A0A2K5ZEF4_MANLE Loading...

Homeobox D3

Sequence-specific transcription factor which is part of a developmental regulatory system that provides cells with specific positional identities on the anterior-posterior axis.

AlphaFold DB , UniProt , Accession A0A2K5ZEF4, Species MANLE (Mandrillus leucophaeus, Drill), Gene HOXD3, Length 432 aa.

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(Predicted Aligned Error values between residue pairs)
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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M38.5Very low41.7Very low228 Ų228165.5 Ų165.5100%1.12386%0.859SS**  0142.50-61.7175-176.100106.7
2L41.9Very low42.2Very low155 Ų155164.7 Ų164.781%0.81286%0.855SS**  trans63.6139.1-174.9-57.8115.4000113.1
3F40.4Very low43.3Very low193 Ų193161.8 Ų161.885%0.84685%0.853SS**  64.3133.750.2-71.1-84.8000111.5
4E43.9Very low43.1Very low147 Ų147161.9 Ų161.969%0.68785%0.847SS**  cis-154.2177.217.8-156.8-163.6104.300111.4
5Q44.8Very low43Very low178 Ų178159.7 Ų159.783%0.83285%0.848SS**  trans71.1131.7147.9-136.8172.59900118.1
6G39.7Very low43.2Very low73 Ų73154.9 Ų154.975%0.75383%0.827SS**  cis-176.7140.6-10.400000110.3
7Q43.5Very low43.4Very low197 Ų197157.2 Ų157.292%0.92184%0.835SS**  trans-100.7136.1175.8-71-176.8-9.300110.8
8Q43.7Very low43.5Very low191 Ų191158.6 Ų158.689%0.89384%0.836SS**  trans-132.9116.5159.9-79.4-175.62.500109.5
9A40.9Very low43.6Very low95 Ų95160.9 Ų160.979%0.78584%0.838SS**  trans-92.1136.6165.300000108.6E11A9-E11 PolarHBondContact O-N 3.39Å
10L41.3Very low43.2Very low177 Ų177158 Ų15893%0.92784%0.839SS**  trans-90.796.3168.8-71.5173.5000108.5
11E40Very low43Very low186 Ų186154.6 Ų154.687%0.86983%0.833SS**  trans-81.4149.6176-169.6166.4-146.300111.5A9A9-E11 PolarHBondContact O-N 3.39Å
12L47.1Very low42.7Very low156 Ų156153 Ų15382%0.81782%0.816SS**  trans-82.9136.6178.8-65.4167.2000110.2E14L12-E14 PolarHBondContact O-N 3.33Å
13P56.5Low42.5Very low128 Ų128154 Ų15483%0.83181%0.81SS**  trans-68.8115.9179.226.8-33.5000111.8
14E40.8Very low42.2Very low162 Ų162150.1 Ų150.176%0.75779%0.794SS**  trans-72.3130.7175.4-167.8-170163.700111.6L12 T16L12-E14 PolarHBondContact O-N 3.33Å; E14-T16 HydrophobicContact CB-CG2 4.45Å; E14-T16 HydrophobicContact CG-CG2 4.07Å; E14-T16 PolarHBondContact O-N 2.68Å
15C41.4Very low41.6Very low129 Ų129150.5 Ų150.587%0.87280%0.801SS**  trans-79.280.8176.5-170.80000111.4
16T46.1Very low42.1Very low84 Ų84146.8 Ų146.852%0.51579%0.792SS.*  trans-86.5120.7176.9510000111.7E14 Q18E14-T16 HydrophobicContact CB-CG2 4.45Å; E14-T16 HydrophobicContact CG-CG2 4.07Å; E14-T16 PolarHBondContact O-N 2.68Å; T16-Q18 PolarHBondContact O-N 2.71Å
17M46.8Very low41.9Very low194 Ų194147 Ų14796%0.95680%0.795SS**  trans-68.2110.6175.4-84.1-172.1161.100111.2
18Q44.9Very low41.8Very low181 Ų181145.2 Ų145.285%0.84679%0.791SS**  trans-86.2123.2173-65.5-169.83.100111.7T16 A20T16-Q18 PolarHBondContact O-N 2.71Å; Q18-A20 PolarHBondContact O-N 2.91Å
19K45.6Very low41.4Very low203 Ų203145.9 Ų145.988%0.88379%0.791SS**  trans-84.396.5179.1175.1-172.3169.8-172.30109.7
20A35.3Very low41Very low103 Ų103145 Ų14585%0.85179%0.791SS**  trans-68.7134175.400000111.8Q18Q18-A20 PolarHBondContact O-N 2.91Å
21A40.3Very low40.7Very low86 Ų86140.2 Ų140.271%0.71178%0.784SS**  trans-154.5149.1168.400000110.7
22Y31.2Very low40.5Very low195 Ų195143 Ų14377%0.76579%0.789SS**  trans84129.3157-127.3-120.3000119.9
23Y37.2Very low39.8Very low177 Ų177139.3 Ų139.369%0.69479%0.789SS**  trans68.8144.4160.3-85.6-145.8000117.9
24E35.6Very low38.8Very low110 Ų110144.5 Ų144.551%0.51479%0.793SS.*  cis-159154.3-8.1-124.8-70.9152.100109.6
25N31.8Very low38.4Very low156 Ų156142.4 Ų142.483%0.83480%0.797SS**  trans-166.2132.6143.8-120.1-96.8000111.7
26P54Low38Very low100 Ų100144.9 Ų144.965%0.64979%0.792SS**  trans-94.3151.6-172.335.9-36000114.3
27G36.2Very low37.4Very low78 Ų78146.7 Ų146.780%0.80480%0.804SS**  trans-147.2102.5173.400000112.1
28L40.8Very low36.7Very low159 Ų159143.5 Ų143.583%0.83280%0.795SS**  trans-51.4145173.5-75.454.3000110.4
29F35.4Very low36.3Very low204 Ų204141.8 Ų141.890%0.89579%0.792SS**  -175.1124.971.3-173-94.9000113.6
30G33.7Very low35.7Very low76 Ų76138.2 Ų138.278%0.78479%0.787SS**  trans75.9147.1154.400000118.8
31G34Very low35.8Very low77 Ų77144.3 Ų144.379%0.79479%0.79SS**  cis160.198.7-400000112.2
32Y36.6Very low35.4Very low245 Ų245143.4 Ų143.496%0.96179%0.789SS**  trans-49.3149.9-173.1-60.6-94000117.1
33G32.3Very low35.7Very low79 Ų79145.3 Ų145.381%0.81480%0.796SS**  trans-168.2105.7161.900000113
34Y35Very low35.7Very low237 Ų237141 Ų14193%0.92979%0.792SS**  trans-114.5122172.1-166.3-84.1000108.8
35S32.7Very low35.4Very low118 Ų118143.1 Ų143.183%0.82581%0.807SS**  trans-140.8166.4179.357.50000111.3
36K33.5Very low36.9Very low180 Ų180140 Ų14078%0.78380%0.795SS**  trans-136.7144.7-157-175-167.1-179.8-1700110.7
37T32.2Very low36Very low123 Ų123144.1 Ų144.176%0.75581%0.806SS**  trans61.7146175.641.60000114.3
38T32.8Very low35.9Very low127 Ų127147.8 Ų147.878%0.77980%0.802SS**  cis-144-178.331.448.10000113.7
39D36.8Very low36.4Very low145 Ų145145.2 Ų145.278%0.77580%0.795SS**  trans-68158.9-178.4-44.7-107.4000116.4
40T31.9Very low35.9Very low127 Ų127145.4 Ų145.478%0.77979%0.791SS**  trans174121.3143-81.40000113.1
41Y38.2Very low36.9Very low231 Ų231147.1 Ų147.191%0.90679%0.788SS**  trans12.6150.3156.2-56.3-97.1000122.7
42G32.4Very low38.2Very low68 Ų68149 Ų14970%0.70179%0.786SS**  cis168.8171.6-1.500000114.2
43Y35.9Very low39.1Very low234 Ų234142.6 Ų142.692%0.91878%0.775SS**  trans25.7147.8157.4-89-122.5000122.8
44S37.8Very low39.4Very low86 Ų86143.5 Ų143.560%0.60178%0.775SS**  cis177.1148.3-7.453.60000115.4
45N29.9Very low39.5Very low155 Ų155137 Ų13783%0.82977%0.77SS**  trans61.3175.8146.3-97.89.3000121.6
46P63.3Low39.7Very low91 Ų91135.7 Ų135.759%0.59177%0.766SS**  cis-143.6179.6-43.440.6-23.2000118
47H33.8Very low39.7Very low187 Ų187134.8 Ų134.887%0.86677%0.77SS**  trans96.2150.3143-74.7-45.7000126
48Q35.5Very low39.8Very low154 Ų154133.8 Ų133.872%0.7277%0.768SS**  trans-101.5-174.1177.7-91-98.2-19.700109.6
49P50.2Low40.1Very low105 Ų105135.5 Ų135.568%0.68277%0.772SS**  cis-153.9170.627.946.6-24.9000121.4
50Y26.4Very low40.1Very low208 Ų208135.1 Ų135.182%0.81677%0.77SS**  trans37.3172.1136.5-80.4-98.5000124
51P53.6Low40.4Very low113 Ų113134.7 Ų134.773%0.73477%0.767SS**  cis-132.6-130.7-17.340.9-16.7000115.4
52P60.9Low40.2Very low115 Ų115130.5 Ų130.575%0.74776%0.76SS**  trans-127.6-134.3-142.336.7-6.9000113.1
53P56.7Low40.3Very low112 Ų112136.7 Ų136.773%0.72776%0.764SS**  cis-142-174.8-20.740.3-19.7000118.1
54A38.4Very low41.1Very low98 Ų98130.7 Ų130.781%0.8175%0.753SS**  trans98.8139136.400000125.9
55A36.1Very low40.9Very low99 Ų99130 Ų13082%0.81876%0.761SS**  trans85.389.3141.300000125.2
56A36.7Very low41.6Very low91 Ų91128.1 Ų128.175%0.75276%0.759SS**  trans20.3133.5131.300000125.7
57N34.6Very low40.3Very low161 Ų161128.2 Ų128.286%0.86177%0.768SS**  175.6130.3126.8-86.7-29.3000108.1
58S34.4Very low40.2Very low103 Ų103125.6 Ų125.672%0.7277%0.769SS**  cis98.493.440.4-171.20000113.4
59L39.4Very low40.2Very low163 Ų163123.9 Ų123.985%0.85377%0.774SS**  trans176.6156.7146.6-104.8163.9000113.6
60D37Very low39.6Very low137 Ų137127 Ų12773%0.73378%0.783SS**  trans-132.4-177.6-172.7-60.2-93.5000109.5
61T37.5Very low40Very low117 Ų117126 Ų12672%0.71879%0.786SS**  cis-156.6172.515.9-27.60000111
62D34.3Very low38.9Very low144 Ų144126.9 Ų126.977%0.7780%0.795SS**  trans70.9129151.5-89.5-64.7000122.1
63Y34.1Very low37.8Very low197 Ų197127.1 Ų127.177%0.77380%0.799SS**  trans-158103161.6-167-83.7000112
64P52.7Low36.8Very low108 Ų108126 Ų12670%0.70180%0.8SS**PPolyproline II helixtrans-88.6141.1170.732.9-32000112.4
65G34.3Very low37.5Very low73 Ų73126.7 Ų126.775%0.75380%0.796SS**PPolyproline II helixtrans-73.6149.6-17400000115.5
66S44.7Very low37.3Very low114 Ų114129.3 Ų129.380%0.79780%0.795SS**PPolyproline II helixtrans-77.3132.3-177.7-45.50000113.5
67A34.4Very low37.1Very low93 Ų93136.4 Ų136.477%0.76980%0.802SS**PPolyproline II helixtrans-102.3146.5165.700000110.7S69A67-S69 PolarHBondContact O-N 3.2Å
68C31.5Very low37Very low133 Ų133132.7 Ų132.790%0.89979%0.794SS**PPolyproline II helixtrans-75.7123.1-179.9-58.30000111.7
69S35.6Very low37.5Very low118 Ų118133.9 Ų133.983%0.82580%0.799SS**  trans-123.4130.9169.6-71.60000109.6A67A67-S69 PolarHBondContact O-N 3.2Å
70I38.4Very low37.4Very low169 Ų169130.3 Ų130.387%0.86779%0.793SS**  trans-116.9132.7174.2-52.7-179.8000108
71Q34.8Very low37.4Very low189 Ų189133.1 Ų133.188%0.88380%0.802SS**  trans-80.7149.7-174.9-63.6168.8-21.500112
72S30.7Very low37.2Very low131 Ų131137.6 Ų137.692%0.91681%0.811SS**  trans-138.9119.1159.3-770000109.4
73S36.9Very low37Very low119 Ų119134.3 Ų134.383%0.83281%0.811SS**  trans-95143.4176.448.60000111.8
74A36.3Very low37Very low90 Ų90129.2 Ų129.274%0.74481%0.81SS**  trans-74.7178.3168.500000110.6
75P52.4Low36.1Very low112 Ų112132.9 Ų132.973%0.72782%0.818SS**  -152.2-172.957.732.9-6.5000117.9
76L33.3Very low36.4Very low153 Ų153138.1 Ų138.180%0.80183%0.828SS**  trans95.195.8154.6-52.5-175.7000121.8
77R32.3Very low36Very low240 Ų240140.6 Ų140.691%0.90683%0.832SS**  63.1122.4109.9-160.8172.7-170.2134.31.6120.7
78A32.4Very low36Very low83 Ų83139.3 Ų139.369%0.68683%0.828SS**  trans-82.6171.9168.400000113.6
79P44.7Very low36.5Very low129 Ų129138.4 Ų138.484%0.83882%0.823SS**  -139.2-179.396.939.6-27.1000114.6
80A38Very low36.3Very low88 Ų88137.3 Ų137.373%0.72781%0.814SS**  trans-112.7159.8-173.200000113.6
81H35.4Very low36.6Very low196 Ų196136.5 Ų136.591%0.90781%0.809SS**  trans-139.9167.7163.6-87.3-80.8000111.8
82K34.9Very low37.2Very low211 Ų211137.5 Ų137.592%0.91780%0.804SS**  trans-118.1160.1-170.1-55.2174.2179.5177.50112.1
83G30.2Very low38.2Very low75 Ų75136.1 Ų136.177%0.77379%0.793SS**  trans119.5152.7133.900000118.1
84A33.8Very low38.3Very low90 Ų90133.8 Ų133.874%0.74479%0.787SS**  trans46.7114.1163.800000118.2
85E32.4Very low38.5Very low184 Ų184136.7 Ų136.786%0.8680%0.796SS**  61.4100.867-63.2-169.4133.200114.8
86L42Very low37.6Very low184 Ų184134.5 Ų134.596%0.96379%0.794SS**  trans-138.1125.2140.5-78-177000109
87N35.4Very low37.8Very low165 Ų165135.1 Ų135.188%0.88280%0.798SS**  trans-100.1145.4-178.6177.76.3000109.8
88G33.9Very low38.2Very low67 Ų67127.5 Ų127.569%0.69178%0.782SS**  trans-170.671.4-178.900000116.6
89S41.8Very low38.6Very low113 Ų113132.6 Ų132.679%0.7979%0.791SS**  trans48.5148.5140.6-72.80000122.5
90C31.6Very low38.2Very low96 Ų96130.2 Ų130.265%0.64979%0.79SS**  cis-169.9174.5-14.556.50000109.6
91M45.7Very low38Very low151 Ų151130.1 Ų130.174%0.74480%0.798SS**  trans71.8141.8172.1-59.8-59.3106.100117
92R47Very low37.9Very low210 Ų210124.8 Ų124.879%0.79280%0.796SS**  cis-161.6-169.5-21.6-151.5-178.6176.8-110.30.3109.1
93P52.7Low37.8Very low103 Ų103118 Ų11867%0.66979%0.786SS**  -67.5161.5-120.641.2-31.9000114.9
94G39Very low38Very low70 Ų70120.4 Ų120.472%0.72279%0.791SS**  cis89125.343.300000109
95T38.7Very low38.2Very low150 Ų150122 Ų12292%0.9280%0.796SS**  cis-125174.738.152.80000113.5
96G34.7Very low38.6Very low67 Ų67121.9 Ų121.969%0.69180%0.796SS**  cis153.4110.6-12.400000113.9
97N37.9Very low39Very low165 Ų165118.5 Ų118.588%0.88279%0.785SS**  trans62.8150.6167-81.822.5000119.1
98S40.9Very low39.3Very low81 Ų81116.9 Ų116.957%0.56678%0.783SS**  cis-161.1149.2-5.337.90000113
99Q40.9Very low39.4Very low189 Ų189117.1 Ų117.188%0.88379%0.786SS**  trans63.8145.7154.6-70.4154.3-33.100118.6
100G35Very low39.6Very low80 Ų80120.5 Ų120.583%0.82579%0.794SS**  cis136.1120.6-7.200000112.9
101G33.9Very low39.9Very low85 Ų85122.6 Ų122.688%0.87680%0.799SS**  trans156.4104.4177.700000111.1
102G34.1Very low39.4Very low85 Ų85120.6 Ų120.688%0.87680%0.8SS**  trans-104.2154.4170.800000110.9
103G32.8Very low39Very low68 Ų68119 Ų11970%0.70180%0.801SS**  trans-177.4140.4175.600000114.2
104S33.6Very low38.6Very low125 Ų125123 Ų12387%0.87481%0.811SS**  trans45114.1156.756.70000119.9
105S37.5Very low38.9Very low123 Ų123128.6 Ų128.686%0.8682%0.818SS**  trans-91.8120.6158.7420000111.7
106Q41.6Very low39.7Very low182 Ų182126.4 Ų126.485%0.8581%0.807SS**  trans-143.6158.2158.9-106.1-165.8-18.300109.8
107P49.5Very low40.7Very low114 Ų114129.3 Ų129.374%0.7481%0.814SS**PPolyproline II helixtrans-86.3139.9-162.432.6-35000113.8
108P43.5Very low41.6Very low130 Ų130129.9 Ų129.984%0.84481%0.811SS**PPolyproline II helixtrans-68.1131159.5-15.130.4000110.3
109G34.5Very low42.8Very low72 Ų72131 Ų13174%0.74282%0.816SS**PPolyproline II helixtrans-76.6173.117600000113.7N111G109-N111 PolarHBondContact O-N 3.28Å
110L45.8Very low44.1Very low184 Ų184127.6 Ų127.696%0.96381%0.81SS**  trans-64.4113.4172.1-70.4164.4000110.6
111N37.7Very low45.8Very low140 Ų140129.3 Ų129.375%0.74981%0.807SS**  trans-148.6125.2149.8-146.91.4000110.2G109G109-N111 PolarHBondContact O-N 3.28Å
112S37Very low47.4Very low109 Ų109130.9 Ų130.976%0.76280%0.802SS**  trans-134.566.7178.7-70.60000109
113E37.3Very low48.9Very low177 Ų177132.2 Ų132.283%0.82780%0.795SS**  trans-65.6133.7172.1-165.2171.999.300109.9Q115E113-Q115 PolarHBondContact O-N 3.44Å
114Q44.5Very low50.3Low187 Ų187134.9 Ų134.987%0.87480%0.8SS**  trans-89.994.9-165.9-70.2175.4-22.900111.5
115Q45.6Very low51Low187 Ų187135.6 Ų135.687%0.87480%0.799SS**PPolyproline II helixtrans-73.3128.3171.3-157.6171.831.700110.4E113E113-Q115 PolarHBondContact O-N 3.44Å
116P55.6Low51.7Low104 Ų104137.4 Ų137.468%0.67580%0.798SS**PPolyproline II helixtrans-70.6148.9-174.727.4-35000112.6Q118P116-Q118 PolarHBondContact O-N 3.48Å
117P55.6Low52.6Low129 Ų129133.7 Ų133.784%0.83879%0.79SS**PPolyproline II helixtrans-68.8126.8-176.327.6-34.5000112.2
118Q57.1Low52.5Low177 Ų177134.1 Ų134.183%0.82779%0.793SS**PPolyproline II helixtrans-60.3143.3170-71.6-95.4-30.800111P116P116-Q118 PolarHBondContact O-N 3.48Å
119P65.4Low52.2Low105 Ų105133.5 Ų133.568%0.68279%0.792SS**PPolyproline II helixtrans-67.4151.7173.929.7-34.7000111.4
120P68.9Low52.7Low116 Ų116135.6 Ų135.675%0.75380%0.795SS**PPolyproline II helixtrans-66.6149.9177.329.1-35.3000111.6
121P70Confident52.9Low117 Ų117133 Ų13376%0.7679%0.789SS**PPolyproline II helixtrans-64.5150178.827.5-35.2000111.9
122P67.6Low53Low118 Ų118132.6 Ų132.677%0.76679%0.792SS**PPolyproline II helixtrans-65.2153.3177.828.4-35.2000111.9
123P66.9Low53Low113 Ų113134.1 Ų134.173%0.73479%0.791SS**PPolyproline II helixtrans-65.2150.5176.629-35.5000111.4T125P123-T125 PolarHBondContact O-N 3.47Å
124P60.5Low53.3Low124 Ų124131.5 Ų131.581%0.80579%0.79SS**PPolyproline II helixtrans-63.3123.5-179.225.9-34.3000111.2
125T48.5Very low52.9Low140 Ų140126 Ų12686%0.85978%0.784SS**PPolyproline II helixtrans-69127.6173.636.50000110.5P123P123-T125 PolarHBondContact O-N 3.47Å
126L53.8Low52.3Low161 Ų161121 Ų12184%0.84378%0.781SS**PPolyproline II helixtrans-71.3142174.5-65.1173.2000110.1
127P60.3Low51.3Low103 Ų103119.9 Ų119.967%0.66979%0.789SS**PPolyproline II helixtrans-69.2143179.928.4-34.8000111.6S129P127-S129 PolarHBondContact O-N 3.39Å
128P45.8Very low50.7Low124 Ų124120.5 Ų120.581%0.80579%0.79SS**PPolyproline II helixtrans-64.4125.8174.427.5-33.7000110.2
129S36.9Very low50.5Low117 Ų117117.7 Ų117.782%0.81879%0.787SS**  trans-93.2108.4-179.6-63.30000110.8P127P127-S129 PolarHBondContact O-N 3.39Å
130S45.6Very low49.4Very low116 Ų116117 Ų11781%0.81179%0.79SS**  trans-124.4125.5175.8-62.80000111.1
131P49.5Very low48Very low128 Ų128121.4 Ų121.483%0.83180%0.798SS**  trans-115.7135156.134-24.6000112.2
132T41.6Very low46.9Very low132 Ų132125.2 Ų125.281%0.8180%0.802SS**  trans-72.2145.1-172.7-39.50000114.6
133N36.3Very low46.2Very low142 Ų142126.2 Ų126.276%0.75981%0.809SS**  trans-155.8143.9136.8-123.5-93.3000109.3G135N133-G135 PolarHBondContact OD1-N 3.08Å; N133-G135 VanDerWaalsContact OD1-N 3.12Å
134P43.4Very low45.1Very low122 Ų122130.9 Ų130.979%0.79282%0.818SS**  -144.4145.679.137.3-20.8000117
135G35.6Very low43.8Very low72 Ų72128.6 Ų128.674%0.74282%0.816SS**  trans99.5125.7139.300000118.2N133N133-G135 PolarHBondContact OD1-N 3.08Å; N133-G135 VanDerWaalsContact OD1-N 3.12Å
136G34.4Very low43.5Very low80 Ų80125.5 Ų125.583%0.82581%0.812SS**  trans159.1117.8164.600000116
137G34.1Very low44Very low81 Ų81123.9 Ų123.984%0.83581%0.812SS**  trans69.2100.4145.100000120.9
138V41.9Very low42.9Very low143 Ų143127 Ų12787%0.86782%0.823SS**  trans-80.2165.4147.8-77.20000109.5
139P52.9Low42.9Very low117 Ų117125.6 Ų125.676%0.7682%0.822SS**  cis-150.5167.93043.7-22.7000121.2
140A42Very low43.1Very low91 Ų91125.1 Ų125.175%0.75282%0.818SS**  trans59.3120.7140.700000122.9
141K41.3Very low43.3Very low209 Ų209125.7 Ų125.791%0.90982%0.822SS**  -163.4154.6106.2-102.7166.9-173.8177.10111.9
142K46.7Very low42.9Very low197 Ų197124.9 Ų124.986%0.85782%0.819SS**  trans-93159.5168.1-66.2-177.7179.1176.80109.5
143P51.2Low43Very low139 Ų139123.1 Ų123.190%0.90381%0.813SS**  -128.8-162.297.736.6-27.8000113.5
144K45.8Very low43.4Very low211 Ų211120.8 Ų120.892%0.91781%0.813SS**  trans-138.6134.5-160.4173.2-168.3179.6-173.10109.9
145G33.1Very low44Very low75 Ų75120.7 Ų120.777%0.77381%0.81SS**  trans-178.7124.7171.500000116.6
146G41.4Very low45Very low76 Ų76123.5 Ų123.578%0.78481%0.807SS**  trans73.9121.8145.700000119.7
147P63.6Low46.2Very low127 Ų127125 Ų12583%0.82580%0.804SS**  trans-95.2149.4164.236.5-30.6000111.9
148N37Very low47.7Very low168 Ų168128.8 Ų128.890%0.89880%0.798SS**  trans-156.2154139.9-136-26.8000112
149A47.6Very low49.4Very low95 Ų95129.3 Ų129.379%0.78579%0.791SS**  trans-89140.2-175.300000112.3
150S39.9Very low50.9Low107 Ų107127.5 Ų127.575%0.74877%0.774SS**  trans-145.9143.4155.559.20000109.1S152S150-S152 VanDerWaalsContact C-N 3.31Å; S150-S152 PolarHBondContact O-N 3.19Å
151S50.3Low52.9Low127 Ų127128.8 Ų128.889%0.88876%0.763SS**  trans-79.673.5-171.346.60000112.2S153S151-S153 VanDerWaalsContact C-N 3.34Å; S151-S153 PolarHBondContact O-N 3.46Å
152S41.5Very low55.1Low111 Ų111124 Ų12478%0.77675%0.753SS**  trans-64.697.2162.246.70000109.1S150 A154S150-S152 VanDerWaalsContact C-N 3.31Å; S150-S152 PolarHBondContact O-N 3.19Å; S152-A154 PolarHBondContact O-N 3.13Å; S152-A154 VanDerWaalsContact O-N 3.17Å
153S43Very low57Low96 Ų96123.7 Ų123.767%0.67175%0.747SS**  trans-46.8125.6168.6-179.20000108.6S151 T155S151-S153 VanDerWaalsContact C-N 3.34Å; S151-S153 PolarHBondContact O-N 3.46Å; S153-T155 PolarHBondContact O-N 3.21Å
154A45.6Very low58.7Low93 Ų93119.2 Ų119.277%0.76971%0.714SS**  trans-70.773.3179.500000109.7S152 I156S152-A154 PolarHBondContact O-N 3.13Å; S152-A154 VanDerWaalsContact O-N 3.17Å; A154-I156 VanDerWaalsContact C-N 3.27Å; A154-I156 PolarHBondContact O-N 3.24Å
155T54.9Low60.3Low119 Ų119114.5 Ų114.573%0.7369%0.694SS**  trans-68.190.4179.155.50000108.3S153 S157S153-T155 PolarHBondContact O-N 3.21Å; T155-S157 PolarHBondContact O-N 3.41Å
156I56.1Low62Low131 Ų131118 Ų11867%0.67269%0.69SS**  trans-37115.3170.8-75.7172.4000108.7A154 K158A154-I156 VanDerWaalsContact C-N 3.27Å; A154-I156 PolarHBondContact O-N 3.24Å; I156-K158 HydrophobicContact CG2-CB 4.11Å; I156-K158 HydrophobicContact CG2-CD 3.71Å; I156-K158 HydrophobicContact CG2-CG 3.59Å; I156-K158 PolarHBondContact O-N 3.3Å
157S59.5Low63.2Low111 Ų111118.5 Ų118.578%0.77668%0.682SS**  trans-74.847.8-179.745.80000111.6T155 Q159T155-S157 PolarHBondContact O-N 3.41Å; S157-Q159 PolarHBondContact O-N 3.38Å
158K65.4Low63.2Low162 Ų162119 Ų11970%0.70467%0.667SS**  trans-54.6108.2167.5-95.5162-176174.80107.5I156 I160I156-K158 HydrophobicContact CG2-CB 4.11Å; I156-K158 HydrophobicContact CG2-CD 3.71Å; I156-K158 HydrophobicContact CG2-CG 3.59Å; I156-K158 PolarHBondContact O-N 3.3Å; K158-I160 PolarHBondContact O-N 3.13Å
159Q78.3Confident64.2Low153 Ų153117.7 Ų117.772%0.71566%0.656SS**  trans-44.8113-176.8-68.7-67.5-1100110.3S157 F161S157-Q159 PolarHBondContact O-N 3.38Å; Q159-F161 VanDerWaalsContact C-N 3.29Å; Q159-F161 VanDerWaalsContact O-CD2 3.28Å; Q159-F161 WeakPolarHBondContact O-CD2 3.25Å; Q159-F161 PolarHBondContact O-N 2.92Å
160I84Confident64.5Low79 Ų79116.3 Ų116.341%0.40564%0.635SS.*  trans-80.186.6-177.5-52.8-179.7000107.7K158 M164 K165K158-I160 PolarHBondContact O-N 3.13Å; I160-M164 HydrophobicContact CG2-CB 4.09Å; I160-M164 HydrophobicContact CG2-CG 4.47Å; I160-K165 HydrophobicContact CG2-CG 3.71Å; I160-K165 WeakPolarHBondContact O-CE 3.49Å
161F85.2Confident65.4Low119 Ų119115.1 Ų115.152%0.52263%0.627SS.*  trans-48.2145174.7-60.9-76.4000111.1Q159 W163 M164Q159-F161 VanDerWaalsContact C-N 3.29Å; Q159-F161 VanDerWaalsContact O-CD2 3.28Å; Q159-F161 WeakPolarHBondContact O-CD2 3.25Å; Q159-F161 PolarHBondContact O-N 2.92Å; F161-W163 VanDerWaalsContact C-N 3.28Å; F161-W163 HydrophobicContact CB-CG 4.5Å; F161-W163 PolarHBondContact O-N 2.82Å; F161-W163 VanDerWaalsContact O-N 3.11Å; F161-M164 WeakPolarHBondContact O-CB 3.34Å; F161-M164 PolarHBondContact O-N 3.34Å
162P86.8Confident65.5Low107 Ų107118 Ų11870%0.69562%0.623SS**Hα-helixtrans-50.6-42.8-172.6-30.736.1000114.6M164 K165P162-M164 PolarHBondContact O-N 3.3Å; P162-M164 VanDerWaalsContact O-N 3.14Å; P162-K165 PolarHBondContact O-N 2.73Å
163W86Confident66.1Low192 Ų192118.3 Ų118.373%0.72761%0.613SS**Hα-helixtrans-60.9-22178.268.1-99.1000114.4F161F161-W163 VanDerWaalsContact C-N 3.28Å; F161-W163 HydrophobicContact CB-CG 4.5Å; F161-W163 PolarHBondContact O-N 2.82Å; F161-W163 VanDerWaalsContact O-N 3.11Å
164M87.5Confident66.3Low45 Ų45122.6 Ų122.622%0.22262%0.619CS.*Hα-helixtrans-90.7-13.4-177.7-160.9-174.3-68.800112.9I160 F161 P162 R168I160-M164 HydrophobicContact CG2-CB 4.09Å; I160-M164 HydrophobicContact CG2-CG 4.47Å; F161-M164 WeakPolarHBondContact O-CB 3.34Å; F161-M164 PolarHBondContact O-N 3.34Å; P162-M164 PolarHBondContact O-N 3.3Å; P162-M164 VanDerWaalsContact O-N 3.14Å; M164-R168 WeakPolarHBondContact O-CG 3.48Å; M164-R168 PolarHBondContact O-N 3.49Å; M164-R168 PolarHBondContact SD-NE 3.36Å; M164-R168 PolarHBondContact SD-NH2 2.73Å
165K79.1Confident66.2Low111 Ų111125.5 Ų125.548%0.48362%0.622SS.*Hα-helixtrans-67.7-48.8-176.2-65.6-175.2178.3-176.70112I160 P162 S167 R168 Q169I160-K165 HydrophobicContact CG2-CG 3.71Å; I160-K165 WeakPolarHBondContact O-CE 3.49Å; P162-K165 PolarHBondContact O-N 2.73Å; K165-S167 VanDerWaalsContact C-N 3.3Å; K165-S167 PolarHBondContact O-N 2.77Å; K165-R168 PolarHBondContact O-N 2.95Å; K165-Q169 PolarHBondContact O-N 3.06Å
166E70.3Confident65.6Low148 Ų148124.8 Ų124.869%0.69262%0.622SS**Hα-helixtrans-51.9-44.6179.6-167.362.4-148.400112.8R168E166-R168 PolarHBondContact O-N 3.15Å
167S66.1Low65.1Low88 Ų88124.4 Ų124.462%0.61563%0.629SS**Hα-helixtrans-69.3-30.7179.3-169.80000113K165K165-S167 VanDerWaalsContact C-N 3.3Å; K165-S167 PolarHBondContact O-N 2.77Å
168R63.3Low64.4Low136 Ų136123.8 Ų123.851%0.51363%0.631SS.*Hα-helixtrans-82.3-38.4-173.8-75.3179.8178.3-83.7-0.9113.9M164 K165 E166 N170 S171M164-R168 WeakPolarHBondContact O-CG 3.48Å; M164-R168 PolarHBondContact O-N 3.49Å; M164-R168 PolarHBondContact SD-NE 3.36Å; M164-R168 PolarHBondContact SD-NH2 2.73Å; K165-R168 PolarHBondContact O-N 2.95Å; E166-R168 PolarHBondContact O-N 3.15Å; R168-N170 PolarHBondContact O-N 3.35Å; R168-S171 PolarHBondContact O-N 3.34Å; R168-S171 VanDerWaalsContact O-N 3.08Å
169Q58.7Low63Low142 Ų142122.6 Ų122.666%0.66464%0.637SS**Hα-helixtrans-55.5-37.7171.3-80.5162.6-9800110.7K165 S171K165-Q169 PolarHBondContact O-N 3.06Å; Q169-S171 PolarHBondContact O-N 3.19Å
170N53.3Low61.1Low65 Ų65120.6 Ų120.635%0.34865%0.647SS.*Hα-helixtrans-73.6-0-179.4-147.7-16.6000114.8R168 K195R168-N170 PolarHBondContact O-N 3.35Å; N170-K195 PolarHBondContact O-NZ 3.49Å; N170-K195 WeakPolarHBondContact OD1-CD 3.42Å; N170-K195 WeakPolarHBondContact OD1-CE 3.35Å; N170-K195 VanDerWaalsContact OD1-CG 3.23Å; N170-K195 WeakPolarHBondContact OD1-CG 3.27Å; N170-K195 PolarHBondContact OD1-NZ 2.88Å
171S57.9Low59Low82 Ų82119.8 Ų119.857%0.57366%0.658SS**Hα-helixtrans-106-42.3178-172.10000112.6R168 Q169 Q173 K174R168-S171 PolarHBondContact O-N 3.34Å; R168-S171 VanDerWaalsContact O-N 3.08Å; Q169-S171 PolarHBondContact O-N 3.19Å; S171-Q173 PolarHBondContact O-N 2.79Å; S171-Q173 VanDerWaalsContact O-N 3.09Å; S171-K174 PolarHBondContact O-N 2.91Å
172K52.7Low56.9Low187 Ų187123.7 Ų123.781%0.81368%0.678SS**Hα-helixtrans-65-21.2-170.2-152.9174.2-175.4-176.20114.3
173Q54Low54.8Low119 Ų119124.5 Ų124.556%0.55669%0.686SS**G310 helixtrans-79.9-11.9175.6-73177-44.300115S171 N175 A193S171-Q173 PolarHBondContact O-N 2.79Å; S171-Q173 VanDerWaalsContact O-N 3.09Å; Q173-N175 PolarHBondContact O-N 3.11Å; Q173-A193 VanDerWaalsContact NE2-CB 3.34Å; Q173-A193 VanDerWaalsContact OE1-CB 3.23Å
174K47.9Very low52.5Low186 Ų186120.9 Ų120.981%0.80969%0.689SS**G310 helixtrans-79.4-4.3178.7-171.5160-179.3179.20113.2S171S171-K174 PolarHBondContact O-N 2.91Å
175N42.3Very low50.5Low153 Ų153128.1 Ų128.182%0.81872%0.722SS**G310 helixtrans-10618.9-170.1-139107.3000114.8Q173Q173-N175 PolarHBondContact O-N 3.11Å
176S43.9Very low48.8Very low105 Ų105128.3 Ų128.373%0.73473%0.728SS**SBendtrans-134.735.3-175.965.40000113.6
177C44.2Very low48Very low122 Ų122130.8 Ų130.882%0.82474%0.737SS**  trans-153.187.5174.5-178.30000109
178A44.9Very low47Very low99 Ų99131 Ų13182%0.81874%0.739SS**  trans-162.126.9-178.200000115
179T37.2Very low46.7Very low137 Ų137130.1 Ų130.184%0.8475%0.75SS**SBendtrans-157.412517419.80000111.1
180A38.2Very low46.6Very low110 Ų110129.6 Ų129.691%0.90976%0.759SS**  trans57.2158.4178.500000115.2
181G39.6Very low46.3Very low63 Ų63128.8 Ų128.865%0.64977%0.767SS**  cis141.1116.1-3.200000110.1
182E41.6Very low46.2Very low201 Ų201132 Ų13294%0.93979%0.785SS**  trans68.9167.9168-49.7-169.3133.100117.7
183S43.1Very low46.3Very low123 Ų123125.3 Ų125.386%0.8677%0.765SS**  trans-44.7133.4-162.9-169.90000118.1
184C37.1Very low46.5Very low116 Ų116124.7 Ų124.778%0.78477%0.774SS**  trans-155.4121.1152.8-172.10000111.4
185E46.2Very low47.4Very low197 Ų197121.5 Ų121.592%0.92176%0.76SS**  trans-107.7101.8168.6-175.4174.3124.100108.7
186D42.2Very low49.2Very low115 Ų115125.4 Ų125.462%0.61576%0.763SS**  trans-140.1150.1175.1175.3-112.2000112.4S188D186-S188 PolarHBondContact O-N 2.95Å; D186-S188 PolarHBondContact OD1-N 3.32Å; D186-S188 PolarHBondContact OD1-OG 3.45Å
187K52.8Low51.3Low201 Ų201126.3 Ų126.387%0.87476%0.764SS**  trans-9762-176.4-66.5-160.8177.1-175.70113.4
188S46.4Very low53.6Low93 Ų93131.9 Ų131.965%0.6577%0.768SS**  trans-76.5129.8167.9-75.20000112.2D186D186-S188 PolarHBondContact O-N 2.95Å; D186-S188 PolarHBondContact OD1-N 3.32Å; D186-S188 PolarHBondContact OD1-OG 3.45Å
189P55.4Low55.9Low116 Ų116132.8 Ų132.875%0.75376%0.763SS**  trans-63.4144176.9-22.533.5000113G191P189-G191 PolarHBondContact O-N 2.99Å
190P56.9Low58.7Low131 Ų131130.4 Ų130.485%0.85176%0.757SS**  trans-67.6104-179.527.1-34.2000111.4
191G48.5Very low61.6Low49 Ų49128.2 Ų128.251%0.50573%0.726SS.*  trans-57.7151.3-179.200000113.7P189 A193P189-G191 PolarHBondContact O-N 2.99Å; G191-A193 PolarHBondContact O-N 3.2Å
192P55.2Low64.4Low149 Ų149129 Ų12997%0.96872%0.718SS**THydrogen-bonded Turntrans-7215.2-161.929.5-38000116.2
193A54.9Low67.1Low46 Ų46124 Ų12438%0.3871%0.705SS.*THydrogen-bonded Turntrans-1135.6-171.900000114.8Q173 G191 K195Q173-A193 VanDerWaalsContact NE2-CB 3.34Å; Q173-A193 VanDerWaalsContact OE1-CB 3.23Å; G191-A193 PolarHBondContact O-N 3.2Å; A193-K195 PolarHBondContact O-N 3.28Å; A193-K195 VanDerWaalsContact O-N 3.08Å
194S58.5Low69.7Low107 Ų107121.3 Ų121.375%0.74869%0.691SS**  trans-64.5111.5173.1-172.20000110.5R196S194-R196 PolarHBondContact O-N 2.86Å; S194-R196 VanDerWaalsContact O-N 3.08Å
195K67Low72.6Confident119 Ų119117.3 Ų117.352%0.51766%0.661SS.*  trans-57.3116.2176.1-51.1-179.3-152-122.20107.9N170 A193 V197N170-K195 PolarHBondContact O-NZ 3.49Å; N170-K195 WeakPolarHBondContact OD1-CD 3.42Å; N170-K195 WeakPolarHBondContact OD1-CE 3.35Å; N170-K195 VanDerWaalsContact OD1-CG 3.23Å; N170-K195 WeakPolarHBondContact OD1-CG 3.27Å; N170-K195 PolarHBondContact OD1-NZ 2.88Å; A193-K195 PolarHBondContact O-N 3.28Å; A193-K195 VanDerWaalsContact O-N 3.08Å; K195-V197 PolarHBondContact O-N 3.41Å
196R78.8Confident75.1Confident234 Ų234111.3 Ų111.388%0.88363%0.634SS**  trans-58.4103.6-178.5-165.5-177.9-56.8-158.32.9110.1S194 R198S194-R196 PolarHBondContact O-N 2.86Å; S194-R196 VanDerWaalsContact O-N 3.08Å; R196-R198 PolarHBondContact O-N 3.02Å
197V88.8Confident77.8Confident124 Ų124109.9 Ų109.975%0.75263%0.63SS**  trans-58.5136.3-176.61790000109K195 T199K195-V197 PolarHBondContact O-N 3.41Å; V197-T199 PolarHBondContact O-N 3.33Å
198R91.8Very high80Confident239 Ų239103.2 Ų103.290%0.90260%0.602SS**  trans-83101.7178.3-68.9-175.1177.5-137.31.5109.3R196 A200R196-R198 PolarHBondContact O-N 3.02Å; R198-A200 PolarHBondContact O-N 3.29Å
199T93.4Very high82.5Confident119 Ų11998.8 Ų98.873%0.7357%0.571SS**PPolyproline II helixtrans-58.6125165.6-39.30000109.2V197V197-T199 PolarHBondContact O-N 3.33Å
200A96.2Very high84.5Confident86 Ų8696.4 Ų96.471%0.71155%0.55SS*.PPolyproline II helixtrans-79.5153.3169.400000110.2R198R198-A200 PolarHBondContact O-N 3.29Å
201Y98.3Very high86.5Confident65 Ų6595.5 Ų95.526%0.25553%0.532SS..PPolyproline II helixtrans-85.7146.9168.5-57.8-59.4000109.6L206 L233 Q237 W241Y201-L206 HydrophobicContact CD2-CD2 4.23Å; Y201-L233 HydrophobicContact CD1-CD1 3.8Å; Y201-L233 HydrophobicContact CD1-CD2 3.82Å; Y201-L233 HydrophobicContact CD1-CG 4.49Å; Y201-L233 HydrophobicContact CE1-CD1 3.75Å; Y201-L233 HydrophobicContact CE1-CD2 3.73Å; Y201-L233 HydrophobicContact CE1-CG 4.4Å; Y201-Q237 HydrophobicContact CE1-CB 4.34Å; Y201-Q237 HydrophobicContact CE1-CG 4.44Å; Y201-Q237 WeakPolarHBondContact OH-CB 3.44Å; Y201-W241 AromaticContact CD2-CD1 3.95Å; Y201-W241 AromaticContact CE2-CD1 3.76Å
202T98.6Very high88.9Confident78 Ų7893.8 Ų93.848%0.47951%0.511SS..PPolyproline II helixtrans-71.8161.5176.472.80000111.1A204 Q205 L206T202-A204 VanDerWaalsContact C-N 3.3Å; T202-A204 PolarHBondContact O-N 3.31Å; T202-Q205 PolarHBondContact O-N 3.37Å; T202-Q205 WeakPolarHBondContact OG1-CG 3.21Å; T202-Q205 PolarHBondContact OG1-N 3.46Å; T202-L206 WeakPolarHBondContact O-CG 3.39Å; T202-L206 PolarHBondContact O-N 2.99Å
203S98.4Very high91Very high96 Ų9686.7 Ų86.767%0.67147%0.465SS*.Hα-helixtrans-57.1-44.6176.5-167.50000111.7Q205 L206 V207S203-Q205 PolarHBondContact O-N 3.08Å; S203-L206 PolarHBondContact O-N 3.06Å; S203-L206 VanDerWaalsContact O-N 3.13Å; S203-V207 WeakPolarHBondContact O-CG2 3.4Å; S203-V207 PolarHBondContact O-N 3.09Å
204A98.3Very high93Very high68 Ų6889.8 Ų89.856%0.56247%0.472SS*.Hα-helixtrans-61-43.2176.900000112.9T202 L206 V207 E208T202-A204 VanDerWaalsContact C-N 3.3Å; T202-A204 PolarHBondContact O-N 3.31Å; A204-L206 VanDerWaalsContact C-N 3.3Å; A204-L206 PolarHBondContact O-N 3.06Å; A204-V207 PolarHBondContact O-N 2.76Å; A204-E208 PolarHBondContact O-N 3.47Å; A204-E208 VanDerWaalsContact O-N 3.13Å
205Q98.6Very high94.9Very high31 Ų3192.5 Ų92.515%0.14547%0.47CS..Hα-helixtrans-59.6-41.4173.8-74.8172.9-23.600111.6T202 S203 L209 L231T202-Q205 PolarHBondContact O-N 3.37Å; T202-Q205 WeakPolarHBondContact OG1-CG 3.21Å; T202-Q205 PolarHBondContact OG1-N 3.46Å; S203-Q205 PolarHBondContact O-N 3.08Å; Q205-L209 VanDerWaalsContact O-CB 3.31Å; Q205-L209 WeakPolarHBondContact O-CB 3Å; Q205-L209 VanDerWaalsContact O-CD1 3.31Å; Q205-L209 WeakPolarHBondContact O-CD1 3.09Å; Q205-L209 WeakPolarHBondContact O-CG 3.1Å; Q205-L209 PolarHBondContact O-N 3.08Å; Q205-L209 VanDerWaalsContact O-N 3.08Å; Q205-L231 HydrophobicContact CG-CB 4.35Å; Q205-L231 PolarHBondContact NE2-O 3.5Å
206L98.5Very high96.4Very high71 Ų7190.1 Ų90.137%0.37246%0.463SS..Hα-helixtrans-67.6-40.3178-67.9174.9000112.3Y201 T202 S203 A204 L209 E210Y201-L206 HydrophobicContact CD2-CD2 4.23Å; T202-L206 WeakPolarHBondContact O-CG 3.39Å; T202-L206 PolarHBondContact O-N 2.99Å; S203-L206 PolarHBondContact O-N 3.06Å; S203-L206 VanDerWaalsContact O-N 3.13Å; A204-L206 VanDerWaalsContact C-N 3.3Å; A204-L206 PolarHBondContact O-N 3.06Å; L206-L209 PolarHBondContact O-N 3.49Å; L206-E210 WeakPolarHBondContact O-CB 3.44Å; L206-E210 WeakPolarHBondContact O-CG 3.45Å; L206-E210 PolarHBondContact O-N 2.94Å
207V98.6Very high97.3Very high86 Ų8682.6 Ų82.652%0.52143%0.434SS..Hα-helixtrans-61.3-49.4178169.10000111.4S203 A204 L209 E210 K211S203-V207 WeakPolarHBondContact O-CG2 3.4Å; S203-V207 PolarHBondContact O-N 3.09Å; A204-V207 PolarHBondContact O-N 2.76Å; V207-L209 PolarHBondContact O-N 3.44Å; V207-E210 PolarHBondContact O-N 3.08Å; V207-K211 VanDerWaalsContact O-CB 3.3Å; V207-K211 WeakPolarHBondContact O-CB 3.49Å; V207-K211 PolarHBondContact O-N 2.83Å
208E98.6Very high97.8Very high60 Ų6084.1 Ų84.128%0.2843%0.428SS..Hα-helixtrans-67.4-35.9178.7-72.2-65.1123.700112.4A204 K211 E212 L231A204-E208 PolarHBondContact O-N 3.47Å; A204-E208 VanDerWaalsContact O-N 3.13Å; E208-K211 PolarHBondContact O-N 2.69Å; E208-K211 WeakPolarHBondContact OE1-CD 3.3Å; E208-K211 IonicContact OE1-NZ 2.71Å; E208-K211 PolarHBondContact OE1-NZ 2.98Å; E208-K211 WeakPolarHBondContact OE2-CD 3.45Å; E208-K211 IonicContact OE2-NZ 2.68Å; E208-K211 PolarHBondContact OE2-NZ 3.39Å; E208-E212 WeakPolarHBondContact O-CB 3.5Å; E208-E212 PolarHBondContact O-N 3.23Å; E208-L231 HydrophobicContact CB-CD1 4.36Å; E208-L231 HydrophobicContact CB-CD2 3.68Å; E208-L231 HydrophobicContact CG-CD2 4.14Å
209L98.7Very high98.1Very high0 Ų073.6 Ų73.60%039%0.39CS..Hα-helixtrans-65.9-37.7172.8-73.1167.9000112.8Q205 L206 V207 F213 L231 L233 I238 W241 F242Q205-L209 VanDerWaalsContact O-CB 3.31Å; Q205-L209 WeakPolarHBondContact O-CB 3Å; Q205-L209 VanDerWaalsContact O-CD1 3.31Å; Q205-L209 WeakPolarHBondContact O-CD1 3.09Å; Q205-L209 WeakPolarHBondContact O-CG 3.1Å; Q205-L209 PolarHBondContact O-N 3.08Å; Q205-L209 VanDerWaalsContact O-N 3.08Å; L206-L209 PolarHBondContact O-N 3.49Å; V207-L209 PolarHBondContact O-N 3.44Å; L209-F213 WeakPolarHBondContact O-CB 3.37Å; L209-F213 PolarHBondContact O-N 2.84Å; L209-L231 HydrophobicContact CD1-CD1 4.37Å; L209-L231 HydrophobicContact CD2-CD1 3.79Å; L209-L231 HydrophobicContact CG-CD1 3.66Å; L209-L233 HydrophobicContact CD1-CD1 4.2Å; L209-I238 HydrophobicContact CD2-CD1 3.84Å; L209-W241 VanDerWaalsContact C-CH2 3.46Å; L209-W241 HydrophobicContact CB-CD2 3.97Å; L209-W241 HydrophobicContact CB-CE3 4Å; L209-W241 HydrophobicContact CB-CH2 3.69Å; L209-W241 HydrophobicContact CB-CZ2 3.63Å; L209-W241 HydrophobicContact CB-CZ3 3.86Å; L209-W241 HydrophobicContact CD1-CD2 3.95Å; L209-W241 HydrophobicContact CD1-CG 3.89Å; L209-W241 HydrophobicContact CD2-CD2 4.37Å; L209-W241 HydrophobicContact CD2-CE3 4.27Å; L209-W241 HydrophobicContact CG-CD2 4.33Å; L209-W241 WeakPolarHBondContact O-CH2 3.43Å; L209-W241 WeakPolarHBondContact O-CZ3 3.21Å; L209-F242 HydrophobicContact CD2-CE2 3.95Å
210E98.6Very high98.3Very high67 Ų6771.4 Ų71.431%0.31338%0.378SS..Hα-helixtrans-67.6-47173.5-64.5-105.9124.600110.5L206 V207 E212 F213 H214 W241 R245L206-E210 WeakPolarHBondContact O-CB 3.44Å; L206-E210 WeakPolarHBondContact O-CG 3.45Å; L206-E210 PolarHBondContact O-N 2.94Å; V207-E210 PolarHBondContact O-N 3.08Å; E210-E212 PolarHBondContact O-N 3.39Å; E210-F213 CarbonylContact O-C 3.37Å; E210-F213 WeakPolarHBondContact O-CA 3.36Å; E210-F213 WeakPolarHBondContact O-CB 3.12Å; E210-F213 PolarHBondContact O-N 2.99Å; E210-F213 VanDerWaalsContact O-N 3.08Å; E210-H214 PolarHBondContact O-CD2 3.35Å; E210-H214 PolarHBondContact O-N 2.85Å; E210-W241 HydrophobicContact CG-CH2 4.25Å; E210-W241 HydrophobicContact CG-CZ2 4.21Å; E210-R245 VanDerWaalsContact CD-NH2 3.3Å; E210-R245 IonicContact OE1-CZ 2.77Å; E210-R245 IonicContact OE1-NE 3.73Å; E210-R245 PolarHBondContact OE1-NE 2.91Å; E210-R245 IonicContact OE1-NH2 2.73Å; E210-R245 PolarHBondContact OE1-NH2 3.45Å; E210-R245 IonicContact OE2-NH2 3.76Å; E210-R245 PolarHBondContact OE2-NH2 3.25Å
211K98.6Very high98.4Very high112 Ų11274 Ų7449%0.48737%0.37SS..Hα-helixtrans-54.3-51.6176.2172.4-170172.9-165.50112.3V207 E208 F213 H214 F215V207-K211 VanDerWaalsContact O-CB 3.3Å; V207-K211 WeakPolarHBondContact O-CB 3.49Å; V207-K211 PolarHBondContact O-N 2.83Å; E208-K211 PolarHBondContact O-N 2.69Å; E208-K211 WeakPolarHBondContact OE1-CD 3.3Å; E208-K211 IonicContact OE1-NZ 2.71Å; E208-K211 PolarHBondContact OE1-NZ 2.98Å; E208-K211 WeakPolarHBondContact OE2-CD 3.45Å; E208-K211 IonicContact OE2-NZ 2.68Å; E208-K211 PolarHBondContact OE2-NZ 3.39Å; K211-F213 VanDerWaalsContact C-N 3.33Å; K211-F213 PolarHBondContact O-N 3.23Å; K211-H214 WeakPolarHBondContact O-CB 3.47Å; K211-H214 PolarHBondContact O-N 2.94Å; K211-F215 PolarHBondContact O-N 3.18Å
212E98.6Very high98.4Very high12 Ų1274.9 Ų74.96%0.05638%0.383CS..Hα-helixtrans-62.8-39.1173.7-78-67.2117.900112.3E208 E210 H214 F215 N216 R223 M227 F242E208-E212 WeakPolarHBondContact O-CB 3.5Å; E208-E212 PolarHBondContact O-N 3.23Å; E210-E212 PolarHBondContact O-N 3.39Å; E212-H214 PolarHBondContact O-N 3.49Å; E212-F215 PolarHBondContact O-N 3.03Å; E212-N216 PolarHBondContact O-N 2.86Å; E212-N216 VanDerWaalsContact O-O 3.08Å; E212-R223 VanDerWaalsContact CD-NH2 3.28Å; E212-R223 IonicContact OE1-CZ 3.65Å; E212-R223 IonicContact OE1-NE 2.94Å; E212-R223 IonicContact OE1-NH2 2.73Å; E212-R223 PolarHBondContact OE1-NH2 3.32Å; E212-R223 IonicContact OE2-CZ 3.45Å; E212-R223 IonicContact OE2-NE 3.18Å; E212-R223 PolarHBondContact OE2-NE 2.99Å; E212-R223 IonicContact OE2-NH2 3.3Å; E212-R223 PolarHBondContact OE2-NH2 2.93Å; E212-M227 HydrophobicContact CG-CE 3.65Å; E212-M227 HydrophobicContact CG-CG 4.04Å; E212-M227 HydrophobicContact CG-SD 3.62Å; E212-F242 HydrophobicContact CB-CZ 4.05Å
213F98.7Very high98.4Very high1 Ų174.8 Ų74.80%0.00437%0.374CS..Hα-helixtrans-67.4-22.6173.4-177.7-99.2000113L209 E210 K211 R217 W241 F242 R245 R246 Y249L209-F213 WeakPolarHBondContact O-CB 3.37Å; L209-F213 PolarHBondContact O-N 2.84Å; E210-F213 CarbonylContact O-C 3.37Å; E210-F213 WeakPolarHBondContact O-CA 3.36Å; E210-F213 WeakPolarHBondContact O-CB 3.12Å; E210-F213 PolarHBondContact O-N 2.99Å; E210-F213 VanDerWaalsContact O-N 3.08Å; K211-F213 VanDerWaalsContact C-N 3.33Å; K211-F213 PolarHBondContact O-N 3.23Å; F213-R217 HydrophobicContact CE2-CB 3.97Å; F213-R217 HydrophobicContact CZ-CB 4.44Å; F213-R217 WeakPolarHBondContact O-CD 3.5Å; F213-R217 PolarHBondContact O-NE 3.48Å; F213-W241 HydrophobicContact CB-CH2 4.21Å; F213-W241 HydrophobicContact CB-CZ3 3.92Å; F213-W241 HydrophobicContact CG-CZ3 4.39Å; F213-F242 HydrophobicContact CB-CE1 4Å; F213-F242 HydrophobicContact CB-CZ 4.12Å; F213-F242 AromaticContact CD2-CD1 3.97Å; F213-F242 HydrophobicContact CD2-CD1 3.97Å; F213-F242 AromaticContact CD2-CE1 3.85Å; F213-F242 HydrophobicContact CD2-CE1 3.85Å; F213-F242 HydrophobicContact CG-CE1 4.45Å; F213-R245 HydrophobicContact CB-CG 4.38Å; F213-R245 HydrophobicContact CD1-CG 3.54Å; F213-R245 HydrophobicContact CD2-CB 4.3Å; F213-R245 HydrophobicContact CD2-CG 3.85Å; F213-R245 HydrophobicContact CE1-CG 3.72Å; F213-R245 HydrophobicContact CE2-CB 4.39Å; F213-R245 HydrophobicContact CE2-CG 4.02Å; F213-R245 HydrophobicContact CG-CB 4.49Å; F213-R245 HydrophobicContact CG-CG 3.61Å; F213-R245 HydrophobicContact CZ-CG 3.95Å; F213-R246 HydrophobicContact CE2-CG 3.75Å; F213-R246 HydrophobicContact CZ-CG 4.35Å; F213-Y249 HydrophobicContact CE1-CD2 4.12Å; F213-Y249 HydrophobicContact CE1-CG 4.22Å; F213-Y249 HydrophobicContact CZ-CD2 4.4Å; F213-Y249 HydrophobicContact CZ-CG 4.06Å
214H98.3Very high98.4Very high111 Ų11172.6 Ų72.651%0.51435%0.351SS..Hα-helixtrans-75.5-43.4171.7-88.3-88.7000110.8E210 K211 E212 R217E210-H214 PolarHBondContact O-CD2 3.35Å; E210-H214 PolarHBondContact O-N 2.85Å; K211-H214 WeakPolarHBondContact O-CB 3.47Å; K211-H214 PolarHBondContact O-N 2.94Å; E212-H214 PolarHBondContact O-N 3.49Å; H214-R217 PolarHBondContact O-NE 2.72Å; H214-R217 PolarHBondContact O-NH2 2.74Å; H214-R217 VanDerWaalsContact O-NH2 3.09Å
215F98.2Very high98.4Very high164 Ų16471.7 Ų71.772%0.71934%0.339SS*.Hα-helixtrans-62.2-52.7175.7-179.9-109.5000113.2K211 E212K211-F215 PolarHBondContact O-N 3.18Å; E212-F215 PolarHBondContact O-N 3.03Å
216N97.8Very high98.4Very high68 Ų6874 Ų7436%0.36435%0.349SS..  trans-142.2127.7178.3-175.5-10.2000111.8E212 Y218E212-N216 PolarHBondContact O-N 2.86Å; E212-N216 VanDerWaalsContact O-O 3.08Å; N216-Y218 VanDerWaalsContact C-N 3.26Å; N216-Y218 PolarHBondContact ND2-O 2.65Å; N216-Y218 PolarHBondContact O-N 3.22Å; N216-Y218 PolarHBondContact OD1-N 3.01Å; N216-Y218 PolarHBondContact OD1-O 3.29Å
217R98Very high98.4Very high76 Ų7670.8 Ų70.829%0.28733%0.332SS..SBendtrans-75.9-13.1-176.2-43.2-49.6164.1110.8-12.5113.3F213 H214 R246F213-R217 HydrophobicContact CE2-CB 3.97Å; F213-R217 HydrophobicContact CZ-CB 4.44Å; F213-R217 WeakPolarHBondContact O-CD 3.5Å; F213-R217 PolarHBondContact O-NE 3.48Å; H214-R217 PolarHBondContact O-NE 2.72Å; H214-R217 PolarHBondContact O-NH2 2.74Å; H214-R217 VanDerWaalsContact O-NH2 3.09Å; R217-R246 VanDerWaalsContact O-CD 3.28Å; R217-R246 WeakPolarHBondContact O-CD 3.42Å
218Y98.4Very high98.4Very high156 Ų15667 Ų6761%0.61231%0.311SS*.SBendtrans-140.5107.8-173.9-64.2-109.1000111.4N216N216-Y218 VanDerWaalsContact C-N 3.26Å; N216-Y218 PolarHBondContact ND2-O 2.65Å; N216-Y218 PolarHBondContact O-N 3.22Å; N216-Y218 PolarHBondContact OD1-N 3.01Å; N216-Y218 PolarHBondContact OD1-O 3.29Å
219L98.3Very high98.4Very high19 Ų1969.5 Ų69.510%0.09933%0.326CS..  trans-78.8125.2178.5-58.2-171.1000113.5R223 R224 M227 I238 F242L219-R223 HydrophobicContact CD2-CG 3.98Å; L219-R224 PolarHBondContact O-NH2 2.83Å; L219-M227 HydrophobicContact CD1-CG 4.48Å; L219-I238 HydrophobicContact CD1-CG2 3.78Å; L219-F242 HydrophobicContact CD1-CD2 4Å; L219-F242 HydrophobicContact CD1-CE1 4.2Å; L219-F242 HydrophobicContact CD1-CE2 3.58Å; L219-F242 HydrophobicContact CD1-CG 4.49Å; L219-F242 HydrophobicContact CD1-CZ 3.7Å; L219-F242 HydrophobicContact CD2-CE1 3.94Å; L219-F242 HydrophobicContact CD2-CZ 3.93Å; L219-F242 HydrophobicContact CG-CD1 4.01Å; L219-F242 HydrophobicContact CG-CD2 4.3Å; L219-F242 HydrophobicContact CG-CE1 3.68Å; L219-F242 HydrophobicContact CG-CE2 4Å; L219-F242 HydrophobicContact CG-CG 4.31Å; L219-F242 HydrophobicContact CG-CZ 3.69Å
220C98.3Very high98.4Very high73 Ų7375 Ų7549%0.49336%0.355SS..  trans-63.2176166.563.80000112.2R224C220-R224 WeakPolarHBondContact O-CB 3.21Å; C220-R224 PolarHBondContact O-N 3.17Å
221R98.3Very high98.4Very high141 Ų14172.6 Ų72.653%0.53234%0.344SS..Hα-helixtrans-67-43.3-176.5-176.567.8178.990.5-17113.6E235R221-E235 IonicContact CZ-OE1 3.03Å; R221-E235 IonicContact CZ-OE2 3.8Å; R221-E235 IonicContact NE-OE2 3.16Å; R221-E235 IonicContact NH1-OE1 2.86Å; R221-E235 PolarHBondContact NH1-OE1 3.04Å; R221-E235 IonicContact NH1-OE2 3.06Å; R221-E235 PolarHBondContact NH1-OE2 2.9Å; R221-E235 IonicContact NH2-OE1 2.65Å; R221-E235 PolarHBondContact NH2-OE1 3.23Å; R221-E235 IonicContact NH2-OE2 2.74Å; R221-E235 PolarHBondContact NH2-OE2 2.79Å
222P98.4Very high98.4Very high83 Ų8374.4 Ų74.454%0.53936%0.359SS..Hα-helixtrans-67.2-53.4177.7-22.935.5000113.1R224 V225 E226P222-R224 PolarHBondContact O-N 3.32Å; P222-V225 WeakPolarHBondContact O-CA 3.31Å; P222-V225 WeakPolarHBondContact O-CB 3.34Å; P222-V225 PolarHBondContact O-N 3.28Å; P222-E226 VanDerWaalsContact C-OE1 3.29Å; P222-E226 PolarHBondContact O-N 2.82Å
223R98.5Very high98.4Very high75 Ų7574.5 Ų74.528%0.28336%0.36SS..Hα-helixtrans-57.5-26.2-178.6-169.555.9170.5-172.2-2.5113.8E212 L219 E226 M227E212-R223 VanDerWaalsContact CD-NH2 3.28Å; E212-R223 IonicContact OE1-CZ 3.65Å; E212-R223 IonicContact OE1-NE 2.94Å; E212-R223 IonicContact OE1-NH2 2.73Å; E212-R223 PolarHBondContact OE1-NH2 3.32Å; E212-R223 IonicContact OE2-CZ 3.45Å; E212-R223 IonicContact OE2-NE 3.18Å; E212-R223 PolarHBondContact OE2-NE 2.99Å; E212-R223 IonicContact OE2-NH2 3.3Å; E212-R223 PolarHBondContact OE2-NH2 2.93Å; L219-R223 HydrophobicContact CD2-CG 3.98Å; R223-E226 WeakPolarHBondContact CA-OE1 3.33Å; R223-E226 WeakPolarHBondContact CD-OE2 3.49Å; R223-E226 IonicContact CZ-OE2 3.63Å; R223-E226 PolarHBondContact N-OE1 3.25Å; R223-E226 IonicContact NE-OE2 3.49Å; R223-E226 IonicContact NH1-OE2 3.83Å; R223-E226 PolarHBondContact NH1-OE2 3Å; R223-M227 WeakPolarHBondContact O-CB 3.31Å; R223-M227 PolarHBondContact O-N 3.44Å
224R98.7Very high98.4Very high51 Ų5178.1 Ų78.119%0.19238%0.382CS..Hα-helixtrans-71.1-31.7173.2-163-173.9-53.4136.59.7113.5L219 C220 P222 A228 E235 I238L219-R224 PolarHBondContact O-NH2 2.83Å; C220-R224 WeakPolarHBondContact O-CB 3.21Å; C220-R224 PolarHBondContact O-N 3.17Å; P222-R224 PolarHBondContact O-N 3.32Å; R224-A228 WeakPolarHBondContact O-CB 3.48Å; R224-A228 PolarHBondContact O-N 3.16Å; R224-E235 HydrophobicContact CG-CB 4.35Å; R224-E235 HydrophobicContact CG-CG 4.19Å; R224-E235 IonicContact NH1-OE2 2.72Å; R224-I238 HydrophobicContact CG-CB 4.03Å; R224-I238 HydrophobicContact CG-CG2 3.81Å
225V98.7Very high98.4Very high49 Ų4975.4 Ų75.430%0.29737%0.369SS..Hα-helixtrans-71.3-46.5173-178.40000109.8P222 M227 A228 N229P222-V225 WeakPolarHBondContact O-CA 3.31Å; P222-V225 WeakPolarHBondContact O-CB 3.34Å; P222-V225 PolarHBondContact O-N 3.28Å; V225-M227 VanDerWaalsContact C-N 3.31Å; V225-M227 PolarHBondContact O-N 2.98Å; V225-A228 WeakPolarHBondContact O-CB 3.38Å; V225-A228 PolarHBondContact O-N 2.94Å; V225-A228 VanDerWaalsContact O-N 3.11Å; V225-N229 WeakPolarHBondContact O-CB 2.85Å; V225-N229 VanDerWaalsContact O-CG 3.24Å; V225-N229 PolarHBondContact O-N 3.45Å; V225-N229 PolarHBondContact O-OD1 2.78Å
226E98.6Very high98.4Very high78 Ų7876 Ų7636%0.36437%0.367SS..Hα-helixtrans-53.1-50.1175.2-64.8155.7-126.800110.7P222 R223 N229 L230P222-E226 VanDerWaalsContact C-OE1 3.29Å; P222-E226 PolarHBondContact O-N 2.82Å; R223-E226 WeakPolarHBondContact CA-OE1 3.33Å; R223-E226 WeakPolarHBondContact CD-OE2 3.49Å; R223-E226 IonicContact CZ-OE2 3.63Å; R223-E226 PolarHBondContact N-OE1 3.25Å; R223-E226 IonicContact NE-OE2 3.49Å; R223-E226 IonicContact NH1-OE2 3.83Å; R223-E226 PolarHBondContact NH1-OE2 3Å; E226-N229 PolarHBondContact O-N 3.4Å; E226-L230 WeakPolarHBondContact O-CB 3.38Å; E226-L230 WeakPolarHBondContact O-CD1 3.28Å; E226-L230 VanDerWaalsContact O-CG 3.25Å; E226-L230 WeakPolarHBondContact O-CG 3.47Å; E226-L230 PolarHBondContact O-N 2.86Å
227M98.6Very high98.4Very high4 Ų475.1 Ų75.12%0.0236%0.361CS..Hα-helixtrans-73.1-24.2178-72.8-61.4141.800115.1E212 L219 R223 V225 L230 L231 I238E212-M227 HydrophobicContact CG-CE 3.65Å; E212-M227 HydrophobicContact CG-CG 4.04Å; E212-M227 HydrophobicContact CG-SD 3.62Å; L219-M227 HydrophobicContact CD1-CG 4.48Å; R223-M227 WeakPolarHBondContact O-CB 3.31Å; R223-M227 PolarHBondContact O-N 3.44Å; V225-M227 VanDerWaalsContact C-N 3.31Å; V225-M227 PolarHBondContact O-N 2.98Å; M227-L230 HydrophobicContact CE-CD1 3.64Å; M227-L230 HydrophobicContact SD-CD1 4.34Å; M227-L231 WeakPolarHBondContact O-CB 3.49Å; M227-L231 WeakPolarHBondContact O-CG 3.39Å; M227-L231 PolarHBondContact O-N 3.22Å; M227-L231 HydrophobicContact SD-CD1 4.43Å; M227-I238 HydrophobicContact CB-CD1 4.39Å
228A98.6Very high98.4Very high8 Ų871.6 Ų71.67%0.06635%0.347CS..Hα-helixtrans-66.5-47.2169.900000110.5R224 V225 N232 L233 E235 I238R224-A228 WeakPolarHBondContact O-CB 3.48Å; R224-A228 PolarHBondContact O-N 3.16Å; V225-A228 WeakPolarHBondContact O-CB 3.38Å; V225-A228 PolarHBondContact O-N 2.94Å; V225-A228 VanDerWaalsContact O-N 3.11Å; A228-N232 WeakPolarHBondContact O-CA 3.27Å; A228-N232 PolarHBondContact O-N 3Å; A228-N232 VanDerWaalsContact O-N 3.15Å; A228-L233 CarbonylContact C-O 3.38Å; A228-L233 WeakPolarHBondContact CA-O 3.13Å; A228-L233 WeakPolarHBondContact CB-O 3.43Å; A228-L233 PolarHBondContact O-N 3.02Å; A228-L233 VanDerWaalsContact O-O 3.05Å; A228-E235 HydrophobicContact CB-CG 4.06Å; A228-I238 HydrophobicContact CB-CG1 4.28Å
229N98.5Very high98.4Very high111 Ų11170.4 Ų70.459%0.59435%0.345SS*.Hα-helixtrans-68.5-50.6-178.2-65.1-6.1000111.7V225 E226 L231 N232V225-N229 WeakPolarHBondContact O-CB 2.85Å; V225-N229 VanDerWaalsContact O-CG 3.24Å; V225-N229 PolarHBondContact O-N 3.45Å; V225-N229 PolarHBondContact O-OD1 2.78Å; E226-N229 PolarHBondContact O-N 3.4Å; N229-L231 PolarHBondContact O-N 2.83Å; N229-N232 PolarHBondContact O-N 3.43Å
230L98.1Very high98.4Very high117 Ų11772.6 Ų72.661%0.61336%0.356SS*.Hα-helixtrans-61.7-26.2-177.3-74.6166.7000114E226 M227E226-L230 WeakPolarHBondContact O-CB 3.38Å; E226-L230 WeakPolarHBondContact O-CD1 3.28Å; E226-L230 VanDerWaalsContact O-CG 3.25Å; E226-L230 WeakPolarHBondContact O-CG 3.47Å; E226-L230 PolarHBondContact O-N 2.86Å; M227-L230 HydrophobicContact CE-CD1 3.64Å; M227-L230 HydrophobicContact SD-CD1 4.34Å
231L98.2Very high98.5Very high15 Ų1570.3 Ų70.38%0.07934%0.337CS..THydrogen-bonded Turntrans-109.61.5-176.6-55.3-177.2000113.4Q205 E208 L209 M227 N229 L233 I238Q205-L231 HydrophobicContact CG-CB 4.35Å; Q205-L231 PolarHBondContact NE2-O 3.5Å; E208-L231 HydrophobicContact CB-CD1 4.36Å; E208-L231 HydrophobicContact CB-CD2 3.68Å; E208-L231 HydrophobicContact CG-CD2 4.14Å; L209-L231 HydrophobicContact CD1-CD1 4.37Å; L209-L231 HydrophobicContact CD2-CD1 3.79Å; L209-L231 HydrophobicContact CG-CD1 3.66Å; M227-L231 WeakPolarHBondContact O-CB 3.49Å; M227-L231 WeakPolarHBondContact O-CG 3.39Å; M227-L231 PolarHBondContact O-N 3.22Å; M227-L231 HydrophobicContact SD-CD1 4.43Å; N229-L231 PolarHBondContact O-N 2.83Å; L231-L233 VanDerWaalsContact C-N 3.26Å; L231-L233 HydrophobicContact CB-CD1 4.29Å; L231-L233 HydrophobicContact CB-CG 4.18Å; L231-L233 PolarHBondContact O-N 3.08Å; L231-I238 HydrophobicContact CD1-CD1 4.35Å
232N98.4Very high98.5Very high150 Ų15064 Ų6480%0.80231%0.314SS*.THydrogen-bonded Turntrans51.441.8-172.1-51.2104.7000113.3A228 N229A228-N232 WeakPolarHBondContact O-CA 3.27Å; A228-N232 PolarHBondContact O-N 3Å; A228-N232 VanDerWaalsContact O-N 3.15Å; N229-N232 PolarHBondContact O-N 3.43Å
233L98.1Very high98.5Very high15 Ų1564.2 Ų64.28%0.07931%0.308CS..  trans-118.5146.1178.9-65.9-176.9000110.6Y201 L209 A228 L231 Q237 I238Y201-L233 HydrophobicContact CD1-CD1 3.8Å; Y201-L233 HydrophobicContact CD1-CD2 3.82Å; Y201-L233 HydrophobicContact CD1-CG 4.49Å; Y201-L233 HydrophobicContact CE1-CD1 3.75Å; Y201-L233 HydrophobicContact CE1-CD2 3.73Å; Y201-L233 HydrophobicContact CE1-CG 4.4Å; L209-L233 HydrophobicContact CD1-CD1 4.2Å; A228-L233 CarbonylContact C-O 3.38Å; A228-L233 WeakPolarHBondContact CA-O 3.13Å; A228-L233 WeakPolarHBondContact CB-O 3.43Å; A228-L233 PolarHBondContact O-N 3.02Å; A228-L233 VanDerWaalsContact O-O 3.05Å; L231-L233 VanDerWaalsContact C-N 3.26Å; L231-L233 HydrophobicContact CB-CD1 4.29Å; L231-L233 HydrophobicContact CB-CG 4.18Å; L231-L233 PolarHBondContact O-N 3.08Å; L233-Q237 HydrophobicContact CB-CB 4.3Å; L233-I238 HydrophobicContact CB-CD1 3.93Å; L233-I238 HydrophobicContact CB-CG1 4.4Å; L233-I238 HydrophobicContact CD1-CD1 4.02Å
234T98.6Very high98.5Very high77 Ų7765.5 Ų65.547%0.47232%0.32SS..  trans-65.6148.117363.60000111.2R236 Q237 I238T234-R236 PolarHBondContact O-N 3.43Å; T234-Q237 WeakPolarHBondContact O-CA 3.22Å; T234-Q237 WeakPolarHBondContact O-CB 3.34Å; T234-Q237 PolarHBondContact O-N 3.08Å; T234-Q237 WeakPolarHBondContact OG1-CG 3.47Å; T234-Q237 PolarHBondContact OG1-N 2.94Å; T234-Q237 PolarHBondContact OG1-OE1 3.22Å; T234-I238 PolarHBondContact O-N 2.82Å; T234-I238 VanDerWaalsContact O-N 3.08Å
235E98.6Very high98.5Very high54 Ų5464.3 Ų64.325%0.25232%0.316SS..Hα-helixtrans-49.8-31.6170.6-79.4-164.8-119.200113.3R221 R224 A228 I238 K239R221-E235 IonicContact CZ-OE1 3.03Å; R221-E235 IonicContact CZ-OE2 3.8Å; R221-E235 IonicContact NE-OE2 3.16Å; R221-E235 IonicContact NH1-OE1 2.86Å; R221-E235 PolarHBondContact NH1-OE1 3.04Å; R221-E235 IonicContact NH1-OE2 3.06Å; R221-E235 PolarHBondContact NH1-OE2 2.9Å; R221-E235 IonicContact NH2-OE1 2.65Å; R221-E235 PolarHBondContact NH2-OE1 3.23Å; R221-E235 IonicContact NH2-OE2 2.74Å; R221-E235 PolarHBondContact NH2-OE2 2.79Å; R224-E235 HydrophobicContact CG-CB 4.35Å; R224-E235 HydrophobicContact CG-CG 4.19Å; R224-E235 IonicContact NH1-OE2 2.72Å; A228-E235 HydrophobicContact CB-CG 4.06Å; E235-I238 PolarHBondContact O-N 3.33Å; E235-K239 VanDerWaalsContact O-CB 3.27Å; E235-K239 WeakPolarHBondContact O-CB 3.38Å; E235-K239 PolarHBondContact O-N 3.28Å
236R98.3Very high98.5Very high175 Ų17564.7 Ų64.766%0.6631%0.312SS*.Hα-helixtrans-66.8-40.6176.5-172.3179-179.6-78.7-1.8111.6T234 I240T234-R236 PolarHBondContact O-N 3.43Å; R236-I240 HydrophobicContact CG-CD1 3.98Å; R236-I240 WeakPolarHBondContact O-CB 3.03Å; R236-I240 WeakPolarHBondContact O-CD1 3.47Å; R236-I240 VanDerWaalsContact O-CG1 3.22Å; R236-I240 WeakPolarHBondContact O-CG1 3.44Å; R236-I240 PolarHBondContact O-N 2.91Å
237Q98.4Very high98.4Very high51 Ų5165.9 Ų65.924%0.23832%0.319CS..Hα-helixtrans-64.6-47.1172.6-76.2158-7100110.9Y201 L233 T234 K239 I240 W241Y201-Q237 HydrophobicContact CE1-CB 4.34Å; Y201-Q237 HydrophobicContact CE1-CG 4.44Å; Y201-Q237 WeakPolarHBondContact OH-CB 3.44Å; L233-Q237 HydrophobicContact CB-CB 4.3Å; T234-Q237 WeakPolarHBondContact O-CA 3.22Å; T234-Q237 WeakPolarHBondContact O-CB 3.34Å; T234-Q237 PolarHBondContact O-N 3.08Å; T234-Q237 WeakPolarHBondContact OG1-CG 3.47Å; T234-Q237 PolarHBondContact OG1-N 2.94Å; T234-Q237 PolarHBondContact OG1-OE1 3.22Å; Q237-K239 PolarHBondContact O-N 2.93Å; Q237-I240 PolarHBondContact O-N 3.24Å; Q237-W241 WeakPolarHBondContact O-CB 3.27Å; Q237-W241 PolarHBondContact O-N 2.71Å
238I98.6Very high98.4Very high1 Ų171.2 Ų71.21%0.00534%0.342CS..Hα-helixtrans-56.7-49.7175.4-54-63.4000110.8L209 L219 R224 M227 A228 L231 L233 T234 E235 I240 W241 F242L209-I238 HydrophobicContact CD2-CD1 3.84Å; L219-I238 HydrophobicContact CD1-CG2 3.78Å; R224-I238 HydrophobicContact CG-CB 4.03Å; R224-I238 HydrophobicContact CG-CG2 3.81Å; M227-I238 HydrophobicContact CB-CD1 4.39Å; A228-I238 HydrophobicContact CB-CG1 4.28Å; L231-I238 HydrophobicContact CD1-CD1 4.35Å; L233-I238 HydrophobicContact CB-CD1 3.93Å; L233-I238 HydrophobicContact CB-CG1 4.4Å; L233-I238 HydrophobicContact CD1-CD1 4.02Å; T234-I238 PolarHBondContact O-N 2.82Å; T234-I238 VanDerWaalsContact O-N 3.08Å; E235-I238 PolarHBondContact O-N 3.33Å; I238-I240 PolarHBondContact O-N 2.7Å; I238-W241 PolarHBondContact O-N 3.03Å; I238-F242 HydrophobicContact CG2-CD2 4.03Å; I238-F242 HydrophobicContact CG2-CE2 4.29Å; I238-F242 WeakPolarHBondContact O-CD2 3.48Å; I238-F242 PolarHBondContact O-N 3.44Å
239K98.4Very high98.3Very high132 Ų13274.9 Ų74.957%0.57435%0.354SS*.Hα-helixtrans-58.5-43.6178-176.7-179.6179.2-178.90112.4E235 Q237 Q243E235-K239 VanDerWaalsContact O-CB 3.27Å; E235-K239 WeakPolarHBondContact O-CB 3.38Å; E235-K239 PolarHBondContact O-N 3.28Å; Q237-K239 PolarHBondContact O-N 2.93Å; K239-Q243 WeakPolarHBondContact O-CB 3.22Å; K239-Q243 PolarHBondContact O-N 3.2Å
240I98.5Very high98.1Very high64 Ų6475.6 Ų75.633%0.32835%0.352SS..Hα-helixtrans-69.3-42178.8-72168.7000110.9R236 Q237 I238 Q243 N244R236-I240 HydrophobicContact CG-CD1 3.98Å; R236-I240 WeakPolarHBondContact O-CB 3.03Å; R236-I240 WeakPolarHBondContact O-CD1 3.47Å; R236-I240 VanDerWaalsContact O-CG1 3.22Å; R236-I240 WeakPolarHBondContact O-CG1 3.44Å; R236-I240 PolarHBondContact O-N 2.91Å; Q237-I240 PolarHBondContact O-N 3.24Å; I238-I240 PolarHBondContact O-N 2.7Å; I240-Q243 PolarHBondContact O-N 2.93Å; I240-N244 WeakPolarHBondContact O-CB 3.4Å; I240-N244 VanDerWaalsContact O-CG 3.25Å; I240-N244 PolarHBondContact O-N 3.12Å; I240-N244 PolarHBondContact O-ND2 3.26Å
241W98.6Very high98Very high25 Ų2577.7 Ų77.710%0.09536%0.356CS..Hα-helixtrans-61.2-48176.8-168.9105.5000110.7Y201 L209 E210 F213 Q237 I238 Q243 N244 R245Y201-W241 AromaticContact CD2-CD1 3.95Å; Y201-W241 AromaticContact CE2-CD1 3.76Å; L209-W241 VanDerWaalsContact C-CH2 3.46Å; L209-W241 HydrophobicContact CB-CD2 3.97Å; L209-W241 HydrophobicContact CB-CE3 4Å; L209-W241 HydrophobicContact CB-CH2 3.69Å; L209-W241 HydrophobicContact CB-CZ2 3.63Å; L209-W241 HydrophobicContact CB-CZ3 3.86Å; L209-W241 HydrophobicContact CD1-CD2 3.95Å; L209-W241 HydrophobicContact CD1-CG 3.89Å; L209-W241 HydrophobicContact CD2-CD2 4.37Å; L209-W241 HydrophobicContact CD2-CE3 4.27Å; L209-W241 HydrophobicContact CG-CD2 4.33Å; L209-W241 WeakPolarHBondContact O-CH2 3.43Å; L209-W241 WeakPolarHBondContact O-CZ3 3.21Å; E210-W241 HydrophobicContact CG-CH2 4.25Å; E210-W241 HydrophobicContact CG-CZ2 4.21Å; F213-W241 HydrophobicContact CB-CH2 4.21Å; F213-W241 HydrophobicContact CB-CZ3 3.92Å; F213-W241 HydrophobicContact CG-CZ3 4.39Å; Q237-W241 WeakPolarHBondContact O-CB 3.27Å; Q237-W241 PolarHBondContact O-N 2.71Å; I238-W241 PolarHBondContact O-N 3.03Å; W241-Q243 VanDerWaalsContact C-N 3.3Å; W241-Q243 PolarHBondContact O-N 3.09Å; W241-N244 PolarHBondContact O-N 3.38Å; W241-N244 VanDerWaalsContact O-N 3.17Å; W241-R245 HydrophobicContact CD2-CB 4.46Å; W241-R245 HydrophobicContact CE3-CB 3.86Å; W241-R245 HydrophobicContact CE3-CG 4.4Å; W241-R245 HydrophobicContact CH2-CB 3.92Å; W241-R245 HydrophobicContact CH2-CG 3.57Å; W241-R245 HydrophobicContact CZ2-CG 4.35Å; W241-R245 HydrophobicContact CZ3-CB 3.56Å; W241-R245 HydrophobicContact CZ3-CG 3.61Å; W241-R245 WeakPolarHBondContact O-CB 3.5Å; W241-R245 PolarHBondContact O-N 3.15Å
242F98.8Very high97.8Very high8 Ų879.4 Ų79.44%0.03537%0.366CS..Hα-helixtrans-65.7-26.9176.1-90.8-99.8000113.9L209 E212 F213 L219 I238 R246L209-F242 HydrophobicContact CD2-CE2 3.95Å; E212-F242 HydrophobicContact CB-CZ 4.05Å; F213-F242 HydrophobicContact CB-CE1 4Å; F213-F242 HydrophobicContact CB-CZ 4.12Å; F213-F242 AromaticContact CD2-CD1 3.97Å; F213-F242 HydrophobicContact CD2-CD1 3.97Å; F213-F242 AromaticContact CD2-CE1 3.85Å; F213-F242 HydrophobicContact CD2-CE1 3.85Å; F213-F242 HydrophobicContact CG-CE1 4.45Å; L219-F242 HydrophobicContact CD1-CD2 4Å; L219-F242 HydrophobicContact CD1-CE1 4.2Å; L219-F242 HydrophobicContact CD1-CE2 3.58Å; L219-F242 HydrophobicContact CD1-CG 4.49Å; L219-F242 HydrophobicContact CD1-CZ 3.7Å; L219-F242 HydrophobicContact CD2-CE1 3.94Å; L219-F242 HydrophobicContact CD2-CZ 3.93Å; L219-F242 HydrophobicContact CG-CD1 4.01Å; L219-F242 HydrophobicContact CG-CD2 4.3Å; L219-F242 HydrophobicContact CG-CE1 3.68Å; L219-F242 HydrophobicContact CG-CE2 4Å; L219-F242 HydrophobicContact CG-CG 4.31Å; L219-F242 HydrophobicContact CG-CZ 3.69Å; I238-F242 HydrophobicContact CG2-CD2 4.03Å; I238-F242 HydrophobicContact CG2-CE2 4.29Å; I238-F242 WeakPolarHBondContact O-CD2 3.48Å; I238-F242 PolarHBondContact O-N 3.44Å; F242-R246 WeakPolarHBondContact O-CB 3.37Å; F242-R246 WeakPolarHBondContact O-CG 3.45Å; F242-R246 PolarHBondContact O-N 3.43Å; F242-R246 PolarHBondContact O-NE 3.04Å
243Q98.7Very high97.4Very high89 Ų8974.2 Ų74.242%0.41634%0.337SS..Hα-helixtrans-70.6-47170.5-17263.145.500111.2K239 I240 W241 M247K239-Q243 WeakPolarHBondContact O-CB 3.22Å; K239-Q243 PolarHBondContact O-N 3.2Å; I240-Q243 PolarHBondContact O-N 2.93Å; W241-Q243 VanDerWaalsContact C-N 3.3Å; W241-Q243 PolarHBondContact O-N 3.09Å; Q243-M247 WeakPolarHBondContact O-CG 3.23Å; Q243-M247 PolarHBondContact O-N 3.17Å; Q243-M247 VanDerWaalsContact O-N 3.12Å
244N98.4Very high96.8Very high101 Ų10180.7 Ų80.754%0.5436%0.364SS..Hα-helixtrans-64-41.7177.7-67.9-14.6000111.5I240 W241 M247 K248I240-N244 WeakPolarHBondContact O-CB 3.4Å; I240-N244 VanDerWaalsContact O-CG 3.25Å; I240-N244 PolarHBondContact O-N 3.12Å; I240-N244 PolarHBondContact O-ND2 3.26Å; W241-N244 PolarHBondContact O-N 3.38Å; W241-N244 VanDerWaalsContact O-N 3.17Å; N244-M247 PolarHBondContact O-N 3.21Å; N244-K248 PolarHBondContact O-N 3.05Å
245R98.6Very high96Very high26 Ų2681 Ų8110%0.09838%0.375CS..Hα-helixtrans-66.8-39.7-179.2-168.162.4171.598.7-13.1112.6E210 F213 W241 K248 Y249E210-R245 VanDerWaalsContact CD-NH2 3.3Å; E210-R245 IonicContact OE1-CZ 2.77Å; E210-R245 IonicContact OE1-NE 3.73Å; E210-R245 PolarHBondContact OE1-NE 2.91Å; E210-R245 IonicContact OE1-NH2 2.73Å; E210-R245 PolarHBondContact OE1-NH2 3.45Å; E210-R245 IonicContact OE2-NH2 3.76Å; E210-R245 PolarHBondContact OE2-NH2 3.25Å; F213-R245 HydrophobicContact CB-CG 4.38Å; F213-R245 HydrophobicContact CD1-CG 3.54Å; F213-R245 HydrophobicContact CD2-CB 4.3Å; F213-R245 HydrophobicContact CD2-CG 3.85Å; F213-R245 HydrophobicContact CE1-CG 3.72Å; F213-R245 HydrophobicContact CE2-CB 4.39Å; F213-R245 HydrophobicContact CE2-CG 4.02Å; F213-R245 HydrophobicContact CG-CB 4.49Å; F213-R245 HydrophobicContact CG-CG 3.61Å; F213-R245 HydrophobicContact CZ-CG 3.95Å; W241-R245 HydrophobicContact CD2-CB 4.46Å; W241-R245 HydrophobicContact CE3-CB 3.86Å; W241-R245 HydrophobicContact CE3-CG 4.4Å; W241-R245 HydrophobicContact CH2-CB 3.92Å; W241-R245 HydrophobicContact CH2-CG 3.57Å; W241-R245 HydrophobicContact CZ2-CG 4.35Å; W241-R245 HydrophobicContact CZ3-CB 3.56Å; W241-R245 HydrophobicContact CZ3-CG 3.61Å; W241-R245 WeakPolarHBondContact O-CB 3.5Å; W241-R245 PolarHBondContact O-N 3.15Å; R245-K248 PolarHBondContact O-N 2.87Å; R245-Y249 VanDerWaalsContact O-CB 3.27Å; R245-Y249 WeakPolarHBondContact O-CB 3.41Å; R245-Y249 PolarHBondContact O-N 2.96Å
246R98.3Very high95Very high58 Ų5885.6 Ų85.622%0.21939%0.394CS..Hα-helixtrans-63.3-40.1170.8-78.2179.4-72.1143.76.9112.4F213 R217 F242 Y249 K250F213-R246 HydrophobicContact CE2-CG 3.75Å; F213-R246 HydrophobicContact CZ-CG 4.35Å; R217-R246 VanDerWaalsContact O-CD 3.28Å; R217-R246 WeakPolarHBondContact O-CD 3.42Å; F242-R246 WeakPolarHBondContact O-CB 3.37Å; F242-R246 WeakPolarHBondContact O-CG 3.45Å; F242-R246 PolarHBondContact O-N 3.43Å; F242-R246 PolarHBondContact O-NE 3.04Å; R246-Y249 PolarHBondContact O-N 3.47Å; R246-K250 WeakPolarHBondContact O-CB 3.36Å; R246-K250 PolarHBondContact O-N 3.25Å
247M98.2Very high93.5Very high103 Ų10379.2 Ų79.251%0.50738%0.382SS..Hα-helixtrans-67.4-40.3176.5-69.9-66.1-78.800112.2Q243 N244 K251Q243-M247 WeakPolarHBondContact O-CG 3.23Å; Q243-M247 PolarHBondContact O-N 3.17Å; Q243-M247 VanDerWaalsContact O-N 3.12Å; N244-M247 PolarHBondContact O-N 3.21Å; M247-K251 PolarHBondContact O-N 3.25Å
248K97.1Very high91.7Very high115 Ų11582.4 Ų82.450%0.540%0.4SS..Hα-helixtrans-60.4-53.5170.4-170.5-165.2168.5-174.80110.5N244 R245 K250 K251 D252N244-K248 PolarHBondContact O-N 3.05Å; R245-K248 PolarHBondContact O-N 2.87Å; K248-K250 VanDerWaalsContact C-N 3.3Å; K248-K250 PolarHBondContact O-N 3.08Å; K248-K251 CarbonylContact O-C 3.57Å; K248-K251 WeakPolarHBondContact O-CA 3.39Å; K248-K251 WeakPolarHBondContact O-CB 3.36Å; K248-K251 PolarHBondContact O-N 3.46Å; K248-D252 WeakPolarHBondContact CE-OD2 3.44Å; K248-D252 WeakPolarHBondContact CG-OD2 3.44Å; K248-D252 PolarHBondContact O-N 2.84Å
249Y96.6Very high89.8Confident85 Ų8588.6 Ų88.633%0.33343%0.432SS..Hα-helixtrans-54.3-42.8179.4-178-101.4000112.9F213 R245 R246 K251 D252 Q253F213-Y249 HydrophobicContact CE1-CD2 4.12Å; F213-Y249 HydrophobicContact CE1-CG 4.22Å; F213-Y249 HydrophobicContact CZ-CD2 4.4Å; F213-Y249 HydrophobicContact CZ-CG 4.06Å; R245-Y249 VanDerWaalsContact O-CB 3.27Å; R245-Y249 WeakPolarHBondContact O-CB 3.41Å; R245-Y249 PolarHBondContact O-N 2.96Å; R246-Y249 PolarHBondContact O-N 3.47Å; Y249-K251 VanDerWaalsContact C-N 3.33Å; Y249-K251 PolarHBondContact O-N 3.21Å; Y249-D252 PolarHBondContact O-N 3.28Å; Y249-Q253 HydrophobicContact CD1-CG 4.32Å; Y249-Q253 HydrophobicContact CD2-CG 4.42Å; Y249-Q253 HydrophobicContact CE1-CG 3.95Å; Y249-Q253 HydrophobicContact CE2-CG 4.05Å; Y249-Q253 VanDerWaalsContact CZ-NE2 3.34Å; Y249-Q253 WeakPolarHBondContact O-CG 3.39Å; Y249-Q253 PolarHBondContact O-N 3.14Å; Y249-Q253 PolarHBondContact OH-NE2 3.44Å
250K95.8Very high87.5Confident127 Ų12789.1 Ų89.155%0.55244%0.436SS*.Hα-helixtrans-62.8-36.5174.6-175.417365.2174.70112.7R246 K248 K254R246-K250 WeakPolarHBondContact O-CB 3.36Å; R246-K250 PolarHBondContact O-N 3.25Å; K248-K250 VanDerWaalsContact C-N 3.3Å; K248-K250 PolarHBondContact O-N 3.08Å; K250-K254 WeakPolarHBondContact O-CG 3.38Å; K250-K254 PolarHBondContact O-N 2.71Å
251K95.4Very high85Confident161 Ų16191.1 Ų91.170%0.746%0.456SS*.Hα-helixtrans-70-47.3173.8-171.5-172.9176.9-1710110.9M247 K248 Y249 Q253 K254 A255M247-K251 PolarHBondContact O-N 3.25Å; K248-K251 CarbonylContact O-C 3.57Å; K248-K251 WeakPolarHBondContact O-CA 3.39Å; K248-K251 WeakPolarHBondContact O-CB 3.36Å; K248-K251 PolarHBondContact O-N 3.46Å; Y249-K251 VanDerWaalsContact C-N 3.33Å; Y249-K251 PolarHBondContact O-N 3.21Å; K251-Q253 PolarHBondContact O-N 3.18Å; K251-K254 PolarHBondContact O-N 2.91Å; K251-A255 PolarHBondContact O-N 3.17Å
252D93Very high82.8Confident51 Ų5196.7 Ų96.727%0.27350%0.495SS..Hα-helixtrans-59.5-43.8-178.2-60.3-12.7000111.2K248 Y249 A255 K256K248-D252 WeakPolarHBondContact CE-OD2 3.44Å; K248-D252 WeakPolarHBondContact CG-OD2 3.44Å; K248-D252 PolarHBondContact O-N 2.84Å; Y249-D252 PolarHBondContact O-N 3.28Å; D252-A255 PolarHBondContact O-N 2.86Å; D252-K256 WeakPolarHBondContact O-CG 3.18Å; D252-K256 PolarHBondContact O-N 2.93Å; D252-K256 VanDerWaalsContact O-N 3.15Å
253Q90.7Very high80.4Confident41 Ų41100.7 Ų100.719%0.19253%0.53CS..Hα-helixtrans-67.1-37.6178.4-69.3-65.110.600113Y249 K251 A255 K256 L259Y249-Q253 HydrophobicContact CD1-CG 4.32Å; Y249-Q253 HydrophobicContact CD2-CG 4.42Å; Y249-Q253 HydrophobicContact CE1-CG 3.95Å; Y249-Q253 HydrophobicContact CE2-CG 4.05Å; Y249-Q253 VanDerWaalsContact CZ-NE2 3.34Å; Y249-Q253 WeakPolarHBondContact O-CG 3.39Å; Y249-Q253 PolarHBondContact O-N 3.14Å; Y249-Q253 PolarHBondContact OH-NE2 3.44Å; K251-Q253 PolarHBondContact O-N 3.18Å; Q253-A255 VanDerWaalsContact C-N 3.28Å; Q253-A255 PolarHBondContact O-N 3.25Å; Q253-K256 PolarHBondContact O-N 3.32Å; Q253-L259 HydrophobicContact CB-CD1 4.4Å
254K85.4Confident78.2Confident150 Ų15099.7 Ų99.765%0.65254%0.543SS*.Hα-helixtrans-66.6-29.7173.3-71.1-16768.3164.20112.8K250 K251K250-K254 WeakPolarHBondContact O-CG 3.38Å; K250-K254 PolarHBondContact O-N 2.71Å; K251-K254 PolarHBondContact O-N 2.91Å
255A82.3Confident75.8Confident85 Ų85104.2 Ų104.270%0.70256%0.561SS**Hα-helixtrans-77.5-20175.800000113.5K251 D252 Q253K251-A255 PolarHBondContact O-N 3.17Å; D252-A255 PolarHBondContact O-N 2.86Å; Q253-A255 VanDerWaalsContact C-N 3.28Å; Q253-A255 PolarHBondContact O-N 3.25Å
256K78.1Confident73.3Confident150 Ų150108.1 Ų108.165%0.65259%0.592SS**THydrogen-bonded Turntrans-92.74.4-178.1-72.9-177.7176.8-1620114.8D252 Q253 I258D252-K256 WeakPolarHBondContact O-CG 3.18Å; D252-K256 PolarHBondContact O-N 2.93Å; D252-K256 VanDerWaalsContact O-N 3.15Å; Q253-K256 PolarHBondContact O-N 3.32Å; K256-I258 HydrophobicContact CB-CD1 3.89Å; K256-I258 HydrophobicContact CB-CG1 4.33Å; K256-I258 HydrophobicContact CD-CD1 4.44Å; K256-I258 PolarHBondContact O-N 2.91Å
257G65.8Low71.2Confident40 Ų40111 Ų11141%0.41262%0.619SS.*THydrogen-bonded Turntrans71.9-7.9179.100000116L259 H260G257-L259 PolarHBondContact O-N 3.05Å; G257-H260 PolarHBondContact O-N 3.11Å
258I61.6Low68.6Low118 Ų118114 Ų11461%0.60563%0.632SS**THydrogen-bonded Turntrans-65.8-1.3-173-69161.6000114.1K256K256-I258 HydrophobicContact CB-CD1 3.89Å; K256-I258 HydrophobicContact CB-CG1 4.33Å; K256-I258 HydrophobicContact CD-CD1 4.44Å; K256-I258 PolarHBondContact O-N 2.91Å
259L57.5Low66.4Low131 Ų131119.8 Ų119.869%0.68665%0.65SS**THydrogen-bonded Turntrans-126.720.8168.9-82.997.8000113.6Q253 G257Q253-L259 HydrophobicContact CB-CD1 4.4Å; G257-L259 PolarHBondContact O-N 3.05Å
260H50.5Low64.1Low144 Ų144119.7 Ų119.767%0.66766%0.662SS**  trans-110.898.2171.3-85-142000110.1G257G257-H260 PolarHBondContact O-N 3.11Å
261S45.1Very low62Low105 Ų105119.6 Ų119.673%0.73467%0.674SS**  trans-59.5152.9156.7-55.20000109.8A263S261-A263 PolarHBondContact O-N 3.39Å
262P52.8Low59.8Low142 Ų142117.9 Ų117.992%0.92268%0.68SS**SBendtrans-7779.3-167.131.2-36.8000113
263A47.8Very low57.7Low92 Ų92123.9 Ų123.976%0.7671%0.711SS**  trans-140.257-178.100000114.1S261S261-A263 PolarHBondContact O-N 3.39Å
264G53Low55.1Low68 Ų68126 Ų12670%0.70174%0.744SS**  trans78.5163.6151.800000119.9
265Q47.5Very low52.7Low197 Ų197122 Ų12292%0.92175%0.746SS**  trans66.498.7164.7-60-179.394.600117.5
266S46.6Very low50.6Low107 Ų107123 Ų12375%0.74875%0.753SS**  trans-65.5138163.1-177.30000111E268S266-E268 VanDerWaalsContact C-N 3.32Å; S266-E268 PolarHBondContact O-N 3.04Å
267P53.6Low48.8Very low120 Ų120120.8 Ų120.878%0.77976%0.763SS**  trans-81.775.1173.834.7-34.5000110.6R269P267-R269 PolarHBondContact O-N 2.8Å
268E44.3Very low47.3Very low165 Ų165122.9 Ų122.977%0.77179%0.785SS**  trans-64.4133.4169.4-149.6-140.5126.600109.7S266S266-E268 VanDerWaalsContact C-N 3.32Å; S266-E268 PolarHBondContact O-N 3.04Å
269R50.9Low46.2Very low237 Ų237125.9 Ų125.989%0.89480%0.796SS**  trans-125.157.7-162.1-163.9-167.1172.8-165.4-4112.1P267P267-R269 PolarHBondContact O-N 2.8Å
270S48.5Very low45.5Very low83 Ų83126.3 Ų126.358%0.5880%0.804SS**  trans-142122.6176.9-63.60000111.5P272S270-P272 WeakPolarHBondContact O-CD 3.28Å
271P51.7Low45Very low124 Ų124123.3 Ų123.381%0.80580%0.804SS**  trans-85.4116.4158.831.5-26.8000109L273P271-L273 PolarHBondContact O-N 2.79Å
272P49.1Very low44.8Very low126 Ų126129.3 Ų129.382%0.81881%0.812SS**  trans-70.6119.9177.327.7-32.9000110.5S270 G274S270-P272 WeakPolarHBondContact O-CD 3.28Å; P272-G274 PolarHBondContact O-N 2.97Å
273L48.7Very low44.3Very low176 Ų176127.6 Ų127.692%0.92180%0.803SS**  trans-78.997.5175.9-162.777.8000109.1P271 G275P271-L273 PolarHBondContact O-N 2.79Å; L273-G275 PolarHBondContact O-N 3.03Å
274G35.4Very low43.9Very low87 Ų87126.1 Ų126.190%0.89780%0.797SS**  trans-66.799.3-177.800000112.6P272P272-G274 PolarHBondContact O-N 2.97Å
275G35.4Very low43.1Very low66 Ų66131.1 Ų131.168%0.6880%0.802SS**  trans-15068.7-169.300000115.8L273L273-G275 PolarHBondContact O-N 3.03Å
276A38.5Very low42.6Very low104 Ų104129.4 Ų129.486%0.8680%0.798SS**  trans66.2161.2159.400000120.3
277A39.4Very low42.6Very low104 Ų104129.6 Ų129.686%0.8680%0.797SS**  trans5794.416600000118.4
278G36.2Very low42.6Very low84 Ų84129.4 Ų129.487%0.86680%0.796SS**  trans-91.2142.7161.400000112.3
279H37.7Very low42.5Very low181 Ų181128.3 Ų128.384%0.83880%0.8SS**  trans-157.1104.5169.9176.1-85.7000111
280V42.3Very low42.1Very low141 Ų141123.4 Ų123.486%0.85580%0.799SS**  trans-141.396.4173.6-172.30000111.8
281A40.1Very low41.4Very low81 Ų81122.8 Ų122.867%0.66981%0.806SS**  trans58.8143.9139.100000124.3
282Y41.8Very low40.7Very low231 Ų231125.4 Ų125.491%0.90681%0.812SS**  trans90164.1149-138.4-103.3000119.8
283S42.1Very low40.4Very low106 Ų106124.3 Ų124.374%0.74181%0.814SS**  trans-147.9150.5-151.9-177.20000112.9
284G38.6Very low39.8Very low61 Ų61127 Ų12763%0.62981%0.813SS**  trans162.5118.217100000116.3
285Q37Very low40.1Very low173 Ų173129.1 Ų129.181%0.80880%0.804SS**  trans6.6110.6163.9-79.876.7-10.500121.9
286L35.8Very low40.1Very low160 Ų160130.2 Ų130.284%0.83881%0.807SS**  36.8152.5101.9-71.5-177.2000121.9
287P48Very low40.3Very low111 Ų111130.8 Ų130.872%0.72180%0.802SS**  cis-137.1-141.3-11.746.1-24.6000113.3
288P53.3Low40.6Very low116 Ų116131.3 Ų131.375%0.75380%0.799SS**  -134.2165.3-128.737.5-13.3000119.4
289V40.8Very low41.5Very low143 Ų143133.1 Ų133.187%0.86780%0.795SS**  trans-144148.6153.8-75.60000111.1
290P42.8Very low42.3Very low134 Ų134130.8 Ų130.887%0.8780%0.796SS**  trans-99152.6-174.537.4-34.2000114
291G34.1Very low42.3Very low70 Ų70128.7 Ų128.772%0.72279%0.794SS**  trans-178.2122.4169.500000115.8
292L37.9Very low42.1Very low178 Ų178133.7 Ų133.793%0.93280%0.801SS**  trans59106.6156.1-50.5-177.3000118.6
293A41.2Very low42Very low104 Ų104126.2 Ų126.286%0.8679%0.786SS**  trans-74.7151.4156.500000110.7
294Y37.5Very low41.8Very low231 Ų231130.2 Ų130.291%0.90679%0.791SS**  trans-140.3136.2164.6-160.5-94.2000110.3
295D40.8Very low41.6Very low133 Ų133131.7 Ų131.771%0.71179%0.791SS**  trans-89.1146.8-174.9-171.6-104.1000111.5
296A36.4Very low41.6Very low88 Ų88131.2 Ų131.273%0.72779%0.789SS**  trans-126.7108.8-177.300000110.4
297P42.5Very low42.3Very low117 Ų117129.3 Ų129.376%0.7679%0.786SS**PPolyproline II helixtrans-77.5138-167.229.2-35.4000113.7
298S46.3Very low42.2Very low114 Ų114128.2 Ų128.280%0.79777%0.774SS**PPolyproline II helixtrans-79.1135.9168.8-65.10000111.6
299P54.4Low41.3Very low122 Ų122130.5 Ų130.579%0.79278%0.777SS**PPolyproline II helixtrans-73.5143.2170.130.2-33.7000111.6
300P53.4Low41.4Very low132 Ų132132.7 Ų132.786%0.85777%0.771SS**PPolyproline II helixtrans-86.1165-173.135.1-37.3000114.1
301A43.5Very low41.1Very low97 Ų97129.7 Ų129.780%0.80277%0.765SS**  trans-115.1123.9173.100000112
302F35.7Very low41.5Very low187 Ų187134.9 Ų134.982%0.8278%0.775SS**  trans-157.3132.6167.7-133.8-106.2000107
303A39Very low41.4Very low73 Ų73131.2 Ų131.260%0.60377%0.77SS**  cis96.6130.623.300000115
304K39.4Very low41Very low191 Ų191129.9 Ų129.983%0.8376%0.759SS**  trans71.3156.1170.3-67.4177.9178.8177.10118.7
305S32.7Very low40.8Very low92 Ų92129 Ų12964%0.64376%0.756SS**  cis-178.4134-38.952.10000112.8
306Q39.1Very low40.6Very low162 Ų162128.6 Ų128.676%0.75776%0.758SS**  trans65.7162.7144.9-74.3-62.3-1900117.6
307P50.4Low40.9Very low121 Ų121129.1 Ų129.179%0.78676%0.762SS**  cis-137.5130.136.837.6-15.9000120.3
308N45.2Very low41.1Very low87 Ų87129.6 Ų129.647%0.46577%0.765SS.*  39.3127.4114.8-173.136.3000121.7Y310N308-Y310 PolarHBondContact ND2-OH 3.25Å
309M33.9Very low41Very low164 Ų164132 Ų13281%0.80877%0.768SS**  trans-152.4152.6140.5-154.159.269.800112.5
310Y43.6Very low40.1Very low190 Ų190131.1 Ų131.175%0.74577%0.765SS**  trans-77.4173.5-169.8-53.4-91.2000114.3N308N308-Y310 PolarHBondContact ND2-OH 3.25Å
311G35.4Very low39Very low71 Ų71130 Ų13073%0.73276%0.76SS**  cis-166.8-136.317.100000116.7
312L43.6Very low38.4Very low179 Ų179130.8 Ų130.894%0.93776%0.759SS**  trans-113.1174.9-150.1-69.3168.5000116.9
313A35.5Very low38.6Very low101 Ų101130 Ų13084%0.83576%0.762SS**  trans78.3162.9163.900000118.6
314A32.7Very low38.8Very low75 Ų75132.1 Ų132.162%0.6277%0.77SS**  cis-178.4167.9-34.400000109.5
315Y33.7Very low38.7Very low214 Ų214132.3 Ų132.384%0.83977%0.774SS**  trans74.1143.1163.3-69.6-76.9000121.9
316T35.6Very low38.9Very low123 Ų123135.8 Ų135.876%0.75578%0.78SS**  trans50.8118.3149.453.10000121.4
317A42.8Very low38.7Very low99 Ų99136.2 Ų136.282%0.81878%0.779SS**  trans-79.2153.7145.400000110.5
318P47.8Very low37.8Very low127 Ų127139.2 Ų139.283%0.82578%0.775SS**  -137173.2126.238.4-27.6000115.2
319L43.1Very low37Very low164 Ų164144.6 Ų144.686%0.85979%0.79SS**  trans-69.9162.6-165.5-57.4158.8000117
320S35.4Very low36.8Very low104 Ų104141 Ų14173%0.72779%0.786SS**  trans88.5112.8141.5-64.40000123.3
321S31.7Very low36.3Very low109 Ų109135.8 Ų135.876%0.76278%0.782SS**  91154.8124.374.20000123.1
322C31.1Very low37Very low113 Ų113137.8 Ų137.876%0.76478%0.783SS**  trans85.595.4158.7-64.20000122.1
323L39.2Very low36.2Very low170 Ų170137.8 Ų137.889%0.8978%0.778SS**  trans40.7149.9130.2-72.3161.9000123.6
324P43.3Very low35.9Very low118 Ų118142.3 Ų142.377%0.76678%0.779SS**  trans-93.5162.4-16938.2-37.9000116.6
325Q36.5Very low36.1Very low195 Ų195146.3 Ų146.391%0.91179%0.785SS**  trans-110.5102.5177-74.8-169.7-1600115
326Q36.3Very low36.7Very low166 Ų166139.8 Ų139.878%0.77677%0.769SS**  32.2144.7118.7-113.9-170.136.700123.7
327K35.8Very low37Very low171 Ų171141.6 Ų141.674%0.74377%0.768SS**  trans88.9144159.3-60.6174.8-175.31720117.3
328R31.1Very low37.7Very low184 Ų184141.9 Ų141.969%0.69476%0.761SS**  cis-164.9138.3-8.9-104.2-98.1-167.5152.4-1.2110.6
329Y29.2Very low37Very low200 Ų200144.3 Ų144.378%0.78476%0.764SS**  trans65.7149.4152.9-82.5-136.5000118.1
330A29.1Very low36.7Very low88 Ų88141 Ų14173%0.72776%0.761SS**  cis-154.6159-9.400000111.8
331A33.5Very low36.5Very low80 Ų80141.6 Ų141.666%0.66176%0.764SS**  trans-96.7174.9159.100000109.7
332P50.8Low36.6Very low114 Ų114143.8 Ų143.874%0.7477%0.768SS**  -120.2145.575.11.821.1000112.5
333E26.8Very low36.6Very low179 Ų179141.6 Ų141.684%0.83676%0.764SS**  68.9106.467.7-61.6178.2127.100114.9
334F29.4Very low36.2Very low196 Ų196137.3 Ų137.386%0.8676%0.761SS**  -164.6121121.6-159.8-101.7000112.8
335E36.6Very low35.7Very low159 Ų159135.2 Ų135.274%0.74376%0.761SS**  trans-128.1134.9160.3175.2177.4160.700103.3
336P46.2Very low35.7Very low77 Ų77135 Ų13550%0.576%0.758SS.*  -161.1159.972.242.6-19.8000122.1
337H41.5Very low35.6Very low161 Ų161132 Ų13275%0.74576%0.76SS**  trans63.9-167148.6-46.9-25.9000118
338P57.9Low35.6Very low104 Ų104129.7 Ų129.768%0.67577%0.766SS**  -129-170.9-112.638.6-17000113.9
339M33Very low35.9Very low178 Ų178125.6 Ų125.688%0.87777%0.772SS**  174.9167.2128.1-88.9-42.8162.700110.9
340A36.9Very low36Very low96 Ų96123 Ų12379%0.79377%0.771SS**  trans-91.9161.917500000112.2
341S30.7Very low36.8Very low115 Ų115126.9 Ų126.980%0.80478%0.779SS**  159.9125.7129.6-166.90000113.8
342N33.9Very low37Very low156 Ų156131.8 Ų131.883%0.83479%0.788SS**  trans36.2123.6137.4-16850.6000122.8
343G30.1Very low36.2Very low66 Ų66130.2 Ų130.268%0.6879%0.793SS**  108.1123.9124.200000119.5
344G32.1Very low36.7Very low81 Ų81127.2 Ų127.284%0.83579%0.791SS**  trans75.1144.4162.100000116.7
345G33.5Very low37.8Very low74 Ų74123.2 Ų123.276%0.76379%0.785SS**  cis12374.2-8.100000114.5
346F36Very low37.8Very low191 Ų191121.2 Ų121.284%0.83878%0.784SS**  trans-156.7141.2168.544.1-98.1000115.2
347A34.1Very low37.6Very low101 Ų101128.6 Ų128.684%0.83580%0.803SS**  trans45.3139.3144.300000123.4
348S35.7Very low37.5Very low123 Ų123126.4 Ų126.486%0.8680%0.801SS**  trans-89.8154.4179.5-420000115.3
349A36.4Very low36.3Very low98 Ų98125.2 Ų125.281%0.8181%0.808SS**  trans-158.1102.5143.200000107.5
350N32.6Very low36.3Very low145 Ų145120.5 Ų120.578%0.77580%0.804SS**  54.499.975.5-166.71000114.3
351L45.4Very low36.1Very low170 Ų170123 Ų12389%0.8981%0.805SS**  trans-147134.7158-107.8166.3000110.1
352Q38.2Very low36.3Very low184 Ų184126 Ų12686%0.8680%0.803SS**  trans-72.5156.1-155.9-54.7168.915.600116.2
353G32.7Very low36.6Very low81 Ų81123.6 Ų123.684%0.83579%0.794SS**  trans-178.3111.7165.800000114
354S37.3Very low36.8Very low115 Ų115129.2 Ų129.280%0.80480%0.803SS**  trans-91173.9177.9-124.40000111.7
355P53.2Low36.9Very low112 Ų112129.7 Ų129.773%0.72779%0.793SS**  cis-140.1156.113.440-20.5000119.4
356V36Very low37.2Very low118 Ų118135.1 Ų135.172%0.71580%0.801SS**  trans31.5118136.5-170.90000120.6V358V356-V358 HydrophobicContact CG1-CG2 4.41Å
357Y42.7Very low37.5Very low232 Ų232130.6 Ų130.691%0.9180%0.799SS**  -139.2163.4128.7-154.1-97.9000110.7
358V39.5Very low38.4Very low114 Ų114131.6 Ų131.669%0.69180%0.797SS**  trans-110.6134.4-164.1170.40000113.3V356V356-V358 HydrophobicContact CG1-CG2 4.41Å
359G32.3Very low38.3Very low80 Ų80129.8 Ų129.883%0.82579%0.79SS**  trans79.7119.3146.500000118.2
360G33.1Very low38.4Very low78 Ų78131 Ų13180%0.80479%0.792SS**  trans174.462.7175.400000116.3
361N32.6Very low38.6Very low150 Ų150127.6 Ų127.680%0.80279%0.791SS**  trans-67.5156.2165.4-78.116.5000110.6
362F35.7Very low38.7Very low176 Ų176125.8 Ų125.877%0.77279%0.79SS**  cis-153.4-173.4-3.4-143.4-125.1000111.1
363V39.9Very low38.9Very low106 Ų106122.7 Ų122.764%0.64278%0.783SS**  trans-52.6142.7172.9-173.10000113.5
364E33.4Very low39.1Very low184 Ų184128.7 Ų128.786%0.8679%0.786SS**  trans-134.2119.4166.9-176.861.2-10600109.5
365S35.5Very low38.9Very low91 Ų91130 Ų13064%0.63679%0.785SS**  trans-137.796.5-169.9-78.80000113
366M39.4Very low38.3Very low188 Ų188133 Ų13393%0.92679%0.794SS**  trans57.4131.2153-54-166.6-17300120.2
367A42.4Very low38.4Very low96 Ų96130.6 Ų130.679%0.79379%0.793SS**  trans-62.4168.917500000114.4
368P52.5Low38.4Very low122 Ų122128 Ų12879%0.79279%0.788SS**  -156164.988.441.6-22.7000119.5
369A34.2Very low38.2Very low86 Ų86130.5 Ų130.571%0.71180%0.797SS**  trans64117.7137.200000125.8
370S38.1Very low38.4Very low122 Ų122130.6 Ų130.685%0.85379%0.785SS**  72.8127124.666.60000125.4
371G37.3Very low38.8Very low74 Ų74135.5 Ų135.576%0.76379%0.787SS**  trans95.3167147.900000117.5
372P47.2Very low39.7Very low133 Ų133134.3 Ų134.386%0.86479%0.787SS**  cis-135.5-161.93.344.4-26.4000116.3
373V42.1Very low40Very low118 Ų118131.2 Ų131.272%0.71579%0.787SS**  trans-58.1155.9-166.7-610000121.8
374F37.7Very low40.1Very low207 Ų207131.8 Ų131.891%0.90880%0.796SS**  -158.7118.6127.5-76-71.5000106.1
375N33.1Very low40.4Very low144 Ų144127.5 Ų127.577%0.7779%0.792SS**  74.19353.5-164.920.6000115.8
376L38.9Very low40.7Very low175 Ų175127.8 Ų127.892%0.91679%0.794SS**  trans-153.5147.7150.5-146.372.8000108.5
377G38.4Very low41.1Very low67 Ų67125 Ų12569%0.69179%0.787SS**  trans-131.1-155.3-170.300000115.2
378H42.6Very low41.1Very low177 Ų177127.5 Ų127.582%0.81979%0.787SS**  trans76.6101.9176.2-115.5-102.7000117.8
379L36.3Very low40.4Very low166 Ų166131.5 Ų131.587%0.86979%0.788SS**  -162.6159.7112.5-124.370.4000110
380S35.6Very low41Very low82 Ų82133.5 Ų133.557%0.57380%0.797SS**  trans-135.5168.7-167-66.70000113.6
381H41.6Very low41.1Very low182 Ų182133.2 Ų133.284%0.84379%0.793SS**  trans81.2153.6167-46.9-74.1000117.5
382P52.7Low41.2Very low125 Ų125134.7 Ų134.781%0.81280%0.798SS**  cis-130.3179.5-29.832.2-13000114.1
383S40.3Very low40.8Very low111 Ų111133.2 Ų133.278%0.77680%0.797SS**  trans-87.5157.6-179.9-178.60000114
384S42.6Very low40.5Very low118 Ų118137 Ų13783%0.82581%0.807SS**  trans-162131.6157-81.20000115.5
385A39Very low40.7Very low94 Ų94134.3 Ų134.378%0.77780%0.801SS**  trans54.1108.5146.400000122.1
386S42.4Very low41.4Very low96 Ų96133.6 Ų133.667%0.67180%0.804SS**  trans-27.6147.5145.353.20000119.6
387V47.7Very low41.2Very low131 Ų131128.4 Ų128.479%0.79479%0.793SS**  trans-141.5107.5134.1-172.10000109.6Y389V387-Y389 HydrophobicContact CG1-CD2 4.32Å
388D43.2Very low41Very low148 Ų148131.5 Ų131.579%0.79179%0.793SS**  trans-84.1136.1164.9-64.6-87.7000109.5
389Y38Very low41.2Very low205 Ų205130 Ų13080%0.80479%0.787SS**  trans-137.583.4177-138.7-87.2000112.7V387V387-Y389 HydrophobicContact CG1-CD2 4.32Å
390S46.4Very low41.5Very low128 Ų128131 Ų13190%0.89579%0.786SS**  trans-95122163.8-74.60000109.8
391C39.3Very low42.1Very low116 Ų116135.6 Ų135.678%0.78480%0.798SS**  trans-133.6136.1154.768.10000109.8
392A40.3Very low42.1Very low105 Ų105130 Ų13087%0.86879%0.79SS**  trans-111.9150.817700000109.6
393A38.5Very low42Very low102 Ų102130.4 Ų130.484%0.84379%0.793SS**  trans-136.3143.7170.100000109.2
394Q36.6Very low42.1Very low197 Ų197131.3 Ų131.392%0.92180%0.798SS**  trans-100.7160.3-171.5-70.6171.1-35.800112.5
395I41.8Very low42.1Very low151 Ų151132.9 Ų132.977%0.77480%0.797SS**  trans-77.4162.1176.9-28.3179.7000110
396P48.2Very low42.9Very low130 Ų130134 Ų13484%0.84480%0.796SS**  -143.9145.7111.636.5-23000115.8
397G34.2Very low42.8Very low65 Ų65136.7 Ų136.767%0.6780%0.798SS**  trans88.1158.7168.800000116.2
398N34.7Very low43.2Very low132 Ų132136.4 Ų136.471%0.70680%0.799SS**  cis-153158.8-4.6-159.623000113.9
399H47.1Very low43.1Very low147 Ų147134.6 Ų134.668%0.68179%0.793SS**  trans26.8136.2167.7-61.2-23.6000123.8
400H42.6Very low43.2Very low186 Ų186133.9 Ų133.986%0.86179%0.79SS**  trans-76134.6156.6-64.9-77.8000111.9
401H46.9Very low43.4Very low178 Ų178133.5 Ų133.582%0.82478%0.783SS**  trans-141.2163.5152.5-75.1-66.1000110.6
402G42.3Very low43.6Very low65 Ų65133.1 Ų133.167%0.6777%0.773SS**  trans-84.1-172.9-163.800000116.8
403P50.3Low43.8Very low133 Ų133135.8 Ų135.886%0.86477%0.772SS**  trans-79.7139.5-174.132.3-34.9000113.1
404C41.5Very low43.9Very low131 Ų131136.1 Ų136.189%0.88577%0.768SS**  trans-136.4143.6169.6-74.90000110.8
405D42.7Very low44.1Very low151 Ų151130.9 Ų130.981%0.80776%0.758SS**  trans-80135.9-171.3-128.3-53.7000113.1H407D405-H407 PolarHBondContact O-N 3.32Å
406P57.2Low44.2Very low118 Ų118132.6 Ų132.677%0.76676%0.762SS**  trans-92.975.217736.3-34000112.4P408P406-P408 VanDerWaalsContact O-CD 3.27Å; P406-P408 WeakPolarHBondContact O-CD 3.5Å
407H39.7Very low43.9Very low151 Ų151134.9 Ų134.970%0.69976%0.761SS**  trans-113.384.6173.7-159.6-66.4000113.3D405 T409D405-H407 PolarHBondContact O-N 3.32Å; H407-T409 PolarHBondContact CE1-OG1 3.01Å; H407-T409 PolarHBondContact ND1-OG1 3.18Å; H407-T409 VanDerWaalsContact ND1-OG1 3.08Å; H407-T409 PolarHBondContact O-N 3.29Å
408P56.5Low44.4Very low125 Ų125137.6 Ų137.681%0.81277%0.77SS**  trans-79.398.7178.431.8-33.7000111.7P406P406-P408 VanDerWaalsContact O-CD 3.27Å; P406-P408 WeakPolarHBondContact O-CD 3.5Å
409T41.2Very low44.7Very low110 Ų110136.8 Ų136.868%0.67578%0.775SS**  trans-90.9108.9175.1-58.30000111.5H407H407-T409 PolarHBondContact CE1-OG1 3.01Å; H407-T409 PolarHBondContact ND1-OG1 3.18Å; H407-T409 VanDerWaalsContact ND1-OG1 3.08Å; H407-T409 PolarHBondContact O-N 3.29Å
410Y39Very low44.6Very low190 Ų190139.2 Ų139.275%0.74579%0.787SS**  trans60.6128.3151.6-158.6-95.1000120.2D412Y410-D412 HydrophobicContact CE1-CB 4.45Å
411T50.2Low44.8Very low120 Ų120134.3 Ų134.374%0.73679%0.787SS**  trans-160.2124.1133.4-72.80000108.8L413T411-L413 HydrophobicContact CG2-CG 4.25Å
412D43.8Very low44.2Very low109 Ų109136.4 Ų136.458%0.58379%0.787SS**  trans-85.8130.8165.4-174.6-46.1000109.1Y410 S414Y410-D412 HydrophobicContact CE1-CB 4.45Å; D412-S414 PolarHBondContact OD1-N 3.12Å
413L45.8Very low44.4Very low161 Ų161140.2 Ų140.284%0.84379%0.791SS**  trans-145.8101.7161.7-87.3-177.6000111.4T411T411-L413 HydrophobicContact CG2-CG 4.25Å
414S40.3Very low44.3Very low109 Ų109139.7 Ų139.776%0.76279%0.788SS**  trans-96.3114164.3-174.90000110.9D412D412-S414 PolarHBondContact OD1-N 3.12Å
415A39.3Very low44.3Very low86 Ų86141.1 Ų141.171%0.71178%0.782SS**  trans-154.6135.5170.700000111.9
416H44.1Very low44.7Very low187 Ų187137.7 Ų137.787%0.86677%0.774SS**  trans-81.5146.8173.1-71.7-115.1000111.4
417H43.1Very low44.8Very low178 Ų178138.1 Ų138.182%0.82478%0.777SS**  trans-149.5144.4143.151.4-94.9000110.6
418S43.6Very low45.2Very low123 Ų123139.1 Ų139.186%0.8678%0.78SS**  trans-121.9135.7177.548.70000109.9
419S41.7Very low45.1Very low115 Ų115140.6 Ų140.680%0.80478%0.78SS**  trans-149.3144.4170.955.90000109.6
420Q45.3Very low46.1Very low198 Ų198141.4 Ų141.493%0.92579%0.785SS**  trans-90.7130.3-175.9-68.6-173.4-1100111.6
421G45.3Very low47.1Very low83 Ų83139.6 Ų139.686%0.85678%0.783SS**  trans-92144.3161.300000110.6
422R35.6Very low47.3Very low222 Ų222145.5 Ų145.584%0.83881%0.809SS**  trans-127.5144.5-168.5-163.5-160-178-167.62.6110.8
423L46.1Very low47.5Very low144 Ų144147.4 Ų147.475%0.75482%0.82SS**  trans74161171.5-45.5179.2000116.2
424P47.7Very low47.5Very low123 Ų123146.6 Ų146.680%0.79982%0.819SS**  cis-117.6159.7-9.117.94.7000114.9
425E41.1Very low47.9Very low160 Ų160148.7 Ų148.775%0.74882%0.822SS**PPolyproline II helixtrans-77.8146.2170.5-177.4178.1158.700111.1K428E425-K428 IonicContact OE1-NZ 3.75Å
426A52.1Low48.5Very low79 Ų79152.4 Ų152.465%0.65383%0.828SS**PPolyproline II helixtrans-88.2137.5177.300000111.9
427P58.6Low48.7Very low128 Ų128150.3 Ų150.383%0.83183%0.826SS**PPolyproline II helixtrans-69.8137.3-175.428-34.7000112.6
428K48Very low49.1Very low172 Ų172148.4 Ų148.475%0.74883%0.826SS**PPolyproline II helixtrans-76.4127.2177.7-70.7163.5-177.9145.80110.6E425 T430E425-K428 IonicContact OE1-NZ 3.75Å; K428-T430 PolarHBondContact O-N 3.2Å
429L54.3Low49.5Very low155 Ų155150.2 Ų150.281%0.81282%0.824SS**  trans-78.6110.9171.5-138.177.8000109.4
430T63.4Low50.1Low127 Ų127152.9 Ų152.978%0.77983%0.825SS**  trans-92.3118.3171.350.90000109.9K428K428-T430 PolarHBondContact O-N 3.2Å
431H58.8Low50.5Low152 Ų152149.2 Ų149.270%0.70482%0.817SS**  trans-131.2112.3167.3-83.1-85.7000110.5
432L54.8Low51Low245 Ų245155.2 Ų155.2100%1.28381%0.813SS**  trans22.30148.3-62.3165.7000117.2

Retrieved 432 of 432 residues in 465.6 ms (Link to these results)