 HydrophobicContact CD1-CG2 4.43Å; I237-T286 HydrophobicContact CG1-CG2 4.14Å; I237-T286 HydrophobicContact CG2-CG2 4.1Å; F247-T286 HydrophobicContact CZ-CG2 4.46Å; D282-T286 WeakPolarHBondContact O-CB 3.47Å; D282-T286 PolarHBondContact O-N 2.78Å; D282-T286 PolarHBondContact O-OG1 3.45Å; L283-T286 WeakPolarHBondContact O-CB 3.44Å; L283-T286 PolarHBondContact O-N 3.05Å; L284-T286 VanDerWaalsContact C-N 3.33Å; L284-T286 PolarHBondContact O-N 3.41Å; T286-H290 PolarHBondContact O-ND1 3.3Å
287L98Very high96.9Very high0 Ų029.9 Ų29.90%018%0.177CC..Hα-helixtrans-66.9-51.9176.2-72.1164.8000112I237 F247 V251 L283 L284 E285 S289 H290 N295 C298 A299I237-L287 HydrophobicContact CD1-CD2 3.8Å; F247-L287 HydrophobicContact CE1-CD2 3.88Å; F247-L287 HydrophobicContact CE1-CG 4.27Å; V251-L287 HydrophobicContact CG1-CD1 4.08Å; L283-L287 WeakPolarHBondContact O-CG 3.34Å; L283-L287 PolarHBondContact O-N 2.57Å; L284-L287 PolarHBondContact O-N 3.04Å; E285-L287 VanDerWaalsContact C-N 3.35Å; E285-L287 PolarHBondContact O-N 3.29Å; L287-S289 PolarHBondContact O-N 3.38Å; L287-H290 CarbonylContact O-C 3.55Å; L287-H290 PolarHBondContact O-N 3.37Å; L287-N295 HydrophobicContact CD2-CB 3.83Å; L287-C298 HydrophobicContact CD1-CB 4.22Å; L287-C298 HydrophobicContact CD2-CB 4.02Å; L287-A299 HydrophobicContact CB-CB 4.13Å; L287-A299 HydrophobicContact CD1-CB 4.14Å
288L96.8Very high97Very high0 Ų029.2 Ų29.20%017%0.174CC..Hα-helixtrans-68.5-20.1-179-64.3174.6000113.1L284 E285 H290 L296 A299 L325 R328 I329 I332L284-L288 WeakPolarHBondContact O-CB 3.43Å; L284-L288 WeakPolarHBondContact O-CG 3.5Å; L284-L288 PolarHBondContact O-N 3.15Å; E285-L288 PolarHBondContact O-N 2.97Å; L288-H290 VanDerWaalsContact C-N 3.28Å; L288-L296 HydrophobicContact CD2-CD2 4.11Å; L288-A299 HydrophobicContact CD2-CB 4.1Å; L288-A299 HydrophobicContact CG-CB 4.47Å; L288-L325 HydrophobicContact CD1-CD2 3.75Å; L288-R328 HydrophobicContact CB-CG 3.94Å; L288-R328 HydrophobicContact CD1-CB 4.42Å; L288-R328 HydrophobicContact CD1-CG 4.35Å; L288-R328 PolarHBondContact O-NH2 3.27Å; L288-I329 HydrophobicContact CD1-CD1 4.32Å; L288-I329 HydrophobicContact CD1-CG1 3.97Å; L288-I329 HydrophobicContact CD2-CG1 3.79Å; L288-I332 HydrophobicContact CB-CD1 4.09Å; L288-I332 HydrophobicContact CD2-CD1 3.9Å
289S95.4Very high97.1Very high65 Ų6526.3 Ų26.346%0.45515%0.154SC..THydrogen-bonded Turntrans-76.2-14.3171.8-620000113.6E285 L287E285-S289 WeakPolarHBondContact O-CB 3.1Å; E285-S289 PolarHBondContact O-N 3.16Å; E285-S289 PolarHBondContact O-OG 3.36Å; L287-S289 PolarHBondContact O-N 3.38Å
290H94.7Very high97.2Very high42 Ų4226.4 Ų26.419%0.19415%0.154CC..SBendtrans-127.269.5178.1-57.791.1000109.9I237 R238 T286 L287 L288 V292 N295I237-H290 HydrophobicContact CG1-CB 3.93Å; R238-H290 PolarHBondContact NE-NE2 3.31Å; R238-H290 PolarHBondContact NH2-NE2 3.04Å; T286-H290 PolarHBondContact O-ND1 3.3Å; L287-H290 CarbonylContact O-C 3.55Å; L287-H290 PolarHBondContact O-N 3.37Å; L288-H290 VanDerWaalsContact C-N 3.28Å; H290-V292 VanDerWaalsContact C-N 3.25Å; H290-V292 PolarHBondContact O-N 3.26Å; H290-N295 WeakPolarHBondContact O-CB 3.37Å; H290-N295 PolarHBondContact O-ND2 3.2Å
291P94Very high97.2Very high51 Ų5132.2 Ų32.233%0.33118%0.179SC..  trans-78.559.8-162.634.6-39.5000114.2L296 I332P291-L296 HydrophobicContact CB-CD1 4.17Å; P291-L296 HydrophobicContact CB-CD2 3.9Å; P291-L296 HydrophobicContact CB-CG 4.27Å; P291-I332 HydrophobicContact CB-CD1 4.16Å; P291-I332 HydrophobicContact CB-CG1 4.25Å; P291-I332 HydrophobicContact CB-CG2 4.24Å
292V93.9Very high97.2Very high76 Ų7630.6 Ų30.646%0.46117%0.172SC..  trans-88.2149.8163.4-630000110.1H290 A294 N295 L296H290-V292 VanDerWaalsContact C-N 3.25Å; H290-V292 PolarHBondContact O-N 3.26Å; V292-A294 VanDerWaalsContact C-N 3.29Å; V292-A294 PolarHBondContact O-N 2.85Å; V292-A294 VanDerWaalsContact O-N 3.09Å; V292-N295 HydrophobicContact CG2-CB 4.09Å; V292-N295 WeakPolarHBondContact CG2-ND2 3.36Å; V292-N295 WeakPolarHBondContact O-CB 3.17Å; V292-N295 PolarHBondContact O-N 3.4Å; V292-L296 PolarHBondContact O-N 3.23Å
293D95.8Very high97.2Very high51 Ų5128.9 Ų28.927%0.27316%0.162SC..Hα-helixtrans-45.7-45.4-173.6-80.229.5000114.6N295 L296 I297 C338 S339 V342D293-N295 PolarHBondContact O-N 3.45Å; D293-L296 PolarHBondContact O-N 2.69Å; D293-I297 WeakPolarHBondContact O-CB 3.27Å; D293-I297 WeakPolarHBondContact O-CD1 3.49Å; D293-I297 WeakPolarHBondContact O-CG1 3.43Å; D293-I297 PolarHBondContact O-N 2.94Å; D293-C338 VanDerWaalsContact OD1-CA 3.22Å; D293-C338 WeakPolarHBondContact OD1-CA 3.44Å; D293-C338 VanDerWaalsContact OD1-CB 3.25Å; D293-C338 WeakPolarHBondContact OD1-CB 3.37Å; D293-S339 PolarHBondContact OD1-N 3.32Å; D293-S339 VanDerWaalsContact OD1-N 3.13Å; D293-S339 WeakPolarHBondContact OD2-CB 3.01Å; D293-S339 PolarHBondContact OD2-N 2.88Å; D293-S339 PolarHBondContact OD2-OG 3.5Å; D293-V342 HydrophobicContact CB-CG2 3.92Å; D293-V342 WeakPolarHBondContact OD2-CG2 3.4Å
294A96Very high97.2Very high47 Ų4735.9 Ų35.939%0.38819%0.193SC..Hα-helixtrans-63.5-40.7179.400000113.1V292 C298V292-A294 VanDerWaalsContact C-N 3.29Å; V292-A294 PolarHBondContact O-N 2.85Å; V292-A294 VanDerWaalsContact O-N 3.09Å; A294-C298 WeakPolarHBondContact O-CB 3.27Å; A294-C298 PolarHBondContact O-N 3.48Å
295N97Very high97.1Very high1 Ų138.5 Ų38.51%0.00521%0.207CC..Hα-helixtrans-68.4-39.4176.1-69.3-16000111.3I237 H248 L287 H290 V292 D293 C298 A299I237-N295 HydrophobicContact CD1-CB 4.5Å; I237-N295 VanDerWaalsContact CD1-ND2 3.34Å; I237-N295 WeakPolarHBondContact CD1-ND2 3.23Å; I237-N295 WeakPolarHBondContact CD1-OD1 3.22Å; H248-N295 PolarHBondContact CE1-OD1 3.39Å; H248-N295 PolarHBondContact NE2-OD1 2.97Å; L287-N295 HydrophobicContact CD2-CB 3.83Å; H290-N295 WeakPolarHBondContact O-CB 3.37Å; H290-N295 PolarHBondContact O-ND2 3.2Å; V292-N295 HydrophobicContact CG2-CB 4.09Å; V292-N295 WeakPolarHBondContact CG2-ND2 3.36Å; V292-N295 WeakPolarHBondContact O-CB 3.17Å; V292-N295 PolarHBondContact O-N 3.4Å; D293-N295 PolarHBondContact O-N 3.45Å; N295-C298 WeakPolarHBondContact O-CB 3.49Å; N295-C298 PolarHBondContact O-N 2.82Å; N295-A299 PolarHBondContact O-N 3.32Å
296L97.6Very high97.1Very high0 Ų035.2 Ų35.20%019%0.191CC..Hα-helixtrans-66.5-41.5176.9-64.1173000111.4L288 P291 V292 D293 C298 A299 V300 I332 C338 V342 L346L288-L296 HydrophobicContact CD2-CD2 4.11Å; P291-L296 HydrophobicContact CB-CD1 4.17Å; P291-L296 HydrophobicContact CB-CD2 3.9Å; P291-L296 HydrophobicContact CB-CG 4.27Å; V292-L296 PolarHBondContact O-N 3.23Å; D293-L296 PolarHBondContact O-N 2.69Å; L296-C298 VanDerWaalsContact C-N 3.34Å; L296-C298 PolarHBondContact O-N 3.04Å; L296-A299 PolarHBondContact O-N 2.91Å; L296-V300 VanDerWaalsContact O-CG2 3.28Å; L296-V300 WeakPolarHBondContact O-CG2 3.32Å; L296-V300 PolarHBondContact O-N 3.32Å; L296-I332 HydrophobicContact CD1-CG2 4.4Å; L296-I332 HydrophobicContact CD2-CD1 4.24Å; L296-I332 HydrophobicContact CD2-CG2 4.25Å; L296-C338 HydrophobicContact CD1-CB 3.77Å; L296-V342 HydrophobicContact CB-CG1 3.58Å; L296-V342 HydrophobicContact CD1-CG1 3.74Å; L296-V342 HydrophobicContact CG-CG1 4.31Å; L296-L346 HydrophobicContact CD1-CD1 4.23Å; L296-L346 HydrophobicContact CD2-CD1 4.3Å
297I97.8Very high97.1Very high56 Ų5634.7 Ų34.729%0.28719%0.188SC..Hα-helixtrans-61.8-41.5172.7-69.7163000110.8D293 V300 K301 V342 M345D293-I297 WeakPolarHBondContact O-CB 3.27Å; D293-I297 WeakPolarHBondContact O-CD1 3.49Å; D293-I297 WeakPolarHBondContact O-CG1 3.43Å; D293-I297 PolarHBondContact O-N 2.94Å; I297-V300 PolarHBondContact O-N 3.15Å; I297-K301 HydrophobicContact CG2-CD 4.37Å; I297-K301 WeakPolarHBondContact O-CB 3.44Å; I297-K301 WeakPolarHBondContact O-CG 3.46Å; I297-K301 PolarHBondContact O-N 3.46Å; I297-V342 HydrophobicContact CD1-CG2 3.82Å; I297-V342 HydrophobicContact CG1-CG2 3.79Å; I297-M345 HydrophobicContact CG1-SD 4.23Å
298C98.3Very high97Very high4 Ų436.2 Ų36.23%0.02720%0.199CC..Hα-helixtrans-62.6-45.3175-172.70000111.9H248 L287 A294 N295 L296 K301 L302H248-C298 HydrophobicContact CB-CB 4.21Å; L287-C298 HydrophobicContact CD1-CB 4.22Å; L287-C298 HydrophobicContact CD2-CB 4.02Å; A294-C298 WeakPolarHBondContact O-CB 3.27Å; A294-C298 PolarHBondContact O-N 3.48Å; N295-C298 WeakPolarHBondContact O-CB 3.49Å; N295-C298 PolarHBondContact O-N 2.82Å; L296-C298 VanDerWaalsContact C-N 3.34Å; L296-C298 PolarHBondContact O-N 3.04Å; C298-K301 PolarHBondContact O-N 3.18Å; C298-L302 PolarHBondContact O-N 3.14Å
299A98.5Very high97Very high1 Ų138.7 Ų38.71%0.00821%0.211CC..Hα-helixtrans-63.4-41.7177.100000112.1L284 L287 L288 N295 L296 L302 L303L284-A299 HydrophobicContact CD2-CB 4.24Å; L287-A299 HydrophobicContact CB-CB 4.13Å; L287-A299 HydrophobicContact CD1-CB 4.14Å; L288-A299 HydrophobicContact CD2-CB 4.1Å; L288-A299 HydrophobicContact CG-CB 4.47Å; N295-A299 PolarHBondContact O-N 3.32Å; L296-A299 PolarHBondContact O-N 2.91Å; A299-L302 PolarHBondContact O-N 3.47Å; A299-L303 WeakPolarHBondContact O-CB 3.28Å; A299-L303 PolarHBondContact O-N 3.29Å
300V98.6Very high97.1Very high10 Ų1035.6 Ų35.66%0.06119%0.19CC..Hα-helixtrans-62.1-45.5174170.60000111.2L296 I297 L303 K304 M345 L346 L349L296-V300 VanDerWaalsContact O-CG2 3.28Å; L296-V300 WeakPolarHBondContact O-CG2 3.32Å; L296-V300 PolarHBondContact O-N 3.32Å; I297-V300 PolarHBondContact O-N 3.15Å; V300-L303 PolarHBondContact O-N 2.98Å; V300-K304 HydrophobicContact CG1-CD 4.11Å; V300-K304 HydrophobicContact CG1-CG 4.36Å; V300-K304 WeakPolarHBondContact O-CB 3.38Å; V300-K304 WeakPolarHBondContact O-CG 3.31Å; V300-K304 PolarHBondContact O-N 3.16Å; V300-M345 HydrophobicContact CG1-CB 4.31Å; V300-M345 HydrophobicContact CG2-CB 4.29Å; V300-L346 HydrophobicContact CG2-CD2 3.67Å; V300-L346 HydrophobicContact CG2-CG 4.34Å; V300-L349 HydrophobicContact CB-CD2 4.43Å; V300-L349 HydrophobicContact CG2-CD2 3.98Å
301K98.3Very high97.3Very high122 Ų12233.6 Ų33.653%0.5318%0.181SC..Hα-helixtrans-60.2-48.3177.2-77.8-178.9175.8-170.30111.5L252 I297 C298 K304 L305L252-K301 HydrophobicContact CD1-CB 4.47Å; L252-K301 HydrophobicContact CD1-CD 4.06Å; L252-K301 HydrophobicContact CD2-CB 3.69Å; I297-K301 HydrophobicContact CG2-CD 4.37Å; I297-K301 WeakPolarHBondContact O-CB 3.44Å; I297-K301 WeakPolarHBondContact O-CG 3.46Å; I297-K301 PolarHBondContact O-N 3.46Å; C298-K301 PolarHBondContact O-N 3.18Å; K301-K304 PolarHBondContact O-N 2.91Å; K301-L305 WeakPolarHBondContact O-CB 3.45Å; K301-L305 PolarHBondContact O-N 3.28Å
302L98.6Very high97.4Very high0 Ų034.3 Ų34.30%018%0.181CC..Hα-helixtrans-63.2-44.8179.2177.160000112.1V251 L252 L280 L284 C298 A299 K304 L305 T306V251-L302 HydrophobicContact CG1-CB 4.47Å; V251-L302 HydrophobicContact CG1-CD2 3.58Å; L252-L302 HydrophobicContact CD2-CB 4.18Å; L280-L302 HydrophobicContact CD2-CD1 4.05Å; L280-L302 HydrophobicContact CD2-CD2 3.94Å; L284-L302 HydrophobicContact CD1-CD2 4.19Å; L284-L302 HydrophobicContact CD2-CB 4.22Å; L284-L302 HydrophobicContact CD2-CD2 3.67Å; L284-L302 HydrophobicContact CD2-CG 4.1Å; L284-L302 HydrophobicContact CG-CD2 3.7Å; L284-L302 HydrophobicContact CG-CG 4.46Å; C298-L302 PolarHBondContact O-N 3.14Å; A299-L302 PolarHBondContact O-N 3.47Å; L302-K304 VanDerWaalsContact C-N 3.33Å; L302-K304 PolarHBondContact O-N 2.89Å; L302-L305 PolarHBondContact O-N 3.43Å; L302-T306 HydrophobicContact CD1-CG2 3.73Å; L302-T306 WeakPolarHBondContact CD1-OG1 3.36Å; L302-T306 PolarHBondContact O-N 3.47Å; L302-T306 PolarHBondContact O-OG1 3.44Å
303L98.6Very high97.4Very high1 Ų131.7 Ų31.71%0.00517%0.168CC..Hα-helixtrans-69.3-28.5177.9-77166.8000112.9L284 A299 V300 G307 M322 I329 L349 W357L284-L303 HydrophobicContact CD1-CD2 3.79Å; L284-L303 HydrophobicContact CD1-CG 4.1Å; L284-L303 HydrophobicContact CD2-CD1 4.05Å; L284-L303 HydrophobicContact CD2-CD2 4.4Å; L284-L303 HydrophobicContact CD2-CG 3.78Å; A299-L303 WeakPolarHBondContact O-CB 3.28Å; A299-L303 PolarHBondContact O-N 3.29Å; V300-L303 PolarHBondContact O-N 2.98Å; L303-G307 WeakPolarHBondContact O-CA 3.44Å; L303-G307 PolarHBondContact O-N 2.81Å; L303-M322 HydrophobicContact CD2-CE 3.87Å; L303-M322 HydrophobicContact CD2-SD 3.88Å; L303-I329 HydrophobicContact CD1-CD1 3.99Å; L303-L349 HydrophobicContact CB-CD1 3.96Å; L303-L349 HydrophobicContact CB-CD2 3.98Å; L303-L349 HydrophobicContact CD1-CD2 3.84Å; L303-W357 HydrophobicContact CD2-CH2 4.34Å; L303-W357 VanDerWaalsContact O-CZ3 3.31Å; L303-W357 WeakPolarHBondContact O-CZ3 3.34Å
304K97.9Very high97.5Very high148 Ų14829.5 Ų29.564%0.64316%0.156SC*.Hα-helixtrans-72.8-28.5170.4-74.6-170.373.2-172.30113.6V300 K301 L302 L349 L352V300-K304 HydrophobicContact CG1-CD 4.11Å; V300-K304 HydrophobicContact CG1-CG 4.36Å; V300-K304 WeakPolarHBondContact O-CB 3.38Å; V300-K304 WeakPolarHBondContact O-CG 3.31Å; V300-K304 PolarHBondContact O-N 3.16Å; K301-K304 PolarHBondContact O-N 2.91Å; L302-K304 VanDerWaalsContact C-N 3.33Å; L302-K304 PolarHBondContact O-N 2.89Å; K304-L349 HydrophobicContact CG-CD1 4.19Å; K304-L352 HydrophobicContact CG-CD2 4.16Å
305L97.5Very high97.4Very high54 Ų5432 Ų3228%0.28316%0.158SC..Hα-helixtrans-78.1-47.9175.4176.464000111.9E256 L259 K301 L302E256-L305 HydrophobicContact CG-CD2 3.89Å; E256-L305 WeakPolarHBondContact OE1-CD1 3.42Å; E256-L305 WeakPolarHBondContact OE1-CD2 3.48Å; L259-L305 HydrophobicContact CD1-CD1 3.68Å; L259-L305 HydrophobicContact CD1-CG 3.79Å; K301-L305 WeakPolarHBondContact O-CB 3.45Å; K301-L305 PolarHBondContact O-N 3.28Å; L302-L305 PolarHBondContact O-N 3.43Å
306T98.1Very high97.3Very high0 Ų041.3 Ų41.30%020%0.198CC..Hα-helixtrans-114.5-13.2-166.360.40000114.7L259 L302 S308 I309 L310L259-T306 HydrophobicContact CD1-CG2 4.17Å; L259-T306 HydrophobicContact CD2-CG2 4.37Å; L259-T306 HydrophobicContact CG-CG2 4.09Å; L302-T306 HydrophobicContact CD1-CG2 3.73Å; L302-T306 WeakPolarHBondContact CD1-OG1 3.36Å; L302-T306 PolarHBondContact O-N 3.47Å; L302-T306 PolarHBondContact O-OG1 3.44Å; T306-S308 PolarHBondContact O-N 3.07Å; T306-I309 PolarHBondContact O-N 2.97Å; T306-L310 WeakPolarHBondContact O-CG 3.44Å; T306-L310 PolarHBondContact O-N 2.91Å; T306-L310 WeakPolarHBondContact OG1-CD1 3.44Å
307G97.6Very high97Very high0 Ų044.1 Ų44.10%022%0.218CC..Hα-helixtrans-57.4-43-163.200000114.6L303 I309 L310 D311 M322L303-G307 WeakPolarHBondContact O-CA 3.44Å; L303-G307 PolarHBondContact O-N 2.81Å; G307-I309 PolarHBondContact O-N 3.41Å; G307-L310 PolarHBondContact O-N 3.25Å; G307-D311 WeakPolarHBondContact O-CB 3.47Å; G307-D311 PolarHBondContact O-N 2.98Å; G307-M322 VanDerWaalsContact O-CE 3.3Å; G307-M322 WeakPolarHBondContact O-CE 3.46Å
308S97Very high96.9Very high32 Ų3244.7 Ų44.722%0.22424%0.238CC..Hα-helixtrans-59-45.4176.352.10000112.9T306 D312T306-S308 PolarHBondContact O-N 3.07Å; S308-D312 PolarHBondContact O-N 3.32Å; S308-D312 VanDerWaalsContact O-N 3.08Å
309I96.6Very high96.7Very high51 Ų5149.4 Ų49.426%0.26226%0.258SS..Hα-helixtrans-71.1-38.5-179.8-51.3-55.9000111.2Y258 L259 T306 G307 A313Y258-I309 HydrophobicContact CE1-CG2 3.9Å; L259-I309 HydrophobicContact CD2-CB 4.17Å; L259-I309 HydrophobicContact CD2-CG1 3.81Å; L259-I309 HydrophobicContact CD2-CG2 4.38Å; T306-I309 PolarHBondContact O-N 2.97Å; G307-I309 PolarHBondContact O-N 3.41Å; I309-A313 VanDerWaalsContact O-CB 3.27Å; I309-A313 WeakPolarHBondContact O-CB 3.28Å; I309-A313 PolarHBondContact O-N 3.29Å
310L97.5Very high96.7Very high0 Ų052.4 Ų52.40%028%0.278CS..Hα-helixtrans-65.6-46.4175.4-67.2177.7000111.8Y258 L277 L280 L284 T306 G307 A313 W314 M322Y258-L310 HydrophobicContact CD1-CD2 4.2Å; Y258-L310 HydrophobicContact CE1-CD2 3.77Å; L277-L310 HydrophobicContact CD1-CD2 3.44Å; L277-L310 VanDerWaalsContact CD1-CD2 3.44Å; L280-L310 HydrophobicContact CB-CD2 4.39Å; L280-L310 HydrophobicContact CD1-CD2 4.11Å; L284-L310 HydrophobicContact CD1-CD1 4.08Å; T306-L310 WeakPolarHBondContact O-CG 3.44Å; T306-L310 PolarHBondContact O-N 2.91Å; T306-L310 WeakPolarHBondContact OG1-CD1 3.44Å; G307-L310 PolarHBondContact O-N 3.25Å; L310-A313 PolarHBondContact O-N 2.66Å; L310-W314 HydrophobicContact CB-CD2 4.41Å; L310-W314 HydrophobicContact CB-CE3 4.17Å; L310-W314 HydrophobicContact CB-CH2 3.79Å; L310-W314 HydrophobicContact CB-CZ2 4Å; L310-W314 HydrophobicContact CB-CZ3 3.88Å; L310-W314 HydrophobicContact CD1-CH2 3.83Å; L310-W314 HydrophobicContact CD1-CZ2 4.23Å; L310-W314 HydrophobicContact CD2-CH2 4.32Å; L310-W314 HydrophobicContact CD2-CZ2 3.91Å; L310-W314 HydrophobicContact CG-CH2 4.2Å; L310-W314 HydrophobicContact CG-CZ2 4.27Å; L310-W314 WeakPolarHBondContact O-CB 3.33Å; L310-W314 VanDerWaalsContact O-CD2 3.29Å; L310-W314 VanDerWaalsContact O-CG 3.26Å; L310-W314 PolarHBondContact O-N 3.35Å; L310-M322 HydrophobicContact CB-CE 3.88Å
311D97.5Very high96.6Very high1 Ų153.7 Ų53.71%0.00528%0.283CS..Hα-helixtrans-60.1-47.8179.1-163.918.8000110.3G307 A313 W314 K315 M322 R353 W357G307-D311 WeakPolarHBondContact O-CB 3.47Å; G307-D311 PolarHBondContact O-N 2.98Å; D311-A313 PolarHBondContact O-N 2.91Å; D311-W314 PolarHBondContact O-N 3.14Å; D311-K315 VanDerWaalsContact O-CB 3.23Å; D311-K315 WeakPolarHBondContact O-CB 3.41Å; D311-K315 WeakPolarHBondContact O-CD 3.11Å; D311-K315 WeakPolarHBondContact O-CG 3.44Å; D311-K315 PolarHBondContact O-N 3.3Å; D311-K315 WeakPolarHBondContact OD1-CE 3.29Å; D311-K315 IonicContact OD1-NZ 3.61Å; D311-K315 PolarHBondContact OD1-NZ 2.99Å; D311-K315 IonicContact OD2-NZ 3.72Å; D311-K315 PolarHBondContact OD2-NZ 3.41Å; D311-M322 HydrophobicContact CB-CB 4.33Å; D311-M322 HydrophobicContact CB-CE 3.8Å; D311-M322 HydrophobicContact CB-CG 4.1Å; D311-M322 VanDerWaalsContact OD1-CB 3.24Å; D311-M322 WeakPolarHBondContact OD1-CB 3.43Å; D311-M322 WeakPolarHBondContact OD1-CG 3.18Å; D311-R353 IonicContact OD1-NH2 3.51Å; D311-R353 PolarHBondContact OD1-NH2 3.07Å; D311-R353 IonicContact OD2-NE 2.83Å; D311-W357 HydrophobicContact CB-CZ2 4.36Å; D311-W357 PolarHBondContact OD2-NE1 3.37Å
312D95.8Very high96.6Very high65 Ų6547.9 Ų47.935%0.34826%0.258SS..Hα-helixtrans-62.1-40.9175.7-65.8-10000112.7S308 K316 R359S308-D312 PolarHBondContact O-N 3.32Å; S308-D312 VanDerWaalsContact O-N 3.08Å; D312-K316 WeakPolarHBondContact O-CB 3.06Å; D312-K316 PolarHBondContact O-N 3.05Å; D312-R359 VanDerWaalsContact CG-NH1 3.3Å; D312-R359 IonicContact OD1-CZ 2.62Å; D312-R359 IonicContact OD1-NH1 3.91Å; D312-R359 PolarHBondContact OD1-NH1 2.76Å; D312-R359 IonicContact OD1-NH2 3.36Å; D312-R359 PolarHBondContact OD1-NH2 3.02Å; D312-R359 IonicContact OD2-CZ 2.78Å; D312-R359 IonicContact OD2-NH1 2.64Å; D312-R359 PolarHBondContact OD2-NH1 3.02Å; D312-R359 IonicContact OD2-NH2 3.32Å
313A95.5Very high96.6Very high22 Ų2251.8 Ų51.818%0.18228%0.276CS..Hα-helixtrans-68.4-38.9179.200000112.6L277 I309 L310 D311 S317L277-A313 HydrophobicContact CD1-CB 4.09Å; L277-A313 HydrophobicContact CD2-CB 3.9Å; I309-A313 VanDerWaalsContact O-CB 3.27Å; I309-A313 WeakPolarHBondContact O-CB 3.28Å; I309-A313 PolarHBondContact O-N 3.29Å; L310-A313 PolarHBondContact O-N 2.66Å; D311-A313 PolarHBondContact O-N 2.91Å; A313-S317 WeakPolarHBondContact O-CB 3.38Å; A313-S317 PolarHBondContact O-N 3.49Å; A313-S317 VanDerWaalsContact O-N 3.12Å; A313-S317 PolarHBondContact O-OG 2.84Å
314W96.5Very high96.5Very high5 Ų556 Ų562%0.01930%0.295CS..Hα-helixtrans-73.9-42176.2-62.1-29.6000111.7L277 K281 L284 L310 D311 K316 S317 G318 K319 H321 M322 L325L277-W314 HydrophobicContact CD1-CZ2 4.22Å; K281-W314 HydrophobicContact CB-CH2 4.26Å; K281-W314 HydrophobicContact CB-CZ2 3.66Å; K281-W314 HydrophobicContact CG-CZ2 4.28Å; L284-W314 HydrophobicContact CD1-CH2 4.42Å; L310-W314 HydrophobicContact CB-CD2 4.41Å; L310-W314 HydrophobicContact CB-CE3 4.17Å; L310-W314 HydrophobicContact CB-CH2 3.79Å; L310-W314 HydrophobicContact CB-CZ2 4Å; L310-W314 HydrophobicContact CB-CZ3 3.88Å; L310-W314 HydrophobicContact CD1-CH2 3.83Å; L310-W314 HydrophobicContact CD1-CZ2 4.23Å; L310-W314 HydrophobicContact CD2-CH2 4.32Å; L310-W314 HydrophobicContact CD2-CZ2 3.91Å; L310-W314 HydrophobicContact CG-CH2 4.2Å; L310-W314 HydrophobicContact CG-CZ2 4.27Å; L310-W314 WeakPolarHBondContact O-CB 3.33Å; L310-W314 VanDerWaalsContact O-CD2 3.29Å; L310-W314 VanDerWaalsContact O-CG 3.26Å; L310-W314 PolarHBondContact O-N 3.35Å; D311-W314 PolarHBondContact O-N 3.14Å; W314-K316 PolarHBondContact O-N 3.05Å; W314-S317 WeakPolarHBondContact CA-OG 3.29Å; W314-S317 CarbonylContact O-C 3.57Å; W314-S317 PolarHBondContact O-N 3.41Å; W314-S317 VanDerWaalsContact O-N 3.15Å; W314-S317 PolarHBondContact O-OG 3.34Å; W314-G318 PolarHBondContact O-N 3.45Å; W314-K319 CarbonylContact C-O 3.6Å; W314-K319 HydrophobicContact CB-CB 4.35Å; W314-K319 PolarHBondContact O-N 2.89Å; W314-H321 HydrophobicContact CB-CB 4.43Å; W314-H321 HydrophobicContact CD2-CB 3.61Å; W314-H321 HydrophobicContact CE3-CB 3.6Å; W314-H321 HydrophobicContact CG-CB 3.97Å; W314-H321 HydrophobicContact CZ3-CB 4.09Å; W314-M322 HydrophobicContact CE3-CB 3.97Å; W314-M322 HydrophobicContact CE3-CE 3.98Å; W314-M322 HydrophobicContact CH2-CE 4.4Å; W314-M322 HydrophobicContact CZ3-CB 4.25Å; W314-M322 HydrophobicContact CZ3-CE 3.48Å; W314-M322 VanDerWaalsContact CZ3-CE 3.48Å; W314-M322 HydrophobicContact CZ3-SD 4.04Å; W314-L325 HydrophobicContact CH2-CD1 3.74Å; W314-L325 HydrophobicContact CZ3-CD1 3.66Å
315K95.1Very high96.5Very high99 Ų9949.1 Ų49.143%0.4327%0.266SS..Hα-helixtrans-55-49.8169.4-75.6163.8173163.80111.7D311 S317 G318D311-K315 VanDerWaalsContact O-CB 3.23Å; D311-K315 WeakPolarHBondContact O-CB 3.41Å; D311-K315 WeakPolarHBondContact O-CD 3.11Å; D311-K315 WeakPolarHBondContact O-CG 3.44Å; D311-K315 PolarHBondContact O-N 3.3Å; D311-K315 WeakPolarHBondContact OD1-CE 3.29Å; D311-K315 IonicContact OD1-NZ 3.61Å; D311-K315 PolarHBondContact OD1-NZ 2.99Å; D311-K315 IonicContact OD2-NZ 3.72Å; D311-K315 PolarHBondContact OD2-NZ 3.41Å; K315-S317 VanDerWaalsContact C-N 3.25Å; K315-S317 PolarHBondContact O-N 2.95Å; K315-G318 PolarHBondContact O-N 3.03Å; K315-G318 VanDerWaalsContact O-N 3.07Å
316K94.2Very high96.6Very high196 Ų19647 Ų4785%0.85226%0.255SS*.Hα-helixtrans-62.2-29.4178-177.1179.4176-173.90113.2D312 W314D312-K316 WeakPolarHBondContact O-CB 3.06Å; D312-K316 PolarHBondContact O-N 3.05Å; W314-K316 PolarHBondContact O-N 3.05Å
317S92.4Very high96.5Very high60 Ų6053.1 Ų53.142%0.4228%0.283SS..THydrogen-bonded Turntrans-94.85.5176.155.50000114.2A313 W314 K315 K319A313-S317 WeakPolarHBondContact O-CB 3.38Å; A313-S317 PolarHBondContact O-N 3.49Å; A313-S317 VanDerWaalsContact O-N 3.12Å; A313-S317 PolarHBondContact O-OG 2.84Å; W314-S317 WeakPolarHBondContact CA-OG 3.29Å; W314-S317 CarbonylContact O-C 3.57Å; W314-S317 PolarHBondContact O-N 3.41Å; W314-S317 VanDerWaalsContact O-N 3.15Å; W314-S317 PolarHBondContact O-OG 3.34Å; K315-S317 VanDerWaalsContact C-N 3.25Å; K315-S317 PolarHBondContact O-N 2.95Å; S317-K319 VanDerWaalsContact C-N 3.31Å; S317-K319 PolarHBondContact O-N 2.94Å
318G94.6Very high96.5Very high68 Ų6857.5 Ų57.570%0.70130%0.3SS*.THydrogen-bonded Turntrans6922.7177.500000114.8W314 K315W314-G318 PolarHBondContact O-N 3.45Å; K315-G318 PolarHBondContact O-N 3.03Å; K315-G318 VanDerWaalsContact O-N 3.07Å
319K95.3Very high96.5Very high102 Ų10256 Ų5644%0.44329%0.29SS..  trans-102.6128.8-176.2-60.5-177.5-177.8-178.50110.9W314 S317 H321W314-K319 CarbonylContact C-O 3.6Å; W314-K319 HydrophobicContact CB-CB 4.35Å; W314-K319 PolarHBondContact O-N 2.89Å; S317-K319 VanDerWaalsContact C-N 3.31Å; S317-K319 PolarHBondContact O-N 2.94Å; K319-H321 PolarHBondContact O-N 2.72Å
320P96.6Very high96.5Very high65 Ų6557.9 Ų57.942%0.42230%0.297SS..  trans-8026.7-176.535.4-38000113.9M322 E323 E324P320-M322 VanDerWaalsContact C-N 3.32Å; P320-M322 PolarHBondContact O-N 3.43Å; P320-E323 VanDerWaalsContact C-OE2 3.23Å; P320-E323 VanDerWaalsContact CA-OE2 3.28Å; P320-E323 WeakPolarHBondContact CA-OE2 3.27Å; P320-E323 HydrophobicContact CB-CB 4.43Å; P320-E323 WeakPolarHBondContact O-CB 3.45Å; P320-E323 PolarHBondContact O-N 3.16Å; P320-E323 VanDerWaalsContact O-N 3.16Å; P320-E324 HydrophobicContact CG-CG 4.48Å; P320-E324 VanDerWaalsContact O-CG 3.31Å; P320-E324 WeakPolarHBondContact O-CG 3.17Å; P320-E324 PolarHBondContact O-N 3.23Å
321H97.8Very high96.4Very high37 Ų3760.2 Ų60.217%0.17131%0.311CS..Hα-helixtrans-66.9-29.3-168-68.7-27.9000113.7K281 W314 K319 E324 L325K281-H321 HydrophobicContact CG-CB 4.33Å; W314-H321 HydrophobicContact CB-CB 4.43Å; W314-H321 HydrophobicContact CD2-CB 3.61Å; W314-H321 HydrophobicContact CE3-CB 3.6Å; W314-H321 HydrophobicContact CG-CB 3.97Å; W314-H321 HydrophobicContact CZ3-CB 4.09Å; K319-H321 PolarHBondContact O-N 2.72Å; H321-E324 WeakPolarHBondContact CA-OE2 3.42Å; H321-E324 IonicContact CE1-OE2 3.14Å; H321-E324 IonicContact CG-OE2 3.47Å; H321-E324 IonicContact ND1-OE2 2.65Å; H321-E324 PolarHBondContact ND1-OE2 2.93Å; H321-L325 WeakPolarHBondContact O-CB 3.17Å; H321-L325 WeakPolarHBondContact O-CD1 3.48Å; H321-L325 WeakPolarHBondContact O-CG 3.19Å; H321-L325 PolarHBondContact O-N 3.01Å
322M98Very high96.3Very high0 Ų060.4 Ų60.40%031%0.313CS..Hα-helixtrans-78.4-31.2175.7-162.162.278.800111.9L303 G307 L310 D311 W314 P320 L325 V326 W357L303-M322 HydrophobicContact CD2-CE 3.87Å; L303-M322 HydrophobicContact CD2-SD 3.88Å; G307-M322 VanDerWaalsContact O-CE 3.3Å; G307-M322 WeakPolarHBondContact O-CE 3.46Å; L310-M322 HydrophobicContact CB-CE 3.88Å; D311-M322 HydrophobicContact CB-CB 4.33Å; D311-M322 HydrophobicContact CB-CE 3.8Å; D311-M322 HydrophobicContact CB-CG 4.1Å; D311-M322 VanDerWaalsContact OD1-CB 3.24Å; D311-M322 WeakPolarHBondContact OD1-CB 3.43Å; D311-M322 WeakPolarHBondContact OD1-CG 3.18Å; W314-M322 HydrophobicContact CE3-CB 3.97Å; W314-M322 HydrophobicContact CE3-CE 3.98Å; W314-M322 HydrophobicContact CH2-CE 4.4Å; W314-M322 HydrophobicContact CZ3-CB 4.25Å; W314-M322 HydrophobicContact CZ3-CE 3.48Å; W314-M322 VanDerWaalsContact CZ3-CE 3.48Å; W314-M322 HydrophobicContact CZ3-SD 4.04Å; P320-M322 VanDerWaalsContact C-N 3.32Å; P320-M322 PolarHBondContact O-N 3.43Å; M322-L325 HydrophobicContact SD-CD1 4.48Å; M322-V326 WeakPolarHBondContact O-CB 3.4Å; M322-V326 WeakPolarHBondContact O-CG2 3.3Å; M322-V326 PolarHBondContact O-N 2.97Å; M322-W357 HydrophobicContact CE-CH2 4.23Å; M322-W357 HydrophobicContact CE-CZ2 3.79Å; M322-W357 HydrophobicContact CG-CZ2 4.14Å; M322-W357 HydrophobicContact SD-CH2 4.21Å; M322-W357 HydrophobicContact SD-CZ2 3.9Å
323E97.7Very high96.2Very high81 Ų8158 Ų5838%0.37930%0.3SS..Hα-helixtrans-62.2-49.5169-66.663.7-145.400110.8P320 L325 V326 Q327 R353P320-E323 VanDerWaalsContact C-OE2 3.23Å; P320-E323 VanDerWaalsContact CA-OE2 3.28Å; P320-E323 WeakPolarHBondContact CA-OE2 3.27Å; P320-E323 HydrophobicContact CB-CB 4.43Å; P320-E323 WeakPolarHBondContact O-CB 3.45Å; P320-E323 PolarHBondContact O-N 3.16Å; P320-E323 VanDerWaalsContact O-N 3.16Å; E323-L325 PolarHBondContact O-N 3.31Å; E323-V326 PolarHBondContact O-N 3.33Å; E323-Q327 WeakPolarHBondContact O-CB 3.45Å; E323-Q327 PolarHBondContact O-N 2.87Å; E323-R353 VanDerWaalsContact CD-NH2 3.3Å; E323-R353 IonicContact OE1-CZ 3.72Å; E323-R353 IonicContact OE1-NH2 3.83Å; E323-R353 PolarHBondContact OE1-NH2 3.36Å; E323-R353 IonicContact OE2-NH2 2.68Å
324E98.1Very high96Very high89 Ų8963.9 Ų63.942%0.41633%0.327SS..Hα-helixtrans-58.6-46.4177.9-70.4168154.400111.6P320 H321 R328P320-E324 HydrophobicContact CG-CG 4.48Å; P320-E324 VanDerWaalsContact O-CG 3.31Å; P320-E324 WeakPolarHBondContact O-CG 3.17Å; P320-E324 PolarHBondContact O-N 3.23Å; H321-E324 WeakPolarHBondContact CA-OE2 3.42Å; H321-E324 IonicContact CE1-OE2 3.14Å; H321-E324 IonicContact CG-OE2 3.47Å; H321-E324 IonicContact ND1-OE2 2.65Å; H321-E324 PolarHBondContact ND1-OE2 2.93Å; E324-R328 WeakPolarHBondContact O-CB 3.39Å; E324-R328 PolarHBondContact O-N 2.88Å
325L98.3Very high95.2Very high4 Ų469.8 Ų69.82%0.02136%0.359CS..Hα-helixtrans-65.9-39.5178.1-73.4169.4000112.9L284 E285 L288 W314 H321 M322 E323 R328 I329L284-L325 HydrophobicContact CB-CD1 4.21Å; L284-L325 HydrophobicContact CB-CD2 3.8Å; L284-L325 HydrophobicContact CD1-CD1 3.97Å; E285-L325 HydrophobicContact CG-CD2 4.07Å; L288-L325 HydrophobicContact CD1-CD2 3.75Å; W314-L325 HydrophobicContact CH2-CD1 3.74Å; W314-L325 HydrophobicContact CZ3-CD1 3.66Å; H321-L325 WeakPolarHBondContact O-CB 3.17Å; H321-L325 WeakPolarHBondContact O-CD1 3.48Å; H321-L325 WeakPolarHBondContact O-CG 3.19Å; H321-L325 PolarHBondContact O-N 3.01Å; M322-L325 HydrophobicContact SD-CD1 4.48Å; E323-L325 PolarHBondContact O-N 3.31Å; L325-R328 WeakPolarHBondContact O-CB 3.13Å; L325-R328 PolarHBondContact O-N 3.19Å; L325-I329 WeakPolarHBondContact O-CG1 3.48Å; L325-I329 PolarHBondContact O-N 2.9Å
326V97.8Very high93.9Very high10 Ų1066.4 Ų66.46%0.06135%0.35CS..Hα-helixtrans-74.8-38.9177.9168.20000112.3M322 E323 R328 I329 E330 V350 R353M322-V326 WeakPolarHBondContact O-CB 3.4Å; M322-V326 WeakPolarHBondContact O-CG2 3.3Å; M322-V326 PolarHBondContact O-N 2.97Å; E323-V326 PolarHBondContact O-N 3.33Å; V326-R328 PolarHBondContact O-N 2.92Å; V326-I329 CarbonylContact O-C 3.57Å; V326-I329 WeakPolarHBondContact O-CA 3.39Å; V326-I329 WeakPolarHBondContact O-CB 3.2Å; V326-I329 PolarHBondContact O-N 2.97Å; V326-E330 HydrophobicContact CG1-CG 4.32Å; V326-E330 WeakPolarHBondContact O-CG 3.17Å; V326-E330 PolarHBondContact O-N 3.47Å; V326-V350 HydrophobicContact CG1-CG1 4.27Å; V326-V350 HydrophobicContact CG1-CG2 4.26Å; V326-R353 VanDerWaalsContact CG2-CD 3.49Å
327Q97.4Very high93.2Very high128 Ų12864 Ų6460%0.59835%0.352SS*.Hα-helixtrans-58.4-36.1170.7-170.8-17917.400110.8E323 E330 T331E323-Q327 WeakPolarHBondContact O-CB 3.45Å; E323-Q327 PolarHBondContact O-N 2.87Å; Q327-E330 PolarHBondContact O-N 2.89Å; Q327-T331 WeakPolarHBondContact O-CB 3.18Å; Q327-T331 PolarHBondContact O-N 2.95Å; Q327-T331 PolarHBondContact O-OG1 2.95Å
328R96.7Very high92.9Very high92 Ų9261.9 Ų61.935%0.34734%0.337SS..Hα-helixtrans-65.9-41.7173.1-169.369.9-172.3120.65.7112.3L288 E324 L325 V326 T331 I332L288-R328 HydrophobicContact CB-CG 3.94Å; L288-R328 HydrophobicContact CD1-CB 4.42Å; L288-R328 HydrophobicContact CD1-CG 4.35Å; L288-R328 PolarHBondContact O-NH2 3.27Å; E324-R328 WeakPolarHBondContact O-CB 3.39Å; E324-R328 PolarHBondContact O-N 2.88Å; L325-R328 WeakPolarHBondContact O-CB 3.13Å; L325-R328 PolarHBondContact O-N 3.19Å; V326-R328 PolarHBondContact O-N 2.92Å; R328-T331 PolarHBondContact O-N 3.41Å; R328-I332 HydrophobicContact CG-CD1 4.32Å; R328-I332 WeakPolarHBondContact O-CD1 3.5Å; R328-I332 VanDerWaalsContact O-CG1 3.26Å; R328-I332 WeakPolarHBondContact O-CG1 3.26Å; R328-I332 PolarHBondContact O-N 3.25Å
329I97.4Very high92.9Very high1 Ų161.1 Ų61.11%0.00532%0.32CS..Hα-helixtrans-63.6-42.3174.1-71.2161.2000111.5L288 L303 L325 V326 I332 L333 L346 L349 V350L288-I329 HydrophobicContact CD1-CD1 4.32Å; L288-I329 HydrophobicContact CD1-CG1 3.97Å; L288-I329 HydrophobicContact CD2-CG1 3.79Å; L303-I329 HydrophobicContact CD1-CD1 3.99Å; L325-I329 WeakPolarHBondContact O-CG1 3.48Å; L325-I329 PolarHBondContact O-N 2.9Å; V326-I329 CarbonylContact O-C 3.57Å; V326-I329 WeakPolarHBondContact O-CA 3.39Å; V326-I329 WeakPolarHBondContact O-CB 3.2Å; V326-I329 PolarHBondContact O-N 2.97Å; I329-I332 WeakPolarHBondContact O-CB 3.46Å; I329-I332 PolarHBondContact O-N 2.68Å; I329-L333 HydrophobicContact CG2-CD1 4.16Å; I329-L333 WeakPolarHBondContact O-CG 3.41Å; I329-L333 PolarHBondContact O-N 3.04Å; I329-L346 HydrophobicContact CG1-CD2 4.42Å; I329-L346 HydrophobicContact CG2-CB 4.14Å; I329-L346 HydrophobicContact CG2-CD2 4Å; I329-L349 HydrophobicContact CD1-CD2 4.03Å; I329-V350 HydrophobicContact CG2-CG2 3.77Å
330E96.1Very high92.9Very high91 Ų9165.6 Ų65.643%0.42533%0.334SS..Hα-helixtrans-63.5-42.3175.2-71.1172.417300111.7V326 Q327 I332 L333 L334 V350V326-E330 HydrophobicContact CG1-CG 4.32Å; V326-E330 WeakPolarHBondContact O-CG 3.17Å; V326-E330 PolarHBondContact O-N 3.47Å; Q327-E330 PolarHBondContact O-N 2.89Å; E330-I332 VanDerWaalsContact C-N 3.32Å; E330-I332 PolarHBondContact O-N 3.49Å; E330-L333 CarbonylContact O-C 3.39Å; E330-L333 WeakPolarHBondContact O-CA 3.48Å; E330-L333 WeakPolarHBondContact O-CB 3.34Å; E330-L333 PolarHBondContact O-N 3.12Å; E330-L333 VanDerWaalsContact O-N 3.09Å; E330-L334 WeakPolarHBondContact O-CG 3.28Å; E330-L334 PolarHBondContact O-N 2.95Å; E330-V350 HydrophobicContact CG-CG2 4.46Å
331T95.4Very high92.8Very high48 Ų4866.4 Ų66.429%0.29434%0.335SS..Hα-helixtrans-58.2-45.7172.7-51.10000110.9Q327 R328 L333 L334 D335Q327-T331 WeakPolarHBondContact O-CB 3.18Å; Q327-T331 PolarHBondContact O-N 2.95Å; Q327-T331 PolarHBondContact O-OG1 2.95Å; R328-T331 PolarHBondContact O-N 3.41Å; T331-L333 VanDerWaalsContact C-N 3.33Å; T331-L333 PolarHBondContact O-N 3.03Å; T331-L334 PolarHBondContact O-N 3.3Å; T331-L334 VanDerWaalsContact O-N 3.15Å; T331-D335 PolarHBondContact O-N 2.96Å
332I94.9Very high92.8Very high6 Ų664.8 Ų64.83%0.03133%0.328CS..Hα-helixtrans-60.9-42.4174.3-67.4160.6000110.2L288 P291 L296 R328 I329 E330 L334 D335 A336 L346L288-I332 HydrophobicContact CB-CD1 4.09Å; L288-I332 HydrophobicContact CD2-CD1 3.9Å; P291-I332 HydrophobicContact CB-CD1 4.16Å; P291-I332 HydrophobicContact CB-CG1 4.25Å; P291-I332 HydrophobicContact CB-CG2 4.24Å; L296-I332 HydrophobicContact CD1-CG2 4.4Å; L296-I332 HydrophobicContact CD2-CD1 4.24Å; L296-I332 HydrophobicContact CD2-CG2 4.25Å; R328-I332 HydrophobicContact CG-CD1 4.32Å; R328-I332 WeakPolarHBondContact O-CD1 3.5Å; R328-I332 VanDerWaalsContact O-CG1 3.26Å; R328-I332 WeakPolarHBondContact O-CG1 3.26Å; R328-I332 PolarHBondContact O-N 3.25Å; I329-I332 WeakPolarHBondContact O-CB 3.46Å; I329-I332 PolarHBondContact O-N 2.68Å; E330-I332 VanDerWaalsContact C-N 3.32Å; E330-I332 PolarHBondContact O-N 3.49Å; I332-L334 VanDerWaalsContact C-N 3.26Å; I332-L334 PolarHBondContact O-N 3.03Å; I332-D335 PolarHBondContact O-N 3.06Å; I332-A336 HydrophobicContact CG2-CB 3.78Å; I332-A336 WeakPolarHBondContact O-CA 3.49Å; I332-A336 WeakPolarHBondContact O-CB 3.46Å; I332-A336 PolarHBondContact O-N 3.36Å; I332-L346 HydrophobicContact CG2-CD1 4.07Å
333L95Very high92.7Very high14 Ų1469.4 Ų69.47%0.07335%0.345CS..Hα-helixtrans-63.7-26.9176.2-75.4170000113.6I329 E330 T331 R343 L346 L347 V350I329-L333 HydrophobicContact CG2-CD1 4.16Å; I329-L333 WeakPolarHBondContact O-CG 3.41Å; I329-L333 PolarHBondContact O-N 3.04Å; E330-L333 CarbonylContact O-C 3.39Å; E330-L333 WeakPolarHBondContact O-CA 3.48Å; E330-L333 WeakPolarHBondContact O-CB 3.34Å; E330-L333 PolarHBondContact O-N 3.12Å; E330-L333 VanDerWaalsContact O-N 3.09Å; T331-L333 VanDerWaalsContact C-N 3.33Å; T331-L333 PolarHBondContact O-N 3.03Å; L333-R343 HydrophobicContact CD2-CG 3.71Å; L333-R343 PolarHBondContact O-NH1 2.89Å; L333-R343 PolarHBondContact O-NH2 2.77Å; L333-L346 HydrophobicContact CD1-CB 4.25Å; L333-L346 HydrophobicContact CD2-CB 3.83Å; L333-L346 HydrophobicContact CD2-CD1 4.42Å; L333-L346 HydrophobicContact CG-CB 4.13Å; L333-L347 HydrophobicContact CD1-CD2 3.89Å; L333-L347 HydrophobicContact CD1-CG 4.13Å; L333-L347 HydrophobicContact CD2-CD2 4.36Å; L333-L347 HydrophobicContact CD2-CG 3.95Å; L333-V350 HydrophobicContact CD1-CG2 4.28Å
334L91.2Very high92.6Very high145 Ų14570 Ų7076%0.75935%0.349SS*.Hα-helixtrans-75.3-46172.6-66.1172.3000111.8E330 T331 I332E330-L334 WeakPolarHBondContact O-CG 3.28Å; E330-L334 PolarHBondContact O-N 2.95Å; T331-L334 PolarHBondContact O-N 3.3Å; T331-L334 VanDerWaalsContact O-N 3.15Å; I332-L334 VanDerWaalsContact C-N 3.26Å; I332-L334 PolarHBondContact O-N 3.03Å
335D80Confident92.6Very high129 Ų12969.8 Ų69.869%0.6935%0.348SS*.Hα-helixtrans-94.7-20.5-168.2-63.9-28.1000115.5T331 I332T331-D335 PolarHBondContact O-N 2.96Å; I332-D335 PolarHBondContact O-N 3.06Å
336A66.5Low92.6Very high28 Ų2869.6 Ų69.623%0.23135%0.348CS..  trans-77.3141-154.400000117.2I332 C338I332-A336 HydrophobicContact CG2-CB 3.78Å; I332-A336 WeakPolarHBondContact O-CA 3.49Å; I332-A336 WeakPolarHBondContact O-CB 3.46Å; I332-A336 PolarHBondContact O-N 3.36Å; A336-C338 VanDerWaalsContact C-N 3.27Å; A336-C338 HydrophobicContact CB-CB 4.22Å
337T79.3Confident92.6Very high147 Ų14772.9 Ų72.990%0.90236%0.364SS*.  trans-82.48.1165.950.80000113.9
338C87.5Confident92.6Very high15 Ų1573 Ų7310%0.10136%0.363CS..  trans-66.2157-179.967.10000112.2D293 L296 A336 V342D293-C338 VanDerWaalsContact OD1-CA 3.22Å; D293-C338 WeakPolarHBondContact OD1-CA 3.44Å; D293-C338 VanDerWaalsContact OD1-CB 3.25Å; D293-C338 WeakPolarHBondContact OD1-CB 3.37Å; L296-C338 HydrophobicContact CD1-CB 3.77Å; A336-C338 VanDerWaalsContact C-N 3.27Å; A336-C338 HydrophobicContact CB-CB 4.22Å; C338-V342 HydrophobicContact CB-CB 4.47Å; C338-V342 HydrophobicContact CB-CG1 4.16Å
339S93.8Very high92.7Very high51 Ų5168.8 Ų68.836%0.35735%0.347SS..  trans-61.6157179.669.10000113.2D293 D341 V342 R343D293-S339 PolarHBondContact OD1-N 3.32Å; D293-S339 VanDerWaalsContact OD1-N 3.13Å; D293-S339 WeakPolarHBondContact OD2-CB 3.01Å; D293-S339 PolarHBondContact OD2-N 2.88Å; D293-S339 PolarHBondContact OD2-OG 3.5Å; S339-D341 PolarHBondContact O-N 3.41Å; S339-V342 PolarHBondContact O-N 3.49Å; S339-V342 WeakPolarHBondContact OG-CG2 3.48Å; S339-R343 WeakPolarHBondContact O-CB 3.37Å; S339-R343 PolarHBondContact O-N 2.95Å
340R94.6Very high92.7Very high196 Ų19670.2 Ų70.274%0.7436%0.356SS*.Hα-helixtrans-52.5-39.7179.6-170.2-159.270.5172.6-1.7112.3R343 Q344R340-R343 WeakPolarHBondContact O-CB 3.48Å; R340-R343 PolarHBondContact O-N 2.64Å; R340-Q344 WeakPolarHBondContact O-CB 2.97Å; R340-Q344 PolarHBondContact O-N 3.12Å
341D96Very high92.8Very high82 Ų8271.4 Ų71.444%0.43936%0.361SS..Hα-helixtrans-80.8-33.5-173.1-59-25.8000111.2S339 Q344 M345S339-D341 PolarHBondContact O-N 3.41Å; D341-Q344 PolarHBondContact O-N 2.87Å; D341-M345 WeakPolarHBondContact O-CG 3.24Å; D341-M345 PolarHBondContact O-N 3.23Å
342V97Very high92.8Very high4 Ų471.4 Ų71.42%0.02436%0.359CS..Hα-helixtrans-65.2-42.3167.71730000111.3D293 L296 I297 C338 S339 Q344 M345 L346D293-V342 HydrophobicContact CB-CG2 3.92Å; D293-V342 WeakPolarHBondContact OD2-CG2 3.4Å; L296-V342 HydrophobicContact CB-CG1 3.58Å; L296-V342 HydrophobicContact CD1-CG1 3.74Å; L296-V342 HydrophobicContact CG-CG1 4.31Å; I297-V342 HydrophobicContact CD1-CG2 3.82Å; I297-V342 HydrophobicContact CG1-CG2 3.79Å; C338-V342 HydrophobicContact CB-CB 4.47Å; C338-V342 HydrophobicContact CB-CG1 4.16Å; S339-V342 PolarHBondContact O-N 3.49Å; S339-V342 WeakPolarHBondContact OG-CG2 3.48Å; V342-Q344 VanDerWaalsContact C-N 3.27Å; V342-Q344 PolarHBondContact O-N 2.92Å; V342-M345 WeakPolarHBondContact O-CB 3.46Å; V342-M345 PolarHBondContact O-N 3.44Å; V342-M345 VanDerWaalsContact O-N 3.15Å; V342-L346 HydrophobicContact CG1-CD1 4.35Å; V342-L346 WeakPolarHBondContact O-CG 3.42Å; V342-L346 PolarHBondContact O-N 3.24Å
343R95.8Very high92.9Very high96 Ų9673.2 Ų73.236%0.36237%0.366SS..Hα-helixtrans-56.5-41.9171.8-171.6-176.1-178.17911.7111.3L333 S339 R340 L346 L347L333-R343 HydrophobicContact CD2-CG 3.71Å; L333-R343 PolarHBondContact O-NH1 2.89Å; L333-R343 PolarHBondContact O-NH2 2.77Å; S339-R343 WeakPolarHBondContact O-CB 3.37Å; S339-R343 PolarHBondContact O-N 2.95Å; R340-R343 WeakPolarHBondContact O-CB 3.48Å; R340-R343 PolarHBondContact O-N 2.64Å; R343-L346 PolarHBondContact O-N 3.29Å; R343-L347 WeakPolarHBondContact O-CG 3.5Å; R343-L347 PolarHBondContact O-N 3.46Å
344Q96.9Very high92.9Very high95 Ų9577.1 Ų77.144%0.44439%0.394SS..Hα-helixtrans-69.7-34.3176.9-174.759.686.400113.2R340 D341 V342 K348R340-Q344 WeakPolarHBondContact O-CB 2.97Å; R340-Q344 PolarHBondContact O-N 3.12Å; D341-Q344 PolarHBondContact O-N 2.87Å; V342-Q344 VanDerWaalsContact C-N 3.27Å; V342-Q344 PolarHBondContact O-N 2.92Å; Q344-K348 WeakPolarHBondContact O-CG 3.11Å; Q344-K348 PolarHBondContact O-N 3.11Å; Q344-K348 VanDerWaalsContact O-N 3.09Å
345M97.8Very high93.1Very high83 Ų8373.6 Ų73.641%0.40938%0.382SS..Hα-helixtrans-64.7-43.5172.3-72.4-179.4-160.900111.9I297 V300 D341 V342 K348 L349I297-M345 HydrophobicContact CG1-SD 4.23Å; V300-M345 HydrophobicContact CG1-CB 4.31Å; V300-M345 HydrophobicContact CG2-CB 4.29Å; D341-M345 WeakPolarHBondContact O-CG 3.24Å; D341-M345 PolarHBondContact O-N 3.23Å; V342-M345 WeakPolarHBondContact O-CB 3.46Å; V342-M345 PolarHBondContact O-N 3.44Å; V342-M345 VanDerWaalsContact O-N 3.15Å; M345-K348 PolarHBondContact O-N 3.07Å; M345-L349 PolarHBondContact O-N 2.98Å
346L97.8Very high93.8Very high1 Ų169.8 Ų69.81%0.00536%0.361CS..Hα-helixtrans-65.1-43177.1-69.5172.1000111.8L296 V300 I329 I332 L333 V342 R343 K348 L349 V350L296-L346 HydrophobicContact CD1-CD1 4.23Å; L296-L346 HydrophobicContact CD2-CD1 4.3Å; V300-L346 HydrophobicContact CG2-CD2 3.67Å; V300-L346 HydrophobicContact CG2-CG 4.34Å; I329-L346 HydrophobicContact CG1-CD2 4.42Å; I329-L346 HydrophobicContact CG2-CB 4.14Å; I329-L346 HydrophobicContact CG2-CD2 4Å; I332-L346 HydrophobicContact CG2-CD1 4.07Å; L333-L346 HydrophobicContact CD1-CB 4.25Å; L333-L346 HydrophobicContact CD2-CB 3.83Å; L333-L346 HydrophobicContact CD2-CD1 4.42Å; L333-L346 HydrophobicContact CG-CB 4.13Å; V342-L346 HydrophobicContact CG1-CD1 4.35Å; V342-L346 WeakPolarHBondContact O-CG 3.42Å; V342-L346 PolarHBondContact O-N 3.24Å; R343-L346 PolarHBondContact O-N 3.29Å; L346-K348 PolarHBondContact O-N 3.32Å; L346-L349 WeakPolarHBondContact O-CB 3.49Å; L346-L349 PolarHBondContact O-N 2.87Å; L346-L349 VanDerWaalsContact O-N 3.09Å; L346-V350 PolarHBondContact O-N 3.15Å; L346-V350 VanDerWaalsContact O-N 3.1Å
347L97.4Very high95.2Very high79 Ų7969.8 Ų69.841%0.41436%0.355SS..Hα-helixtrans-57.3-46.9173.2-76.5165.3000111.9L333 R343 L349 V350 E351L333-L347 HydrophobicContact CD1-CD2 3.89Å; L333-L347 HydrophobicContact CD1-CG 4.13Å; L333-L347 HydrophobicContact CD2-CD2 4.36Å; L333-L347 HydrophobicContact CD2-CG 3.95Å; R343-L347 WeakPolarHBondContact O-CG 3.5Å; R343-L347 PolarHBondContact O-N 3.46Å; L347-L349 PolarHBondContact O-N 3.01Å; L347-V350 PolarHBondContact O-N 2.86Å; L347-E351 WeakPolarHBondContact O-CB 3.37Å; L347-E351 PolarHBondContact O-N 3.28Å
348K97.8Very high95.8Very high129 Ų12965.4 Ų65.456%0.56134%0.339SS*.Hα-helixtrans-65.4-22.3176.5-76.2-172172.2-167.50113.7Q344 M345 L346 L352Q344-K348 WeakPolarHBondContact O-CG 3.11Å; Q344-K348 PolarHBondContact O-N 3.11Å; Q344-K348 VanDerWaalsContact O-N 3.09Å; M345-K348 PolarHBondContact O-N 3.07Å; L346-K348 PolarHBondContact O-N 3.32Å; K348-L352 WeakPolarHBondContact O-CB 3.46Å; K348-L352 PolarHBondContact O-N 3.13Å
349L98.1Very high96Very high5 Ų568.6 Ų68.63%0.02635%0.349CS..Hα-helixtrans-78.5-38.9175.8-176.661.5000112V300 L303 K304 I329 M345 L346 L347 L352 R353 W357V300-L349 HydrophobicContact CB-CD2 4.43Å; V300-L349 HydrophobicContact CG2-CD2 3.98Å; L303-L349 HydrophobicContact CB-CD1 3.96Å; L303-L349 HydrophobicContact CB-CD2 3.98Å; L303-L349 HydrophobicContact CD1-CD2 3.84Å; K304-L349 HydrophobicContact CG-CD1 4.19Å; I329-L349 HydrophobicContact CD1-CD2 4.03Å; M345-L349 PolarHBondContact O-N 2.98Å; L346-L349 WeakPolarHBondContact O-CB 3.49Å; L346-L349 PolarHBondContact O-N 2.87Å; L346-L349 VanDerWaalsContact O-N 3.09Å; L347-L349 PolarHBondContact O-N 3.01Å; L349-L352 HydrophobicContact CD1-CD2 4.39Å; L349-L352 PolarHBondContact O-N 3.15Å; L349-R353 PolarHBondContact O-N 2.9Å; L349-W357 HydrophobicContact CD1-CH2 4.46Å; L349-W357 HydrophobicContact CD1-CZ3 3.93Å
350V97.7Very high95.1Very high31 Ų3171.9 Ų71.919%0.18837%0.367CS..Hα-helixtrans-64.8-44.7171.5-179.20000110.2V326 I329 E330 L333 L346 L347 R353 S354V326-V350 HydrophobicContact CG1-CG1 4.27Å; V326-V350 HydrophobicContact CG1-CG2 4.26Å; I329-V350 HydrophobicContact CG2-CG2 3.77Å; E330-V350 HydrophobicContact CG-CG2 4.46Å; L333-V350 HydrophobicContact CD1-CG2 4.28Å; L346-V350 PolarHBondContact O-N 3.15Å; L346-V350 VanDerWaalsContact O-N 3.1Å; L347-V350 PolarHBondContact O-N 2.86Å; V350-R353 PolarHBondContact O-N 2.67Å; V350-S354 WeakPolarHBondContact O-CB 3.13Å; V350-S354 PolarHBondContact O-N 3.02Å
351E97.3Very high93.2Very high115 Ų11566.3 Ų66.354%0.53736%0.358SS..Hα-helixtrans-55.7-50.5172.5-177.4-179.5-159.200111.8L347 R353 S354 S355L347-E351 WeakPolarHBondContact O-CB 3.37Å; L347-E351 PolarHBondContact O-N 3.28Å; E351-R353 PolarHBondContact O-N 2.88Å; E351-S354 PolarHBondContact O-N 2.99Å; E351-S354 VanDerWaalsContact O-N 3.14Å; E351-S354 PolarHBondContact O-OG 2.91Å; E351-S355 PolarHBondContact O-N 3.33Å; E351-S355 PolarHBondContact O-OG 2.89Å
352L97.2Very high91.2Very high48 Ų4865.9 Ų65.925%0.25137%0.366SS..Hα-helixtrans-56.5-47.1177.5178.562.3000112K304 K348 L349 S355 W357K304-L352 HydrophobicContact CG-CD2 4.16Å; K348-L352 WeakPolarHBondContact O-CB 3.46Å; K348-L352 PolarHBondContact O-N 3.13Å; L349-L352 HydrophobicContact CD1-CD2 4.39Å; L349-L352 PolarHBondContact O-N 3.15Å; L352-S355 CarbonylContact O-C 3.44Å; L352-S355 PolarHBondContact O-N 2.87Å; L352-W357 VanDerWaalsContact CD1-C 3.5Å; L352-W357 HydrophobicContact CD2-CE3 4.05Å; L352-W357 HydrophobicContact CD2-CZ3 4.4Å; L352-W357 HydrophobicContact CG-CE3 4.03Å; L352-W357 VanDerWaalsContact O-CA 3.22Å; L352-W357 WeakPolarHBondContact O-CA 3.18Å; L352-W357 PolarHBondContact O-N 3.41Å
353R95.9Very high89.1Confident44 Ų4469.8 Ų69.817%0.16640%0.399CS..Hα-helixtrans-63.5-42.4175.9-175.3-173.2-179.7-135.80.5112D311 E323 V326 L349 V350 E351 S355 D356 W357D311-R353 IonicContact OD1-NH2 3.51Å; D311-R353 PolarHBondContact OD1-NH2 3.07Å; D311-R353 IonicContact OD2-NE 2.83Å; E323-R353 VanDerWaalsContact CD-NH2 3.3Å; E323-R353 IonicContact OE1-CZ 3.72Å; E323-R353 IonicContact OE1-NH2 3.83Å; E323-R353 PolarHBondContact OE1-NH2 3.36Å; E323-R353 IonicContact OE2-NH2 2.68Å; V326-R353 VanDerWaalsContact CG2-CD 3.49Å; L349-R353 PolarHBondContact O-N 2.9Å; V350-R353 PolarHBondContact O-N 2.67Å; E351-R353 PolarHBondContact O-N 2.88Å; R353-S355 PolarHBondContact O-N 3Å; R353-D356 PolarHBondContact O-N 2.86Å; R353-W357 HydrophobicContact CB-CH2 4.22Å; R353-W357 HydrophobicContact CB-CZ2 3.91Å; R353-W357 HydrophobicContact CG-CH2 4.45Å; R353-W357 HydrophobicContact CG-CZ2 3.7Å
354S95.4Very high86.9Confident96 Ų9667.7 Ų67.767%0.67140%0.402SS*.Hα-helixtrans-62.2-26.1-18074.60000112.8V350 E351 D356V350-S354 WeakPolarHBondContact O-CB 3.13Å; V350-S354 PolarHBondContact O-N 3.02Å; E351-S354 PolarHBondContact O-N 2.99Å; E351-S354 VanDerWaalsContact O-N 3.14Å; E351-S354 PolarHBondContact O-OG 2.91Å; S354-D356 VanDerWaalsContact C-N 3.3Å; S354-D356 PolarHBondContact O-N 3.46Å
355S95.2Very high84.4Confident71 Ų7167 Ų6750%0.49740%0.404SS..THydrogen-bonded Turntrans-94.131.8174.3-58.70000112.6E351 L352 R353 W357 G358E351-S355 PolarHBondContact O-N 3.33Å; E351-S355 PolarHBondContact O-OG 2.89Å; L352-S355 CarbonylContact O-C 3.44Å; L352-S355 PolarHBondContact O-N 2.87Å; R353-S355 PolarHBondContact O-N 3Å; S355-W357 VanDerWaalsContact C-N 3.28Å; S355-W357 PolarHBondContact O-N 2.9Å; S355-G358 WeakPolarHBondContact O-CA 3.15Å; S355-G358 PolarHBondContact O-N 3.49Å
356D94.8Very high82.1Confident49 Ų4966.8 Ų66.826%0.26242%0.416SS..G310 helixtrans42.849-174.8-167.650.1000113.9R353 S354 G358 R359R353-D356 PolarHBondContact O-N 2.86Å; S354-D356 VanDerWaalsContact C-N 3.3Å; S354-D356 PolarHBondContact O-N 3.46Å; D356-G358 PolarHBondContact O-N 3.5Å; D356-G358 VanDerWaalsContact O-N 3.15Å; D356-R359 VanDerWaalsContact CG-NH2 3.33Å; D356-R359 VanDerWaalsContact O-CB 3.28Å; D356-R359 WeakPolarHBondContact O-CB 3.19Å; D356-R359 VanDerWaalsContact O-CG 3.29Å; D356-R359 WeakPolarHBondContact O-CG 3.21Å; D356-R359 PolarHBondContact O-N 3.18Å; D356-R359 PolarHBondContact O-NE 3.49Å; D356-R359 IonicContact OD1-CZ 2.79Å; D356-R359 IonicContact OD1-NE 3.01Å; D356-R359 IonicContact OD1-NH2 3.17Å; D356-R359 PolarHBondContact OD1-NH2 2.96Å; D356-R359 IonicContact OD2-CZ 3.88Å; D356-R359 IonicContact OD2-NE 3.78Å; D356-R359 PolarHBondContact OD2-NE 3.16Å; D356-R359 IonicContact OD2-NH2 2.66Å; D356-R359 PolarHBondContact OD2-NH2 3.03Å
357W96.4Very high79.8Confident29 Ų2970.4 Ų70.411%0.1144%0.441CS..G310 helixtrans60.422-178.9-53.290.9000114.7L303 D311 M322 L349 L352 R353 S355L303-W357 HydrophobicContact CD2-CH2 4.34Å; L303-W357 VanDerWaalsContact O-CZ3 3.31Å; L303-W357 WeakPolarHBondContact O-CZ3 3.34Å; D311-W357 HydrophobicContact CB-CZ2 4.36Å; D311-W357 PolarHBondContact OD2-NE1 3.37Å; M322-W357 HydrophobicContact CE-CH2 4.23Å; M322-W357 HydrophobicContact CE-CZ2 3.79Å; M322-W357 HydrophobicContact CG-CZ2 4.14Å; M322-W357 HydrophobicContact SD-CH2 4.21Å; M322-W357 HydrophobicContact SD-CZ2 3.9Å; L349-W357 HydrophobicContact CD1-CH2 4.46Å; L349-W357 HydrophobicContact CD1-CZ3 3.93Å; L352-W357 VanDerWaalsContact CD1-C 3.5Å; L352-W357 HydrophobicContact CD2-CE3 4.05Å; L352-W357 HydrophobicContact CD2-CZ3 4.4Å; L352-W357 HydrophobicContact CG-CE3 4.03Å; L352-W357 VanDerWaalsContact O-CA 3.22Å; L352-W357 WeakPolarHBondContact O-CA 3.18Å; L352-W357 PolarHBondContact O-N 3.41Å; R353-W357 HydrophobicContact CB-CH2 4.22Å; R353-W357 HydrophobicContact CB-CZ2 3.91Å; R353-W357 HydrophobicContact CG-CH2 4.45Å; R353-W357 HydrophobicContact CG-CZ2 3.7Å; S355-W357 VanDerWaalsContact C-N 3.28Å; S355-W357 PolarHBondContact O-N 2.9Å
358G90.9Very high77.5Confident54 Ų5472.6 Ų72.656%0.55745%0.453SS*.G310 helixtrans83.89-176.300000114S355 D356 V360S355-G358 WeakPolarHBondContact O-CA 3.15Å; S355-G358 PolarHBondContact O-N 3.49Å; D356-G358 PolarHBondContact O-N 3.5Å; D356-G358 VanDerWaalsContact O-N 3.15Å; G358-V360 PolarHBondContact O-N 3.46Å
359R91.4Very high74.9Confident82 Ų8269.5 Ų69.531%0.30945%0.451SS..  trans-76.8117.2179.3-62.9-176.1-68.4-153.64.4110.7D312 D356 S361D312-R359 VanDerWaalsContact CG-NH1 3.3Å; D312-R359 IonicContact OD1-CZ 2.62Å; D312-R359 IonicContact OD1-NH1 3.91Å; D312-R359 PolarHBondContact OD1-NH1 2.76Å; D312-R359 IonicContact OD1-NH2 3.36Å; D312-R359 PolarHBondContact OD1-NH2 3.02Å; D312-R359 IonicContact OD2-CZ 2.78Å; D312-R359 IonicContact OD2-NH1 2.64Å; D312-R359 PolarHBondContact OD2-NH1 3.02Å; D312-R359 IonicContact OD2-NH2 3.32Å; D356-R359 VanDerWaalsContact CG-NH2 3.33Å; D356-R359 VanDerWaalsContact O-CB 3.28Å; D356-R359 WeakPolarHBondContact O-CB 3.19Å; D356-R359 VanDerWaalsContact O-CG 3.29Å; D356-R359 WeakPolarHBondContact O-CG 3.21Å; D356-R359 PolarHBondContact O-N 3.18Å; D356-R359 PolarHBondContact O-NE 3.49Å; D356-R359 IonicContact OD1-CZ 2.79Å; D356-R359 IonicContact OD1-NE 3.01Å; D356-R359 IonicContact OD1-NH2 3.17Å; D356-R359 PolarHBondContact OD1-NH2 2.96Å; D356-R359 IonicContact OD2-CZ 3.88Å; D356-R359 IonicContact OD2-NE 3.78Å; D356-R359 PolarHBondContact OD2-NE 3.16Å; D356-R359 IonicContact OD2-NH2 2.66Å; D356-R359 PolarHBondContact OD2-NH2 3.03Å; R359-S361 PolarHBondContact O-N 3.17Å; R359-S361 VanDerWaalsContact O-N 3.12Å
360V75.1Confident72.3Confident120 Ų12073.8 Ų73.873%0.72748%0.478SS*.  trans-69110171.5-177.20000108.7G358 A362G358-V360 PolarHBondContact O-N 3.46Å; V360-A362 PolarHBondContact O-N 2.9Å
361S55.8Low69.9Low79 Ų7975.8 Ų75.855%0.55249%0.491SS*.  trans-65.994.1172.8-81.60000110.5R359 A363 A364R359-S361 PolarHBondContact O-N 3.17Å; R359-S361 VanDerWaalsContact O-N 3.12Å; S361-A363 PolarHBondContact O-N 2.9Å; S361-A364 PolarHBondContact O-N 2.74Å
362A54.4Low67.7Low74 Ų7477.7 Ų77.761%0.61251%0.505SS*.Hα-helixtrans-52.1-29-175.500000114.3V360 A364 T365 A366V360-A362 PolarHBondContact O-N 2.9Å; A362-A364 VanDerWaalsContact C-N 3.26Å; A362-A364 PolarHBondContact O-N 3.28Å; A362-T365 PolarHBondContact O-N 2.65Å; A362-A366 PolarHBondContact O-N 3.16Å; A362-A366 VanDerWaalsContact O-N 3.09Å
363A52.1Low65.5Low86 Ų8682.9 Ų82.971%0.71153%0.533SS*.Hα-helixtrans-59.6-31.4174.700000113.9S361S361-A363 PolarHBondContact O-N 2.9Å
364A50.4Low63.3Low52 Ų5284.8 Ų84.843%0.4355%0.547SS..Hα-helixtrans-84-27.6178.600000112.8S361 A362 S367 N368S361-A364 PolarHBondContact O-N 2.74Å; A362-A364 VanDerWaalsContact C-N 3.26Å; A362-A364 PolarHBondContact O-N 3.28Å; A364-S367 PolarHBondContact O-OG 3.22Å; A364-S367 VanDerWaalsContact O-OG 3.06Å; A364-N368 WeakPolarHBondContact O-CB 3.3Å; A364-N368 PolarHBondContact O-ND2 3.3Å; A364-N368 PolarHBondContact O-OD1 2.83Å
365T44.7Very low61.3Low81 Ų8186.3 Ų86.350%0.49755%0.554SS.*Hα-helixtrans-72.2-41.8174.4-42.40000110.4A362 S367 N368 A369A362-T365 PolarHBondContact O-N 2.65Å; T365-S367 VanDerWaalsContact C-N 3.3Å; T365-S367 PolarHBondContact O-N 3.13Å; T365-N368 PolarHBondContact O-N 3.15Å; T365-A369 PolarHBondContact O-N 3.33Å; T365-A369 VanDerWaalsContact O-N 3.15Å
366A48Very low59.4Low78 Ų7889.9 Ų89.965%0.64557%0.568SS**Hα-helixtrans-65.1-27.5178.600000114.1A362A362-A366 PolarHBondContact O-N 3.16Å; A362-A366 VanDerWaalsContact O-N 3.09Å
367S50.6Low57.3Low77 Ų7793.5 Ų93.554%0.53858%0.579SS.*Hα-helixtrans-81.3-17.8175.360.20000114.2A364 T365A364-S367 PolarHBondContact O-OG 3.22Å; A364-S367 VanDerWaalsContact O-OG 3.06Å; T365-S367 VanDerWaalsContact C-N 3.3Å; T365-S367 PolarHBondContact O-N 3.13Å
368N49.4Very low55Low125 Ų125101.1 Ų101.167%0.66861%0.613SS**Hα-helixtrans-113.7-5.8-168.5-63.58.9000113.2A364 T365 T370A364-N368 WeakPolarHBondContact O-CB 3.3Å; A364-N368 PolarHBondContact O-ND2 3.3Å; A364-N368 PolarHBondContact O-OD1 2.83Å; T365-N368 PolarHBondContact O-N 3.15Å; N368-T370 VanDerWaalsContact C-N 3.31Å; N368-T370 PolarHBondContact O-N 2.9Å
369A42.8Very low53.3Low63 Ų63103.5 Ų103.552%0.52161%0.611SS.*SBendtrans-76.2-12.6-177.600000114.5T365T365-A369 PolarHBondContact O-N 3.33Å; T365-A369 VanDerWaalsContact O-N 3.15Å
370T42.2Very low51.4Low96 Ų96107.7 Ų107.759%0.58964%0.64SS**  trans-129.391.6178.251.70000111.1N368 D372N368-T370 VanDerWaalsContact C-N 3.31Å; N368-T370 PolarHBondContact O-N 2.9Å; T370-D372 PolarHBondContact O-N 2.73Å
371P48.5Very low50.7Low72 Ų72106.6 Ų106.647%0.46863%0.627SS.*  trans-69.784.315930.7-32.1000108.1N373 D374 Y377P371-N373 PolarHBondContact O-N 2.76Å; P371-D374 PolarHBondContact O-N 2.87Å; P371-Y377 HydrophobicContact CG-CD2 4.42Å; P371-Y377 HydrophobicContact CG-CE2 4.5Å
372D51.6Low51Low156 Ų156107 Ų10783%0.83463%0.627SS**THydrogen-bonded Turntrans-67.222.8-166.7-149.326.7000114.8T370T370-D372 PolarHBondContact O-N 2.73Å
373N51.1Low51.9Low156 Ų156106.6 Ų106.683%0.83462%0.617SS**THydrogen-bonded Turntrans-163.226.6-173.1-16030.2000114.8P371 P375P371-N373 PolarHBondContact O-N 2.76Å; N373-P375 WeakPolarHBondContact O-CD 3.2Å
374D49.2Very low53.1Low85 Ų85105.2 Ų105.246%0.45560%0.595SS.*  trans-102.4105.4168.9-171.3-10.5000111.1P371 N376 Y377P371-D374 PolarHBondContact O-N 2.87Å; D374-N376 PolarHBondContact O-N 3.24Å; D374-N376 WeakPolarHBondContact OD1-CB 3.45Å; D374-N376 PolarHBondContact OD1-N 2.94Å; D374-Y377 VanDerWaalsContact O-CB 3.31Å; D374-Y377 WeakPolarHBondContact O-CB 3.5Å; D374-Y377 PolarHBondContact O-N 3.02Å
375P53.8Low54.6Low127 Ų127109.7 Ų109.783%0.82560%0.602SS**THydrogen-bonded Turntrans-70.9-5.4-179.931-36.2000114.1N373N373-P375 WeakPolarHBondContact O-CD 3.2Å
376N53.6Low56Low147 Ų147107.1 Ų107.179%0.78659%0.586SS**THydrogen-bonded Turntrans-96.14.5169.8-86.1-19.9000113.1D374 F378D374-N376 PolarHBondContact O-N 3.24Å; D374-N376 WeakPolarHBondContact OD1-CB 3.45Å; D374-N376 PolarHBondContact OD1-N 2.94Å; N376-F378 PolarHBondContact O-N 3.28Å
377Y52.3Low57.2Low124 Ų124111 Ų11149%0.48659%0.591SS.*  trans-75.962.3176.9-162.9-103.7000112P371 D374 M379P371-Y377 HydrophobicContact CG-CD2 4.42Å; P371-Y377 HydrophobicContact CG-CE2 4.5Å; D374-Y377 VanDerWaalsContact O-CB 3.31Å; D374-Y377 WeakPolarHBondContact O-CB 3.5Å; D374-Y377 PolarHBondContact O-N 3.02Å; Y377-M379 HydrophobicContact CD1-CG 4.18Å; Y377-M379 HydrophobicContact CE1-CE 3.84Å; Y377-M379 HydrophobicContact CE1-CG 3.76Å; Y377-M379 HydrophobicContact CE1-SD 3.57Å; Y377-M379 VanDerWaalsContact CE1-SD 3.57Å; Y377-M379 PolarHBondContact O-N 3.43Å; Y377-M379 VanDerWaalsContact O-N 3.14Å
378F47.3Very low58.5Low189 Ų189113.1 Ų113.183%0.82960%0.596SS**  trans-70.1104169-140-86.2000107.5N376N376-F378 PolarHBondContact O-N 3.28Å
379M56.3Low59.7Low104 Ų104109.3 Ų109.351%0.51259%0.587SS.*  trans-59.1152.3-179.1-91.7-71.3-144.600111.5Y377 E381Y377-M379 HydrophobicContact CD1-CG 4.18Å; Y377-M379 HydrophobicContact CE1-CE 3.84Å; Y377-M379 HydrophobicContact CE1-CG 3.76Å; Y377-M379 HydrophobicContact CE1-SD 3.57Å; Y377-M379 VanDerWaalsContact CE1-SD 3.57Å; Y377-M379 PolarHBondContact O-N 3.43Å; Y377-M379 VanDerWaalsContact O-N 3.14Å; M379-E381 HydrophobicContact CB-CG 3.62Å; M379-E381 PolarHBondContact O-N 3.31Å
380N51.5Low61.5Low171 Ų171109.8 Ų109.891%0.91458%0.583SS**  trans-75.659.2164.8-65.4-53.9000109.8
381E58.8Low63.2Low97 Ų97108.6 Ų108.645%0.45358%0.577SS.*  trans-68.4138.2174.6-61.3-172.3153.900109.7M379 T383 A394M379-E381 HydrophobicContact CB-CG 3.62Å; M379-E381 PolarHBondContact O-N 3.31Å; E381-T383 PolarHBondContact O-N 2.88Å; E381-A394 VanDerWaalsContact OE2-CB 3.26Å; E381-A394 WeakPolarHBondContact OE2-CB 3.42Å
382P62.4Low64.7Low86 Ų86105.5 Ų105.556%0.55856%0.557SS**  trans-61123.4174-19.631.6000110.1F384P382-F384 HydrophobicContact CB-CD2 4.33Å; P382-F384 HydrophobicContact CB-CE2 3.76Å; P382-F384 HydrophobicContact CB-CZ 3.95Å; P382-F384 HydrophobicContact CG-CE2 4.32Å; P382-F384 HydrophobicContact CG-CZ 4.4Å; P382-F384 WeakPolarHBondContact O-CD2 3.36Å; P382-F384 WeakPolarHBondContact O-CE2 3.36Å; P382-F384 PolarHBondContact O-N 2.87Å
383T72.9Confident66.1Low66 Ų66100.1 Ų100.141%0.40553%0.529SS..  trans-74.1111.4165.6-53.90000107.8E381 Y385 P391 T393E381-T383 PolarHBondContact O-N 2.88Å; T383-Y385 HydrophobicContact CG2-CE2 4.29Å; T383-P391 HydrophobicContact CG2-CB 3.46Å; T383-P391 VanDerWaalsContact CG2-CB 3.46Å; T383-T393 HydrophobicContact CG2-CG2 4.25Å
384F77.8Confident67.2Low58 Ų5895 Ų9525%0.25451%0.509SS..EExtended strand (participates in β ladder)trans-85159.5173-66.8-88.7000109.5P382 P391 F392 Y399 Y403 L406P382-F384 HydrophobicContact CB-CD2 4.33Å; P382-F384 HydrophobicContact CB-CE2 3.76Å; P382-F384 HydrophobicContact CB-CZ 3.95Å; P382-F384 HydrophobicContact CG-CE2 4.32Å; P382-F384 HydrophobicContact CG-CZ 4.4Å; P382-F384 WeakPolarHBondContact O-CD2 3.36Å; P382-F384 WeakPolarHBondContact O-CE2 3.36Å; P382-F384 PolarHBondContact O-N 2.87Å; F384-P391 CarbonylContact O-C 3.37Å; F384-P391 VanDerWaalsContact O-CA 3.3Å; F384-P391 WeakPolarHBondContact O-CA 3.46Å; F384-F392 HydrophobicContact CB-CD1 3.96Å; F384-F392 HydrophobicContact CB-CE1 3.44Å; F384-F392 VanDerWaalsContact CB-CE1 3.44Å; F384-F392 HydrophobicContact CB-CE2 4.19Å; F384-F392 HydrophobicContact CB-CZ 3.56Å; F384-F392 HydrophobicContact CG-CZ 4.41Å; F384-F392 PolarHBondContact N-O 3.38Å; F384-F392 WeakPolarHBondContact O-CD1 3.45Å; F384-F392 PolarHBondContact O-N 3.45Å; F384-Y399 AromaticContact CD2-CE2 3.92Å; F384-Y399 HydrophobicContact CD2-CE2 3.92Å; F384-Y399 HydrophobicContact CE2-CE2 4.3Å; F384-Y399 WeakPolarHBondContact CE2-OH 3.29Å; F384-Y403 HydrophobicContact CE1-CD2 4.5Å; F384-Y403 HydrophobicContact CE1-CE2 4.19Å; F384-Y403 HydrophobicContact CE2-CD2 4.26Å; F384-Y403 HydrophobicContact CE2-CE2 4.17Å; F384-Y403 HydrophobicContact CZ-CD2 4.21Å; F384-Y403 AromaticContact CZ-CE2 3.77Å; F384-Y403 HydrophobicContact CZ-CE2 3.77Å; F384-L406 HydrophobicContact CB-CD1 4.41Å; F384-L406 HydrophobicContact CD1-CD1 4.18Å
385Y81.6Confident68.3Low145 Ų14594.8 Ų94.857%0.56952%0.519SS*.EExtended strand (participates in β ladder)trans-122.9138.9177.8-66-96.1000109.2T383 G389 P391T383-Y385 HydrophobicContact CG2-CE2 4.29Å; Y385-G389 WeakPolarHBondContact CD1-O 3.49Å; Y385-P391 HydrophobicContact CD1-CB 4Å; Y385-P391 HydrophobicContact CE1-CB 3.71Å; Y385-P391 HydrophobicContact CE1-CG 4.31Å
386T75.3Confident69.5Low28 Ų2892 Ų9217%0.17250%0.497CS..  trans-75.6170.6168.847.10000110.7D388 G389 T390 F392 K402T386-D388 VanDerWaalsContact C-N 3.25Å; T386-D388 VanDerWaalsContact CB-OD1 3.32Å; T386-D388 WeakPolarHBondContact CB-OD1 3.26Å; T386-D388 PolarHBondContact O-N 2.58Å; T386-D388 PolarHBondContact OG1-OD1 2.87Å; T386-G389 WeakPolarHBondContact O-CA 3.48Å; T386-G389 PolarHBondContact O-N 2.76Å; T386-T390 PolarHBondContact N-O 3.47Å; T386-T390 WeakPolarHBondContact OG1-CA 3.21Å; T386-T390 VanDerWaalsContact OG1-CB 3.32Å; T386-T390 WeakPolarHBondContact OG1-CB 3.36Å; T386-T390 PolarHBondContact OG1-N 3.39Å; T386-T390 VanDerWaalsContact OG1-N 3.13Å; T386-T390 PolarHBondContact OG1-O 3.46Å; T386-F392 HydrophobicContact CG2-CD1 3.89Å; T386-F392 HydrophobicContact CG2-CE1 4.06Å; T386-K402 HydrophobicContact CG2-CD 4.01Å
387E71.8Confident70.6Confident158 Ų15891.4 Ų91.474%0.73850%0.501SS*.THydrogen-bonded Turntrans-61.8-31.4-177.9-54.5-156.5119.300113.7G389 R409E387-G389 PolarHBondContact O-N 3.38Å; E387-R409 IonicContact OE1-CZ 2.64Å; E387-R409 IonicContact OE1-NH1 2.65Å; E387-R409 PolarHBondContact OE1-NH1 3.08Å; E387-R409 IonicContact OE1-NH2 2.7Å; E387-R409 PolarHBondContact OE1-NH2 3.29Å
388D78.1Confident71.7Confident122 Ų12290.6 Ų90.665%0.65250%0.502SS*.THydrogen-bonded Turntrans-77.71.2173.959.2-72.6000113.6T386 T390T386-D388 VanDerWaalsContact C-N 3.25Å; T386-D388 VanDerWaalsContact CB-OD1 3.32Å; T386-D388 WeakPolarHBondContact CB-OD1 3.26Å; T386-D388 PolarHBondContact O-N 2.58Å; T386-D388 PolarHBondContact OG1-OD1 2.87Å; D388-T390 VanDerWaalsContact OD2-CB 3.23Å; D388-T390 WeakPolarHBondContact OD2-CB 3.46Å; D388-T390 PolarHBondContact OD2-OG1 2.92Å
389G75Confident73.2Confident45 Ų4584.1 Ų84.146%0.46447%0.472SS..  trans79.712.3-179.800000114.3Y385 T386 E387 P391Y385-G389 WeakPolarHBondContact CD1-O 3.49Å; T386-G389 WeakPolarHBondContact O-CA 3.48Å; T386-G389 PolarHBondContact O-N 2.76Å; E387-G389 PolarHBondContact O-N 3.38Å; G389-P391 WeakPolarHBondContact O-CD 3.49Å
390T80.7Confident74.2Confident73 Ų7382.6 Ų82.645%0.44848%0.476SS..  trans-77.1122.9174.4-64.60000110.3T386 D388T386-T390 PolarHBondContact N-O 3.47Å; T386-T390 WeakPolarHBondContact OG1-CA 3.21Å; T386-T390 VanDerWaalsContact OG1-CB 3.32Å; T386-T390 WeakPolarHBondContact OG1-CB 3.36Å; T386-T390 PolarHBondContact OG1-N 3.39Å; T386-T390 VanDerWaalsContact OG1-N 3.13Å; T386-T390 PolarHBondContact OG1-O 3.46Å; D388-T390 VanDerWaalsContact OD2-CB 3.23Å; D388-T390 WeakPolarHBondContact OD2-CB 3.46Å; D388-T390 PolarHBondContact OD2-OG1 2.92Å
391P78.4Confident75.5Confident72 Ų7281.9 Ų81.947%0.46847%0.468SS..EExtended strand (participates in β ladder)trans-69.8144.2176.627.3-33.5000112.1T383 F384 Y385 G389T383-P391 HydrophobicContact CG2-CB 3.46Å; T383-P391 VanDerWaalsContact CG2-CB 3.46Å; F384-P391 CarbonylContact O-C 3.37Å; F384-P391 VanDerWaalsContact O-CA 3.3Å; F384-P391 WeakPolarHBondContact O-CA 3.46Å; Y385-P391 HydrophobicContact CD1-CB 4Å; Y385-P391 HydrophobicContact CE1-CB 3.71Å; Y385-P391 HydrophobicContact CE1-CG 4.31Å; G389-P391 WeakPolarHBondContact O-CD 3.49Å
392F79.4Confident76.4Confident7 Ų780 Ų803%0.03146%0.458CS..EExtended strand (participates in β ladder)trans-141.9156.117274.3-77.3000112F384 T386 D396 Y399 K402 L406F384-F392 HydrophobicContact CB-CD1 3.96Å; F384-F392 HydrophobicContact CB-CE1 3.44Å; F384-F392 VanDerWaalsContact CB-CE1 3.44Å; F384-F392 HydrophobicContact CB-CE2 4.19Å; F384-F392 HydrophobicContact CB-CZ 3.56Å; F384-F392 HydrophobicContact CG-CZ 4.41Å; F384-F392 PolarHBondContact N-O 3.38Å; F384-F392 WeakPolarHBondContact O-CD1 3.45Å; F384-F392 PolarHBondContact O-N 3.45Å; T386-F392 HydrophobicContact CG2-CD1 3.89Å; T386-F392 HydrophobicContact CG2-CE1 4.06Å; F392-D396 WeakPolarHBondContact CA-OD2 3.49Å; F392-Y399 AromaticContact CD2-CD2 3.56Å; F392-Y399 HydrophobicContact CD2-CD2 3.56Å; F392-Y399 HydrophobicContact CD2-CE2 4.26Å; F392-Y399 HydrophobicContact CD2-CG 4.32Å; F392-Y399 AromaticContact CE2-CD2 3.71Å; F392-Y399 HydrophobicContact CE2-CD2 3.71Å; F392-Y399 HydrophobicContact CE2-CE2 4.11Å; F392-Y399 HydrophobicContact CE2-CG 4.4Å; F392-K402 HydrophobicContact CD2-CB 4.07Å; F392-K402 HydrophobicContact CD2-CD 4.29Å; F392-K402 HydrophobicContact CE1-CB 4.27Å; F392-K402 HydrophobicContact CE2-CB 3.48Å; F392-K402 VanDerWaalsContact CE2-CB 3.48Å; F392-K402 HydrophobicContact CG-CD 4.37Å; F392-K402 HydrophobicContact CZ-CB 3.59Å; F392-L406 HydrophobicContact CE1-CD1 4.24Å; F392-L406 HydrophobicContact CZ-CD1 3.86Å
393T80.5Confident77.2Confident42 Ų4280.3 Ų80.326%0.25845%0.448SS..  trans-144.5166-166.462.90000110.6T383 A395 D396 Y399T383-T393 HydrophobicContact CG2-CG2 4.25Å; T393-A395 PolarHBondContact O-N 2.89Å; T393-D396 PolarHBondContact N-OD2 3.17Å; T393-D396 WeakPolarHBondContact O-CB 3.31Å; T393-D396 PolarHBondContact O-N 3.04Å; T393-D396 PolarHBondContact OG1-OD2 3.11Å; T393-Y399 WeakPolarHBondContact O-CB 3.44Å; T393-Y399 WeakPolarHBondContact O-CD2 3.49Å
394A74.9Confident77.5Confident50 Ų5082.3 Ų82.341%0.41345%0.453SS..THydrogen-bonded Turntrans-69.1-3.8-178.700000114.2E381 D396 Y399E381-A394 VanDerWaalsContact OE2-CB 3.26Å; E381-A394 WeakPolarHBondContact OE2-CB 3.42Å; A394-D396 VanDerWaalsContact C-N 3.35Å; A394-Y399 HydrophobicContact CB-CD1 4.22Å; A394-Y399 HydrophobicContact CB-CD2 4.42Å; A394-Y399 HydrophobicContact CB-CE1 4.27Å; A394-Y399 HydrophobicContact CB-CE2 4.44Å; A394-Y399 HydrophobicContact CB-CG 4.32Å
395A71.3Confident77.6Confident80 Ų8085.9 Ų85.966%0.66147%0.471SS*.THydrogen-bonded Turntrans-78.4-16.416800000113.4T393T393-A395 PolarHBondContact O-N 2.89Å
396D79Confident77.3Confident68 Ų6881.5 Ų81.536%0.36446%0.457SS..SBendtrans-84131.1-177.7-64.2-68.3000111.2F392 T393 A394 E398 Y399F392-D396 WeakPolarHBondContact CA-OD2 3.49Å; T393-D396 PolarHBondContact N-OD2 3.17Å; T393-D396 WeakPolarHBondContact O-CB 3.31Å; T393-D396 PolarHBondContact O-N 3.04Å; T393-D396 PolarHBondContact OG1-OD2 3.11Å; A394-D396 VanDerWaalsContact C-N 3.35Å; D396-E398 PolarHBondContact O-N 3.04Å; D396-Y399 VanDerWaalsContact O-CB 3.27Å; D396-Y399 WeakPolarHBondContact O-CB 3.24Å; D396-Y399 PolarHBondContact O-N 3.16Å
397P77.4Confident77.3Confident134 Ų13483.7 Ų83.787%0.8747%0.467SS*.THydrogen-bonded Turntrans-58.4-22.5-176.8-26.534.9000115.2
398E74.9Confident77.4Confident108 Ų10881.7 Ų81.751%0.50546%0.458SS..THydrogen-bonded Turntrans-94.5-2.6-176.5-62.4163.9-169.300112.5D396 A400 E401 K402D396-E398 PolarHBondContact O-N 3.04Å; E398-A400 VanDerWaalsContact C-N 3.34Å; E398-A400 PolarHBondContact O-N 3.16Å; E398-E401 PolarHBondContact O-N 3.05Å; E398-K402 HydrophobicContact CB-CD 4.14Å; E398-K402 PolarHBondContact O-N 3.16Å; E398-K402 VanDerWaalsContact O-N 3.1Å; E398-K402 WeakPolarHBondContact OE2-CE 3.39Å; E398-K402 IonicContact OE2-NZ 3.65Å; E398-K402 PolarHBondContact OE2-NZ 2.77Å
399Y80.2Confident77Confident52 Ų5281.7 Ų81.720%0.20445%0.449CS..Hα-helixtrans-55.3-45.1-172.5176.2-90.3000113.1F384 F392 T393 A394 D396 E401 K402 Y403F384-Y399 AromaticContact CD2-CE2 3.92Å; F384-Y399 HydrophobicContact CD2-CE2 3.92Å; F384-Y399 HydrophobicContact CE2-CE2 4.3Å; F384-Y399 WeakPolarHBondContact CE2-OH 3.29Å; F392-Y399 AromaticContact CD2-CD2 3.56Å; F392-Y399 HydrophobicContact CD2-CD2 3.56Å; F392-Y399 HydrophobicContact CD2-CE2 4.26Å; F392-Y399 HydrophobicContact CD2-CG 4.32Å; F392-Y399 AromaticContact CE2-CD2 3.71Å; F392-Y399 HydrophobicContact CE2-CD2 3.71Å; F392-Y399 HydrophobicContact CE2-CE2 4.11Å; F392-Y399 HydrophobicContact CE2-CG 4.4Å; T393-Y399 WeakPolarHBondContact O-CB 3.44Å; T393-Y399 WeakPolarHBondContact O-CD2 3.49Å; A394-Y399 HydrophobicContact CB-CD1 4.22Å; A394-Y399 HydrophobicContact CB-CD2 4.42Å; A394-Y399 HydrophobicContact CB-CE1 4.27Å; A394-Y399 HydrophobicContact CB-CE2 4.44Å; A394-Y399 HydrophobicContact CB-CG 4.32Å; D396-Y399 VanDerWaalsContact O-CB 3.27Å; D396-Y399 WeakPolarHBondContact O-CB 3.24Å; D396-Y399 PolarHBondContact O-N 3.16Å; Y399-E401 VanDerWaalsContact C-N 3.31Å; Y399-E401 PolarHBondContact O-N 2.79Å; Y399-K402 PolarHBondContact O-N 3.42Å; Y399-Y403 HydrophobicContact CE1-CG 4.24Å; Y399-Y403 WeakPolarHBondContact O-CB 3.36Å; Y399-Y403 PolarHBondContact O-N 3.19Å
400A75.8Confident76.2Confident73 Ų7386.2 Ų86.260%0.60346%0.458SS*.Hα-helixtrans-64.6-35.8-176.900000112.7E398 Q404E398-A400 VanDerWaalsContact C-N 3.34Å; E398-A400 PolarHBondContact O-N 3.16Å; A400-Q404 VanDerWaalsContact O-CB 3.32Å; A400-Q404 WeakPolarHBondContact O-CB 3.48Å; A400-Q404 PolarHBondContact O-N 3.28Å; A400-Q404 VanDerWaalsContact O-N 3.12Å
401E80.2Confident74.9Confident156 Ų15688.2 Ų88.273%0.72947%0.466SS*.Hα-helixtrans-73.4-48179.7-168.4165.2-154.200110.4E398 Y399 Y403 Q404 E405E398-E401 PolarHBondContact O-N 3.05Å; Y399-E401 VanDerWaalsContact C-N 3.31Å; Y399-E401 PolarHBondContact O-N 2.79Å; E401-Y403 PolarHBondContact O-N 3.23Å; E401-Q404 PolarHBondContact O-N 3.23Å; E401-E405 PolarHBondContact O-N 3.28Å
402K77.4Confident73.5Confident57 Ų5794.6 Ų94.625%0.24848%0.482CS..Hα-helixtrans-66.1-34.5176.6-71.8170.4169.8169.10113.4T386 F392 E398 Y399 L406T386-K402 HydrophobicContact CG2-CD 4.01Å; F392-K402 HydrophobicContact CD2-CB 4.07Å; F392-K402 HydrophobicContact CD2-CD 4.29Å; F392-K402 HydrophobicContact CE1-CB 4.27Å; F392-K402 HydrophobicContact CE2-CB 3.48Å; F392-K402 VanDerWaalsContact CE2-CB 3.48Å; F392-K402 HydrophobicContact CG-CD 4.37Å; F392-K402 HydrophobicContact CZ-CB 3.59Å; E398-K402 HydrophobicContact CB-CD 4.14Å; E398-K402 PolarHBondContact O-N 3.16Å; E398-K402 VanDerWaalsContact O-N 3.1Å; E398-K402 WeakPolarHBondContact OE2-CE 3.39Å; E398-K402 IonicContact OE2-NZ 3.65Å; E398-K402 PolarHBondContact OE2-NZ 2.77Å; Y399-K402 PolarHBondContact O-N 3.42Å; K402-L406 WeakPolarHBondContact O-CG 3.41Å; K402-L406 PolarHBondContact O-N 3.08Å; K402-L406 VanDerWaalsContact O-N 3.14Å
403Y78Confident71.8Confident92 Ų92102.4 Ų102.436%0.36152%0.516SS..Hα-helixtrans-70.3-37.5175.1-175.9-101.1000111.6F384 Y399 E401 L406 L407F384-Y403 HydrophobicContact CE1-CD2 4.5Å; F384-Y403 HydrophobicContact CE1-CE2 4.19Å; F384-Y403 HydrophobicContact CE2-CD2 4.26Å; F384-Y403 HydrophobicContact CE2-CE2 4.17Å; F384-Y403 HydrophobicContact CZ-CD2 4.21Å; F384-Y403 AromaticContact CZ-CE2 3.77Å; F384-Y403 HydrophobicContact CZ-CE2 3.77Å; Y399-Y403 HydrophobicContact CE1-CG 4.24Å; Y399-Y403 WeakPolarHBondContact O-CB 3.36Å; Y399-Y403 PolarHBondContact O-N 3.19Å; E401-Y403 PolarHBondContact O-N 3.23Å; Y403-L406 PolarHBondContact O-N 3.32Å; Y403-L407 HydrophobicContact CD1-CD1 4.06Å; Y403-L407 HydrophobicContact CE1-CD1 3.65Å; Y403-L407 HydrophobicContact CE1-CG 4.29Å; Y403-L407 PolarHBondContact O-N 3.24Å
404Q79Confident69.9Low109 Ų109107.1 Ų107.151%0.50954%0.535SS..Hα-helixtrans-66.7-42.9173.7-178.9126.4-100111.6A400 E401 L406 L407 E408A400-Q404 VanDerWaalsContact O-CB 3.32Å; A400-Q404 WeakPolarHBondContact O-CB 3.48Å; A400-Q404 PolarHBondContact O-N 3.28Å; A400-Q404 VanDerWaalsContact O-N 3.12Å; E401-Q404 PolarHBondContact O-N 3.23Å; Q404-L406 VanDerWaalsContact C-N 3.29Å; Q404-L406 PolarHBondContact O-N 3.15Å; Q404-L407 PolarHBondContact O-N 2.9Å; Q404-L407 VanDerWaalsContact O-N 3.08Å; Q404-E408 HydrophobicContact CG-CG 4.33Å; Q404-E408 WeakPolarHBondContact CG-OE1 3.4Å; Q404-E408 PolarHBondContact NE2-OE1 3.18Å; Q404-E408 WeakPolarHBondContact O-CG 3.5Å; Q404-E408 PolarHBondContact O-N 3.13Å
405E79.7Confident68.3Low132 Ų132112.8 Ų112.862%0.61756%0.558SS**Hα-helixtrans-57.8-38.5174.1-177.1176.2-148.500112.6E401 R409E401-E405 PolarHBondContact O-N 3.28Å; E405-R409 WeakPolarHBondContact O-CB 3.15Å; E405-R409 PolarHBondContact O-N 2.97Å; E405-R409 VanDerWaalsContact O-N 3.17Å
406L77.4Confident66.9Low54 Ų54112.5 Ų112.528%0.28356%0.556SS.*Hα-helixtrans-66-36.8173.9-74175.8000113.2F384 F392 K402 Y403 Q404 Q410F384-L406 HydrophobicContact CB-CD1 4.41Å; F384-L406 HydrophobicContact CD1-CD1 4.18Å; F392-L406 HydrophobicContact CE1-CD1 4.24Å; F392-L406 HydrophobicContact CZ-CD1 3.86Å; K402-L406 WeakPolarHBondContact O-CG 3.41Å; K402-L406 PolarHBondContact O-N 3.08Å; K402-L406 VanDerWaalsContact O-N 3.14Å; Y403-L406 PolarHBondContact O-N 3.32Å; Q404-L406 VanDerWaalsContact C-N 3.29Å; Q404-L406 PolarHBondContact O-N 3.15Å; L406-Q410 PolarHBondContact O-N 3.49Å
407L74.8Confident65.3Low74 Ų74118.8 Ų118.839%0.38758%0.576SS.*Hα-helixtrans-70.9-48.7176.5-70.8173.4000111.7Y403 Q404 R409 Q410 D411Y403-L407 HydrophobicContact CD1-CD1 4.06Å; Y403-L407 HydrophobicContact CE1-CD1 3.65Å; Y403-L407 HydrophobicContact CE1-CG 4.29Å; Y403-L407 PolarHBondContact O-N 3.24Å; Q404-L407 PolarHBondContact O-N 2.9Å; Q404-L407 VanDerWaalsContact O-N 3.08Å; L407-R409 PolarHBondContact O-N 2.87Å; L407-Q410 WeakPolarHBondContact O-CA 3.33Å; L407-Q410 WeakPolarHBondContact O-CB 3.48Å; L407-Q410 PolarHBondContact O-N 2.87Å; L407-D411 PolarHBondContact O-N 3.33Å; L407-D411 VanDerWaalsContact O-N 3.16Å
408E73.6Confident63.4Low116 Ų116115.5 Ų115.554%0.54257%0.567SS.*Hα-helixtrans-62.4-25.8-179.5-69.7178.4-166.900112.2Q404Q404-E408 HydrophobicContact CG-CG 4.33Å; Q404-E408 WeakPolarHBondContact CG-OE1 3.4Å; Q404-E408 PolarHBondContact NE2-OE1 3.18Å; Q404-E408 WeakPolarHBondContact O-CG 3.5Å; Q404-E408 PolarHBondContact O-N 3.13Å
409R69.6Low61.9Low121 Ų121119.3 Ų119.346%0.45758%0.584SS.*Hα-helixtrans-81.2-24.2170.5-172.6163.165.4147.9-18.7114.2E387 E405 L407 Y412E387-R409 IonicContact OE1-CZ 2.64Å; E387-R409 IonicContact OE1-NH1 2.65Å; E387-R409 PolarHBondContact OE1-NH1 3.08Å; E387-R409 IonicContact OE1-NH2 2.7Å; E387-R409 PolarHBondContact OE1-NH2 3.29Å; E405-R409 WeakPolarHBondContact O-CB 3.15Å; E405-R409 PolarHBondContact O-N 2.97Å; E405-R409 VanDerWaalsContact O-N 3.17Å; L407-R409 PolarHBondContact O-N 2.87Å; R409-Y412 WeakPolarHBondContact O-CB 3.41Å
410Q58.2Low59.9Low141 Ų141124.3 Ų124.366%0.65961%0.614SS**Hα-helixtrans-76.1-35.7178.2-172.6159.498.400111.9L406 L407 Y412 F413L406-Q410 PolarHBondContact O-N 3.49Å; L407-Q410 WeakPolarHBondContact O-CA 3.33Å; L407-Q410 WeakPolarHBondContact O-CB 3.48Å; L407-Q410 PolarHBondContact O-N 2.87Å; Q410-Y412 PolarHBondContact O-N 3.37Å; Q410-F413 PolarHBondContact O-N 3.05Å; Q410-F413 VanDerWaalsContact O-N 3.11Å
411D54.1Low58.2Low115 Ų115125.2 Ų125.262%0.61563%0.631SS**Hα-helixtrans-57.7-33.1173.3-74.7-22.1000112.2L407 F413 H414L407-D411 PolarHBondContact O-N 3.33Å; L407-D411 VanDerWaalsContact O-N 3.16Å; D411-F413 PolarHBondContact O-N 2.78Å; D411-H414 PolarHBondContact O-N 2.89Å
412Y47.4Very low56.5Low205 Ų205124.9 Ų124.980%0.80463%0.634SS**THydrogen-bonded Turntrans-61.6-11.7177.2-119.4-83.6000115R409 Q410R409-Y412 WeakPolarHBondContact O-CB 3.41Å; Q410-Y412 PolarHBondContact O-N 3.37Å
413F43.3Very low54.6Low171 Ų171130.4 Ų130.475%0.7566%0.661SS**THydrogen-bonded Turntrans-107.6-3176.5-80-91.4000113.8Q410 D411Q410-F413 PolarHBondContact O-N 3.05Å; Q410-F413 VanDerWaalsContact O-N 3.11Å; D411-F413 PolarHBondContact O-N 2.78Å
414H42.6Very low53.1Low141 Ų141135.4 Ų135.465%0.65369%0.688SS**THydrogen-bonded Turntrans-90.1-28.4-172.4-152.655.9000114.5D411 A416 Y417D411-H414 PolarHBondContact O-N 2.89Å; H414-A416 PolarHBondContact O-N 3.42Å; H414-Y417 PolarHBondContact O-N 3.24Å
415D40.2Very low51.3Low169 Ų169138.2 Ų138.290%0.90470%0.699SS**THydrogen-bonded Turntrans-68.53.1-177.6-80.5-10.7000115.1
416A42Very low49.8Very low74 Ų74139.4 Ų139.461%0.61271%0.709SS**THydrogen-bonded Turntrans-94.9-16.6177.800000114.6H414H414-A416 PolarHBondContact O-N 3.42Å
417Y45.3Very low48.3Very low201 Ų201143 Ų14379%0.78873%0.727SS**SBendtrans-130.346.9-172.4-71.1-74.9000113.2H414H414-Y417 PolarHBondContact O-N 3.24Å
418G38.2Very low47.3Very low65 Ų65148.1 Ų148.167%0.6775%0.749SS**  trans-103.6118.8173.200000113.6N420G418-N420 PolarHBondContact O-N 3.31Å
419E43.6Very low46.6Very low187 Ų187150.6 Ų150.687%0.87477%0.766SS**SBendtrans56.657.6144.2-157.2168.3-134.900118.6
420N38.2Very low46.2Very low157 Ų157153.6 Ų153.684%0.8479%0.785SS**  trans-175.195.3139.2-95.2-45.6000111.8G418 N422G418-N420 PolarHBondContact O-N 3.31Å; N420-N422 VanDerWaalsContact C-N 3.34Å; N420-N422 PolarHBondContact O-N 3.31Å
421G38.9Very low46.6Very low92 Ų92152.1 Ų152.195%0.94878%0.78SS**  trans-79.871.1178.100000113.4
422N44.3Very low47.8Very low149 Ų149150.9 Ų150.980%0.79777%0.773SS**  trans-148.947.6177.2-161.192.7000113N420N420-N422 VanDerWaalsContact C-N 3.34Å; N420-N422 PolarHBondContact O-N 3.31Å
423E38.6Very low49.1Very low173 Ų173145.8 Ų145.881%0.80877%0.765SS**  trans-127.7141.3161.6-68.7-165.4170.300110.1F425E423-F425 PolarHBondContact O-N 2.92Å
424E47.2Very low50.8Low198 Ų198145.1 Ų145.193%0.92576%0.764SS**  trans-85.898.3-173.7-175.7170.4-160.300108.6D426E424-D426 PolarHBondContact O-N 3.47Å
425F40.2Very low52.4Low168 Ų168143.3 Ų143.374%0.73776%0.758SS**  trans-73.697.8177.9-81.4-86.5000110.5E423 I427E423-F425 PolarHBondContact O-N 2.92Å; F425-I427 PolarHBondContact O-N 3.2Å
426D47.8Very low54.4Low157 Ų157140.1 Ų140.184%0.8474%0.738SS**  trans-66.3105.6161.9-153.75.2000107.4E424 E428E424-D426 PolarHBondContact O-N 3.47Å; D426-E428 PolarHBondContact O-N 2.87Å
427I47.3Very low56.4Low129 Ų129143.3 Ų143.366%0.66274%0.74SS**  trans-84.3109-177.5-57177.8000107.5F425 D429F425-I427 PolarHBondContact O-N 3.2Å; I427-D429 PolarHBondContact O-N 3.44Å
428E53.8Low58.3Low182 Ų182136.7 Ų136.785%0.8573%0.727SS**  trans-65.3103.7170.1-68.4-174.6133.800109.1D426 E430D426-E428 PolarHBondContact O-N 2.87Å; E428-E430 PolarHBondContact O-N 3.26Å
429D56.9Low60.5Low167 Ų167140.7 Ų140.789%0.89372%0.723SS**  trans-68.541.2178.2-89.2-31.5000113I427I427-D429 PolarHBondContact O-N 3.44Å
430E62.3Low62.6Low184 Ų184137.6 Ų137.686%0.8671%0.708SS**  trans-97.4103.4173.6-166.4158.2-137.200110E428E428-E430 PolarHBondContact O-N 3.26Å
431M67.5Low64.8Low110 Ų110133.2 Ų133.254%0.54269%0.69SS.*  trans-70.8135.9-179.9-161.6-176-33.900110.4I435 E436M431-I435 HydrophobicContact CG-CG2 4.42Å; M431-I435 HydrophobicContact SD-CG2 4.33Å; M431-E436 HydrophobicContact SD-CB 4.42Å
432D77.8Confident67Low90 Ų90135.3 Ų135.348%0.48167%0.673SS.*  trans-59.5127.9178-170.1-51.6000110.6E434 I435 E436D432-E434 PolarHBondContact O-N 2.99Å; D432-E434 PolarHBondContact OD1-N 3.23Å; D432-I435 HydrophobicContact CB-CB 4.36Å; D432-I435 HydrophobicContact CB-CD1 3.95Å; D432-I435 HydrophobicContact CB-CG1 4.04Å; D432-I435 WeakPolarHBondContact O-CA 3.46Å; D432-I435 WeakPolarHBondContact O-CB 3.24Å; D432-I435 PolarHBondContact O-N 2.98Å; D432-E436 PolarHBondContact O-N 3.48Å
433P76.1Confident69Low97 Ų97130.3 Ų130.363%0.6365%0.649SS**Hα-helixtrans-61.9-24-176.323.7-34.4000114.2I435 E437P433-I435 VanDerWaalsContact C-N 3.32Å; P433-E437 PolarHBondContact O-N 2.97Å; P433-E437 VanDerWaalsContact O-N 3.07Å
434E77.6Confident71.1Confident157 Ų157127.5 Ų127.573%0.73464%0.639SS**Hα-helixtrans-69.8-33.1172.2-172.2172.6169.500111.2D432 A438D432-E434 PolarHBondContact O-N 2.99Å; D432-E434 PolarHBondContact OD1-N 3.23Å; E434-A438 WeakPolarHBondContact O-CB 3.38Å; E434-A438 PolarHBondContact O-N 2.65Å
435I77Confident72.7Confident104 Ų104122.7 Ų122.753%0.53362%0.617SS.*Hα-helixtrans-74.9-37.7175.9-59.8178.8000110.6M431 D432 P433 A438 Y439M431-I435 HydrophobicContact CG-CG2 4.42Å; M431-I435 HydrophobicContact SD-CG2 4.33Å; D432-I435 HydrophobicContact CB-CB 4.36Å; D432-I435 HydrophobicContact CB-CD1 3.95Å; D432-I435 HydrophobicContact CB-CG1 4.04Å; D432-I435 WeakPolarHBondContact O-CA 3.46Å; D432-I435 WeakPolarHBondContact O-CB 3.24Å; D432-I435 PolarHBondContact O-N 2.98Å; P433-I435 VanDerWaalsContact C-N 3.32Å; I435-A438 PolarHBondContact O-N 2.73Å; I435-Y439 WeakPolarHBondContact O-CB 3.36Å; I435-Y439 PolarHBondContact O-N 3.44Å
436E82.3Confident74.3Confident102 Ų102116.2 Ų116.248%0.47759%0.592SS.*Hα-helixtrans-65.1-47.8176.2-168.4171-134.100111.8M431 D432 A438 Y439 E440M431-E436 HydrophobicContact SD-CB 4.42Å; D432-E436 PolarHBondContact O-N 3.48Å; E436-A438 VanDerWaalsContact C-N 3.31Å; E436-A438 PolarHBondContact O-N 2.89Å; E436-Y439 PolarHBondContact O-N 2.97Å; E436-Y439 VanDerWaalsContact O-N 3.11Å; E436-E440 PolarHBondContact O-N 3.1Å
437E84.9Confident75.6Confident141 Ų141113.2 Ų113.266%0.65957%0.574SS**Hα-helixtrans-62.2-37176.5-175.2173.2-162.800112P433 S441P433-E437 PolarHBondContact O-N 2.97Å; P433-E437 VanDerWaalsContact O-N 3.07Å; E437-S441 VanDerWaalsContact O-CB 3.26Å; E437-S441 WeakPolarHBondContact O-CB 3.45Å; E437-S441 PolarHBondContact O-N 2.98Å; E437-S441 PolarHBondContact O-OG 3.1Å
438A84.6Confident76.8Confident61 Ų61113 Ų11350%0.50457%0.571SS.*Hα-helixtrans-65.9-3817400000112.5E434 I435 E436 F442E434-A438 WeakPolarHBondContact O-CB 3.38Å; E434-A438 PolarHBondContact O-N 2.65Å; I435-A438 PolarHBondContact O-N 2.73Å; E436-A438 VanDerWaalsContact C-N 3.31Å; E436-A438 PolarHBondContact O-N 2.89Å; A438-F442 PolarHBondContact O-N 3.34Å
439Y84.1Confident77.4Confident150 Ų150110.5 Ų110.559%0.58856%0.558SS**Hα-helixtrans-68.9-47.3176.8-177-98.7000112.2I435 E436 S441 F442 C443I435-Y439 WeakPolarHBondContact O-CB 3.36Å; I435-Y439 PolarHBondContact O-N 3.44Å; E436-Y439 PolarHBondContact O-N 2.97Å; E436-Y439 VanDerWaalsContact O-N 3.11Å; Y439-S441 VanDerWaalsContact C-N 3.3Å; Y439-S441 PolarHBondContact O-N 3.21Å; Y439-F442 PolarHBondContact O-N 3.26Å; Y439-C443 PolarHBondContact O-N 3.12Å
440E87.6Confident77.9Confident121 Ų121110.4 Ų110.457%0.56555%0.545SS*.Hα-helixtrans-58-44.4174.7-70.9-153141.100111.4E436 F442 C443 L444E436-E440 PolarHBondContact O-N 3.1Å; E440-F442 VanDerWaalsContact C-N 3.35Å; E440-F442 PolarHBondContact O-N 3.36Å; E440-C443 WeakPolarHBondContact O-CB 3.44Å; E440-C443 PolarHBondContact O-N 3.34Å; E440-L444 WeakPolarHBondContact O-CG 3.49Å; E440-L444 PolarHBondContact O-N 3Å
441S84.9Confident77.9Confident66 Ų66109.1 Ų109.146%0.46254%0.539SS..Hα-helixtrans-58.5-43.7176.9-65.60000112.5E437 Y439 E445E437-S441 VanDerWaalsContact O-CB 3.26Å; E437-S441 WeakPolarHBondContact O-CB 3.45Å; E437-S441 PolarHBondContact O-N 2.98Å; E437-S441 PolarHBondContact O-OG 3.1Å; Y439-S441 VanDerWaalsContact C-N 3.3Å; Y439-S441 PolarHBondContact O-N 3.21Å; S441-E445 PolarHBondContact O-N 2.89Å
442F85.4Confident76.9Confident136 Ų136114.6 Ų114.660%0.59656%0.563SS**Hα-helixtrans-64.7-44175.4173.8-98.7000112.1A438 Y439 E440 L444 E445 S446A438-F442 PolarHBondContact O-N 3.34Å; Y439-F442 PolarHBondContact O-N 3.26Å; E440-F442 VanDerWaalsContact C-N 3.35Å; E440-F442 PolarHBondContact O-N 3.36Å; F442-L444 PolarHBondContact O-N 3.24Å; F442-E445 PolarHBondContact O-N 3.46Å; F442-S446 WeakPolarHBondContact O-CB 3.31Å; F442-S446 PolarHBondContact O-N 3.3Å
443C85.7Confident76.9Confident43 Ų43115.8 Ų115.829%0.29157%0.567SS.*Hα-helixtrans-57.6-50176.1-80.10000111.5Y439 E440 E445 S446 E447Y439-C443 PolarHBondContact O-N 3.12Å; E440-C443 WeakPolarHBondContact O-CB 3.44Å; E440-C443 PolarHBondContact O-N 3.34Å; C443-E445 PolarHBondContact O-N 3.36Å; C443-S446 WeakPolarHBondContact O-CB 3.41Å; C443-S446 PolarHBondContact O-N 3.18Å; C443-S446 VanDerWaalsContact O-N 3.16Å; C443-S446 PolarHBondContact O-OG 2.92Å; C443-E447 PolarHBondContact O-N 3.34Å; C443-E447 VanDerWaalsContact O-N 3.07Å
444L82.9Confident76.9Confident114 Ų114116.8 Ų116.860%0.59756%0.564SS**Hα-helixtrans-61.5-42.1178.8-70.3169000112.6E440 F442 S446 E447 M448E440-L444 WeakPolarHBondContact O-CG 3.49Å; E440-L444 PolarHBondContact O-N 3Å; F442-L444 PolarHBondContact O-N 3.24Å; L444-S446 VanDerWaalsContact C-N 3.32Å; L444-S446 PolarHBondContact O-N 3.43Å; L444-E447 PolarHBondContact O-N 3.21Å; L444-M448 PolarHBondContact O-N 3.12Å
445E80.4Confident76.9Confident97 Ų97114.6 Ų114.645%0.45355%0.554SS.*Hα-helixtrans-65.1-37.5175.6-153.2-150-174.200111.7S441 F442 C443 E447 M448 K449S441-E445 PolarHBondContact O-N 2.89Å; F442-E445 PolarHBondContact O-N 3.46Å; C443-E445 PolarHBondContact O-N 3.36Å; E445-E447 VanDerWaalsContact C-N 3.28Å; E445-E447 PolarHBondContact O-N 2.76Å; E445-M448 PolarHBondContact O-N 2.84Å; E445-K449 HydrophobicContact CG-CD 4.46Å; E445-K449 WeakPolarHBondContact O-CB 3.48Å; E445-K449 WeakPolarHBondContact O-CG 3.45Å; E445-K449 PolarHBondContact O-N 2.54Å; E445-K449 WeakPolarHBondContact OE1-CE 3.3Å; E445-K449 IonicContact OE1-NZ 3.47Å; E445-K449 PolarHBondContact OE1-NZ 3.11Å; E445-K449 IonicContact OE2-NZ 3.81Å; E445-K449 PolarHBondContact OE2-NZ 3.07Å
446S74.1Confident76.9Confident32 Ų32115.2 Ų115.222%0.22456%0.555CS.*Hα-helixtrans-66.8-26.6176.789.50000113.6F442 C443 L444 R450F442-S446 WeakPolarHBondContact O-CB 3.31Å; F442-S446 PolarHBondContact O-N 3.3Å; C443-S446 WeakPolarHBondContact O-CB 3.41Å; C443-S446 PolarHBondContact O-N 3.18Å; C443-S446 VanDerWaalsContact O-N 3.16Å; C443-S446 PolarHBondContact O-OG 2.92Å; L444-S446 VanDerWaalsContact C-N 3.32Å; L444-S446 PolarHBondContact O-N 3.43Å; S446-R450 PolarHBondContact O-NE 3.18Å; S446-R450 PolarHBondContact OG-NH2 3.42Å
447E75.6Confident76.6Confident95 Ų95116 Ų11644%0.44456%0.56SS.*Hα-helixtrans-84-39.3175.1-68.5-151.2143.900111.8C443 L444 E445 K449 R450 Q451C443-E447 PolarHBondContact O-N 3.34Å; C443-E447 VanDerWaalsContact O-N 3.07Å; L444-E447 PolarHBondContact O-N 3.21Å; E445-E447 VanDerWaalsContact C-N 3.28Å; E445-E447 PolarHBondContact O-N 2.76Å; E447-K449 VanDerWaalsContact C-N 3.28Å; E447-K449 PolarHBondContact O-N 2.68Å; E447-R450 WeakPolarHBondContact O-CA 3.2Å; E447-R450 WeakPolarHBondContact O-CB 3.18Å; E447-R450 PolarHBondContact O-N 3.39Å; E447-Q451 PolarHBondContact O-N 2.99Å
448M71Confident76Confident125 Ų125114.3 Ų114.362%0.61655%0.554SS**Hα-helixtrans-62.4-38.4174.3-139.6-161.3-54.400111.3L444 E445 R450 Q451L444-M448 PolarHBondContact O-N 3.12Å; E445-M448 PolarHBondContact O-N 2.84Å; M448-R450 PolarHBondContact O-N 3.39Å; M448-Q451 PolarHBondContact O-N 3.27Å
449K66.8Low75.4Confident129 Ų129118.1 Ų118.156%0.56156%0.557SS**THydrogen-bonded Turntrans-68.8-9.3171.9-72.8171.3-179.8168.20114.6E445 E447E445-K449 HydrophobicContact CG-CD 4.46Å; E445-K449 WeakPolarHBondContact O-CB 3.48Å; E445-K449 WeakPolarHBondContact O-CG 3.45Å; E445-K449 PolarHBondContact O-N 2.54Å; E445-K449 WeakPolarHBondContact OE1-CE 3.3Å; E445-K449 IonicContact OE1-NZ 3.47Å; E445-K449 PolarHBondContact OE1-NZ 3.11Å; E445-K449 IonicContact OE2-NZ 3.81Å; E445-K449 PolarHBondContact OE2-NZ 3.07Å; E447-K449 VanDerWaalsContact C-N 3.28Å; E447-K449 PolarHBondContact O-N 2.68Å
450R66.9Low74.7Confident164 Ų164115.7 Ų115.762%0.61956%0.555SS**THydrogen-bonded Turntrans-100.6-4.5173.2-87.5179.6-78.5156.9-7.8113.6S446 E447 M448S446-R450 PolarHBondContact O-NE 3.18Å; S446-R450 PolarHBondContact OG-NH2 3.42Å; E447-R450 WeakPolarHBondContact O-CA 3.2Å; E447-R450 WeakPolarHBondContact O-CB 3.18Å; E447-R450 PolarHBondContact O-N 3.39Å; M448-R450 PolarHBondContact O-N 3.39Å
451Q61.9Low73.7Confident158 Ų158115.3 Ų115.374%0.73855%0.554SS**  trans-1139.3180-64.6-177.347.400113.2E447 M448E447-Q451 PolarHBondContact O-N 2.99Å; M448-Q451 PolarHBondContact O-N 3.27Å
452Q48.4Very low72.6Confident224 Ų224119.7 Ų119.7100%1.04756%0.562SS**  trans-109.40167.8-65.2-174.212.300110.4

Retrieved 452 of 452 residues in 73.6 ms (Link to these results)