A0A803WCW7_FICAL Loading...

Transcription factor AP-2 beta

AlphaFold DB , UniProt , Accession A0A803WCW7, Species FICAL (Ficedula albicollis, Collared flycatcher), Gene TFAP2B, Length 460 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M38.9Very low41.1Very low240 Ų240151 Ų151100%1.18281%0.806SS**  0142.20-59.2173.387.200107.7
2H35.2Very low41.2Very low194 Ų194153.4 Ų153.490%0.89881%0.813SS**  trans-129.1137.4178.6-83.2-0.3000110.1
3S31.7Very low41.3Very low119 Ų119153.1 Ų153.183%0.83281%0.811SS**PPolyproline II helixtrans-86.1136.7169.8-53.70000109.5
4P44.6Very low40.9Very low116 Ų116156.9 Ų156.975%0.75381%0.809SS**PPolyproline II helixtrans-78.8147.217032.5-33.4000111.3
5P47.6Very low40.8Very low125 Ų125158.2 Ų158.281%0.81281%0.806SS**PPolyproline II helixtrans-76.8173.2167.633.9-35000111.8
6R43.1Very low40.8Very low228 Ų228157.7 Ų157.786%0.8680%0.804SS**PPolyproline II helixtrans-98.8170176-65.4-179.1165.9-175.5-4112.3
7E39.3Very low40.9Very low167 Ų167155.1 Ų155.178%0.7880%0.797SS**  trans75.8116159.8-64.1175.1-155.600119.2
8Q36.3Very low40.8Very low150 Ų150156.4 Ų156.470%0.70180%0.8SS**  179.999.4115.1-98.1-177.250.600112.4A10Q8-A10 VanDerWaalsContact C-N 3.35Å; Q8-A10 PolarHBondContact O-N 3.32Å
9P46.2Very low41Very low141 Ų141155.3 Ų155.392%0.91680%0.796SS**THydrogen-bonded Turntrans-92.851.4174.537.8-34.5000112.5
10A46.1Very low40.7Very low66 Ų66154.4 Ų154.455%0.54580%0.797SS.*THydrogen-bonded Turntrans-123.9-20.1-174.600000115.4Q8Q8-A10 VanDerWaalsContact C-N 3.35Å; Q8-A10 PolarHBondContact O-N 3.32Å
11I43.3Very low40.4Very low115 Ų115155.4 Ų155.459%0.5980%0.796SS**SBendtrans-94.6-18.3-166.1-65.2175.1000113.4
12M41.6Very low40.1Very low180 Ų180154.5 Ų154.589%0.88778%0.781SS**THydrogen-bonded Turntrans-72.7-30.1-175.8-64.9-168.3-17200114.4W14 K15M12-W14 VanDerWaalsContact C-N 3.32Å; M12-W14 PolarHBondContact O-N 3.21Å; M12-K15 PolarHBondContact O-N 2.87Å
13L42.6Very low39.9Very low149 Ų149153.4 Ų153.478%0.7878%0.776SS**G310 helixtrans-68.4-26.9-172.9-103162.3000114.1
14W36.3Very low40Very low207 Ų207154.3 Ų154.378%0.78477%0.771SS**G310 helixtrans-80.2-23.9179.4-76.2103000114M12 L16M12-W14 VanDerWaalsContact C-N 3.32Å; M12-W14 PolarHBondContact O-N 3.21Å; W14-L16 VanDerWaalsContact C-N 3.33Å; W14-L16 PolarHBondContact O-N 2.82Å
15K39.3Very low39.3Very low176 Ų176156.1 Ų156.177%0.76577%0.773SS**G310 helixtrans-81.5-4.9-178.4-81.1-166.5171.2-173.40115.1M12M12-K15 PolarHBondContact O-N 2.87Å
16L40.7Very low38.5Very low150 Ų150160.9 Ų160.979%0.78578%0.777SS**G310 helixtrans-88.4-7.8179.3-145.675.7000113.9W14W14-L16 VanDerWaalsContact C-N 3.33Å; W14-L16 PolarHBondContact O-N 2.82Å
17V42.5Very low38Very low113 Ų113158 Ų15869%0.68577%0.773SS**SBendtrans-94.2-25.7-171.4-179.20000113.4
18E39.6Very low37.5Very low179 Ų179156.2 Ų156.284%0.83677%0.769SS**SBendtrans-97.8-6.1-172-63.8-167.4127.100115.1
19N43.6Very low37.3Very low136 Ų136159.9 Ų159.973%0.72778%0.776SS**  trans-121.837.6-163.3-130.731.9000115.3
20V34.7Very low36.6Very low136 Ų136161.2 Ų161.282%0.82477%0.77SS**  trans-10785165.1-174.40000109.4
21K34.8Very low36.1Very low177 Ų177165.8 Ų165.877%0.7779%0.785SS**  trans-77155.7161.9-72.4-177.3178.11780109.5
22Y33.7Very low35.5Very low221 Ų221163.7 Ų163.787%0.86779%0.792SS**  trans-63.2133.7161.2-95.5-121.2000109.1
23E30.2Very low35Very low171 Ų171161.9 Ų161.980%0.79979%0.79SS**  trans-112.3140158.5-90.2-65.8158.900107.3
24D33.2Very low35Very low137 Ų137160.7 Ų160.773%0.73379%0.792SS**  trans-86.9115.7-173.6-80.4-57.5000111Y26D24-Y26 PolarHBondContact O-N 3.2Å
25I30.4Very low34.7Very low155 Ų155155.2 Ų155.280%0.79579%0.785SS**  trans-91.386172.4-54.3179.8000109.6
26Y30.7Very low34.5Very low225 Ų225155.7 Ų155.788%0.88279%0.79SS**  trans-111.590.6152.9-88-85.6000108.3D24D24-Y26 PolarHBondContact O-N 3.2Å
27E31.9Very low33.9Very low168 Ų168153 Ų15379%0.78578%0.784SS**  trans-83.4119.9163-80.5-163.4142.500109.7
28D29.8Very low33.4Very low128 Ų128152.7 Ų152.768%0.68479%0.786SS**  trans-72.4150.2170.4-174.316.8000110.9H30D28-H30 IonicContact OD2-CD2 2.75Å; D28-H30 PolarHBondContact OD2-CD2 3.42Å
29R32Very low33.1Very low228 Ų228156.3 Ų156.386%0.8679%0.792SS**  trans-135.475.5173.1-78-165.5177.5-173.8-0.1110.5
30H31.7Very low32.6Very low169 Ų169157.8 Ų157.878%0.78280%0.799SS**  trans-72.3122.9164.4-108.6-67.6000111D28D28-H30 IonicContact OD2-CD2 2.75Å; D28-H30 PolarHBondContact OD2-CD2 3.42Å
31D35.6Very low32.5Very low162 Ų162156.6 Ų156.687%0.86680%0.797SS**  trans-153.9145164.4-134.1-26.4000111.9
32G29.7Very low32.4Very low71 Ų71156.4 Ų156.473%0.73280%0.799SS**  trans55.595.2163.200000121
33V33Very low32.4Very low141 Ų141154 Ų15486%0.85580%0.8SS**  trans-88.8156.3155.4-152.30000109.7
34P41.2Very low32.4Very low125 Ų125149.6 Ų149.681%0.81280%0.8SS**  -139.7128.1118.734.4-21.5000115.9
35S30.7Very low32.4Very low92 Ų92148.7 Ų148.764%0.64381%0.805SS**  trans6.2139.1152.1-166.10000121.3
36H34.4Very low32.6Very low185 Ų185148 Ų14886%0.85681%0.808SS**  -159.3123.2122.3-99.5-62.5000114.7
37S29.1Very low32.7Very low95 Ų95142.2 Ų142.266%0.66480%0.8SS**  trans27.6104.4150.1-57.70000123.4
38S30.8Very low33Very low106 Ų106142.6 Ų142.674%0.74180%0.801SS**  34.2133.1119.558.10000123.1
39R33.1Very low33.3Very low255 Ų255139.3 Ų139.396%0.96280%0.798SS**  -165.9160.6121.9-105.4162.2-164.1-126.91.4112.6
40L34.4Very low34.2Very low166 Ų166133.3 Ų133.387%0.86979%0.789SS**  trans-129.4135.9-172.5-166.389.3000110.1
41S33.3Very low34.5Very low112 Ų112136 Ų13678%0.78379%0.794SS**  trans-178.4150.8167.4-72.20000108.9
42Q31.7Very low34.4Very low172 Ų172134 Ų13480%0.80479%0.792SS**  cis-178.7121.8-31.3-120.2-176.7-1500105.1
43L33.2Very low34.6Very low172 Ų172135.9 Ų135.990%0.90179%0.794SS**  trans29132.7150.6-73.9159000123.1
44G30.5Very low34.6Very low77 Ų77133.5 Ų133.579%0.79479%0.79SS**  trans-150.7145.3151.700000110
45S33.7Very low34.7Very low118 Ų118133.4 Ų133.483%0.82579%0.789SS**  trans-152.2-172.6-171.3-170.10000111.9
46V34.2Very low35.7Very low142 Ų142134.3 Ų134.386%0.86179%0.792SS**  trans89.3140.6-178179.50000114.1
47S33.3Very low35.7Very low102 Ų102133 Ų13371%0.71379%0.791SS**  cis176.1152.5-20.5-169.50000108.7
48Q37.9Very low35.8Very low176 Ų176134 Ų13482%0.82280%0.798SS**  cis-165.8156.6-20.6-106.9-71.422.600110.8
49G35.8Very low36.2Very low60 Ų60137.7 Ų137.762%0.61980%0.803SS**  trans81.9174.5148.200000120.8
50P50.9Low36.3Very low102 Ų102132 Ų13266%0.66280%0.797SS**  cis-130.5167.8-7.535.8-17.4000116.6
51Y38Very low36.8Very low225 Ų225130.6 Ų130.688%0.88280%0.798SS**  trans70.3134.2174.6-44.4-71.4000116.6
52S33.2Very low37Very low119 Ų119130.1 Ų130.183%0.83280%0.795SS**  cis-146.5171.6-0.3-160.30000112.2
53S35.3Very low37.9Very low111 Ų111127.6 Ų127.678%0.77680%0.796SS**  trans-123.7161.4-161.450.80000113.3
54A32.1Very low38.4Very low92 Ų92126.1 Ų126.176%0.7679%0.789SS**  cis-169.6-160.4-5.100000106.3
55P43.9Very low39.1Very low122 Ų122131 Ų13179%0.79279%0.788SS**  cis-129.9-174-8.444.5-26.8000114.9
56P50.6Low40.1Very low111 Ų111134 Ų13472%0.72179%0.789SS**  trans-117-177-175.441.5-31.3000116.6
57L35.3Very low41.4Very low157 Ų157132 Ų13282%0.82278%0.779SS**  trans81.1142.3176.6-50.8173.5000114.7
58S31.3Very low42.6Very low116 Ų116132.2 Ų132.281%0.81178%0.778SS**  cis-143.8170.829.2-60.30000114.3
59H37.7Very low43.8Very low185 Ų185133.2 Ų133.286%0.85678%0.776SS**  trans-94.9138.6175.5-70.2-99.5000113.8
60T35.6Very low45Very low136 Ų136138.8 Ų138.883%0.83478%0.784SS**  trans-143.2148.1142.146.20000109.4
61P44.8Very low45.4Very low135 Ų135138.5 Ų138.588%0.87778%0.781SS**  trans-98.2129.5177.934.7-30000112.6
62S37.5Very low46.6Very low103 Ų103132.3 Ų132.372%0.7277%0.769SS**  trans-127.2135.9163.859.20000110.4D64S62-D64 PolarHBondContact O-N 3.06Å
63S50.1Low47.5Very low118 Ų118132.4 Ų132.483%0.82577%0.767SS**  trans-97.878.8-171.6171.50000111.7F65S63-F65 PolarHBondContact O-N 3.45Å
64D44.1Very low48Very low141 Ų141138.1 Ų138.175%0.75477%0.773SS**  trans-88.579.5176.2-72.6-66.1000112.1S62 Q66S62-D64 PolarHBondContact O-N 3.06Å; D64-Q66 PolarHBondContact O-N 3.11Å
65F44.9Very low49.1Very low180 Ų180141.9 Ų141.979%0.78978%0.775SS**  trans-75.896.1171-170.5-83.7000109.5S63 P67S63-F65 PolarHBondContact O-N 3.45Å; F65-P67 VanDerWaalsContact O-CD 3.26Å; F65-P67 WeakPolarHBondContact O-CD 3.42Å
66Q55.5Low49.2Very low180 Ų180142.1 Ų142.184%0.84178%0.776SS**PPolyproline II helixtrans-71116.8174.4-81.8-172.5-31.800110.9D64D64-Q66 PolarHBondContact O-N 3.11Å
67P61.7Low49Very low100 Ų100143.9 Ų143.965%0.64978%0.779SS**PPolyproline II helixtrans-71.5151.4171.931.5-34.7000110.7F65 Y69F65-P67 VanDerWaalsContact O-CD 3.26Å; F65-P67 WeakPolarHBondContact O-CD 3.42Å; P67-Y69 PolarHBondContact O-N 3.21Å
68P59.3Low49.2Very low107 Ų107142.2 Ų142.270%0.69578%0.777SS**PPolyproline II helixtrans-64.6132.3179.726.5-34.3000111.7F70P68-F70 PolarHBondContact O-N 3.43Å
69Y61.6Low49.4Very low197 Ų197147.5 Ų147.577%0.77378%0.781SS**PPolyproline II helixtrans-65.6118.7179177.6-93.7000111.6P67 P71P67-Y69 PolarHBondContact O-N 3.21Å; Y69-P71 HydrophobicContact CE1-CB 4.41Å
70F60.8Low49.4Very low178 Ų178147.6 Ų147.678%0.78178%0.781SS**PPolyproline II helixtrans-92.1129.4167-88.5-100.8000110P68P68-F70 PolarHBondContact O-N 3.43Å
71P60.9Low49.4Very low95 Ų95149.9 Ų149.962%0.61778%0.783SS**PPolyproline II helixtrans-68.6148.4172.130.1-34.3000110.8Y69Y69-P71 HydrophobicContact CE1-CB 4.41Å
72P62.1Low49Very low96 Ų96148 Ų14862%0.62377%0.773SS**PPolyproline II helixtrans-66.8152.9177.528.8-35.1000111.8
73P52.6Low49.1Very low120 Ų120152 Ų15278%0.77978%0.78SS**PPolyproline II helixtrans-65.3139.8176.728-34.6000111.2Q75P73-Q75 PolarHBondContact O-N 3.09Å
74Y46.6Very low48.6Very low231 Ų231152.8 Ų152.891%0.90678%0.775SS**PPolyproline II helixtrans-59.8119.1178.4-80.1-94.8000111.6
75Q54Low48.5Very low172 Ų172150.5 Ų150.580%0.80477%0.768SS**PPolyproline II helixtrans-79.9130.8159-70.3-173.8-15.900109.1P73 L77P73-Q75 PolarHBondContact O-N 3.09Å; Q75-L77 PolarHBondContact O-N 3.34Å
76P45.6Very low48.3Very low127 Ų127150.8 Ų150.883%0.82577%0.765SS**PPolyproline II helixtrans-71.9116.3172.928.8-32.3000109.8
77L46.2Very low47.9Very low147 Ų147147.8 Ų147.877%0.7776%0.764SS**PPolyproline II helixtrans-68.9140.6169.9-71.4169000110Q75 Y79Q75-L77 PolarHBondContact O-N 3.34Å; L77-Y79 PolarHBondContact O-N 2.98Å
78P39.7Very low47.2Very low122 Ų122149.8 Ų149.879%0.79277%0.765SS**PPolyproline II helixtrans-68.4117.4174.528.3-33.1000109.9H80P78-H80 PolarHBondContact O-N 3.43Å
79Y35.4Very low46.7Very low227 Ų227150.9 Ų150.989%0.8977%0.769SS**PPolyproline II helixtrans-68.4126.7173.2-95.1-97.4000110.5L77 Q81L77-Y79 PolarHBondContact O-N 2.98Å; Y79-Q81 PolarHBondContact O-N 3.32Å
80H38.7Very low45.7Very low187 Ų187148.7 Ų148.787%0.86677%0.77SS**PPolyproline II helixtrans-65.8129.6166-113.9-98.9000109.4P78 S82P78-H80 PolarHBondContact O-N 3.43Å; H80-S82 PolarHBondContact O-N 3.33Å; H80-S82 VanDerWaalsContact O-N 3.15Å
81Q35.8Very low44.7Very low184 Ų184145.7 Ų145.786%0.8676%0.763SS**  trans-77.799.3-178.4-170.9174.737.500110.5Y79Y79-Q81 PolarHBondContact O-N 3.32Å
82S36Very low43.8Very low97 Ų97146.6 Ų146.668%0.67877%0.768SS**  trans-72.8132.3168.549.30000110.6H80H80-S82 PolarHBondContact O-N 3.33Å; H80-S82 VanDerWaalsContact O-N 3.15Å
83Q40.3Very low42.8Very low186 Ų186152.2 Ų152.287%0.86978%0.779SS**  trans-86.8110177.2-67172.4-72.200110.3
84D38Very low42.3Very low134 Ų134151 Ų15172%0.71777%0.773SS**  trans-79.9125.1173.1-86.5-59.1000111.6Y86D84-Y86 VanDerWaalsContact C-N 3.29Å; D84-Y86 PolarHBondContact O-N 3.49Å
85P42.2Very low41.8Very low94 Ų94147.8 Ų147.861%0.6177%0.77SS**THydrogen-bonded Turntrans-73.2-4-171.2-22.334.8000117.3H88P85-H88 PolarHBondContact O-CE1 3.38Å
86Y41.7Very low40.8Very low186 Ų186146.3 Ų146.373%0.72977%0.768SS**THydrogen-bonded Turntrans-111.829-163.9-79.8-80.4000115.4D84 H88D84-Y86 VanDerWaalsContact C-N 3.29Å; D84-Y86 PolarHBondContact O-N 3.49Å; Y86-H88 PolarHBondContact O-N 2.64Å
87S45.9Very low40.5Very low116 Ų116146.5 Ų146.581%0.81177%0.769SS**THydrogen-bonded Turntrans-7014.9-177.254.60000116.7
88H48.9Very low39.9Very low143 Ų143146.1 Ų146.166%0.66277%0.768SS**THydrogen-bonded Turntrans-132.719.1-166.851.3-95.4000115.3P85 Y86P85-H88 PolarHBondContact O-CE1 3.38Å; Y86-H88 PolarHBondContact O-N 2.64Å
89V46.9Very low39.7Very low129 Ų129148.2 Ų148.278%0.78277%0.766SS**  trans-99.3116.8161.9-80.20000109.6
90N42.6Very low39.6Very low151 Ų151146.5 Ų146.581%0.80777%0.766SS**  trans-105.7131.3-171.9-164.113.1000110.5
91D39.2Very low39.6Very low115 Ų115142.4 Ų142.462%0.61576%0.756SS**  trans-89.9115.4-168.5-161.7-13.2000111.5Y93 S94D91-Y93 PolarHBondContact O-N 3Å; D91-S94 PolarHBondContact O-N 3.06Å; D91-S94 PolarHBondContact O-OG 3.39Å
92P40.8Very low39.4Very low114 Ų114142.5 Ų142.574%0.7476%0.757SS**THydrogen-bonded Turntrans-72.915.5-161.628.8-37.9000117.1
93Y41.1Very low39.2Very low215 Ų215146.3 Ų146.384%0.84376%0.764SS**THydrogen-bonded Turntrans-111.210.2174.3-74.7-78.4000114.4D91 L95D91-Y93 PolarHBondContact O-N 3Å; Y93-L95 PolarHBondContact O-N 3.45Å
94S43Very low38.8Very low93 Ų93146 Ų14665%0.6576%0.762SS**  trans-84.4107.2-178.3-57.60000112.9D91D91-S94 PolarHBondContact O-N 3.06Å; D91-S94 PolarHBondContact O-OG 3.39Å
95L35Very low38.9Very low164 Ų164144.9 Ų144.986%0.85976%0.762SS**  trans-117.1118.9171.2-79.7173.2000112.6Y93Y93-L95 PolarHBondContact O-N 3.45Å
96N33.8Very low38.3Very low141 Ų141153 Ų15375%0.75478%0.781SS**  trans52.6102.2164.8-70.41.9000120.2
97P38.4Very low37.7Very low131 Ų131148 Ų14885%0.85179%0.786SS**  trans-111.4107.7139.133.1-21.7000110
98L33.8Very low37Very low140 Ų140150.3 Ų150.373%0.73378%0.784SS**  trans-117.3119.9-179.7-145.182.1000112.6
99H35.8Very low36.1Very low166 Ų166153.2 Ų153.277%0.76979%0.789SS**  trans63.3109.2170.2-65113.5000120
100Q33.2Very low35.2Very low190 Ų190154.1 Ų154.189%0.88879%0.785SS**  trans-127.6127135-171.6-177.469.500107.6
101P39.3Very low34.5Very low101 Ų101156.1 Ų156.166%0.65678%0.781SS**  -138.6179.7120.341.2-29.2000110.5
102Q31.1Very low34Very low186 Ų186155.8 Ų155.887%0.86978%0.776SS**  cis-149.4176.18.6-149.2169.630.200111
103Q33.2Very low33.5Very low177 Ų177157.8 Ų157.883%0.82778%0.775SS**  trans-77157.1179-67.4-77.6-3.500113.9
104H31.1Very low33.1Very low180 Ų180154.3 Ų154.383%0.83378%0.776SS**  trans-77.7157.6168.4-61.4-67.9000112.4
105P39.6Very low32.4Very low111 Ų111153.2 Ų153.272%0.72178%0.78SS**  -148.2150108.535.3-18.5000117.3
106W29.2Very low32.2Very low264 Ų264150.9 Ų150.9100%178%0.777SS**  trans27.9125.7148.9-64.590.2000122.6
107G30.8Very low32.1Very low81 Ų81152.4 Ų152.484%0.83578%0.78SS**  trans-165.2147.1161.600000113.2
108Q30.6Very low32Very low164 Ų164153.4 Ų153.477%0.76678%0.783SS**  trans-102.7164.9177.4-86.7-160.1-5.200112.7
109R28.9Very low31.9Very low204 Ų204150.2 Ų150.277%0.7778%0.784SS**  trans70.1164.2161.3-70.7165.1-167.3-96.19.5115.3
110Q28.7Very low31.7Very low149 Ų149147.7 Ų147.770%0.69679%0.785SS**  cis-178.4161.4-28.2-179.4173.7-2.900105.7
111R28.4Very low31.8Very low192 Ų192146.5 Ų146.573%0.72578%0.784SS**  trans75.6114165.7-95.4-162.3155.3-112.6-6.6119.6
112Q28.7Very low31.6Very low108 Ų108149.6 Ų149.651%0.50579%0.794SS.*  87.6112108.9-145.3124.2-8.100122.3
113E29.9Very low32.3Very low157 Ų157146.2 Ų146.273%0.73479%0.789SS**  trans83.6161.8133.3-96.1163.8-127.500123.9
114V31.9Very low32.5Very low141 Ų141145.4 Ų145.486%0.85579%0.785SS**  trans67.5121.4-179.6-161.80000115.4
115G29.1Very low33Very low71 Ų71142.6 Ų142.673%0.73278%0.782SS**  cis134.197.2-7.700000113.6
116S31.1Very low32.7Very low114 Ų114148.4 Ų148.480%0.79779%0.79SS**  trans-172.8101.6162-169.20000107
117E31.5Very low32.9Very low174 Ų174140.8 Ų140.881%0.81378%0.784SS**  74.683.476.9-70.1-69.2102.400114.2
118T36.1Very low33Very low151 Ų151141.9 Ų141.993%0.92678%0.784SS**  trans-171.8145.1134.215.90000109.9
119G32Very low33.3Very low73 Ų73142 Ų14275%0.75379%0.79SS**  trans-94.9-161.8-172.500000115.2
120S32.1Very low34.1Very low113 Ų113137.7 Ų137.779%0.7979%0.788SS**  cis-164.8155.70.3-144.10000113.2
121L34.8Very low34.3Very low165 Ų165138.9 Ų138.986%0.86479%0.794SS**  trans71.6144.8160.1-55.6179.9000121.6
122L35.1Very low34.4Very low166 Ų166138.3 Ų138.387%0.86980%0.804SS**  trans-102.1-168.8176-65.9161.5000109
123P44.9Very low34.5Very low116 Ų116138.7 Ų138.775%0.75382%0.819SS**  cis-132177.7-7.726.6-2.6000115.4
124Q37.2Very low34.6Very low159 Ų159134.6 Ų134.674%0.74382%0.818SS**  trans-81.3160.3161.1-161.5-160.28700111
125P43.2Very low34.8Very low121 Ų121136.1 Ų136.179%0.78682%0.82SS**  trans-129159.1135.836.9-28.8000114.6
126R32Very low35.2Very low233 Ų233139.6 Ų139.688%0.87982%0.823SS**  trans-78.1155.6-176.5-67.1168.1159.1134.5-8.9113.2
127A34Very low35.9Very low105 Ų105139.7 Ų139.787%0.86882%0.82SS**  trans-120.2153.115000000109.5
128A32.7Very low36Very low103 Ų103141.7 Ų141.785%0.85182%0.82SS**  trans-113.5156.5-171.600000113.1
129L36.8Very low36Very low168 Ų168146.3 Ų146.388%0.8882%0.821SS**PPolyproline II helixtrans-100.1125.5-179.5-124.8158000109.9
130P45Very low36Very low112 Ų112149.1 Ų149.173%0.72782%0.818SS**PPolyproline II helixtrans-77.2139.5170.2-9.125.8000110.9
131Q32.9Very low36Very low175 Ų175154.7 Ų154.782%0.81882%0.824SS**PPolyproline II helixtrans-94.2145.3160.5-73.5-153.2-18.600110.4
132L32.1Very low35.9Very low180 Ų180154.5 Ų154.594%0.94282%0.818SS**  trans-137.5137.3155.9-75.8178.4000109.3
133S31.2Very low35.8Very low116 Ų116152.5 Ų152.581%0.81182%0.818SS**  trans-125.1141.4175.5-640000108.7
134G31.4Very low35.2Very low70 Ų70152.9 Ų152.972%0.72282%0.818SS**  trans145.8131.1156.400000118.1
135L35.6Very low35Very low173 Ų173156.5 Ų156.591%0.90683%0.825SS**  trans75.694.4145.2-49.7-175.6000119.5
136D37.6Very low34.6Very low145 Ų145160.2 Ų160.278%0.77582%0.823SS**  trans-71.7141.5147.8172.33.4000110.1R138D136-R138 PolarHBondContact OD1-N 3.22Å
137P44.8Very low35Very low115 Ų115154.8 Ų154.875%0.74782%0.818SS**  trans-138.9107.5135.335.2-20.7000115.5
138R35.4Very low34.9Very low216 Ų216155.8 Ų155.882%0.81581%0.809SS**  trans45.7120.5138.8-71-174166.2111.7-2.3119.1D136D136-R138 PolarHBondContact OD1-N 3.22Å
139R34.5Very low34.9Very low249 Ų249156.8 Ų156.894%0.9480%0.804SS**  trans-138.6116.7141.3-86.7-166.4172.3-161.2-2.2111.9
140D33.5Very low34.8Very low131 Ų131156.7 Ų156.770%0.70180%0.804SS**  trans-70.4151.1162.1-55-92.7000111.1
141Y32Very low34.2Very low230 Ų230159.2 Ų159.290%0.90281%0.81SS**  trans-151.6153145.7-128.4-86.6000111.5
142H31.6Very low34.3Very low162 Ų162159 Ų15975%0.7581%0.809SS**  trans-85.5150.6-158.8-72.2-92.4000116.5
143S32.5Very low34.1Very low124 Ų124156 Ų15687%0.86780%0.803SS**  trans-60.9125.2163.5-43.20000112.4
144V33.2Very low34Very low124 Ų124154.8 Ų154.875%0.75280%0.8SS**  trans-136.4103.2169.5-175.80000112.2
145R32Very low34.1Very low234 Ų234160 Ų16088%0.88381%0.805SS**  trans57.1124.7149.4-66.8-171176.3-153-0.9122
146R35.3Very low33.9Very low199 Ų199161.3 Ų161.375%0.75181%0.807SS**  trans-61.5156.6140.4-64.7177.8176.5176.9-2.5111.5D148R146-D148 WeakPolarHBondContact CD-OD2 3.28Å; R146-D148 IonicContact NH1-OD1 3.73Å; R146-D148 IonicContact NH1-OD2 3.69Å
147P40.6Very low33.5Very low119 Ų119157.8 Ų157.877%0.77380%0.804SS**  trans-100.3110.2145.120.6-2.6000110.5
148D32.4Very low33Very low127 Ų127160.8 Ų160.868%0.67981%0.813SS**  trans-81.3124.1160.8-77.1-84.6000108.3R146R146-D148 WeakPolarHBondContact CD-OD2 3.28Å; R146-D148 IonicContact NH1-OD1 3.73Å; R146-D148 IonicContact NH1-OD2 3.69Å
149V33.1Very low32.9Very low124 Ų124157.3 Ų157.375%0.75281%0.81SS**  trans-132.890.9172.5-175.70000109.7
150L34.5Very low32.9Very low166 Ų166151 Ų15187%0.86981%0.805SS**  trans-107.9120.3159.6-78.8171.9000108
151L32.9Very low32.9Very low164 Ų164148 Ų14886%0.85981%0.805SS**  trans-138.5130.4169.6-117.9167.4000108.9
152H33.4Very low33Very low170 Ų170146.2 Ų146.279%0.78781%0.807SS**  trans-88.8135.2-175.6-72.346000111
153S28.3Very low33Very low118 Ų118141.3 Ų141.383%0.82580%0.801SS**  trans-157116.9149.3-86.80000105.9
154A30Very low33.1Very low91 Ų91143.3 Ų143.375%0.75280%0.801SS**  109.1136.853.300000108.9
155H33.9Very low33Very low179 Ų179142.2 Ų142.283%0.82980%0.799SS**  trans-45.1134.3-169.7-54.9-102.2000116.1
156H31.3Very low33.1Very low201 Ų201138.9 Ų138.993%0.93180%0.798SS**  trans-145.4142.4131.2-85.8-71.2000109.4
157G29.3Very low33Very low70 Ų70134.7 Ų134.772%0.72280%0.799SS**  trans-131154.116200000108.3
158L34.2Very low32.7Very low179 Ų179136.3 Ų136.394%0.93780%0.801SS**  trans-154.6152.3166.7-109.5174.4000109.9
159D31.9Very low32.7Very low142 Ų142138.2 Ų138.276%0.75981%0.805SS**  trans-95.9144.3171.6172.244.1000110.1
160S35.3Very low32.5Very low117 Ų117135.1 Ų135.182%0.81880%0.798SS**  trans167141.3163.6-77.60000108.7
161G33.2Very low32.5Very low69 Ų69136 Ų13671%0.71180%0.802SS**  cis120.956.93.800000112.9
162M35.1Very low32.2Very low191 Ų191131.5 Ų131.594%0.94180%0.796SS**  trans-158.7145.5173.8-150.863.3120.300110.4
163G31.1Very low32.2Very low60 Ų60132.1 Ų132.162%0.61980%0.798SS**  cis152.856.2-6.600000115.1
164D34.2Very low33Very low165 Ų165132.3 Ų132.388%0.88280%0.797SS**  trans66.8172.8152.6-129.6-31.1000120.8
165S30.6Very low33Very low101 Ų101131.1 Ų131.171%0.70679%0.794SS**  trans68.9141.5-176.5-94.20000117.1
166L33.9Very low32.9Very low164 Ų164130.6 Ų130.686%0.85979%0.793SS**  cis-118.5159.318.3-67.7163.8000113.9
167S33.8Very low32.9Very low111 Ų111128.6 Ų128.678%0.77679%0.785SS**  trans-147.1127.3173.2-74.40000111.7
168L33.6Very low32.9Very low153 Ų153133.2 Ų133.280%0.80179%0.788SS**  trans170.7144.2164-119.657.2000107.3
169H33.3Very low32.8Very low168 Ų168129.8 Ų129.878%0.77877%0.773SS**  cis-124.3172.1-8.5-78.9-98.3000107.8
170G28.7Very low32.6Very low58 Ų58131.9 Ų131.960%0.59878%0.779SS**  cis116.6130.96.400000112.1
171I34.2Very low32.4Very low184 Ų184131.5 Ų131.594%0.94478%0.776SS**  trans76.3129.6-174.4-47.9165000113.4
172G27.3Very low32.4Very low71 Ų71135.3 Ų135.373%0.73279%0.785SS**  cis178.7148-7.900000113.4
173H33.2Very low32.3Very low182 Ų182134.9 Ų134.984%0.84378%0.781SS**  trans-95.6154.7174.7-97.7-69.3000111.8
174P43.9Very low32.4Very low122 Ų122139.8 Ų139.879%0.79279%0.793SS**  -110.7-17988.6-9.229.5000112.7
175G30.8Very low32.3Very low67 Ų67136 Ų13669%0.69179%0.785SS**  cis112.3132.22100000109
176M32.9Very low32.3Very low167 Ų167138.8 Ų138.882%0.82379%0.792SS**  cis-144-17813.3-69.415557.600111.5
177E30.7Very low32.2Very low160 Ų160138 Ų13875%0.74879%0.789SS**  trans6.8156.9146.7-69.5150.2151.300121.2
178E29.3Very low32.1Very low167 Ų167138.2 Ų138.278%0.7879%0.79SS**  cis-160.5146.327.1-142.3-168.9143.800113.9
179V31.3Very low31.8Very low106 Ų106134.1 Ų134.164%0.64279%0.785SS**  trans48.5143.6137.6165.70000125.4
180Q27.9Very low31.8Very low186 Ų186135 Ų13587%0.86979%0.791SS**  trans103.9148.5148.7-102.4155.732.400122.9
181S31.5Very low32Very low110 Ų110139.2 Ų139.277%0.76980%0.8SS**  trans-127.9150.7-168.1-22.90000110.7
182V32.7Very low31.9Very low148 Ų148137.9 Ų137.990%0.89779%0.794SS**  trans-154.6168.6153.3-111.10000111
183E33.1Very low32.3Very low183 Ų183140.9 Ų140.986%0.85579%0.793SS**  trans-105.5157.5-161-60.5158109.100114.2
184D32.8Very low32.2Very low162 Ų162139.9 Ų139.987%0.86679%0.794SS**  trans40.6159.4143.6-109.3-51000125.9
185A31.9Very low31.8Very low87 Ų87142 Ų14272%0.71979%0.793SS**  trans59.6103.3156.300000120.6
186N30.8Very low31.9Very low159 Ų159144.5 Ų144.585%0.8580%0.8SS**  -146141.6117.5-154.4-11.1000113
187N32.8Very low32Very low148 Ų148143.2 Ų143.279%0.79180%0.801SS**  trans-144.5117.4176.9168.927.6000109.5
188S31.6Very low32.5Very low114 Ų114143 Ų14380%0.79780%0.804SS**  trans-165.4138.1167.1-86.60000113
189G28.1Very low33.3Very low68 Ų68145.5 Ų145.570%0.70181%0.812SS**  trans96.481.4143.900000118.3
190M32Very low33.4Very low185 Ų185149.3 Ų149.391%0.91182%0.82SS**  -159.314397.4-157.159.470.500110.9
191N32.3Very low33.8Very low147 Ų147146.7 Ų146.779%0.78682%0.816SS**  trans-152.3120.7178.5-170.6-5.8000108.8
192L32.5Very low33.9Very low156 Ų156146.9 Ų146.982%0.81782%0.815SS**  trans-154130.3169.5-14372000111.4
193L37Very low34.4Very low135 Ų135146.3 Ų146.371%0.70781%0.812SS**  trans2.4141.2161.7-81.866.3000118.6
194D31Very low34.7Very low161 Ų161142 Ų14286%0.86180%0.8SS**  -141.9172.666.9-146.4-8.4000117.2
195Q34.3Very low35.1Very low166 Ų166140.5 Ų140.578%0.77680%0.798SS**  trans-122.3120.1-158.2-165.4-176.7122.600111
196S33.4Very low35.4Very low120 Ų120145.2 Ų145.284%0.83980%0.803SS**  trans-149.6143.316761.90000112.9
197V34.6Very low35.6Very low139 Ų139141.7 Ų141.784%0.84279%0.791SS**  trans-104.7108.5-176.3177.70000110
198I41.1Very low36.3Very low156 Ų156139.4 Ų139.480%0.878%0.782SS**  trans-154.6136.8157.2-100.6143000108.9K200I198-K200 PolarHBondContact O-N 3.18Å
199K46.1Very low36.6Very low219 Ų219138.2 Ų138.295%0.95277%0.77SS**  trans-71.1108.9175.5-73.4174.3176.6171.70110
200K34.5Very low37.1Very low187 Ų187139.5 Ų139.581%0.81377%0.768SS**  trans-123.4122.8168.5-157.3171-172.1175.40109.7I198 P202I198-K200 PolarHBondContact O-N 3.18Å; K200-P202 WeakPolarHBondContact O-CD 3.44Å
201V35.3Very low37.8Very low130 Ų130133 Ų13379%0.78874%0.737SS**  trans-71122.8-177.4179.10000109.6V203V201-V203 PolarHBondContact O-N 3.03Å
202P33.5Very low38.2Very low115 Ų115131.5 Ų131.575%0.74773%0.726SS**  trans-70.5121.1174.3-17.532.1000110.6K200 P204K200-P202 WeakPolarHBondContact O-CD 3.44Å; P202-P204 WeakPolarHBondContact O-CD 3.35Å
203V44.6Very low38.8Very low136 Ų136131.1 Ų131.182%0.82472%0.722SS**  trans-85.3113.7164.3-143.30000106.7V201V201-V203 PolarHBondContact O-N 3.03Å
204P37.6Very low38.4Very low93 Ų93131.6 Ų131.660%0.60473%0.725SS**  trans-74.5130.6-173.228-33.8000111P202 K206P202-P204 WeakPolarHBondContact O-CD 3.35Å; P204-K206 PolarHBondContact O-N 3.05Å; P204-K206 VanDerWaalsContact O-N 3.07Å
205P41.6Very low38.8Very low129 Ų129133.2 Ų133.284%0.83873%0.725SS**  trans-67.1109.2170.228.1-32.5000108.7S207P205-S207 PolarHBondContact O-N 3.29Å
206K38.7Very low38.9Very low187 Ų187132 Ų13281%0.81372%0.723SS**  trans-73.298.6176.7-75.7-174.1176.5-179.60109.8P204 V208P204-K206 PolarHBondContact O-N 3.05Å; P204-K206 VanDerWaalsContact O-N 3.07Å; K206-V208 PolarHBondContact O-N 3.01Å
207S35.5Very low39Very low85 Ų85130.2 Ų130.259%0.59472%0.724SS**  trans-46.1124.8166.8169.70000111P205 T209P205-S207 PolarHBondContact O-N 3.29Å; S207-T209 WeakPolarHBondContact OG-CB 3.45Å; S207-T209 PolarHBondContact OG-N 2.64Å; S207-T209 PolarHBondContact OG-OG1 3.48Å
208V47.8Very low39.2Very low100 Ų100132.6 Ų132.661%0.60672%0.724SS**THydrogen-bonded Turntrans-889.9173.1-66.10000112.4K206 S210 S393K206-V208 PolarHBondContact O-N 3.01Å; V208-S210 VanDerWaalsContact C-N 3.28Å; V208-S210 PolarHBondContact O-N 3.31Å; V208-S393 PolarHBondContact O-OG 2.89Å
209T38.1Very low39.2Very low89 Ų89133.3 Ų133.355%0.54673%0.728SS.*THydrogen-bonded Turntrans-76.1-15.3-179.4-38.50000112.5S207 L211S207-T209 WeakPolarHBondContact OG-CB 3.45Å; S207-T209 PolarHBondContact OG-N 2.64Å; S207-T209 PolarHBondContact OG-OG1 3.48Å; T209-L211 VanDerWaalsContact C-N 3.27Å; T209-L211 PolarHBondContact O-N 3.09Å; T209-L211 VanDerWaalsContact O-N 3.16Å
210S38.5Very low38.9Very low95 Ų95126 Ų12666%0.66471%0.714SS**THydrogen-bonded Turntrans-8950.5177-1590000113V208V208-S210 VanDerWaalsContact C-N 3.28Å; V208-S210 PolarHBondContact O-N 3.31Å
211L46.6Very low39.2Very low49 Ų49121.4 Ų121.426%0.25772%0.72SS.*THydrogen-bonded Turntrans-110.9-5.4161.7-69.5-177.4000112.6T209 M213 P259 H397T209-L211 VanDerWaalsContact C-N 3.27Å; T209-L211 PolarHBondContact O-N 3.09Å; T209-L211 VanDerWaalsContact O-N 3.16Å; L211-M213 PolarHBondContact O-N 3.14Å; L211-P259 HydrophobicContact CD2-CB 4.42Å; L211-H397 HydrophobicContact CD1-CB 4.28Å
212M40.2Very low40.2Very low114 Ų114120.5 Ų120.556%0.56271%0.71SS**SBendtrans-61.3127.8163.7-59.7-173.1112.300108.1N214 P389M212-N214 PolarHBondContact O-N 3.26Å; M212-N214 VanDerWaalsContact O-N 3.08Å; M212-P389 HydrophobicContact CE-CB 3.82Å; M212-P389 HydrophobicContact CE-CG 3.92Å; M212-P389 HydrophobicContact SD-CB 4.3Å
213M44.5Very low41.7Very low149 Ų149120.6 Ų120.673%0.73471%0.713SS**  trans-66.6113.4-173-70.7-169.5173.400110.5L211 K215 P377L211-M213 PolarHBondContact O-N 3.14Å; M213-K215 VanDerWaalsContact C-N 3.3Å; M213-K215 PolarHBondContact O-N 3.37Å; M213-P377 HydrophobicContact CE-CG 3.8Å
214N29.8Very low43.4Very low144 Ų144115.9 Ų115.977%0.7769%0.685SS**  trans-61.295.1167.5-94.1-5.4000109.6M212 D216M212-N214 PolarHBondContact O-N 3.26Å; M212-N214 VanDerWaalsContact O-N 3.08Å; N214-D216 PolarHBondContact O-N 2.91Å
215K39.3Very low45.8Very low196 Ų196116.5 Ų116.585%0.85268%0.683SS**SBendtrans-64.677152.7178.4-160.3168.3-173.30107.4M213M213-K215 VanDerWaalsContact C-N 3.3Å; M213-K215 PolarHBondContact O-N 3.37Å
216D36.6Very low48.1Very low139 Ų139112 Ų11274%0.74365%0.654SS**  trans-171.969.5157.9-91-25.5000110.1N214 F218N214-D216 PolarHBondContact O-N 2.91Å; D216-F218 PolarHBondContact O-N 2.81Å; D216-F218 VanDerWaalsContact O-N 3.16Å
217G35.1Very low50.5Low83 Ų83104.6 Ų104.686%0.85663%0.63SS**  trans-8353.1169.900000112.1L219G217-L219 PolarHBondContact O-N 3.47Å
218F39.4Very low53.2Low190 Ų190105.2 Ų105.283%0.83362%0.623SS**  trans-78.285.4-171.9-157.2-82.5000112.5D216D216-F218 PolarHBondContact O-N 2.81Å; D216-F218 VanDerWaalsContact O-N 3.16Å
219L40.8Very low55.5Low170 Ų170103.1 Ų103.189%0.8961%0.611SS**SBendtrans-171.5104.1150-104.4169.4000109.5G217G217-L219 PolarHBondContact O-N 3.47Å
220G38.1Very low58.3Low65 Ų6599.2 Ų99.267%0.6759%0.586SS**SBendtrans9952162.600000118.9I222G220-I222 VanDerWaalsContact C-N 3.26Å; G220-I222 PolarHBondContact O-N 3Å
221G41.8Very low61Low91 Ų9196.1 Ų96.194%0.93856%0.564SS**  trans58.7-9.313800000122.7
222I56.5Low63.4Low111 Ų11197.1 Ų97.157%0.56958%0.575SS**  trans-98.5111.4-175.4-59.9175.2000109.7G220 V224G220-I222 VanDerWaalsContact C-N 3.26Å; G220-I222 PolarHBondContact O-N 3Å; I222-V224 PolarHBondContact O-N 2.96Å
223S65.6Low66Low117 Ų11791.8 Ų91.882%0.81855%0.549SS*.  trans-71.494.6171.347.30000110.6N225S223-N225 PolarHBondContact O-N 3.09Å
224V80.6Confident68.3Low38 Ų3888 Ų8823%0.2354%0.536CS..  trans-58.5109.7179-179.10000110.3I222 T226 V250 L293I222-V224 PolarHBondContact O-N 2.96Å; V224-T226 HydrophobicContact CG1-CG2 4.32Å; V224-T226 WeakPolarHBondContact O-CG2 3.4Å; V224-T226 PolarHBondContact O-N 2.84Å; V224-V250 HydrophobicContact CG1-CG1 3.44Å; V224-V250 VanDerWaalsContact CG1-CG1 3.44Å; V224-L293 HydrophobicContact CG1-CD2 4.04Å; V224-L293 HydrophobicContact CG1-CG 4.41Å
225N86.7Confident71.3Confident105 Ų10582 Ų8256%0.56151%0.507SS*.  trans-76.586.3180-168.1-29.5000110.7S223 G227 E228S223-N225 PolarHBondContact O-N 3.09Å; N225-G227 PolarHBondContact O-N 3.5Å; N225-G227 PolarHBondContact OD1-N 2.67Å; N225-E228 HydrophobicContact CB-CB 4.34Å; N225-E228 VanDerWaalsContact O-CB 3.3Å; N225-E228 WeakPolarHBondContact O-CB 3.5Å; N225-E228 PolarHBondContact O-N 3Å
226T89.2Confident73.8Confident36 Ų3677.4 Ų77.422%0.22149%0.485CS..THydrogen-bonded Turntrans-64-10-173.770.70000115.1V224 G251 R382V224-T226 HydrophobicContact CG1-CG2 4.32Å; V224-T226 WeakPolarHBondContact O-CG2 3.4Å; V224-T226 PolarHBondContact O-N 2.84Å; T226-G251 WeakPolarHBondContact O-CA 3.36Å; T226-G251 PolarHBondContact O-N 3.04Å; T226-R382 PolarHBondContact O-NH2 3.28Å; T226-R382 PolarHBondContact OG1-NE 3.13Å; T226-R382 PolarHBondContact OG1-NH2 3.02Å
227G89.1Confident76.4Confident30 Ų3076.2 Ų76.231%0.30948%0.478SS..THydrogen-bonded Turntrans-90.4-12.6173.700000114.6N225N225-G227 PolarHBondContact O-N 3.5Å; N225-G227 PolarHBondContact OD1-N 2.67Å
228E93.8Very high78.8Confident99 Ų9973.8 Ų73.846%0.46345%0.448SS..SBendtrans-64.9146.9179.7-168.8-170.3147.400111.7N225 F230 T249 V250N225-E228 HydrophobicContact CB-CB 4.34Å; N225-E228 VanDerWaalsContact O-CB 3.3Å; N225-E228 WeakPolarHBondContact O-CB 3.5Å; N225-E228 PolarHBondContact O-N 3Å; E228-F230 PolarHBondContact O-N 3.48Å; E228-T249 CarbonylContact O-C 3.53Å; E228-T249 WeakPolarHBondContact O-CA 3.31Å; E228-T249 VanDerWaalsContact O-CB 3.32Å; E228-T249 WeakPolarHBondContact O-CB 3.43Å; E228-V250 HydrophobicContact CB-CG2 3.92Å; E228-V250 PolarHBondContact O-N 3.03Å
229V95.5Very high81Confident56 Ų5671 Ų7134%0.33944%0.441SS..EExtended strand (participates in β ladder)trans-85.4106.1178.3-178.40000110.3C231 K247 V248V229-C231 VanDerWaalsContact CG1-O 3.24Å; V229-C231 WeakPolarHBondContact CG1-O 3.45Å; V229-K247 HydrophobicContact CG1-CB 3.98Å; V229-K247 HydrophobicContact CG1-CG 4.08Å; V229-K247 HydrophobicContact CG2-CB 4.16Å; V229-K247 HydrophobicContact CG2-CD 3.92Å; V229-K247 HydrophobicContact CG2-CG 4.18Å; V229-V248 CarbonylContact C-O 3.58Å
230F95.8Very high82.7Confident7 Ų770.9 Ų70.93%0.03144%0.44CS..EExtended strand (participates in β ladder)trans-66.6-42.1176.4-175.1-112.6000112.3E228 V248 V250 V253 L272 L284 R287 L288 I291E228-F230 PolarHBondContact O-N 3.48Å; F230-V248 PolarHBondContact N-O 3.2Å; F230-V250 HydrophobicContact CB-CG2 4.29Å; F230-V253 HydrophobicContact CB-CG2 4.19Å; F230-V253 HydrophobicContact CD1-CG2 3.87Å; F230-V253 HydrophobicContact CG-CG2 4.14Å; F230-L272 HydrophobicContact CD1-CD1 4.34Å; F230-L272 HydrophobicContact CD1-CD2 4.17Å; F230-L272 HydrophobicContact CE1-CD1 3.83Å; F230-L272 HydrophobicContact CE1-CD2 4.48Å; F230-L284 HydrophobicContact CE1-CD1 4.25Å; F230-L284 HydrophobicContact CZ-CD1 4.2Å; F230-R287 HydrophobicContact CE2-CG 3.9Å; F230-R287 HydrophobicContact CZ-CB 4.45Å; F230-R287 HydrophobicContact CZ-CG 4.07Å; F230-R287 PolarHBondContact O-NH1 3.35Å; F230-R287 PolarHBondContact O-NH2 2.97Å; F230-L288 HydrophobicContact CE1-CD2 4.33Å; F230-L288 HydrophobicContact CE2-CD2 3.94Å; F230-L288 HydrophobicContact CZ-CD2 3.69Å; F230-L288 HydrophobicContact CZ-CG 4.23Å; F230-I291 HydrophobicContact CD2-CD1 3.56Å; F230-I291 HydrophobicContact CE2-CD1 3.73Å
231C95.8Very high84.5Confident29 Ų2973.1 Ų73.120%0.19645%0.446CS..EExtended strand (participates in β ladder)trans-159.3175168.566.90000111.4V229 V248V229-C231 VanDerWaalsContact CG1-O 3.24Å; V229-C231 WeakPolarHBondContact CG1-O 3.45Å; C231-V248 PolarHBondContact N-O 2.68Å; C231-V248 PolarHBondContact O-N 3.49Å
232S96.6Very high86.1Confident71 Ų7172.4 Ų72.450%0.49743%0.426SS..EExtended strand (participates in β ladder)trans-112.7138.9163.3-61.40000109.8Y246S232-Y246 CarbonylContact C-O 3.59Å; S232-Y246 VanDerWaalsContact CA-O 3.26Å; S232-Y246 WeakPolarHBondContact CA-O 3.49Å
233V95.5Very high87Confident2 Ų271 Ų711%0.01242%0.423CS..EExtended strand (participates in β ladder)trans-120.2141-179-61.40000111.3K245 Y246 V248 L272 V312V233-K245 CarbonylContact O-C 3.53Å; V233-K245 WeakPolarHBondContact O-CA 3.5Å; V233-Y246 PolarHBondContact N-O 2.75Å; V233-Y246 PolarHBondContact O-N 2.7Å; V233-V248 HydrophobicContact CG1-CG2 3.97Å; V233-V248 HydrophobicContact CG2-CG2 3.94Å; V233-L272 WeakPolarHBondContact CG1-O 3.36Å; V233-V312 HydrophobicContact CG2-CG1 4.15Å; V233-V312 HydrophobicContact CG2-CG2 3.82Å
234P93.1Very high87.9Confident70 Ų7067.6 Ų67.646%0.45540%0.399SS..EExtended strand (participates in β ladder)trans-71.5136.6173.630.5-34.1000110.4R273P234-R273 VanDerWaalsContact O-CD 3.23Å; P234-R273 WeakPolarHBondContact O-CD 3.46Å; P234-R273 PolarHBondContact O-NH1 2.94Å
235G93Very high88.4Confident16 Ų1673.5 Ų73.517%0.16542%0.421CS..  trans-60.4140.3-17500000114.3S244 E315G235-S244 PolarHBondContact N-O 3.26Å; G235-E315 VanDerWaalsContact CA-OE1 3.27Å; G235-E315 WeakPolarHBondContact CA-OE1 3.25Å
236R92Very high88.9Confident101 Ų10170.2 Ų70.238%0.38140%0.401SS..SBendtrans-77.6-34.6174.4-60.4-163.4-166.8-85-1.3113G270 S310 E315R236-G270 PolarHBondContact NH2-O 3.24Å; R236-S310 VanDerWaalsContact CZ-O 3.3Å; R236-S310 PolarHBondContact NE-O 3.05Å; R236-S310 PolarHBondContact NH2-O 3.44Å; R236-E315 PolarHBondContact N-OE1 3.44Å
237L89.8Confident89.2Confident114 Ų11475.3 Ų75.360%0.59742%0.421SS*.SBendtrans-97.510.3-177.3-53.9-179.2000112.2L311 L319L237-L311 HydrophobicContact CD1-CD2 4.1Å; L237-L311 HydrophobicContact CG-CD2 4.33Å; L237-L319 HydrophobicContact CD1-CD1 4.07Å; L237-L319 HydrophobicContact CD1-CD2 4.03Å; L237-L319 HydrophobicContact CD1-CG 4.5Å
238S85.2Confident89.6Confident32 Ų3274 Ų7422%0.22441%0.406CS..  trans-84.8128.1177.4-81.70000111.2S242 S244S238-S242 VanDerWaalsContact CB-O 3.23Å; S238-S242 WeakPolarHBondContact CB-O 3.4Å; S238-S242 PolarHBondContact OG-O 3.48Å; S238-S244 WeakPolarHBondContact OG-CB 3.41Å; S238-S244 PolarHBondContact OG-N 3.49Å
239L85.6Confident89.7Confident131 Ų13169.9 Ų69.969%0.68639%0.388SS*.  trans-68.4156.1163.7-60.7179.4000110.4S241 S242 T243L239-S241 VanDerWaalsContact C-N 3.3Å; L239-S241 PolarHBondContact O-N 3.11Å; L239-S242 CarbonylContact O-C 3.57Å; L239-S242 VanDerWaalsContact O-C 3.24Å; L239-S242 WeakPolarHBondContact O-CA 3.5Å; L239-S242 PolarHBondContact O-N 2.83Å; L239-T243 PolarHBondContact O-N 3Å
240L78Confident89.7Confident167 Ų16767.3 Ų67.387%0.87437%0.372SS*.G310 helixtrans-52-44.7-173.3-62.6173.2000113.3S242 T243L240-S242 VanDerWaalsContact C-N 3.28Å; L240-S242 PolarHBondContact O-N 3.18Å; L240-T243 PolarHBondContact O-OG1 3.11Å
241S75.5Confident89.7Confident113 Ų11367 Ų6779%0.7937%0.371SS*.G310 helixtrans-69-21177.546.60000114.4L239L239-S241 VanDerWaalsContact C-N 3.3Å; L239-S241 PolarHBondContact O-N 3.11Å
242S74.7Confident89.8Confident75 Ų7565.7 Ų65.752%0.52436%0.362SS..G310 helixtrans-119.846.8-175-58.20000111S238 L239 L240 S244S238-S242 VanDerWaalsContact CB-O 3.23Å; S238-S242 WeakPolarHBondContact CB-O 3.4Å; S238-S242 PolarHBondContact OG-O 3.48Å; L239-S242 CarbonylContact O-C 3.57Å; L239-S242 VanDerWaalsContact O-C 3.24Å; L239-S242 WeakPolarHBondContact O-CA 3.5Å; L239-S242 PolarHBondContact O-N 2.83Å; L240-S242 VanDerWaalsContact C-N 3.28Å; L240-S242 PolarHBondContact O-N 3.18Å; S242-S244 PolarHBondContact O-N 3.29Å
243T75.6Confident89.8Confident83 Ų8362.3 Ų62.351%0.50934%0.339SS..  trans-70.184.8-177.1-63.50000111.8L239 L240L239-T243 PolarHBondContact O-N 3Å; L240-T243 PolarHBondContact O-OG1 3.11Å
244S84.4Confident89.7Confident44 Ų4466 Ų6631%0.30836%0.356SS..  trans-69.9139174.8-63.60000111.2G235 S238 S242G235-S244 PolarHBondContact N-O 3.26Å; S238-S244 WeakPolarHBondContact OG-CB 3.41Å; S238-S244 PolarHBondContact OG-N 3.49Å; S242-S244 PolarHBondContact O-N 3.29Å
245K92.4Very high89.8Confident163 Ų16363.7 Ų63.771%0.70934%0.338SS*.EExtended strand (participates in β ladder)trans-110.8115.7172.2-70.5178.9-177.3172.70109.7V233V233-K245 CarbonylContact O-C 3.53Å; V233-K245 WeakPolarHBondContact O-CA 3.5Å
246Y95.3Very high89.9Confident35 Ų3563 Ų6314%0.13733%0.331CS..EExtended strand (participates in β ladder)trans-94.5131.4-177.4-63.9-86.6000110.6S232 V233 V312 G314 E315 H318S232-Y246 CarbonylContact C-O 3.59Å; S232-Y246 VanDerWaalsContact CA-O 3.26Å; S232-Y246 WeakPolarHBondContact CA-O 3.49Å; V233-Y246 PolarHBondContact N-O 2.75Å; V233-Y246 PolarHBondContact O-N 2.7Å; Y246-V312 HydrophobicContact CG-CG2 4.36Å; Y246-G314 VanDerWaalsContact CD1-C 3.4Å; Y246-G314 WeakPolarHBondContact CD1-O 3.33Å; Y246-G314 VanDerWaalsContact CE1-O 3.22Å; Y246-G314 WeakPolarHBondContact CE1-O 3.35Å; Y246-E315 HydrophobicContact CD1-CG 4Å; Y246-E315 HydrophobicContact CD2-CG 3.45Å; Y246-E315 VanDerWaalsContact CD2-CG 3.45Å; Y246-E315 HydrophobicContact CE1-CG 4.03Å; Y246-E315 HydrophobicContact CE2-CG 3.49Å; Y246-E315 VanDerWaalsContact CE2-CG 3.49Å; Y246-E315 HydrophobicContact CG-CG 3.71Å; Y246-H318 HydrophobicContact CE1-CB 4.34Å; Y246-H318 AromaticContact CE1-ND1 3.93Å; Y246-H318 AromaticContact CZ-ND1 3.88Å; Y246-H318 PolarHBondContact OH-ND1 3.21Å
247K96.1Very high90Very high144 Ų14458.7 Ų58.763%0.62632%0.315SS*.EExtended strand (participates in β ladder)trans-78.8119.6175-68.9173.5175.6179.70109.1V229V229-K247 HydrophobicContact CG1-CB 3.98Å; V229-K247 HydrophobicContact CG1-CG 4.08Å; V229-K247 HydrophobicContact CG2-CB 4.16Å; V229-K247 HydrophobicContact CG2-CD 3.92Å; V229-K247 HydrophobicContact CG2-CG 4.18Å
248V97.1Very high90.2Very high2 Ų255.3 Ų55.31%0.01230%0.301CS..EExtended strand (participates in β ladder)trans-93.9120.2170.7-178.10000107.5V229 F230 C231 V233 E252 V253 L272 V312V229-V248 CarbonylContact C-O 3.58Å; F230-V248 PolarHBondContact N-O 3.2Å; C231-V248 PolarHBondContact N-O 2.68Å; C231-V248 PolarHBondContact O-N 3.49Å; V233-V248 HydrophobicContact CG1-CG2 3.97Å; V233-V248 HydrophobicContact CG2-CG2 3.94Å; V248-E252 HydrophobicContact CG1-CB 4.36Å; V248-E252 HydrophobicContact CG1-CG 4.26Å; V248-V253 HydrophobicContact CG1-CG2 3.86Å; V248-L272 HydrophobicContact CB-CD2 4.28Å; V248-L272 HydrophobicContact CG1-CD2 3.77Å; V248-L272 HydrophobicContact CG2-CD2 4.35Å; V248-V312 HydrophobicContact CG2-CB 4.09Å; V248-V312 HydrophobicContact CG2-CG1 3.6Å; V248-V312 HydrophobicContact CG2-CG2 4.35Å
249T96.6Very high90.5Very high13 Ų1357.2 Ų57.28%0.0831%0.312CS..EExtended strand (participates in β ladder)trans-92.1160.5-17765.30000112.5E228 G251 E252 V253E228-T249 CarbonylContact O-C 3.53Å; E228-T249 WeakPolarHBondContact O-CA 3.31Å; E228-T249 VanDerWaalsContact O-CB 3.32Å; E228-T249 WeakPolarHBondContact O-CB 3.43Å; T249-G251 PolarHBondContact O-N 2.96Å; T249-E252 PolarHBondContact O-N 3.28Å; T249-E252 VanDerWaalsContact O-N 3.13Å; T249-E252 PolarHBondContact OG1-N 3.47Å; T249-V253 WeakPolarHBondContact O-CG2 3.42Å; T249-V253 PolarHBondContact O-N 3.42Å
250V95.8Very high90.9Very high1 Ų151.4 Ų51.41%0.00628%0.283CS..Hα-helixtrans-55.7-36.1172.4172.20000110.8V224 E228 F230 V253 Q254 I291 L293V224-V250 HydrophobicContact CG1-CG1 3.44Å; V224-V250 VanDerWaalsContact CG1-CG1 3.44Å; E228-V250 HydrophobicContact CB-CG2 3.92Å; E228-V250 PolarHBondContact O-N 3.03Å; F230-V250 HydrophobicContact CB-CG2 4.29Å; V250-V253 PolarHBondContact O-N 2.85Å; V250-Q254 WeakPolarHBondContact O-CB 3.07Å; V250-Q254 PolarHBondContact O-N 3.04Å; V250-I291 HydrophobicContact CB-CD1 4.46Å; V250-I291 HydrophobicContact CG1-CD1 4.05Å; V250-I291 HydrophobicContact CG2-CD1 3.73Å; V250-L293 HydrophobicContact CG1-CD1 4.06Å; V250-L293 HydrophobicContact CG1-CG 4.47Å
251G95.7Very high91.6Very high1 Ų143.7 Ų43.71%0.0124%0.242CC..Hα-helixtrans-63.7-42.6173.600000114.2T226 T249 Q254 R255T226-G251 WeakPolarHBondContact O-CA 3.36Å; T226-G251 PolarHBondContact O-N 3.04Å; T249-G251 PolarHBondContact O-N 2.96Å; G251-Q254 PolarHBondContact O-N 2.87Å; G251-R255 WeakPolarHBondContact O-CB 3.36Å; G251-R255 WeakPolarHBondContact O-CG 3.2Å; G251-R255 PolarHBondContact O-N 2.85Å
252E97.2Very high92.5Very high2 Ų239.1 Ų39.11%0.00921%0.21CC..Hα-helixtrans-62.1-46.2173.7172.6172.6-170.800110.5V248 T249 Q254 R255 R256 V312 E313V248-E252 HydrophobicContact CG1-CB 4.36Å; V248-E252 HydrophobicContact CG1-CG 4.26Å; T249-E252 PolarHBondContact O-N 3.28Å; T249-E252 VanDerWaalsContact O-N 3.13Å; T249-E252 PolarHBondContact OG1-N 3.47Å; E252-Q254 VanDerWaalsContact C-N 3.31Å; E252-Q254 PolarHBondContact O-N 3.47Å; E252-R255 PolarHBondContact O-N 3.05Å; E252-R256 HydrophobicContact CG-CG 4.47Å; E252-R256 WeakPolarHBondContact O-CG 3.33Å; E252-R256 PolarHBondContact O-N 3.19Å; E252-R256 IonicContact OE1-CZ 2.9Å; E252-R256 IonicContact OE1-NE 2.99Å; E252-R256 PolarHBondContact OE1-NE 3.41Å; E252-R256 IonicContact OE1-NH2 3.79Å; E252-R256 PolarHBondContact OE1-NH2 3.08Å; E252-V312 VanDerWaalsContact OE1-CA 3.27Å; E252-V312 WeakPolarHBondContact OE1-CA 3.47Å; E252-V312 WeakPolarHBondContact OE1-CB 3.39Å; E252-E313 WeakPolarHBondContact CA-OE1 3.39Å; E252-E313 HydrophobicContact CB-CG 4.41Å; E252-E313 WeakPolarHBondContact CB-OE1 3.41Å; E252-E313 HydrophobicContact CG-CG 3.95Å; E252-E313 WeakPolarHBondContact CG-OE1 3.37Å; E252-E313 PolarHBondContact OE1-N 3.09Å; E252-E313 PolarHBondContact OE2-N 2.81Å
253V96.3Very high93.4Very high0 Ų035.7 Ų35.70%019%0.186CC..Hα-helixtrans-60.3-43.5178.4177.80000110.9F230 V248 T249 V250 R256 L257 L268 L272 L288 L293F230-V253 HydrophobicContact CB-CG2 4.19Å; F230-V253 HydrophobicContact CD1-CG2 3.87Å; F230-V253 HydrophobicContact CG-CG2 4.14Å; V248-V253 HydrophobicContact CG1-CG2 3.86Å; T249-V253 WeakPolarHBondContact O-CG2 3.42Å; T249-V253 PolarHBondContact O-N 3.42Å; V250-V253 PolarHBondContact O-N 2.85Å; V253-R256 PolarHBondContact O-N 3.44Å; V253-L257 HydrophobicContact CG1-CD1 4.31Å; V253-L257 WeakPolarHBondContact O-CG 3.34Å; V253-L257 PolarHBondContact O-N 3.2Å; V253-L257 VanDerWaalsContact O-N 3.1Å; V253-L268 HydrophobicContact CG1-CD1 4.5Å; V253-L268 HydrophobicContact CG1-CD2 4.08Å; V253-L272 HydrophobicContact CG2-CD2 4.5Å; V253-L288 HydrophobicContact CG1-CD2 3.5Å; V253-L288 VanDerWaalsContact CG1-CD2 3.5Å; V253-L293 HydrophobicContact CB-CD1 4.2Å; V253-L293 HydrophobicContact CG1-CD1 3.84Å
254Q94.9Very high94.1Very high80 Ų8034 Ų3437%0.37417%0.173SC..Hα-helixtrans-59.3-49.9175.8-171.2179.416.400111.7V250 G251 E252 R256 L257 S258 L293V250-Q254 WeakPolarHBondContact O-CB 3.07Å; V250-Q254 PolarHBondContact O-N 3.04Å; G251-Q254 PolarHBondContact O-N 2.87Å; E252-Q254 VanDerWaalsContact C-N 3.31Å; E252-Q254 PolarHBondContact O-N 3.47Å; Q254-R256 VanDerWaalsContact C-N 3.29Å; Q254-R256 PolarHBondContact O-N 2.89Å; Q254-L257 PolarHBondContact O-N 2.8Å; Q254-L257 VanDerWaalsContact O-N 3.1Å; Q254-S258 PolarHBondContact O-N 3.43Å; Q254-S258 PolarHBondContact O-OG 3.02Å; Q254-L293 HydrophobicContact CB-CD1 4.33Å; Q254-L293 HydrophobicContact CB-CD2 4.02Å; Q254-L293 HydrophobicContact CG-CD2 3.93Å
255R95.6Very high94.4Very high21 Ų2132.3 Ų32.38%0.07916%0.162CC..Hα-helixtrans-57.8-36.7177.8-77.5-176.2-70.6-95.7-2.2113.3G251 E252 S258 E313 P377 G379 L400G251-R255 WeakPolarHBondContact O-CB 3.36Å; G251-R255 WeakPolarHBondContact O-CG 3.2Å; G251-R255 PolarHBondContact O-N 2.85Å; E252-R255 PolarHBondContact O-N 3.05Å; R255-S258 WeakPolarHBondContact CA-OG 3.36Å; R255-S258 PolarHBondContact O-OG 3.42Å; R255-E313 IonicContact CZ-OE1 3.77Å; R255-E313 VanDerWaalsContact CZ-OE1 3.3Å; R255-E313 IonicContact CZ-OE2 2.84Å; R255-E313 IonicContact NE-OE1 3.44Å; R255-E313 PolarHBondContact NE-OE1 3.31Å; R255-E313 IonicContact NE-OE2 3.78Å; R255-E313 VanDerWaalsContact NH2-CD 3.28Å; R255-E313 IonicContact NH2-OE1 3.74Å; R255-E313 PolarHBondContact NH2-OE1 3.03Å; R255-E313 IonicContact NH2-OE2 3.5Å; R255-E313 PolarHBondContact NH2-OE2 3.47Å; R255-P377 WeakPolarHBondContact CD-O 3.49Å; R255-P377 PolarHBondContact NH1-O 3.43Å; R255-G379 PolarHBondContact NH1-O 3.22Å; R255-G379 VanDerWaalsContact NH2-N 3.17Å; R255-G379 PolarHBondContact NH2-O 2.85Å; R255-L400 HydrophobicContact CB-CD2 4.14Å; R255-L400 VanDerWaalsContact CD-CD2 3.46Å; R255-L400 HydrophobicContact CG-CD2 3.94Å
256R95.1Very high94.2Very high2 Ų229.4 Ų29.41%0.00816%0.162CC..Hα-helixtrans-75.4-26.8177.2-69.8-178.1179.8-90.97.5113.8E252 V253 Q254 E261 C262 L263 T309 L311 H403E252-R256 HydrophobicContact CG-CG 4.47Å; E252-R256 WeakPolarHBondContact O-CG 3.33Å; E252-R256 PolarHBondContact O-N 3.19Å; E252-R256 IonicContact OE1-CZ 2.9Å; E252-R256 IonicContact OE1-NE 2.99Å; E252-R256 PolarHBondContact OE1-NE 3.41Å; E252-R256 IonicContact OE1-NH2 3.79Å; E252-R256 PolarHBondContact OE1-NH2 3.08Å; V253-R256 PolarHBondContact O-N 3.44Å; Q254-R256 VanDerWaalsContact C-N 3.29Å; Q254-R256 PolarHBondContact O-N 2.89Å; R256-E261 IonicContact CZ-OE2 2.7Å; R256-E261 IonicContact NH1-OE2 3.4Å; R256-E261 PolarHBondContact NH1-OE2 3.48Å; R256-C262 PolarHBondContact O-N 3.26Å; R256-L263 HydrophobicContact CB-CD1 3.99Å; R256-L263 HydrophobicContact CB-CG 4.24Å; R256-L263 HydrophobicContact CG-CD1 4.3Å; R256-L263 PolarHBondContact O-N 2.97Å; R256-T309 PolarHBondContact NH1-O 3.04Å; R256-L311 PolarHBondContact NH2-O 3.22Å; R256-H403 PolarHBondContact NH1-NE2 2.76Å; R256-H403 PolarHBondContact NH2-CD2 3.44Å; R256-H403 VanDerWaalsContact NH2-CD2 3.28Å
257L93.6Very high94.1Very high10 Ų1030.2 Ų30.25%0.05217%0.169CC..Hα-helixtrans-82.2-31.2176.6-69.3-172.9000112.3V253 Q254 L263 L268 L288 L295 R299V253-L257 HydrophobicContact CG1-CD1 4.31Å; V253-L257 WeakPolarHBondContact O-CG 3.34Å; V253-L257 PolarHBondContact O-N 3.2Å; V253-L257 VanDerWaalsContact O-N 3.1Å; Q254-L257 PolarHBondContact O-N 2.8Å; Q254-L257 VanDerWaalsContact O-N 3.1Å; L257-L263 WeakPolarHBondContact CD2-O 2.85Å; L257-L268 HydrophobicContact CD2-CD2 3.84Å; L257-L268 HydrophobicContact CG-CD2 4.33Å; L257-L288 HydrophobicContact CD1-CD1 4.22Å; L257-L295 HydrophobicContact CD1-CB 4.19Å; L257-L295 HydrophobicContact CD2-CD1 3.75Å; L257-L295 HydrophobicContact CD2-CD2 4.09Å; L257-L295 HydrophobicContact CD2-CG 4.37Å; L257-R299 PolarHBondContact O-NH1 3.41Å
258S92.5Very high94Very high43 Ų4323.3 Ų23.330%0.30114%0.139SC..SBendtrans-73.8172.7169.459.70000112.4Q254 R255 C262Q254-S258 PolarHBondContact O-N 3.43Å; Q254-S258 PolarHBondContact O-OG 3.02Å; R255-S258 WeakPolarHBondContact CA-OG 3.36Å; R255-S258 PolarHBondContact O-OG 3.42Å; S258-C262 WeakPolarHBondContact O-CA 3.48Å; S258-C262 PolarHBondContact O-N 2.99Å
259P92.3Very high93.8Very high71 Ų7123.8 Ų23.846%0.46114%0.144SC..THydrogen-bonded Turntrans-54.6152.9158.1-23.335000110.8L211 C262L211-P259 HydrophobicContact CD2-CB 4.42Å; P259-C262 VanDerWaalsContact N-SG 3.43Å
260P94Very high93.7Very high10 Ų1025 Ų257%0.06516%0.16CC..THydrogen-bonded Turncis-81.4-21.42.731-35.1000115.1A302 A303 L400 I401P260-A302 WeakPolarHBondContact O-CB 3.47Å; P260-A303 PolarHBondContact O-N 3.26Å; P260-L400 HydrophobicContact CG-CB 3.78Å; P260-L400 HydrophobicContact CG-CD1 4.38Å; P260-I401 HydrophobicContact CB-CG2 3.82Å; P260-I401 HydrophobicContact CG-CG2 3.44Å; P260-I401 VanDerWaalsContact CG-CG2 3.44Å
261E93.8Very high93.6Very high5 Ų525.3 Ų25.32%0.02316%0.161CC..THydrogen-bonded Turntrans-74.7-45-173.9-68.4-154.211100113.5R256 L263 A302 A303 T309 H403R256-E261 IonicContact CZ-OE2 2.7Å; R256-E261 IonicContact NH1-OE2 3.4Å; R256-E261 PolarHBondContact NH1-OE2 3.48Å; E261-L263 VanDerWaalsContact C-N 3.33Å; E261-L263 HydrophobicContact CB-CD2 3.87Å; E261-L263 HydrophobicContact CB-CG 3.93Å; E261-L263 PolarHBondContact O-N 3.22Å; E261-A302 PolarHBondContact O-N 3.34Å; E261-A303 HydrophobicContact CG-CB 4.46Å; E261-A303 PolarHBondContact O-N 2.97Å; E261-T309 VanDerWaalsContact OE1-CG2 3.24Å; E261-T309 WeakPolarHBondContact OE1-CG2 3.48Å; E261-T309 PolarHBondContact OE1-OG1 3.22Å; E261-H403 WeakPolarHBondContact CG-NE2 3.47Å; E261-H403 IonicContact OE1-CE1 3.72Å; E261-H403 PolarHBondContact OE1-CE1 2.77Å; E261-H403 IonicContact OE1-NE2 3.3Å; E261-H403 PolarHBondContact OE1-NE2 3.04Å; E261-H403 IonicContact OE2-CE1 3.05Å; E261-H403 IonicContact OE2-NE2 3.53Å; E261-H403 PolarHBondContact OE2-NE2 3.01Å
262C93.3Very high93.6Very high17 Ų1725.7 Ų25.712%0.11516%0.163CC..  trans50.246.4-172.3-73.60000113.5R256 S258 P259 A302R256-C262 PolarHBondContact O-N 3.26Å; S258-C262 WeakPolarHBondContact O-CA 3.48Å; S258-C262 PolarHBondContact O-N 2.99Å; P259-C262 VanDerWaalsContact N-SG 3.43Å; C262-A302 HydrophobicContact CB-CB 3.75Å
263L93.2Very high93.5Very high3 Ų328.2 Ų28.22%0.01617%0.172CC..  trans-58.5141.3-175-63-168.4000112.6R256 L257 E261 L267 L268 V271 T309R256-L263 HydrophobicContact CB-CD1 3.99Å; R256-L263 HydrophobicContact CB-CG 4.24Å; R256-L263 HydrophobicContact CG-CD1 4.3Å; R256-L263 PolarHBondContact O-N 2.97Å; L257-L263 WeakPolarHBondContact CD2-O 2.85Å; E261-L263 VanDerWaalsContact C-N 3.33Å; E261-L263 HydrophobicContact CB-CD2 3.87Å; E261-L263 HydrophobicContact CB-CG 3.93Å; E261-L263 PolarHBondContact O-N 3.22Å; L263-L267 HydrophobicContact CB-CB 4.37Å; L263-L267 HydrophobicContact CD2-CB 4.18Å; L263-L267 HydrophobicContact CD2-CD1 4.1Å; L263-L268 HydrophobicContact CB-CB 4.49Å; L263-V271 HydrophobicContact CD1-CG2 4.15Å; L263-T309 HydrophobicContact CD2-CG2 4.34Å
264N90.9Very high93.1Very high47 Ų4732.7 Ų32.725%0.25119%0.189SC..  trans-86.2168169.970.146.4000111.3S266 L267 L268N264-S266 PolarHBondContact O-N 3.38Å; N264-S266 VanDerWaalsContact O-N 3.16Å; N264-S266 WeakPolarHBondContact OD1-CB 3.48Å; N264-S266 PolarHBondContact OD1-N 3.36Å; N264-L267 PolarHBondContact O-N 3.12Å; N264-L267 PolarHBondContact OD1-N 3.43Å; N264-L268 WeakPolarHBondContact O-CB 3.23Å; N264-L268 PolarHBondContact O-N 3.27Å
265A90.3Very high92.7Very high8 Ų833.3 Ų33.37%0.06621%0.208CC..Hα-helixtrans-58.1-29.5-176.900000114.6G269 L284 L295A265-G269 PolarHBondContact O-N 3.31Å; A265-L284 HydrophobicContact CB-CD2 4.22Å; A265-L284 WeakPolarHBondContact O-CD2 3.4Å; A265-L295 HydrophobicContact CB-CD2 3.81Å
266S88.8Confident92.2Very high103 Ų10342.7 Ų42.772%0.7225%0.249SC*.Hα-helixtrans-75.3-45.3178.3-52.90000111.5N264 G269 G270N264-S266 PolarHBondContact O-N 3.38Å; N264-S266 VanDerWaalsContact O-N 3.16Å; N264-S266 WeakPolarHBondContact OD1-CB 3.48Å; N264-S266 PolarHBondContact OD1-N 3.36Å; S266-G269 PolarHBondContact O-N 3.03Å; S266-G270 PolarHBondContact O-N 2.92Å; S266-G270 VanDerWaalsContact O-N 3.07Å
267L92.4Very high91.9Very high51 Ų5146.1 Ų46.127%0.26727%0.273SS..Hα-helixtrans-64.9-48.4176.3-68.3173.2000111L263 N264 G269 G270 V271 K301 V305L263-L267 HydrophobicContact CB-CB 4.37Å; L263-L267 HydrophobicContact CD2-CB 4.18Å; L263-L267 HydrophobicContact CD2-CD1 4.1Å; N264-L267 PolarHBondContact O-N 3.12Å; N264-L267 PolarHBondContact OD1-N 3.43Å; L267-G269 VanDerWaalsContact C-N 3.31Å; L267-G269 PolarHBondContact O-N 3.15Å; L267-G270 PolarHBondContact O-N 3.05Å; L267-V271 WeakPolarHBondContact O-CG2 3.24Å; L267-V271 PolarHBondContact O-N 3.44Å; L267-K301 HydrophobicContact CD1-CB 4.38Å; L267-V305 HydrophobicContact CD1-CG2 4.13Å; L267-V305 HydrophobicContact CD2-CG2 4.21Å
268L93.9Very high91.6Very high0 Ų055.8 Ų55.80%032%0.315CS..Hα-helixtrans-59.3-41.9175.4-179.760.8000111.2V253 L257 L263 N264 G270 V271 L272 L284 L288 L295V253-L268 HydrophobicContact CG1-CD1 4.5Å; V253-L268 HydrophobicContact CG1-CD2 4.08Å; L257-L268 HydrophobicContact CD2-CD2 3.84Å; L257-L268 HydrophobicContact CG-CD2 4.33Å; L263-L268 HydrophobicContact CB-CB 4.49Å; N264-L268 WeakPolarHBondContact O-CB 3.23Å; N264-L268 PolarHBondContact O-N 3.27Å; L268-G270 VanDerWaalsContact C-N 3.29Å; L268-G270 PolarHBondContact O-N 2.93Å; L268-V271 PolarHBondContact O-N 3.17Å; L268-L272 HydrophobicContact CD1-CD1 3.92Å; L268-L272 HydrophobicContact CD1-CG 3.99Å; L268-L272 HydrophobicContact CD2-CD1 4.45Å; L268-L272 HydrophobicContact CG-CD1 3.75Å; L268-L272 HydrophobicContact CG-CG 4.27Å; L268-L272 WeakPolarHBondContact O-CB 3.32Å; L268-L272 WeakPolarHBondContact O-CG 3.26Å; L268-L272 PolarHBondContact O-N 2.96Å; L268-L284 HydrophobicContact CB-CD2 4.34Å; L268-L284 HydrophobicContact CD2-CD2 4.13Å; L268-L284 HydrophobicContact CG-CD2 4.21Å; L268-L288 HydrophobicContact CD2-CD1 4.15Å; L268-L295 HydrophobicContact CD2-CD2 4.24Å
269G93.8Very high91.4Very high12 Ų1258.3 Ų58.312%0.12433%0.325CS..Hα-helixtrans-57.7-38.2173.600000113.8A265 S266 L267 L272 R273 R274A265-G269 PolarHBondContact O-N 3.31Å; S266-G269 PolarHBondContact O-N 3.03Å; L267-G269 VanDerWaalsContact C-N 3.31Å; L267-G269 PolarHBondContact O-N 3.15Å; G269-L272 CarbonylContact O-C 3.07Å; G269-R273 PolarHBondContact O-N 2.83Å; G269-R274 PolarHBondContact O-N 2.88Å
270G93.4Very high91.3Very high39 Ų3955.6 Ų55.640%0.40231%0.31SS..Hα-helixtrans-72.5-37176.300000114.3R236 S266 L267 L268 R273R236-G270 PolarHBondContact NH2-O 3.24Å; S266-G270 PolarHBondContact O-N 2.92Å; S266-G270 VanDerWaalsContact O-N 3.07Å; L267-G270 PolarHBondContact O-N 3.05Å; L268-G270 VanDerWaalsContact C-N 3.29Å; L268-G270 PolarHBondContact O-N 2.93Å; G270-R273 PolarHBondContact O-N 2.6Å
271V95.4Very high91Very high6 Ų656.9 Ų56.94%0.03633%0.325CS..Hα-helixtrans-61-50170.7173.80000110.1L263 L267 L268 R273 T309 V312L263-V271 HydrophobicContact CD1-CG2 4.15Å; L267-V271 WeakPolarHBondContact O-CG2 3.24Å; L267-V271 PolarHBondContact O-N 3.44Å; L268-V271 PolarHBondContact O-N 3.17Å; V271-R273 PolarHBondContact O-N 3.28Å; V271-R273 VanDerWaalsContact O-N 3.07Å; V271-R273 PolarHBondContact O-NE 3.28Å; V271-R273 PolarHBondContact O-NH2 3.06Å; V271-T309 WeakPolarHBondContact CG2-O 3.37Å; V271-V312 HydrophobicContact CG1-CG1 3.71Å
272L95.6Very high90.9Very high9 Ų964.3 Ų64.35%0.04735%0.353CS..THydrogen-bonded Turntrans-69.83.7177.7-62.2172.7000114.2F230 V233 V248 V253 L268 G269 R274 L284F230-L272 HydrophobicContact CD1-CD1 4.34Å; F230-L272 HydrophobicContact CD1-CD2 4.17Å; F230-L272 HydrophobicContact CE1-CD1 3.83Å; F230-L272 HydrophobicContact CE1-CD2 4.48Å; V233-L272 WeakPolarHBondContact CG1-O 3.36Å; V248-L272 HydrophobicContact CB-CD2 4.28Å; V248-L272 HydrophobicContact CG1-CD2 3.77Å; V248-L272 HydrophobicContact CG2-CD2 4.35Å; V253-L272 HydrophobicContact CG2-CD2 4.5Å; L268-L272 HydrophobicContact CD1-CD1 3.92Å; L268-L272 HydrophobicContact CD1-CG 3.99Å; L268-L272 HydrophobicContact CD2-CD1 4.45Å; L268-L272 HydrophobicContact CG-CD1 3.75Å; L268-L272 HydrophobicContact CG-CG 4.27Å; L268-L272 WeakPolarHBondContact O-CB 3.32Å; L268-L272 WeakPolarHBondContact O-CG 3.26Å; L268-L272 PolarHBondContact O-N 2.96Å; G269-L272 CarbonylContact O-C 3.07Å; L272-R274 HydrophobicContact CB-CG 4.17Å; L272-R274 PolarHBondContact O-N 2.95Å; L272-R274 VanDerWaalsContact O-N 3.07Å; L272-L284 HydrophobicContact CD1-CD1 3.94Å
273R94.1Very high90.8Very high56 Ų5665.5 Ų65.521%0.21136%0.361CS..THydrogen-bonded Turntrans51.733.1177.4-78.9149-100.2-153.3-16.9113.8P234 G269 G270 V271 E315P234-R273 VanDerWaalsContact O-CD 3.23Å; P234-R273 WeakPolarHBondContact O-CD 3.46Å; P234-R273 PolarHBondContact O-NH1 2.94Å; G269-R273 PolarHBondContact O-N 2.83Å; G270-R273 PolarHBondContact O-N 2.6Å; V271-R273 PolarHBondContact O-N 3.28Å; V271-R273 VanDerWaalsContact O-N 3.07Å; V271-R273 PolarHBondContact O-NE 3.28Å; V271-R273 PolarHBondContact O-NH2 3.06Å; R273-E315 IonicContact CZ-OE1 3.01Å; R273-E315 IonicContact CZ-OE2 3.32Å; R273-E315 VanDerWaalsContact NH1-CD 3.29Å; R273-E315 IonicContact NH1-OE1 3.64Å; R273-E315 PolarHBondContact NH1-OE1 2.89Å; R273-E315 IonicContact NH1-OE2 1.95Å; R273-E315 PolarHBondContact NH1-OE2 2.92Å; R273-E315 IonicContact NH2-OE1 3.88Å; R273-E315 IonicContact NH2-OE2 2.95Å; R273-E315 PolarHBondContact NH2-OE2 3.05Å
274R88.9Confident90.8Very high94 Ų9465.4 Ų65.436%0.35536%0.361SS..PPolyproline II helixtrans-78.5133.8176.5-67-173.568-179.40.4110.6G269 L272 S283G269-R274 PolarHBondContact O-N 2.88Å; L272-R274 HydrophobicContact CB-CG 4.17Å; L272-R274 PolarHBondContact O-N 2.95Å; L272-R274 VanDerWaalsContact O-N 3.07Å; R274-S283 PolarHBondContact NH2-OG 3.36Å
275A85.3Confident90.9Very high92 Ų9266.8 Ų66.876%0.7636%0.362SS*.PPolyproline II helixtrans-58141.8170.700000111.6S277A275-S277 PolarHBondContact O-N 3.01Å
276K86.3Confident91.1Very high219 Ų21970.6 Ų70.695%0.95238%0.379SS*.PPolyproline II helixtrans-70.9119.5178.9-174.9-178.4179.4-175.30109.7
277S87.4Confident91.3Very high73 Ų7371.1 Ų71.151%0.5137%0.365SS..  trans-135.8153.8176.570.70000111.5A275 N279 G280A275-S277 PolarHBondContact O-N 3.01Å; S277-N279 PolarHBondContact O-N 3.39Å; S277-N279 VanDerWaalsContact O-N 3.11Å; S277-G280 PolarHBondContact O-N 3Å; S277-G280 WeakPolarHBondContact OG-CA 3.49Å; S277-G280 PolarHBondContact OG-N 3.39Å
278K87.9Confident91.4Very high214 Ų21468.7 Ų68.793%0.9335%0.352SS*.THydrogen-bonded Turntrans-51.1-38.2-175-172.6174.6-179.6176.90113.4
279N89.4Confident91.3Very high95 Ų9575.4 Ų75.451%0.50838%0.383SS..THydrogen-bonded Turntrans-104.85.1-179.6-63.5-15000113.5S277 G281 R282 S283S277-N279 PolarHBondContact O-N 3.39Å; S277-N279 VanDerWaalsContact O-N 3.11Å; N279-G281 VanDerWaalsContact C-N 3.31Å; N279-G281 PolarHBondContact O-N 2.78Å; N279-R282 WeakPolarHBondContact O-CB 3.4Å; N279-R282 PolarHBondContact O-N 3.13Å; N279-S283 PolarHBondContact O-N 3.17Å
280G88.6Confident91.3Very high14 Ų1483.3 Ų83.314%0.14441%0.414CS..Hα-helixtrans-58.3-38-170.200000114.3S277 R282 L284S277-G280 PolarHBondContact O-N 3Å; S277-G280 WeakPolarHBondContact OG-CA 3.49Å; S277-G280 PolarHBondContact OG-N 3.39Å; G280-R282 VanDerWaalsContact C-N 3.33Å; G280-R282 PolarHBondContact O-N 3.03Å; G280-L284 WeakPolarHBondContact O-CB 3.45Å; G280-L284 PolarHBondContact O-N 2.86Å
281G89.1Confident91.3Very high37 Ų3782.9 Ų82.938%0.38140%0.403SS..Hα-helixtrans-73-18175.700000115N279 R285N279-G281 VanDerWaalsContact C-N 3.31Å; N279-G281 PolarHBondContact O-N 2.78Å; G281-R285 WeakPolarHBondContact O-CG 3.39Å; G281-R285 PolarHBondContact O-NE 3.23Å
282R90.9Very high91Very high162 Ų16284.2 Ų84.261%0.61142%0.417SS*.Hα-helixtrans-84.8-50.7171.3-162.9-164.5-71.8169.6-4.4109.9N279 G280 L284 R285 E286N279-R282 WeakPolarHBondContact O-CB 3.4Å; N279-R282 PolarHBondContact O-N 3.13Å; G280-R282 VanDerWaalsContact C-N 3.33Å; G280-R282 PolarHBondContact O-N 3.03Å; R282-L284 PolarHBondContact O-N 3.46Å; R282-L284 VanDerWaalsContact O-N 3.14Å; R282-R285 WeakPolarHBondContact O-CA 3.45Å; R282-R285 WeakPolarHBondContact O-CB 3.48Å; R282-R285 PolarHBondContact O-N 3.02Å; R282-E286 WeakPolarHBondContact CD-OE1 3.5Å; R282-E286 WeakPolarHBondContact CG-OE1 3.41Å; R282-E286 WeakPolarHBondContact O-CG 3.49Å; R282-E286 PolarHBondContact O-N 3.48Å
283S92.2Very high90.9Very high41 Ų4184.4 Ų84.429%0.28742%0.419SS..Hα-helixtrans-52.5-33.5172.1162.70000113.5R274 N279 E286 R287R274-S283 PolarHBondContact NH2-OG 3.36Å; N279-S283 PolarHBondContact O-N 3.17Å; S283-E286 WeakPolarHBondContact CA-OE2 3.48Å; S283-R287 WeakPolarHBondContact O-CB 3.5Å; S283-R287 PolarHBondContact O-N 3.23Å
284L92.7Very high90.6Very high2 Ų287.9 Ų87.91%0.0144%0.441CS..Hα-helixtrans-67.4-44.4173-175.957.6000112F230 A265 L268 L272 G280 R282 R287 L288 L295F230-L284 HydrophobicContact CE1-CD1 4.25Å; F230-L284 HydrophobicContact CZ-CD1 4.2Å; A265-L284 HydrophobicContact CB-CD2 4.22Å; A265-L284 WeakPolarHBondContact O-CD2 3.4Å; L268-L284 HydrophobicContact CB-CD2 4.34Å; L268-L284 HydrophobicContact CD2-CD2 4.13Å; L268-L284 HydrophobicContact CG-CD2 4.21Å; L272-L284 HydrophobicContact CD1-CD1 3.94Å; G280-L284 WeakPolarHBondContact O-CB 3.45Å; G280-L284 PolarHBondContact O-N 2.86Å; R282-L284 PolarHBondContact O-N 3.46Å; R282-L284 VanDerWaalsContact O-N 3.14Å; L284-R287 PolarHBondContact O-N 3.44Å; L284-L288 HydrophobicContact CD1-CD1 4.11Å; L284-L288 HydrophobicContact CD1-CG 4.26Å; L284-L288 HydrophobicContact CG-CD1 3.93Å; L284-L288 WeakPolarHBondContact O-CD1 3.46Å; L284-L288 WeakPolarHBondContact O-CG 3.38Å; L284-L288 PolarHBondContact O-N 3.46Å; L284-L295 HydrophobicContact CD2-CD2 4.46Å
285R92.7Very high90.6Very high76 Ų7683.8 Ų83.829%0.28743%0.426SS..Hα-helixtrans-65.3-49.5178.9-63.5170.5-158-87.73.7111.1G281 R282 R287 L288 E289 L295 P296G281-R285 WeakPolarHBondContact O-CG 3.39Å; G281-R285 PolarHBondContact O-NE 3.23Å; R282-R285 WeakPolarHBondContact O-CA 3.45Å; R282-R285 WeakPolarHBondContact O-CB 3.48Å; R282-R285 PolarHBondContact O-N 3.02Å; R285-R287 PolarHBondContact O-N 2.98Å; R285-R287 VanDerWaalsContact O-N 3.15Å; R285-L288 PolarHBondContact O-N 2.99Å; R285-E289 WeakPolarHBondContact O-CB 3.47Å; R285-E289 PolarHBondContact O-N 3.43Å; R285-L295 HydrophobicContact CG-CB 4.4Å; R285-L295 HydrophobicContact CG-CG 4.45Å; R285-L295 PolarHBondContact NH1-O 3.36Å; R285-P296 PolarHBondContact NH1-O 3.02Å
286E93.6Very high90.4Very high88 Ų8881.6 Ų81.641%0.41140%0.404SS..Hα-helixtrans-54.2-33.8175.4-66160.8-169.600112.7R282 S283 K290R282-E286 WeakPolarHBondContact CD-OE1 3.5Å; R282-E286 WeakPolarHBondContact CG-OE1 3.41Å; R282-E286 WeakPolarHBondContact O-CG 3.49Å; R282-E286 PolarHBondContact O-N 3.48Å; S283-E286 WeakPolarHBondContact CA-OE2 3.48Å; E286-K290 WeakPolarHBondContact O-CD 3.28Å; E286-K290 VanDerWaalsContact O-CG 3.29Å; E286-K290 WeakPolarHBondContact O-CG 3.46Å; E286-K290 PolarHBondContact O-N 3.06Å
287R93.4Very high90Very high114 Ų11475.1 Ų75.143%0.4339%0.392SS..Hα-helixtrans-81.4-29.8177.7-166177.3-175.1-126.3-6.2113.3F230 S283 L284 R285F230-R287 HydrophobicContact CE2-CG 3.9Å; F230-R287 HydrophobicContact CZ-CB 4.45Å; F230-R287 HydrophobicContact CZ-CG 4.07Å; F230-R287 PolarHBondContact O-NH1 3.35Å; F230-R287 PolarHBondContact O-NH2 2.97Å; S283-R287 WeakPolarHBondContact O-CB 3.5Å; S283-R287 PolarHBondContact O-N 3.23Å; L284-R287 PolarHBondContact O-N 3.44Å; R285-R287 PolarHBondContact O-N 2.98Å; R285-R287 VanDerWaalsContact O-N 3.15Å
288L94Very high89.4Confident0 Ų075.3 Ų75.30%041%0.405CS..Hα-helixtrans-75.5-40.6175.2-67.7167.2000110.9F230 V253 L257 L268 L284 R285 K290 I291 G292 L293 L295F230-L288 HydrophobicContact CE1-CD2 4.33Å; F230-L288 HydrophobicContact CE2-CD2 3.94Å; F230-L288 HydrophobicContact CZ-CD2 3.69Å; F230-L288 HydrophobicContact CZ-CG 4.23Å; V253-L288 HydrophobicContact CG1-CD2 3.5Å; V253-L288 VanDerWaalsContact CG1-CD2 3.5Å; L257-L288 HydrophobicContact CD1-CD1 4.22Å; L268-L288 HydrophobicContact CD2-CD1 4.15Å; L284-L288 HydrophobicContact CD1-CD1 4.11Å; L284-L288 HydrophobicContact CD1-CG 4.26Å; L284-L288 HydrophobicContact CG-CD1 3.93Å; L284-L288 WeakPolarHBondContact O-CD1 3.46Å; L284-L288 WeakPolarHBondContact O-CG 3.38Å; L284-L288 PolarHBondContact O-N 3.46Å; R285-L288 PolarHBondContact O-N 2.99Å; L288-K290 VanDerWaalsContact C-N 3.31Å; L288-K290 PolarHBondContact O-N 3.36Å; L288-I291 HydrophobicContact CD2-CD1 4.48Å; L288-I291 CarbonylContact O-C 3.57Å; L288-I291 WeakPolarHBondContact O-CG1 3.45Å; L288-I291 PolarHBondContact O-N 2.99Å; L288-G292 PolarHBondContact O-N 2.86Å; L288-L293 CarbonylContact C-O 3.46Å; L288-L293 HydrophobicContact CB-CB 4.07Å; L288-L293 WeakPolarHBondContact CB-O 3.34Å; L288-L293 HydrophobicContact CD2-CB 4.31Å; L288-L293 HydrophobicContact CD2-CD1 4.2Å; L288-L293 PolarHBondContact O-N 3.14Å; L288-L295 HydrophobicContact CD1-CB 3.78Å; L288-L295 HydrophobicContact CD1-CD2 3.65Å; L288-L295 HydrophobicContact CD1-CG 4.39Å
289E93.2Very high89Confident140 Ų14069.6 Ų69.665%0.65438%0.378SS*.Hα-helixtrans-58.7-42176.9-175.4168.5-146.900111.8R285 I291 G292 L293R285-E289 WeakPolarHBondContact O-CB 3.47Å; R285-E289 PolarHBondContact O-N 3.43Å; E289-I291 PolarHBondContact O-N 3.43Å; E289-I291 VanDerWaalsContact O-N 3.1Å; E289-G292 PolarHBondContact O-N 2.93Å; E289-L293 PolarHBondContact N-O 2.77Å
290K93.4Very high88.3Confident178 Ų17875.6 Ų75.677%0.77439%0.394SS*.THydrogen-bonded Turntrans-60.8-15.3174.1-76.5174.8-179.3-175.60115.5E286 L288E286-K290 WeakPolarHBondContact O-CD 3.28Å; E286-K290 VanDerWaalsContact O-CG 3.29Å; E286-K290 WeakPolarHBondContact O-CG 3.46Å; E286-K290 PolarHBondContact O-N 3.06Å; L288-K290 VanDerWaalsContact C-N 3.31Å; L288-K290 PolarHBondContact O-N 3.36Å
291I92.8Very high87.9Confident31 Ų3179.9 Ų79.916%0.15941%0.408CS..THydrogen-bonded Turntrans-115.817.7175.562.1164.5000112.3F230 V250 L288 E289 L293F230-I291 HydrophobicContact CD2-CD1 3.56Å; F230-I291 HydrophobicContact CE2-CD1 3.73Å; V250-I291 HydrophobicContact CB-CD1 4.46Å; V250-I291 HydrophobicContact CG1-CD1 4.05Å; V250-I291 HydrophobicContact CG2-CD1 3.73Å; L288-I291 HydrophobicContact CD2-CD1 4.48Å; L288-I291 CarbonylContact O-C 3.57Å; L288-I291 WeakPolarHBondContact O-CG1 3.45Å; L288-I291 PolarHBondContact O-N 2.99Å; E289-I291 PolarHBondContact O-N 3.43Å; E289-I291 VanDerWaalsContact O-N 3.1Å; I291-L293 VanDerWaalsContact C-N 3.34Å; I291-L293 HydrophobicContact CD1-CD1 3.97Å; I291-L293 HydrophobicContact CD1-CG 4.25Å; I291-L293 HydrophobicContact CG1-CB 4.41Å; I291-L293 HydrophobicContact CG1-CG 4.3Å; I291-L293 PolarHBondContact O-N 3.39Å
292G90.6Very high87.5Confident33 Ų3381.5 Ų81.534%0.3442%0.418SS..THydrogen-bonded Turntrans75.513178.800000115.5L288 E289L288-G292 PolarHBondContact O-N 2.86Å; E289-G292 PolarHBondContact O-N 2.93Å
293L91.9Very high87.1Confident14 Ų1474.8 Ų74.87%0.07340%0.397CS..  trans-101.3115.3176.7-67.4-172.3000111.8V224 V250 V253 Q254 L288 E289 I291V224-L293 HydrophobicContact CG1-CD2 4.04Å; V224-L293 HydrophobicContact CG1-CG 4.41Å; V250-L293 HydrophobicContact CG1-CD1 4.06Å; V250-L293 HydrophobicContact CG1-CG 4.47Å; V253-L293 HydrophobicContact CB-CD1 4.2Å; V253-L293 HydrophobicContact CG1-CD1 3.84Å; Q254-L293 HydrophobicContact CB-CD1 4.33Å; Q254-L293 HydrophobicContact CB-CD2 4.02Å; Q254-L293 HydrophobicContact CG-CD2 3.93Å; L288-L293 CarbonylContact C-O 3.46Å; L288-L293 HydrophobicContact CB-CB 4.07Å; L288-L293 WeakPolarHBondContact CB-O 3.34Å; L288-L293 HydrophobicContact CD2-CB 4.31Å; L288-L293 HydrophobicContact CD2-CD1 4.2Å; L288-L293 PolarHBondContact O-N 3.14Å; E289-L293 PolarHBondContact N-O 2.77Å; I291-L293 VanDerWaalsContact C-N 3.34Å; I291-L293 HydrophobicContact CD1-CD1 3.97Å; I291-L293 HydrophobicContact CD1-CG 4.25Å; I291-L293 HydrophobicContact CG1-CB 4.41Å; I291-L293 HydrophobicContact CG1-CG 4.3Å; I291-L293 PolarHBondContact O-N 3.39Å
294N89.2Confident87Confident129 Ų12979.1 Ų79.169%0.6942%0.417SS*.  trans-86.4125.6173.7-173.8-10.8000111.6
295L87.6Confident86.9Confident7 Ų782.5 Ų82.54%0.03744%0.438CS..  trans-114.7100.5167.4176.345.8000109.7L257 A265 L268 L284 R285 L288L257-L295 HydrophobicContact CD1-CB 4.19Å; L257-L295 HydrophobicContact CD2-CD1 3.75Å; L257-L295 HydrophobicContact CD2-CD2 4.09Å; L257-L295 HydrophobicContact CD2-CG 4.37Å; A265-L295 HydrophobicContact CB-CD2 3.81Å; L268-L295 HydrophobicContact CD2-CD2 4.24Å; L284-L295 HydrophobicContact CD2-CD2 4.46Å; R285-L295 HydrophobicContact CG-CB 4.4Å; R285-L295 HydrophobicContact CG-CG 4.45Å; R285-L295 PolarHBondContact NH1-O 3.36Å; L288-L295 HydrophobicContact CD1-CB 3.78Å; L288-L295 HydrophobicContact CD1-CD2 3.65Å; L288-L295 HydrophobicContact CD1-CG 4.39Å
296P80.5Confident87Confident46 Ų4682.1 Ų82.130%0.29944%0.444SS..  trans-73.1154.9-176.327.4-34.2000113.2R285 R299R285-P296 PolarHBondContact NH1-O 3.02Å; P296-R299 HydrophobicContact CG-CB 4.45Å
297A79.9Confident87.1Confident84 Ų8485.3 Ų85.369%0.69446%0.463SS*.THydrogen-bonded Turntrans-67.8158.5172.200000111.1R299A297-R299 PolarHBondContact O-N 3.26Å
298G74.3Confident87.2Confident77 Ų7781.9 Ų81.979%0.79445%0.453SS*.THydrogen-bonded Turntrans66.7-4.5175.500000117.5R300G298-R300 PolarHBondContact O-N 3.08Å
299R78.1Confident87.3Confident94 Ų9482.2 Ų82.236%0.35546%0.455SS..PPolyproline II helixtrans-54.7122.4179.8179.9168.6-69.9-147-1.8111.4L257 P296 A297L257-R299 PolarHBondContact O-NH1 3.41Å; P296-R299 HydrophobicContact CG-CB 4.45Å; A297-R299 PolarHBondContact O-N 3.26Å
300R75.3Confident87.3Confident221 Ų22177.4 Ų77.483%0.83444%0.437SS*.PPolyproline II helixtrans-79.4145.7170.5-59.8-178-177.3-174.60.5109.4G298G298-R300 PolarHBondContact O-N 3.08Å
301K80.1Confident87.5Confident104 Ų10469.4 Ų69.445%0.45240%0.403SS..PPolyproline II helixtrans-60.9149.4167.265.8176-172.5169.90109.7L267 A303 V305L267-K301 HydrophobicContact CD1-CB 4.38Å; K301-A303 WeakPolarHBondContact CD-O 3.27Å; K301-V305 HydrophobicContact CD-CG2 4.21Å
302A80.6Confident87.7Confident70 Ų7068 Ų6858%0.57940%0.395SS*.  trans-104.1-44.5173.900000111.6P260 E261 C262P260-A302 WeakPolarHBondContact O-CB 3.47Å; E261-A302 PolarHBondContact O-N 3.34Å; C262-A302 HydrophobicContact CB-CB 3.75Å
303A84.2Confident88Confident22 Ų2266.8 Ų66.818%0.18238%0.381CS..SBendtrans-80160.7173.200000113.1P260 E261 K301P260-A303 PolarHBondContact O-N 3.26Å; E261-A303 HydrophobicContact CG-CB 4.46Å; E261-A303 PolarHBondContact O-N 2.97Å; K301-A303 WeakPolarHBondContact CD-O 3.27Å
304N89Confident88.2Confident131 Ų13167.6 Ų67.670%0.70139%0.392SS*.PPolyproline II helixtrans-71.5141.9161.5-78.4-33.7000109.9
305V90.8Very high88.5Confident74 Ų7461.7 Ų61.745%0.44836%0.36SS..PPolyproline II helixtrans-80.1124.3175.8176.40000107.5L267 K301 T309L267-V305 HydrophobicContact CD1-CG2 4.13Å; L267-V305 HydrophobicContact CD2-CG2 4.21Å; K301-V305 HydrophobicContact CD-CG2 4.21Å; V305-T309 HydrophobicContact CG1-CG2 4.06Å
306T94.1Very high88.9Confident68 Ų6861.3 Ų61.342%0.41736%0.359SS..  trans-114.6178.5177.6680000110.6L308 T309T306-L308 PolarHBondContact O-N 3.49Å; T306-L308 PolarHBondContact OG1-N 2.84Å; T306-T309 PolarHBondContact N-OG1 3.4Å; T306-T309 WeakPolarHBondContact O-CB 3.46Å; T306-T309 PolarHBondContact O-N 2.88Å; T306-T309 PolarHBondContact OG1-N 3.02Å
307L95.4Very high89.7Confident155 Ų15562 Ų6281%0.81236%0.362SS*.Hα-helixtrans-61.9-34.5168.7-61.9179.3000111.6S310L307-S310 WeakPolarHBondContact O-CB 3.37Å; L307-S310 PolarHBondContact O-N 3.33Å; L307-S310 VanDerWaalsContact O-N 3.13Å; L307-S310 PolarHBondContact O-OG 2.92Å
308L96.1Very high90.4Very high42 Ų4260.9 Ų60.922%0.2234%0.342CS..Hα-helixtrans-64.8-39.3177.8-60.8177.4000111.9T306 S310 L311 T402 H403 F405T306-L308 PolarHBondContact O-N 3.49Å; T306-L308 PolarHBondContact OG1-N 2.84Å; L308-S310 PolarHBondContact O-N 3.1Å; L308-L311 HydrophobicContact CD2-CD1 4.02Å; L308-L311 WeakPolarHBondContact O-CB 3.37Å; L308-L311 PolarHBondContact O-N 3.43Å; L308-T402 HydrophobicContact CD1-CG2 3.8Å; L308-H403 PolarHBondContact O-ND1 2.76Å; L308-F405 HydrophobicContact CD1-CD1 4.38Å; L308-F405 HydrophobicContact CD2-CD1 4.13Å; L308-F405 HydrophobicContact CD2-CG 4.44Å
309T95.3Very high91.5Very high6 Ų660 Ų604%0.03732%0.319CS..Hα-helixtrans-51.2-27.2172.7-60.90000113R256 E261 L263 V271 V305 T306 H403R256-T309 PolarHBondContact NH1-O 3.04Å; E261-T309 VanDerWaalsContact OE1-CG2 3.24Å; E261-T309 WeakPolarHBondContact OE1-CG2 3.48Å; E261-T309 PolarHBondContact OE1-OG1 3.22Å; L263-T309 HydrophobicContact CD2-CG2 4.34Å; V271-T309 WeakPolarHBondContact CG2-O 3.37Å; V305-T309 HydrophobicContact CG1-CG2 4.06Å; T306-T309 PolarHBondContact N-OG1 3.4Å; T306-T309 WeakPolarHBondContact O-CB 3.46Å; T306-T309 PolarHBondContact O-N 2.88Å; T306-T309 PolarHBondContact OG1-N 3.02Å; T309-H403 WeakPolarHBondContact CA-CE1 3.49Å; T309-H403 PolarHBondContact N-CE1 3.07Å; T309-H403 VanDerWaalsContact N-CE1 3.35Å; T309-H403 PolarHBondContact OG1-CE1 3.5Å
310S94.3Very high92.4Very high40 Ų4055.8 Ų55.828%0.2830%0.304SS..Hα-helixtrans-75.4-30.4178.882.70000114.1R236 L307 L308R236-S310 VanDerWaalsContact CZ-O 3.3Å; R236-S310 PolarHBondContact NE-O 3.05Å; R236-S310 PolarHBondContact NH2-O 3.44Å; L307-S310 WeakPolarHBondContact O-CB 3.37Å; L307-S310 PolarHBondContact O-N 3.33Å; L307-S310 VanDerWaalsContact O-N 3.13Å; L307-S310 PolarHBondContact O-OG 2.92Å; L308-S310 PolarHBondContact O-N 3.1Å
311L96.5Very high93.5Very high10 Ų1053.1 Ų53.15%0.05229%0.294CS..SBendtrans-72.2147.7178.2-57179.6000109.6L237 R256 L308 E315 A316 L319L237-L311 HydrophobicContact CD1-CD2 4.1Å; L237-L311 HydrophobicContact CG-CD2 4.33Å; R256-L311 PolarHBondContact NH2-O 3.22Å; L308-L311 HydrophobicContact CD2-CD1 4.02Å; L308-L311 WeakPolarHBondContact O-CB 3.37Å; L308-L311 PolarHBondContact O-N 3.43Å; L311-E315 WeakPolarHBondContact CA-OE2 3.4Å; L311-E315 HydrophobicContact CB-CB 4.18Å; L311-E315 HydrophobicContact CD2-CB 4.29Å; L311-A316 HydrophobicContact CB-CB 4.43Å; L311-A316 HydrophobicContact CD1-CB 4.36Å; L311-L319 HydrophobicContact CD1-CD2 3.97Å
312V97.2Very high94.3Very high0 Ų051.7 Ų51.70%029%0.291CS..  trans-87159.4162.6-67.40000110.5V233 Y246 V248 E252 V271 G314 E315 A316V233-V312 HydrophobicContact CG2-CG1 4.15Å; V233-V312 HydrophobicContact CG2-CG2 3.82Å; Y246-V312 HydrophobicContact CG-CG2 4.36Å; V248-V312 HydrophobicContact CG2-CB 4.09Å; V248-V312 HydrophobicContact CG2-CG1 3.6Å; V248-V312 HydrophobicContact CG2-CG2 4.35Å; E252-V312 VanDerWaalsContact OE1-CA 3.27Å; E252-V312 WeakPolarHBondContact OE1-CA 3.47Å; E252-V312 WeakPolarHBondContact OE1-CB 3.39Å; V271-V312 HydrophobicContact CG1-CG1 3.71Å; V312-G314 PolarHBondContact O-N 3.11Å; V312-G314 VanDerWaalsContact O-N 3.12Å; V312-E315 HydrophobicContact CG2-CB 4.39Å; V312-E315 HydrophobicContact CG2-CG 3.86Å; V312-E315 WeakPolarHBondContact CG2-OE2 3.45Å; V312-E315 PolarHBondContact N-OE2 3.44Å; V312-E315 WeakPolarHBondContact O-CA 3.41Å; V312-E315 WeakPolarHBondContact O-CB 3.38Å; V312-E315 PolarHBondContact O-N 3.45Å; V312-A316 PolarHBondContact O-N 2.96Å
313E97.1Very high95.1Very high9 Ų952.1 Ų52.14%0.04228%0.28CS..Hα-helixtrans-53.4-38.6-176.4-71.3174.6-163.200112.4E252 R255 E315 A316 V317 I378 G379 H403E252-E313 WeakPolarHBondContact CA-OE1 3.39Å; E252-E313 HydrophobicContact CB-CG 4.41Å; E252-E313 WeakPolarHBondContact CB-OE1 3.41Å; E252-E313 HydrophobicContact CG-CG 3.95Å; E252-E313 WeakPolarHBondContact CG-OE1 3.37Å; E252-E313 PolarHBondContact OE1-N 3.09Å; E252-E313 PolarHBondContact OE2-N 2.81Å; R255-E313 IonicContact CZ-OE1 3.77Å; R255-E313 VanDerWaalsContact CZ-OE1 3.3Å; R255-E313 IonicContact CZ-OE2 2.84Å; R255-E313 IonicContact NE-OE1 3.44Å; R255-E313 PolarHBondContact NE-OE1 3.31Å; R255-E313 IonicContact NE-OE2 3.78Å; R255-E313 VanDerWaalsContact NH2-CD 3.28Å; R255-E313 IonicContact NH2-OE1 3.74Å; R255-E313 PolarHBondContact NH2-OE1 3.03Å; R255-E313 IonicContact NH2-OE2 3.5Å; R255-E313 PolarHBondContact NH2-OE2 3.47Å; E313-E315 VanDerWaalsContact C-N 3.29Å; E313-E315 PolarHBondContact O-N 2.86Å; E313-A316 PolarHBondContact O-N 3.44Å; E313-V317 WeakPolarHBondContact O-CB 3.45Å; E313-V317 WeakPolarHBondContact O-CG2 3.38Å; E313-V317 PolarHBondContact O-N 2.68Å; E313-I378 HydrophobicContact CG-CG2 4.39Å; E313-G379 WeakPolarHBondContact OE2-CA 3.27Å; E313-G379 PolarHBondContact OE2-N 2.7Å; E313-H403 HydrophobicContact CG-CB 4.02Å
314G95.7Very high95.8Very high30 Ų3052.1 Ų52.131%0.30928%0.282SS..Hα-helixtrans-63.8-27.4175.200000114.8Y246 V312 H318Y246-G314 VanDerWaalsContact CD1-C 3.4Å; Y246-G314 WeakPolarHBondContact CD1-O 3.33Å; Y246-G314 VanDerWaalsContact CE1-O 3.22Å; Y246-G314 WeakPolarHBondContact CE1-O 3.35Å; V312-G314 PolarHBondContact O-N 3.11Å; V312-G314 VanDerWaalsContact O-N 3.12Å; G314-H318 WeakPolarHBondContact O-CB 3.4Å; G314-H318 PolarHBondContact O-N 3.11Å
315E96.1Very high96.2Very high5 Ų552.9 Ų52.92%0.02328%0.276CS..Hα-helixtrans-81.2-43.1172.8-69.6172.5131.800111.3G235 R236 Y246 R273 L311 V312 E313 V317 H318 L319G235-E315 VanDerWaalsContact CA-OE1 3.27Å; G235-E315 WeakPolarHBondContact CA-OE1 3.25Å; R236-E315 PolarHBondContact N-OE1 3.44Å; Y246-E315 HydrophobicContact CD1-CG 4Å; Y246-E315 HydrophobicContact CD2-CG 3.45Å; Y246-E315 VanDerWaalsContact CD2-CG 3.45Å; Y246-E315 HydrophobicContact CE1-CG 4.03Å; Y246-E315 HydrophobicContact CE2-CG 3.49Å; Y246-E315 VanDerWaalsContact CE2-CG 3.49Å; Y246-E315 HydrophobicContact CG-CG 3.71Å; R273-E315 IonicContact CZ-OE1 3.01Å; R273-E315 IonicContact CZ-OE2 3.32Å; R273-E315 VanDerWaalsContact NH1-CD 3.29Å; R273-E315 IonicContact NH1-OE1 3.64Å; R273-E315 PolarHBondContact NH1-OE1 2.89Å; R273-E315 IonicContact NH1-OE2 1.95Å; R273-E315 PolarHBondContact NH1-OE2 2.92Å; R273-E315 IonicContact NH2-OE1 3.88Å; R273-E315 IonicContact NH2-OE2 2.95Å; R273-E315 PolarHBondContact NH2-OE2 3.05Å; L311-E315 WeakPolarHBondContact CA-OE2 3.4Å; L311-E315 HydrophobicContact CB-CB 4.18Å; L311-E315 HydrophobicContact CD2-CB 4.29Å; V312-E315 HydrophobicContact CG2-CB 4.39Å; V312-E315 HydrophobicContact CG2-CG 3.86Å; V312-E315 WeakPolarHBondContact CG2-OE2 3.45Å; V312-E315 PolarHBondContact N-OE2 3.44Å; V312-E315 WeakPolarHBondContact O-CA 3.41Å; V312-E315 WeakPolarHBondContact O-CB 3.38Å; V312-E315 PolarHBondContact O-N 3.45Å; E313-E315 VanDerWaalsContact C-N 3.29Å; E313-E315 PolarHBondContact O-N 2.86Å; E315-V317 PolarHBondContact O-N 3.12Å; E315-H318 PolarHBondContact O-N 3.48Å; E315-L319 WeakPolarHBondContact O-CB 3.49Å; E315-L319 PolarHBondContact O-N 3.34Å
316A97.3Very high96.6Very high0 Ų053.8 Ų53.80%028%0.278CS..Hα-helixtrans-61.9-43.2-179.200000111.8L311 V312 E313 A320 H403 F405L311-A316 HydrophobicContact CB-CB 4.43Å; L311-A316 HydrophobicContact CD1-CB 4.36Å; V312-A316 PolarHBondContact O-N 2.96Å; E313-A316 PolarHBondContact O-N 3.44Å; A316-A320 WeakPolarHBondContact O-CB 3.39Å; A316-A320 PolarHBondContact O-N 2.87Å; A316-H403 HydrophobicContact CB-CB 3.84Å; A316-H403 WeakPolarHBondContact CB-O 3.45Å; A316-F405 HydrophobicContact CB-CB 4.05Å
317V95.6Very high96.8Very high61 Ų6151.4 Ų51.437%0.3726%0.263SS..Hα-helixtrans-69.2-32.8174.8173.40000112.2E313 E315 R321 I378E313-V317 WeakPolarHBondContact O-CB 3.45Å; E313-V317 WeakPolarHBondContact O-CG2 3.38Å; E313-V317 PolarHBondContact O-N 2.68Å; E315-V317 PolarHBondContact O-N 3.12Å; V317-R321 PolarHBondContact O-N 3.33Å; V317-I378 HydrophobicContact CG2-CG2 4.5Å
318H95.7Very high96.8Very high59 Ų5950.5 Ų50.527%0.27326%0.255SS..Hα-helixtrans-70.4-48176-162.1-175.2000111.1Y246 G314 E315 A320 R321 D322Y246-H318 HydrophobicContact CE1-CB 4.34Å; Y246-H318 AromaticContact CE1-ND1 3.93Å; Y246-H318 AromaticContact CZ-ND1 3.88Å; Y246-H318 PolarHBondContact OH-ND1 3.21Å; G314-H318 WeakPolarHBondContact O-CB 3.4Å; G314-H318 PolarHBondContact O-N 3.11Å; E315-H318 PolarHBondContact O-N 3.48Å; H318-A320 VanDerWaalsContact C-N 3.25Å; H318-A320 PolarHBondContact O-N 3.03Å; H318-R321 WeakPolarHBondContact O-CB 3.36Å; H318-R321 PolarHBondContact O-N 3.06Å; H318-D322 IonicContact CD2-OD1 2.74Å; H318-D322 PolarHBondContact CD2-OD1 2.9Å; H318-D322 IonicContact CD2-OD2 2.67Å; H318-D322 IonicContact NE2-OD1 2.74Å; H318-D322 PolarHBondContact O-N 3.5Å
319L97.1Very high96.8Very high59 Ų5951.6 Ų51.631%0.30926%0.263SS..Hα-helixtrans-57.1-38.3175.5-179.663.8000112.1L237 L311 E315 F323 F405L237-L319 HydrophobicContact CD1-CD1 4.07Å; L237-L319 HydrophobicContact CD1-CD2 4.03Å; L237-L319 HydrophobicContact CD1-CG 4.5Å; L311-L319 HydrophobicContact CD1-CD2 3.97Å; E315-L319 WeakPolarHBondContact O-CB 3.49Å; E315-L319 PolarHBondContact O-N 3.34Å; L319-F323 VanDerWaalsContact O-CB 3.25Å; L319-F323 WeakPolarHBondContact O-CB 3.31Å; L319-F323 PolarHBondContact O-N 2.97Å; L319-F405 HydrophobicContact CB-CD2 4.31Å; L319-F405 HydrophobicContact CB-CE2 4.5Å; L319-F405 HydrophobicContact CD2-CD2 4.14Å; L319-F405 HydrophobicContact CD2-CE2 4.02Å; L319-F405 HydrophobicContact CG-CD2 4.1Å; L319-F405 HydrophobicContact CG-CE2 3.85Å
320A97.6Very high97Very high5 Ų557.4 Ų57.44%0.04129%0.29CS..Hα-helixtrans-67.3-36.7175.800000113A316 H318 G324 F405 P408A316-A320 WeakPolarHBondContact O-CB 3.39Å; A316-A320 PolarHBondContact O-N 2.87Å; H318-A320 VanDerWaalsContact C-N 3.25Å; H318-A320 PolarHBondContact O-N 3.03Å; A320-G324 PolarHBondContact O-N 3.3Å; A320-F405 HydrophobicContact CB-CD2 3.7Å; A320-F405 HydrophobicContact CB-CE2 4.27Å; A320-F405 HydrophobicContact CB-CG 4.45Å; A320-P408 HydrophobicContact CB-CB 4.09Å
321R96.8Very high97.1Very high166 Ų16659.6 Ų59.663%0.62630%0.295SS*.Hα-helixtrans-65.7-48.1173.9-177.7-167.9-63.2148.9-0.5111.1V317 H318 F323 G324 Y325V317-R321 PolarHBondContact O-N 3.33Å; H318-R321 WeakPolarHBondContact O-CB 3.36Å; H318-R321 PolarHBondContact O-N 3.06Å; R321-F323 VanDerWaalsContact C-N 3.33Å; R321-F323 PolarHBondContact O-N 3.5Å; R321-G324 WeakPolarHBondContact O-CA 3.2Å; R321-G324 PolarHBondContact O-N 3.45Å; R321-G324 VanDerWaalsContact O-N 3.11Å; R321-Y325 PolarHBondContact O-N 2.95Å
322D96.9Very high97.2Very high73 Ų7362.8 Ų62.839%0.3932%0.316SS..Hα-helixtrans-66.1-39.3-176.8-62-4.6000110.7H318 Y325 I326H318-D322 IonicContact CD2-OD1 2.74Å; H318-D322 PolarHBondContact CD2-OD1 2.9Å; H318-D322 IonicContact CD2-OD2 2.67Å; H318-D322 IonicContact NE2-OD1 2.74Å; H318-D322 PolarHBondContact O-N 3.5Å; D322-Y325 PolarHBondContact O-N 2.86Å; D322-I326 VanDerWaalsContact O-CG1 3.31Å; D322-I326 WeakPolarHBondContact O-CG1 3.37Å; D322-I326 PolarHBondContact O-N 2.81Å
323F98.4Very high97.3Very high80 Ų8063.3 Ų63.335%0.35132%0.32SS..Hα-helixtrans-61.7-43.7169.8-179.8-107.6000112.2L319 R321 Y325 I326 C327 A409 A412L319-F323 VanDerWaalsContact O-CB 3.25Å; L319-F323 WeakPolarHBondContact O-CB 3.31Å; L319-F323 PolarHBondContact O-N 2.97Å; R321-F323 VanDerWaalsContact C-N 3.33Å; R321-F323 PolarHBondContact O-N 3.5Å; F323-Y325 PolarHBondContact O-N 3.38Å; F323-I326 PolarHBondContact O-N 3.06Å; F323-C327 VanDerWaalsContact CZ-SG 3.57Å; F323-C327 WeakPolarHBondContact O-CB 3.46Å; F323-C327 PolarHBondContact O-N 3.02Å; F323-C327 PolarHBondContact O-SG 3.37Å; F323-A409 HydrophobicContact CD1-CB 4.14Å; F323-A409 HydrophobicContact CE1-CB 4.32Å; F323-A412 HydrophobicContact CD1-CB 3.92Å; F323-A412 HydrophobicContact CE1-CB 4.01Å
324G98.3Very high97.3Very high21 Ų2168.3 Ų68.322%0.21634%0.342CS..Hα-helixtrans-57.5-47.3174.800000113.2A320 R321 C327 E328A320-G324 PolarHBondContact O-N 3.3Å; R321-G324 WeakPolarHBondContact O-CA 3.2Å; R321-G324 PolarHBondContact O-N 3.45Å; R321-G324 VanDerWaalsContact O-N 3.11Å; G324-C327 WeakPolarHBondContact O-CB 3.45Å; G324-C327 PolarHBondContact O-N 3Å; G324-E328 PolarHBondContact O-N 3.22Å
325Y98.4Very high97.4Very high147 Ų14769.6 Ų69.658%0.57635%0.35SS*.Hα-helixtrans-58.9-48.6175.8178.3-89.9000111.6R321 D322 F323 C327 E328 T329R321-Y325 PolarHBondContact O-N 2.95Å; D322-Y325 PolarHBondContact O-N 2.86Å; F323-Y325 PolarHBondContact O-N 3.38Å; Y325-C327 VanDerWaalsContact C-N 3.32Å; Y325-C327 PolarHBondContact O-N 3.48Å; Y325-E328 PolarHBondContact O-N 3.22Å; Y325-T329 HydrophobicContact CD1-CG2 4.47Å; Y325-T329 HydrophobicContact CD2-CG2 4.21Å; Y325-T329 HydrophobicContact CE1-CG2 4.05Å; Y325-T329 WeakPolarHBondContact CE1-OG1 3.47Å; Y325-T329 HydrophobicContact CE2-CG2 3.78Å; Y325-T329 PolarHBondContact O-N 2.74Å; Y325-T329 PolarHBondContact O-OG1 2.89Å
326I98.3Very high97.5Very high94 Ų9471.8 Ų71.848%0.48236%0.363SS..Hα-helixtrans-63.5-37.4178.6-66.8166.4000111.6D322 F323 E328 E330 F331D322-I326 VanDerWaalsContact O-CG1 3.31Å; D322-I326 WeakPolarHBondContact O-CG1 3.37Å; D322-I326 PolarHBondContact O-N 2.81Å; F323-I326 PolarHBondContact O-N 3.06Å; I326-E328 PolarHBondContact O-N 2.74Å; I326-E330 HydrophobicContact CG2-CB 4.12Å; I326-E330 HydrophobicContact CG2-CG 4.1Å; I326-E330 WeakPolarHBondContact O-CB 3.42Å; I326-E330 PolarHBondContact O-N 3.36Å; I326-F331 PolarHBondContact O-N 2.93Å
327C98.3Very high97.5Very high18 Ų1871.9 Ų71.912%0.12236%0.364CS..Hα-helixtrans-65.7-23.3173-81.20000113.8F323 G324 Y325 F331 A412 A416F323-C327 VanDerWaalsContact CZ-SG 3.57Å; F323-C327 WeakPolarHBondContact O-CB 3.46Å; F323-C327 PolarHBondContact O-N 3.02Å; F323-C327 PolarHBondContact O-SG 3.37Å; G324-C327 WeakPolarHBondContact O-CB 3.45Å; G324-C327 PolarHBondContact O-N 3Å; Y325-C327 VanDerWaalsContact C-N 3.32Å; Y325-C327 PolarHBondContact O-N 3.48Å; C327-F331 WeakPolarHBondContact O-CB 3.4Å; C327-A412 HydrophobicContact CB-CB 4.32Å; C327-A416 HydrophobicContact CB-CB 4.19Å
328E95.7Very high97.5Very high135 Ų13572.9 Ų72.963%0.63137%0.365SS*.Hα-helixtrans-91.4-43.4178.5-173168.4-160.800112.6G324 Y325 I326G324-E328 PolarHBondContact O-N 3.22Å; Y325-E328 PolarHBondContact O-N 3.22Å; I326-E328 PolarHBondContact O-N 2.74Å
329T97.3Very high97.5Very high65 Ų6577.1 Ų77.140%0.39938%0.379SS..Hα-helixtrans-92.8-39.4-174.366.80000114.4Y325Y325-T329 HydrophobicContact CD1-CG2 4.47Å; Y325-T329 HydrophobicContact CD2-CG2 4.21Å; Y325-T329 HydrophobicContact CE1-CG2 4.05Å; Y325-T329 WeakPolarHBondContact CE1-OG1 3.47Å; Y325-T329 HydrophobicContact CE2-CG2 3.78Å; Y325-T329 PolarHBondContact O-N 2.74Å; Y325-T329 PolarHBondContact O-OG1 2.89Å
330E97.8Very high97.4Very high129 Ų12976.7 Ų76.760%0.60338%0.377SS*.THydrogen-bonded Turntrans-99.5-18.9-170.5-49.1-51.2121.800113.6I326 P332I326-E330 HydrophobicContact CG2-CB 4.12Å; I326-E330 HydrophobicContact CG2-CG 4.1Å; I326-E330 WeakPolarHBondContact O-CB 3.42Å; I326-E330 PolarHBondContact O-N 3.36Å; E330-P332 WeakPolarHBondContact O-CD 3.43Å
331F98Very high97.3Very high86 Ų8677 Ų7738%0.37738%0.378SS..  trans-69.1121.3-177.1-176.2-106.7000111.3I326 C327 A333 A416I326-F331 PolarHBondContact O-N 2.93Å; C327-F331 WeakPolarHBondContact O-CB 3.4Å; F331-A333 HydrophobicContact CD1-CB 3.94Å; F331-A333 HydrophobicContact CE1-CB 4.14Å; F331-A333 PolarHBondContact O-N 3.35Å; F331-A416 HydrophobicContact CB-CB 4.39Å; F331-A416 HydrophobicContact CD1-CB 3.76Å; F331-A416 HydrophobicContact CE1-CB 4.2Å; F331-A416 HydrophobicContact CG-CB 4.01Å
332P98.1Very high97Very high76 Ų7677.2 Ų77.249%0.49438%0.379SS..  trans-81.147.7-168.534.2-38000113.5E330 K334 A335 V336E330-P332 WeakPolarHBondContact O-CD 3.43Å; P332-K334 VanDerWaalsContact C-N 3.29Å; P332-K334 PolarHBondContact O-N 3.19Å; P332-K334 VanDerWaalsContact O-N 3.13Å; P332-A335 HydrophobicContact CB-CB 4.38Å; P332-A335 PolarHBondContact O-N 3.41Å; P332-V336 HydrophobicContact CG-CG2 4.17Å; P332-V336 WeakPolarHBondContact O-CG2 3.4Å; P332-V336 PolarHBondContact O-N 3.06Å
333A98.1Very high96.7Very high11 Ų1179.2 Ų79.29%0.09139%0.386CS..Hα-helixtrans-44.7-48.7-174.200000113.6F331 S337 N419F331-A333 HydrophobicContact CD1-CB 3.94Å; F331-A333 HydrophobicContact CE1-CB 4.14Å; F331-A333 PolarHBondContact O-N 3.35Å; A333-S337 WeakPolarHBondContact O-CB 3.33Å; A333-S337 PolarHBondContact O-N 2.96Å; A333-S337 PolarHBondContact O-OG 2.96Å; A333-N419 HydrophobicContact CB-CB 4.15Å
334K97.6Very high96.1Very high114 Ų11478.2 Ų78.250%0.49638%0.382SS..Hα-helixtrans-61.3-51.7178.1-178.2-177.3167.1-1710112P332 V336 S337 E338 E423P332-K334 VanDerWaalsContact C-N 3.29Å; P332-K334 PolarHBondContact O-N 3.19Å; P332-K334 VanDerWaalsContact O-N 3.13Å; K334-V336 VanDerWaalsContact C-N 3.32Å; K334-V336 PolarHBondContact O-N 3.49Å; K334-S337 PolarHBondContact O-N 2.88Å; K334-S337 VanDerWaalsContact O-N 3.14Å; K334-S337 PolarHBondContact O-OG 3.29Å; K334-E338 WeakPolarHBondContact CE-OE1 3.35Å; K334-E338 HydrophobicContact CG-CG 4.45Å; K334-E338 IonicContact NZ-OE1 2.64Å; K334-E338 PolarHBondContact O-N 3.08Å; K334-E423 HydrophobicContact CB-CB 4.47Å; K334-E423 HydrophobicContact CB-CG 4.04Å
335A98Very high95.6Very high57 Ų5781.7 Ų81.747%0.47140%0.399SS..Hα-helixtrans-64.1-38-177.100000112P332 E338 Y339P332-A335 HydrophobicContact CB-CB 4.38Å; P332-A335 PolarHBondContact O-N 3.41Å; A335-E338 PolarHBondContact O-N 3.15Å; A335-Y339 WeakPolarHBondContact O-CB 3.25Å; A335-Y339 PolarHBondContact O-N 3.42Å
336V98.1Very high95.1Very high52 Ų5278.6 Ų78.632%0.31539%0.393SS..Hα-helixtrans-64.2-42.5173.7179.30000111P332 K334 Y339 L340 Y420P332-V336 HydrophobicContact CG-CG2 4.17Å; P332-V336 WeakPolarHBondContact O-CG2 3.4Å; P332-V336 PolarHBondContact O-N 3.06Å; K334-V336 VanDerWaalsContact C-N 3.32Å; K334-V336 PolarHBondContact O-N 3.49Å; V336-Y339 PolarHBondContact O-N 3.49Å; V336-L340 HydrophobicContact CG1-CD1 4.03Å; V336-L340 PolarHBondContact O-N 2.86Å; V336-Y420 HydrophobicContact CB-CD2 4.14Å; V336-Y420 HydrophobicContact CB-CE2 4.5Å; V336-Y420 HydrophobicContact CG1-CD2 3.83Å; V336-Y420 HydrophobicContact CG1-CE2 3.86Å
337S97.3Very high94.5Very high1 Ų178.2 Ų78.21%0.00740%0.396CS..Hα-helixtrans-66.2-39.6175.676.10000113.6A333 K334 Y339 L340 N341 E423A333-S337 WeakPolarHBondContact O-CB 3.33Å; A333-S337 PolarHBondContact O-N 2.96Å; A333-S337 PolarHBondContact O-OG 2.96Å; K334-S337 PolarHBondContact O-N 2.88Å; K334-S337 VanDerWaalsContact O-N 3.14Å; K334-S337 PolarHBondContact O-OG 3.29Å; S337-Y339 VanDerWaalsContact C-N 3.28Å; S337-Y339 PolarHBondContact O-N 3.08Å; S337-L340 PolarHBondContact O-N 2.74Å; S337-N341 VanDerWaalsContact O-CB 3.28Å; S337-N341 WeakPolarHBondContact O-CB 3.4Å; S337-N341 PolarHBondContact O-N 3.34Å; S337-E423 VanDerWaalsContact OG-CB 3.23Å; S337-E423 WeakPolarHBondContact OG-CB 3.39Å
338E95.8Very high94Very high83 Ų8381.7 Ų81.739%0.38842%0.42SS..Hα-helixtrans-69.1-28.5177.2-76.3-177179.900111.7K334 A335 R342K334-E338 WeakPolarHBondContact CE-OE1 3.35Å; K334-E338 HydrophobicContact CG-CG 4.45Å; K334-E338 IonicContact NZ-OE1 2.64Å; K334-E338 PolarHBondContact O-N 3.08Å; A335-E338 PolarHBondContact O-N 3.15Å; E338-R342 WeakPolarHBondContact O-CD 3.44Å; E338-R342 VanDerWaalsContact O-CG 3.27Å; E338-R342 WeakPolarHBondContact O-CG 3.48Å; E338-R342 PolarHBondContact O-NE 2.82Å
339Y96.4Very high93.7Very high148 Ų14880 Ų8058%0.5842%0.416SS*.Hα-helixtrans-73-51.6172.2-179.4-96.4000111.7A335 V336 S337 R342A335-Y339 WeakPolarHBondContact O-CB 3.25Å; A335-Y339 PolarHBondContact O-N 3.42Å; V336-Y339 PolarHBondContact O-N 3.49Å; S337-Y339 VanDerWaalsContact C-N 3.28Å; S337-Y339 PolarHBondContact O-N 3.08Å; Y339-R342 WeakPolarHBondContact O-CB 3.14Å; Y339-R342 PolarHBondContact O-N 2.63Å
340L95.3Very high93.4Very high50 Ų5077 Ų7726%0.26240%0.398SS..Hα-helixtrans-71.3-34.6-175.3-69.2175.6000113.3V336 S337 R342 Q343 H344 Y420V336-L340 HydrophobicContact CG1-CD1 4.03Å; V336-L340 PolarHBondContact O-N 2.86Å; S337-L340 PolarHBondContact O-N 2.74Å; L340-R342 PolarHBondContact O-N 2.59Å; L340-Q343 WeakPolarHBondContact O-CB 3.22Å; L340-Q343 PolarHBondContact O-N 3.36Å; L340-H344 PolarHBondContact O-CD2 3.45Å; L340-Y420 HydrophobicContact CD1-CE2 3.9Å; L340-Y420 WeakPolarHBondContact CD1-OH 3.36Å
341N94.3Very high93.1Very high10 Ų1076.5 Ų76.55%0.05340%0.395CS..G310 helixtrans-63.8-24.4176.4-79.6-1.6000113.4S337 Q343 H344 A424S337-N341 VanDerWaalsContact O-CB 3.28Å; S337-N341 WeakPolarHBondContact O-CB 3.4Å; S337-N341 PolarHBondContact O-N 3.34Å; N341-Q343 PolarHBondContact O-N 2.79Å; N341-H344 PolarHBondContact O-N 3.18Å; N341-A424 PolarHBondContact ND2-O 2.8Å
342R91.1Very high92.9Very high171 Ų17175.2 Ų75.265%0.64540%0.397SS*.G310 helixtrans-64.6-17.7174.2-64.7166-157.4-162.42.7113E338 Y339 L340 H344E338-R342 WeakPolarHBondContact O-CD 3.44Å; E338-R342 VanDerWaalsContact O-CG 3.27Å; E338-R342 WeakPolarHBondContact O-CG 3.48Å; E338-R342 PolarHBondContact O-NE 2.82Å; Y339-R342 WeakPolarHBondContact O-CB 3.14Å; Y339-R342 PolarHBondContact O-N 2.63Å; L340-R342 PolarHBondContact O-N 2.59Å; R342-H344 VanDerWaalsContact C-N 3.33Å
343Q89.9Confident92.7Very high116 Ų11674.4 Ų74.454%0.54238%0.384SS..G310 helixtrans-86.5-3.9176.3-55.4-179.7-1300112.6L340 N341L340-Q343 WeakPolarHBondContact O-CB 3.22Å; L340-Q343 PolarHBondContact O-N 3.36Å; N341-Q343 PolarHBondContact O-N 2.79Å
344H87.3Confident92.6Very high59 Ų5976.4 Ų76.427%0.27339%0.39SS..  trans-126.660.5-175-59.9-58.2000111.2L340 N341 R342 L350 R353 M431L340-H344 PolarHBondContact O-CD2 3.45Å; N341-H344 PolarHBondContact O-N 3.18Å; R342-H344 VanDerWaalsContact C-N 3.33Å; H344-L350 WeakPolarHBondContact O-CD2 3.39Å; H344-R353 HydrophobicContact CB-CG 4.3Å; H344-R353 PolarHBondContact CD2-NE 3.5Å; H344-R353 VanDerWaalsContact CD2-NE 3.34Å; H344-R353 PolarHBondContact NE2-NE 3.49Å; H344-R353 VanDerWaalsContact NE2-NE 3.12Å; H344-R353 PolarHBondContact NE2-NH2 2.85Å; H344-M431 VanDerWaalsContact O-CE 3.26Å; H344-M431 WeakPolarHBondContact O-CE 3.48Å
345T85.9Confident92.5Very high93 Ų9374.4 Ų74.457%0.57139%0.385SS*.  trans-94.3-13.4-177.147.20000114.8P347 M431T345-P347 WeakPolarHBondContact O-CD 3.24Å; T345-M431 HydrophobicContact CG2-CE 3.98Å
346D87.7Confident92.5Very high83 Ų8376.1 Ų76.144%0.44439%0.385SS..  trans-64.8119.2-178.9-167.6-57.4000111.2S348 D349 L350D346-S348 PolarHBondContact O-N 3.16Å; D346-S348 VanDerWaalsContact O-N 3.17Å; D346-S348 WeakPolarHBondContact OD1-CB 3.22Å; D346-S348 PolarHBondContact OD1-N 2.82Å; D346-S348 PolarHBondContact OD1-OG 2.92Å; D346-D349 HydrophobicContact CB-CB 4.5Å; D346-D349 PolarHBondContact O-N 3.42Å; D346-L350 WeakPolarHBondContact O-CG 3.4Å; D346-L350 PolarHBondContact O-N 2.94Å
347P86.4Confident92.4Very high85 Ų8573.9 Ų73.955%0.55237%0.371SS*.THydrogen-bonded Turntrans-58-28.1-178.1-24.934.7000114.9T345T345-P347 WeakPolarHBondContact O-CD 3.24Å
348S88.1Confident92.5Very high91 Ų9177.7 Ų77.764%0.63639%0.391SS*.THydrogen-bonded Turntrans-73.3-40.4-178.867.50000111.9D346D346-S348 PolarHBondContact O-N 3.16Å; D346-S348 VanDerWaalsContact O-N 3.17Å; D346-S348 WeakPolarHBondContact OD1-CB 3.22Å; D346-S348 PolarHBondContact OD1-N 2.82Å; D346-S348 PolarHBondContact OD1-OG 2.92Å
349D89.9Confident92.6Very high100 Ų10076.3 Ų76.354%0.53539%0.393SS..THydrogen-bonded Turntrans-79.7-18.5-179.7-87.3-28.6000113.9D346 H351 S352 R353D346-D349 HydrophobicContact CB-CB 4.5Å; D346-D349 PolarHBondContact O-N 3.42Å; D349-H351 PolarHBondContact O-N 3.37Å; D349-H351 VanDerWaalsContact O-N 3.11Å; D349-S352 WeakPolarHBondContact O-CB 3.34Å; D349-S352 PolarHBondContact O-N 3.39Å; D349-S352 VanDerWaalsContact O-N 3.11Å; D349-R353 WeakPolarHBondContact O-CB 3.25Å; D349-R353 PolarHBondContact O-N 2.95Å
350L90Very high92.7Very high3 Ų372.2 Ų72.22%0.01638%0.384CS..Hα-helixtrans-52.7-38.3-176.3-68.5-175.8000113.2H344 D346 K354 M428 M431 F432H344-L350 WeakPolarHBondContact O-CD2 3.39Å; D346-L350 WeakPolarHBondContact O-CG 3.4Å; D346-L350 PolarHBondContact O-N 2.94Å; L350-K354 WeakPolarHBondContact O-CB 3.3Å; L350-K354 PolarHBondContact O-N 2.84Å; L350-M428 HydrophobicContact CB-CE 4.15Å; L350-M428 HydrophobicContact CD2-CE 3.87Å; L350-M428 WeakPolarHBondContact O-CE 3.44Å; L350-M431 HydrophobicContact CD1-CB 4.38Å; L350-M431 HydrophobicContact CD2-CE 4.14Å; L350-F432 HydrophobicContact CB-CE1 3.88Å; L350-F432 HydrophobicContact CB-CE2 4.03Å; L350-F432 HydrophobicContact CB-CZ 3.51Å; L350-F432 HydrophobicContact CD1-CD1 4.49Å; L350-F432 HydrophobicContact CD1-CE1 4.43Å
351H91.8Very high92.8Very high117 Ų11773 Ų7354%0.54239%0.385SS..Hα-helixtrans-71.6-45.8-179.9-170.273.9000111.9D349 R353 K354 N355 F432D349-H351 PolarHBondContact O-N 3.37Å; D349-H351 VanDerWaalsContact O-N 3.11Å; H351-R353 VanDerWaalsContact C-N 3.33Å; H351-R353 PolarHBondContact O-N 3.44Å; H351-K354 PolarHBondContact O-N 3.34Å; H351-N355 PolarHBondContact CD2-ND2 3.22Å; H351-N355 VanDerWaalsContact CD2-ND2 3.31Å; H351-N355 PolarHBondContact NE2-ND2 3.15Å; H351-N355 VanDerWaalsContact O-CG 3.23Å; H351-N355 PolarHBondContact O-N 3.49Å; H351-N355 PolarHBondContact O-ND2 2.96Å; H351-F432 HydrophobicContact CB-CZ 4.44Å
352S93.9Very high93Very high60 Ų6077 Ų7742%0.4240%0.404SS..Hα-helixtrans-56.8-47.3173.5-178.30000111.2D349 K354 N355 M356D349-S352 WeakPolarHBondContact O-CB 3.34Å; D349-S352 PolarHBondContact O-N 3.39Å; D349-S352 VanDerWaalsContact O-N 3.11Å; S352-K354 PolarHBondContact O-N 3.28Å; S352-N355 PolarHBondContact O-N 3.35Å; S352-M356 PolarHBondContact O-N 3.32Å
353R94.6Very high93.4Very high58 Ų5874.2 Ų74.222%0.21940%0.401CS..Hα-helixtrans-65.6-38.9-179.6-174.656.7164.1157.5-5.6112.9H344 D349 H351 M356 L357 M428H344-R353 HydrophobicContact CB-CG 4.3Å; H344-R353 PolarHBondContact CD2-NE 3.5Å; H344-R353 VanDerWaalsContact CD2-NE 3.34Å; H344-R353 PolarHBondContact NE2-NE 3.49Å; H344-R353 VanDerWaalsContact NE2-NE 3.12Å; H344-R353 PolarHBondContact NE2-NH2 2.85Å; D349-R353 WeakPolarHBondContact O-CB 3.25Å; D349-R353 PolarHBondContact O-N 2.95Å; H351-R353 VanDerWaalsContact C-N 3.33Å; H351-R353 PolarHBondContact O-N 3.44Å; R353-M356 HydrophobicContact CB-CE 4.44Å; R353-M356 PolarHBondContact O-N 3.2Å; R353-L357 WeakPolarHBondContact O-CG 3.15Å; R353-L357 PolarHBondContact O-N 3Å; R353-L357 VanDerWaalsContact O-N 3.12Å; R353-M428 HydrophobicContact CB-CE 3.94Å; R353-M428 HydrophobicContact CB-SD 4.38Å; R353-M428 HydrophobicContact CG-CE 4.05Å; R353-M428 HydrophobicContact CG-SD 4.03Å
354K94.8Very high93.8Very high53 Ų5369.4 Ų69.423%0.2338%0.38CS..Hα-helixtrans-62.4-44.1172.8-178.1169.5178.2172.60111.7L350 H351 S352 M356 L357 L358 L425 M428 D429 F432L350-K354 WeakPolarHBondContact O-CB 3.3Å; L350-K354 PolarHBondContact O-N 2.84Å; H351-K354 PolarHBondContact O-N 3.34Å; S352-K354 PolarHBondContact O-N 3.28Å; K354-M356 PolarHBondContact O-N 3Å; K354-L357 PolarHBondContact O-N 2.84Å; K354-L358 HydrophobicContact CG-CD1 4.2Å; K354-L358 WeakPolarHBondContact O-CG 3.37Å; K354-L358 PolarHBondContact O-N 2.91Å; K354-L425 HydrophobicContact CG-CD2 3.89Å; K354-M428 HydrophobicContact CB-CE 4.07Å; K354-M428 HydrophobicContact CB-SD 3.98Å; K354-D429 IonicContact NZ-OD1 2.7Å; K354-D429 PolarHBondContact NZ-OD1 3.21Å; K354-D429 IonicContact NZ-OD2 3.42Å; K354-F432 HydrophobicContact CB-CE2 4.29Å; K354-F432 HydrophobicContact CD-CE2 3.91Å
355N96.3Very high94.2Very high72 Ų7270.9 Ų70.939%0.38539%0.385SS..Hα-helixtrans-65.7-38.9179.3-65-12.6000111.8H351 S352 L358 A359H351-N355 PolarHBondContact CD2-ND2 3.22Å; H351-N355 VanDerWaalsContact CD2-ND2 3.31Å; H351-N355 PolarHBondContact NE2-ND2 3.15Å; H351-N355 VanDerWaalsContact O-CG 3.23Å; H351-N355 PolarHBondContact O-N 3.49Å; H351-N355 PolarHBondContact O-ND2 2.96Å; S352-N355 PolarHBondContact O-N 3.35Å; N355-L358 PolarHBondContact O-N 3.03Å; N355-A359 WeakPolarHBondContact O-CB 3.32Å; N355-A359 PolarHBondContact O-N 3.12Å
356M96.9Very high94.8Very high94 Ų9471 Ų7146%0.46338%0.379SS..Hα-helixtrans-59.8-45.1172.3-74.8-169.6-81.900112.7S352 R353 K354 A359 T360S352-M356 PolarHBondContact O-N 3.32Å; R353-M356 HydrophobicContact CB-CE 4.44Å; R353-M356 PolarHBondContact O-N 3.2Å; K354-M356 PolarHBondContact O-N 3Å; M356-A359 PolarHBondContact O-N 3.03Å; M356-T360 WeakPolarHBondContact O-CB 3.34Å; M356-T360 PolarHBondContact O-N 2.91Å; M356-T360 PolarHBondContact O-OG1 3.06Å
357L97.4Very high95.3Very high4 Ų471.8 Ų71.82%0.02138%0.379CS..Hα-helixtrans-63.4-41177.2-68.4178.7000112.3R353 K354 K361 L421 A424 L425 M428R353-L357 WeakPolarHBondContact O-CG 3.15Å; R353-L357 PolarHBondContact O-N 3Å; R353-L357 VanDerWaalsContact O-N 3.12Å; K354-L357 PolarHBondContact O-N 2.84Å; L357-K361 WeakPolarHBondContact O-CB 3.47Å; L357-K361 PolarHBondContact O-N 2.75Å; L357-L421 HydrophobicContact CD2-CD2 3.62Å; L357-A424 HydrophobicContact CD1-CB 3.81Å; L357-A424 HydrophobicContact CD2-CB 4.42Å; L357-L425 HydrophobicContact CB-CD2 3.8Å; L357-L425 HydrophobicContact CB-CG 4.08Å; L357-L425 HydrophobicContact CD1-CD2 4.15Å; L357-L425 HydrophobicContact CD1-CG 4.27Å; L357-M428 HydrophobicContact CD1-CG 4.22Å; L357-M428 HydrophobicContact CD1-SD 3.59Å; L357-M428 VanDerWaalsContact CD1-SD 3.59Å
358L98.1Very high95.8Very high81 Ų8168.8 Ų68.842%0.42436%0.359SS..Hα-helixtrans-63.3-47.9176.2-72.2169.3000111.6K354 N355 K361 Q362 L425K354-L358 HydrophobicContact CG-CD1 4.2Å; K354-L358 WeakPolarHBondContact O-CG 3.37Å; K354-L358 PolarHBondContact O-N 2.91Å; N355-L358 PolarHBondContact O-N 3.03Å; L358-K361 PolarHBondContact O-N 2.95Å; L358-Q362 PolarHBondContact O-N 3.11Å; L358-L425 HydrophobicContact CD2-CD1 3.74Å; L358-L425 HydrophobicContact CD2-CD2 4.09Å; L358-L425 HydrophobicContact CG-CD1 4.36Å; L358-L425 HydrophobicContact CG-CD2 3.96Å
359A98.3Very high96.3Very high54 Ų5467.5 Ų67.545%0.44635%0.345SS..Hα-helixtrans-62.1-43.8177.800000112.1N355 M356 K361 Q362 L363N355-A359 WeakPolarHBondContact O-CB 3.32Å; N355-A359 PolarHBondContact O-N 3.12Å; M356-A359 PolarHBondContact O-N 3.03Å; A359-K361 PolarHBondContact O-N 3.38Å; A359-Q362 PolarHBondContact O-N 2.94Å; A359-L363 WeakPolarHBondContact O-CG 3.49Å; A359-L363 PolarHBondContact O-N 3.23Å
360T98.5Very high96.7Very high63 Ų6365.7 Ų65.739%0.38734%0.335SS..Hα-helixtrans-61-44.4174.9-56.50000111.2M356 Q362 L363 C364 L421M356-T360 WeakPolarHBondContact O-CB 3.34Å; M356-T360 PolarHBondContact O-N 2.91Å; M356-T360 PolarHBondContact O-OG1 3.06Å; T360-Q362 VanDerWaalsContact C-N 3.33Å; T360-Q362 PolarHBondContact O-N 3.12Å; T360-L363 PolarHBondContact O-N 2.7Å; T360-C364 PolarHBondContact O-N 2.76Å; T360-C364 PolarHBondContact O-SG 3.05Å; T360-L421 HydrophobicContact CG2-CD1 3.88Å; T360-L421 HydrophobicContact CG2-CD2 4.35Å
361K98Very high97Very high66 Ų6666.1 Ų66.129%0.28734%0.338SS..Hα-helixtrans-61.6-41.3178.7-177.7174.1173.9175.70111.8L357 L358 A359 C364 K365 Q418 L421 T422 L425L357-K361 WeakPolarHBondContact O-CB 3.47Å; L357-K361 PolarHBondContact O-N 2.75Å; L358-K361 PolarHBondContact O-N 2.95Å; A359-K361 PolarHBondContact O-N 3.38Å; K361-C364 PolarHBondContact O-N 3.07Å; K361-K365 PolarHBondContact O-N 3.36Å; K361-Q418 HydrophobicContact CG-CG 4.4Å; K361-L421 HydrophobicContact CB-CB 4.3Å; K361-L421 HydrophobicContact CB-CD1 3.94Å; K361-T422 PolarHBondContact NZ-OG1 2.93Å; K361-L425 HydrophobicContact CD-CD1 4.45Å
362Q98.3Very high97.2Very high94 Ų9463.6 Ų63.644%0.43934%0.337SS..Hα-helixtrans-63.9-47.3178-178.858.524.100111.8L358 A359 T360 C364 K365 E366L358-Q362 PolarHBondContact O-N 3.11Å; A359-Q362 PolarHBondContact O-N 2.94Å; T360-Q362 VanDerWaalsContact C-N 3.33Å; T360-Q362 PolarHBondContact O-N 3.12Å; Q362-C364 VanDerWaalsContact C-N 3.34Å; Q362-C364 PolarHBondContact O-N 2.72Å; Q362-K365 WeakPolarHBondContact O-CB 3.38Å; Q362-K365 PolarHBondContact O-N 3.39Å; Q362-K365 VanDerWaalsContact O-N 3.08Å; Q362-E366 WeakPolarHBondContact CG-OE1 3.44Å; Q362-E366 PolarHBondContact NE2-OE1 2.88Å; Q362-E366 WeakPolarHBondContact O-CG 3.3Å; Q362-E366 PolarHBondContact O-N 2.96Å
363L98.4Very high97.3Very high112 Ų11264.3 Ų64.359%0.58633%0.333SS*.Hα-helixtrans-62.2-39176.5-68.6171000112.5A359 T360 K365 F367A359-L363 WeakPolarHBondContact O-CG 3.49Å; A359-L363 PolarHBondContact O-N 3.23Å; T360-L363 PolarHBondContact O-N 2.7Å; L363-K365 VanDerWaalsContact C-N 3.31Å; L363-K365 PolarHBondContact O-N 2.98Å; L363-F367 PolarHBondContact O-N 3.36Å; L363-F367 VanDerWaalsContact O-N 3.15Å
364C98.3Very high97.4Very high15 Ų1562.8 Ų62.810%0.10133%0.33CS..Hα-helixtrans-62.1-38.9173-66.60000112.1T360 K361 Q362 T368 L414 Q418T360-C364 PolarHBondContact O-N 2.76Å; T360-C364 PolarHBondContact O-SG 3.05Å; K361-C364 PolarHBondContact O-N 3.07Å; Q362-C364 VanDerWaalsContact C-N 3.34Å; Q362-C364 PolarHBondContact O-N 2.72Å; C364-T368 WeakPolarHBondContact O-CB 3.43Å; C364-T368 PolarHBondContact O-N 3.11Å; C364-T368 VanDerWaalsContact O-N 3.11Å; C364-T368 PolarHBondContact O-OG1 2.91Å; C364-L414 HydrophobicContact CB-CD2 4.38Å; C364-Q418 HydrophobicContact CB-CG 3.8Å
365K97.1Very high97.4Very high90 Ų9063.8 Ų63.839%0.39133%0.332SS..Hα-helixtrans-66.3-51.3175.8173162.6171.849.30111.7K361 Q362 L363 F367 T368 D369K361-K365 PolarHBondContact O-N 3.36Å; Q362-K365 WeakPolarHBondContact O-CB 3.38Å; Q362-K365 PolarHBondContact O-N 3.39Å; Q362-K365 VanDerWaalsContact O-N 3.08Å; L363-K365 VanDerWaalsContact C-N 3.31Å; L363-K365 PolarHBondContact O-N 2.98Å; K365-F367 VanDerWaalsContact C-N 3.31Å; K365-F367 PolarHBondContact O-N 2.81Å; K365-T368 CarbonylContact O-C 3.24Å; K365-T368 WeakPolarHBondContact O-CA 3.48Å; K365-T368 WeakPolarHBondContact O-CB 3.46Å; K365-T368 PolarHBondContact O-N 3.04Å; K365-D369 WeakPolarHBondContact CE-OD2 3.08Å; K365-D369 VanDerWaalsContact CG-OD2 3.31Å; K365-D369 WeakPolarHBondContact CG-OD2 3.43Å; K365-D369 IonicContact NZ-OD1 2.64Å; K365-D369 PolarHBondContact NZ-OD1 3.38Å; K365-D369 IonicContact NZ-OD2 3.22Å; K365-D369 PolarHBondContact NZ-OD2 2.87Å; K365-D369 VanDerWaalsContact O-CG 3.28Å; K365-D369 PolarHBondContact O-N 3.16Å
366E98.1Very high97.4Very high95 Ų9560.8 Ų60.844%0.44432%0.317SS..Hα-helixtrans-56-43.8-179-72.9167.7-170.900112.4Q362 D369 L370Q362-E366 WeakPolarHBondContact CG-OE1 3.44Å; Q362-E366 PolarHBondContact NE2-OE1 2.88Å; Q362-E366 WeakPolarHBondContact O-CG 3.3Å; Q362-E366 PolarHBondContact O-N 2.96Å; E366-D369 PolarHBondContact O-N 3.08Å; E366-L370 PolarHBondContact O-N 3.44Å
367F98.3Very high97.1Very high101 Ų10157.5 Ų57.544%0.44330%0.302SS..Hα-helixtrans-69-35176.2-176.5-128.4000112.8L363 K365 L370 L371 I410 L414L363-F367 PolarHBondContact O-N 3.36Å; L363-F367 VanDerWaalsContact O-N 3.15Å; K365-F367 VanDerWaalsContact C-N 3.31Å; K365-F367 PolarHBondContact O-N 2.81Å; F367-L370 PolarHBondContact O-N 3.46Å; F367-L371 HydrophobicContact CD1-CD1 4.43Å; F367-L371 HydrophobicContact CE1-CD1 4Å; F367-L371 HydrophobicContact CE2-CD1 4.37Å; F367-L371 HydrophobicContact CE2-CD2 4.4Å; F367-L371 HydrophobicContact CE2-CG 4.27Å; F367-L371 HydrophobicContact CZ-CD1 3.96Å; F367-L371 HydrophobicContact CZ-CD2 4.46Å; F367-L371 HydrophobicContact CZ-CG 4.33Å; F367-L371 WeakPolarHBondContact O-CG 3.22Å; F367-L371 PolarHBondContact O-N 2.97Å; F367-L371 VanDerWaalsContact O-N 3.09Å; F367-I410 HydrophobicContact CE1-CG2 3.98Å; F367-L414 HydrophobicContact CD1-CD1 3.62Å; F367-L414 HydrophobicContact CE1-CD1 4.08Å
368T97.8Very high96.9Very high21 Ų2158.5 Ų58.513%0.12931%0.307CS..Hα-helixtrans-67-42173.9-56.40000111.5C364 K365 L370 L371 A372 C411C364-T368 WeakPolarHBondContact O-CB 3.43Å; C364-T368 PolarHBondContact O-N 3.11Å; C364-T368 VanDerWaalsContact O-N 3.11Å; C364-T368 PolarHBondContact O-OG1 2.91Å; K365-T368 CarbonylContact O-C 3.24Å; K365-T368 WeakPolarHBondContact O-CA 3.48Å; K365-T368 WeakPolarHBondContact O-CB 3.46Å; K365-T368 PolarHBondContact O-N 3.04Å; T368-L370 VanDerWaalsContact C-N 3.3Å; T368-L370 PolarHBondContact O-N 3.33Å; T368-L371 PolarHBondContact O-N 3.2Å; T368-A372 WeakPolarHBondContact O-CB 3.45Å; T368-A372 PolarHBondContact O-N 3.29Å; T368-C411 HydrophobicContact CG2-CB 4.25Å
369D97.5Very high96.4Very high64 Ų6455.6 Ų55.634%0.34230%0.297SS..Hα-helixtrans-65.5-32.8177.5-66.6-22.3000111.6K365 E366 Q373K365-D369 WeakPolarHBondContact CE-OD2 3.08Å; K365-D369 VanDerWaalsContact CG-OD2 3.31Å; K365-D369 WeakPolarHBondContact CG-OD2 3.43Å; K365-D369 IonicContact NZ-OD1 2.64Å; K365-D369 PolarHBondContact NZ-OD1 3.38Å; K365-D369 IonicContact NZ-OD2 3.22Å; K365-D369 PolarHBondContact NZ-OD2 2.87Å; K365-D369 VanDerWaalsContact O-CG 3.28Å; K365-D369 PolarHBondContact O-N 3.16Å; E366-D369 PolarHBondContact O-N 3.08Å; D369-Q373 WeakPolarHBondContact O-CG 3.28Å; D369-Q373 PolarHBondContact O-N 3.41Å; D369-Q373 PolarHBondContact O-NE2 3.16Å
370L97.6Very high95.8Very high63 Ų6357.8 Ų57.833%0.3330%0.301SS..Hα-helixtrans-66.7-45.6170.4177.162.8000112E366 F367 T368 A372 Q373 L387 I391E366-L370 PolarHBondContact O-N 3.44Å; F367-L370 PolarHBondContact O-N 3.46Å; T368-L370 VanDerWaalsContact C-N 3.3Å; T368-L370 PolarHBondContact O-N 3.33Å; L370-A372 VanDerWaalsContact C-N 3.3Å; L370-A372 PolarHBondContact O-N 2.79Å; L370-Q373 WeakPolarHBondContact O-CB 3.39Å; L370-Q373 PolarHBondContact O-N 2.86Å; L370-L387 HydrophobicContact CD1-CD1 4.18Å; L370-L387 HydrophobicContact CD1-CD2 3.79Å; L370-I391 HydrophobicContact CD1-CG2 4.45Å
371L97.5Very high95.1Very high12 Ų1257.5 Ų57.56%0.06330%0.302CS..Hα-helixtrans-65-34.4177.7-68.8175.8000112.1F367 T368 Q373 D374 L395 A407 I410F367-L371 HydrophobicContact CD1-CD1 4.43Å; F367-L371 HydrophobicContact CE1-CD1 4Å; F367-L371 HydrophobicContact CE2-CD1 4.37Å; F367-L371 HydrophobicContact CE2-CD2 4.4Å; F367-L371 HydrophobicContact CE2-CG 4.27Å; F367-L371 HydrophobicContact CZ-CD1 3.96Å; F367-L371 HydrophobicContact CZ-CD2 4.46Å; F367-L371 HydrophobicContact CZ-CG 4.33Å; F367-L371 WeakPolarHBondContact O-CG 3.22Å; F367-L371 PolarHBondContact O-N 2.97Å; F367-L371 VanDerWaalsContact O-N 3.09Å; T368-L371 PolarHBondContact O-N 3.2Å; L371-Q373 PolarHBondContact O-N 3.2Å; L371-D374 WeakPolarHBondContact O-CB 3.36Å; L371-D374 PolarHBondContact O-N 2.87Å; L371-D374 VanDerWaalsContact O-N 3.1Å; L371-L395 HydrophobicContact CD2-CD2 3.77Å; L371-A407 HydrophobicContact CD2-CB 4.34Å; L371-I410 HydrophobicContact CD1-CB 4.12Å; L371-I410 HydrophobicContact CD1-CG2 3.59Å
372A95.6Very high94.6Very high63 Ų6359.4 Ų59.452%0.52131%0.307SS..THydrogen-bonded Turntrans-65.4-13.9172.500000113.8T368 L370 R375T368-A372 WeakPolarHBondContact O-CB 3.45Å; T368-A372 PolarHBondContact O-N 3.29Å; L370-A372 VanDerWaalsContact C-N 3.3Å; L370-A372 PolarHBondContact O-N 2.79Å; A372-R375 PolarHBondContact O-NH1 2.95Å; A372-R375 PolarHBondContact O-NH2 2.87Å
373Q96.1Very high94.3Very high75 Ų7557.3 Ų57.335%0.3530%0.302SS..THydrogen-bonded Turntrans-90.9-1.6173.8-69.8168.477.200113.7D369 L370 L371 R375 I386 L387D369-Q373 WeakPolarHBondContact O-CG 3.28Å; D369-Q373 PolarHBondContact O-N 3.41Å; D369-Q373 PolarHBondContact O-NE2 3.16Å; L370-Q373 WeakPolarHBondContact O-CB 3.39Å; L370-Q373 PolarHBondContact O-N 2.86Å; L371-Q373 PolarHBondContact O-N 3.2Å; Q373-R375 VanDerWaalsContact C-NH1 3.31Å; Q373-R375 WeakPolarHBondContact O-CG 3.23Å; Q373-R375 PolarHBondContact O-N 3.43Å; Q373-R375 PolarHBondContact O-NH1 2.87Å; Q373-I386 HydrophobicContact CB-CD1 4.06Å; Q373-I386 HydrophobicContact CB-CG1 4.46Å; Q373-I386 HydrophobicContact CG-CD1 4.09Å; Q373-L387 HydrophobicContact CB-CD1 3.93Å; Q373-L387 HydrophobicContact CB-CD2 3.77Å; Q373-L387 HydrophobicContact CB-CG 3.91Å
374D96.3Very high94Very high27 Ų2757.5 Ų57.514%0.14431%0.308CS..  trans-57.5128.9173.5-175.512.5000111.2L371 T376 Q392 L395 S399L371-D374 WeakPolarHBondContact O-CB 3.36Å; L371-D374 PolarHBondContact O-N 2.87Å; L371-D374 VanDerWaalsContact O-N 3.1Å; D374-T376 VanDerWaalsContact CG-OG1 3.26Å; D374-T376 WeakPolarHBondContact OD1-CB 3.26Å; D374-T376 PolarHBondContact OD1-N 2.86Å; D374-T376 PolarHBondContact OD1-OG1 3.31Å; D374-T376 PolarHBondContact OD2-OG1 2.82Å; D374-T376 VanDerWaalsContact OD2-OG1 3.08Å; D374-Q392 PolarHBondContact OD1-NE2 3.2Å; D374-L395 HydrophobicContact CB-CD1 4.23Å; D374-S399 PolarHBondContact OD2-OG 3.43Å
375R95.7Very high93.8Very high74 Ų7460.4 Ų60.428%0.27933%0.326SS..  trans-116.129.5175.8-57.2-59.4170.7-111.44.6112.4A372 Q373 P383 T384 I386A372-R375 PolarHBondContact O-NH1 2.95Å; A372-R375 PolarHBondContact O-NH2 2.87Å; Q373-R375 VanDerWaalsContact C-NH1 3.31Å; Q373-R375 WeakPolarHBondContact O-CG 3.23Å; Q373-R375 PolarHBondContact O-N 3.43Å; Q373-R375 PolarHBondContact O-NH1 2.87Å; R375-P383 HydrophobicContact CB-CB 4.22Å; R375-P383 HydrophobicContact CB-CG 3.86Å; R375-P383 HydrophobicContact CG-CB 4.49Å; R375-P383 WeakPolarHBondContact O-CG 3.4Å; R375-T384 WeakPolarHBondContact CG-O 3.45Å; R375-I386 HydrophobicContact CG-CD1 4.49Å; R375-I386 HydrophobicContact CG-CG1 3.92Å
376T95.1Very high93.7Very high9 Ų960.8 Ų60.86%0.05533%0.332CS..  trans-58.3127.3172.4-590000111D374 I378 Q392 T396 L400D374-T376 VanDerWaalsContact CG-OG1 3.26Å; D374-T376 WeakPolarHBondContact OD1-CB 3.26Å; D374-T376 PolarHBondContact OD1-N 2.86Å; D374-T376 PolarHBondContact OD1-OG1 3.31Å; D374-T376 PolarHBondContact OD2-OG1 2.82Å; D374-T376 VanDerWaalsContact OD2-OG1 3.08Å; T376-I378 VanDerWaalsContact C-N 3.34Å; T376-I378 HydrophobicContact CG2-CD1 3.77Å; T376-I378 HydrophobicContact CG2-CG1 3.86Å; T376-I378 PolarHBondContact O-N 2.86Å; T376-Q392 PolarHBondContact OG1-NE2 2.78Å; T376-T396 HydrophobicContact CG2-CG2 4.25Å; T376-T396 VanDerWaalsContact OG1-CA 3.25Å; T376-T396 WeakPolarHBondContact OG1-CA 3.37Å; T376-T396 PolarHBondContact OG1-N 2.78Å; T376-L400 HydrophobicContact CG2-CG 4.32Å
377P92.2Very high93.7Very high24 Ų2457.4 Ų57.416%0.15632%0.317CS..  trans-77.778.2-178.830.9-35.6000112M213 R255 S381M213-P377 HydrophobicContact CE-CG 3.8Å; R255-P377 WeakPolarHBondContact CD-O 3.49Å; R255-P377 PolarHBondContact NH1-O 3.43Å; P377-S381 WeakPolarHBondContact CA-O 3.42Å; P377-S381 WeakPolarHBondContact CB-O 3.37Å
378I92.1Very high93.6Very high25 Ų2559.4 Ų59.413%0.12833%0.327CS..  trans-89.8149173.6-58.5-59.4000110.9E313 V317 T376 N380 S381 L400E313-I378 HydrophobicContact CG-CG2 4.39Å; V317-I378 HydrophobicContact CG2-CG2 4.5Å; T376-I378 VanDerWaalsContact C-N 3.34Å; T376-I378 HydrophobicContact CG2-CD1 3.77Å; T376-I378 HydrophobicContact CG2-CG1 3.86Å; T376-I378 PolarHBondContact O-N 2.86Å; I378-N380 PolarHBondContact O-N 2.74Å; I378-S381 PolarHBondContact O-N 3.29Å; I378-S381 PolarHBondContact O-OG 3.07Å; I378-L400 HydrophobicContact CD1-CD2 4.07Å
379G88.6Confident93.5Very high21 Ų2161.1 Ų61.122%0.21634%0.339CS..THydrogen-bonded Turntrans56.3-123.5-177.500000111.4R255 E313 R382R255-G379 PolarHBondContact NH1-O 3.22Å; R255-G379 VanDerWaalsContact NH2-N 3.17Å; R255-G379 PolarHBondContact NH2-O 2.85Å; E313-G379 WeakPolarHBondContact OE2-CA 3.27Å; E313-G379 PolarHBondContact OE2-N 2.7Å; G379-R382 PolarHBondContact O-NH1 3.47Å; G379-R382 PolarHBondContact O-NH2 2.66Å
380N85.4Confident93.5Very high100 Ų10060.3 Ų60.354%0.53535%0.345SS..THydrogen-bonded Turntrans-100.81.1177.3-71.3-0.3000113.7I378I378-N380 PolarHBondContact O-N 2.74Å
381S84.1Confident93.5Very high57 Ų5761.3 Ų61.340%0.39935%0.35SS..  trans-73.9137.8176.678.30000110.8P377 I378 P383P377-S381 WeakPolarHBondContact CA-O 3.42Å; P377-S381 WeakPolarHBondContact CB-O 3.37Å; I378-S381 PolarHBondContact O-N 3.29Å; I378-S381 PolarHBondContact O-OG 3.07Å; S381-P383 VanDerWaalsContact C-CD 3.44Å
382R86.6Confident93.5Very high105 Ų10561.3 Ų61.340%0.39635%0.35SS..  trans-133.756.4173.8-57.8-66.6177.8-85.5-10.7110.2T226 G379T226-R382 PolarHBondContact O-NH2 3.28Å; T226-R382 PolarHBondContact OG1-NE 3.13Å; T226-R382 PolarHBondContact OG1-NH2 3.02Å; G379-R382 PolarHBondContact O-NH1 3.47Å; G379-R382 PolarHBondContact O-NH2 2.66Å
383P91.8Very high93.6Very high50 Ų5058.8 Ų58.833%0.32533%0.329SS..PPolyproline II helixtrans-70.3151.9-178.731.9-35.9000111.5R375 S381R375-P383 HydrophobicContact CB-CB 4.22Å; R375-P383 HydrophobicContact CB-CG 3.86Å; R375-P383 HydrophobicContact CG-CB 4.49Å; R375-P383 WeakPolarHBondContact O-CG 3.4Å; S381-P383 VanDerWaalsContact C-CD 3.44Å
384T92.9Very high93.7Very high116 Ų11659.1 Ų59.171%0.71234%0.338SS*.PPolyproline II helixtrans-68133.6168.7-470000109.8R375R375-T384 WeakPolarHBondContact CG-O 3.45Å
385P92.9Very high93.7Very high76 Ų7658.9 Ų58.949%0.49434%0.337SS..PPolyproline II helixtrans-53.9137.2168.1-29.438.1000112.9Q392P385-Q392 HydrophobicContact CB-CG 4.27Å
386I96.2Very high93.8Very high98 Ų9856.3 Ų56.350%0.50333%0.329SS..  trans-121.8-12.3174.165.6173.6000113.2Q373 R375Q373-I386 HydrophobicContact CB-CD1 4.06Å; Q373-I386 HydrophobicContact CB-CG1 4.46Å; Q373-I386 HydrophobicContact CG-CD1 4.09Å; R375-I386 HydrophobicContact CG-CD1 4.49Å; R375-I386 HydrophobicContact CG-CG1 3.92Å
387L96.9Very high93.9Very high25 Ų2559.6 Ų59.613%0.13134%0.344CS..SBendtrans-95.4153.6178.5-68.8175.7000110.8L370 Q373 I391 Q392 L395L370-L387 HydrophobicContact CD1-CD1 4.18Å; L370-L387 HydrophobicContact CD1-CD2 3.79Å; Q373-L387 HydrophobicContact CB-CD1 3.93Å; Q373-L387 HydrophobicContact CB-CD2 3.77Å; Q373-L387 HydrophobicContact CB-CG 3.91Å; L387-I391 HydrophobicContact CD1-CG2 4.34Å; L387-Q392 HydrophobicContact CB-CB 4.22Å; L387-L395 HydrophobicContact CD1-CD1 3.55Å
388E96.9Very high94.2Very high143 Ų14361.8 Ų61.867%0.66835%0.351SS*.  trans-45.9134.8173.8-80.7-60.3147.500112.4G390 I391 Q392E388-G390 PolarHBondContact O-N 2.74Å; E388-I391 HydrophobicContact CB-CB 4.5Å; E388-I391 HydrophobicContact CB-CG1 4.22Å; E388-I391 PolarHBondContact O-N 3.28Å; E388-Q392 PolarHBondContact O-N 2.95Å
389P95.9Very high94.4Very high56 Ų5660.8 Ų60.836%0.36435%0.346SS..Hα-helixtrans-52.8-36-171.7-31.637.3000115.1M212 S393M212-P389 HydrophobicContact CE-CB 3.82Å; M212-P389 HydrophobicContact CE-CG 3.92Å; M212-P389 HydrophobicContact SD-CB 4.3Å; P389-S393 WeakPolarHBondContact O-CB 3.45Å; P389-S393 PolarHBondContact O-N 3.1Å
390G97.6Very high94.8Very high47 Ų4760.7 Ų60.749%0.48534%0.341SS..Hα-helixtrans-65.9-45175.600000112.9E388 S393 C394E388-G390 PolarHBondContact O-N 2.74Å; G390-S393 PolarHBondContact O-N 3.03Å; G390-C394 PolarHBondContact O-N 2.87Å; G390-C394 VanDerWaalsContact O-N 3.15Å; G390-C394 PolarHBondContact O-SG 3.01Å; G390-C394 VanDerWaalsContact O-SG 3.39Å
391I97.6Very high95.4Very high84 Ų8458.6 Ų58.643%0.43133%0.329SS..Hα-helixtrans-69.1-46.6178.9-56.6-57.9000110.3L370 L387 E388 S393 C394 L395L370-I391 HydrophobicContact CD1-CG2 4.45Å; L387-I391 HydrophobicContact CD1-CG2 4.34Å; E388-I391 HydrophobicContact CB-CB 4.5Å; E388-I391 HydrophobicContact CB-CG1 4.22Å; E388-I391 PolarHBondContact O-N 3.28Å; I391-S393 VanDerWaalsContact C-N 3.29Å; I391-S393 PolarHBondContact O-N 3.45Å; I391-C394 PolarHBondContact O-N 3.4Å; I391-L395 HydrophobicContact CG2-CD1 4.01Å; I391-L395 HydrophobicContact CG2-CG 4.44Å; I391-L395 WeakPolarHBondContact O-CG 3.05Å; I391-L395 PolarHBondContact O-N 3.1Å
392Q97.4Very high96Very high12 Ų1256.3 Ų56.36%0.05631%0.313CS..Hα-helixtrans-62.9-35.2176.4-1735969.500111.6D374 T376 P385 L387 E388 T396D374-Q392 PolarHBondContact OD1-NE2 3.2Å; T376-Q392 PolarHBondContact OG1-NE2 2.78Å; P385-Q392 HydrophobicContact CB-CG 4.27Å; L387-Q392 HydrophobicContact CB-CB 4.22Å; E388-Q392 PolarHBondContact O-N 2.95Å; Q392-T396 PolarHBondContact NE2-OG1 2.87Å; Q392-T396 WeakPolarHBondContact O-CB 3.47Å; Q392-T396 PolarHBondContact O-N 3.33Å; Q392-T396 PolarHBondContact O-OG1 1.95Å
393S97.1Very high96.5Very high11 Ų1151.5 Ų51.58%0.07730%0.295CS..Hα-helixtrans-63.4-44.5174.5-173.50000112V208 P389 G390 I391 T396 H397V208-S393 PolarHBondContact O-OG 2.89Å; P389-S393 WeakPolarHBondContact O-CB 3.45Å; P389-S393 PolarHBondContact O-N 3.1Å; G390-S393 PolarHBondContact O-N 3.03Å; I391-S393 VanDerWaalsContact C-N 3.29Å; I391-S393 PolarHBondContact O-N 3.45Å; S393-T396 WeakPolarHBondContact O-CB 3.48Å; S393-T396 PolarHBondContact O-N 3.01Å; S393-H397 PolarHBondContact O-N 3.01Å
394C97.7Very high96.7Very high82 Ų8249.5 Ų49.555%0.55428%0.283SS*.Hα-helixtrans-63.8-45.6176.7-710000112.7G390 I391 H397 F398G390-C394 PolarHBondContact O-N 2.87Å; G390-C394 VanDerWaalsContact O-N 3.15Å; G390-C394 PolarHBondContact O-SG 3.01Å; G390-C394 VanDerWaalsContact O-SG 3.39Å; I391-C394 PolarHBondContact O-N 3.4Å; C394-H397 PolarHBondContact O-N 3.49Å; C394-F398 PolarHBondContact O-N 3.45Å; C394-F398 VanDerWaalsContact O-N 3.11Å
395L97.9Very high97Very high21 Ų2146.1 Ų46.111%0.1126%0.258CS..Hα-helixtrans-64.1-41.1175-66.4174.5000111.3L371 D374 L387 I391 H397 F398 S399L371-L395 HydrophobicContact CD2-CD2 3.77Å; D374-L395 HydrophobicContact CB-CD1 4.23Å; L387-L395 HydrophobicContact CD1-CD1 3.55Å; I391-L395 HydrophobicContact CG2-CD1 4.01Å; I391-L395 HydrophobicContact CG2-CG 4.44Å; I391-L395 WeakPolarHBondContact O-CG 3.05Å; I391-L395 PolarHBondContact O-N 3.1Å; L395-H397 PolarHBondContact O-N 3.36Å; L395-F398 PolarHBondContact O-N 3.39Å; L395-F398 VanDerWaalsContact O-N 3.16Å; L395-S399 WeakPolarHBondContact O-CB 3.27Å; L395-S399 PolarHBondContact O-N 2.9Å; L395-S399 PolarHBondContact O-OG 3.1Å
396T97.3Very high97.2Very high20 Ų2042.7 Ų42.712%0.12324%0.237CC..Hα-helixtrans-56.9-46.6173.4-60.30000111.5T376 Q392 S393 F398 L400T376-T396 HydrophobicContact CG2-CG2 4.25Å; T376-T396 VanDerWaalsContact OG1-CA 3.25Å; T376-T396 WeakPolarHBondContact OG1-CA 3.37Å; T376-T396 PolarHBondContact OG1-N 2.78Å; Q392-T396 PolarHBondContact NE2-OG1 2.87Å; Q392-T396 WeakPolarHBondContact O-CB 3.47Å; Q392-T396 PolarHBondContact O-N 3.33Å; Q392-T396 PolarHBondContact O-OG1 1.95Å; S393-T396 WeakPolarHBondContact O-CB 3.48Å; S393-T396 PolarHBondContact O-N 3.01Å; T396-F398 PolarHBondContact O-N 3.28Å; T396-L400 HydrophobicContact CG2-CD1 3.65Å; T396-L400 HydrophobicContact CG2-CG 4.26Å; T396-L400 VanDerWaalsContact O-CB 3.22Å; T396-L400 WeakPolarHBondContact O-CB 3.42Å; T396-L400 WeakPolarHBondContact O-CD1 3.34Å; T396-L400 WeakPolarHBondContact O-CG 3.33Å; T396-L400 PolarHBondContact O-N 3.24Å
397H97.3Very high97.3Very high79 Ų7938.3 Ų38.337%0.36622%0.216SC..Hα-helixtrans-58-49.7175.7-165.9127.7000111.2L211 S393 C394 L395 L400 I401L211-H397 HydrophobicContact CD1-CB 4.28Å; S393-H397 PolarHBondContact O-N 3.01Å; C394-H397 PolarHBondContact O-N 3.49Å; L395-H397 PolarHBondContact O-N 3.36Å; H397-L400 PolarHBondContact O-N 3.01Å; H397-I401 WeakPolarHBondContact O-CG1 3.35Å; H397-I401 PolarHBondContact O-N 2.91Å
398F97.9Very high97.3Very high69 Ų6940.2 Ų40.230%0.30323%0.23SC..Hα-helixtrans-64.9-48.8-177.3179.3-118.3000113C394 L395 T396 L400 I401 T402 G406 A407 I410C394-F398 PolarHBondContact O-N 3.45Å; C394-F398 VanDerWaalsContact O-N 3.11Å; L395-F398 PolarHBondContact O-N 3.39Å; L395-F398 VanDerWaalsContact O-N 3.16Å; T396-F398 PolarHBondContact O-N 3.28Å; F398-L400 VanDerWaalsContact C-N 3.27Å; F398-L400 PolarHBondContact O-N 3.32Å; F398-I401 WeakPolarHBondContact O-CG1 3.47Å; F398-I401 PolarHBondContact O-N 3.35Å; F398-T402 HydrophobicContact CD2-CG2 4.02Å; F398-T402 HydrophobicContact CE2-CG2 3.72Å; F398-T402 HydrophobicContact CZ-CG2 4.18Å; F398-T402 WeakPolarHBondContact O-CB 3.49Å; F398-T402 WeakPolarHBondContact O-CG2 3.42Å; F398-T402 PolarHBondContact O-N 3.05Å; F398-T402 PolarHBondContact O-OG1 3.36Å; F398-G406 VanDerWaalsContact CE1-C 3.44Å; F398-A407 HydrophobicContact CE1-CB 4.4Å; F398-I410 HydrophobicContact CE1-CD1 3.76Å; F398-I410 HydrophobicContact CZ-CD1 3.7Å
399S97.5Very high97.4Very high4 Ų433.9 Ų33.93%0.02820%0.202CC..Hα-helixtrans-64.3-30.2177.5-73.70000111.9D374 L395 H403 G404D374-S399 PolarHBondContact OD2-OG 3.43Å; L395-S399 WeakPolarHBondContact O-CB 3.27Å; L395-S399 PolarHBondContact O-N 2.9Å; L395-S399 PolarHBondContact O-OG 3.1Å; S399-H403 PolarHBondContact O-N 3Å; S399-H403 VanDerWaalsContact O-N 3.12Å; S399-G404 PolarHBondContact O-N 2.95Å
400L96.9Very high97.5Very high20 Ų2034.1 Ų34.111%0.10520%0.199CC..Hα-helixtrans-73.2-47.5172.5-71.5173000113.6R255 P260 T376 I378 T396 H397 F398 T402 H403R255-L400 HydrophobicContact CB-CD2 4.14Å; R255-L400 VanDerWaalsContact CD-CD2 3.46Å; R255-L400 HydrophobicContact CG-CD2 3.94Å; P260-L400 HydrophobicContact CG-CB 3.78Å; P260-L400 HydrophobicContact CG-CD1 4.38Å; T376-L400 HydrophobicContact CG2-CG 4.32Å; I378-L400 HydrophobicContact CD1-CD2 4.07Å; T396-L400 HydrophobicContact CG2-CD1 3.65Å; T396-L400 HydrophobicContact CG2-CG 4.26Å; T396-L400 VanDerWaalsContact O-CB 3.22Å; T396-L400 WeakPolarHBondContact O-CB 3.42Å; T396-L400 WeakPolarHBondContact O-CD1 3.34Å; T396-L400 WeakPolarHBondContact O-CG 3.33Å; T396-L400 PolarHBondContact O-N 3.24Å; H397-L400 PolarHBondContact O-N 3.01Å; F398-L400 VanDerWaalsContact C-N 3.27Å; F398-L400 PolarHBondContact O-N 3.32Å; L400-T402 PolarHBondContact O-N 2.92Å; L400-H403 PolarHBondContact O-CD2 2.85Å; L400-H403 PolarHBondContact O-N 3.07Å
401I96.7Very high97.5Very high55 Ų5533.1 Ų33.128%0.28219%0.185SC..Hα-helixtrans-72.2-17.6179.765.9175.1000113.7P260 H397 F398 H403P260-I401 HydrophobicContact CB-CG2 3.82Å; P260-I401 HydrophobicContact CG-CG2 3.44Å; P260-I401 VanDerWaalsContact CG-CG2 3.44Å; H397-I401 WeakPolarHBondContact O-CG1 3.35Å; H397-I401 PolarHBondContact O-N 2.91Å; F398-I401 WeakPolarHBondContact O-CG1 3.47Å; F398-I401 PolarHBondContact O-N 3.35Å; I401-H403 PolarHBondContact O-CE1 3.04Å
402T97.4Very high97.6Very high9 Ų929.6 Ų29.66%0.05517%0.168CC..THydrogen-bonded Turntrans-101.42.8173.563.10000113.3L308 F398 L400 G404 F405 G406L308-T402 HydrophobicContact CD1-CG2 3.8Å; F398-T402 HydrophobicContact CD2-CG2 4.02Å; F398-T402 HydrophobicContact CE2-CG2 3.72Å; F398-T402 HydrophobicContact CZ-CG2 4.18Å; F398-T402 WeakPolarHBondContact O-CB 3.49Å; F398-T402 WeakPolarHBondContact O-CG2 3.42Å; F398-T402 PolarHBondContact O-N 3.05Å; F398-T402 PolarHBondContact O-OG1 3.36Å; L400-T402 PolarHBondContact O-N 2.92Å; T402-G404 PolarHBondContact O-N 2.88Å; T402-G404 VanDerWaalsContact O-N 3.11Å; T402-F405 VanDerWaalsContact O-CB 3.3Å; T402-F405 WeakPolarHBondContact O-CB 3.12Å; T402-F405 PolarHBondContact O-N 2.95Å; T402-G406 WeakPolarHBondContact OG1-CA 3.4Å; T402-G406 PolarHBondContact OG1-N 3Å
403H97Very high97.6Very high5 Ų531.4 Ų31.42%0.02319%0.185CC..THydrogen-bonded Turntrans54.430.8177.3-50.190.5000113.9R256 E261 L308 T309 E313 A316 S399 L400 I401R256-H403 PolarHBondContact NH1-NE2 2.76Å; R256-H403 PolarHBondContact NH2-CD2 3.44Å; R256-H403 VanDerWaalsContact NH2-CD2 3.28Å; E261-H403 WeakPolarHBondContact CG-NE2 3.47Å; E261-H403 IonicContact OE1-CE1 3.72Å; E261-H403 PolarHBondContact OE1-CE1 2.77Å; E261-H403 IonicContact OE1-NE2 3.3Å; E261-H403 PolarHBondContact OE1-NE2 3.04Å; E261-H403 IonicContact OE2-CE1 3.05Å; E261-H403 IonicContact OE2-NE2 3.53Å; E261-H403 PolarHBondContact OE2-NE2 3.01Å; L308-H403 PolarHBondContact O-ND1 2.76Å; T309-H403 WeakPolarHBondContact CA-CE1 3.49Å; T309-H403 PolarHBondContact N-CE1 3.07Å; T309-H403 VanDerWaalsContact N-CE1 3.35Å; T309-H403 PolarHBondContact OG1-CE1 3.5Å; E313-H403 HydrophobicContact CG-CB 4.02Å; A316-H403 HydrophobicContact CB-CB 3.84Å; A316-H403 WeakPolarHBondContact CB-O 3.45Å; S399-H403 PolarHBondContact O-N 3Å; S399-H403 VanDerWaalsContact O-N 3.12Å; L400-H403 PolarHBondContact O-CD2 2.85Å; L400-H403 PolarHBondContact O-N 3.07Å; I401-H403 PolarHBondContact O-CE1 3.04Å
404G96.4Very high97.7Very high7 Ų732.1 Ų32.17%0.07219%0.188CC..THydrogen-bonded Turntrans89.5-2.5-176.300000116.1S399 T402 P408S399-G404 PolarHBondContact O-N 2.95Å; T402-G404 PolarHBondContact O-N 2.88Å; T402-G404 VanDerWaalsContact O-N 3.11Å; G404-P408 WeakPolarHBondContact O-CD 3.23Å
405F98.2Very high97.7Very high45 Ų4530.7 Ų30.720%0.19718%0.176CC..  trans-73.9-39.2177.1171.7-96000113.1L308 A316 L319 A320 T402 A409L308-F405 HydrophobicContact CD1-CD1 4.38Å; L308-F405 HydrophobicContact CD2-CD1 4.13Å; L308-F405 HydrophobicContact CD2-CG 4.44Å; A316-F405 HydrophobicContact CB-CB 4.05Å; L319-F405 HydrophobicContact CB-CD2 4.31Å; L319-F405 HydrophobicContact CB-CE2 4.5Å; L319-F405 HydrophobicContact CD2-CD2 4.14Å; L319-F405 HydrophobicContact CD2-CE2 4.02Å; L319-F405 HydrophobicContact CG-CD2 4.1Å; L319-F405 HydrophobicContact CG-CE2 3.85Å; A320-F405 HydrophobicContact CB-CD2 3.7Å; A320-F405 HydrophobicContact CB-CE2 4.27Å; A320-F405 HydrophobicContact CB-CG 4.45Å; T402-F405 VanDerWaalsContact O-CB 3.3Å; T402-F405 WeakPolarHBondContact O-CB 3.12Å; T402-F405 PolarHBondContact O-N 2.95Å; F405-A409 HydrophobicContact CD1-CB 4.12Å; F405-A409 HydrophobicContact CD2-CB 4.37Å; F405-A409 HydrophobicContact CE1-CB 3.64Å; F405-A409 HydrophobicContact CE2-CB 3.9Å; F405-A409 HydrophobicContact CG-CB 4.45Å; F405-A409 HydrophobicContact CZ-CB 3.51Å; F405-A409 VanDerWaalsContact O-CB 3.28Å; F405-A409 WeakPolarHBondContact O-CB 3.48Å; F405-A409 PolarHBondContact O-N 3.13Å
406G97.8Very high97.7Very high5 Ų530 Ų305%0.05217%0.174CC..Hα-helixtrans-62.2-59-159.800000115.1F398 T402 A409 I410F398-G406 VanDerWaalsContact CE1-C 3.44Å; T402-G406 WeakPolarHBondContact OG1-CA 3.4Å; T402-G406 PolarHBondContact OG1-N 3Å; G406-A409 PolarHBondContact O-N 2.95Å; G406-I410 WeakPolarHBondContact O-CG1 3.48Å; G406-I410 PolarHBondContact O-N 2.85Å; G406-I410 VanDerWaalsContact O-N 3.08Å
407A97.5Very high97.7Very high6 Ų632.3 Ų32.35%0.0519%0.185CC..Hα-helixtrans-64.9-45.5-176.400000112.6L371 F398 A409 I410 C411L371-A407 HydrophobicContact CD2-CB 4.34Å; F398-A407 HydrophobicContact CE1-CB 4.4Å; A407-A409 VanDerWaalsContact C-N 3.33Å; A407-A409 PolarHBondContact O-N 3.38Å; A407-I410 PolarHBondContact O-N 2.94Å; A407-C411 PolarHBondContact O-N 2.69Å; A407-C411 PolarHBondContact O-SG 3.45Å
408P97.7Very high97.8Very high65 Ų6529.9 Ų29.942%0.42217%0.174SC..Hα-helixtrans-60.3-36.5174.2-2636.3000114A320 G404 C411 A412A320-P408 HydrophobicContact CB-CB 4.09Å; G404-P408 WeakPolarHBondContact O-CD 3.23Å; P408-C411 PolarHBondContact O-N 3.31Å; P408-A412 WeakPolarHBondContact O-CB 3.33Å; P408-A412 PolarHBondContact O-N 3.2Å
409A98.4Very high97.8Very high10 Ų1029.7 Ų29.78%0.08318%0.176CC..Hα-helixtrans-67.7-35.8175.900000112.8F323 F405 G406 A407 A412 A413F323-A409 HydrophobicContact CD1-CB 4.14Å; F323-A409 HydrophobicContact CE1-CB 4.32Å; F405-A409 HydrophobicContact CD1-CB 4.12Å; F405-A409 HydrophobicContact CD2-CB 4.37Å; F405-A409 HydrophobicContact CE1-CB 3.64Å; F405-A409 HydrophobicContact CE2-CB 3.9Å; F405-A409 HydrophobicContact CG-CB 4.45Å; F405-A409 HydrophobicContact CZ-CB 3.51Å; F405-A409 VanDerWaalsContact O-CB 3.28Å; F405-A409 WeakPolarHBondContact O-CB 3.48Å; F405-A409 PolarHBondContact O-N 3.13Å; G406-A409 PolarHBondContact O-N 2.95Å; A407-A409 VanDerWaalsContact C-N 3.33Å; A407-A409 PolarHBondContact O-N 3.38Å; A409-A412 PolarHBondContact O-N 2.85Å; A409-A413 PolarHBondContact O-N 3.31Å; A409-A413 VanDerWaalsContact O-N 3.15Å
410I98.5Very high97.8Very high61 Ų6130.7 Ų30.731%0.31318%0.179SC..Hα-helixtrans-65-46.2171.4-67.7170.3000110.2F367 L371 F398 G406 A407 A412 A413 L414F367-I410 HydrophobicContact CE1-CG2 3.98Å; L371-I410 HydrophobicContact CD1-CB 4.12Å; L371-I410 HydrophobicContact CD1-CG2 3.59Å; F398-I410 HydrophobicContact CE1-CD1 3.76Å; F398-I410 HydrophobicContact CZ-CD1 3.7Å; G406-I410 WeakPolarHBondContact O-CG1 3.48Å; G406-I410 PolarHBondContact O-N 2.85Å; G406-I410 VanDerWaalsContact O-N 3.08Å; A407-I410 PolarHBondContact O-N 2.94Å; I410-A412 VanDerWaalsContact C-N 3.34Å; I410-A412 PolarHBondContact O-N 3.43Å; I410-A413 PolarHBondContact O-N 3.31Å; I410-L414 HydrophobicContact CG2-CD1 3.75Å; I410-L414 HydrophobicContact CG2-CG 4.34Å; I410-L414 WeakPolarHBondContact O-CG 3.29Å; I410-L414 PolarHBondContact O-N 2.99Å
411C98.3Very high97.9Very high26 Ų2630 Ų3018%0.17618%0.175CC..Hα-helixtrans-58.6-43.1176-63.50000112T368 A407 P408 A413 L414 T415T368-C411 HydrophobicContact CG2-CB 4.25Å; A407-C411 PolarHBondContact O-N 2.69Å; A407-C411 PolarHBondContact O-SG 3.45Å; P408-C411 PolarHBondContact O-N 3.31Å; C411-A413 PolarHBondContact O-N 2.94Å; C411-L414 PolarHBondContact O-N 3.4Å; C411-T415 PolarHBondContact O-N 3.28Å; C411-T415 PolarHBondContact O-OG1 3.02Å; C411-T415 VanDerWaalsContact O-OG1 3.08Å
412A98.4Very high98Very high10 Ų1029 Ų298%0.08317%0.172CC..Hα-helixtrans-57.7-48.3175.600000112.9F323 C327 P408 A409 I410 L414 T415 A416F323-A412 HydrophobicContact CD1-CB 3.92Å; F323-A412 HydrophobicContact CE1-CB 4.01Å; C327-A412 HydrophobicContact CB-CB 4.32Å; P408-A412 WeakPolarHBondContact O-CB 3.33Å; P408-A412 PolarHBondContact O-N 3.2Å; A409-A412 PolarHBondContact O-N 2.85Å; I410-A412 VanDerWaalsContact C-N 3.34Å; I410-A412 PolarHBondContact O-N 3.43Å; A412-L414 VanDerWaalsContact C-N 3.33Å; A412-L414 PolarHBondContact O-N 3.44Å; A412-T415 PolarHBondContact O-N 2.71Å; A412-A416 PolarHBondContact O-N 3.21Å
413A98.4Very high98Very high49 Ų4931 Ų3141%0.40518%0.181SC..Hα-helixtrans-64.2-37.5177.400000112.4A409 I410 C411 A416 L417A409-A413 PolarHBondContact O-N 3.31Å; A409-A413 VanDerWaalsContact O-N 3.15Å; I410-A413 PolarHBondContact O-N 3.31Å; C411-A413 PolarHBondContact O-N 2.94Å; A413-A416 PolarHBondContact O-N 3.27Å; A413-L417 WeakPolarHBondContact O-CB 3.15Å; A413-L417 PolarHBondContact O-N 3.48Å
414L98.4Very high98Very high27 Ų2730.8 Ų30.814%0.14118%0.18CC..Hα-helixtrans-70.8-30174.9-68.9170.9000112.8C364 F367 I410 C411 A412 L417 Q418C364-L414 HydrophobicContact CB-CD2 4.38Å; F367-L414 HydrophobicContact CD1-CD1 3.62Å; F367-L414 HydrophobicContact CE1-CD1 4.08Å; I410-L414 HydrophobicContact CG2-CD1 3.75Å; I410-L414 HydrophobicContact CG2-CG 4.34Å; I410-L414 WeakPolarHBondContact O-CG 3.29Å; I410-L414 PolarHBondContact O-N 2.99Å; C411-L414 PolarHBondContact O-N 3.4Å; A412-L414 VanDerWaalsContact C-N 3.33Å; A412-L414 PolarHBondContact O-N 3.44Å; L414-L417 HydrophobicContact CD2-CD2 4.38Å; L414-Q418 WeakPolarHBondContact O-CB 3.49Å; L414-Q418 VanDerWaalsContact O-CG 3.24Å; L414-Q418 WeakPolarHBondContact O-CG 3.34Å; L414-Q418 PolarHBondContact O-N 2.99Å; L414-Q418 PolarHBondContact O-NE2 3.2Å
415T97.1Very high98Very high52 Ų5231.3 Ų31.332%0.31918%0.181SC..Hα-helixtrans-68.6-45.9171.8-64.50000110.9C411 A412 L417 Q418 N419C411-T415 PolarHBondContact O-N 3.28Å; C411-T415 PolarHBondContact O-OG1 3.02Å; C411-T415 VanDerWaalsContact O-OG1 3.08Å; A412-T415 PolarHBondContact O-N 2.71Å; T415-L417 VanDerWaalsContact C-N 3.29Å; T415-L417 PolarHBondContact O-N 3.45Å; T415-Q418 PolarHBondContact O-N 3.22Å; T415-Q418 VanDerWaalsContact O-N 3.17Å; T415-N419 WeakPolarHBondContact O-CB 3.33Å; T415-N419 VanDerWaalsContact O-CG 3.31Å; T415-N419 PolarHBondContact O-N 2.95Å
416A98.4Very high97.9Very high6 Ų634.1 Ų34.15%0.0519%0.193CC..Hα-helixtrans-57.3-42.2173.300000112.1C327 F331 A412 A413 N419 Y420C327-A416 HydrophobicContact CB-CB 4.19Å; F331-A416 HydrophobicContact CB-CB 4.39Å; F331-A416 HydrophobicContact CD1-CB 3.76Å; F331-A416 HydrophobicContact CE1-CB 4.2Å; F331-A416 HydrophobicContact CG-CB 4.01Å; A412-A416 PolarHBondContact O-N 3.21Å; A413-A416 PolarHBondContact O-N 3.27Å; A416-N419 PolarHBondContact O-N 3.07Å; A416-Y420 PolarHBondContact O-N 3.07Å
417L98.5Very high97.7Very high68 Ų6834.8 Ų34.836%0.35620%0.199SC..Hα-helixtrans-64.4-44.9173.9-178.962.1000112.4A413 L414 T415 N419 Y420 L421A413-L417 WeakPolarHBondContact O-CB 3.15Å; A413-L417 PolarHBondContact O-N 3.48Å; L414-L417 HydrophobicContact CD2-CD2 4.38Å; T415-L417 VanDerWaalsContact C-N 3.29Å; T415-L417 PolarHBondContact O-N 3.45Å; L417-N419 VanDerWaalsContact C-N 3.3Å; L417-N419 PolarHBondContact O-N 3.15Å; L417-Y420 HydrophobicContact CD1-CD1 4Å; L417-Y420 WeakPolarHBondContact O-CB 3.33Å; L417-Y420 PolarHBondContact O-N 3.07Å; L417-L421 HydrophobicContact CG-CD1 4.2Å; L417-L421 VanDerWaalsContact O-CG 3.32Å; L417-L421 WeakPolarHBondContact O-CG 3.21Å; L417-L421 PolarHBondContact O-N 3.4Å
418Q97.9Very high97.4Very high29 Ų2934.6 Ų34.614%0.13620%0.198CC..Hα-helixtrans-64.8-32.8177-77.317587.800112.7K361 C364 L414 T415 L421 T422K361-Q418 HydrophobicContact CG-CG 4.4Å; C364-Q418 HydrophobicContact CB-CG 3.8Å; L414-Q418 WeakPolarHBondContact O-CB 3.49Å; L414-Q418 VanDerWaalsContact O-CG 3.24Å; L414-Q418 WeakPolarHBondContact O-CG 3.34Å; L414-Q418 PolarHBondContact O-N 2.99Å; L414-Q418 PolarHBondContact O-NE2 3.2Å; T415-Q418 PolarHBondContact O-N 3.22Å; T415-Q418 VanDerWaalsContact O-N 3.17Å; Q418-L421 PolarHBondContact O-N 3.33Å; Q418-T422 WeakPolarHBondContact O-CB 3.24Å; Q418-T422 PolarHBondContact O-N 2.99Å; Q418-T422 PolarHBondContact O-OG1 2.92Å
419N98Very high97Very high64 Ų6434.6 Ų34.634%0.34219%0.194SC..Hα-helixtrans-65.5-46.5172.1-72.4-11.8000110.6A333 T415 A416 L417 L421 T422 E423A333-N419 HydrophobicContact CB-CB 4.15Å; T415-N419 WeakPolarHBondContact O-CB 3.33Å; T415-N419 VanDerWaalsContact O-CG 3.31Å; T415-N419 PolarHBondContact O-N 2.95Å; A416-N419 PolarHBondContact O-N 3.07Å; L417-N419 VanDerWaalsContact C-N 3.3Å; L417-N419 PolarHBondContact O-N 3.15Å; N419-L421 PolarHBondContact O-N 3.14Å; N419-T422 WeakPolarHBondContact O-CB 3.45Å; N419-T422 PolarHBondContact O-N 2.93Å; N419-E423 PolarHBondContact O-N 3.34Å
420Y98.4Very high96.5Very high26 Ų2640.6 Ų40.610%0.10222%0.218CC..Hα-helixtrans-57.5-47.6171.8155.6-93.8000112.4V336 L340 A416 L417 T422 E423 A424V336-Y420 HydrophobicContact CB-CD2 4.14Å; V336-Y420 HydrophobicContact CB-CE2 4.5Å; V336-Y420 HydrophobicContact CG1-CD2 3.83Å; V336-Y420 HydrophobicContact CG1-CE2 3.86Å; L340-Y420 HydrophobicContact CD1-CE2 3.9Å; L340-Y420 WeakPolarHBondContact CD1-OH 3.36Å; A416-Y420 PolarHBondContact O-N 3.07Å; L417-Y420 HydrophobicContact CD1-CD1 4Å; L417-Y420 WeakPolarHBondContact O-CB 3.33Å; L417-Y420 PolarHBondContact O-N 3.07Å; Y420-T422 PolarHBondContact O-N 3.38Å; Y420-E423 PolarHBondContact O-N 3.2Å; Y420-A424 WeakPolarHBondContact O-CB 3.34Å; Y420-A424 PolarHBondContact O-N 2.7Å
421L98.3Very high95.9Very high5 Ų539.9 Ų39.93%0.02621%0.214CC..Hα-helixtrans-61.5-33.1178.4-68.4169.7000111.5L357 T360 K361 L417 Q418 N419 L425L357-L421 HydrophobicContact CD2-CD2 3.62Å; T360-L421 HydrophobicContact CG2-CD1 3.88Å; T360-L421 HydrophobicContact CG2-CD2 4.35Å; K361-L421 HydrophobicContact CB-CB 4.3Å; K361-L421 HydrophobicContact CB-CD1 3.94Å; L417-L421 HydrophobicContact CG-CD1 4.2Å; L417-L421 VanDerWaalsContact O-CG 3.32Å; L417-L421 WeakPolarHBondContact O-CG 3.21Å; L417-L421 PolarHBondContact O-N 3.4Å; Q418-L421 PolarHBondContact O-N 3.33Å; N419-L421 PolarHBondContact O-N 3.14Å; L421-L425 WeakPolarHBondContact O-CB 3.44Å; L421-L425 WeakPolarHBondContact O-CD1 3.18Å; L421-L425 VanDerWaalsContact O-CG 3.25Å; L421-L425 WeakPolarHBondContact O-CG 3.43Å; L421-L425 PolarHBondContact O-N 3.34Å
422T98.1Very high95.1Very high35 Ų3541.8 Ų41.822%0.21522%0.219CC..Hα-helixtrans-71.8-42.8177.5-57.60000112.1K361 Q418 N419 Y420 L425 K426K361-T422 PolarHBondContact NZ-OG1 2.93Å; Q418-T422 WeakPolarHBondContact O-CB 3.24Å; Q418-T422 PolarHBondContact O-N 2.99Å; Q418-T422 PolarHBondContact O-OG1 2.92Å; N419-T422 WeakPolarHBondContact O-CB 3.45Å; N419-T422 PolarHBondContact O-N 2.93Å; Y420-T422 PolarHBondContact O-N 3.38Å; T422-L425 PolarHBondContact O-N 3.3Å; T422-K426 WeakPolarHBondContact O-CG 3.39Å; T422-K426 PolarHBondContact O-N 2.97Å; T422-K426 VanDerWaalsContact O-N 3.09Å
423E97.9Very high94.3Very high50 Ų5047.2 Ų47.223%0.23425%0.247CC..Hα-helixtrans-68.1-36.2173.1-64.8-57122.600112K334 S337 N419 Y420 L425 K426 G427K334-E423 HydrophobicContact CB-CB 4.47Å; K334-E423 HydrophobicContact CB-CG 4.04Å; S337-E423 VanDerWaalsContact OG-CB 3.23Å; S337-E423 WeakPolarHBondContact OG-CB 3.39Å; N419-E423 PolarHBondContact O-N 3.34Å; Y420-E423 PolarHBondContact O-N 3.2Å; E423-L425 PolarHBondContact O-N 2.99Å; E423-K426 PolarHBondContact O-N 3.16Å; E423-K426 WeakPolarHBondContact OE1-CD 3.41Å; E423-K426 WeakPolarHBondContact OE1-CE 3.42Å; E423-K426 IonicContact OE1-NZ 3.9Å; E423-K426 PolarHBondContact OE1-NZ 3.2Å; E423-G427 PolarHBondContact O-N 3.27Å
424A97.5Very high93.3Very high0 Ų050 Ų500%025%0.254CS..Hα-helixtrans-60.4-46.117400000111.6N341 L357 Y420 G427 M428N341-A424 PolarHBondContact ND2-O 2.8Å; L357-A424 HydrophobicContact CD1-CB 3.81Å; L357-A424 HydrophobicContact CD2-CB 4.42Å; Y420-A424 WeakPolarHBondContact O-CB 3.34Å; Y420-A424 PolarHBondContact O-N 2.7Å; A424-G427 WeakPolarHBondContact O-CA 3.46Å; A424-G427 PolarHBondContact O-N 3.37Å; A424-G427 VanDerWaalsContact O-N 3.14Å; A424-M428 WeakPolarHBondContact O-CG 3.38Å; A424-M428 PolarHBondContact O-N 2.93Å
425L96.9Very high91.9Very high18 Ų1851.6 Ų51.69%0.09426%0.263CS..Hα-helixtrans-60.9-45.6174.5-73.3165.1000112.2K354 L357 L358 K361 L421 T422 E423 G427 M428 D429K354-L425 HydrophobicContact CG-CD2 3.89Å; L357-L425 HydrophobicContact CB-CD2 3.8Å; L357-L425 HydrophobicContact CB-CG 4.08Å; L357-L425 HydrophobicContact CD1-CD2 4.15Å; L357-L425 HydrophobicContact CD1-CG 4.27Å; L358-L425 HydrophobicContact CD2-CD1 3.74Å; L358-L425 HydrophobicContact CD2-CD2 4.09Å; L358-L425 HydrophobicContact CG-CD1 4.36Å; L358-L425 HydrophobicContact CG-CD2 3.96Å; K361-L425 HydrophobicContact CD-CD1 4.45Å; L421-L425 WeakPolarHBondContact O-CB 3.44Å; L421-L425 WeakPolarHBondContact O-CD1 3.18Å; L421-L425 VanDerWaalsContact O-CG 3.25Å; L421-L425 WeakPolarHBondContact O-CG 3.43Å; L421-L425 PolarHBondContact O-N 3.34Å; T422-L425 PolarHBondContact O-N 3.3Å; E423-L425 PolarHBondContact O-N 2.99Å; L425-G427 PolarHBondContact O-N 2.96Å; L425-M428 PolarHBondContact O-N 3.47Å; L425-M428 VanDerWaalsContact O-N 3.09Å; L425-D429 PolarHBondContact O-N 3.22Å
426K95.9Very high90.2Very high105 Ų10554.6 Ų54.646%0.45728%0.278SS..Hα-helixtrans-58-33.5173.4-71.1170.7-176.8173.90112.7T422 E423 K430T422-K426 WeakPolarHBondContact O-CG 3.39Å; T422-K426 PolarHBondContact O-N 2.97Å; T422-K426 VanDerWaalsContact O-N 3.09Å; E423-K426 PolarHBondContact O-N 3.16Å; E423-K426 WeakPolarHBondContact OE1-CD 3.41Å; E423-K426 WeakPolarHBondContact OE1-CE 3.42Å; E423-K426 IonicContact OE1-NZ 3.9Å; E423-K426 PolarHBondContact OE1-NZ 3.2Å; K426-K430 WeakPolarHBondContact O-CG 3.49Å
427G93.2Very high88.5Confident18 Ų1858.2 Ų58.219%0.18630%0.299CS..Hα-helixtrans-69.3-44.8173.500000112.5E423 A424 L425 D429 K430 M431E423-G427 PolarHBondContact O-N 3.27Å; A424-G427 WeakPolarHBondContact O-CA 3.46Å; A424-G427 PolarHBondContact O-N 3.37Å; A424-G427 VanDerWaalsContact O-N 3.14Å; L425-G427 PolarHBondContact O-N 2.96Å; G427-D429 PolarHBondContact O-N 2.97Å; G427-K430 PolarHBondContact O-N 3.02Å; G427-M431 WeakPolarHBondContact O-CG 3.49Å; G427-M431 PolarHBondContact O-N 2.89Å
428M90.6Very high86.5Confident3 Ų357.9 Ų57.92%0.01531%0.306CS..Hα-helixtrans-62.1-41.3178-66.3-155.769.500112.7L350 R353 K354 L357 A424 L425 K430 M431 F432L350-M428 HydrophobicContact CB-CE 4.15Å; L350-M428 HydrophobicContact CD2-CE 3.87Å; L350-M428 WeakPolarHBondContact O-CE 3.44Å; R353-M428 HydrophobicContact CB-CE 3.94Å; R353-M428 HydrophobicContact CB-SD 4.38Å; R353-M428 HydrophobicContact CG-CE 4.05Å; R353-M428 HydrophobicContact CG-SD 4.03Å; K354-M428 HydrophobicContact CB-CE 4.07Å; K354-M428 HydrophobicContact CB-SD 3.98Å; L357-M428 HydrophobicContact CD1-CG 4.22Å; L357-M428 HydrophobicContact CD1-SD 3.59Å; L357-M428 VanDerWaalsContact CD1-SD 3.59Å; A424-M428 WeakPolarHBondContact O-CG 3.38Å; A424-M428 PolarHBondContact O-N 2.93Å; L425-M428 PolarHBondContact O-N 3.47Å; L425-M428 VanDerWaalsContact O-N 3.09Å; M428-K430 VanDerWaalsContact C-N 3.27Å; M428-K430 PolarHBondContact O-N 2.95Å; M428-M431 WeakPolarHBondContact O-CA 3.17Å; M428-M431 WeakPolarHBondContact O-CB 3.48Å; M428-M431 PolarHBondContact O-N 3.45Å; M428-F432 HydrophobicContact CE-CE2 4.4Å; M428-F432 WeakPolarHBondContact O-CD2 3.37Å; M428-F432 PolarHBondContact O-N 3.11Å
429D89.9Confident84.4Confident64 Ų6462.1 Ų62.134%0.34233%0.33SS..Hα-helixtrans-61.1-36.5179.6-72.3-30.9000112.2K354 L425 G427 M431 F432 L433K354-D429 IonicContact NZ-OD1 2.7Å; K354-D429 PolarHBondContact NZ-OD1 3.21Å; K354-D429 IonicContact NZ-OD2 3.42Å; L425-D429 PolarHBondContact O-N 3.22Å; G427-D429 PolarHBondContact O-N 2.97Å; D429-M431 VanDerWaalsContact C-N 3.32Å; D429-M431 PolarHBondContact O-N 2.96Å; D429-F432 PolarHBondContact O-N 3.43Å; D429-L433 VanDerWaalsContact O-CD1 3.28Å; D429-L433 WeakPolarHBondContact O-CD1 3.48Å; D429-L433 PolarHBondContact O-N 3.38Å
430K88.4Confident82.2Confident137 Ų13769 Ų6960%0.59635%0.351SS*.Hα-helixtrans-62.9-38.1172.4-65169.2-174.9176.10112.2K426 G427 M428 L433 N434K426-K430 WeakPolarHBondContact O-CG 3.49Å; G427-K430 PolarHBondContact O-N 3.02Å; M428-K430 VanDerWaalsContact C-N 3.27Å; M428-K430 PolarHBondContact O-N 2.95Å; K430-L433 PolarHBondContact O-N 3.21Å; K430-N434 WeakPolarHBondContact O-CB 3.11Å; K430-N434 PolarHBondContact O-N 2.89Å
431M85.9Confident79.9Confident46 Ų4676.1 Ų76.123%0.22739%0.385CS..Hα-helixtrans-69-39.6179.1-61.9170.571.800111.4H344 T345 L350 G427 M428 D429 N434 N435H344-M431 VanDerWaalsContact O-CE 3.26Å; H344-M431 WeakPolarHBondContact O-CE 3.48Å; T345-M431 HydrophobicContact CG2-CE 3.98Å; L350-M431 HydrophobicContact CD1-CB 4.38Å; L350-M431 HydrophobicContact CD2-CE 4.14Å; G427-M431 WeakPolarHBondContact O-CG 3.49Å; G427-M431 PolarHBondContact O-N 2.89Å; M428-M431 WeakPolarHBondContact O-CA 3.17Å; M428-M431 WeakPolarHBondContact O-CB 3.48Å; M428-M431 PolarHBondContact O-N 3.45Å; D429-M431 VanDerWaalsContact C-N 3.32Å; D429-M431 PolarHBondContact O-N 2.96Å; M431-N434 PolarHBondContact O-N 3.34Å; M431-N435 PolarHBondContact O-N 3.36Å
432F82Confident77.4Confident65 Ų6580.9 Ų80.929%0.28541%0.414SS..Hα-helixtrans-60.1-47171.4-82.3-70.6000112.4L350 H351 K354 M428 D429 N434 N436L350-F432 HydrophobicContact CB-CE1 3.88Å; L350-F432 HydrophobicContact CB-CE2 4.03Å; L350-F432 HydrophobicContact CB-CZ 3.51Å; L350-F432 HydrophobicContact CD1-CD1 4.49Å; L350-F432 HydrophobicContact CD1-CE1 4.43Å; H351-F432 HydrophobicContact CB-CZ 4.44Å; K354-F432 HydrophobicContact CB-CE2 4.29Å; K354-F432 HydrophobicContact CD-CE2 3.91Å; M428-F432 HydrophobicContact CE-CE2 4.4Å; M428-F432 WeakPolarHBondContact O-CD2 3.37Å; M428-F432 PolarHBondContact O-N 3.11Å; D429-F432 PolarHBondContact O-N 3.43Å; F432-N434 PolarHBondContact O-N 3.32Å; F432-N436 WeakPolarHBondContact O-CB 3.41Å; F432-N436 PolarHBondContact O-N 3.28Å
433L80.4Confident74.9Confident125 Ų12584.4 Ų84.465%0.65444%0.44SS*.Hα-helixtrans-59.6-46.6176.3-9469.3000111.3D429 K430 N436 T437D429-L433 VanDerWaalsContact O-CD1 3.28Å; D429-L433 WeakPolarHBondContact O-CD1 3.48Å; D429-L433 PolarHBondContact O-N 3.38Å; K430-L433 PolarHBondContact O-N 3.21Å; L433-N436 PolarHBondContact O-N 2.95Å; L433-T437 PolarHBondContact O-N 3.4Å; L433-T437 PolarHBondContact O-OG1 3.31Å
434N77.8Confident72.5Confident106 Ų10685.5 Ų85.557%0.56747%0.465SS*.Hα-helixtrans-64.7-41.4-176.3-166.783.1000113.2K430 M431 F432 N436 T437 A438K430-N434 WeakPolarHBondContact O-CB 3.11Å; K430-N434 PolarHBondContact O-N 2.89Å; M431-N434 PolarHBondContact O-N 3.34Å; F432-N434 PolarHBondContact O-N 3.32Å; N434-N436 VanDerWaalsContact C-N 3.34Å; N434-T437 WeakPolarHBondContact CA-OG1 3.26Å; N434-T437 PolarHBondContact O-N 3.17Å; N434-T437 PolarHBondContact O-OG1 3.22Å; N434-A438 PolarHBondContact O-N 3.17Å
435N68.6Low69.8Low62 Ų6295.1 Ų95.133%0.33251%0.51SS..Hα-helixtrans-63.8-39.6174-80.2-4000111.8M431 T437 A438 N439M431-N435 PolarHBondContact O-N 3.36Å; N435-T437 VanDerWaalsContact C-N 3.32Å; N435-T437 PolarHBondContact O-N 3.12Å; N435-A438 PolarHBondContact O-N 3.29Å; N435-N439 PolarHBondContact O-N 3.43Å; N435-N439 VanDerWaalsContact O-N 3.09Å
436N62.4Low66.8Low115 Ų11597.3 Ų97.362%0.61554%0.536SS*.Hα-helixtrans-71.4-26.6-178.5-148.46.7000112.5F432 L433 N434F432-N436 WeakPolarHBondContact O-CB 3.41Å; F432-N436 PolarHBondContact O-N 3.28Å; L433-N436 PolarHBondContact O-N 2.95Å; N434-N436 VanDerWaalsContact C-N 3.34Å
437T61.1Low64.5Low82 Ų8299 Ų9950%0.50356%0.559SS.*Hα-helixtrans-76.2-39168.843.30000113.1L433 N434 N435 N439 R440L433-T437 PolarHBondContact O-N 3.4Å; L433-T437 PolarHBondContact O-OG1 3.31Å; N434-T437 WeakPolarHBondContact CA-OG1 3.26Å; N434-T437 PolarHBondContact O-N 3.17Å; N434-T437 PolarHBondContact O-OG1 3.22Å; N435-T437 VanDerWaalsContact C-N 3.32Å; N435-T437 PolarHBondContact O-N 3.12Å; T437-N439 VanDerWaalsContact C-N 3.33Å; T437-N439 PolarHBondContact O-N 3.15Å; T437-R440 PolarHBondContact O-N 3.47Å
438A57.8Low61.8Low60 Ų60101.8 Ų101.850%0.49659%0.587SS.*Hα-helixtrans-61-42.9177.400000111.6N434 N435 R440 H441N434-A438 PolarHBondContact O-N 3.17Å; N435-A438 PolarHBondContact O-N 3.29Å; A438-R440 PolarHBondContact O-N 3.19Å; A438-R440 VanDerWaalsContact O-N 3.11Å; A438-H441 PolarHBondContact O-N 3.23Å
439N53.1Low59.5Low119 Ų119107.1 Ų107.164%0.63662%0.624SS**THydrogen-bonded Turntrans-73.51.5-179.1-150.938.2000114.5N435 T437N435-N439 PolarHBondContact O-N 3.43Å; N435-N439 VanDerWaalsContact O-N 3.09Å; T437-N439 VanDerWaalsContact C-N 3.33Å; T437-N439 PolarHBondContact O-N 3.15Å
440R51.8Low57Low207 Ų207113.7 Ų113.778%0.78165%0.65SS**THydrogen-bonded Turntrans-96.7-15.8174.4-86.1-176.7159.5-163.8-6.4114.4T437 A438T437-R440 PolarHBondContact O-N 3.47Å; A438-R440 PolarHBondContact O-N 3.19Å; A438-R440 VanDerWaalsContact O-N 3.11Å
441H50.2Low54.5Low177 Ų177113.9 Ų113.982%0.81966%0.663SS**SBendtrans-89.5-2.4-179.2-86.3-82.2000114.6A438A438-H441 PolarHBondContact O-N 3.23Å
442T46.8Very low52Low104 Ų104115.1 Ų115.164%0.63869%0.687SS**SBendtrans-99.5-4.8-175.951.70000114.5
443S45Very low50.1Low110 Ų110119.6 Ų119.677%0.76971%0.714SS**SBendtrans-11062.3-176.8-63.90000111.4
444G47.1Very low48.3Very low73 Ų73123.8 Ų123.875%0.75373%0.727SS**SBendtrans-159.3-9-171.100000119.3
445E41.2Very low46.6Very low202 Ų202127.3 Ų127.394%0.94474%0.74SS**  trans-140.7105.8-177.1-113.2167.3-166.300112.8
446G34.5Very low45.3Very low63 Ų63131.1 Ų131.165%0.64976%0.756SS**  trans-107.3150.2164.500000110.1G448G446-G448 PolarHBondContact O-N 3.43Å
447P47.4Very low44.3Very low142 Ų142133.3 Ų133.392%0.92276%0.76SS**  trans-74.186.8-16629.2-36.2000113.7S449P447-S449 PolarHBondContact O-N 3.43Å
448G36.5Very low43.6Very low76 Ų76137.8 Ų137.878%0.78478%0.775SS**  trans-83.480.1176.100000113.5G446 K450G446-G448 PolarHBondContact O-N 3.43Å; G448-K450 PolarHBondContact O-N 3.2Å
449S41.2Very low43Very low114 Ų114146.1 Ų146.180%0.79779%0.793SS**  trans-63.9121.7171.8179.30000111.8P447P447-S449 PolarHBondContact O-N 3.43Å
450K37.8Very low42.6Very low203 Ų203153 Ų15388%0.88382%0.818SS**  trans-161.4109.1156-115.1163.6-171.9174.50113G448G448-K450 PolarHBondContact O-N 3.2Å
451T35.4Very low42.2Very low141 Ų141150.3 Ų150.387%0.86582%0.819SS**  trans-72.7160.6153.144.20000110.1
452G34.4Very low41.7Very low72 Ų72148.8 Ų148.874%0.74282%0.819SS**  trans148.6120.6169.400000113.7
453D42.4Very low41.4Very low159 Ų159151.3 Ų151.385%0.8583%0.829SS**  trans-64.8160.2-174.3-51.9-85.8000115.2
454K41.7Very low41.2Very low213 Ų213153.8 Ų153.893%0.92683%0.833SS**  trans-153.2113.3145.3-116169.7-171.4178.50111.8
455E42.3Very low40.9Very low179 Ų179158.8 Ų158.884%0.83684%0.838SS**  trans-100.1157.9175.5-164.9179-164.900110.5
456E40.5Very low40.9Very low143 Ų143155.9 Ų155.967%0.66883%0.831SS**  trans63.7158.6175.5-71.6-151.111300117.2
457K42.3Very low41.3Very low161 Ų161162.6 Ų162.670%0.784%0.844SS**  cis-148.8152.613.5-147159.7-178.876.70113.8
458H45.9Very low40.8Very low175 Ų175164.2 Ų164.281%0.8184%0.838SS**  trans-29.7133170.1-87.1-151.3000119.3
459R44.9Very low41.2Very low235 Ų235171.5 Ų171.589%0.88784%0.842SS**  169.7157113.7-98.9175.8166.9158.8-2.9110.3
460K45.7Very low41.2Very low263 Ų263176.7 Ų176.7100%1.14385%0.846SS**  cis-142.2013.5-163.5-176.5-179.6-173.80111.4

Retrieved 460 of 460 residues in 1174.4 ms (Link to these results)