A0A096LW02_POEFO Loading...

GPALPP motifs-containing protein 1

AlphaFold DB , UniProt , Accession A0A096LW02, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 348 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M39.3Very low57.3Low244 Ų244140.5 Ų140.5100%1.20282%0.818SS**  098.20-71.3-163.1164.900107.3
2S43.4Very low58.8Low121 Ų121134.7 Ų134.785%0.84679%0.788SS**  trans-116.8110.7179.2-58.80000106.9
3S46Very low59.4Low105 Ų105132.8 Ų132.873%0.73478%0.783SS**  trans-93103.2-178.739.40000109.5K5S3-K5 PolarHBondContact O-N 3.48Å; S3-K5 VanDerWaalsContact O-N 3.11Å
4D51.6Low59.5Low156 Ų156135.9 Ų135.983%0.83479%0.788SS**  trans-68.4104166.2-76.9-30.5000108.8L6D4-L6 PolarHBondContact O-N 3.41Å; D4-L6 VanDerWaalsContact O-N 3.17Å
5K57.6Low59.7Low181 Ų181136.2 Ų136.279%0.78778%0.777SS**  trans-73.4102.6170.5-86.9165.8177171.10108.5S3 I7S3-K5 PolarHBondContact O-N 3.48Å; S3-K5 VanDerWaalsContact O-N 3.11Å; K5-I7 PolarHBondContact O-N 3.17Å
6L61.8Low60Low172 Ų172138.6 Ų138.690%0.90177%0.77SS**  trans-61.4103.9167.5-71.8158000109.1D4D4-L6 PolarHBondContact O-N 3.41Å; D4-L6 VanDerWaalsContact O-N 3.17Å
7I50.6Low60.1Low165 Ų165142.6 Ų142.685%0.84678%0.777SS**  trans-81.5111.3167.6-113.372.3000107.1K5K5-I7 PolarHBondContact O-N 3.17Å
8G68.8Low59Low60 Ų60142.7 Ų142.762%0.61978%0.777SS**SBendtrans154.5159176.900000113.2
9P73.7Confident58.5Low128 Ų128139.8 Ų139.883%0.83178%0.783SS**PPolyproline II helixtrans-62141.9174.727.6-33.7000110.5L11P9-L11 PolarHBondContact O-N 3.12Å
10A70.6Confident57.4Low92 Ų92138.1 Ų138.176%0.7678%0.781SS**PPolyproline II helixtrans-61.8127.3-177.100000111.3
11L66.9Low56.8Low121 Ų121140.8 Ų140.863%0.63479%0.787SS**PPolyproline II helixtrans-66.4143175.5-76.8161.8000111P9P9-L11 PolarHBondContact O-N 3.12Å
12P75.9Confident56.7Low71 Ų71134.1 Ų134.146%0.46177%0.765SS.*PPolyproline II helixtrans-61.8150.1177.514.3-16.8000111.4M14 F15P12-M14 PolarHBondContact O-N 3.03Å; P12-F15 HydrophobicContact CB-CD2 4.43Å; P12-F15 HydrophobicContact CG-CD2 3.74Å; P12-F15 HydrophobicContact CG-CE2 3.97Å; P12-F15 PolarHBondContact O-N 3.33Å
13P66Low56.4Low111 Ų111135.8 Ų135.872%0.72176%0.764SS**G310 helixtrans-58.1-22.3-166.119.1-31.2000114.9F15P13-F15 VanDerWaalsContact C-N 3.26Å; P13-F15 PolarHBondContact O-N 3.33Å
14M61.1Low56.5Low175 Ų175140.2 Ų140.286%0.86277%0.773SS**G310 helixtrans-75.5-8.3179.5-54.3-142.1-50.300114.7P12P12-M14 PolarHBondContact O-N 3.03Å
15F62.8Low55.9Low141 Ų141137.6 Ų137.662%0.61877%0.767SS**G310 helixtrans-104.99.4-178.7-66.3-84.6000113.6P12 P13 K17P12-F15 HydrophobicContact CB-CD2 4.43Å; P12-F15 HydrophobicContact CG-CD2 3.74Å; P12-F15 HydrophobicContact CG-CE2 3.97Å; P12-F15 PolarHBondContact O-N 3.33Å; P13-F15 VanDerWaalsContact C-N 3.26Å; P13-F15 PolarHBondContact O-N 3.33Å; F15-K17 PolarHBondContact O-N 3.16Å; F15-K17 VanDerWaalsContact O-N 3.16Å
16R64.3Low55.7Low175 Ų175137.9 Ų137.966%0.6677%0.771SS**  trans-78.899.4171-62.6-174.8-177.8-92-3.3107.3D18R16-D18 PolarHBondContact O-N 3.24Å
17K61.7Low55.2Low206 Ų206135.3 Ų135.390%0.89676%0.758SS**  trans-81.3101.2176.7-164.1165.5-176.9171.40107.9F15F15-K17 PolarHBondContact O-N 3.16Å; F15-K17 VanDerWaalsContact O-N 3.16Å
18D40Very low55.2Low145 Ų145135.4 Ų135.478%0.77576%0.761SS**  trans-66.8130.3167.3-67.3-40000108.4R16 S20R16-D18 PolarHBondContact O-N 3.24Å; D18-S20 PolarHBondContact O-N 3.1Å
19G49.8Very low54.6Low87 Ų87140.5 Ų140.590%0.89777%0.766SS**  trans-72.3113.117800000110.7
20S36Very low53.7Low106 Ų106139.5 Ų139.574%0.74177%0.769SS**  trans-141.9127.6153.964.90000109.7D18 S22D18-S20 PolarHBondContact O-N 3.1Å; S20-S22 PolarHBondContact O-N 3.05Å
21E45.8Very low53.6Low195 Ų195137 Ų13791%0.91175%0.752SS**  trans-57.5123.4169.4-62.8167.412500109.4
22S36Very low53.9Low104 Ų104137.5 Ų137.573%0.72776%0.762SS**  trans-168.6113.1162.8-79.20000111S20S20-S22 PolarHBondContact O-N 3.05Å
23D37.3Very low53.8Low156 Ų156139 Ų13983%0.83478%0.781SS**  trans39.4117.3149.5-58.8-55.9000121S25D23-S25 PolarHBondContact O-N 3.45Å
24E47.9Very low54.2Low198 Ų198139.4 Ų139.493%0.92578%0.776SS**  trans-65.997.6167.2-59.4-160.1146.400110.8
25S40.4Very low55.1Low101 Ų101134.5 Ų134.571%0.70676%0.758SS**  trans-97.7103.4157.7173.50000108.1D23 N27D23-S25 PolarHBondContact O-N 3.45Å; S25-N27 PolarHBondContact O-N 3.35Å
26E51.8Low55.6Low186 Ų186134.3 Ų134.387%0.86977%0.77SS**THydrogen-bonded Turntrans-6373.7170.9-71.8179.4131.800110.9
27N51.4Low55.6Low118 Ų118129.9 Ų129.963%0.63178%0.78SS**THydrogen-bonded Turntrans-153.24.5167-129.922.4000117.1S25 F29S25-N27 PolarHBondContact O-N 3.35Å; N27-F29 VanDerWaalsContact C-N 3.29Å; N27-F29 PolarHBondContact O-N 3.03Å
28D51.7Low55.8Low168 Ų168128.1 Ų128.190%0.89877%0.768SS**  trans-85.473.3173-78.1-18.3000111.1A30D28-A30 PolarHBondContact O-N 2.77Å; D28-A30 VanDerWaalsContact O-N 3.15Å
29F55.9Low57.4Low166 Ų166131 Ų13173%0.72877%0.774SS**  trans-7598.5168.8-173.9-98.7000109.5N27 G31N27-F29 VanDerWaalsContact C-N 3.29Å; N27-F29 PolarHBondContact O-N 3.03Å; F29-G31 PolarHBondContact O-N 3.43Å
30A55Low58.1Low108 Ų108135.6 Ų135.689%0.89376%0.764SS**  trans-68.892.4174.700000110.9D28D28-A30 PolarHBondContact O-N 2.77Å; D28-A30 VanDerWaalsContact O-N 3.15Å
31G68.3Low58.9Low40 Ų40134 Ų13441%0.41276%0.764SS.*SBendtrans-150.2162.6174.600000111.8F29F29-G31 PolarHBondContact O-N 3.43Å
32P72.1Confident59.3Low130 Ų130133.2 Ų133.284%0.84476%0.76SS**PPolyproline II helixtrans-59.9140.9177.626.3-34000110.8
33A75.4Confident59.7Low102 Ų102134.6 Ų134.684%0.84377%0.767SS**PPolyproline II helixtrans-59.8137-179.800000111.6
34L74.2Confident59.7Low120 Ų120132.9 Ų132.963%0.62877%0.767SS**PPolyproline II helixtrans-73148.3176.8-71.3170.5000111.2
35P79.3Confident59.6Low73 Ų73129.4 Ų129.447%0.47477%0.765SS.*PPolyproline II helixtrans-64.8155.4176.325.7-32.2000111.9G37 Y38P35-G37 PolarHBondContact O-N 2.83Å; P35-Y38 HydrophobicContact CB-CD2 4.5Å; P35-Y38 HydrophobicContact CG-CD2 3.71Å; P35-Y38 HydrophobicContact CG-CE2 3.89Å; P35-Y38 HydrophobicContact CG-CG 4.46Å; P35-Y38 PolarHBondContact O-N 3.22Å
36P72.9Confident59.5Low136 Ų136129.8 Ų129.888%0.88377%0.768SS**THydrogen-bonded Turntrans-55.4131.1179.7-21.431.2000111.8
37G65.8Low59.2Low83 Ų83126.5 Ų126.586%0.85677%0.765SS**THydrogen-bonded Turntrans103.4-6.4177.200000115.9P35P35-G37 PolarHBondContact O-N 2.83Å
38Y64.8Low58.6Low168 Ų168127.9 Ų127.966%0.65977%0.773SS**  trans-95.9119.3175.8-73.9-103.1000110.7P35P35-Y38 HydrophobicContact CB-CD2 4.5Å; P35-Y38 HydrophobicContact CG-CD2 3.71Å; P35-Y38 HydrophobicContact CG-CE2 3.89Å; P35-Y38 HydrophobicContact CG-CG 4.46Å; P35-Y38 PolarHBondContact O-N 3.22Å
39K73.2Confident58.4Low205 Ų205128.7 Ų128.789%0.89177%0.771SS**  trans-104137.6170.9-63-159.2179.5-168.70110.2
40R65.8Low57.7Low185 Ų185125.6 Ų125.670%0.69877%0.77SS**PPolyproline II helixtrans-71.8125.6174.9-170.1-178.7-170.3-154.52.6108.6
41G52.6Low57.2Low71 Ų71129.8 Ų129.873%0.73277%0.771SS**PPolyproline II helixtrans-68.6134173.100000110.7
42E53.9Low55.9Low179 Ų179133.1 Ų133.184%0.83679%0.785SS**PPolyproline II helixtrans-79.5143.7178.3-46.9-166176.900110S44E42-S44 PolarHBondContact O-N 2.76Å
43P43.8Very low54.4Low134 Ų134135.7 Ų135.787%0.8779%0.786SS**  trans-79.692-179.632.5-31.8000109.8S45P43-S45 PolarHBondContact O-N 2.7Å
44S37.3Very low52.7Low119 Ų119136.4 Ų136.483%0.83278%0.78SS**  trans-77.5110166.1-92.60000110.4E42 S46E42-S44 PolarHBondContact O-N 2.76Å; S44-S46 PolarHBondContact O-N 2.79Å
45S46.8Very low50.9Low125 Ų125135.5 Ų135.587%0.87478%0.779SS**  trans-68.2108.8160.9-179.50000109.1P43P43-S45 PolarHBondContact O-N 2.7Å
46S37.8Very low48.9Very low110 Ų110141.4 Ų141.477%0.76980%0.798SS**  trans-163.6121.8158.7-176.50000110S44S44-S46 PolarHBondContact O-N 2.79Å
47S44.3Very low47.4Very low117 Ų117144.1 Ų144.182%0.81880%0.796SS**  trans-65.1121.7170-177.30000110.7
48D39.1Very low46.3Very low147 Ų147150.4 Ų150.479%0.78679%0.794SS**  trans-165137148.8-148.8-124.7000110.8S50D48-S50 PolarHBondContact O-N 2.89Å
49E48.3Very low44.9Very low185 Ų185148.2 Ų148.286%0.86480%0.8SS**  trans-74112.1178.2-85.4-94.9113.700111
50S40.4Very low43.3Very low101 Ų101149.5 Ų149.571%0.70680%0.799SS**  trans-174.1125.9149.825.60000109.9D48 P52D48-S50 PolarHBondContact O-N 2.89Å; S50-P52 VanDerWaalsContact O-CD 3.32Å; S50-P52 WeakPolarHBondContact O-CD 3.32Å
51E44.4Very low42.2Very low195 Ų195147.6 Ų147.691%0.91181%0.808SS**  trans-67.6128.8176.3-59.6-146.5158.500111
52P40.8Very low41.4Very low110 Ų110148 Ų14871%0.71481%0.813SS**  trans-90.2112.1161.631.2-27.8000110.2S50 V54S50-P52 VanDerWaalsContact O-CD 3.32Å; S50-P52 WeakPolarHBondContact O-CD 3.32Å; P52-V54 PolarHBondContact O-N 2.97Å; P52-V54 VanDerWaalsContact O-N 3.12Å
53E41.8Very low40.4Very low184 Ų184142.6 Ų142.686%0.8681%0.805SS**  trans-51111.3160.5-100.7-175.4141.700110.1T55E53-T55 PolarHBondContact O-N 3.15Å
54V38.5Very low39.9Very low117 Ų117143.1 Ų143.171%0.70981%0.806SS**  trans-86.886.9175.3-162.70000108.8P52 F56P52-V54 PolarHBondContact O-N 2.97Å; P52-V54 VanDerWaalsContact O-N 3.12Å; V54-F56 PolarHBondContact O-N 3.29Å
55T37.2Very low40Very low101 Ų101141.9 Ų141.962%0.6280%0.803SS**  trans-68.4117.6167.657.60000109.7E53 K57E53-T55 PolarHBondContact O-N 3.15Å; T55-K57 PolarHBondContact O-N 2.88Å; T55-K57 VanDerWaalsContact O-N 3.1Å
56F37.3Very low39.3Very low197 Ų197145.6 Ų145.686%0.86481%0.806SS**  trans-70.4102.3168.8-72.5-85.7000109.7V54 R58V54-F56 PolarHBondContact O-N 3.29Å; F56-R58 PolarHBondContact O-N 2.84Å
57K41.5Very low39.4Very low193 Ų193146.5 Ų146.584%0.83981%0.807SS**  trans-73.6106.9169.6-70.9-169.2177.1-179.20109.7T55T55-K57 PolarHBondContact O-N 2.88Å; T55-K57 VanDerWaalsContact O-N 3.1Å
58R41.7Very low38.9Very low216 Ų216147 Ų14782%0.81581%0.806SS**  trans-68.8131.3164.1-177175.8179.6171.30.2108.7F56 R60F56-R58 PolarHBondContact O-N 2.84Å; R58-R60 PolarHBondContact O-N 3.24Å; R58-R60 VanDerWaalsContact O-N 3.16Å
59P35.8Very low38.6Very low121 Ų121149.2 Ų149.279%0.78681%0.808SS**  trans-68115.8172.626.8-31.1000109.1
60R40Very low38.1Very low232 Ų232147.5 Ų147.588%0.87581%0.805SS**PPolyproline II helixtrans-97.6116.8157.1-75.3-143.9172.1-159-0.9107.1R58R58-R60 PolarHBondContact O-N 3.24Å; R58-R60 VanDerWaalsContact O-N 3.16Å
61T42.2Very low37.8Very low145 Ų145151.8 Ų151.889%0.8981%0.814SS**PPolyproline II helixtrans-79.7116.7160.749.80000106.9
62G35.7Very low37.5Very low80 Ų80149.7 Ų149.783%0.82581%0.809SS**PPolyproline II helixtrans-99.3159.2174.200000111.6
63G32.8Very low37.3Very low65 Ų65153.6 Ų153.667%0.6782%0.818SS**  trans-171.474163.800000106.4
64T34.2Very low37.1Very low145 Ų145152.1 Ų152.189%0.8982%0.815SS**  69.7100.5105.255.60000112.9
65A38.6Very low37.1Very low94 Ų94153.5 Ų153.578%0.77782%0.819SS**  trans-81.2141.3153.700000108.2
66E33.8Very low37.1Very low202 Ų202155.1 Ų155.194%0.94482%0.824SS**  trans-160.1151.6132.1-75.7-142.9152.300110.1
67V40.1Very low37.5Very low130 Ų130152.2 Ų152.279%0.78882%0.817SS**  trans-94.2149.5-164.1167.80000110.6
68T33.7Very low37.4Very low128 Ų128150.8 Ų150.879%0.78582%0.819SS**  trans178.5128.7131.131.20000115.1
69K32.3Very low37.7Very low193 Ų193147.3 Ų147.384%0.83982%0.817SS**  trans75135.8140.6-81.3-177.1169.6-173.20123.3
70D37.8Very low38Very low149 Ų149149.1 Ų149.180%0.79782%0.819SS**  trans-63.2148.4176.6-44-87.7000114.7
71E34.6Very low38.4Very low191 Ų191144.9 Ų144.989%0.89381%0.814SS**  177.3152.3123.1-94.1173.8-166.800110.6
72D38Very low38.6Very low151 Ų151145 Ų14581%0.80781%0.809SS**  trans-66.1155.6-168.9-53.3-82.2000116
73E36.5Very low39.2Very low192 Ų192148 Ų14890%0.89781%0.807SS**  164.2145.7126.4-87.9176.7-17500112.4
74D37.6Very low39.9Very low152 Ų152152.2 Ų152.281%0.81381%0.814SS**  trans-63.9151.2-174.7-56.9-74.5000115.3
75D36.8Very low40.9Very low146 Ų146152.7 Ų152.778%0.78181%0.811SS**  170.3124.7122.2-100-26.6000113
76D38.8Very low41.6Very low135 Ų135150.4 Ų150.472%0.72280%0.796SS**  trans45.9128.6138.5-66.5-23.6000124.8
77D44.7Very low43Very low137 Ų137148.5 Ų148.573%0.73379%0.785SS**  trans43.1118.5136.3-69-34.5000120.7
78D40Very low43.6Very low162 Ų162152.4 Ų152.487%0.86679%0.792SS**  -167.6127.1107.3-103.7-33.9000110.6
79D48.8Very low45.1Very low144 Ų144147.7 Ų147.777%0.7777%0.769SS**  trans-61.5127.5163.6-85.7-46.3000109.6
80D42.1Very low46.8Very low158 Ų158144.5 Ų144.585%0.84577%0.768SS**  trans-146.690.9149.7-97.9-32.8000107.9D82D80-D82 PolarHBondContact O-N 3.11Å
81D47.4Very low48.4Very low143 Ų143142.1 Ų142.177%0.76577%0.769SS**  trans-63.684.1161.5-86.8-40000108.7D83D81-D83 PolarHBondContact O-N 2.83Å
82D45.8Very low50.1Low147 Ų147138 Ų13879%0.78675%0.752SS**  trans-82.193158.2-95-28.8000107.8D80 D84D80-D82 PolarHBondContact O-N 3.11Å; D82-D84 PolarHBondContact O-N 3.27Å
83D49.5Very low51.9Low145 Ų145134.5 Ų134.578%0.77574%0.738SS**  trans-60.869.9159.8-81.4-41.2000109.4D81 D85D81-D83 PolarHBondContact O-N 2.83Å; D83-D85 PolarHBondContact O-N 2.64Å
84D46.7Very low53.4Low153 Ų153132 Ų13282%0.81874%0.738SS**  trans-77.282.1168.3-140.1-0.8000105.8D82 G86D82-D84 PolarHBondContact O-N 3.27Å; D84-G86 PolarHBondContact O-N 2.88Å
85D54.7Low54.7Low155 Ų155128.3 Ų128.383%0.82974%0.737SS**  trans-49.788.9172.2-99.2-35.1000108.7D83 F87D83-D85 PolarHBondContact O-N 2.64Å; D85-F87 PolarHBondContact O-N 2.76Å
86G53.9Low55.9Low45 Ų45128.2 Ų128.246%0.46473%0.73SS.*  trans-60.198.9-174.700000109.1D84 F88D84-G86 PolarHBondContact O-N 2.88Å; G86-F88 WeakPolarHBondContact O-CD2 3.36Å; G86-F88 PolarHBondContact O-N 3.08Å
87F63.6Low57.2Low162 Ų162131 Ų13171%0.71174%0.735SS**  trans-64.288.5168.4179.3-104000108.5D85 G89D85-F87 PolarHBondContact O-N 2.76Å; F87-G89 PolarHBondContact O-N 2.98Å
88F52.2Low58.1Low212 Ų212134.3 Ų134.393%0.9374%0.743SS**  trans-73.954.1177.9-74.8-81.4000111.9G86G86-F88 WeakPolarHBondContact O-CD2 3.36Å; G86-F88 PolarHBondContact O-N 3.08Å
89G65.9Low58.5Low30 Ų30135.4 Ų135.431%0.30974%0.743SS.*SBendtrans-123.7157.2176.300000112.1F87 A91F87-G89 PolarHBondContact O-N 2.98Å; G89-A91 PolarHBondContact O-N 3.46Å
90P67.5Low58.5Low125 Ų125134 Ų13481%0.81274%0.744SS**PPolyproline II helixtrans-58.2135.8175.426.1-33.9000110.4L92P90-L92 PolarHBondContact O-N 2.98Å
91A70.9Confident58.4Low99 Ų99131.8 Ų131.882%0.81874%0.742SS**PPolyproline II helixtrans-56.5135.6179.600000111.4G89G89-A91 PolarHBondContact O-N 3.46Å
92L70.8Confident58.3Low104 Ų104129.9 Ų129.955%0.54574%0.737SS.*PPolyproline II helixtrans-66.1143.7177.9-80.298000111.1P90 F96P90-L92 PolarHBondContact O-N 2.98Å; L92-F96 HydrophobicContact CB-CB 4.21Å; L92-F96 HydrophobicContact CD2-CB 3.6Å; L92-F96 HydrophobicContact CD2-CD1 4.2Å; L92-F96 HydrophobicContact CD2-CG 3.9Å
93P75.7Confident58.5Low78 Ų78132.6 Ų132.651%0.50675%0.745SS.*PPolyproline II helixtrans-62.7152.7177.225.4-32.6000111.7G95 F96P93-G95 PolarHBondContact O-N 3.14Å; P93-F96 HydrophobicContact CG-CD2 3.96Å; P93-F96 HydrophobicContact CG-CE2 4Å; P93-F96 PolarHBondContact O-N 2.81Å
94P67.3Low58.8Low139 Ų139136 Ų13690%0.90375%0.747SS**THydrogen-bonded Turntrans-58122.8-179.222.1-32000110.9
95G64.6Low59.3Low76 Ų76134.1 Ų134.178%0.78474%0.743SS**THydrogen-bonded Turntrans128.7-16-177.500000114.8P93P93-G95 PolarHBondContact O-N 3.14Å
96F63.5Low59.2Low144 Ų144132.5 Ų132.563%0.63274%0.741SS**  trans-97.9116.4176.9-69.9-96.5000110.6L92 P93L92-F96 HydrophobicContact CB-CB 4.21Å; L92-F96 HydrophobicContact CD2-CB 3.6Å; L92-F96 HydrophobicContact CD2-CD1 4.2Å; L92-F96 HydrophobicContact CD2-CG 3.9Å; P93-F96 HydrophobicContact CG-CD2 3.96Å; P93-F96 HydrophobicContact CG-CE2 4Å; P93-F96 PolarHBondContact O-N 2.81Å
97K65.8Low59.4Low194 Ų194136.1 Ų136.184%0.84375%0.754SS**  trans-85130.3177.5-63.1-179.5-178.3-1780109.6Q99K97-Q99 PolarHBondContact O-N 3.43Å
98K63.7Low58.8Low205 Ų205137 Ų13789%0.89177%0.765SS**  trans-61.7114.1167.5-65.3-178.9179.3-172.90107.6
99Q48.2Very low59.6Low185 Ų185129.1 Ų129.186%0.86474%0.743SS**PPolyproline II helixtrans-81.8117.3171.1-59-172.1-7800106.8K97 S101K97-Q99 PolarHBondContact O-N 3.43Å; Q99-S101 PolarHBondContact O-N 3.03Å
100S48.5Very low59.8Low114 Ų114133.7 Ų133.780%0.79777%0.768SS**PPolyproline II helixtrans-63.3119.8162.355.40000107.4
101S40.6Very low60Low113 Ų113132.2 Ų132.279%0.7977%0.766SS**PPolyproline II helixtrans-52.6136.5177.3-74.40000111.7Q99Q99-S101 PolarHBondContact O-N 3.03Å
102P45.1Very low60Low103 Ų103132.5 Ų132.567%0.66975%0.753SS**PPolyproline II helixtrans-81.2135.7139.931.3-23.8000108.2R104P102-R104 PolarHBondContact O-N 2.76Å
103E49.8Very low60.4Low203 Ų203131.5 Ų131.595%0.94975%0.753SS**  trans-42.7104.1172.2-68.6176.5144.500111
104R56.7Low60.1Low218 Ų218134.3 Ų134.382%0.82377%0.771SS**  trans-132.7132.2164.6-81.9-173.6174.6-172.6-2107.3P102P102-R104 PolarHBondContact O-N 2.76Å
105P55.4Low60Low113 Ų113130.7 Ų130.773%0.73476%0.759SS**  trans-57.1138.8179.223.2-32000109.4V107P105-V107 PolarHBondContact O-N 3.01Å; P105-V107 VanDerWaalsContact O-N 3.13Å
106P53.9Low59.9Low120 Ų120134 Ų13478%0.77975%0.752SS**  trans-60.7120.3-171.823.4-32.9000110.1L108P106-L108 PolarHBondContact O-N 2.97Å
107V57.3Low60.2Low122 Ų122135.5 Ų135.574%0.73976%0.761SS**  trans-69.199.4171.2177.40000107.2P105 G109P105-V107 PolarHBondContact O-N 3.01Å; P105-V107 VanDerWaalsContact O-N 3.13Å; V107-G109 PolarHBondContact O-N 3.24Å
108L50.7Low60.1Low180 Ų180137.3 Ų137.394%0.94276%0.762SS**  trans-73.293.8176.3-153.783.4000109.1P106P106-L108 PolarHBondContact O-N 2.97Å
109G69.1Low59.4Low46 Ų46132.2 Ų132.247%0.47476%0.758SS.*SBendtrans142.1165.4173.200000114.1V107V107-G109 PolarHBondContact O-N 3.24Å
110P71.4Confident59.2Low127 Ų127127.9 Ų127.983%0.82575%0.754SS**SBendtrans-60139.5174.526.9-33.8000110.5L112P110-L112 PolarHBondContact O-N 3.14Å
111A71.4Confident58.9Low94 Ų94128.3 Ų128.378%0.77776%0.757SS**PPolyproline II helixtrans-58.1136.8179.900000111.4
112L70.9Confident58.8Low104 Ų104130.1 Ų130.155%0.54576%0.758SS.*PPolyproline II helixtrans-66.4144.1177.3-81.784.9000110.6P110 F116P110-L112 PolarHBondContact O-N 3.14Å; L112-F116 HydrophobicContact CB-CB 4.05Å; L112-F116 HydrophobicContact CD2-CB 3.56Å; L112-F116 HydrophobicContact CD2-CD1 4.4Å; L112-F116 HydrophobicContact CD2-CG 4.31Å; L112-F116 HydrophobicContact CG-CB 4.43Å
113P78.1Confident58.9Low83 Ų83131 Ų13154%0.53977%0.766SS.*PPolyproline II helixtrans-60.6156.1178.523.2-31.8000112G115 F116P113-G115 PolarHBondContact O-N 3.23Å; P113-F116 HydrophobicContact CG-CD2 4.39Å; P113-F116 PolarHBondContact O-N 2.89Å
114P69Low58.3Low138 Ų138128.4 Ų128.490%0.89676%0.759SS**THydrogen-bonded Turntrans-52.9124.1179.6-23.332.4000111.5
115G66.5Low57.7Low62 Ų62125.6 Ų125.664%0.63976%0.76SS**THydrogen-bonded Turntrans110.2-5.4-179.200000115.7P113P113-G115 PolarHBondContact O-N 3.23Å
116F63.1Low56.7Low146 Ų146123.5 Ų123.564%0.6476%0.76SS**  trans-111.8114.8173.8-77.8-104.3000110.8L112 P113L112-F116 HydrophobicContact CB-CB 4.05Å; L112-F116 HydrophobicContact CD2-CB 3.56Å; L112-F116 HydrophobicContact CD2-CD1 4.4Å; L112-F116 HydrophobicContact CD2-CG 4.31Å; L112-F116 HydrophobicContact CG-CB 4.43Å; P113-F116 HydrophobicContact CG-CD2 4.39Å; P113-F116 PolarHBondContact O-N 2.89Å
117H68.8Low56.4Low176 Ų176126.3 Ų126.382%0.81576%0.762SS**  trans-112.7139.3176.8-54.4-60.9000109.9
118R62.8Low55.9Low232 Ų232128.1 Ų128.188%0.87577%0.768SS**PPolyproline II helixtrans-70.4133.3165.3-91.7-173.7-177.9-115.82.4108.2A120R118-A120 PolarHBondContact O-N 3.44Å
119A49.6Very low55.5Low97 Ų97122.6 Ų122.680%0.80276%0.755SS**PPolyproline II helixtrans-58.5127.7166.800000108.3S121A119-S121 PolarHBondContact O-N 3.45Å
120A43.5Very low54.8Low95 Ų95129.4 Ų129.479%0.78577%0.774SS**PPolyproline II helixtrans-60.5125.3173.400000108R118 D122R118-A120 PolarHBondContact O-N 3.44Å; A120-D122 VanDerWaalsContact C-N 3.31Å; A120-D122 PolarHBondContact O-N 2.9Å
121S43.3Very low53.6Low123 Ų123130.8 Ų130.886%0.8678%0.775SS**  trans-69.498.5163-8.30000105.3A119A119-S121 PolarHBondContact O-N 3.45Å
122D39Very low52.6Low150 Ų150133.9 Ų133.980%0.80278%0.777SS**  trans-75.1121.2162.1-1491.6000105.8A120 D124A120-D122 VanDerWaalsContact C-N 3.31Å; A120-D122 PolarHBondContact O-N 2.9Å; D122-D124 PolarHBondContact O-N 3.36Å
123S46.3Very low51.5Low122 Ų122135.4 Ų135.485%0.85379%0.793SS**  trans-81.796.3174.6-166.40000105.7
124D37.6Very low50.6Low148 Ų148134 Ų13479%0.79179%0.794SS**  trans-130.8140.2165.1-158.741.7000110.2D122D122-D124 PolarHBondContact O-N 3.36Å
125D43.4Very low50.4Low159 Ų159133.5 Ų133.585%0.8579%0.791SS**  trans-55.7140.2-171-168.448.6000113.3
126G35.3Very low50.2Low70 Ų70135.5 Ų135.572%0.72280%0.801SS**  trans173.4111.9175.800000113.4
127E47.2Very low50.2Low178 Ų178134.2 Ų134.283%0.83280%0.8SS**  trans-58.1166.3175.3-66.7176.2141.500113.5
128D46.7Very low50.4Low160 Ų160130.1 Ų130.186%0.85679%0.79SS**  trans56.6105.3158.676.8-67.6000120
129G42.8Very low50.1Low65 Ų65126 Ų12667%0.6779%0.792SS**  trans160113.6159.200000113.6D131G129-D131 PolarHBondContact O-N 2.83Å
130E53.9Low50.5Low188 Ų188125.1 Ų125.188%0.87979%0.794SS**  trans-61.372.2174.7-48.8-70.4167.100112.3L132E130-L132 PolarHBondContact O-N 3.49Å
131D45.9Very low51.3Low157 Ų157128 Ų12884%0.8479%0.785SS**  trans-91.385.5177.3-90.2-13.8000111.1G129G129-D131 PolarHBondContact O-N 2.83Å
132L50.4Low51.9Low159 Ų159130.3 Ų130.383%0.83278%0.782SS**  trans-55.7124.9160.7-67.1163.8000108.8E130 G134E130-L132 PolarHBondContact O-N 3.49Å; L132-G134 VanDerWaalsContact C-N 3.31Å; L132-G134 PolarHBondContact O-N 3.16Å
133P48.8Very low52.8Low135 Ų135126.7 Ų126.788%0.87777%0.773SS**  trans-74.483.1-175.529.8-34.7000111.1
134G58.8Low52.6Low55 Ų55129 Ų12957%0.56777%0.771SS**PPolyproline II helixtrans-84.5157.6166.500000111.7L132 A136L132-G134 VanDerWaalsContact C-N 3.31Å; L132-G134 PolarHBondContact O-N 3.16Å; G134-A136 PolarHBondContact O-N 3.42Å
135P64.7Low53Low127 Ų127133.3 Ų133.383%0.82578%0.776SS**PPolyproline II helixtrans-59.5129.9173.925.6-33000110.3L137P135-L137 PolarHBondContact O-N 2.7Å
136A62.4Low52.9Low103 Ų103131.1 Ų131.185%0.85177%0.773SS**PPolyproline II helixtrans-56.8125.1-179.800000111.1G134G134-A136 PolarHBondContact O-N 3.42Å
137L63.8Low53.6Low119 Ų119132.8 Ų132.862%0.62377%0.774SS**PPolyproline II helixtrans-70147.8177-66.7168.3000110.2P135 Y141P135-L137 PolarHBondContact O-N 2.7Å; L137-Y141 HydrophobicContact CD1-CD1 3.66Å; L137-Y141 HydrophobicContact CD1-CE1 3.98Å
138P71.2Confident53.3Low91 Ų91129.3 Ų129.359%0.59177%0.769SS**PPolyproline II helixtrans-62.2148.8-177.524.9-33.8000111.9G140 Y141P138-G140 PolarHBondContact O-N 2.91Å; P138-G140 VanDerWaalsContact O-N 3.1Å; P138-Y141 PolarHBondContact O-N 2.88Å
139P57.9Low53.5Low144 Ų144130.9 Ų130.994%0.93577%0.771SS**THydrogen-bonded Turntrans-55.9117.4178.4-23.332.8000111.3
140G58.4Low53.7Low80 Ų80131.9 Ų131.983%0.82577%0.773SS**THydrogen-bonded Turntrans115.31.117800000116.4P138P138-G140 PolarHBondContact O-N 2.91Å; P138-G140 VanDerWaalsContact O-N 3.1Å
141Y60.2Low53.8Low154 Ų154132.2 Ų132.260%0.60477%0.774SS**  trans-84.1116.8173.5-171.7-97.5000111.4L137 P138 A143L137-Y141 HydrophobicContact CD1-CD1 3.66Å; L137-Y141 HydrophobicContact CD1-CE1 3.98Å; P138-Y141 PolarHBondContact O-N 2.88Å; Y141-A143 HydrophobicContact CE1-CB 4.15Å
142Q54.8Low54.4Low173 Ų173132.3 Ų132.381%0.80878%0.775SS**  trans-105.9115.7169.7-68.3-173.8-30.400108.7E144Q142-E144 PolarHBondContact O-N 3.26Å
143A57.6Low54.8Low73 Ų73133.8 Ų133.860%0.60378%0.778SS**  trans-75.9110.2170.300000108.4Y141 R145Y141-A143 HydrophobicContact CE1-CB 4.15Å; A143-R145 PolarHBondContact O-N 3.45Å
144E42.3Very low55.5Low172 Ų172134.8 Ų134.880%0.80478%0.776SS**  trans-60.6104.1168.9-73.9-72.4179.600108.5Q142 S146Q142-E144 PolarHBondContact O-N 3.26Å; E144-S146 PolarHBondContact O-N 3.39Å; E144-S146 VanDerWaalsContact O-N 3.08Å
145R46.7Very low55.8Low237 Ų237137.3 Ų137.389%0.89478%0.78SS**  trans-73.395.1167.7-70.6-177.1-176.6177.90.4106.7A143 S147A143-R145 PolarHBondContact O-N 3.45Å; R145-S147 VanDerWaalsContact C-N 3.29Å; R145-S147 PolarHBondContact O-N 3.47Å
146S40.5Very low55.9Low113 Ų113140.2 Ų140.279%0.7979%0.786SS**  trans-61.797.9163.2-80.70000108.5E144 S148E144-S146 PolarHBondContact O-N 3.39Å; E144-S146 VanDerWaalsContact O-N 3.08Å; S146-S148 PolarHBondContact O-N 2.93Å
147S50.9Low56.5Low106 Ų106137.5 Ų137.574%0.74177%0.768SS**  trans-65.6110.7159.9-175.10000107.9R145R145-S147 VanDerWaalsContact C-N 3.29Å; R145-S147 PolarHBondContact O-N 3.47Å
148S40.2Very low57.2Low105 Ų105138.3 Ų138.373%0.73478%0.781SS**  trans-12893159.460.90000107.6S146 A150S146-S148 PolarHBondContact O-N 2.93Å; S148-A150 PolarHBondContact O-N 3.28Å; S148-A150 VanDerWaalsContact O-N 3.16Å
149E51.6Low57.3Low192 Ų192139.6 Ų139.690%0.89778%0.78SS**  trans-56.2108.1157-84.8175.197.100108.7
150A46.5Very low58Low86 Ų86138 Ų13871%0.71177%0.77SS**  trans-149.599.9154.700000106.2S148 D152S148-A150 PolarHBondContact O-N 3.28Å; S148-A150 VanDerWaalsContact O-N 3.16Å; A150-D152 PolarHBondContact O-N 2.86Å
151E56.6Low58.7Low195 Ų195138.6 Ų138.691%0.91177%0.767SS**  trans-53.6107.4165.8-64.6178.6158.600108.7
152D58.6Low58.8Low159 Ų159140.5 Ų140.585%0.8578%0.779SS**  trans-161.950.1157.8-84.9-34.9000107.3A150 D154A150-D152 PolarHBondContact O-N 2.86Å; D152-D154 VanDerWaalsContact C-N 3.31Å; D152-D154 PolarHBondContact O-N 2.75Å; D152-D154 VanDerWaalsContact O-N 3.12Å
153E58.2Low59.7Low190 Ų190134.2 Ų134.289%0.88876%0.761SS**  trans-7589.2161.2-82.9-177.7171.300107.8
154D63.5Low60.1Low157 Ų157136.7 Ų136.784%0.8477%0.771SS**SBendtrans167.677.3146.2-84.1-28.1000109.7D152D152-D154 VanDerWaalsContact C-N 3.31Å; D152-D154 PolarHBondContact O-N 2.75Å; D152-D154 VanDerWaalsContact O-N 3.12Å
155V64.9Low61Low108 Ų108134.1 Ų134.166%0.65577%0.766SS**  trans173.283.4146.1155.90000107.9M159V155-M159 HydrophobicContact CG1-CG 4.05Å
156I67.6Low61.8Low187 Ų187131.4 Ų131.496%0.95976%0.764SS**  trans-94.695.3168.2-64.5161.4000106.9
157G74.9Confident63Low46 Ų46130.9 Ų130.947%0.47475%0.752SS.*SBendtrans157.7156.7174.600000113.3M159G157-M159 PolarHBondContact O-N 2.68Å; G157-M159 VanDerWaalsContact O-N 3.16Å
158P78.4Confident64.3Low136 Ų136128.6 Ų128.688%0.88374%0.736SS**PPolyproline II helixtrans-63.5118176.926.2-32.8000110
159M73.1Confident66.2Low118 Ų118128.5 Ų128.558%0.58173%0.731SS**PPolyproline II helixtrans-62.4131.1174.4-79.6-1726900110.2V155 G157 K162V155-M159 HydrophobicContact CG1-CG 4.05Å; G157-M159 PolarHBondContact O-N 2.68Å; G157-M159 VanDerWaalsContact O-N 3.16Å; M159-K162 VanDerWaalsContact CE-CE 3.5Å
160P72.9Confident67.6Low112 Ų112122.6 Ų122.673%0.72772%0.715SS**PPolyproline II helixtrans-61.1142.9173.924.3-31.6000110.4K162P160-K162 PolarHBondContact O-N 2.92Å; P160-K162 VanDerWaalsContact O-N 3.17Å
161A72.7Confident69.4Low92 Ų92122.6 Ų122.676%0.7670%0.702SS**PPolyproline II helixtrans-58.4120.8-17900000110.4G163A161-G163 PolarHBondContact O-N 3.18Å
162K63.4Low70.8Confident193 Ų193116.2 Ų116.284%0.83967%0.673SS**SBendtrans-78.774.4173.7-68.2176.1177.5173.10109.3M159 P160M159-K162 VanDerWaalsContact CE-CE 3.5Å; P160-K162 PolarHBondContact O-N 2.92Å; P160-K162 VanDerWaalsContact O-N 3.17Å
163G71.9Confident72.1Confident42 Ų42114.9 Ų114.943%0.43366%0.66SS.*SBendtrans-160.1160.617600000111.3A161 V165A161-G163 PolarHBondContact O-N 3.18Å; G163-V165 PolarHBondContact O-N 3.39Å
164P66.4Low73.6Confident125 Ų125110.9 Ų110.981%0.81264%0.641SS**  trans-60.3111.3174.424.9-31.5000108.8Q166P164-Q166 PolarHBondContact O-N 3.48Å
165V62Low74.9Confident117 Ų117110.3 Ų110.371%0.70963%0.627SS**  trans-65.6106178.6-172.30000107.3G163 D167G163-V165 PolarHBondContact O-N 3.39Å; V165-D167 HydrophobicContact CG1-CB 4.36Å; V165-D167 WeakPolarHBondContact CG1-O 3.4Å; V165-D167 PolarHBondContact O-N 2.87Å
166Q63.1Low76Confident180 Ų180111.7 Ų111.784%0.84162%0.62SS**SBendtrans-71-15.6179-65.7-173.2-13.600112.3P164 S168P164-Q166 PolarHBondContact O-N 3.48Å; Q166-S168 PolarHBondContact O-N 2.83Å
167D64.7Low77.1Confident103 Ų103105.6 Ų105.655%0.55160%0.598SS**SBendtrans-93.796.1176.2-72.4-20.1000109.9V165V165-D167 HydrophobicContact CG1-CB 4.36Å; V165-D167 WeakPolarHBondContact CG1-O 3.4Å; V165-D167 PolarHBondContact O-N 2.87Å
168S78.4Confident77.7Confident57 Ų57108 Ų10840%0.39960%0.597SS.*  trans-63.9144.3169.9730000110.2Q166 A170 L171 E172Q166-S168 PolarHBondContact O-N 2.83Å; S168-A170 PolarHBondContact O-N 3.05Å; S168-L171 WeakPolarHBondContact O-CB 3.33Å; S168-L171 PolarHBondContact O-N 3.4Å; S168-L171 WeakPolarHBondContact OG-CG 3.35Å; S168-L171 PolarHBondContact OG-N 3.1Å; S168-E172 PolarHBondContact O-N 3.4Å
169V80.4Confident78.1Confident104 Ų104106.9 Ų106.963%0.6358%0.575SS**Hα-helixtrans-51.7-33.4178173.40000111.8E172 F173V169-E172 WeakPolarHBondContact O-CB 2.99Å; V169-E172 PolarHBondContact O-N 2.78Å; V169-F173 HydrophobicContact CG1-CD2 3.69Å; V169-F173 HydrophobicContact CG1-CE2 3.28Å; V169-F173 HydrophobicContact CG1-CZ 4.21Å; V169-F173 WeakPolarHBondContact O-CD2 3.21Å; V169-F173 PolarHBondContact O-N 3.42Å; V169-F173 VanDerWaalsContact O-N 3.09Å
170A82.3Confident78.7Confident68 Ų68106.9 Ų106.956%0.56258%0.575SS**Hα-helixtrans-62.4-42.2175.100000113.2S168 E172 F173 E174S168-A170 PolarHBondContact O-N 3.05Å; A170-E172 VanDerWaalsContact C-N 3.34Å; A170-F173 PolarHBondContact O-N 2.88Å; A170-E174 PolarHBondContact O-N 3.28Å
171L84.6Confident79.3Confident85 Ų85108.2 Ų108.245%0.44557%0.569SS.*Hα-helixtrans-71-29.7177.2-67.7173.8000112S168 R175S168-L171 WeakPolarHBondContact O-CB 3.33Å; S168-L171 PolarHBondContact O-N 3.4Å; S168-L171 WeakPolarHBondContact OG-CG 3.35Å; S168-L171 PolarHBondContact OG-N 3.1Å; L171-R175 VanDerWaalsContact O-CB 3.3Å; L171-R175 WeakPolarHBondContact O-CB 3.43Å; L171-R175 PolarHBondContact O-N 3.25Å
172E85.5Confident79.7Confident62 Ų62109.9 Ų109.929%0.2956%0.562SS.*Hα-helixtrans-61.4-53.4169.5-165.2-66.7163.600109.7S168 V169 A170 E174 R175 R176 R179S168-E172 PolarHBondContact O-N 3.4Å; V169-E172 WeakPolarHBondContact O-CB 2.99Å; V169-E172 PolarHBondContact O-N 2.78Å; A170-E172 VanDerWaalsContact C-N 3.34Å; E172-E174 PolarHBondContact O-N 2.85Å; E172-R175 CarbonylContact O-C 3.58Å; E172-R175 PolarHBondContact O-N 3.46Å; E172-R175 VanDerWaalsContact O-N 3.09Å; E172-R176 WeakPolarHBondContact O-CB 3.22Å; E172-R176 PolarHBondContact O-N 3.43Å; E172-R176 IonicContact OE1-CZ 2.68Å; E172-R176 IonicContact OE1-NE 2.82Å; E172-R176 PolarHBondContact OE1-NE 3.28Å; E172-R176 IonicContact OE1-NH2 3.01Å; E172-R176 PolarHBondContact OE1-NH2 3.16Å; E172-R176 IonicContact OE2-CZ 3.97Å; E172-R176 IonicContact OE2-NE 2.91Å; E172-R176 PolarHBondContact OE2-NE 2.9Å; E172-R176 VanDerWaalsContact OE2-NE 3.13Å; E172-R176 IonicContact OE2-NH2 2.88Å; E172-R179 IonicContact OE1-NH2 2.79Å
173F86.1Confident80.4Confident131 Ų131109.3 Ų109.358%0.57556%0.559SS**Hα-helixtrans-59-40.5-176.4-78.2-58.6000111.2V169 A170 R176 A177V169-F173 HydrophobicContact CG1-CD2 3.69Å; V169-F173 HydrophobicContact CG1-CE2 3.28Å; V169-F173 HydrophobicContact CG1-CZ 4.21Å; V169-F173 WeakPolarHBondContact O-CD2 3.21Å; V169-F173 PolarHBondContact O-N 3.42Å; V169-F173 VanDerWaalsContact O-N 3.09Å; A170-F173 PolarHBondContact O-N 2.88Å; F173-R176 PolarHBondContact O-N 2.75Å; F173-A177 VanDerWaalsContact O-CB 3.3Å; F173-A177 WeakPolarHBondContact O-CB 3.17Å; F173-A177 PolarHBondContact O-N 3.29Å
174E89.7Confident80.5Confident105 Ų105114 Ų11449%0.49157%0.574SS.*Hα-helixtrans-64.9-46.7175.4-173.5171.1-161.800111.9A170 E172 R176 A177 Q178A170-E174 PolarHBondContact O-N 3.28Å; E172-E174 PolarHBondContact O-N 2.85Å; E174-R176 VanDerWaalsContact C-N 3.29Å; E174-R176 PolarHBondContact O-N 2.96Å; E174-A177 PolarHBondContact O-N 3.37Å; E174-Q178 WeakPolarHBondContact O-CB 3.35Å; E174-Q178 WeakPolarHBondContact O-CG 3.31Å; E174-Q178 PolarHBondContact O-N 3.36Å
175R89.6Confident80.6Confident146 Ų146112.4 Ų112.455%0.55156%0.562SS**Hα-helixtrans-63.9-35.4176.7-167-174.6-68.5-163.34.2111.9L171 E172 R179L171-R175 VanDerWaalsContact O-CB 3.3Å; L171-R175 WeakPolarHBondContact O-CB 3.43Å; L171-R175 PolarHBondContact O-N 3.25Å; E172-R175 CarbonylContact O-C 3.58Å; E172-R175 PolarHBondContact O-N 3.46Å; E172-R175 VanDerWaalsContact O-N 3.09Å; R175-R179 WeakPolarHBondContact O-CB 3.44Å; R175-R179 WeakPolarHBondContact O-CG 3.4Å; R175-R179 PolarHBondContact O-N 2.97Å; R175-R179 PolarHBondContact O-NE 3.24Å
176R88.4Confident80.7Confident136 Ų136109.2 Ų109.251%0.51355%0.552SS.*Hα-helixtrans-67.8-43.4175.3-179.8-178.2-66.4-133.8-4111E172 F173 E174 R179 M180E172-R176 WeakPolarHBondContact O-CB 3.22Å; E172-R176 PolarHBondContact O-N 3.43Å; E172-R176 IonicContact OE1-CZ 2.68Å; E172-R176 IonicContact OE1-NE 2.82Å; E172-R176 PolarHBondContact OE1-NE 3.28Å; E172-R176 IonicContact OE1-NH2 3.01Å; E172-R176 PolarHBondContact OE1-NH2 3.16Å; E172-R176 IonicContact OE2-CZ 3.97Å; E172-R176 IonicContact OE2-NE 2.91Å; E172-R176 PolarHBondContact OE2-NE 2.9Å; E172-R176 VanDerWaalsContact OE2-NE 3.13Å; E172-R176 IonicContact OE2-NH2 2.88Å; F173-R176 PolarHBondContact O-N 2.75Å; E174-R176 VanDerWaalsContact C-N 3.29Å; E174-R176 PolarHBondContact O-N 2.96Å; R176-R179 PolarHBondContact O-N 2.98Å; R176-M180 WeakPolarHBondContact O-CB 2.98Å; R176-M180 PolarHBondContact O-N 3.4Å
177A89.9Confident80.3Confident59 Ų59110.3 Ų110.349%0.48856%0.557SS.*Hα-helixtrans-64.3-42.1175.800000111.5F173 E174 M180 K181F173-A177 VanDerWaalsContact O-CB 3.3Å; F173-A177 WeakPolarHBondContact O-CB 3.17Å; F173-A177 PolarHBondContact O-N 3.29Å; E174-A177 PolarHBondContact O-N 3.37Å; A177-M180 PolarHBondContact O-N 3.06Å; A177-K181 WeakPolarHBondContact O-CB 3.23Å; A177-K181 PolarHBondContact O-N 2.85Å
178Q88.9Confident80Confident98 Ų98113.3 Ų113.346%0.45857%0.568SS.*Hα-helixtrans-61.4-47.6174.5-73.1176.24.800111.6E174 M180 K181 E182E174-Q178 WeakPolarHBondContact O-CB 3.35Å; E174-Q178 WeakPolarHBondContact O-CG 3.31Å; E174-Q178 PolarHBondContact O-N 3.36Å; Q178-M180 VanDerWaalsContact C-N 3.29Å; Q178-M180 PolarHBondContact O-N 3.21Å; Q178-K181 WeakPolarHBondContact O-CB 3.45Å; Q178-K181 PolarHBondContact O-N 3.15Å; Q178-K181 VanDerWaalsContact O-N 3.13Å; Q178-E182 WeakPolarHBondContact O-CG 3.22Å; Q178-E182 PolarHBondContact O-N 3.4Å
179R87.1Confident79Confident111 Ų111115 Ų11542%0.41959%0.585SS.*Hα-helixtrans-57.9-39.2173.6-81.5-177.6-87.1127-5.2112.8E172 R175 R176 K183E172-R179 IonicContact OE1-NH2 2.79Å; R175-R179 WeakPolarHBondContact O-CB 3.44Å; R175-R179 WeakPolarHBondContact O-CG 3.4Å; R175-R179 PolarHBondContact O-N 2.97Å; R175-R179 PolarHBondContact O-NE 3.24Å; R176-R179 PolarHBondContact O-N 2.98Å; R179-K183 VanDerWaalsContact O-CG 3.24Å; R179-K183 WeakPolarHBondContact O-CG 3.34Å; R179-K183 PolarHBondContact O-N 3.04Å
180M83.9Confident78Confident118 Ų118114.3 Ų114.358%0.58158%0.583SS**Hα-helixtrans-69.5-40.7176.6-174.2-175.9-72.400111.4R176 A177 Q178 K183 L184R176-M180 WeakPolarHBondContact O-CB 2.98Å; R176-M180 PolarHBondContact O-N 3.4Å; A177-M180 PolarHBondContact O-N 3.06Å; Q178-M180 VanDerWaalsContact C-N 3.29Å; Q178-M180 PolarHBondContact O-N 3.21Å; M180-K183 WeakPolarHBondContact O-CB 3.42Å; M180-K183 PolarHBondContact O-N 3.34Å; M180-L184 HydrophobicContact CG-CD1 4.32Å; M180-L184 WeakPolarHBondContact O-CG 3.41Å; M180-L184 PolarHBondContact O-N 2.92Å; M180-L184 VanDerWaalsContact O-N 3.13Å
181K85.7Confident77Confident140 Ų140119.4 Ų119.461%0.60960%0.595SS**Hα-helixtrans-61.9-47.3176.5-175.3-178.5176.4-175.50111A177 Q178 K183 L184 T185A177-K181 WeakPolarHBondContact O-CB 3.23Å; A177-K181 PolarHBondContact O-N 2.85Å; Q178-K181 WeakPolarHBondContact O-CB 3.45Å; Q178-K181 PolarHBondContact O-N 3.15Å; Q178-K181 VanDerWaalsContact O-N 3.13Å; K181-K183 VanDerWaalsContact C-N 3.31Å; K181-K183 PolarHBondContact O-N 3.36Å; K181-L184 CarbonylContact O-C 3.58Å; K181-L184 PolarHBondContact O-N 3.23Å; K181-T185 HydrophobicContact CG-CG2 4.34Å; K181-T185 PolarHBondContact O-N 2.81Å; K181-T185 PolarHBondContact O-OG1 2.88Å
182E82.6Confident76.1Confident128 Ų128121.2 Ų121.260%0.59861%0.609SS**Hα-helixtrans-59.4-40.1176.1-72.1169.6176.800112.2Q178 L184 T185 G186Q178-E182 WeakPolarHBondContact O-CG 3.22Å; Q178-E182 PolarHBondContact O-N 3.4Å; E182-L184 PolarHBondContact O-N 2.66Å; E182-T185 PolarHBondContact O-N 3.4Å; E182-G186 PolarHBondContact O-N 3.2Å
183K77.2Confident75.2Confident181 Ų181124.8 Ų124.879%0.78764%0.635SS**Hα-helixtrans-62.7-28.2172.6-72.3172.7-177.4-169.70113.8R179 M180 K181R179-K183 VanDerWaalsContact O-CG 3.24Å; R179-K183 WeakPolarHBondContact O-CG 3.34Å; R179-K183 PolarHBondContact O-N 3.04Å; M180-K183 WeakPolarHBondContact O-CB 3.42Å; M180-K183 PolarHBondContact O-N 3.34Å; K181-K183 VanDerWaalsContact C-N 3.31Å; K181-K183 PolarHBondContact O-N 3.36Å
184L73.1Confident74.6Confident141 Ų141122.6 Ų122.674%0.73864%0.636SS**Hα-helixtrans-91-28.6-179.3-70.3173.6000112.9M180 K181 E182M180-L184 HydrophobicContact CG-CD1 4.32Å; M180-L184 WeakPolarHBondContact O-CG 3.41Å; M180-L184 PolarHBondContact O-N 2.92Å; M180-L184 VanDerWaalsContact O-N 3.13Å; K181-L184 CarbonylContact O-C 3.58Å; K181-L184 PolarHBondContact O-N 3.23Å; E182-L184 PolarHBondContact O-N 2.66Å
185T70.2Confident74.3Confident91 Ų91125.7 Ų125.756%0.55864%0.643SS**Hα-helixtrans-114.4-3.6-171.966.10000114.8K181 E182 E187K181-T185 HydrophobicContact CG-CG2 4.34Å; K181-T185 PolarHBondContact O-N 2.81Å; K181-T185 PolarHBondContact O-OG1 2.88Å; E182-T185 PolarHBondContact O-N 3.4Å; T185-E187 PolarHBondContact O-N 3.04Å
186G62.3Low74Confident50 Ų50124.7 Ų124.752%0.51565%0.645SS.*  trans-68.3116.917700000112E182 E188E182-G186 PolarHBondContact O-N 3.2Å; G186-E188 PolarHBondContact O-N 3.5Å
187E55.5Low73.6Confident203 Ų203122.8 Ų122.895%0.94965%0.649SS**SBendtrans-74.927.7174.6-65.2-171.4152.600113.9T185T185-E187 PolarHBondContact O-N 3.04Å
188E57.7Low73.2Confident166 Ų166128.6 Ų128.678%0.77666%0.658SS**  trans-106.596.1154.3-159.9-160.8-140.700104.8G186 P190G186-E188 PolarHBondContact O-N 3.5Å; E188-P190 WeakPolarHBondContact O-CD 3.45Å; E188-P190 VanDerWaalsContact O-N 3.11Å
189A59.3Low72.7Confident92 Ų92128.3 Ų128.376%0.7666%0.658SS**  trans-66.5107.4166.600000105.7E191A189-E191 PolarHBondContact O-N 3.34Å; A189-E191 VanDerWaalsContact O-N 3.13Å
190P58.3Low72.4Confident90 Ų90127.2 Ų127.258%0.58466%0.664SS**  trans-57.5128.4161.928.1-32.8000104.5E188 V192E188-P190 WeakPolarHBondContact O-CD 3.45Å; E188-P190 VanDerWaalsContact O-N 3.11Å; P190-V192 PolarHBondContact O-N 2.96Å
191E61.7Low72.2Confident174 Ų174127.9 Ų127.981%0.81367%0.665SS**  trans-34.4109.2163.3-179.3172.6-167.500106.1A189 V193A189-E191 PolarHBondContact O-N 3.34Å; A189-E191 VanDerWaalsContact O-N 3.13Å; E191-V193 PolarHBondContact O-N 2.81Å
192V65.2Low71.8Confident123 Ų123125.7 Ų125.775%0.74566%0.66SS**  trans-41.6120.7-172.3170.70000104.7P190 S194P190-V192 PolarHBondContact O-N 2.96Å; V192-S194 WeakPolarHBondContact O-CA 3.5Å; V192-S194 WeakPolarHBondContact O-CB 3.31Å; V192-S194 PolarHBondContact O-N 3.11Å; V192-S194 PolarHBondContact O-OG 2.95Å
193V66.4Low71.7Confident138 Ų138123.1 Ų123.184%0.83665%0.654SS**  trans-63.977.5-175-176.50000107.2E191E191-V193 PolarHBondContact O-N 2.81Å
194S73.8Confident71.3Confident84 Ų84119.1 Ų119.159%0.58765%0.646SS**PPolyproline II helixtrans-84.2121.9-176.353.30000102.9V192 E196V192-S194 WeakPolarHBondContact O-CA 3.5Å; V192-S194 WeakPolarHBondContact O-CB 3.31Å; V192-S194 PolarHBondContact O-N 3.11Å; V192-S194 PolarHBondContact O-OG 2.95Å; S194-E196 PolarHBondContact O-N 3.13Å
195R83Confident70.9Confident171 Ų171117.1 Ų117.165%0.64563%0.634SS**PPolyproline II helixtrans-51.3135.9172.1-81.7-176.216377.83.2108.2M199 T200R195-M199 HydrophobicContact CB-CB 4.07Å; R195-M199 HydrophobicContact CB-CE 3.75Å; R195-M199 HydrophobicContact CG-CE 3.73Å; R195-T200 HydrophobicContact CB-CG2 3.49Å; R195-T200 VanDerWaalsContact CB-CG2 3.49Å
196E83.3Confident70.7Confident125 Ų125115.9 Ų115.958%0.58462%0.623SS**PPolyproline II helixtrans-48.7144.1178.4-65.3171.4-156.200109.8S194 W198 M199 T200S194-E196 PolarHBondContact O-N 3.13Å; E196-W198 VanDerWaalsContact CB-CD1 3.42Å; E196-W198 HydrophobicContact CB-CG 4.48Å; E196-W198 VanDerWaalsContact CB-NE1 3.3Å; E196-W198 PolarHBondContact O-N 3.28Å; E196-W198 PolarHBondContact OE2-NE1 2.88Å; E196-M199 HydrophobicContact CB-CE 4.37Å; E196-M199 WeakPolarHBondContact O-CA 3.46Å; E196-M199 WeakPolarHBondContact O-CB 3.5Å; E196-M199 PolarHBondContact O-N 3.43Å; E196-T200 PolarHBondContact O-N 3.25Å
197T80Confident70.9Confident96 Ų96119.5 Ų119.559%0.58963%0.626SS**Hα-helixtrans-55.7-29.2-169.249.30000113.5M199 T200 E201T197-M199 PolarHBondContact O-N 2.91Å; T197-T200 PolarHBondContact O-N 3.29Å; T197-E201 WeakPolarHBondContact O-CA 3.47Å; T197-E201 VanDerWaalsContact O-CB 3.28Å; T197-E201 WeakPolarHBondContact O-CB 3.4Å; T197-E201 PolarHBondContact O-N 3.49Å
198W81.1Confident71.3Confident181 Ų181117.4 Ų117.469%0.68662%0.616SS**Hα-helixtrans-67.7-18.7174.570.3-89.6000114.4E196E196-W198 VanDerWaalsContact CB-CD1 3.42Å; E196-W198 HydrophobicContact CB-CG 4.48Å; E196-W198 VanDerWaalsContact CB-NE1 3.3Å; E196-W198 PolarHBondContact O-N 3.28Å; E196-W198 PolarHBondContact OE2-NE1 2.88Å
199M79.9Confident71.7Confident91 Ų91114.8 Ų114.845%0.44861%0.607SS.*Hα-helixtrans-92.2-22.9176.4-70.5-158.2-76.900113.4R195 E196 T197R195-M199 HydrophobicContact CB-CB 4.07Å; R195-M199 HydrophobicContact CB-CE 3.75Å; R195-M199 HydrophobicContact CG-CE 3.73Å; E196-M199 HydrophobicContact CB-CE 4.37Å; E196-M199 WeakPolarHBondContact O-CA 3.46Å; E196-M199 WeakPolarHBondContact O-CB 3.5Å; E196-M199 PolarHBondContact O-N 3.43Å; T197-M199 PolarHBondContact O-N 2.91Å
200T80.5Confident72.2Confident89 Ų89112.7 Ų112.755%0.54659%0.594SS.*Hα-helixtrans-108.9-30.3-176.353.60000113R195 E196 T197R195-T200 HydrophobicContact CB-CG2 3.49Å; R195-T200 VanDerWaalsContact CB-CG2 3.49Å; E196-T200 PolarHBondContact O-N 3.25Å; T197-T200 PolarHBondContact O-N 3.29Å
201E78.6Confident72.6Confident131 Ų131117.9 Ų117.961%0.61262%0.616SS**SBendtrans-104.3120.2-178.5-57.6-175.1176.300109.4T197T197-E201 WeakPolarHBondContact O-CA 3.47Å; T197-E201 VanDerWaalsContact O-CB 3.28Å; T197-E201 WeakPolarHBondContact O-CB 3.4Å; T197-E201 PolarHBondContact O-N 3.49Å
202L79.3Confident73Confident94 Ų94112 Ų11249%0.49260%0.601SS.*  trans-61143.1169.1-76.1154.5000108.8L206L202-L206 HydrophobicContact CB-CB 4.08Å; L202-L206 HydrophobicContact CD2-CB 4.04Å
203P78.5Confident73.5Confident74 Ų74110.7 Ų110.748%0.48160%0.604SS.*  trans-47.9146.4170-27.333.8000110.7E205 L206 Q207P203-E205 PolarHBondContact O-N 2.92Å; P203-L206 HydrophobicContact CB-CD1 3.98Å; P203-L206 HydrophobicContact CG-CD1 4.02Å; P203-L206 WeakPolarHBondContact O-CA 3.39Å; P203-L206 PolarHBondContact O-N 2.95Å; P203-Q207 PolarHBondContact O-N 3.44Å
204P69.3Low73.6Confident97 Ų97115.4 Ų115.463%0.6361%0.607SS**G310 helixtrans-50.4-30.1-173.9-29.834.7000114.8L206P204-L206 VanDerWaalsContact C-N 3.34Å
205E66Low73.7Confident100 Ų100117.1 Ų117.147%0.46761%0.614SS.*G310 helixtrans-72.4-24.3177.9-55-170.9148.100114.1P203 N225P203-E205 PolarHBondContact O-N 2.92Å; E205-N225 PolarHBondContact OE1-ND2 2.83Å; E205-N225 PolarHBondContact OE1-OD1 3.42Å; E205-N225 PolarHBondContact OE2-ND2 2.95Å
206L65.3Low73.2Confident65 Ų65118.5 Ų118.534%0.3463%0.625SS.*G310 helixtrans-102.80.5-176.6-75.1112000114.1L202 P203 P204 H208 I209L202-L206 HydrophobicContact CB-CB 4.08Å; L202-L206 HydrophobicContact CD2-CB 4.04Å; P203-L206 HydrophobicContact CB-CD1 3.98Å; P203-L206 HydrophobicContact CG-CD1 4.02Å; P203-L206 WeakPolarHBondContact O-CA 3.39Å; P203-L206 PolarHBondContact O-N 2.95Å; P204-L206 VanDerWaalsContact C-N 3.34Å; L206-H208 PolarHBondContact O-N 2.95Å; L206-I209 HydrophobicContact CB-CD1 3.76Å; L206-I209 HydrophobicContact CD2-CD1 3.33Å; L206-I209 HydrophobicContact CG-CD1 3.44Å; L206-I209 VanDerWaalsContact CG-CD1 3.44Å; L206-I209 WeakPolarHBondContact O-CB 3.42Å; L206-I209 PolarHBondContact O-N 2.65Å
207Q66.5Low72.5Confident125 Ų125120.7 Ų120.758%0.58463%0.632SS**THydrogen-bonded Turntrans-55.6-22.3-179.8-70179-5.800113.8P203P203-Q207 PolarHBondContact O-N 3.44Å
208H64.1Low72.1Confident159 Ų159126 Ų12674%0.73665%0.647SS**THydrogen-bonded Turntrans-99.910.5-179.4-42.1-70000114.4L206 G210L206-H208 PolarHBondContact O-N 2.95Å; H208-G210 VanDerWaalsContact C-N 3.32Å
209I66.8Low71.4Confident112 Ų112127.2 Ų127.257%0.57465%0.652SS**SBendtrans-89.41.4-175.7-68.7170.3000112.4L206L206-I209 HydrophobicContact CB-CD1 3.76Å; L206-I209 HydrophobicContact CD2-CD1 3.33Å; L206-I209 HydrophobicContact CG-CD1 3.44Å; L206-I209 VanDerWaalsContact CG-CD1 3.44Å; L206-I209 WeakPolarHBondContact O-CB 3.42Å; L206-I209 PolarHBondContact O-N 2.65Å
210G68.9Low70.4Confident48 Ų48127.4 Ų127.450%0.49566%0.662SS.*SBendtrans-99.8154.3175.100000114.9H208 G212H208-G210 VanDerWaalsContact C-N 3.32Å; G210-G212 PolarHBondContact O-N 3.13Å
211L65.6Low69.7Low198 Ų198124.8 Ų124.8100%1.03765%0.652SS**SBendtrans45.51.8162.2-62.7171.3000120
212G71.6Confident68.8Low50 Ų50122.2 Ų122.252%0.51565%0.647SS.*SBendtrans-102.2166.9172.200000112.5G210 R214G210-G212 PolarHBondContact O-N 3.13Å; G212-R214 PolarHBondContact O-N 2.97Å; G212-R214 VanDerWaalsContact O-N 3.08Å
213A75.6Confident67.8Low96 Ų96123.7 Ų123.779%0.79365%0.651SS**  trans-55.5116.1175.300000111T215A213-T215 PolarHBondContact O-N 3.48Å; A213-T215 VanDerWaalsContact O-N 3.09Å
214R68.1Low66.7Low238 Ų238126.6 Ų126.690%0.89866%0.663SS**  trans-7991.8-177.1-63.8170.170178.12.5109.4G212G212-R214 PolarHBondContact O-N 2.97Å; G212-R214 VanDerWaalsContact O-N 3.08Å
215T76.8Confident66.3Low119 Ų119126.1 Ų126.173%0.7366%0.655SS**  trans-102.6143170.863.90000110.8A213 K217A213-T215 PolarHBondContact O-N 3.48Å; A213-T215 VanDerWaalsContact O-N 3.09Å; T215-K217 PolarHBondContact O-N 2.95Å
216F71.1Confident65.9Low201 Ų201124.6 Ų124.688%0.88265%0.65SS**  trans-54137.8171.7-69.2-81.8000111.3K218F216-K218 PolarHBondContact O-N 3.01Å
217K69.4Low65.7Low170 Ų170129.2 Ų129.274%0.73966%0.663SS**  trans-66.2102.2177.3-160.286.9172.3-171.60108.7T215 R219T215-K217 PolarHBondContact O-N 2.95Å; K217-R219 WeakPolarHBondContact CG-O 3.18Å; K217-R219 PolarHBondContact O-N 3.27Å; K217-R219 VanDerWaalsContact O-N 3.1Å
218K71.8Confident65.4Low209 Ų209124.4 Ų124.491%0.90964%0.644SS**SBendtrans-69.1-0.3179.3-67.2-175.1178-178.90114.6F216F216-K218 PolarHBondContact O-N 3.01Å
219R65.3Low65.4Low206 Ų206124 Ų12478%0.77765%0.645SS**SBendtrans-130.3142.8177.4-64.1-170-70.4173.9-0.7108.1K217 G221K217-R219 WeakPolarHBondContact CG-O 3.18Å; K217-R219 PolarHBondContact O-N 3.27Å; K217-R219 VanDerWaalsContact O-N 3.1Å; R219-G221 PolarHBondContact O-N 3.35Å
220S60.5Low65.4Low95 Ų95130.1 Ų130.166%0.66466%0.661SS**PPolyproline II helixtrans-50.6134.9166.347.60000108.4
221G64.2Low65.3Low33 Ų33133.1 Ų133.134%0.3467%0.67SS.*PPolyproline II helixtrans-57167.7177.900000111.4R219 E223R219-G221 PolarHBondContact O-N 3.35Å; G221-E223 PolarHBondContact O-N 3.39Å
222P61Low65.5Low78 Ų78126.2 Ų126.251%0.50663%0.634SS.*PPolyproline II helixtrans-51.6120.9175.723-31.7000109.3N224P222-N224 HydrophobicContact CB-CB 4.35Å; P222-N224 PolarHBondContact O-N 3.12Å
223E56.8Low65.7Low124 Ų124127.1 Ų127.158%0.57963%0.63SS**THydrogen-bonded Turntrans-65.623.4174.2-66.2-73162.300112G221 R227G221-E223 PolarHBondContact O-N 3.39Å; E223-R227 IonicContact OE2-CZ 3.97Å; E223-R227 IonicContact OE2-NH1 3.91Å; E223-R227 PolarHBondContact OE2-NH1 3.15Å
224N56.5Low65.5Low136 Ų136128.2 Ų128.273%0.72763%0.629SS**THydrogen-bonded Turntrans-95.4-10.5-174.3-56.3-12.1000112P222 D226P222-N224 HydrophobicContact CB-CB 4.35Å; P222-N224 PolarHBondContact O-N 3.12Å; N224-D226 PolarHBondContact O-N 3.13Å
225N59.8Low65.8Low86 Ų86120.1 Ų120.146%0.4661%0.613SS.*SBendtrans-77.6102.9166.7-90.5-21.8000108E205 R227E205-N225 PolarHBondContact OE1-ND2 2.83Å; E205-N225 PolarHBondContact OE1-OD1 3.42Å; E205-N225 PolarHBondContact OE2-ND2 2.95Å; N225-R227 WeakPolarHBondContact O-CG 3.39Å; N225-R227 PolarHBondContact O-N 3.36Å
226D59Low65.8Low69 Ų69117.7 Ų117.737%0.36960%0.596SS.*  trans-49.589.4163.2-107.9-27.3000108.3N224 S228 I229 K240 R244N224-D226 PolarHBondContact O-N 3.13Å; D226-S228 PolarHBondContact O-N 3.44Å; D226-S228 VanDerWaalsContact O-N 3.08Å; D226-I229 WeakPolarHBondContact O-CD1 3.31Å; D226-K240 IonicContact OD1-NZ 3.74Å; D226-K240 PolarHBondContact OD1-NZ 2.95Å; D226-K240 WeakPolarHBondContact OD2-CE 3.33Å; D226-K240 IonicContact OD2-NZ 3.13Å; D226-K240 PolarHBondContact OD2-NZ 3.46Å; D226-R244 IonicContact OD2-NH2 3.08Å; D226-R244 PolarHBondContact OD2-NH2 2.88Å
227R60.8Low66Low161 Ų161117 Ų11761%0.60859%0.587SS**THydrogen-bonded Turntrans-66.5-4.2170.9-60.6179.5-177.599.5-5.4111.4E223 N225 I229E223-R227 IonicContact OE2-CZ 3.97Å; E223-R227 IonicContact OE2-NH1 3.91Å; E223-R227 PolarHBondContact OE2-NH1 3.15Å; N225-R227 WeakPolarHBondContact O-CG 3.39Å; N225-R227 PolarHBondContact O-N 3.36Å; R227-I229 PolarHBondContact O-N 3.35Å
228S59.7Low66.5Low25 Ų25114.4 Ų114.418%0.17558%0.578CS.*Hα-helixtrans-64.6-14.3177.792.70000113.5D226 W230 T231 D232 K240D226-S228 PolarHBondContact O-N 3.44Å; D226-S228 VanDerWaalsContact O-N 3.08Å; S228-W230 PolarHBondContact O-N 2.97Å; S228-T231 WeakPolarHBondContact CA-OG1 3.23Å; S228-T231 PolarHBondContact O-N 3.02Å; S228-D232 VanDerWaalsContact O-CB 3.28Å; S228-D232 WeakPolarHBondContact O-CB 3.32Å; S228-D232 PolarHBondContact O-N 3.25Å; S228-K240 PolarHBondContact OG-NZ 2.94Å
229I64.8Low66.8Low150 Ų150113.2 Ų113.277%0.76957%0.567SS**Hα-helixtrans-60-29-179.9-66157.2000112D226 R227D226-I229 WeakPolarHBondContact O-CD1 3.31Å; R227-I229 PolarHBondContact O-N 3.35Å
230W65.8Low67.2Low241 Ų241106.1 Ų106.191%0.91354%0.542SS*.Hα-helixtrans-99.3-19.5178-174.7-88.7000113.8S228S228-W230 PolarHBondContact O-N 2.97Å
231T67.6Low67.9Low110 Ų110103.9 Ų103.968%0.67553%0.529SS*.Hα-helixtrans-104.8-2.8-177.656.70000114.2S228S228-T231 WeakPolarHBondContact CA-OG1 3.23Å; S228-T231 PolarHBondContact O-N 3.02Å
232D69.9Low68.3Low53 Ų53109.2 Ų109.228%0.28354%0.539SS..  trans-77.4133.7179.6-119.22.4000112.3S228 D236S228-D232 VanDerWaalsContact O-CB 3.28Å; S228-D232 WeakPolarHBondContact O-CB 3.32Å; S228-D232 PolarHBondContact O-N 3.25Å; D232-D236 WeakPolarHBondContact OD1-CB 3.47Å
233T75.4Confident68.8Low70 Ų70111.7 Ų111.743%0.42954%0.544SS..  trans-76.9158.4166.267.60000110.5A235 D236 R237T233-A235 PolarHBondContact O-N 3.36Å; T233-A235 VanDerWaalsContact O-N 3.15Å; T233-D236 PolarHBondContact O-N 3.06Å; T233-D236 PolarHBondContact OG1-N 2.98Å; T233-D236 PolarHBondContact OG1-OD2 2.86Å; T233-R237 PolarHBondContact O-N 2.77Å
234P71.3Confident69.3Low118 Ų118113 Ų11377%0.76654%0.544SS*.Hα-helixtrans-55.1-33.4177.2-26.834.8000113.9E238P234-E238 PolarHBondContact O-N 2.84Å; P234-E238 VanDerWaalsContact O-N 3.16Å
235A74.8Confident69.6Low69 Ų69112.2 Ų112.257%0.5754%0.539SS*.Hα-helixtrans-71.3-40175.900000112.6T233 R237 E238 R239T233-A235 PolarHBondContact O-N 3.36Å; T233-A235 VanDerWaalsContact O-N 3.15Å; A235-R237 VanDerWaalsContact C-N 3.33Å; A235-E238 PolarHBondContact O-N 3.45Å; A235-R239 WeakPolarHBondContact O-CB 3.27Å; A235-R239 PolarHBondContact O-N 2.79Å
236D76.8Confident69.5Low68 Ų68114.1 Ų114.136%0.36455%0.545SS..Hα-helixtrans-68.6-34.9175.1-68.6-45.5000111.6D232 T233 E238 R239 K240D232-D236 WeakPolarHBondContact OD1-CB 3.47Å; T233-D236 PolarHBondContact O-N 3.06Å; T233-D236 PolarHBondContact OG1-N 2.98Å; T233-D236 PolarHBondContact OG1-OD2 2.86Å; D236-E238 PolarHBondContact O-N 3.31Å; D236-R239 PolarHBondContact O-N 3.21Å; D236-K240 VanDerWaalsContact O-CB 3.23Å; D236-K240 WeakPolarHBondContact O-CB 3.46Å; D236-K240 PolarHBondContact O-N 3.18Å
237R75.9Confident69.2Low185 Ų185113.1 Ų113.170%0.69855%0.551SS**Hα-helixtrans-63.6-41.7175.1-168.2173.5-175.2163.91.1112T233 A235 A241T233-R237 PolarHBondContact O-N 2.77Å; A235-R237 VanDerWaalsContact C-N 3.33Å; R237-A241 WeakPolarHBondContact O-CB 3.47Å; R237-A241 PolarHBondContact O-N 3.35Å
238E77.9Confident68.9Low117 Ų117113.5 Ų113.555%0.54756%0.557SS.*Hα-helixtrans-67.1-43.6175.2-165.9-167.5152.200111.4P234 A235 D236 K240 A241 R242P234-E238 PolarHBondContact O-N 2.84Å; P234-E238 VanDerWaalsContact O-N 3.16Å; A235-E238 PolarHBondContact O-N 3.45Å; D236-E238 PolarHBondContact O-N 3.31Å; E238-K240 PolarHBondContact O-N 3.33Å; E238-A241 PolarHBondContact O-N 3.24Å; E238-R242 WeakPolarHBondContact O-CB 3.38Å; E238-R242 PolarHBondContact O-N 2.64Å; E238-R242 IonicContact OE1-CZ 3.88Å; E238-R242 IonicContact OE1-NH2 2.93Å; E238-R242 PolarHBondContact OE1-NH2 3.24Å
239R78.2Confident68.4Low184 Ų184121.5 Ų121.569%0.69459%0.589SS**Hα-helixtrans-60.8-45.9177-174.1-178.7176.8-176.7-0111.8A235 D236 R242 E243A235-R239 WeakPolarHBondContact O-CB 3.27Å; A235-R239 PolarHBondContact O-N 2.79Å; D236-R239 PolarHBondContact O-N 3.21Å; R239-R242 PolarHBondContact O-N 2.97Å; R239-E243 PolarHBondContact O-N 3.19Å
240K74.3Confident67.2Low57 Ų57118.7 Ų118.725%0.24858%0.578CS.*Hα-helixtrans-69.6-33.7178.5-163.6171.8-176.7170.80112.1D226 S228 D236 E238 R244D226-K240 IonicContact OD1-NZ 3.74Å; D226-K240 PolarHBondContact OD1-NZ 2.95Å; D226-K240 WeakPolarHBondContact OD2-CE 3.33Å; D226-K240 IonicContact OD2-NZ 3.13Å; D226-K240 PolarHBondContact OD2-NZ 3.46Å; S228-K240 PolarHBondContact OG-NZ 2.94Å; D236-K240 VanDerWaalsContact O-CB 3.23Å; D236-K240 WeakPolarHBondContact O-CB 3.46Å; D236-K240 PolarHBondContact O-N 3.18Å; E238-K240 PolarHBondContact O-N 3.33Å; K240-R244 WeakPolarHBondContact O-CB 3.49Å; K240-R244 PolarHBondContact O-N 3.36Å
241A75.8Confident66.3Low48 Ų48111.4 Ų111.440%0.39758%0.579SS.*Hα-helixtrans-67.3-41.9172.800000112R237 E238 R244 L245R237-A241 WeakPolarHBondContact O-CB 3.47Å; R237-A241 PolarHBondContact O-N 3.35Å; E238-A241 PolarHBondContact O-N 3.24Å; A241-R244 PolarHBondContact O-N 2.82Å; A241-L245 WeakPolarHBondContact O-CG 3.47Å; A241-L245 PolarHBondContact O-N 3.42Å
242R73.1Confident65.1Low144 Ų144113.4 Ų113.454%0.54358%0.58SS.*Hα-helixtrans-62.2-45.7175-164.4178.6-64.9-175.31.5111E238 R239 R244 L245 E246E238-R242 WeakPolarHBondContact O-CB 3.38Å; E238-R242 PolarHBondContact O-N 2.64Å; E238-R242 IonicContact OE1-CZ 3.88Å; E238-R242 IonicContact OE1-NH2 2.93Å; E238-R242 PolarHBondContact OE1-NH2 3.24Å; R239-R242 PolarHBondContact O-N 2.97Å; R242-R244 PolarHBondContact O-N 3.27Å; R242-L245 PolarHBondContact O-N 3.05Å; R242-E246 WeakPolarHBondContact O-CG 3.31Å; R242-E246 PolarHBondContact O-N 2.77Å
243E71.4Confident63.9Low131 Ų131114.6 Ų114.661%0.61260%0.597SS**Hα-helixtrans-62.7-39.7175.6-171.5-177.517500112.6R239 E246 G247R239-E243 PolarHBondContact O-N 3.19Å; E243-E246 PolarHBondContact O-N 3.49Å; E243-G247 PolarHBondContact O-N 3.44Å
244R67.1Low62.5Low151 Ų151121 Ų12157%0.5762%0.619SS**Hα-helixtrans-67.7-32.1174.7-85.3-166.6-175163.83.8113.3D226 K240 A241 R242 K248D226-R244 IonicContact OD2-NH2 3.08Å; D226-R244 PolarHBondContact OD2-NH2 2.88Å; K240-R244 WeakPolarHBondContact O-CB 3.49Å; K240-R244 PolarHBondContact O-N 3.36Å; A241-R244 PolarHBondContact O-N 2.82Å; R242-R244 PolarHBondContact O-N 3.27Å; R244-K248 VanDerWaalsContact O-CG 3.25Å; R244-K248 WeakPolarHBondContact O-CG 3.37Å; R244-K248 PolarHBondContact O-N 3.07Å
245L61.3Low61.3Low119 Ų119121.5 Ų121.562%0.62362%0.615SS**Hα-helixtrans-76-35.5176.4-73.3172000111.7A241 R242A241-L245 WeakPolarHBondContact O-CG 3.47Å; A241-L245 PolarHBondContact O-N 3.42Å; R242-L245 PolarHBondContact O-N 3.05Å
246E58.4Low59.8Low127 Ų127123.7 Ų123.759%0.59362%0.618SS**Hα-helixtrans-71.7-41.7174.1-72.2174.7-176.600111.7R242 E243 K248 K249R242-E246 WeakPolarHBondContact O-CG 3.31Å; R242-E246 PolarHBondContact O-N 2.77Å; E243-E246 PolarHBondContact O-N 3.49Å; E246-K248 PolarHBondContact O-N 3.17Å; E246-K249 PolarHBondContact O-N 3.11Å; E246-K249 VanDerWaalsContact O-N 3.16Å
247G54Low58.5Low48 Ų48129.6 Ų129.650%0.49564%0.64SS.*THydrogen-bonded Turntrans-70.1-9.3176.600000115.4E243E243-G247 PolarHBondContact O-N 3.44Å
248K52.8Low57.3Low168 Ų168125.7 Ų125.773%0.7364%0.637SS**THydrogen-bonded Turntrans-91.2-17.4172.2-78.7175.6175-171.70113.3R244 E246R244-K248 VanDerWaalsContact O-CG 3.25Å; R244-K248 WeakPolarHBondContact O-CG 3.37Å; R244-K248 PolarHBondContact O-N 3.07Å; E246-K248 PolarHBondContact O-N 3.17Å
249K49.5Very low56.2Low194 Ų194123.4 Ų123.484%0.84363%0.632SS**THydrogen-bonded Turntrans-89.1-19.2178.3-72.1-174.5176.8179.60113E246E246-K249 PolarHBondContact O-N 3.11Å; E246-K249 VanDerWaalsContact O-N 3.16Å
250T40.7Very low55.3Low90 Ų90123.5 Ų123.555%0.55264%0.64SS**  trans-97.486168.150.50000109.2E252T250-E252 PolarHBondContact O-N 2.96Å
251G45.4Very low54.8Low89 Ų89125.2 Ų125.292%0.91866%0.656SS**  trans-68.852.8162.800000111.4
252E43.3Very low55Low151 Ų151125.5 Ų125.571%0.70666%0.655SS**  trans-113.3125.1176.7-140.3177.1145.800107T250 K254T250-E252 PolarHBondContact O-N 2.96Å; E252-K254 PolarHBondContact O-N 3.1Å; E252-K254 VanDerWaalsContact O-N 3.1Å
253A45.2Very low55.6Low78 Ų78129 Ų12965%0.64567%0.668SS**  trans-38.2123.1173.200000108.9N255A253-N255 PolarHBondContact O-N 2.99Å
254K46.1Very low56.3Low204 Ų204132.2 Ų132.289%0.88767%0.674SS**  trans-59.189.1154.4-69.9-177.4179.9-179.80104.3E252 D256E252-K254 PolarHBondContact O-N 3.1Å; E252-K254 VanDerWaalsContact O-N 3.1Å; K254-D256 PolarHBondContact O-N 3.2Å
255N44.9Very low57.1Low129 Ų129128.5 Ų128.569%0.6967%0.666SS**  trans-48.5105.3152.6-75.4-67.4000102.5A253 K257A253-N255 PolarHBondContact O-N 2.99Å; N255-K257 VanDerWaalsContact C-N 3.33Å; N255-K257 PolarHBondContact O-N 2.94Å
256D42.7Very low58.3Low115 Ų115125.8 Ų125.862%0.61565%0.654SS**  trans-38112.8156.3-92.8-58.4000104.6K254 V258 K343K254-D256 PolarHBondContact O-N 3.2Å; D256-V258 PolarHBondContact O-N 3.46Å; D256-K343 IonicContact OD1-NZ 2.9Å; D256-K343 PolarHBondContact OD1-NZ 3.36Å
257K51.3Low60Low192 Ų192124.6 Ų124.684%0.83565%0.648SS**  trans-6287.3162.4-78.3-176.3179.3-173.90103.2N255 P259N255-K257 VanDerWaalsContact C-N 3.33Å; N255-K257 PolarHBondContact O-N 2.94Å; K257-P259 WeakPolarHBondContact O-CD 3.45Å; K257-P259 VanDerWaalsContact O-N 3.12Å
258V51Low61.7Low103 Ų103127.8 Ų127.862%0.62465%0.652SS**  trans-45.3121.5163.51800000102.8D256 Q260D256-V258 PolarHBondContact O-N 3.46Å; V258-Q260 PolarHBondContact O-N 3.26Å
259P53.5Low63.4Low70 Ų70122.8 Ų122.846%0.45564%0.642SS.*  trans-49.2111.9171-23.932.7000105.4K257 V261 K343K257-P259 WeakPolarHBondContact O-CD 3.45Å; K257-P259 VanDerWaalsContact O-N 3.12Å; P259-V261 PolarHBondContact O-N 3.34Å; P259-K343 HydrophobicContact CG-CB 3.92Å; P259-K343 HydrophobicContact CG-CD 4.03Å; P259-K343 HydrophobicContact CG-CG 3.9Å
260Q60Low65.5Low185 Ų185118 Ų11886%0.86462%0.623SS**  trans-65.497.6179.5-79.3-164.1-7.700104.9V258 S262V258-Q260 PolarHBondContact O-N 3.26Å; Q260-S262 PolarHBondContact O-N 2.63Å
261V64.3Low68Low94 Ų94120.3 Ų120.357%0.5763%0.625SS**  trans-47.7127.7164.9-135.70000104.9P259 R263 D265 V266P259-V261 PolarHBondContact O-N 3.34Å; V261-R263 PolarHBondContact O-N 3.18Å; V261-D265 HydrophobicContact CG1-CB 4.08Å; V261-V266 HydrophobicContact CB-CG2 3.97Å; V261-V266 HydrophobicContact CG2-CG2 4.44Å
262S79.8Confident70.1Confident54 Ų54119.6 Ų119.638%0.37860%0.603SS.*  trans-56.7142.7-17280.90000108.2Q260 R264 D265 V266Q260-S262 PolarHBondContact O-N 2.63Å; S262-R264 PolarHBondContact O-N 2.92Å; S262-D265 WeakPolarHBondContact CB-OD2 3.35Å; S262-D265 PolarHBondContact N-OD2 3.28Å; S262-D265 PolarHBondContact O-N 2.72Å; S262-D265 PolarHBondContact OG-N 3.08Å; S262-D265 PolarHBondContact OG-OD1 3.46Å; S262-D265 PolarHBondContact OG-OD2 3.35Å; S262-V266 PolarHBondContact O-N 2.74Å
263R84.1Confident72.3Confident217 Ų217114.7 Ų114.782%0.81959%0.585SS**Hα-helixtrans-51.9-32.9-179.1-70.5-174.5177-176.3-1.3111.7V261 V266 E267V261-R263 PolarHBondContact O-N 3.18Å; R263-V266 PolarHBondContact O-N 2.8Å; R263-E267 VanDerWaalsContact O-CG 3.32Å; R263-E267 WeakPolarHBondContact O-CG 2.96Å; R263-E267 PolarHBondContact O-N 2.96Å
264R87.4Confident74.6Confident198 Ų198117 Ų11775%0.74758%0.58SS**Hα-helixtrans-61.2-44.1173.2-75.2-169.4174.689.60.6113.3S262 E267 M268S262-R264 PolarHBondContact O-N 2.92Å; R264-E267 PolarHBondContact O-N 2.98Å; R264-M268 VanDerWaalsContact O-CB 3.32Å; R264-M268 WeakPolarHBondContact O-CB 3.35Å; R264-M268 PolarHBondContact O-N 2.86Å
265D83.6Confident76.8Confident73 Ų73114 Ų11439%0.3956%0.564SS.*Hα-helixtrans-68.2-38-178.8-59.2-34.8000111.4V261 S262 M268 A269V261-D265 HydrophobicContact CG1-CB 4.08Å; S262-D265 WeakPolarHBondContact CB-OD2 3.35Å; S262-D265 PolarHBondContact N-OD2 3.28Å; S262-D265 PolarHBondContact O-N 2.72Å; S262-D265 PolarHBondContact OG-N 3.08Å; S262-D265 PolarHBondContact OG-OD1 3.46Å; S262-D265 PolarHBondContact OG-OD2 3.35Å; D265-M268 PolarHBondContact O-N 3.09Å; D265-A269 WeakPolarHBondContact O-CB 3.37Å; D265-A269 PolarHBondContact O-N 2.93Å
266V86.9Confident78.9Confident62 Ų62110.1 Ų110.138%0.37654%0.544SS..Hα-helixtrans-63-49.6174.6-178.50000110.3V261 S262 R263 M268 A269 E270V261-V266 HydrophobicContact CB-CG2 3.97Å; V261-V266 HydrophobicContact CG2-CG2 4.44Å; S262-V266 PolarHBondContact O-N 2.74Å; R263-V266 PolarHBondContact O-N 2.8Å; V266-M268 VanDerWaalsContact C-N 3.28Å; V266-M268 PolarHBondContact O-N 2.98Å; V266-A269 PolarHBondContact O-N 3.13Å; V266-E270 WeakPolarHBondContact O-CG 3.2Å; V266-E270 PolarHBondContact O-N 2.83Å
267E92.8Very high81Confident102 Ų102111.9 Ų111.948%0.47755%0.548SS..Hα-helixtrans-60.3-38.3176.5-73.2173.8-15500112.4R263 R264 K271R263-E267 VanDerWaalsContact O-CG 3.32Å; R263-E267 WeakPolarHBondContact O-CG 2.96Å; R263-E267 PolarHBondContact O-N 2.96Å; R264-E267 PolarHBondContact O-N 2.98Å; E267-K271 WeakPolarHBondContact O-CB 3.47Å; E267-K271 WeakPolarHBondContact O-CD 3.4Å; E267-K271 VanDerWaalsContact O-CG 3.22Å; E267-K271 WeakPolarHBondContact O-CG 3.22Å; E267-K271 PolarHBondContact O-N 3.04Å
268M90.3Very high82.8Confident116 Ų116107 Ų10757%0.57154%0.538SS*.Hα-helixtrans-67.3-44.6177.4-168.1-177.4-56.900111.1R264 D265 V266 E270 K271 V272R264-M268 VanDerWaalsContact O-CB 3.32Å; R264-M268 WeakPolarHBondContact O-CB 3.35Å; R264-M268 PolarHBondContact O-N 2.86Å; D265-M268 PolarHBondContact O-N 3.09Å; V266-M268 VanDerWaalsContact C-N 3.28Å; V266-M268 PolarHBondContact O-N 2.98Å; M268-E270 VanDerWaalsContact C-N 3.34Å; M268-E270 PolarHBondContact O-N 2.79Å; M268-K271 PolarHBondContact O-N 2.79Å; M268-V272 WeakPolarHBondContact O-CG2 3.3Å; M268-V272 PolarHBondContact O-N 3.03Å
269A89.1Confident84.6Confident62 Ų62109.4 Ų109.451%0.51254%0.54SS..Hα-helixtrans-60.6-42.7176.600000111.7D265 V266 V272 S273D265-A269 WeakPolarHBondContact O-CB 3.37Å; D265-A269 PolarHBondContact O-N 2.93Å; V266-A269 PolarHBondContact O-N 3.13Å; A269-V272 PolarHBondContact O-N 2.64Å; A269-S273 WeakPolarHBondContact O-CB 3.44Å; A269-S273 PolarHBondContact O-N 3.28Å
270E92.3Very high86.2Confident95 Ų95113.8 Ų113.844%0.44455%0.548SS..Hα-helixtrans-65-39.6175.4-73.3-176.9-16900113V266 M268 V272 S273 K274V266-E270 WeakPolarHBondContact O-CG 3.2Å; V266-E270 PolarHBondContact O-N 2.83Å; M268-E270 VanDerWaalsContact C-N 3.34Å; M268-E270 PolarHBondContact O-N 2.79Å; E270-V272 VanDerWaalsContact C-N 3.33Å; E270-S273 WeakPolarHBondContact CA-OG 3.46Å; E270-S273 PolarHBondContact O-N 3.2Å; E270-S273 PolarHBondContact O-OG 2.76Å; E270-K274 WeakPolarHBondContact O-CB 3.46Å; E270-K274 VanDerWaalsContact O-CG 3.25Å; E270-K274 WeakPolarHBondContact O-CG 3.49Å; E270-K274 PolarHBondContact O-N 2.91Å; E270-K274 IonicContact OE2-NZ 3.88Å
271K93.6Very high87.4Confident137 Ų137108.3 Ų108.360%0.59654%0.541SS*.Hα-helixtrans-62.9-43.3175.4-74.6166.6-171.8167.60110.7E267 M268 Y275E267-K271 WeakPolarHBondContact O-CB 3.47Å; E267-K271 WeakPolarHBondContact O-CD 3.4Å; E267-K271 VanDerWaalsContact O-CG 3.22Å; E267-K271 WeakPolarHBondContact O-CG 3.22Å; E267-K271 PolarHBondContact O-N 3.04Å; M268-K271 PolarHBondContact O-N 2.79Å; K271-Y275 WeakPolarHBondContact O-CB 3.25Å; K271-Y275 PolarHBondContact O-N 2.77Å
272V90.9Very high88.5Confident75 Ų75108.5 Ų108.546%0.45554%0.535SS..Hα-helixtrans-67.8-39.9177.8172.40000111.3M268 A269 E270 Y275 N276M268-V272 WeakPolarHBondContact O-CG2 3.3Å; M268-V272 PolarHBondContact O-N 3.03Å; A269-V272 PolarHBondContact O-N 2.64Å; E270-V272 VanDerWaalsContact C-N 3.33Å; V272-Y275 PolarHBondContact O-N 3.47Å; V272-N276 WeakPolarHBondContact CG1-ND2 3.31Å; V272-N276 WeakPolarHBondContact O-CB 3.34Å; V272-N276 PolarHBondContact O-N 3.29Å; V272-N276 PolarHBondContact O-ND2 2.74Å
273S88.9Confident88.9Confident47 Ų47109 Ų10933%0.32954%0.539SS..Hα-helixtrans-64-47.4177710000111.4A269 E270 Y275 N276 E277A269-S273 WeakPolarHBondContact O-CB 3.44Å; A269-S273 PolarHBondContact O-N 3.28Å; E270-S273 WeakPolarHBondContact CA-OG 3.46Å; E270-S273 PolarHBondContact O-N 3.2Å; E270-S273 PolarHBondContact O-OG 2.76Å; S273-Y275 VanDerWaalsContact C-N 3.31Å; S273-Y275 PolarHBondContact O-N 3.41Å; S273-N276 PolarHBondContact O-N 2.66Å; S273-N276 VanDerWaalsContact O-N 3.15Å; S273-E277 WeakPolarHBondContact O-CB 3.47Å; S273-E277 VanDerWaalsContact O-CG 3.31Å; S273-E277 WeakPolarHBondContact O-CG 3.22Å; S273-E277 PolarHBondContact O-N 3.24Å
274K92.3Very high89.1Confident126 Ų126105.6 Ų105.655%0.54854%0.536SS..Hα-helixtrans-59.1-40.2175.7-71.5169.4-175.6167.30112.5E270 S278E270-K274 WeakPolarHBondContact O-CB 3.46Å; E270-K274 VanDerWaalsContact O-CG 3.25Å; E270-K274 WeakPolarHBondContact O-CG 3.49Å; E270-K274 PolarHBondContact O-N 2.91Å; E270-K274 IonicContact OE2-NZ 3.88Å; K274-S278 PolarHBondContact O-N 3.05Å; K274-S278 PolarHBondContact O-OG 3.33Å
275Y92.5Very high89.1Confident142 Ų142102.4 Ų102.456%0.55753%0.533SS*.Hα-helixtrans-65.8-45.9175.1-179.6-92.7000111.4K271 V272 S273 E277 S278 K279K271-Y275 WeakPolarHBondContact O-CB 3.25Å; K271-Y275 PolarHBondContact O-N 2.77Å; V272-Y275 PolarHBondContact O-N 3.47Å; S273-Y275 VanDerWaalsContact C-N 3.31Å; S273-Y275 PolarHBondContact O-N 3.41Å; Y275-E277 PolarHBondContact O-N 3.2Å; Y275-S278 PolarHBondContact O-N 3.31Å; Y275-S278 PolarHBondContact O-OG 2.82Å; Y275-K279 HydrophobicContact CD1-CB 4.47Å; Y275-K279 HydrophobicContact CD2-CG 3.94Å; Y275-K279 HydrophobicContact CE1-CB 4.12Å; Y275-K279 HydrophobicContact CE1-CG 4.45Å; Y275-K279 HydrophobicContact CE2-CB 4.2Å; Y275-K279 HydrophobicContact CE2-CG 3.64Å; Y275-K279 HydrophobicContact CG-CG 4.49Å; Y275-K279 WeakPolarHBondContact O-CB 3.43Å; Y275-K279 PolarHBondContact O-N 3.1Å
276N89.4Confident89.3Confident48 Ų48100.8 Ų100.826%0.25753%0.527SS..Hα-helixtrans-62.6-41.6178.2-72.1-27000111.7V272 S273 S278 R280V272-N276 WeakPolarHBondContact CG1-ND2 3.31Å; V272-N276 WeakPolarHBondContact O-CB 3.34Å; V272-N276 PolarHBondContact O-N 3.29Å; V272-N276 PolarHBondContact O-ND2 2.74Å; S273-N276 PolarHBondContact O-N 2.66Å; S273-N276 VanDerWaalsContact O-N 3.15Å; N276-S278 VanDerWaalsContact C-N 3.33Å; N276-S278 PolarHBondContact O-N 3.18Å; N276-R280 CarbonylContact O-C 3.54Å; N276-R280 VanDerWaalsContact O-CA 3.31Å; N276-R280 WeakPolarHBondContact O-CA 3.5Å; N276-R280 WeakPolarHBondContact O-CB 3.15Å; N276-R280 PolarHBondContact O-N 2.81Å; N276-R280 VanDerWaalsContact O-O 3.06Å; N276-R280 WeakPolarHBondContact OD1-CD 3.45Å; N276-R280 PolarHBondContact OD1-NE 3.01Å; N276-R280 PolarHBondContact OD1-NH1 2.82Å
277E87.4Confident89.6Confident151 Ų151100.2 Ų100.271%0.70652%0.522SS*.Hα-helixtrans-65.8-32.9179.6-73.1166.3-165.600113.4S273 Y275S273-E277 WeakPolarHBondContact O-CB 3.47Å; S273-E277 VanDerWaalsContact O-CG 3.31Å; S273-E277 WeakPolarHBondContact O-CG 3.22Å; S273-E277 PolarHBondContact O-N 3.24Å; Y275-E277 PolarHBondContact O-N 3.2Å
278S88.2Confident89.6Confident90 Ų90100.9 Ų100.963%0.62953%0.525SS*.Hα-helixtrans-94-31.2-176.857.60000114.1K274 Y275 N276K274-S278 PolarHBondContact O-N 3.05Å; K274-S278 PolarHBondContact O-OG 3.33Å; Y275-S278 PolarHBondContact O-N 3.31Å; Y275-S278 PolarHBondContact O-OG 2.82Å; N276-S278 VanDerWaalsContact C-N 3.33Å; N276-S278 PolarHBondContact O-N 3.18Å
279K88.8Confident89.5Confident154 Ų15497.6 Ų97.667%0.6751%0.513SS*.Hα-helixtrans-107-24.2-175.8-63.8-63.1-173.4179.70113.8Y275Y275-K279 HydrophobicContact CD1-CB 4.47Å; Y275-K279 HydrophobicContact CD2-CG 3.94Å; Y275-K279 HydrophobicContact CE1-CB 4.12Å; Y275-K279 HydrophobicContact CE1-CG 4.45Å; Y275-K279 HydrophobicContact CE2-CB 4.2Å; Y275-K279 HydrophobicContact CE2-CG 3.64Å; Y275-K279 HydrophobicContact CG-CG 4.49Å; Y275-K279 WeakPolarHBondContact O-CB 3.43Å; Y275-K279 PolarHBondContact O-N 3.1Å
280R86.6Confident89.7Confident162 Ų162100 Ų10061%0.61151%0.512SS*.SBendtrans-100.3142.1172.9-59.6-176170.8167.4-5.1109N276N276-R280 CarbonylContact O-C 3.54Å; N276-R280 VanDerWaalsContact O-CA 3.31Å; N276-R280 WeakPolarHBondContact O-CA 3.5Å; N276-R280 WeakPolarHBondContact O-CB 3.15Å; N276-R280 PolarHBondContact O-N 2.81Å; N276-R280 VanDerWaalsContact O-O 3.06Å; N276-R280 WeakPolarHBondContact OD1-CD 3.45Å; N276-R280 PolarHBondContact OD1-NE 3.01Å; N276-R280 PolarHBondContact OD1-NH1 2.82Å
281G86.8Confident89.6Confident70 Ų70101.6 Ų101.672%0.72252%0.517SS*.  trans-63.3174166.500000111S283G281-S283 PolarHBondContact O-N 3.08Å
282E87.5Confident89.3Confident97 Ų9799.9 Ų99.945%0.45351%0.514SS..  trans-52.9137.1174.647.9176.6164.400112L287 K290E282-L287 HydrophobicContact CB-CG 4.4Å; E282-L287 VanDerWaalsContact CD-CG 3.46Å; E282-L287 HydrophobicContact CG-CD1 4Å; E282-L287 HydrophobicContact CG-CD2 3.85Å; E282-L287 HydrophobicContact CG-CG 3.61Å; E282-L287 WeakPolarHBondContact OE1-CD2 3.32Å; E282-K290 WeakPolarHBondContact OE2-CD 3.47Å; E282-K290 WeakPolarHBondContact OE2-CE 3.32Å; E282-K290 IonicContact OE2-NZ 3.39Å; E282-K290 PolarHBondContact OE2-NZ 2.79Å
283S87.3Confident89.3Confident66 Ų66102.9 Ų102.946%0.46252%0.521SS..  trans-59.7142.9179.3173.40000110.4G281 I285 S286 L287G281-S283 PolarHBondContact O-N 3.08Å; S283-I285 PolarHBondContact O-N 2.85Å; S283-I285 VanDerWaalsContact O-N 3.1Å; S283-I285 PolarHBondContact OG-N 3.5Å; S283-S286 PolarHBondContact N-OG 3.3Å; S283-S286 CarbonylContact O-C 3.55Å; S283-S286 WeakPolarHBondContact O-CA 3.48Å; S283-S286 PolarHBondContact O-N 3.34Å; S283-S286 PolarHBondContact O-OG 3.18Å; S283-L287 PolarHBondContact O-N 3Å
284L89Confident89.4Confident144 Ų144106.6 Ų106.675%0.75453%0.533SS*.Hα-helixtrans-52.5-35.3175-172.666.3000112.1L287 H288L284-L287 WeakPolarHBondContact O-CB 3.17Å; L284-L287 PolarHBondContact O-N 3.39Å; L284-H288 WeakPolarHBondContact O-CB 3.36Å; L284-H288 PolarHBondContact O-N 3.21Å
285I87.3Confident89.1Confident132 Ų132106.2 Ų106.268%0.67753%0.532SS*.Hα-helixtrans-67.4-43.4175.5-65.9162.8000110.6S283 L287 H288 S289S283-I285 PolarHBondContact O-N 2.85Å; S283-I285 VanDerWaalsContact O-N 3.1Å; S283-I285 PolarHBondContact OG-N 3.5Å; I285-L287 VanDerWaalsContact C-N 3.35Å; I285-H288 PolarHBondContact O-N 2.83Å; I285-S289 WeakPolarHBondContact O-CB 3.34Å; I285-S289 PolarHBondContact O-N 3.35Å
286S88.4Confident88.9Confident38 Ų38102 Ų10227%0.26653%0.526SS..Hα-helixtrans-66-40.717764.70000111.2S283 S289 K290S283-S286 PolarHBondContact N-OG 3.3Å; S283-S286 CarbonylContact O-C 3.55Å; S283-S286 WeakPolarHBondContact O-CA 3.48Å; S283-S286 PolarHBondContact O-N 3.34Å; S283-S286 PolarHBondContact O-OG 3.18Å; S286-S289 WeakPolarHBondContact CA-OG 3.44Å; S286-S289 PolarHBondContact O-N 2.95Å; S286-S289 PolarHBondContact O-OG 2.77Å; S286-K290 WeakPolarHBondContact O-CB 3.31Å; S286-K290 VanDerWaalsContact O-CG 3.31Å; S286-K290 WeakPolarHBondContact O-CG 3.42Å; S286-K290 PolarHBondContact O-N 3.23Å
287L92.1Very high88.7Confident51 Ų51106.5 Ų106.527%0.26754%0.544SS..Hα-helixtrans-55.4-52172.9-87.7166.3000111.4E282 S283 L284 I285 S289 K290 K291E282-L287 HydrophobicContact CB-CG 4.4Å; E282-L287 VanDerWaalsContact CD-CG 3.46Å; E282-L287 HydrophobicContact CG-CD1 4Å; E282-L287 HydrophobicContact CG-CD2 3.85Å; E282-L287 HydrophobicContact CG-CG 3.61Å; E282-L287 WeakPolarHBondContact OE1-CD2 3.32Å; S283-L287 PolarHBondContact O-N 3Å; L284-L287 WeakPolarHBondContact O-CB 3.17Å; L284-L287 PolarHBondContact O-N 3.39Å; I285-L287 VanDerWaalsContact C-N 3.35Å; L287-S289 VanDerWaalsContact C-N 3.34Å; L287-S289 PolarHBondContact O-N 3.45Å; L287-K290 PolarHBondContact O-N 3.19Å; L287-K291 WeakPolarHBondContact O-CG 3.38Å; L287-K291 PolarHBondContact O-N 2.78Å
288H92.5Very high88.4Confident116 Ų116103 Ų10354%0.53753%0.527SS..Hα-helixtrans-63-41.1178.9-169.6-93.6000111.7L284 I285 K290 K291 L292L284-H288 WeakPolarHBondContact O-CB 3.36Å; L284-H288 PolarHBondContact O-N 3.21Å; I285-H288 PolarHBondContact O-N 2.83Å; H288-K290 PolarHBondContact O-N 3.05Å; H288-K291 PolarHBondContact O-N 3.46Å; H288-L292 VanDerWaalsContact CE1-CD1 3.46Å; H288-L292 WeakPolarHBondContact CE1-CD1 3.46Å; H288-L292 WeakPolarHBondContact O-CB 3.19Å; H288-L292 WeakPolarHBondContact O-CG 3.41Å; H288-L292 PolarHBondContact O-N 3.33Å
289S89.4Confident87.7Confident46 Ų46103 Ų10332%0.32252%0.524SS..Hα-helixtrans-64.7-37.7176.979.20000112.8I285 S286 L287 K293I285-S289 WeakPolarHBondContact O-CB 3.34Å; I285-S289 PolarHBondContact O-N 3.35Å; S286-S289 WeakPolarHBondContact CA-OG 3.44Å; S286-S289 PolarHBondContact O-N 2.95Å; S286-S289 PolarHBondContact O-OG 2.77Å; L287-S289 VanDerWaalsContact C-N 3.34Å; L287-S289 PolarHBondContact O-N 3.45Å; S289-K293 WeakPolarHBondContact O-CB 3.46Å; S289-K293 VanDerWaalsContact O-CG 3.27Å; S289-K293 WeakPolarHBondContact O-CG 3.28Å; S289-K293 PolarHBondContact O-N 2.93Å
290K91.6Very high87.1Confident114 Ų11499.4 Ų99.450%0.49652%0.523SS..Hα-helixtrans-66.4-48.1175.2-75175.1-178.6178.60110.4E282 S286 L287 H288 L292 K293 E294E282-K290 WeakPolarHBondContact OE2-CD 3.47Å; E282-K290 WeakPolarHBondContact OE2-CE 3.32Å; E282-K290 IonicContact OE2-NZ 3.39Å; E282-K290 PolarHBondContact OE2-NZ 2.79Å; S286-K290 WeakPolarHBondContact O-CB 3.31Å; S286-K290 VanDerWaalsContact O-CG 3.31Å; S286-K290 WeakPolarHBondContact O-CG 3.42Å; S286-K290 PolarHBondContact O-N 3.23Å; L287-K290 PolarHBondContact O-N 3.19Å; H288-K290 PolarHBondContact O-N 3.05Å; K290-L292 PolarHBondContact O-N 2.93Å; K290-K293 PolarHBondContact O-N 2.75Å; K290-K293 VanDerWaalsContact O-N 3.16Å; K290-E294 WeakPolarHBondContact O-CB 3.45Å; K290-E294 PolarHBondContact O-N 3.33Å
291K92Very high86.5Confident127 Ų12798.3 Ų98.355%0.55253%0.529SS*.Hα-helixtrans-57.6-45176.1-72178.5-178.3-176.50112.2L287 H288 K293 E294 K295L287-K291 WeakPolarHBondContact O-CG 3.38Å; L287-K291 PolarHBondContact O-N 2.78Å; H288-K291 PolarHBondContact O-N 3.46Å; K291-K293 PolarHBondContact O-N 3.25Å; K291-E294 PolarHBondContact O-N 2.53Å; K291-K295 WeakPolarHBondContact O-CB 3.4Å; K291-K295 WeakPolarHBondContact O-CG 3.47Å; K291-K295 PolarHBondContact O-N 2.94Å
292L87.4Confident86Confident101 Ų101100.4 Ų100.453%0.52952%0.518SS..Hα-helixtrans-61.8-43.7175.9-78.5175.2000112.2H288 K290 K295 A296H288-L292 VanDerWaalsContact CE1-CD1 3.46Å; H288-L292 WeakPolarHBondContact CE1-CD1 3.46Å; H288-L292 WeakPolarHBondContact O-CB 3.19Å; H288-L292 WeakPolarHBondContact O-CG 3.41Å; H288-L292 PolarHBondContact O-N 3.33Å; K290-L292 PolarHBondContact O-N 2.93Å; L292-K295 PolarHBondContact O-N 3.21Å; L292-A296 WeakPolarHBondContact O-CB 3.44Å; L292-A296 PolarHBondContact O-N 2.92Å
293K89.5Confident85.2Confident138 Ų138100.9 Ų100.960%0.653%0.529SS*.Hα-helixtrans-65.9-38.9177.4-74.1174.2-178.5-178.50112.3S289 K290 K291 A296 K297S289-K293 WeakPolarHBondContact O-CB 3.46Å; S289-K293 VanDerWaalsContact O-CG 3.27Å; S289-K293 WeakPolarHBondContact O-CG 3.28Å; S289-K293 PolarHBondContact O-N 2.93Å; K290-K293 PolarHBondContact O-N 2.75Å; K290-K293 VanDerWaalsContact O-N 3.16Å; K291-K293 PolarHBondContact O-N 3.25Å; K293-A296 PolarHBondContact O-N 3.33Å; K293-K297 VanDerWaalsContact O-CG 3.32Å; K293-K297 WeakPolarHBondContact O-CG 3.46Å; K293-K297 PolarHBondContact O-N 2.99Å
294E91.1Very high84.5Confident125 Ų125104.9 Ų104.958%0.58455%0.551SS**Hα-helixtrans-65.4-45.4176-170.9-178.3174.400110.9K290 K291 A296 K297 E298K290-E294 WeakPolarHBondContact O-CB 3.45Å; K290-E294 PolarHBondContact O-N 3.33Å; K291-E294 PolarHBondContact O-N 2.53Å; E294-A296 VanDerWaalsContact C-N 3.33Å; E294-A296 PolarHBondContact O-N 3.33Å; E294-K297 PolarHBondContact O-N 3.16Å; E294-K297 VanDerWaalsContact O-N 3.14Å; E294-E298 WeakPolarHBondContact O-CB 3.34Å; E294-E298 PolarHBondContact O-N 2.82Å
295K87.3Confident84Confident118 Ų118105.6 Ų105.651%0.51355%0.551SS.*Hα-helixtrans-62.7-38174.5-68.1-72.3159.2-159.20112.5K291 L292 K297 E298 T299K291-K295 WeakPolarHBondContact O-CB 3.4Å; K291-K295 WeakPolarHBondContact O-CG 3.47Å; K291-K295 PolarHBondContact O-N 2.94Å; L292-K295 PolarHBondContact O-N 3.21Å; K295-K297 VanDerWaalsContact C-N 3.35Å; K295-E298 IonicContact NZ-OE2 3.05Å; K295-E298 PolarHBondContact NZ-OE2 3.5Å; K295-E298 PolarHBondContact O-N 3.01Å; K295-T299 WeakPolarHBondContact O-CB 3.46Å; K295-T299 VanDerWaalsContact O-CG2 3.31Å; K295-T299 WeakPolarHBondContact O-CG2 3.47Å; K295-T299 PolarHBondContact O-N 3.44Å; K295-T299 PolarHBondContact O-OG1 3.16Å
296A86.9Confident83.6Confident54 Ų54111.6 Ų111.645%0.44657%0.565SS.*Hα-helixtrans-64.9-37.5173.800000112.2L292 K293 E294 T299 A300L292-A296 WeakPolarHBondContact O-CB 3.44Å; L292-A296 PolarHBondContact O-N 2.92Å; K293-A296 PolarHBondContact O-N 3.33Å; E294-A296 VanDerWaalsContact C-N 3.33Å; E294-A296 PolarHBondContact O-N 3.33Å; A296-T299 WeakPolarHBondContact CA-OG1 3.23Å; A296-T299 PolarHBondContact O-OG1 2.92Å; A296-A300 VanDerWaalsContact O-CB 3.23Å; A296-A300 WeakPolarHBondContact O-CB 3.28Å; A296-A300 PolarHBondContact O-N 3.32Å
297K85Confident83.3Confident143 Ų143116 Ų11662%0.62258%0.575SS**Hα-helixtrans-70.8-43.8174.2-71.5174.6179.6-171.10112K293 E294 K295 T299 A300 D301K293-K297 VanDerWaalsContact O-CG 3.32Å; K293-K297 WeakPolarHBondContact O-CG 3.46Å; K293-K297 PolarHBondContact O-N 2.99Å; E294-K297 PolarHBondContact O-N 3.16Å; E294-K297 VanDerWaalsContact O-N 3.14Å; K295-K297 VanDerWaalsContact C-N 3.35Å; K297-T299 PolarHBondContact O-N 3.37Å; K297-A300 PolarHBondContact O-N 2.9Å; K297-A300 VanDerWaalsContact O-N 3.11Å; K297-D301 WeakPolarHBondContact O-CB 2.97Å; K297-D301 PolarHBondContact O-N 3.49Å
298E81.4Confident83.1Confident76 Ų76118.7 Ų118.736%0.35560%0.596SS.*Hα-helixtrans-61-32.3177.3-161.1-157.2140.600112.2E294 K295 K302E294-E298 WeakPolarHBondContact O-CB 3.34Å; E294-E298 PolarHBondContact O-N 2.82Å; K295-E298 IonicContact NZ-OE2 3.05Å; K295-E298 PolarHBondContact NZ-OE2 3.5Å; K295-E298 PolarHBondContact O-N 3.01Å; E298-K302 WeakPolarHBondContact O-CD 3.48Å; E298-K302 WeakPolarHBondContact O-CE 3.25Å; E298-K302 WeakPolarHBondContact O-CG 3.44Å; E298-K302 IonicContact OE1-NZ 2.83Å; E298-K302 PolarHBondContact OE1-NZ 3.06Å
299T74.5Confident82.7Confident92 Ų92119.9 Ų119.956%0.56460%0.6SS**Hα-helixtrans-82-32.6174.748.20000112.5K295 A296 K297K295-T299 WeakPolarHBondContact O-CB 3.46Å; K295-T299 VanDerWaalsContact O-CG2 3.31Å; K295-T299 WeakPolarHBondContact O-CG2 3.47Å; K295-T299 PolarHBondContact O-N 3.44Å; K295-T299 PolarHBondContact O-OG1 3.16Å; A296-T299 WeakPolarHBondContact CA-OG1 3.23Å; A296-T299 PolarHBondContact O-OG1 2.92Å; K297-T299 PolarHBondContact O-N 3.37Å
300A75.9Confident82.5Confident78 Ų78120.2 Ų120.265%0.64560%0.598SS**Hα-helixtrans-72.7-31.2174.700000113.5A296 K297 K302A296-A300 VanDerWaalsContact O-CB 3.23Å; A296-A300 WeakPolarHBondContact O-CB 3.28Å; A296-A300 PolarHBondContact O-N 3.32Å; K297-A300 PolarHBondContact O-N 2.9Å; K297-A300 VanDerWaalsContact O-N 3.11Å; A300-K302 VanDerWaalsContact C-N 3.28Å
301D74.3Confident82.1Confident139 Ų139122.5 Ų122.574%0.74360%0.603SS**SBendtrans-77-14.8177.5-72.7-26.9000112.5K297K297-D301 WeakPolarHBondContact O-CB 2.97Å; K297-D301 PolarHBondContact O-N 3.49Å
302K75.4Confident81.5Confident113 Ų113121.2 Ų121.249%0.49160%0.603SS.*SBendtrans-83.7124.8172.4-70.6169.6-167.2172.10108.6E298 A300 V304E298-K302 WeakPolarHBondContact O-CD 3.48Å; E298-K302 WeakPolarHBondContact O-CE 3.25Å; E298-K302 WeakPolarHBondContact O-CG 3.44Å; E298-K302 IonicContact OE1-NZ 2.83Å; E298-K302 PolarHBondContact OE1-NZ 3.06Å; A300-K302 VanDerWaalsContact C-N 3.28Å; K302-V304 PolarHBondContact O-N 3.31Å
303P70.8Confident81.1Confident107 Ų107120.9 Ų120.970%0.69560%0.599SS**  trans-58.3136.217524.9-32.5000109.4E305P303-E305 VanDerWaalsContact C-N 3.32Å; P303-E305 PolarHBondContact O-N 3.04Å
304V73.1Confident80.8Confident151 Ų151118.2 Ų118.292%0.91559%0.591SS**  trans-70.989.2-176.6-177.60000109.2K302K302-V304 PolarHBondContact O-N 3.31Å
305E78.9Confident80.2Confident159 Ų159115.7 Ų115.774%0.74358%0.581SS**  trans-75.8152.1169.4-66.2-176.4176.800110.3P303 R307P303-E305 VanDerWaalsContact C-N 3.32Å; P303-E305 PolarHBondContact O-N 3.04Å; E305-R307 PolarHBondContact O-N 3.15Å
306R77.8Confident79.5Confident258 Ų258117.4 Ų117.497%0.97459%0.591SS**  trans-65.799.8178-69.3-17891.9128.40.6109.3
307R82Confident78.8Confident130 Ų130118.7 Ų118.749%0.49159%0.593SS.*PPolyproline II helixtrans-77.1143.3174.1-175.7-172.5159.6164.7-2.4110.4E305 D310 E313E305-R307 PolarHBondContact O-N 3.15Å; R307-D310 IonicContact CZ-OD2 3.22Å; R307-D310 IonicContact NH2-OD2 2.7Å; R307-D310 PolarHBondContact NH2-OD2 2.86Å; R307-E313 VanDerWaalsContact CZ-CD 3.44Å; R307-E313 IonicContact CZ-OE1 2.79Å; R307-E313 IonicContact CZ-OE2 3.35Å; R307-E313 VanDerWaalsContact CZ-OE2 3.22Å; R307-E313 IonicContact NH1-OE1 2.64Å; R307-E313 PolarHBondContact NH1-OE1 3.26Å; R307-E313 VanDerWaalsContact NH1-OE1 3.08Å; R307-E313 IonicContact NH1-OE2 3.9Å; R307-E313 PolarHBondContact NH1-OE2 3.13Å; R307-E313 IonicContact NH2-OE1 2.76Å; R307-E313 PolarHBondContact NH2-OE1 3.46Å; R307-E313 IonicContact NH2-OE2 3.22Å; R307-E313 PolarHBondContact NH2-OE2 3.01Å
308P87.4Confident78.1Confident108 Ų108119.4 Ų119.470%0.70160%0.604SS**PPolyproline II helixtrans-63.9154.5169.727.9-35.2000111.4D310P308-D310 PolarHBondContact O-N 3.38Å
309F84.9Confident77.8Confident141 Ų141122.5 Ų122.562%0.61861%0.612SS**PPolyproline II helixtrans-58.4122.9-179.8-176.6-93.1000110.8R311 D314 L315F309-R311 HydrophobicContact CE1-CB 4.49Å; F309-D314 WeakPolarHBondContact CA-OD2 3.44Å; F309-D314 HydrophobicContact CD2-CB 3.57Å; F309-D314 VanDerWaalsContact CD2-OD2 3.22Å; F309-D314 WeakPolarHBondContact CD2-OD2 3.38Å; F309-D314 HydrophobicContact CE1-CB 4.39Å; F309-D314 HydrophobicContact CE2-CB 3.23Å; F309-D314 HydrophobicContact CG-CB 4.3Å; F309-D314 HydrophobicContact CZ-CB 3.69Å; F309-L315 HydrophobicContact CZ-CB 4.17Å; F309-L315 HydrophobicContact CZ-CD1 4.15Å
310D84.2Confident77.5Confident53 Ų53125.9 Ų125.928%0.28362%0.619SS.*  trans-106.9115.9174.5-172.2-24.1000108.6R307 P308 D312 E313 D314R307-D310 IonicContact CZ-OD2 3.22Å; R307-D310 IonicContact NH2-OD2 2.7Å; R307-D310 PolarHBondContact NH2-OD2 2.86Å; P308-D310 PolarHBondContact O-N 3.38Å; D310-D312 PolarHBondContact O-N 2.82Å; D310-D312 VanDerWaalsContact O-N 3.14Å; D310-D312 PolarHBondContact OD1-N 3.13Å; D310-E313 HydrophobicContact CB-CB 4.28Å; D310-E313 PolarHBondContact O-N 2.98Å; D310-D314 PolarHBondContact N-OD2 2.65Å; D310-D314 WeakPolarHBondContact O-CA 3.41Å; D310-D314 WeakPolarHBondContact O-CB 3.43Å; D310-D314 PolarHBondContact O-N 2.8Å
311R84.8Confident78Confident161 Ų161126.5 Ų126.561%0.60861%0.612SS**Hα-helixtrans-55.5-35-180-178.5-177158.987.13.9111.7F309 L315F309-R311 HydrophobicContact CE1-CB 4.49Å; R311-L315 HydrophobicContact CG-CB 4.02Å; R311-L315 HydrophobicContact CG-CD2 4.03Å; R311-L315 VanDerWaalsContact NH1-CD2 3.35Å; R311-L315 CarbonylContact O-C 3.38Å; R311-L315 VanDerWaalsContact O-CA 3.23Å; R311-L315 WeakPolarHBondContact O-CA 3.19Å; R311-L315 WeakPolarHBondContact O-CB 3.49Å; R311-L315 PolarHBondContact O-N 2.9Å
312D78.9Confident78.4Confident100 Ų100126.6 Ų126.654%0.53561%0.608SS.*Hα-helixtrans-76.7-37.6-176.5-80.7-14.8000112.2D310 R319D310-D312 PolarHBondContact O-N 2.82Å; D310-D312 VanDerWaalsContact O-N 3.14Å; D310-D312 PolarHBondContact OD1-N 3.13Å; D312-R319 PolarHBondContact O-NE 3.13Å; D312-R319 PolarHBondContact O-NH1 3.34Å; D312-R319 PolarHBondContact O-NH2 3.33Å
313E80Confident78.8Confident95 Ų95123.3 Ų123.344%0.44460%0.602SS.*Hα-helixtrans-86.6-38.9179.5-69.1-172.6-151.700113.4R307 D310R307-E313 VanDerWaalsContact CZ-CD 3.44Å; R307-E313 IonicContact CZ-OE1 2.79Å; R307-E313 IonicContact CZ-OE2 3.35Å; R307-E313 VanDerWaalsContact CZ-OE2 3.22Å; R307-E313 IonicContact NH1-OE1 2.64Å; R307-E313 PolarHBondContact NH1-OE1 3.26Å; R307-E313 VanDerWaalsContact NH1-OE1 3.08Å; R307-E313 IonicContact NH1-OE2 3.9Å; R307-E313 PolarHBondContact NH1-OE2 3.13Å; R307-E313 IonicContact NH2-OE1 2.76Å; R307-E313 PolarHBondContact NH2-OE1 3.46Å; R307-E313 IonicContact NH2-OE2 3.22Å; R307-E313 PolarHBondContact NH2-OE2 3.01Å; D310-E313 HydrophobicContact CB-CB 4.28Å; D310-E313 PolarHBondContact O-N 2.98Å
314D81.3Confident79.5Confident82 Ų82122.9 Ų122.944%0.43959%0.59SS.*Hα-helixtrans-92.1-33.7-173.6-57.6-23.8000111.8F309 D310 Q316F309-D314 WeakPolarHBondContact CA-OD2 3.44Å; F309-D314 HydrophobicContact CD2-CB 3.57Å; F309-D314 VanDerWaalsContact CD2-OD2 3.22Å; F309-D314 WeakPolarHBondContact CD2-OD2 3.38Å; F309-D314 HydrophobicContact CE1-CB 4.39Å; F309-D314 HydrophobicContact CE2-CB 3.23Å; F309-D314 HydrophobicContact CG-CB 4.3Å; F309-D314 HydrophobicContact CZ-CB 3.69Å; D310-D314 PolarHBondContact N-OD2 2.65Å; D310-D314 WeakPolarHBondContact O-CA 3.41Å; D310-D314 WeakPolarHBondContact O-CB 3.43Å; D310-D314 PolarHBondContact O-N 2.8Å; D314-Q316 PolarHBondContact O-N 3.1Å
315L80Confident80.2Confident71 Ų71122.3 Ų122.337%0.37258%0.576SS.*SBendtrans-97.680.4173.8-14776.6000108.3F309 R311 V317F309-L315 HydrophobicContact CZ-CB 4.17Å; F309-L315 HydrophobicContact CZ-CD1 4.15Å; R311-L315 HydrophobicContact CG-CB 4.02Å; R311-L315 HydrophobicContact CG-CD2 4.03Å; R311-L315 VanDerWaalsContact NH1-CD2 3.35Å; R311-L315 CarbonylContact O-C 3.38Å; R311-L315 VanDerWaalsContact O-CA 3.23Å; R311-L315 WeakPolarHBondContact O-CA 3.19Å; R311-L315 WeakPolarHBondContact O-CB 3.49Å; R311-L315 PolarHBondContact O-N 2.9Å; L315-V317 HydrophobicContact CB-CG2 4.16Å; L315-V317 HydrophobicContact CD2-CG2 3.62Å; L315-V317 HydrophobicContact CG-CG2 3.45Å; L315-V317 VanDerWaalsContact CG-CG2 3.45Å; L315-V317 PolarHBondContact O-N 3.38Å
316Q71.6Confident80.6Confident155 Ų155118.8 Ų118.872%0.72456%0.559SS**  trans-67.346178.7-60.2-179.4-9.400113.5D314D314-Q316 PolarHBondContact O-N 3.1Å
317V73.3Confident81Confident80 Ų80114.5 Ų114.549%0.48554%0.543SS..THydrogen-bonded Turntrans-79.1126.2179.8-158.70000108.7L315 R319L315-V317 HydrophobicContact CB-CG2 4.16Å; L315-V317 HydrophobicContact CD2-CG2 3.62Å; L315-V317 HydrophobicContact CG-CG2 3.45Å; L315-V317 VanDerWaalsContact CG-CG2 3.45Å; L315-V317 PolarHBondContact O-N 3.38Å; V317-R319 PolarHBondContact O-N 2.86Å
318N69.7Low81.4Confident159 Ų159114 Ų11485%0.8555%0.549SS*.THydrogen-bonded Turntrans61.718175.7-57.9-22.1000116.3
319R74.6Confident81.3Confident141 Ų141113.4 Ų113.453%0.53254%0.54SS..PPolyproline II helixtrans-77.9135.7167.6-67.3-168.9168.5-172.9-4.6109.3D312 V317 D321D312-R319 PolarHBondContact O-NE 3.13Å; D312-R319 PolarHBondContact O-NH1 3.34Å; D312-R319 PolarHBondContact O-NH2 3.33Å; V317-R319 PolarHBondContact O-N 2.86Å; R319-D321 PolarHBondContact O-N 3.32Å
320F69.7Low81.5Confident162 Ų162112.7 Ų112.771%0.71154%0.536SS*.PPolyproline II helixtrans-55.9125.9166.5-88.1-84.2000108.1E322 Q324F320-E322 PolarHBondContact O-N 3.06Å; F320-Q324 HydrophobicContact CD1-CB 4.21Å
321D84.4Confident81.7Confident92 Ų92116 Ų11649%0.49255%0.548SS..PPolyproline II helixtrans-47.3133.7170.31738.2000108.7R319 A323 Q324 K325R319-D321 PolarHBondContact O-N 3.32Å; D321-A323 PolarHBondContact O-N 2.92Å; D321-A323 VanDerWaalsContact O-N 3.13Å; D321-A323 PolarHBondContact OD1-N 3.29Å; D321-A323 VanDerWaalsContact OD1-N 3.11Å; D321-Q324 HydrophobicContact CB-CB 4.29Å; D321-Q324 HydrophobicContact CB-CG 3.94Å; D321-Q324 WeakPolarHBondContact O-CA 3.38Å; D321-Q324 WeakPolarHBondContact O-CB 3.47Å; D321-Q324 PolarHBondContact O-N 3.05Å; D321-K325 PolarHBondContact O-N 3.02Å
322E83.1Confident81.8Confident141 Ų141111.1 Ų111.166%0.65954%0.539SS*.Hα-helixtrans-55.8-34.8-177.7-169.5170.9-172.600110.3F320 Q324 K325 Q326F320-E322 PolarHBondContact O-N 3.06Å; E322-Q324 PolarHBondContact O-N 3.09Å; E322-K325 PolarHBondContact O-N 3.24Å; E322-Q326 HydrophobicContact CG-CG 4.42Å; E322-Q326 WeakPolarHBondContact O-CB 2.94Å; E322-Q326 WeakPolarHBondContact O-CG 3.44Å; E322-Q326 PolarHBondContact O-N 2.86Å
323A84Confident82.1Confident44 Ų44113.4 Ų113.436%0.36455%0.546SS..Hα-helixtrans-62.7-39173.100000112.8D321 R327D321-A323 PolarHBondContact O-N 2.92Å; D321-A323 VanDerWaalsContact O-N 3.13Å; D321-A323 PolarHBondContact OD1-N 3.29Å; D321-A323 VanDerWaalsContact OD1-N 3.11Å; A323-R327 WeakPolarHBondContact O-CB 3.34Å; A323-R327 WeakPolarHBondContact O-CG 3.33Å; A323-R327 PolarHBondContact O-N 3.33Å
324Q85.4Confident82.2Confident98 Ų98113.6 Ų113.646%0.45855%0.547SS..Hα-helixtrans-68.2-41.3175.6-66.3-178.57.300111.5F320 D321 E322 R327 L328F320-Q324 HydrophobicContact CD1-CB 4.21Å; D321-Q324 HydrophobicContact CB-CB 4.29Å; D321-Q324 HydrophobicContact CB-CG 3.94Å; D321-Q324 WeakPolarHBondContact O-CA 3.38Å; D321-Q324 WeakPolarHBondContact O-CB 3.47Å; D321-Q324 PolarHBondContact O-N 3.05Å; E322-Q324 PolarHBondContact O-N 3.09Å; Q324-R327 PolarHBondContact O-N 3.32Å; Q324-L328 PolarHBondContact O-N 2.77Å
325K87.9Confident82.2Confident139 Ų139113.9 Ų113.960%0.60455%0.548SS*.Hα-helixtrans-60.3-48174.6-174.9-179.9178.9-179.90111.4D321 E322 R327 L328 L329D321-K325 PolarHBondContact O-N 3.02Å; E322-K325 PolarHBondContact O-N 3.24Å; K325-R327 VanDerWaalsContact C-N 3.33Å; K325-R327 PolarHBondContact O-N 3.38Å; K325-L328 PolarHBondContact O-N 3.09Å; K325-L329 PolarHBondContact O-N 2.96Å
326Q87.2Confident82.1Confident85 Ų85117.5 Ų117.540%0.39757%0.568SS.*Hα-helixtrans-63.4-38.5177-65.6-63.9-12.100111.8E322 L329 K330E322-Q326 HydrophobicContact CG-CG 4.42Å; E322-Q326 WeakPolarHBondContact O-CB 2.94Å; E322-Q326 WeakPolarHBondContact O-CG 3.44Å; E322-Q326 PolarHBondContact O-N 2.86Å; Q326-L329 PolarHBondContact O-N 2.85Å; Q326-K330 WeakPolarHBondContact O-CB 3.48Å; Q326-K330 VanDerWaalsContact O-CG 3.3Å; Q326-K330 WeakPolarHBondContact O-CG 3.38Å; Q326-K330 PolarHBondContact O-N 3Å
327R87.6Confident82.3Confident167 Ų167114 Ų11463%0.6356%0.557SS**Hα-helixtrans-63.4-43174.4-77.6170-179.5-178.13.1112A323 Q324 K325 K330 K331A323-R327 WeakPolarHBondContact O-CB 3.34Å; A323-R327 WeakPolarHBondContact O-CG 3.33Å; A323-R327 PolarHBondContact O-N 3.33Å; Q324-R327 PolarHBondContact O-N 3.32Å; K325-R327 VanDerWaalsContact C-N 3.33Å; K325-R327 PolarHBondContact O-N 3.38Å; R327-K330 PolarHBondContact O-N 3.39Å; R327-K331 WeakPolarHBondContact O-CB 3.11Å; R327-K331 VanDerWaalsContact O-CG 3.22Å; R327-K331 WeakPolarHBondContact O-CG 3.48Å; R327-K331 PolarHBondContact O-N 3.42Å
328L88.4Confident82.3Confident120 Ų120115.4 Ų115.463%0.62855%0.554SS**Hα-helixtrans-63.9-43.7177.1-174.763.9000111Q324 K325 K331 S332Q324-L328 PolarHBondContact O-N 2.77Å; K325-L328 PolarHBondContact O-N 3.09Å; L328-K331 PolarHBondContact O-N 3.18Å; L328-S332 PolarHBondContact O-N 3.13Å
329L86.6Confident82.3Confident96 Ų96116.3 Ų116.350%0.50355%0.55SS.*Hα-helixtrans-59.7-48.8176.3-161.493.7000111.5K325 Q326 K331 S332 Q333K325-L329 PolarHBondContact O-N 2.96Å; Q326-L329 PolarHBondContact O-N 2.85Å; L329-K331 PolarHBondContact O-N 3.32Å; L329-S332 PolarHBondContact O-N 3.25Å; L329-S332 VanDerWaalsContact O-N 3.13Å; L329-S332 PolarHBondContact O-OG 2.95Å; L329-Q333 PolarHBondContact O-N 3.44Å
330K88.6Confident82Confident125 Ų125112.4 Ų112.454%0.54355%0.545SS..Hα-helixtrans-60.2-46176.9-73.9177.8-179.5-174.70112.1Q326 R327 S332 Q333 E334Q326-K330 WeakPolarHBondContact O-CB 3.48Å; Q326-K330 VanDerWaalsContact O-CG 3.3Å; Q326-K330 WeakPolarHBondContact O-CG 3.38Å; Q326-K330 PolarHBondContact O-N 3Å; R327-K330 PolarHBondContact O-N 3.39Å; K330-S332 PolarHBondContact O-N 2.88Å; K330-Q333 WeakPolarHBondContact O-CB 3.48Å; K330-Q333 PolarHBondContact O-N 2.99Å; K330-Q333 VanDerWaalsContact O-N 3.15Å; K330-E334 WeakPolarHBondContact O-CG 3.3Å; K330-E334 PolarHBondContact O-N 3.48Å; K330-E334 VanDerWaalsContact O-N 3.12Å
331K88.6Confident81.7Confident123 Ų123113.7 Ų113.754%0.53555%0.552SS.*Hα-helixtrans-57.5-37.7174.9-75.7172.5-178.1-179.70112.3R327 L328 L329R327-K331 WeakPolarHBondContact O-CB 3.11Å; R327-K331 VanDerWaalsContact O-CG 3.22Å; R327-K331 WeakPolarHBondContact O-CG 3.48Å; R327-K331 PolarHBondContact O-N 3.42Å; L328-K331 PolarHBondContact O-N 3.18Å; L329-K331 PolarHBondContact O-N 3.32Å
332S87.1Confident80.3Confident59 Ų59111.4 Ų111.441%0.41354%0.544SS..Hα-helixtrans-71.9-37.3178.1770000112.5L328 L329 K330 E334 L335L328-S332 PolarHBondContact O-N 3.13Å; L329-S332 PolarHBondContact O-N 3.25Å; L329-S332 VanDerWaalsContact O-N 3.13Å; L329-S332 PolarHBondContact O-OG 2.95Å; K330-S332 PolarHBondContact O-N 2.88Å; S332-E334 VanDerWaalsContact C-N 3.27Å; S332-E334 PolarHBondContact O-N 3.19Å; S332-L335 VanDerWaalsContact O-CB 3.31Å; S332-L335 WeakPolarHBondContact O-CB 3.36Å; S332-L335 WeakPolarHBondContact O-CG 3.45Å; S332-L335 PolarHBondContact O-N 2.91Å; S332-L335 VanDerWaalsContact O-N 3.13Å
333Q85.1Confident79.1Confident147 Ų147110.7 Ų110.769%0.68754%0.539SS*.Hα-helixtrans-62.1-38.1176.5-174.9177.90.300111.4L329 K330 L335L329-Q333 PolarHBondContact O-N 3.44Å; K330-Q333 WeakPolarHBondContact O-CB 3.48Å; K330-Q333 PolarHBondContact O-N 2.99Å; K330-Q333 VanDerWaalsContact O-N 3.15Å; Q333-L335 VanDerWaalsContact C-N 3.26Å; Q333-L335 PolarHBondContact O-N 3.32Å
334E81.2Confident77.8Confident99 Ų99115.6 Ų115.646%0.46356%0.559SS.*THydrogen-bonded Turntrans-75.4-6.2178.5-67.2167.3-165.200113.4K330 S332 N336 T337 R338K330-E334 WeakPolarHBondContact O-CG 3.3Å; K330-E334 PolarHBondContact O-N 3.48Å; K330-E334 VanDerWaalsContact O-N 3.12Å; S332-E334 VanDerWaalsContact C-N 3.27Å; S332-E334 PolarHBondContact O-N 3.19Å; E334-N336 PolarHBondContact O-N 2.88Å; E334-T337 CarbonylContact O-C 3.57Å; E334-T337 PolarHBondContact O-N 3.16Å; E334-T337 PolarHBondContact O-OG1 3.12Å; E334-T337 VanDerWaalsContact O-OG1 3.06Å; E334-R338 HydrophobicContact CB-CG 4.31Å; E334-R338 WeakPolarHBondContact O-CB 3.24Å; E334-R338 WeakPolarHBondContact O-CG 3.4Å; E334-R338 PolarHBondContact O-N 3.16Å
335L81.5Confident76.5Confident88 Ų88118.2 Ų118.246%0.46157%0.565SS.*Hα-helixtrans-57.6-35.5179.4-70.1169.7000113.2S332 Q333 T337S332-L335 VanDerWaalsContact O-CB 3.31Å; S332-L335 WeakPolarHBondContact O-CB 3.36Å; S332-L335 WeakPolarHBondContact O-CG 3.45Å; S332-L335 PolarHBondContact O-N 2.91Å; S332-L335 VanDerWaalsContact O-N 3.13Å; Q333-L335 VanDerWaalsContact C-N 3.26Å; Q333-L335 PolarHBondContact O-N 3.32Å; L335-T337 VanDerWaalsContact C-N 3.25Å; L335-T337 PolarHBondContact O-N 3.3Å
336N78Confident74.7Confident147 Ų147119.9 Ų119.979%0.78658%0.577SS**Hα-helixtrans-66.4-27.7177-68.6-49.1000112.9E334E334-N336 PolarHBondContact O-N 2.88Å
337T76.3Confident73Confident81 Ų81122.3 Ų122.350%0.49759%0.586SS.*Hα-helixtrans-102.7-15.4-179.859.60000113E334 L335 F339 S340E334-T337 CarbonylContact O-C 3.57Å; E334-T337 PolarHBondContact O-N 3.16Å; E334-T337 PolarHBondContact O-OG1 3.12Å; E334-T337 VanDerWaalsContact O-OG1 3.06Å; L335-T337 VanDerWaalsContact C-N 3.25Å; L335-T337 PolarHBondContact O-N 3.3Å; T337-F339 PolarHBondContact O-N 2.87Å; T337-S340 VanDerWaalsContact CA-OG 3.31Å; T337-S340 WeakPolarHBondContact CA-OG 3.39Å; T337-S340 WeakPolarHBondContact O-CA 3.3Å; T337-S340 WeakPolarHBondContact O-CB 3.49Å; T337-S340 PolarHBondContact O-N 3.08Å; T337-S340 VanDerWaalsContact O-O 3.11Å; T337-S340 PolarHBondContact O-OG 3.35Å
338R73.2Confident71Confident111 Ų111125.3 Ų125.342%0.41961%0.613SS.*Hα-helixtrans-62-27.4179-83.116868.498.17113.9E334E334-R338 HydrophobicContact CB-CG 4.31Å; E334-R338 WeakPolarHBondContact O-CB 3.24Å; E334-R338 WeakPolarHBondContact O-CG 3.4Å; E334-R338 PolarHBondContact O-N 3.16Å
339F70.1Confident70.2Confident177 Ų177125.6 Ų125.678%0.77661%0.612SS**THydrogen-bonded Turntrans-98.5-7.3173.1-60.2-75.8000113T337T337-F339 PolarHBondContact O-N 2.87Å
340S68.5Low69.3Low59 Ų59127.1 Ų127.141%0.41362%0.618SS.*SBendtrans-76.5155.1164.778.30000109.1T337 S342T337-S340 VanDerWaalsContact CA-OG 3.31Å; T337-S340 WeakPolarHBondContact CA-OG 3.39Å; T337-S340 WeakPolarHBondContact O-CA 3.3Å; T337-S340 WeakPolarHBondContact O-CB 3.49Å; T337-S340 PolarHBondContact O-N 3.08Å; T337-S340 VanDerWaalsContact O-O 3.11Å; T337-S340 PolarHBondContact O-OG 3.35Å; S340-S342 PolarHBondContact O-N 3.47Å
341H62.2Low68.2Low189 Ų189127.2 Ų127.288%0.87562%0.622SS**  trans-42.596.1-176.6-59.884.6000112.8
342S56.5Low67Low45 Ų45127.5 Ų127.532%0.31563%0.628SS.*  trans-92.7138.4-178.187.10000109.9S340 D344 R345S340-S342 PolarHBondContact O-N 3.47Å; S342-D344 PolarHBondContact O-N 3.03Å; S342-R345 PolarHBondContact OG-N 2.99Å; S342-R345 PolarHBondContact OG-O 3.17Å
343K57.8Low65.8Low126 Ų126131.8 Ų131.855%0.54864%0.641SS.*SBendtrans-55.6-30.7-178.2-170.1177.5177.8-177.20113.5D256 P259D256-K343 IonicContact OD1-NZ 2.9Å; D256-K343 PolarHBondContact OD1-NZ 3.36Å; P259-K343 HydrophobicContact CG-CB 3.92Å; P259-K343 HydrophobicContact CG-CD 4.03Å; P259-K343 HydrophobicContact CG-CG 3.9Å
344D55.8Low64.5Low147 Ų147130.7 Ų130.779%0.78664%0.638SS**SBendtrans-106.9-17.8-168.1-75.7-10.3000114.5S342S342-D344 PolarHBondContact O-N 3.03Å
345R57.4Low63.3Low153 Ų153133 Ų13358%0.57765%0.65SS**  trans-144.4110.1175.8-71-168.8-74.6-168.2-0.8110.4S342 F347S342-R345 PolarHBondContact OG-N 2.99Å; S342-R345 PolarHBondContact OG-O 3.17Å; R345-F347 HydrophobicContact CB-CD2 4.16Å; R345-F347 HydrophobicContact CB-CE2 3.7Å; R345-F347 HydrophobicContact CB-CZ 3.97Å; R345-F347 PolarHBondContact O-N 2.97Å
346M50.5Low61.9Low174 Ų174136.5 Ų136.586%0.85767%0.665SS**  trans-73.9101.2159-62.2-160.5-64.200106.6L348M346-L348 PolarHBondContact O-N 3.06Å
347F52.7Low60.5Low135 Ų135135.6 Ų135.659%0.59266%0.655SS**  trans-78.7101162.2-63.9-79.9000105.7R345R345-F347 HydrophobicContact CB-CD2 4.16Å; R345-F347 HydrophobicContact CB-CE2 3.7Å; R345-F347 HydrophobicContact CB-CZ 3.97Å; R345-F347 PolarHBondContact O-N 2.97Å
348L45.5Very low59.1Low230 Ų230140.5 Ų140.5100%1.20467%0.669SS**  trans-88.20165.5-132.487000108.9M346M346-L348 PolarHBondContact O-N 3.06Å

Retrieved 348 of 348 residues in 618.6 ms (Link to these results)