A0A087XAI4_POEFO Loading...

Fli-1 proto-oncogene, ETS transcription factor

AlphaFold DB , UniProt , Accession A0A087XAI4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 475 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
1M29.9Very low29.9Very low208 Ų208105.1 Ų105.1100%1.02556%0.564SS**  0145.70-69.3169.2177.800107.9A152M1-A152 PolarHBondContact O-N 2.97Å
2W25.7Very low30.3Very low183 Ų183103.4 Ų103.469%0.69356%0.563SS**EExtended strand (participates in β ladder)trans-117.3124.1-171.2-66.2103.8000109.9I149W2-I149 HydrophobicContact CB-CG2 3.61Å; W2-I149 HydrophobicContact CD2-CG2 3.86Å; W2-I149 HydrophobicContact CE3-CB 4.06Å; W2-I149 HydrophobicContact CE3-CG2 3.52Å; W2-I149 HydrophobicContact CG-CG2 3.97Å; W2-I149 HydrophobicContact CZ3-CB 4.44Å; W2-I149 HydrophobicContact CZ3-CG2 4.35Å
3A28.5Very low30.4Very low26 Ų26103.4 Ų103.422%0.21557%0.568CS.*EExtended strand (participates in β ladder)trans-85.4139.1168.800000110.4V150 A152A3-V150 WeakPolarHBondContact CA-O 3.48Å; A3-V150 WeakPolarHBondContact CB-O 3.45Å; A3-V150 PolarHBondContact N-O 2.92Å; A3-V150 PolarHBondContact O-N 2.89Å; A3-A152 HydrophobicContact CB-CB 4.12Å
4H31.5Very low30.6Very low105 Ų105102.3 Ų102.349%0.48657%0.57SS.*EExtended strand (participates in β ladder)trans-106.9105-175.8-126.2-89.4000109.9T6H4-T6 PolarHBondContact O-N 3.1Å; H4-T6 VanDerWaalsContact O-N 3.1Å
5W36.3Very low30.7Very low61 Ų6199.4 Ų99.423%0.23155%0.552CS.*  trans-83.785.7179.6-66.893.9000110.5W168 H214 L218W5-W168 HydrophobicContact CE3-CD2 4.35Å; W5-W168 HydrophobicContact CE3-CH2 4.39Å; W5-W168 HydrophobicContact CE3-CZ2 4.15Å; W5-W168 HydrophobicContact CZ3-CE3 4.47Å; W5-W168 AromaticContact CZ3-CH2 3.88Å; W5-W168 HydrophobicContact CZ3-CH2 3.88Å; W5-W168 HydrophobicContact CZ3-CZ2 4.04Å; W5-W168 HydrophobicContact CZ3-CZ3 4.14Å; W5-H214 AromaticContact CH2-CE1 3.36Å; W5-H214 WeakPolarHBondContact CH2-CE1 3.22Å; W5-H214 AromaticContact CH2-NE2 3.41Å; W5-H214 WeakPolarHBondContact CH2-NE2 3.23Å; W5-H214 AromaticContact CZ3-CE1 3.68Å; W5-H214 AromaticContact CZ3-NE2 3.72Å; W5-L218 HydrophobicContact CH2-CD1 3.94Å; W5-L218 HydrophobicContact CH2-CD2 3.79Å; W5-L218 HydrophobicContact CH2-CG 4.34Å; W5-L218 HydrophobicContact CZ2-CD1 3.95Å; W5-L218 HydrophobicContact CZ2-CD2 3.79Å; W5-L218 HydrophobicContact CZ2-CG 4.5Å
6T28.6Very low30.7Very low67 Ų6799.6 Ų99.641%0.41156%0.556SS.*  trans-137.190.4173.650.20000112.6H4 R147H4-T6 PolarHBondContact O-N 3.1Å; H4-T6 VanDerWaalsContact O-N 3.1Å; T6-R147 HydrophobicContact CG2-CB 4.38Å; T6-R147 HydrophobicContact CG2-CG 3.7Å
7L31.4Very low30.5Very low144 Ų144100.6 Ų100.675%0.75456%0.561SS**  trans44.383.4144.4-150.379.3000116.6
8S27.2Very low30.5Very low97 Ų97103.3 Ų103.368%0.67857%0.57SS**  trans-153.283.2163.6-77.40000111.9
9T32.6Very low30.7Very low99 Ų99104.8 Ų104.861%0.60757%0.571SS**  trans46.479.514659.80000118.2
10L29.6Very low30.8Very low120 Ų120108.3 Ų108.363%0.62858%0.583SS**  trans-118.984.4134.8-81.8178000108.6
11G27.1Very low31.1Very low46 Ų46108.4 Ų108.447%0.47459%0.588SS.*  trans-63.8153.1167.800000110.5V13G11-V13 PolarHBondContact O-N 2.69Å
12P34.9Very low31.1Very low85 Ų85104.8 Ų104.855%0.55258%0.577SS**THydrogen-bonded Turntrans-67.1-1.5-160.624.2-35.2000116.7C14 L15P12-C14 VanDerWaalsContact C-N 3.33Å; P12-C14 PolarHBondContact O-N 2.85Å; P12-L15 PolarHBondContact O-N 3.05Å
13V31.3Very low31.5Very low103 Ų103101.1 Ų101.162%0.62458%0.577SS**Hα-helixtrans-54.1-46.6-178.2-170.40000111.6G11 L15 V16 D17G11-V13 PolarHBondContact O-N 2.69Å; V13-L15 VanDerWaalsContact C-N 3.29Å; V13-L15 PolarHBondContact O-N 3.16Å; V13-V16 PolarHBondContact O-N 3.02Å; V13-D17 PolarHBondContact O-N 3.1Å
14C33.4Very low31.5Very low88 Ų88105.8 Ų105.860%0.59560%0.598SS**Hα-helixtrans-71.5-16.8-174.2-59.20000114.9P12P12-C14 VanDerWaalsContact C-N 3.33Å; P12-C14 PolarHBondContact O-N 2.85Å
15L33.2Very low31.8Very low59 Ų59106.4 Ų106.431%0.30961%0.609SS.*Hα-helixtrans-82.6-37.4176.2-155.879.8000111P12 V13 M18 F19 V210P12-L15 PolarHBondContact O-N 3.05Å; V13-L15 VanDerWaalsContact C-N 3.29Å; V13-L15 PolarHBondContact O-N 3.16Å; L15-M18 PolarHBondContact O-N 3.12Å; L15-F19 HydrophobicContact CD2-CE2 4.43Å; L15-F19 HydrophobicContact CG-CE2 4.31Å; L15-F19 VanDerWaalsContact O-CD2 3.25Å; L15-F19 WeakPolarHBondContact O-CD2 3.24Å; L15-V210 HydrophobicContact CD2-CG2 4.04Å
16V30.1Very low31.7Very low102 Ų102108.4 Ų108.462%0.61863%0.633SS**Hα-helixtrans-68.8-39.5-177.9-175.30000111.5V13 M18 F19V13-V16 PolarHBondContact O-N 3.02Å; V16-M18 PolarHBondContact O-N 3.34Å; V16-F19 PolarHBondContact O-N 3.44Å
17D27.5Very low32Very low118 Ų118110.1 Ų110.163%0.63165%0.647SS**G310 helixtrans-62.7-25.8176.1-92.8-63.7000113.5V13 F19V13-D17 PolarHBondContact O-N 3.1Å; D17-F19 VanDerWaalsContact C-N 3.26Å; D17-F19 PolarHBondContact O-N 3.01Å
18M30.3Very low32.1Very low149 Ų149112 Ų11273%0.73465%0.646SS**G310 helixtrans-70.4-18.2173.4-80.5-164.967.800113.9L15 V16L15-M18 PolarHBondContact O-N 3.12Å; V16-M18 PolarHBondContact O-N 3.34Å
19F33.5Very low32.5Very low132 Ų132113.6 Ų113.658%0.57965%0.651SS**G310 helixtrans-85.5-1.7-175-82.3-77.6000115L15 V16 D17L15-F19 HydrophobicContact CD2-CE2 4.43Å; L15-F19 HydrophobicContact CG-CE2 4.31Å; L15-F19 VanDerWaalsContact O-CD2 3.25Å; L15-F19 WeakPolarHBondContact O-CD2 3.24Å; V16-F19 PolarHBondContact O-N 3.44Å; D17-F19 VanDerWaalsContact C-N 3.26Å; D17-F19 PolarHBondContact O-N 3.01Å
20Q32.9Very low32.5Very low173 Ų173118.4 Ų118.481%0.80866%0.664SS**SBendtrans-116.4-10.2-171.1-154.888.693.400115.8
21T36.8Very low32.8Very low112 Ų112120.6 Ų120.669%0.68767%0.671SS**  trans-135.778.6-176.755.40000115.5
22V29.9Very low32.9Very low131 Ų131122.4 Ų122.479%0.79468%0.681SS**  trans-134.893155.4-174.90000110.1
23P34.1Very low32.7Very low107 Ų107126.7 Ų126.770%0.69570%0.699SS**  trans-72133.7154.431-31.1000109T25P23-T25 PolarHBondContact O-N 3.42Å
24D30.3Very low32.7Very low123 Ų123126.7 Ų126.766%0.65870%0.703SS**  trans-63.1114.4-173.5-175.2-9000112.7S26D24-S26 VanDerWaalsContact C-N 3.33Å; D24-S26 PolarHBondContact O-N 2.97Å; D24-S26 WeakPolarHBondContact OD1-CB 3.39Å; D24-S26 PolarHBondContact OD1-N 2.95Å
25T37.1Very low32.7Very low118 Ų118128.7 Ų128.772%0.72471%0.713SS**G310 helixtrans-83.80.3-179.652.90000114.3P23 S27P23-T25 PolarHBondContact O-N 3.42Å; T25-S27 PolarHBondContact O-N 2.85Å; T25-S27 VanDerWaalsContact O-N 3.12Å
26S33.6Very low32.5Very low104 Ų104132.8 Ų132.873%0.72774%0.739SS**G310 helixtrans-70.6-3.4-177.1-169.40000114.7D24D24-S26 VanDerWaalsContact C-N 3.33Å; D24-S26 PolarHBondContact O-N 2.97Å; D24-S26 WeakPolarHBondContact OD1-CB 3.39Å; D24-S26 PolarHBondContact OD1-N 2.95Å
27S34.7Very low32.6Very low103 Ų103133 Ų13372%0.7275%0.746SS**G310 helixtrans-98.6-27.2-171.955.70000115.5T25T25-S27 PolarHBondContact O-N 2.85Å; T25-S27 VanDerWaalsContact O-N 3.12Å
28Y33.5Very low32.9Very low183 Ų183136.4 Ų136.472%0.71876%0.758SS**SBendtrans-88.9-15.3-163.7-159.7-112.1000115.6K30Y28-K30 PolarHBondContact O-N 2.71Å
29V35.3Very low33.2Very low131 Ų131136 Ų13679%0.79476%0.758SS**THydrogen-bonded Turntrans-85.832.1-166.7-154.20000113.9
30K33.5Very low33.1Very low200 Ų200138.8 Ų138.887%0.8777%0.773SS**THydrogen-bonded Turntrans-134.8-9178.1-78.6-171.4176176.20116.6Y28Y28-K30 PolarHBondContact O-N 2.71Å
31E35.7Very low33.1Very low165 Ų165135.3 Ų135.377%0.77177%0.768SS**SBendtrans-98.3-16.7-177.1-147.1171142.200113.5L33E31-L33 PolarHBondContact O-N 2.8Å
32A29.9Very low32.9Very low85 Ų85137.1 Ų137.170%0.70277%0.773SS**THydrogen-bonded Turntrans-87.58.9-169.700000116.4
33L30Very low33Very low174 Ų174140.2 Ų140.291%0.91178%0.776SS**THydrogen-bonded Turntrans-130.715.5-173.1-75.5175.5000115E31E31-L33 PolarHBondContact O-N 2.8Å
34S32.5Very low33Very low104 Ų104143.7 Ų143.773%0.72778%0.783SS**SBendtrans-120.820.6-169.9-165.60000115.6
35V31.5Very low34Very low130 Ų130143.3 Ų143.379%0.78879%0.788SS**  trans-135.849.1-171.3-150.60000114.4
36V29.9Very low34.8Very low144 Ų144142.2 Ų142.287%0.87378%0.782SS**  trans-142.298.9163.4-178.20000111
37S32.4Very low34.7Very low107 Ų107147.8 Ų147.875%0.74879%0.789SS**  trans179.1155153.3-84.50000110.6
38E33.3Very low34.5Very low189 Ų189147.7 Ų147.788%0.88380%0.795SS**  trans60.294.9165-63.6170.7136.200116
39D36.2Very low34.4Very low140 Ų140144 Ų14475%0.74980%0.802SS**  93.8111.151.6-168.9-79.4000114
40Q32.3Very low34.2Very low191 Ų191143 Ų14389%0.89381%0.807SS**  -164.6144.4128.7-112.8160.48000113.3
41S33.1Very low34.2Very low101 Ų101138.1 Ų138.171%0.70680%0.804SS**  trans-82.4164.8-178.1178.60000113.1
42L32.5Very low34.7Very low150 Ų150135.8 Ų135.879%0.78580%0.803SS**  trans-169.3119137.7-99.9157.3000113.2
43F31.4Very low34.8Very low195 Ų195139.5 Ų139.586%0.85581%0.811SS**  trans77.1149.9164.9-78-79.5000122.5
44E34.1Very low35.7Very low180 Ų180136.7 Ų136.784%0.84180%0.803SS**  trans-112.9166.1-171.6-95.5-172.275.200113.5
45P50.9Low35.7Very low116 Ų116141.3 Ų141.375%0.75381%0.81SS**  trans-86.3-116.8-175.437.8-35.1000113.7
46P55.5Low35.8Very low95 Ų95141.8 Ų141.862%0.61781%0.813SS**  cis-126.2-166.63.425.61.9000115.1
47Y29.7Very low35.6Very low220 Ų220142.5 Ų142.586%0.86381%0.812SS**  trans76.4114.8163.4-70.1-74.4000122.2
48A31Very low36.1Very low102 Ų102146.4 Ų146.484%0.84382%0.821SS**  159138.3106.800000114.4
49A31Very low36.2Very low106 Ų106143.8 Ų143.888%0.87682%0.818SS**  trans-56.8156.3-17300000120.1
50A32.1Very low35.9Very low109 Ų109141.1 Ų141.190%0.90182%0.815SS**  trans-162.7167.4135.300000111.9
51A33.6Very low35.8Very low97 Ų97138.1 Ų138.180%0.80282%0.815SS**  trans-106162.1-170.400000114.8
52P45.7Very low35.5Very low116 Ų116136.5 Ų136.575%0.75382%0.815SS**  trans-100.2-174.1-177.740.3-36.7000114.8
53L33.1Very low35.3Very low163 Ų163135.8 Ų135.885%0.85382%0.817SS**  trans105.5155.6171-61.2168000115.5
54P47.5Very low35.3Very low116 Ų116134.6 Ų134.675%0.75381%0.814SS**  cis-134.8-172.4-41.338.9-23000113.2
55K33.3Very low35Very low201 Ų201131.9 Ų131.987%0.87481%0.805SS**  trans-80.2160.6173.9-59.8174.7-179.7177.50112.4
56T32.8Very low33.9Very low140 Ų140136.1 Ų136.186%0.85981%0.808SS**  trans-116.9126.116838.20000112.2
57D27.1Very low32.6Very low159 Ų159136 Ų13685%0.8581%0.808SS**  trans-86.5161.7159-93.9-80.4000110.2
58M41.1Very low32.6Very low189 Ų189134.1 Ų134.193%0.93181%0.808SS**  trans-137.5140.8175.1-110-175.3168.400111.8
59T36.6Very low32.4Very low134 Ų134134 Ų13482%0.82280%0.797SS**  trans-140118.8-171.9-75.30000112.2
60A29.2Very low32.5Very low84 Ų84137 Ų13769%0.69479%0.793SS**  trans50.6138.5143.300000124.5
61S30.2Very low32.4Very low127 Ų127140.4 Ų140.489%0.88879%0.787SS**  trans90.7145139-61.90000122.6
62G27.6Very low32.4Very low67 Ų67143 Ų14369%0.69179%0.786SS**  trans99.7109.3173.500000113.9
63T27.2Very low32Very low135 Ų135144.9 Ų144.983%0.82879%0.789SS**  cis98.6138.816.2-43.90000114.9
64Q31.1Very low32.3Very low170 Ų170142.9 Ų142.979%0.79479%0.786SS**  trans88.7146.2-179.2-58.3-107.8-99.800116.6
65D28.6Very low31.7Very low123 Ų123144.9 Ų144.966%0.65879%0.79SS**  cis-171.5146.2-30-147.4-76.4000110.8
66Y27.9Very low32.1Very low206 Ų206141.1 Ų141.181%0.80879%0.786SS**  trans174.5139.3130.8-129.5-111.3000116.5
67S27.4Very low32.3Very low91 Ų91140.5 Ų140.564%0.63678%0.784SS**  trans48.5114.9158.156.60000121.1
68Q29.8Very low32.4Very low182 Ų182141.5 Ų141.585%0.8578%0.784SS**  87117.461.2-153.1-169.364.100113.4
69T28.3Very low31.8Very low100 Ų100141.8 Ų141.861%0.61378%0.783SS**  -173.8151.579.739.60000115.9
70H32Very low31.4Very low169 Ų169143.5 Ų143.578%0.78278%0.781SS**  trans71.7125147.1-64-40.6000127
71K30.3Very low31.1Very low179 Ų179149.5 Ų149.578%0.77879%0.786SS**  trans82101.7138-76.4-169175.4-177.70124.8
72I34.5Very low31.1Very low152 Ų152149 Ų14978%0.77977%0.773SS**  59.8127.8119.2-59.4166.6000121.3
73N36.5Very low31Very low155 Ų155152.7 Ų152.783%0.82978%0.776SS**  trans-73.3158.5171.9-71.4-5.3000115.7
74P39.5Very low31Very low121 Ų121153.8 Ų153.879%0.78677%0.772SS**  trans-128.8168.714137.7-26.3000114.5
75L33.9Very low31.5Very low158 Ų158151.1 Ų151.183%0.82777%0.769SS**PPolyproline II helixtrans-86.9161.2172.1-76.677.6000111.7
76P41.6Very low31.4Very low122 Ų122151.3 Ų151.379%0.79278%0.775SS**PPolyproline II helixtrans-76150.6163.833-34.6000112.2
77P37.1Very low31.4Very low128 Ų128152.2 Ų152.283%0.83178%0.777SS**PPolyproline II helixtrans-96.1158.3-171.836.8-36.4000115.5
78Q31Very low31.3Very low179 Ų179154.9 Ų154.984%0.83679%0.789SS**PPolyproline II helixtrans-90.2152.4151.7-81.1-172.9-36.600110.1
79Q27.5Very low31.2Very low195 Ų195153 Ų15391%0.91178%0.784SS**  trans-158.8143.5132.4-126.4168.4-19.100113.2
80E27.9Very low31.2Very low170 Ų170154.6 Ų154.679%0.79479%0.794SS**  trans-81.5-178168.5-62.8172.3105.200109
81W24.3Very low31Very low211 Ų211153.4 Ų153.480%0.79979%0.786SS**  cis-174159.141.860.8-55.7000112.7
82I29.7Very low31.1Very low117 Ų117155.5 Ų155.560%0.679%0.789SS**  trans65.5124.6155.2-130.9161.8000117.6
83N25.1Very low30.7Very low143 Ų143154.9 Ų154.977%0.76578%0.783SS**  -157.2162.860-111.2-51.2000114.3
84Q28Very low30Very low159 Ų159158.2 Ų158.274%0.74379%0.786SS**  trans-133.9143.2171.4-97.6-102.3-600107.8
85P39.7Very low29.4Very low113 Ų113159.9 Ų159.973%0.73478%0.783SS**  -137.2179.379.232.9-12.3000111.8
86V26.6Very low29.1Very low127 Ų127159.4 Ų159.477%0.7778%0.776SS**  cis-146.1154.945.3168.80000111.8
87R28.5Very low28.5Very low226 Ų226161.6 Ų161.685%0.85378%0.778SS**  trans-92.7156.7-176.2-32.8-179.5-164.3-133.66.8112.6
88V25.9Very low28Very low147 Ų147162.8 Ų162.889%0.89178%0.777SS**  -144.8134.4126.1-104.30000110
89N27.1Very low27.9Very low142 Ų142157.1 Ų157.176%0.75977%0.767SS**  trans-124.9124.4171.2171.134.9000107.2K91N89-K91 PolarHBondContact O-N 3.37Å
90V28.3Very low28Very low133 Ų133153 Ų15381%0.80676%0.759SS**  trans-101.276.1-179.3-172.80000109.9
91K28.5Very low28.1Very low144 Ų144149.6 Ų149.663%0.62675%0.754SS**  trans-90.3109.9153.9-174.1-164.5179-1610106.7N89 E93N89-K91 PolarHBondContact O-N 3.37Å; K91-E93 HydrophobicContact CD-CG 4.18Å; K91-E93 WeakPolarHBondContact CE-OE1 3.49Å; K91-E93 HydrophobicContact CG-CG 4.41Å; K91-E93 IonicContact NZ-OE1 3.2Å; K91-E93 PolarHBondContact NZ-OE1 2.84Å
92R32.9Very low28.5Very low224 Ų224150.8 Ų150.885%0.84576%0.759SS**  trans-94.2120.5166.5-178.5173.8-69.4178.6-0108.3
93E24.9Very low28.6Very low139 Ų139154.2 Ų154.265%0.6577%0.772SS**  trans-83.3156.9174.8-70.9160.8152.100110.3K91K91-E93 HydrophobicContact CD-CG 4.18Å; K91-E93 WeakPolarHBondContact CE-OE1 3.49Å; K91-E93 HydrophobicContact CG-CG 4.41Å; K91-E93 IonicContact NZ-OE1 3.2Å; K91-E93 PolarHBondContact NZ-OE1 2.84Å
94Y23.2Very low29.1Very low224 Ų224152.7 Ų152.788%0.87877%0.773SS**  trans-133.6129-178.9-137.2-76.1000106.8
95E25.7Very low30.1Very low156 Ų156150.9 Ų150.973%0.72978%0.775SS**  trans-134.1158.8177.7-86.2-147.3144.800111.7
96H28.6Very low30.1Very low149 Ų149151.7 Ų151.769%0.6978%0.778SS**  trans75.3107.4168-72.689.2000119.8
97M27.9Very low30.2Very low167 Ų167153.3 Ų153.382%0.82378%0.782SS**  trans72.3112.6144.9-133.968.67700117
98N27.3Very low30.6Very low154 Ų154148 Ų14882%0.82478%0.778SS**  -175146.159.3178.625.7000112.1
99G27.7Very low31Very low59 Ų59147.1 Ų147.161%0.60878%0.778SS**  trans84.591.113300000122.1
100S30.1Very low31.4Very low109 Ų109147.6 Ų147.676%0.76279%0.786SS**  trans78.9128.3133-162.10000122.3
101S30.7Very low31.7Very low98 Ų98144.8 Ų144.869%0.68578%0.784SS**  trans68.7137.8148.7-62.20000118.8
102R32.7Very low31.9Very low236 Ų236148.1 Ų148.189%0.89180%0.798SS**  cis-152.3139.84.3-123.5169-177.5-178.9-1.1109.4
103E31.3Very low32Very low189 Ų189142.7 Ų142.788%0.88379%0.793SS**  trans-83.8159.7-178.7-69.9150.1106.200113.4
104S35.8Very low32.1Very low112 Ų112143.2 Ų143.278%0.78380%0.801SS**  trans-121.1107.3167.7173.70000109.1
105P48.2Very low32.6Very low120 Ų120141.2 Ų141.278%0.77980%0.796SS**  trans-81.3128.3172.9-11.929.3000111.3
106V40.5Very low33Very low131 Ų131140.6 Ų140.679%0.79480%0.797SS**  trans-91.3146.9152.2-67.30000107.8
107D29.3Very low33.1Very low160 Ų160140 Ų14086%0.85680%0.804SS**  trans-153.2145.8154.6-130.7-31.9000112.2
108C36.6Very low33.1Very low116 Ų116135.5 Ų135.578%0.78480%0.801SS**  trans-121.5137.4-177.1-75.20000109.7
109S33.7Very low33.2Very low127 Ų127132.6 Ų132.689%0.88880%0.798SS**  trans-150.4150.6171.5-870000113
110V36.5Very low33.3Very low153 Ų153136.7 Ų136.793%0.92781%0.806SS**  trans-110.8140.3-161.31750000111.9
111G33.2Very low33.3Very low73 Ų73137.9 Ų137.975%0.75380%0.804SS**  trans-129.312.2-159.700000120.8
112K32.6Very low33.5Very low214 Ų214139 Ų13993%0.9381%0.806SS**  trans61-178.3170.5-90.7177.6176174.90117.8
113C35Very low33.5Very low110 Ų110133.3 Ų133.374%0.74380%0.803SS**  trans-153.5141.2-163.3175.50000112.5
114N27.8Very low33.7Very low151 Ų151133.3 Ų133.381%0.80780%0.803SS**  trans173.2116.3134.8-97.7-10.6000116
115K33.4Very low33.7Very low181 Ų181136.7 Ų136.779%0.78781%0.809SS**  41.8149.3123.6-146.3-174.9179.6-179.80123.9
116L34.6Very low33.1Very low143 Ų143138 Ų13875%0.74982%0.815SS**  trans94.6141.4160.5-51.8175.1000116
117V30.7Very low32.6Very low137 Ų137142 Ų14283%0.8382%0.817SS**  cis-158151.6-8.9114.50000113.1
118G27.4Very low32.7Very low73 Ų73137 Ų13775%0.75380%0.803SS**  trans85.1163.315800000118.2
119A29.3Very low32.2Very low92 Ų92135.8 Ų135.876%0.7680%0.796SS**  cis-171.9142.5-24.700000109.3
120N29.8Very low32.1Very low146 Ų146140.5 Ų140.578%0.78180%0.796SS**  trans59159-173.9-83.139.6000115.6
121D30.8Very low32.4Very low133 Ų133140.7 Ų140.771%0.71179%0.789SS**  cis-136.3-172.82.9-140.2-52.8000113
122T34Very low32.4Very low121 Ų121144.4 Ų144.474%0.74279%0.791SS**  trans-91126.3-162.5-45.20000113.1
123S32.2Very low32.4Very low118 Ų118142.7 Ų142.783%0.82579%0.787SS**  trans-169.5131.7151-85.70000112.2
124Q35.8Very low32.3Very low188 Ų188146 Ų14688%0.87979%0.789SS**  trans-82.2127.9164-66.1175.5-91.300109.6
125M36.3Very low32.6Very low184 Ų184146.3 Ų146.391%0.90679%0.79SS**  trans-144.7129.5153.9-82.4-57.6150.200110.5Y127M125-Y127 PolarHBondContact O-N 3.33Å
126T35.9Very low32.8Very low148 Ų148141.6 Ų141.691%0.90879%0.785SS**  trans-80.4108.7178.3-57.60000109.8
127Y28.7Very low32.8Very low214 Ų214140.4 Ų140.484%0.83979%0.786SS**  trans-89.4108.9177.8-155.7-90.3000111.4M125 S129M125-Y127 PolarHBondContact O-N 3.33Å; Y127-S129 PolarHBondContact O-N 3.49Å
128G31.9Very low33.1Very low55 Ų55139.3 Ų139.357%0.56778%0.781SS**  trans-75.1111.3171.800000110.8Y130G128-Y130 PolarHBondContact O-N 3.01Å
129S26Very low33.3Very low91 Ų91141.1 Ų141.164%0.63678%0.78SS**  trans-75.390.7177.3-170.90000110.9Y127 M131Y127-S129 PolarHBondContact O-N 3.49Å; S129-M131 PolarHBondContact O-N 3.44Å
130Y32.3Very low33.6Very low225 Ų225143.7 Ų143.788%0.88278%0.781SS**  trans-58.2129.5163.1-90.9-100.7000109.8G128G128-Y130 PolarHBondContact O-N 3.01Å
131M43Very low33.4Very low157 Ų157143.6 Ų143.677%0.77378%0.778SS**  trans-91.4120.3165-65.3-62.8179.200108S129 E133S129-M131 PolarHBondContact O-N 3.44Å; M131-E133 PolarHBondContact O-N 2.85Å; M131-E133 VanDerWaalsContact O-N 3.14Å
132D33.3Very low33.6Very low151 Ų151142.8 Ų142.881%0.80778%0.778SS**  trans-77.690.9173.5-173.4-112.7000108.7K134D132-K134 PolarHBondContact O-N 2.97Å
133E32.9Very low33.6Very low178 Ų178141.1 Ų141.183%0.83277%0.768SS**  trans-78.375.8-179.5-160.6169.7130.700110.7M131 N135M131-E133 PolarHBondContact O-N 2.85Å; M131-E133 VanDerWaalsContact O-N 3.14Å; E133-N135 PolarHBondContact O-N 3.48Å; E133-N135 PolarHBondContact O-OD1 3.29Å
134K32.5Very low33.4Very low180 Ų180143.6 Ų143.678%0.78377%0.772SS**  trans-60101.7179.1179.7-179.9178.3176.90111.5D132 A136D132-K134 PolarHBondContact O-N 2.97Å; K134-A136 PolarHBondContact O-N 3.38Å
135N34.3Very low33.2Very low157 Ų157142.5 Ų142.584%0.8477%0.766SS**  trans-42.4104.9178.7-71.512.5000113.7E133E133-N135 PolarHBondContact O-N 3.48Å; E133-N135 PolarHBondContact O-OD1 3.29Å
136A36.3Very low33.2Very low83 Ų83143.8 Ų143.869%0.68676%0.761SS**PPolyproline II helixtrans-89.2138.1155.700000108.5K134K134-A136 PolarHBondContact O-N 3.38Å
137P35.8Very low33.3Very low118 Ų118144.9 Ų144.977%0.76675%0.749SS**PPolyproline II helixtrans-63.3136.3170.927.7-33.3000109.2
138P36.5Very low33.7Very low113 Ų113136.3 Ų136.373%0.73472%0.718SS**PPolyproline II helixtrans-64.2146.5-178.226.2-34.3000111.1N140P138-N140 PolarHBondContact O-N 2.84Å
139P32.2Very low34.4Very low112 Ų112137.1 Ų137.173%0.72771%0.709SS**PPolyproline II helixtrans-61.2135.4173.927.2-34.1000109.9M141P139-M141 VanDerWaalsContact C-N 3.33Å; P139-M141 PolarHBondContact O-N 3.17Å
140N36.3Very low35.5Very low145 Ų145132.8 Ų132.878%0.77568%0.679SS**  trans-74.480.6-171.1-1662.8000111.6P138 T142P138-N140 PolarHBondContact O-N 2.84Å; N140-T142 VanDerWaalsContact C-N 3.34Å; N140-T142 PolarHBondContact O-N 3.22Å
141M25.2Very low36.7Very low145 Ų145123 Ų12371%0.71464%0.643SS**  trans-74.780-179.4-79-169.563.300112.2P139 T143P139-M141 VanDerWaalsContact C-N 3.33Å; P139-M141 PolarHBondContact O-N 3.17Å; M141-T143 PolarHBondContact O-N 3.21Å
142T35Very low37.4Very low116 Ų116117.3 Ų117.371%0.71262%0.621SS**  trans-76.661.9172.558.30000112N140N140-T142 VanDerWaalsContact C-N 3.34Å; N140-T142 PolarHBondContact O-N 3.22Å
143T33Very low39.4Very low86 Ų86112.4 Ų112.453%0.52860%0.595SS.*  trans-126.535.2177.563.70000112.7M141 E145M141-T143 PolarHBondContact O-N 3.21Å; T143-E145 PolarHBondContact O-N 2.87Å
144N27.9Very low41.7Very low170 Ų170104 Ų10491%0.90956%0.555SS**  trans-77.267.5165.9-91.6-38.7000110R146N144-R146 VanDerWaalsContact C-N 3.31Å; N144-R146 PolarHBondContact O-N 2.93Å
145E31.5Very low44.2Very low164 Ų16497.3 Ų97.377%0.76653%0.531SS*.  trans-75.683.3-178.4-69.2-172-149.200111.6T143 R147T143-E145 PolarHBondContact O-N 2.87Å; E145-R147 PolarHBondContact O-N 2.88Å
146R36.8Very low46.4Very low212 Ų21294.9 Ų94.980%0.852%0.518SS*.  trans46.355.6157.2-160.9-178.3-70.7-102.6-1.7115.4N144N144-R146 VanDerWaalsContact C-N 3.31Å; N144-R146 PolarHBondContact O-N 2.93Å
147R37.6Very low48.8Very low171 Ų17191.2 Ų91.265%0.64549%0.486SS*.  trans-88.2101.9163.5-63.6-172.8177.7176.2-2.9109.2T6 E145 I149T6-R147 HydrophobicContact CG2-CB 4.38Å; T6-R147 HydrophobicContact CG2-CG 3.7Å; E145-R147 PolarHBondContact O-N 2.88Å; R147-I149 PolarHBondContact O-N 3.23Å
148V37.8Very low51.2Low33 Ų3387.6 Ų87.620%0.246%0.463CS..  trans-72.9125.5172-175.30000108.4V150 Q164V148-V150 HydrophobicContact CG1-CG2 3.6Å; V148-Q164 HydrophobicContact CB-CB 4.49Å; V148-Q164 HydrophobicContact CG1-CB 3.71Å; V148-Q164 HydrophobicContact CG1-CG 4.15Å; V148-Q164 HydrophobicContact CG2-CB 4.15Å; V148-Q164 HydrophobicContact CG2-CG 4.27Å
149I46.8Very low53.6Low72 Ų7286.5 Ų86.537%0.36945%0.449SS..EExtended strand (participates in β ladder)trans-105.7121.6176.8-39.6-178.3000107.3W2 R147 H161W2-I149 HydrophobicContact CB-CG2 3.61Å; W2-I149 HydrophobicContact CD2-CG2 3.86Å; W2-I149 HydrophobicContact CE3-CB 4.06Å; W2-I149 HydrophobicContact CE3-CG2 3.52Å; W2-I149 HydrophobicContact CG-CG2 3.97Å; W2-I149 HydrophobicContact CZ3-CB 4.44Å; W2-I149 HydrophobicContact CZ3-CG2 4.35Å; R147-I149 PolarHBondContact O-N 3.23Å; I149-H161 PolarHBondContact O-NE2 2.94Å
150V49.7Very low56Low1 Ų186.3 Ų86.31%0.00644%0.441CS..EExtended strand (participates in β ladder)trans-126.5145.4-171.9-174.30000109.2A3 V148 W157 H161A3-V150 WeakPolarHBondContact CA-O 3.48Å; A3-V150 WeakPolarHBondContact CB-O 3.45Å; A3-V150 PolarHBondContact N-O 2.92Å; A3-V150 PolarHBondContact O-N 2.89Å; V148-V150 HydrophobicContact CG1-CG2 3.6Å; V150-W157 HydrophobicContact CG1-CD2 4.01Å; V150-W157 HydrophobicContact CG1-CG 4.02Å; V150-W157 HydrophobicContact CG1-CZ2 4.12Å; V150-H161 HydrophobicContact CG1-CB 4Å
151P55.6Low58.2Low19 Ų1981 Ų8112%0.12341%0.412CS..EExtended strand (participates in β ladder)trans-56142.5171.8-26.235.4000112.6D153 L156 W157P151-D153 VanDerWaalsContact C-N 3.28Å; P151-D153 PolarHBondContact O-N 3.43Å; P151-L156 HydrophobicContact CB-CB 3.82Å; P151-L156 HydrophobicContact CG-CB 4.33Å; P151-W157 PolarHBondContact O-NE1 2.99Å
152A59.2Low61.2Low38 Ų3874.1 Ų74.131%0.31438%0.378SS..SBendtrans-72.1-18.4-17600000114.5M1 A3M1-A152 PolarHBondContact O-N 2.97Å; A3-A152 HydrophobicContact CB-CB 4.12Å
153D74.4Confident63.6Low48 Ų4873.1 Ų73.126%0.25736%0.361SS..SBendtrans-100.8121.6170.5169.618000109.3P151 S155 L156 W157P151-D153 VanDerWaalsContact C-N 3.28Å; P151-D153 PolarHBondContact O-N 3.43Å; D153-S155 PolarHBondContact O-N 2.67Å; D153-S155 WeakPolarHBondContact OD1-CB 3.46Å; D153-S155 PolarHBondContact OD1-N 2.87Å; D153-S155 PolarHBondContact OD1-OG 3.2Å; D153-S155 WeakPolarHBondContact OD2-CB 3.37Å; D153-S155 PolarHBondContact OD2-OG 2.64Å; D153-L156 HydrophobicContact CB-CD1 4.14Å; D153-L156 HydrophobicContact CB-CG 4.15Å; D153-L156 PolarHBondContact O-N 3.14Å; D153-W157 PolarHBondContact O-NE1 2.87Å
154P81.4Confident65.9Low0 Ų072.2 Ų72.20%035%0.351CS..G310 helixtrans-53.7-27.6173.3-28.337.5000115.4L156 W157 G188 C192 L215 L218 R219P154-L156 PolarHBondContact O-N 3.41Å; P154-L156 VanDerWaalsContact O-N 3.13Å; P154-W157 HydrophobicContact CB-CD2 4.26Å; P154-W157 HydrophobicContact CB-CE3 4.48Å; P154-W157 HydrophobicContact CB-CH2 4.31Å; P154-W157 HydrophobicContact CB-CZ2 4.09Å; P154-W157 HydrophobicContact CB-CZ3 4.49Å; P154-W157 HydrophobicContact CG-CH2 4.22Å; P154-W157 HydrophobicContact CG-CZ2 3.87Å; P154-W157 PolarHBondContact O-N 2.84Å; P154-G188 CarbonylContact O-C 3.43Å; P154-G188 WeakPolarHBondContact O-CA 3.42Å; P154-C192 VanDerWaalsContact CB-SG 3.59Å; P154-L215 HydrophobicContact CB-CD1 3.63Å; P154-L215 HydrophobicContact CG-CD1 4.03Å; P154-L218 HydrophobicContact CG-CB 3.58Å; P154-L218 HydrophobicContact CG-CD1 4.38Å; P154-R219 HydrophobicContact CG-CG 4.19Å
155S84.5Confident68.7Low41 Ų4164.4 Ų64.429%0.28731%0.309SS..G310 helixtrans-66.7-13177.296.50000114D153 K189D153-S155 PolarHBondContact O-N 2.67Å; D153-S155 WeakPolarHBondContact OD1-CB 3.46Å; D153-S155 PolarHBondContact OD1-N 2.87Å; D153-S155 PolarHBondContact OD1-OG 3.2Å; D153-S155 WeakPolarHBondContact OD2-CB 3.37Å; D153-S155 PolarHBondContact OD2-OG 2.64Å; S155-K189 WeakPolarHBondContact O-CE 3.35Å; S155-K189 WeakPolarHBondContact O-CG 3.29Å
156L81.9Confident71.4Confident106 Ų10656.6 Ų56.656%0.55527%0.272SS*.G310 helixtrans-102.44-179.4-57.1-179000113.7P151 D153 P154P151-L156 HydrophobicContact CB-CB 3.82Å; P151-L156 HydrophobicContact CG-CB 4.33Å; D153-L156 HydrophobicContact CB-CD1 4.14Å; D153-L156 HydrophobicContact CB-CG 4.15Å; D153-L156 PolarHBondContact O-N 3.14Å; P154-L156 PolarHBondContact O-N 3.41Å; P154-L156 VanDerWaalsContact O-N 3.13Å
157W86.4Confident73.7Confident6 Ų650 Ų502%0.02325%0.251CS..  trans-74.7140.4-178.3-63.40.5000112.3V150 P151 D153 P154 H161 V162 W165 G188 L191 L215 L218V150-W157 HydrophobicContact CG1-CD2 4.01Å; V150-W157 HydrophobicContact CG1-CG 4.02Å; V150-W157 HydrophobicContact CG1-CZ2 4.12Å; P151-W157 PolarHBondContact O-NE1 2.99Å; D153-W157 PolarHBondContact O-NE1 2.87Å; P154-W157 HydrophobicContact CB-CD2 4.26Å; P154-W157 HydrophobicContact CB-CE3 4.48Å; P154-W157 HydrophobicContact CB-CH2 4.31Å; P154-W157 HydrophobicContact CB-CZ2 4.09Å; P154-W157 HydrophobicContact CB-CZ3 4.49Å; P154-W157 HydrophobicContact CG-CH2 4.22Å; P154-W157 HydrophobicContact CG-CZ2 3.87Å; P154-W157 PolarHBondContact O-N 2.84Å; W157-H161 HydrophobicContact CB-CB 3.75Å; W157-H161 HydrophobicContact CG-CB 4.07Å; W157-V162 HydrophobicContact CB-CG2 4.1Å; W157-V162 HydrophobicContact CE3-CG2 4.15Å; W157-W165 HydrophobicContact CE3-CB 4.45Å; W157-W165 HydrophobicContact CE3-CG 4.46Å; W157-W165 HydrophobicContact CH2-CB 4.17Å; W157-W165 AromaticContact CH2-CD1 3.37Å; W157-W165 AromaticContact CH2-CD2 3.99Å; W157-W165 HydrophobicContact CH2-CD2 3.99Å; W157-W165 AromaticContact CH2-CE2 3.97Å; W157-W165 AromaticContact CH2-CG 3.6Å; W157-W165 HydrophobicContact CH2-CG 3.6Å; W157-W165 AromaticContact CH2-NE1 3.57Å; W157-W165 HydrophobicContact CZ3-CB 3.85Å; W157-W165 AromaticContact CZ3-CD1 3.73Å; W157-W165 AromaticContact CZ3-CD2 3.57Å; W157-W165 HydrophobicContact CZ3-CD2 3.57Å; W157-W165 AromaticContact CZ3-CE2 3.89Å; W157-W165 HydrophobicContact CZ3-CE3 4.11Å; W157-W165 AromaticContact CZ3-CG 3.45Å; W157-W165 HydrophobicContact CZ3-CG 3.45Å; W157-W165 VanDerWaalsContact CZ3-CG 3.45Å; W157-W165 AromaticContact CZ3-NE1 3.95Å; W157-G188 PolarHBondContact O-N 2.92Å; W157-L191 HydrophobicContact CE3-CD2 3.99Å; W157-L191 HydrophobicContact CZ3-CD2 3.91Å; W157-L215 HydrophobicContact CZ3-CD1 4.37Å; W157-L218 HydrophobicContact CH2-CD1 3.69Å; W157-L218 HydrophobicContact CZ2-CD1 3.89Å
158S85.3Confident75.9Confident41 Ų4144.6 Ų44.629%0.28723%0.23SC..  trans-84.5172164.470.90000111D160 H161 V162S158-D160 PolarHBondContact O-N 3.39Å; S158-D160 PolarHBondContact OG-N 3.37Å; S158-D160 PolarHBondContact OG-OD2 3.42Å; S158-D160 VanDerWaalsContact OG-OD2 3.1Å; S158-H161 PolarHBondContact N-ND1 2.87Å; S158-H161 WeakPolarHBondContact O-CB 3.37Å; S158-H161 PolarHBondContact O-N 2.94Å; S158-H161 PolarHBondContact OG-N 3.5Å; S158-H161 PolarHBondContact OG-ND1 3.19Å; S158-V162 WeakPolarHBondContact O-CG2 3.34Å; S158-V162 PolarHBondContact O-N 3.45Å
159Q87.1Confident78.2Confident91 Ų9143 Ų4343%0.42522%0.221SC..Hα-helixtrans-54.1-40173.3-71.5163.6-19.500112.2H161 V162 R163 N185 D187Q159-H161 VanDerWaalsContact C-N 3.34Å; Q159-H161 PolarHBondContact O-N 3.4Å; Q159-V162 PolarHBondContact O-N 3.01Å; Q159-R163 WeakPolarHBondContact O-CB 3.4Å; Q159-R163 PolarHBondContact O-N 3.23Å; Q159-N185 PolarHBondContact NE2-O 3.38Å; Q159-D187 HydrophobicContact CG-CB 4.41Å
160D82.3Confident80.1Confident107 Ų10741.7 Ų41.757%0.57221%0.214SC*.Hα-helixtrans-64.3-37.5175.3-40-92.7000112.5S158 Q164S158-D160 PolarHBondContact O-N 3.39Å; S158-D160 PolarHBondContact OG-N 3.37Å; S158-D160 PolarHBondContact OG-OD2 3.42Å; S158-D160 VanDerWaalsContact OG-OD2 3.1Å; D160-Q164 WeakPolarHBondContact O-CB 3.36Å; D160-Q164 VanDerWaalsContact O-CG 3.24Å; D160-Q164 WeakPolarHBondContact O-CG 3.45Å; D160-Q164 PolarHBondContact O-N 3.17Å; D160-Q164 PolarHBondContact O-NE2 3.06Å
161H82.8Confident81.6Confident34 Ų3450.2 Ų50.216%0.15725%0.251CS..Hα-helixtrans-69.7-43.4177.5-69.9112.7000111.1I149 V150 W157 S158 Q159 Q164 W165I149-H161 PolarHBondContact O-NE2 2.94Å; V150-H161 HydrophobicContact CG1-CB 4Å; W157-H161 HydrophobicContact CB-CB 3.75Å; W157-H161 HydrophobicContact CG-CB 4.07Å; S158-H161 PolarHBondContact N-ND1 2.87Å; S158-H161 WeakPolarHBondContact O-CB 3.37Å; S158-H161 PolarHBondContact O-N 2.94Å; S158-H161 PolarHBondContact OG-N 3.5Å; S158-H161 PolarHBondContact OG-ND1 3.19Å; Q159-H161 VanDerWaalsContact C-N 3.34Å; Q159-H161 PolarHBondContact O-N 3.4Å; H161-Q164 PolarHBondContact O-N 3.25Å; H161-W165 WeakPolarHBondContact O-CB 3.26Å; H161-W165 PolarHBondContact O-N 3.18Å
162V87.4Confident82.8Confident0 Ų052.7 Ų52.70%026%0.261CS..Hα-helixtrans-59.6-46.2172.51740000110.6W157 S158 Q159 Q164 W165 L166 T186 L191W157-V162 HydrophobicContact CB-CG2 4.1Å; W157-V162 HydrophobicContact CE3-CG2 4.15Å; S158-V162 WeakPolarHBondContact O-CG2 3.34Å; S158-V162 PolarHBondContact O-N 3.45Å; Q159-V162 PolarHBondContact O-N 3.01Å; V162-Q164 PolarHBondContact O-N 2.93Å; V162-W165 PolarHBondContact O-N 2.86Å; V162-L166 WeakPolarHBondContact O-CB 3.41Å; V162-L166 PolarHBondContact O-N 3.22Å; V162-T186 WeakPolarHBondContact CG2-O 3.47Å; V162-L191 HydrophobicContact CG1-CD1 4.37Å; V162-L191 HydrophobicContact CG1-CD2 4.17Å; V162-L191 HydrophobicContact CG2-CD2 4.11Å
163R85.9Confident83.7Confident95 Ų9553.8 Ų53.836%0.35826%0.257SS..Hα-helixtrans-58.5-49.9176.7-175.8-173.4173.482.819.4111.8Q159 L166 E167Q159-R163 WeakPolarHBondContact O-CB 3.4Å; Q159-R163 PolarHBondContact O-N 3.23Å; R163-L166 PolarHBondContact O-N 3.44Å; R163-E167 IonicContact CZ-OE1 2.84Å; R163-E167 IonicContact NE-OE1 2.72Å; R163-E167 PolarHBondContact NE-OE1 3.3Å; R163-E167 IonicContact NH2-OE1 3.58Å; R163-E167 PolarHBondContact NH2-OE1 3.48Å; R163-E167 PolarHBondContact O-N 2.81Å
164Q81.8Confident84.2Confident68 Ų6853.9 Ų53.932%0.31827%0.27SS..Hα-helixtrans-69.7-33.3-176.8-70.6167.4106.900112.4V148 D160 H161 V162 W168V148-Q164 HydrophobicContact CB-CB 4.49Å; V148-Q164 HydrophobicContact CG1-CB 3.71Å; V148-Q164 HydrophobicContact CG1-CG 4.15Å; V148-Q164 HydrophobicContact CG2-CB 4.15Å; V148-Q164 HydrophobicContact CG2-CG 4.27Å; D160-Q164 WeakPolarHBondContact O-CB 3.36Å; D160-Q164 VanDerWaalsContact O-CG 3.24Å; D160-Q164 WeakPolarHBondContact O-CG 3.45Å; D160-Q164 PolarHBondContact O-N 3.17Å; D160-Q164 PolarHBondContact O-NE2 3.06Å; H161-Q164 PolarHBondContact O-N 3.25Å; V162-Q164 PolarHBondContact O-N 2.93Å; Q164-W168 WeakPolarHBondContact O-CB 3.42Å; Q164-W168 PolarHBondContact O-N 3.13Å
165W86.9Confident84.3Confident5 Ų554.1 Ų54.12%0.01927%0.271CS..Hα-helixtrans-62.6-42.2168.816984.1000111.7W157 H161 V162 W168 A169 L191 L211 H214 L215W157-W165 HydrophobicContact CE3-CB 4.45Å; W157-W165 HydrophobicContact CE3-CG 4.46Å; W157-W165 HydrophobicContact CH2-CB 4.17Å; W157-W165 AromaticContact CH2-CD1 3.37Å; W157-W165 AromaticContact CH2-CD2 3.99Å; W157-W165 HydrophobicContact CH2-CD2 3.99Å; W157-W165 AromaticContact CH2-CE2 3.97Å; W157-W165 AromaticContact CH2-CG 3.6Å; W157-W165 HydrophobicContact CH2-CG 3.6Å; W157-W165 AromaticContact CH2-NE1 3.57Å; W157-W165 HydrophobicContact CZ3-CB 3.85Å; W157-W165 AromaticContact CZ3-CD1 3.73Å; W157-W165 AromaticContact CZ3-CD2 3.57Å; W157-W165 HydrophobicContact CZ3-CD2 3.57Å; W157-W165 AromaticContact CZ3-CE2 3.89Å; W157-W165 HydrophobicContact CZ3-CE3 4.11Å; W157-W165 AromaticContact CZ3-CG 3.45Å; W157-W165 HydrophobicContact CZ3-CG 3.45Å; W157-W165 VanDerWaalsContact CZ3-CG 3.45Å; W157-W165 AromaticContact CZ3-NE1 3.95Å; H161-W165 WeakPolarHBondContact O-CB 3.26Å; H161-W165 PolarHBondContact O-N 3.18Å; V162-W165 PolarHBondContact O-N 2.86Å; W165-W168 PolarHBondContact O-N 3.37Å; W165-A169 WeakPolarHBondContact O-CB 3.45Å; W165-A169 PolarHBondContact O-N 2.98Å; W165-L191 HydrophobicContact CE3-CD2 4.18Å; W165-L191 HydrophobicContact CH2-CD2 4.24Å; W165-L191 HydrophobicContact CZ3-CD1 4.28Å; W165-L191 HydrophobicContact CZ3-CD2 3.85Å; W165-L211 HydrophobicContact CH2-CB 4Å; W165-L211 HydrophobicContact CH2-CD2 3.76Å; W165-L211 HydrophobicContact CH2-CG 4.4Å; W165-L211 HydrophobicContact CZ2-CD2 4.19Å; W165-L211 HydrophobicContact CZ3-CD2 4.09Å; W165-H214 AromaticContact CE2-ND1 3.88Å; W165-H214 AromaticContact NE1-CE1 3.41Å; W165-H214 PolarHBondContact NE1-CE1 2.9Å; W165-H214 AromaticContact NE1-ND1 3.1Å; W165-H214 PolarHBondContact NE1-ND1 3.27Å; W165-L215 HydrophobicContact CZ2-CB 4.31Å
166L87.9Confident84.1Confident1 Ų158.8 Ų58.81%0.00529%0.292CS..Hα-helixtrans-68-44.7178.2-170.267.3000112.1V162 R163 W168 A169 I170 I178 T180 F183 L211V162-L166 WeakPolarHBondContact O-CB 3.41Å; V162-L166 PolarHBondContact O-N 3.22Å; R163-L166 PolarHBondContact O-N 3.44Å; L166-W168 VanDerWaalsContact C-N 3.28Å; L166-W168 PolarHBondContact O-N 3.13Å; L166-A169 PolarHBondContact O-N 3.03Å; L166-I170 HydrophobicContact CG-CD1 4.12Å; L166-I170 WeakPolarHBondContact O-CB 3.28Å; L166-I170 WeakPolarHBondContact O-CD1 3.11Å; L166-I170 VanDerWaalsContact O-CG1 3.26Å; L166-I170 WeakPolarHBondContact O-CG1 3.25Å; L166-I170 PolarHBondContact O-N 3.26Å; L166-I178 HydrophobicContact CD1-CG2 4.13Å; L166-I178 HydrophobicContact CD2-CG2 4.13Å; L166-I178 HydrophobicContact CG-CG2 4.3Å; L166-T180 HydrophobicContact CD2-CG2 4.23Å; L166-F183 HydrophobicContact CD2-CB 3.76Å; L166-F183 HydrophobicContact CD2-CD1 4.42Å; L166-F183 HydrophobicContact CD2-CD2 3.51Å; L166-F183 HydrophobicContact CD2-CE2 4.19Å; L166-F183 HydrophobicContact CD2-CG 3.64Å; L166-L211 HydrophobicContact CD1-CD1 3.8Å; L166-L211 HydrophobicContact CD1-CD2 3.87Å
167E84.6Confident83.9Confident74 Ų7462.1 Ų62.135%0.34630%0.304SS..Hα-helixtrans-58.3-39.3173.1-75.6-177.2-173.500112R163 K171R163-E167 IonicContact CZ-OE1 2.84Å; R163-E167 IonicContact NE-OE1 2.72Å; R163-E167 PolarHBondContact NE-OE1 3.3Å; R163-E167 IonicContact NH2-OE1 3.58Å; R163-E167 PolarHBondContact NH2-OE1 3.48Å; R163-E167 PolarHBondContact O-N 2.81Å; E167-K171 PolarHBondContact O-N 3.46Å
168W84.8Confident83.7Confident56 Ų5662.9 Ų62.921%0.21231%0.309CS..Hα-helixtrans-67.8-47.1173.4168.778.7000111.9W5 Q164 W165 L166 I170 K171 E172 Y173 H214W5-W168 HydrophobicContact CE3-CD2 4.35Å; W5-W168 HydrophobicContact CE3-CH2 4.39Å; W5-W168 HydrophobicContact CE3-CZ2 4.15Å; W5-W168 HydrophobicContact CZ3-CE3 4.47Å; W5-W168 AromaticContact CZ3-CH2 3.88Å; W5-W168 HydrophobicContact CZ3-CH2 3.88Å; W5-W168 HydrophobicContact CZ3-CZ2 4.04Å; W5-W168 HydrophobicContact CZ3-CZ3 4.14Å; Q164-W168 WeakPolarHBondContact O-CB 3.42Å; Q164-W168 PolarHBondContact O-N 3.13Å; W165-W168 PolarHBondContact O-N 3.37Å; L166-W168 VanDerWaalsContact C-N 3.28Å; L166-W168 PolarHBondContact O-N 3.13Å; W168-I170 PolarHBondContact O-N 3.12Å; W168-K171 CarbonylContact O-C 3.46Å; W168-K171 WeakPolarHBondContact O-CA 3.44Å; W168-K171 WeakPolarHBondContact O-CB 3.28Å; W168-K171 PolarHBondContact O-N 2.93Å; W168-E172 HydrophobicContact CD2-CB 4.37Å; W168-E172 HydrophobicContact CH2-CB 4.38Å; W168-E172 HydrophobicContact CH2-CG 4.38Å; W168-E172 HydrophobicContact CZ2-CB 3.8Å; W168-E172 HydrophobicContact CZ2-CG 3.6Å; W168-E172 PolarHBondContact NE1-OE2 3Å; W168-E172 WeakPolarHBondContact O-CB 3.5Å; W168-E172 PolarHBondContact O-N 3.23Å; W168-Y173 AromaticContact CH2-CE2 3.78Å; W168-Y173 HydrophobicContact CH2-CE2 3.78Å; W168-Y173 AromaticContact CZ3-CE2 3.83Å; W168-Y173 HydrophobicContact CZ3-CE2 3.83Å; W168-H214 AromaticContact CH2-CE1 3.51Å; W168-H214 AromaticContact CH2-NE2 3.91Å; W168-H214 AromaticContact CZ3-CE1 3.15Å; W168-H214 WeakPolarHBondContact CZ3-CE1 3.48Å; W168-H214 AromaticContact CZ3-ND1 3.52Å
169A85.3Confident83.4Confident0 Ų064.8 Ų64.80%032%0.316CS..Hα-helixtrans-64.1-39.2-177.100000112.3W165 L166 K171 Y173 L211W165-A169 WeakPolarHBondContact O-CB 3.45Å; W165-A169 PolarHBondContact O-N 2.98Å; L166-A169 PolarHBondContact O-N 3.03Å; A169-K171 VanDerWaalsContact C-N 3.29Å; A169-K171 PolarHBondContact O-N 3.22Å; A169-Y173 HydrophobicContact CB-CD2 4.17Å; A169-Y173 HydrophobicContact CB-CE2 4.45Å; A169-Y173 WeakPolarHBondContact O-CB 3.2Å; A169-Y173 WeakPolarHBondContact O-CD2 3.14Å; A169-Y173 PolarHBondContact O-N 3.25Å; A169-L211 HydrophobicContact CB-CD2 3.72Å
170I86.3Confident83.2Confident45 Ų4562.4 Ų62.423%0.23131%0.307CS..Hα-helixtrans-54.5-46.6170.1-73.3163.3000110.7L166 W168 G174 L175 I178 T180L166-I170 HydrophobicContact CG-CD1 4.12Å; L166-I170 WeakPolarHBondContact O-CB 3.28Å; L166-I170 WeakPolarHBondContact O-CD1 3.11Å; L166-I170 VanDerWaalsContact O-CG1 3.26Å; L166-I170 WeakPolarHBondContact O-CG1 3.25Å; L166-I170 PolarHBondContact O-N 3.26Å; W168-I170 PolarHBondContact O-N 3.12Å; I170-G174 CarbonylContact O-C 3.36Å; I170-G174 VanDerWaalsContact O-CA 3.27Å; I170-G174 WeakPolarHBondContact O-CA 3.4Å; I170-G174 PolarHBondContact O-N 3.43Å; I170-G174 VanDerWaalsContact O-N 3.1Å; I170-L175 PolarHBondContact O-N 2.82Å; I170-I178 HydrophobicContact CD1-CB 3.9Å; I170-I178 HydrophobicContact CD1-CG2 3.92Å; I170-I178 HydrophobicContact CG1-CB 4.04Å; I170-I178 HydrophobicContact CG1-CD1 3.9Å; I170-I178 HydrophobicContact CG1-CG1 4.33Å; I170-I178 HydrophobicContact CG1-CG2 4.34Å; I170-T180 HydrophobicContact CD1-CG2 3.65Å
171K81.9Confident83.2Confident179 Ų17960 Ų6078%0.77830%0.3SS*.Hα-helixtrans-74.6-40.5-176.6-172.9-173.7174.7-169.20113.5E167 W168 A169E167-K171 PolarHBondContact O-N 3.46Å; W168-K171 CarbonylContact O-C 3.46Å; W168-K171 WeakPolarHBondContact O-CA 3.44Å; W168-K171 WeakPolarHBondContact O-CB 3.28Å; W168-K171 PolarHBondContact O-N 2.93Å; A169-K171 VanDerWaalsContact C-N 3.29Å; A169-K171 PolarHBondContact O-N 3.22Å
172E79.8Confident83.1Confident72 Ų7262.9 Ų62.934%0.33631%0.314SS..Hα-helixtrans-79.3-42.1-173.6-160.985.7-148.300111.8W168W168-E172 HydrophobicContact CD2-CB 4.37Å; W168-E172 HydrophobicContact CH2-CB 4.38Å; W168-E172 HydrophobicContact CH2-CG 4.38Å; W168-E172 HydrophobicContact CZ2-CB 3.8Å; W168-E172 HydrophobicContact CZ2-CG 3.6Å; W168-E172 PolarHBondContact NE1-OE2 3Å; W168-E172 WeakPolarHBondContact O-CB 3.5Å; W168-E172 PolarHBondContact O-N 3.23Å
173Y80.1Confident82.9Confident61 Ų6163 Ų6324%0.23931%0.314CS..Hα-helixtrans-93.2-2.5178.5-57.2-67.6000113.7W168 A169 V210W168-Y173 AromaticContact CH2-CE2 3.78Å; W168-Y173 HydrophobicContact CH2-CE2 3.78Å; W168-Y173 AromaticContact CZ3-CE2 3.83Å; W168-Y173 HydrophobicContact CZ3-CE2 3.83Å; A169-Y173 HydrophobicContact CB-CD2 4.17Å; A169-Y173 HydrophobicContact CB-CE2 4.45Å; A169-Y173 WeakPolarHBondContact O-CB 3.2Å; A169-Y173 WeakPolarHBondContact O-CD2 3.14Å; A169-Y173 PolarHBondContact O-N 3.25Å; Y173-V210 HydrophobicContact CD1-CG1 4.13Å; Y173-V210 HydrophobicContact CD2-CG1 3.63Å; Y173-V210 HydrophobicContact CE2-CG1 4.1Å; Y173-V210 HydrophobicContact CG-CG1 3.65Å
174G83.1Confident82.7Confident50 Ų5063.8 Ų63.852%0.51532%0.322SS..THydrogen-bonded Turntrans68.230.917900000114.1I170 L176I170-G174 CarbonylContact O-C 3.36Å; I170-G174 VanDerWaalsContact O-CA 3.27Å; I170-G174 WeakPolarHBondContact O-CA 3.4Å; I170-G174 PolarHBondContact O-N 3.43Å; I170-G174 VanDerWaalsContact O-N 3.1Å; G174-L176 PolarHBondContact O-N 3.05Å
175L84.9Confident82.9Confident5 Ų567 Ų673%0.02634%0.341CS..  trans-70.8114.2-172.5-49.6179.6000110.8I170 I178 Y206 V210 L211I170-L175 PolarHBondContact O-N 2.82Å; L175-I178 HydrophobicContact CB-CD1 3.58Å; L175-I178 HydrophobicContact CB-CG1 4.16Å; L175-I178 HydrophobicContact CD1-CD1 3.61Å; L175-I178 HydrophobicContact CG-CD1 4.23Å; L175-Y206 HydrophobicContact CD2-CD1 4.4Å; L175-Y206 HydrophobicContact CD2-CE1 3.89Å; L175-V210 HydrophobicContact CD1-CG1 4.28Å; L175-V210 HydrophobicContact CD2-CB 4.26Å; L175-V210 HydrophobicContact CD2-CG1 4.16Å; L175-V210 HydrophobicContact CD2-CG2 4.29Å; L175-L211 HydrophobicContact CD1-CD2 4.08Å; L175-L211 HydrophobicContact CD1-CG 4.21Å
176L80.4Confident82.9Confident139 Ų13967.7 Ų67.773%0.72835%0.347SS*.  trans-83.7157176.1-57.3179.8000110.9G174 I178 N207G174-L176 PolarHBondContact O-N 3.05Å; L176-I178 VanDerWaalsContact C-N 3.3Å; L176-I178 PolarHBondContact O-N 2.62Å; L176-N207 PolarHBondContact O-ND2 3.44Å
177E76.5Confident82.9Confident175 Ų17570 Ų7082%0.81836%0.359SS*.SBendtrans59.928.7169.9-53.1-17315100115.9
178I82.3Confident83.1Confident22 Ų2266.4 Ų66.411%0.11334%0.342CS..  trans-87.4113.7169.1-59.1-168.4000110.6L166 I170 L175 L176 T180 F183 N207 L211L166-I178 HydrophobicContact CD1-CG2 4.13Å; L166-I178 HydrophobicContact CD2-CG2 4.13Å; L166-I178 HydrophobicContact CG-CG2 4.3Å; I170-I178 HydrophobicContact CD1-CB 3.9Å; I170-I178 HydrophobicContact CD1-CG2 3.92Å; I170-I178 HydrophobicContact CG1-CB 4.04Å; I170-I178 HydrophobicContact CG1-CD1 3.9Å; I170-I178 HydrophobicContact CG1-CG1 4.33Å; I170-I178 HydrophobicContact CG1-CG2 4.34Å; L175-I178 HydrophobicContact CB-CD1 3.58Å; L175-I178 HydrophobicContact CB-CG1 4.16Å; L175-I178 HydrophobicContact CD1-CD1 3.61Å; L175-I178 HydrophobicContact CG-CD1 4.23Å; L176-I178 VanDerWaalsContact C-N 3.3Å; L176-I178 PolarHBondContact O-N 2.62Å; I178-T180 PolarHBondContact O-N 3.05Å; I178-F183 HydrophobicContact CG2-CE2 4.4Å; I178-N207 HydrophobicContact CD1-CB 4Å; I178-N207 HydrophobicContact CG1-CB 4.27Å; I178-N207 WeakPolarHBondContact CG1-ND2 3.46Å; I178-L211 HydrophobicContact CD1-CD1 4.12Å
179D80.1Confident83.2Confident82 Ų8269.3 Ų69.344%0.43936%0.356SS..  trans-77.3102.1168.6-172.9-10.6000110.8S181 M182D179-S181 PolarHBondContact O-N 3.48Å; D179-S181 VanDerWaalsContact O-N 3.17Å; D179-S181 VanDerWaalsContact OD1-CB 3.23Å; D179-S181 WeakPolarHBondContact OD1-CB 3.48Å; D179-S181 PolarHBondContact OD1-N 3.48Å; D179-S181 PolarHBondContact OD1-OG 3.36Å; D179-S181 PolarHBondContact OD2-OG 3.39Å; D179-S181 VanDerWaalsContact OD2-OG 3.1Å; D179-M182 HydrophobicContact CB-CG 3.94Å; D179-M182 WeakPolarHBondContact O-CB 3.35Å; D179-M182 PolarHBondContact O-N 3.17Å
180T81.9Confident83.4Confident40 Ų4073.7 Ų73.725%0.24538%0.377CS..G310 helixtrans-63.7-15.617865.40000114.4L166 I170 I178L166-T180 HydrophobicContact CD2-CG2 4.23Å; I170-T180 HydrophobicContact CD1-CG2 3.65Å; I178-T180 PolarHBondContact O-N 3.05Å
181S82.1Confident83.5Confident58 Ų5871.6 Ų71.641%0.40637%0.366SS..G310 helixtrans-71.1-32.3175.875.80000112.1D179 F183 Q184D179-S181 PolarHBondContact O-N 3.48Å; D179-S181 VanDerWaalsContact O-N 3.17Å; D179-S181 VanDerWaalsContact OD1-CB 3.23Å; D179-S181 WeakPolarHBondContact OD1-CB 3.48Å; D179-S181 PolarHBondContact OD1-N 3.48Å; D179-S181 PolarHBondContact OD1-OG 3.36Å; D179-S181 PolarHBondContact OD2-OG 3.39Å; D179-S181 VanDerWaalsContact OD2-OG 3.1Å; S181-F183 PolarHBondContact O-N 3.31Å; S181-F183 VanDerWaalsContact O-N 3.12Å; S181-Q184 VanDerWaalsContact O-CB 3.22Å; S181-Q184 WeakPolarHBondContact O-CB 3.5Å; S181-Q184 PolarHBondContact O-N 3.01Å
182M82.1Confident83.8Confident93 Ų9364.5 Ų64.546%0.45834%0.338SS..G310 helixtrans-64.5-18.4179.5-62.3-62.9-74.400113.3D179 L202D179-M182 HydrophobicContact CB-CG 3.94Å; D179-M182 WeakPolarHBondContact O-CB 3.35Å; D179-M182 PolarHBondContact O-N 3.17Å; M182-L202 HydrophobicContact CB-CB 4.46Å; M182-L202 HydrophobicContact CB-CD2 4.32Å; M182-L202 HydrophobicContact CE-CD2 3.85Å
183F83.1Confident84.2Confident2 Ų267.6 Ų67.61%0.00935%0.351CS..G310 helixtrans-105.4-2176.8-65.9-95.4000113.3L166 I178 S181 N185 T186 L191 M194 F199 L202L166-F183 HydrophobicContact CD2-CB 3.76Å; L166-F183 HydrophobicContact CD2-CD1 4.42Å; L166-F183 HydrophobicContact CD2-CD2 3.51Å; L166-F183 HydrophobicContact CD2-CE2 4.19Å; L166-F183 HydrophobicContact CD2-CG 3.64Å; I178-F183 HydrophobicContact CG2-CE2 4.4Å; S181-F183 PolarHBondContact O-N 3.31Å; S181-F183 VanDerWaalsContact O-N 3.12Å; F183-N185 PolarHBondContact O-N 3.23Å; F183-N185 VanDerWaalsContact O-N 3.16Å; F183-T186 WeakPolarHBondContact O-CB 3.49Å; F183-T186 PolarHBondContact O-N 3.02Å; F183-L191 HydrophobicContact CD1-CD1 4.37Å; F183-L191 HydrophobicContact CE1-CD1 4.43Å; F183-M194 HydrophobicContact CE1-CE 4.32Å; F183-F199 HydrophobicContact CE1-CD1 4.18Å; F183-F199 AromaticContact CE1-CE1 3.93Å; F183-F199 HydrophobicContact CE1-CE1 3.93Å; F183-F199 HydrophobicContact CZ-CD1 4.3Å; F183-F199 HydrophobicContact CZ-CE1 4.44Å; F183-L202 HydrophobicContact CD1-CD1 4.07Å; F183-L202 HydrophobicContact CD2-CD1 4.43Å; F183-L202 HydrophobicContact CE1-CD1 3.7Å; F183-L202 HydrophobicContact CE2-CB 3.86Å; F183-L202 HydrophobicContact CE2-CD1 4.09Å; F183-L202 HydrophobicContact CG-CD1 4.42Å; F183-L202 HydrophobicContact CZ-CB 3.75Å; F183-L202 HydrophobicContact CZ-CD1 3.72Å; F183-L202 HydrophobicContact CZ-CG 4.38Å
184Q81.9Confident84.5Confident113 Ų11366 Ų6653%0.52835%0.346SS..THydrogen-bonded Turntrans-61.4-30-170.1-177.11711.600113.8S181S181-Q184 VanDerWaalsContact O-CB 3.22Å; S181-Q184 WeakPolarHBondContact O-CB 3.5Å; S181-Q184 PolarHBondContact O-N 3.01Å
185N84.7Confident84.8Confident134 Ų13465.9 Ų65.972%0.71734%0.337SS*.THydrogen-bonded Turntrans-97.9-1.6179.8-65.4-19.9000113.4Q159 F183Q159-N185 PolarHBondContact NE2-O 3.38Å; F183-N185 PolarHBondContact O-N 3.23Å; F183-N185 VanDerWaalsContact O-N 3.16Å
186T87.5Confident84.8Confident21 Ų2169.7 Ų69.713%0.12935%0.353CS..  trans-85.4121.6-174.9-520000110.3V162 F183 E190 L191 M194V162-T186 WeakPolarHBondContact CG2-O 3.47Å; F183-T186 WeakPolarHBondContact O-CB 3.49Å; F183-T186 PolarHBondContact O-N 3.02Å; T186-E190 HydrophobicContact CG2-CB 4.17Å; T186-L191 HydrophobicContact CG2-CB 4Å; T186-L191 HydrophobicContact CG2-CD1 4.24Å; T186-M194 HydrophobicContact CG2-SD 4.27Å
187D88.2Confident85.2Confident48 Ų4868.2 Ų68.226%0.25735%0.346SS..  trans-89.6174.7170.187-6.3000111.4Q159 K189 E190 L191Q159-D187 HydrophobicContact CG-CB 4.41Å; D187-K189 PolarHBondContact O-N 2.82Å; D187-K189 WeakPolarHBondContact OD1-CA 3.45Å; D187-K189 WeakPolarHBondContact OD1-CB 3.48Å; D187-K189 PolarHBondContact OD1-N 3.04Å; D187-E190 PolarHBondContact O-N 3.42Å; D187-E190 PolarHBondContact OD1-N 2.93Å; D187-L191 VanDerWaalsContact O-CB 3.29Å; D187-L191 WeakPolarHBondContact O-CB 3.27Å; D187-L191 PolarHBondContact O-N 3.41Å
188G87.9Confident85.8Confident0 Ų061.9 Ų61.90%032%0.318CS..Hα-helixtrans-61.2-26.4-179.700000114.9P154 W157 C192P154-G188 CarbonylContact O-C 3.43Å; P154-G188 WeakPolarHBondContact O-CA 3.42Å; W157-G188 PolarHBondContact O-N 2.92Å; G188-C192 VanDerWaalsContact O-CB 3.28Å; G188-C192 WeakPolarHBondContact O-CB 3.47Å; G188-C192 PolarHBondContact O-N 2.83Å; G188-C192 PolarHBondContact O-SG 3.02Å
189K87.4Confident86.1Confident116 Ų11660.9 Ų60.950%0.50431%0.313SS..Hα-helixtrans-80-42.9-178.3-63175.6-178170.30110.9S155 D187 C192 K193S155-K189 WeakPolarHBondContact O-CE 3.35Å; S155-K189 WeakPolarHBondContact O-CG 3.29Å; D187-K189 PolarHBondContact O-N 2.82Å; D187-K189 WeakPolarHBondContact OD1-CA 3.45Å; D187-K189 WeakPolarHBondContact OD1-CB 3.48Å; D187-K189 PolarHBondContact OD1-N 3.04Å; K189-C192 PolarHBondContact O-N 2.84Å; K189-K193 VanDerWaalsContact O-CG 3.28Å; K189-K193 WeakPolarHBondContact O-CG 3.49Å; K189-K193 PolarHBondContact O-N 3.44Å
190E88.7Confident86.5Confident93 Ų9360.3 Ų60.344%0.43531%0.309SS..Hα-helixtrans-68.3-40.4172.1-57.8-43.1124.100110.9T186 D187 C192 K193 M194T186-E190 HydrophobicContact CG2-CB 4.17Å; D187-E190 PolarHBondContact O-N 3.42Å; D187-E190 PolarHBondContact OD1-N 2.93Å; E190-C192 VanDerWaalsContact C-N 3.28Å; E190-C192 PolarHBondContact O-N 3.24Å; E190-K193 VanDerWaalsContact CD-NZ 3.31Å; E190-K193 PolarHBondContact O-N 3.36Å; E190-K193 IonicContact OE1-NZ 2.71Å; E190-K193 PolarHBondContact OE1-NZ 3.1Å; E190-K193 WeakPolarHBondContact OE2-CD 3.34Å; E190-K193 IonicContact OE2-NZ 3.79Å; E190-K193 PolarHBondContact OE2-NZ 3.23Å; E190-M194 WeakPolarHBondContact O-CG 3.3Å; E190-M194 PolarHBondContact O-N 3.1Å
191L88.9Confident86.7Confident0 Ų066.5 Ų66.50%033%0.328CS..Hα-helixtrans-57.1-40.5174-16874000112.2W157 V162 W165 F183 T186 D187 K193 M194 F199 L215W157-L191 HydrophobicContact CE3-CD2 3.99Å; W157-L191 HydrophobicContact CZ3-CD2 3.91Å; V162-L191 HydrophobicContact CG1-CD1 4.37Å; V162-L191 HydrophobicContact CG1-CD2 4.17Å; V162-L191 HydrophobicContact CG2-CD2 4.11Å; W165-L191 HydrophobicContact CE3-CD2 4.18Å; W165-L191 HydrophobicContact CH2-CD2 4.24Å; W165-L191 HydrophobicContact CZ3-CD1 4.28Å; W165-L191 HydrophobicContact CZ3-CD2 3.85Å; F183-L191 HydrophobicContact CD1-CD1 4.37Å; F183-L191 HydrophobicContact CE1-CD1 4.43Å; T186-L191 HydrophobicContact CG2-CB 4Å; T186-L191 HydrophobicContact CG2-CD1 4.24Å; D187-L191 VanDerWaalsContact O-CB 3.29Å; D187-L191 WeakPolarHBondContact O-CB 3.27Å; D187-L191 PolarHBondContact O-N 3.41Å; L191-K193 VanDerWaalsContact C-N 3.33Å; L191-K193 PolarHBondContact O-N 2.73Å; L191-M194 HydrophobicContact CD1-SD 4.23Å; L191-F199 HydrophobicContact CD1-CE1 4.03Å; L191-F199 HydrophobicContact CD1-CZ 3.65Å; L191-F199 HydrophobicContact CG-CZ 4.29Å; L191-L215 HydrophobicContact CD2-CD1 3.87Å; L191-L215 HydrophobicContact CD2-CD2 4.44Å; L191-L215 HydrophobicContact CG-CD1 4.31Å; L191-L215 HydrophobicContact CG-CD2 4.02Å; L191-L215 WeakPolarHBondContact O-CD2 3.44Å
192C88.7Confident86.8Confident30 Ų3065.4 Ų65.420%0.20332%0.318CS..Hα-helixtrans-74.7-13.9176.1-79.60000115.3P154 G188 K189 E190P154-C192 VanDerWaalsContact CB-SG 3.59Å; G188-C192 VanDerWaalsContact O-CB 3.28Å; G188-C192 WeakPolarHBondContact O-CB 3.47Å; G188-C192 PolarHBondContact O-N 2.83Å; G188-C192 PolarHBondContact O-SG 3.02Å; K189-C192 PolarHBondContact O-N 2.84Å; E190-C192 VanDerWaalsContact C-N 3.28Å; E190-C192 PolarHBondContact O-N 3.24Å
193K87.6Confident87Confident137 Ų13761.7 Ų61.760%0.59630%0.3SS*.Hα-helixtrans-92.4-24.9173.8-70.9165.4-173.9174.10112.8K189 E190 L191 S195K189-K193 VanDerWaalsContact O-CG 3.28Å; K189-K193 WeakPolarHBondContact O-CG 3.49Å; K189-K193 PolarHBondContact O-N 3.44Å; E190-K193 VanDerWaalsContact CD-NZ 3.31Å; E190-K193 PolarHBondContact O-N 3.36Å; E190-K193 IonicContact OE1-NZ 2.71Å; E190-K193 PolarHBondContact OE1-NZ 3.1Å; E190-K193 WeakPolarHBondContact OE2-CD 3.34Å; E190-K193 IonicContact OE2-NZ 3.79Å; E190-K193 PolarHBondContact OE2-NZ 3.23Å; L191-K193 VanDerWaalsContact C-N 3.33Å; L191-K193 PolarHBondContact O-N 2.73Å; K193-S195 PolarHBondContact O-N 3.47Å
194M87.4Confident87.2Confident29 Ų2964.5 Ų64.514%0.14332%0.318CS..  trans-55.6123.6-178.1-79.3175.864.200111.3F183 T186 E190 L191 D198 F199 L202F183-M194 HydrophobicContact CE1-CE 4.32Å; T186-M194 HydrophobicContact CG2-SD 4.27Å; E190-M194 WeakPolarHBondContact O-CG 3.3Å; E190-M194 PolarHBondContact O-N 3.1Å; L191-M194 HydrophobicContact CD1-SD 4.23Å; M194-D198 HydrophobicContact CB-CB 3.91Å; M194-D198 HydrophobicContact CE-CB 4.05Å; M194-D198 HydrophobicContact CG-CB 3.95Å; M194-F199 HydrophobicContact CB-CD2 3.85Å; M194-F199 HydrophobicContact CB-CE2 3.56Å; M194-F199 HydrophobicContact CB-CZ 4.39Å; M194-F199 HydrophobicContact CE-CB 4.38Å; M194-F199 HydrophobicContact CE-CD1 3.91Å; M194-F199 HydrophobicContact CE-CD2 3.79Å; M194-F199 HydrophobicContact CE-CE1 4.1Å; M194-F199 HydrophobicContact CE-CE2 3.97Å; M194-F199 HydrophobicContact CE-CG 3.75Å; M194-F199 HydrophobicContact CE-CZ 4.12Å; M194-F199 HydrophobicContact SD-CE2 4.36Å; M194-F199 HydrophobicContact SD-CZ 4.37Å; M194-L202 HydrophobicContact CE-CD1 3.6Å; M194-L202 HydrophobicContact CE-CG 4.24Å; M194-L202 HydrophobicContact SD-CD1 4.43Å
195S88.6Confident87.3Confident47 Ų4763.4 Ų63.433%0.32932%0.315SS..  trans-72.217017067.60000111.4K193 D197 D198 F199K193-S195 PolarHBondContact O-N 3.47Å; S195-D197 PolarHBondContact O-N 2.97Å; S195-D197 PolarHBondContact OG-N 3.42Å; S195-D198 WeakPolarHBondContact CB-OD2 3.23Å; S195-D198 PolarHBondContact N-OD2 2.93Å; S195-D198 WeakPolarHBondContact O-CB 3.36Å; S195-D198 PolarHBondContact O-N 3.38Å; S195-D198 PolarHBondContact OG-N 2.85Å; S195-D198 VanDerWaalsContact OG-N 3.17Å; S195-D198 PolarHBondContact OG-OD2 3.19Å; S195-F199 WeakPolarHBondContact O-CD2 3.48Å; S195-F199 PolarHBondContact O-N 3.28Å; S195-F199 VanDerWaalsContact O-N 3.13Å
196K85.8Confident87.4Confident85 Ų8563 Ų6337%0.3730%0.304SS..Hα-helixtrans-56.9-38.7172.1-171.8177.2-178.7177.50111.4D198 F199 L200 E209 L212K196-D198 VanDerWaalsContact C-N 3.32Å; K196-D198 PolarHBondContact O-N 3.44Å; K196-F199 PolarHBondContact O-N 2.6Å; K196-L200 HydrophobicContact CG-CD1 4.25Å; K196-L200 WeakPolarHBondContact O-CB 3.36Å; K196-L200 WeakPolarHBondContact O-CG 3.45Å; K196-L200 PolarHBondContact O-N 3.47Å; K196-E209 WeakPolarHBondContact CE-OE1 3.36Å; K196-E209 IonicContact NZ-OE1 3.98Å; K196-E209 PolarHBondContact NZ-OE1 2.94Å; K196-L212 HydrophobicContact CB-CD2 3.89Å; K196-L212 HydrophobicContact CG-CD2 4.24Å
197D88.6Confident87.3Confident108 Ų10862.3 Ų62.358%0.57830%0.3SS*.Hα-helixtrans-65.8-32.7176.2-55.9-85.6000112.4S195 L200 R201S195-D197 PolarHBondContact O-N 2.97Å; S195-D197 PolarHBondContact OG-N 3.42Å; D197-L200 PolarHBondContact O-N 2.98Å; D197-R201 WeakPolarHBondContact O-CG 3.34Å; D197-R201 PolarHBondContact O-N 2.84Å; D197-R201 VanDerWaalsContact O-N 3.12Å
198D88.4Confident87.3Confident42 Ų4260 Ų6023%0.22529%0.287CS..Hα-helixtrans-70.3-41.7174.6-60.2-52000112M194 S195 K196 L200 R201M194-D198 HydrophobicContact CB-CB 3.91Å; M194-D198 HydrophobicContact CE-CB 4.05Å; M194-D198 HydrophobicContact CG-CB 3.95Å; S195-D198 WeakPolarHBondContact CB-OD2 3.23Å; S195-D198 PolarHBondContact N-OD2 2.93Å; S195-D198 WeakPolarHBondContact O-CB 3.36Å; S195-D198 PolarHBondContact O-N 3.38Å; S195-D198 PolarHBondContact OG-N 2.85Å; S195-D198 VanDerWaalsContact OG-N 3.17Å; S195-D198 PolarHBondContact OG-OD2 3.19Å; K196-D198 VanDerWaalsContact C-N 3.32Å; K196-D198 PolarHBondContact O-N 3.44Å; D198-L200 VanDerWaalsContact C-N 3.34Å; D198-R201 PolarHBondContact O-N 3.41Å; D198-R201 IonicContact OD1-CZ 2.71Å; D198-R201 IonicContact OD1-NE 2.8Å; D198-R201 IonicContact OD1-NH2 3.15Å; D198-R201 PolarHBondContact OD1-NH2 2.77Å
199F88.3Confident87.2Confident0 Ų062.8 Ų62.80%030%0.3CS..Hα-helixtrans-63.5-39.5171.5-82.3-85.9000111.8F183 L191 M194 S195 K196 R201 L202 T203 A208 L211 L212 L215F183-F199 HydrophobicContact CE1-CD1 4.18Å; F183-F199 AromaticContact CE1-CE1 3.93Å; F183-F199 HydrophobicContact CE1-CE1 3.93Å; F183-F199 HydrophobicContact CZ-CD1 4.3Å; F183-F199 HydrophobicContact CZ-CE1 4.44Å; L191-F199 HydrophobicContact CD1-CE1 4.03Å; L191-F199 HydrophobicContact CD1-CZ 3.65Å; L191-F199 HydrophobicContact CG-CZ 4.29Å; M194-F199 HydrophobicContact CB-CD2 3.85Å; M194-F199 HydrophobicContact CB-CE2 3.56Å; M194-F199 HydrophobicContact CB-CZ 4.39Å; M194-F199 HydrophobicContact CE-CB 4.38Å; M194-F199 HydrophobicContact CE-CD1 3.91Å; M194-F199 HydrophobicContact CE-CD2 3.79Å; M194-F199 HydrophobicContact CE-CE1 4.1Å; M194-F199 HydrophobicContact CE-CE2 3.97Å; M194-F199 HydrophobicContact CE-CG 3.75Å; M194-F199 HydrophobicContact CE-CZ 4.12Å; M194-F199 HydrophobicContact SD-CE2 4.36Å; M194-F199 HydrophobicContact SD-CZ 4.37Å; S195-F199 WeakPolarHBondContact O-CD2 3.48Å; S195-F199 PolarHBondContact O-N 3.28Å; S195-F199 VanDerWaalsContact O-N 3.13Å; K196-F199 PolarHBondContact O-N 2.6Å; F199-R201 PolarHBondContact O-N 3.1Å; F199-L202 PolarHBondContact O-N 3.04Å; F199-T203 PolarHBondContact O-N 3.41Å; F199-A208 HydrophobicContact CB-CB 3.7Å; F199-L211 HydrophobicContact CD1-CB 4.33Å; F199-L211 HydrophobicContact CD1-CD1 4.42Å; F199-L211 HydrophobicContact CE1-CB 4.1Å; F199-L211 HydrophobicContact CE1-CD1 4.43Å; F199-L212 HydrophobicContact CD2-CD1 4.32Å; F199-L212 HydrophobicContact CE2-CD1 4.05Å; F199-L215 HydrophobicContact CE2-CD2 4.39Å; F199-L215 HydrophobicContact CZ-CD2 4.16Å
200L88.1Confident87.2Confident70 Ų7057.6 Ų57.637%0.36628%0.278SS..Hα-helixtrans-62-23174.5-83.7165.5000114.1K196 D197 D198 T203 L205 A208K196-L200 HydrophobicContact CG-CD1 4.25Å; K196-L200 WeakPolarHBondContact O-CB 3.36Å; K196-L200 WeakPolarHBondContact O-CG 3.45Å; K196-L200 PolarHBondContact O-N 3.47Å; D197-L200 PolarHBondContact O-N 2.98Å; D198-L200 VanDerWaalsContact C-N 3.34Å; L200-T203 WeakPolarHBondContact CA-O 3.42Å; L200-L205 HydrophobicContact CD1-CD1 4.37Å; L200-L205 HydrophobicContact CD2-CB 3.76Å; L200-L205 HydrophobicContact CD2-CD1 3.91Å; L200-L205 HydrophobicContact CD2-CG 4.44Å; L200-A208 HydrophobicContact CG-CB 4.37Å
201R86.6Confident87.2Confident170 Ų17053.2 Ų53.264%0.64226%0.258SS*.THydrogen-bonded Turntrans-82.5-12.6172.6-69.2-178.6-52.298.4-7.6113.6D197 D198 F199D197-R201 WeakPolarHBondContact O-CG 3.34Å; D197-R201 PolarHBondContact O-N 2.84Å; D197-R201 VanDerWaalsContact O-N 3.12Å; D198-R201 PolarHBondContact O-N 3.41Å; D198-R201 IonicContact OD1-CZ 2.71Å; D198-R201 IonicContact OD1-NE 2.8Å; D198-R201 IonicContact OD1-NH2 3.15Å; D198-R201 PolarHBondContact OD1-NH2 2.77Å; F199-R201 PolarHBondContact O-N 3.1Å
202L84.7Confident87.2Confident36 Ų3654.7 Ų54.719%0.18827%0.266CS..THydrogen-bonded Turntrans-109.8-21.9178.7-53.3-169.6000113.5M182 F183 M194 F199M182-L202 HydrophobicContact CB-CB 4.46Å; M182-L202 HydrophobicContact CB-CD2 4.32Å; M182-L202 HydrophobicContact CE-CD2 3.85Å; F183-L202 HydrophobicContact CD1-CD1 4.07Å; F183-L202 HydrophobicContact CD2-CD1 4.43Å; F183-L202 HydrophobicContact CE1-CD1 3.7Å; F183-L202 HydrophobicContact CE2-CB 3.86Å; F183-L202 HydrophobicContact CE2-CD1 4.09Å; F183-L202 HydrophobicContact CG-CD1 4.42Å; F183-L202 HydrophobicContact CZ-CB 3.75Å; F183-L202 HydrophobicContact CZ-CD1 3.72Å; F183-L202 HydrophobicContact CZ-CG 4.38Å; M194-L202 HydrophobicContact CE-CD1 3.6Å; M194-L202 HydrophobicContact CE-CG 4.24Å; M194-L202 HydrophobicContact SD-CD1 4.43Å; F199-L202 PolarHBondContact O-N 3.04Å
203T86.3Confident87Confident14 Ų1456.1 Ų56.19%0.08628%0.276CS..SBendtrans-157.7169.5-178-172.60000112.3F199 L200 N207 A208 L211F199-T203 PolarHBondContact O-N 3.41Å; L200-T203 WeakPolarHBondContact CA-O 3.42Å; T203-N207 HydrophobicContact CG2-CB 3.76Å; T203-N207 WeakPolarHBondContact OG1-CB 3.12Å; T203-N207 PolarHBondContact OG1-ND2 3.03Å; T203-A208 HydrophobicContact CG2-CB 4.22Å; T203-L211 HydrophobicContact CG2-CD1 4.42Å
204T87.1Confident86.9Confident62 Ų6250.3 Ų50.338%0.3825%0.251SS..  trans-57.5156.4177.471.10000113.2Y206 N207 A208T204-Y206 VanDerWaalsContact C-N 3.3Å; T204-Y206 PolarHBondContact O-N 3.17Å; T204-N207 PolarHBondContact O-N 3.44Å; T204-N207 WeakPolarHBondContact OG1-CB 3.4Å; T204-N207 PolarHBondContact OG1-N 3.5Å; T204-N207 PolarHBondContact OG1-ND2 3.05Å; T204-A208 WeakPolarHBondContact O-CB 3.5Å; T204-A208 PolarHBondContact O-N 3.28Å
205L84.8Confident86.9Confident90 Ų9049 Ų4947%0.47125%0.245SC..Hα-helixtrans-52.8-44178.4175.162.3000113.2L200 A208 E209L200-L205 HydrophobicContact CD1-CD1 4.37Å; L200-L205 HydrophobicContact CD2-CB 3.76Å; L200-L205 HydrophobicContact CD2-CD1 3.91Å; L200-L205 HydrophobicContact CD2-CG 4.44Å; L205-A208 PolarHBondContact O-N 3.29Å; L205-E209 HydrophobicContact CD1-CG 4.21Å; L205-E209 WeakPolarHBondContact O-CG 3.41Å; L205-E209 PolarHBondContact O-N 3.23Å
206Y85Confident86.7Confident126 Ų12649.8 Ų49.849%0.49425%0.245SC..Hα-helixtrans-61.5-50.6178.3177.2-103.6000111.7L175 T204 A208 E209 V210L175-Y206 HydrophobicContact CD2-CD1 4.4Å; L175-Y206 HydrophobicContact CD2-CE1 3.89Å; T204-Y206 VanDerWaalsContact C-N 3.3Å; T204-Y206 PolarHBondContact O-N 3.17Å; Y206-A208 VanDerWaalsContact C-N 3.32Å; Y206-A208 PolarHBondContact O-N 2.98Å; Y206-E209 PolarHBondContact O-N 2.73Å; Y206-V210 HydrophobicContact CE1-CG2 4.32Å; Y206-V210 HydrophobicContact CE2-CG2 4.31Å; Y206-V210 WeakPolarHBondContact O-CG2 3.15Å; Y206-V210 PolarHBondContact O-N 3.05Å
207N86.8Confident86.5Confident5 Ų552.4 Ų52.43%0.02725%0.254CS..Hα-helixtrans-62.4-40.5178-67.2-9.1000111.4L176 I178 T203 T204 V210 L211L176-N207 PolarHBondContact O-ND2 3.44Å; I178-N207 HydrophobicContact CD1-CB 4Å; I178-N207 HydrophobicContact CG1-CB 4.27Å; I178-N207 WeakPolarHBondContact CG1-ND2 3.46Å; T203-N207 HydrophobicContact CG2-CB 3.76Å; T203-N207 WeakPolarHBondContact OG1-CB 3.12Å; T203-N207 PolarHBondContact OG1-ND2 3.03Å; T204-N207 PolarHBondContact O-N 3.44Å; T204-N207 WeakPolarHBondContact OG1-CB 3.4Å; T204-N207 PolarHBondContact OG1-N 3.5Å; T204-N207 PolarHBondContact OG1-ND2 3.05Å; N207-V210 PolarHBondContact O-N 3.1Å; N207-L211 WeakPolarHBondContact O-CB 3.45Å; N207-L211 VanDerWaalsContact O-CG 3.23Å; N207-L211 WeakPolarHBondContact O-CG 3.45Å; N207-L211 PolarHBondContact O-N 3.21Å
208A87.8Confident86.2Confident0 Ų048 Ų480%023%0.23CC..Hα-helixtrans-61.3-42.7177.300000111.9F199 L200 T203 T204 L205 Y206 L212F199-A208 HydrophobicContact CB-CB 3.7Å; L200-A208 HydrophobicContact CG-CB 4.37Å; T203-A208 HydrophobicContact CG2-CB 4.22Å; T204-A208 WeakPolarHBondContact O-CB 3.5Å; T204-A208 PolarHBondContact O-N 3.28Å; L205-A208 PolarHBondContact O-N 3.29Å; Y206-A208 VanDerWaalsContact C-N 3.32Å; Y206-A208 PolarHBondContact O-N 2.98Å; A208-L212 WeakPolarHBondContact O-CB 3.44Å; A208-L212 PolarHBondContact O-N 2.66Å
209E84.9Confident85.7Confident58 Ų5851 Ų5127%0.27124%0.238SC..Hα-helixtrans-68.3-42.7177.1-73.4-176.4163.400112.6K196 L205 Y206 S213K196-E209 WeakPolarHBondContact CE-OE1 3.36Å; K196-E209 IonicContact NZ-OE1 3.98Å; K196-E209 PolarHBondContact NZ-OE1 2.94Å; L205-E209 HydrophobicContact CD1-CG 4.21Å; L205-E209 WeakPolarHBondContact O-CG 3.41Å; L205-E209 PolarHBondContact O-N 3.23Å; Y206-E209 PolarHBondContact O-N 2.73Å; E209-S213 WeakPolarHBondContact O-CB 3.5Å; E209-S213 PolarHBondContact O-N 3.11Å
210V87.4Confident84.8Confident7 Ų758 Ų584%0.04227%0.271CS..Hα-helixtrans-62.6-48.4176.6175.60000111.2L15 Y173 L175 Y206 N207 H214L15-V210 HydrophobicContact CD2-CG2 4.04Å; Y173-V210 HydrophobicContact CD1-CG1 4.13Å; Y173-V210 HydrophobicContact CD2-CG1 3.63Å; Y173-V210 HydrophobicContact CE2-CG1 4.1Å; Y173-V210 HydrophobicContact CG-CG1 3.65Å; L175-V210 HydrophobicContact CD1-CG1 4.28Å; L175-V210 HydrophobicContact CD2-CB 4.26Å; L175-V210 HydrophobicContact CD2-CG1 4.16Å; L175-V210 HydrophobicContact CD2-CG2 4.29Å; Y206-V210 HydrophobicContact CE1-CG2 4.32Å; Y206-V210 HydrophobicContact CE2-CG2 4.31Å; Y206-V210 WeakPolarHBondContact O-CG2 3.15Å; Y206-V210 PolarHBondContact O-N 3.05Å; N207-V210 PolarHBondContact O-N 3.1Å; V210-H214 WeakPolarHBondContact O-CB 3.3Å; V210-H214 PolarHBondContact O-N 2.97Å
211L89.9Confident83.6Confident1 Ų157 Ų571%0.00527%0.27CS..Hα-helixtrans-64.7-45.6-179.4-69.5175.4000112.1W165 L166 A169 L175 I178 F199 T203 N207 H214 L215W165-L211 HydrophobicContact CH2-CB 4Å; W165-L211 HydrophobicContact CH2-CD2 3.76Å; W165-L211 HydrophobicContact CH2-CG 4.4Å; W165-L211 HydrophobicContact CZ2-CD2 4.19Å; W165-L211 HydrophobicContact CZ3-CD2 4.09Å; L166-L211 HydrophobicContact CD1-CD1 3.8Å; L166-L211 HydrophobicContact CD1-CD2 3.87Å; A169-L211 HydrophobicContact CB-CD2 3.72Å; L175-L211 HydrophobicContact CD1-CD2 4.08Å; L175-L211 HydrophobicContact CD1-CG 4.21Å; I178-L211 HydrophobicContact CD1-CD1 4.12Å; F199-L211 HydrophobicContact CD1-CB 4.33Å; F199-L211 HydrophobicContact CD1-CD1 4.42Å; F199-L211 HydrophobicContact CE1-CB 4.1Å; F199-L211 HydrophobicContact CE1-CD1 4.43Å; T203-L211 HydrophobicContact CG2-CD1 4.42Å; N207-L211 WeakPolarHBondContact O-CB 3.45Å; N207-L211 VanDerWaalsContact O-CG 3.23Å; N207-L211 WeakPolarHBondContact O-CG 3.45Å; N207-L211 PolarHBondContact O-N 3.21Å; L211-H214 PolarHBondContact O-N 3.48Å; L211-L215 VanDerWaalsContact O-CB 3.3Å; L211-L215 WeakPolarHBondContact O-CB 3.43Å; L211-L215 PolarHBondContact O-N 2.84Å
212L89Confident82.1Confident31 Ų3150.1 Ų50.116%0.16225%0.248CC..Hα-helixtrans-69.4-36.6180-176.461.2000112.2K196 F199 A208 L215 N216K196-L212 HydrophobicContact CB-CD2 3.89Å; K196-L212 HydrophobicContact CG-CD2 4.24Å; F199-L212 HydrophobicContact CD2-CD1 4.32Å; F199-L212 HydrophobicContact CE2-CD1 4.05Å; A208-L212 WeakPolarHBondContact O-CB 3.44Å; A208-L212 PolarHBondContact O-N 2.66Å; L212-L215 PolarHBondContact O-N 3.21Å; L212-N216 WeakPolarHBondContact O-CB 3.25Å; L212-N216 PolarHBondContact O-N 2.89Å; L212-N216 PolarHBondContact O-ND2 3.11Å; L212-N216 VanDerWaalsContact O-ND2 3.12Å
213S84.8Confident80.6Confident61 Ų6151.4 Ų51.443%0.42726%0.26SS..Hα-helixtrans-61.3-50.2173.5-178.50000111E209 L215 N216 Y217E209-S213 WeakPolarHBondContact O-CB 3.5Å; E209-S213 PolarHBondContact O-N 3.11Å; S213-L215 PolarHBondContact O-N 2.98Å; S213-N216 PolarHBondContact O-N 3.12Å; S213-Y217 PolarHBondContact O-N 2.98Å
214H85.1Confident78.7Confident14 Ų1455.5 Ų55.57%0.06529%0.289CS..Hα-helixtrans-65.4-37.3178.7-175.7-130.6000112.9W5 W165 W168 V210 L211 Y217 L218W5-H214 AromaticContact CH2-CE1 3.36Å; W5-H214 WeakPolarHBondContact CH2-CE1 3.22Å; W5-H214 AromaticContact CH2-NE2 3.41Å; W5-H214 WeakPolarHBondContact CH2-NE2 3.23Å; W5-H214 AromaticContact CZ3-CE1 3.68Å; W5-H214 AromaticContact CZ3-NE2 3.72Å; W165-H214 AromaticContact CE2-ND1 3.88Å; W165-H214 AromaticContact NE1-CE1 3.41Å; W165-H214 PolarHBondContact NE1-CE1 2.9Å; W165-H214 AromaticContact NE1-ND1 3.1Å; W165-H214 PolarHBondContact NE1-ND1 3.27Å; W168-H214 AromaticContact CH2-CE1 3.51Å; W168-H214 AromaticContact CH2-NE2 3.91Å; W168-H214 AromaticContact CZ3-CE1 3.15Å; W168-H214 WeakPolarHBondContact CZ3-CE1 3.48Å; W168-H214 AromaticContact CZ3-ND1 3.52Å; V210-H214 WeakPolarHBondContact O-CB 3.3Å; V210-H214 PolarHBondContact O-N 2.97Å; L211-H214 PolarHBondContact O-N 3.48Å; H214-Y217 PolarHBondContact O-N 3.33Å; H214-L218 WeakPolarHBondContact O-CG 3.43Å; H214-L218 PolarHBondContact O-N 3.44Å; H214-L218 VanDerWaalsContact O-N 3.1Å
215L87.7Confident76.8Confident2 Ų259.2 Ų59.21%0.0131%0.306CS..Hα-helixtrans-62.4-41173.5-174.367.5000112P154 W157 W165 L191 F199 L211 L212 S213 L218 R219P154-L215 HydrophobicContact CB-CD1 3.63Å; P154-L215 HydrophobicContact CG-CD1 4.03Å; W157-L215 HydrophobicContact CZ3-CD1 4.37Å; W165-L215 HydrophobicContact CZ2-CB 4.31Å; L191-L215 HydrophobicContact CD2-CD1 3.87Å; L191-L215 HydrophobicContact CD2-CD2 4.44Å; L191-L215 HydrophobicContact CG-CD1 4.31Å; L191-L215 HydrophobicContact CG-CD2 4.02Å; L191-L215 WeakPolarHBondContact O-CD2 3.44Å; F199-L215 HydrophobicContact CE2-CD2 4.39Å; F199-L215 HydrophobicContact CZ-CD2 4.16Å; L211-L215 VanDerWaalsContact O-CB 3.3Å; L211-L215 WeakPolarHBondContact O-CB 3.43Å; L211-L215 PolarHBondContact O-N 2.84Å; L212-L215 PolarHBondContact O-N 3.21Å; S213-L215 PolarHBondContact O-N 2.98Å; L215-L218 PolarHBondContact O-N 3.18Å; L215-R219 WeakPolarHBondContact O-CG 3.33Å; L215-R219 PolarHBondContact O-N 2.93Å; L215-R219 VanDerWaalsContact O-N 3.11Å
216N84.3Confident74.5Confident64 Ų6459 Ų5934%0.34231%0.311SS..Hα-helixtrans-71.5-38.9177.2-74.6-36.6000112.6L212 S213 L218 R219 E220L212-N216 WeakPolarHBondContact O-CB 3.25Å; L212-N216 PolarHBondContact O-N 2.89Å; L212-N216 PolarHBondContact O-ND2 3.11Å; L212-N216 VanDerWaalsContact O-ND2 3.12Å; S213-N216 PolarHBondContact O-N 3.12Å; N216-L218 VanDerWaalsContact C-N 3.26Å; N216-L218 PolarHBondContact O-N 3.18Å; N216-R219 PolarHBondContact O-N 3Å; N216-R219 VanDerWaalsContact O-N 3.11Å; N216-R219 PolarHBondContact OD1-NH1 3.3Å; N216-E220 WeakPolarHBondContact O-CB 3.38Å; N216-E220 PolarHBondContact O-N 3.41Å
217Y81.9Confident71.9Confident140 Ų14063.1 Ų63.155%0.54933%0.328SS..Hα-helixtrans-55.3-41.7171.2171.2-99.6000112.1S213 H214 E220 S221S213-Y217 PolarHBondContact O-N 2.98Å; H214-Y217 PolarHBondContact O-N 3.33Å; Y217-E220 PolarHBondContact O-N 3.45Å; Y217-S221 WeakPolarHBondContact O-CB 3.44Å; Y217-S221 PolarHBondContact O-N 2.62Å; Y217-S221 PolarHBondContact O-OG 3.16Å
218L82Confident69.3Low15 Ų1570.1 Ų70.18%0.07937%0.365CS..Hα-helixtrans-66.6-40175.3-74.2165000112.7W5 P154 W157 H214 L215 N216 S221 S222W5-L218 HydrophobicContact CH2-CD1 3.94Å; W5-L218 HydrophobicContact CH2-CD2 3.79Å; W5-L218 HydrophobicContact CH2-CG 4.34Å; W5-L218 HydrophobicContact CZ2-CD1 3.95Å; W5-L218 HydrophobicContact CZ2-CD2 3.79Å; W5-L218 HydrophobicContact CZ2-CG 4.5Å; P154-L218 HydrophobicContact CG-CB 3.58Å; P154-L218 HydrophobicContact CG-CD1 4.38Å; W157-L218 HydrophobicContact CH2-CD1 3.69Å; W157-L218 HydrophobicContact CZ2-CD1 3.89Å; H214-L218 WeakPolarHBondContact O-CG 3.43Å; H214-L218 PolarHBondContact O-N 3.44Å; H214-L218 VanDerWaalsContact O-N 3.1Å; L215-L218 PolarHBondContact O-N 3.18Å; N216-L218 VanDerWaalsContact C-N 3.26Å; N216-L218 PolarHBondContact O-N 3.18Å; L218-S221 WeakPolarHBondContact CA-OG 3.45Å; L218-S221 PolarHBondContact O-OG 2.9Å; L218-S222 VanDerWaalsContact O-CB 3.3Å; L218-S222 WeakPolarHBondContact O-CB 3.5Å; L218-S222 PolarHBondContact O-N 2.65Å; L218-S222 PolarHBondContact O-OG 3.13Å
219R78.1Confident66.4Low106 Ų10676.4 Ų76.440%0.440%0.403SS..Hα-helixtrans-68.6-34.9175.8-68.5169.566.4-140.81.7113P154 L215 N216 S222 S223P154-R219 HydrophobicContact CG-CG 4.19Å; L215-R219 WeakPolarHBondContact O-CG 3.33Å; L215-R219 PolarHBondContact O-N 2.93Å; L215-R219 VanDerWaalsContact O-N 3.11Å; N216-R219 PolarHBondContact O-N 3Å; N216-R219 VanDerWaalsContact O-N 3.11Å; N216-R219 PolarHBondContact OD1-NH1 3.3Å; R219-S222 WeakPolarHBondContact CA-OG 3.27Å; R219-S222 PolarHBondContact O-OG 2.69Å; R219-S222 VanDerWaalsContact O-OG 3.05Å; R219-S223 VanDerWaalsContact O-CB 3.25Å; R219-S223 WeakPolarHBondContact O-CB 3.07Å; R219-S223 PolarHBondContact O-N 2.68Å; R219-S223 PolarHBondContact O-OG 3.45Å
220E68.9Low64Low147 Ų14779.4 Ų79.469%0.68743%0.428SS*.Hα-helixtrans-74.7-43.6179-171.5165.5-138.300111.1N216 Y217 S223 S224N216-E220 WeakPolarHBondContact O-CB 3.38Å; N216-E220 PolarHBondContact O-N 3.41Å; Y217-E220 PolarHBondContact O-N 3.45Å; E220-S223 PolarHBondContact O-N 2.61Å; E220-S224 PolarHBondContact O-N 3.07Å
221S61.7Low61.3Low48 Ų4884.7 Ų84.734%0.33647%0.465SS..Hα-helixtrans-66.3-34.3173.4550000113.1Y217 L218Y217-S221 WeakPolarHBondContact O-CB 3.44Å; Y217-S221 PolarHBondContact O-N 2.62Å; Y217-S221 PolarHBondContact O-OG 3.16Å; L218-S221 WeakPolarHBondContact CA-OG 3.45Å; L218-S221 PolarHBondContact O-OG 2.9Å
222S56.6Low58.9Low26 Ų2693.3 Ų93.318%0.18251%0.505CS..Hα-helixtrans-70.3-37.8171.473.40000112.6L218 R219 L225L218-S222 VanDerWaalsContact O-CB 3.3Å; L218-S222 WeakPolarHBondContact O-CB 3.5Å; L218-S222 PolarHBondContact O-N 2.65Å; L218-S222 PolarHBondContact O-OG 3.13Å; R219-S222 WeakPolarHBondContact CA-OG 3.27Å; R219-S222 PolarHBondContact O-OG 2.69Å; R219-S222 VanDerWaalsContact O-OG 3.05Å; S222-L225 WeakPolarHBondContact O-CB 3.25Å; S222-L225 PolarHBondContact O-N 3.44Å
223S51.9Low56.2Low63 Ų6398.9 Ų98.944%0.44154%0.541SS..Hα-helixtrans-70.4-31.6177.3-590000112.8R219 E220 L225 S226R219-S223 VanDerWaalsContact O-CB 3.25Å; R219-S223 WeakPolarHBondContact O-CB 3.07Å; R219-S223 PolarHBondContact O-N 2.68Å; R219-S223 PolarHBondContact O-OG 3.45Å; E220-S223 PolarHBondContact O-N 2.61Å; S223-L225 PolarHBondContact O-N 2.78Å; S223-L225 VanDerWaalsContact O-N 3.16Å; S223-S226 PolarHBondContact O-N 3.46Å; S223-S226 PolarHBondContact O-OG 3.35Å
224S47.8Very low53.5Low99 Ų99103.1 Ų103.169%0.69256%0.558SS**THydrogen-bonded Turntrans-62.3-18.3172.5-175.20000113.4E220E220-S224 PolarHBondContact O-N 3.07Å
225L46.9Very low50.9Low141 Ų141106.8 Ų106.874%0.73859%0.592SS**THydrogen-bonded Turntrans-91.9-9.8179-69.3163.7000113.5S222 S223S222-L225 WeakPolarHBondContact O-CB 3.25Å; S222-L225 PolarHBondContact O-N 3.44Å; S223-L225 PolarHBondContact O-N 2.78Å; S223-L225 VanDerWaalsContact O-N 3.16Å
226S36.3Very low48.2Very low84 Ų84111.5 Ų111.559%0.58763%0.625SS**SBendtrans-950.3-171.960.90000116S223S223-S226 PolarHBondContact O-N 3.46Å; S223-S226 PolarHBondContact O-OG 3.35Å
227Y30.3Very low45.8Very low214 Ų214114.6 Ų114.684%0.83965%0.648SS**  trans-91.911.3-177.7-86.5-74.1000115.8
228N31.7Very low43.4Very low151 Ų151119.4 Ų119.481%0.80767%0.665SS**SBendtrans-82.8119164.1-91.9-15.8000110.2P230N228-P230 WeakPolarHBondContact O-CD 3.39Å
229T28.1Very low41.1Very low132 Ų132127.2 Ų127.281%0.8171%0.706SS**  trans-63.4122.3-179.727.60000112S231T229-S231 PolarHBondContact O-N 2.84Å
230P33.9Very low38.8Very low122 Ų122126.7 Ų126.779%0.79273%0.725SS**  trans-80.7101.8-174.630.6-34.4000112.3N228 H232N228-P230 WeakPolarHBondContact O-CD 3.39Å; P230-H232 PolarHBondContact O-N 3.09Å
231S30Very low37Very low117 Ų117124.4 Ų124.482%0.81873%0.731SS**  trans-71.989.5166-61.40000111.2T229T229-S231 PolarHBondContact O-N 2.84Å
232H39.5Very low35.5Very low183 Ų183132 Ų13285%0.84776%0.758SS**SBendtrans35.495.7164.1-88.7-89.9000118P230P230-H232 PolarHBondContact O-N 3.09Å
233T31.9Very low34.5Very low148 Ų148139.6 Ų139.691%0.90879%0.791SS**  -167.3108.3127.29.90000110.1
234D29.9Very low33.3Very low149 Ų149144.3 Ų144.380%0.79781%0.811SS**  trans-88.5138173.6-166.3-25.5000110
235A30.1Very low32.7Very low92 Ų92145 Ų14576%0.7681%0.813SS**  trans-151.987.8174.500000109.9
236S29.4Very low31.9Very low101 Ų101143.4 Ų143.471%0.70681%0.814SS**  trans-60.5138179.2-74.40000113.2R238S236-R238 PolarHBondContact O-N 2.96Å
237P35Very low31.8Very low129 Ų129150.1 Ų150.184%0.83883%0.828SS**  trans-78.7113.6179.930.9-33.7000112.2
238R31.5Very low32.1Very low240 Ų240147.4 Ų147.491%0.90683%0.827SS**  trans-132.3104.1159-88.5-168.5173.7-130.61.4110.3S236S236-R238 PolarHBondContact O-N 2.96Å
239L33.7Very low32.1Very low179 Ų179144.4 Ų144.494%0.93782%0.824SS**  trans-126.9109.3160.2-71.2176.5000108.1
240A30.5Very low32.6Very low96 Ų96144.9 Ų144.979%0.79383%0.826SS**  trans-76.5144.3160.500000108.2
241A31Very low32.8Very low98 Ų98150 Ų15081%0.8183%0.83SS**  trans-60.9142.9172.400000110.4
242K29.1Very low33Very low207 Ų207156 Ų15690%0.983%0.834SS**  trans-115.2111.2162.7-79.5-171.4172-173.40107.8
243E35.1Very low32.7Very low187 Ų187154.1 Ų154.187%0.87484%0.836SS**PPolyproline II helixtrans-77.1146.5162.9-61.2176.4126.600108.6
244D27.5Very low32.5Very low161 Ų161149.9 Ų149.986%0.86182%0.822SS**PPolyproline II helixtrans-89.6134.4176.5-131.1-27.3000109.7
245P34.5Very low32.5Very low114 Ų114154.8 Ų154.874%0.7483%0.829SS**PPolyproline II helixtrans-72.5137.3-171.4-19.333.2000114.4
246S31.5Very low32.4Very low108 Ų108156.3 Ų156.376%0.75583%0.834SS**PPolyproline II helixtrans-71.9160.7170.7-166.50000113D248S246-D248 VanDerWaalsContact C-N 3.28Å; S246-D248 PolarHBondContact O-N 3.3Å
247Y34Very low32.4Very low225 Ų225159.4 Ų159.488%0.88284%0.843SS**SBendtrans-7722.5-158.3-169-105.8000116.8
248D35.4Very low32.3Very low156 Ų156160.2 Ų160.283%0.83484%0.84SS**  trans-113.713.5-167.2-94.5-66.2000116.2S246S246-D248 VanDerWaalsContact C-N 3.28Å; S246-D248 PolarHBondContact O-N 3.3Å
249A32.7Very low32.2Very low88 Ų88155.9 Ų155.973%0.72783%0.832SS**  trans-962.4-173.100000116.4
250V39Very low32.3Very low143 Ų143156.3 Ų156.387%0.86783%0.829SS**  trans-105.454.3-174.8-165.90000112.4
251R37Very low32.3Very low229 Ų229157.7 Ų157.786%0.86483%0.833SS**SBendtrans-156.7122.4164.2-117.2174.3-178.7-173.40.3111.7
252R34.8Very low32.2Very low243 Ų243156.5 Ų156.592%0.91783%0.83SS**  trans68.9139.3-159.8-45.4179.9-124.2-122.85.4111
253T33.7Very low32.3Very low143 Ų143156.9 Ų156.988%0.87783%0.832SS**  cis-120.2154.13.942.40000111.9
254G28Very low31.9Very low59 Ų59151.9 Ų151.961%0.60883%0.83SS**  trans-109.3165.5168.400000111.6
255W28.8Very low32.2Very low252 Ų252149.6 Ų149.696%0.95583%0.827SS**  trans62.6109.7165.7-47.3-41.1000118.4
256S29.1Very low32.8Very low124 Ų124149.5 Ų149.587%0.86783%0.826SS**  -162.4135.9118.1-82.10000111.2
257N29.2Very low32.7Very low167 Ų167150.3 Ų150.389%0.89383%0.826SS**  trans-90.7152.3167.8-61.3-29.8000109.1
258N31.6Very low32.5Very low146 Ų146146.1 Ų146.178%0.78182%0.824SS**  -166.2166.5109.5-149.3-1.8000113
259M30Very low32.5Very low149 Ų149144 Ų14473%0.73482%0.818SS**  trans-61.5159.1175-59.4-84.493.900114.1
260H35.6Very low32.2Very low188 Ų188149 Ų14987%0.8783%0.827SS**  -164.6168.8103.5-96.885000111.2
261S30.9Very low31.7Very low124 Ų124149.7 Ų149.787%0.86783%0.826SS**  trans-114.2145-166.9-177.50000113.1
262G29.3Very low31.4Very low73 Ų73144.7 Ų144.775%0.75382%0.821SS**  trans-170.593-177.300000115.4
263K30.2Very low31Very low215 Ų215139.5 Ų139.594%0.93582%0.816SS**  trans-37.5141.1175-56.2165.3179.1176.60116.1
264G28.2Very low30.6Very low82 Ų82142.3 Ų142.385%0.84582%0.816SS**  trans162.5111.3156.700000117.6
265S32.2Very low30.4Very low113 Ų113145.2 Ų145.279%0.7983%0.827SS**  trans-155155.9163-131.40000107.4
266P47.1Very low30.4Very low113 Ų113139.6 Ų139.673%0.73482%0.821SS**  -146.6151.456.938.8-18.6000118.9
267V30.3Very low30.4Very low124 Ų124142.7 Ų142.775%0.75282%0.821SS**  60126.7129.5177.70000121.7
268V30.6Very low30.4Very low138 Ų138143.4 Ų143.484%0.83682%0.819SS**  -158.9141.2117.5139.90000108.5
269P33.9Very low30.6Very low110 Ų110141.6 Ų141.671%0.71483%0.825SS**PPolyproline II helixtrans-96.1153.7-163.136.2-36.4000115.3
270Q27.1Very low30.5Very low195 Ų195146 Ų14691%0.91183%0.833SS**PPolyproline II helixtrans-101.5136.8155.7-71.8-167.4-77.200110.1
271N27.9Very low30.6Very low156 Ų156142.6 Ų142.683%0.83483%0.828SS**PPolyproline II helixtrans-88.7147.8-176.8-165.820.7000111.9
272V31.8Very low30.5Very low125 Ų125144.9 Ų144.976%0.75883%0.825SS**  trans-104.4123.6-179.6174.60000110
273T25.3Very low31Very low133 Ų133146.3 Ų146.382%0.81682%0.821SS**  trans-153.8134.5148.9220000112.9
274K24.9Very low31.6Very low202 Ų202140 Ų14088%0.87880%0.797SS**  trans-29.5138.1172.8-64.1171.7172.6-179.80117.2
275S24.8Very low32.3Very low121 Ų121139.3 Ų139.385%0.84678%0.778SS**  trans-65.5145.1155.9-45.70000111.6
276T29.5Very low33.3Very low134 Ų134134.6 Ų134.682%0.82274%0.743SS**  trans-107.6136153.2-64.50000107.4
277E29.2Very low33.5Very low188 Ų188136 Ų13688%0.87974%0.74SS**  trans-83.1131.1-172.9-165.3167.7109.400111.9
278Q28.7Very low34.5Very low182 Ų182136.1 Ų136.185%0.8574%0.735SS**  trans-140.4138.4166.4-74.4-166-18.300110.1
279A35Very low35.8Very low108 Ų108130.2 Ų130.289%0.89370%0.699SS**PPolyproline II helixtrans-70.7146.9-173.600000112.9
280R28.9Very low36.8Very low241 Ų241125.9 Ų125.991%0.90967%0.674SS**PPolyproline II helixtrans-102.4138.1176.8-164.6171.1-178155.42.6110.1
281P36.2Very low37.9Very low117 Ų117120.6 Ų120.676%0.7666%0.657SS**PPolyproline II helixtrans-73.9150.1-166.828-36.4000114.3
282Q30Very low39.1Very low172 Ų172115.6 Ų115.680%0.80463%0.632SS**PPolyproline II helixtrans-70.9145.6164-73-72.9-12.800110.4
283P38.7Very low40.2Very low104 Ų104109.8 Ų109.868%0.67560%0.596SS**PPolyproline II helixtrans-68.1138.3168.430.3-33.5000110.2
284D43.6Very low41.4Very low82 Ų82107.5 Ų107.544%0.43959%0.586SS.*PPolyproline II helixtrans-83118.4-165.9-168.340.8000111.8Y286 Q287D284-Y286 PolarHBondContact O-N 3.35Å; D284-Y286 VanDerWaalsContact OD1-CD2 3.27Å; D284-Y286 WeakPolarHBondContact OD1-CD2 3.27Å; D284-Q287 PolarHBondContact O-N 3.41Å
285P43.7Very low42.8Very low68 Ų68108.4 Ų108.444%0.44258%0.584SS.*G310 helixtrans-64.1-15.8-171.525.5-35.5000113.8Q287P285-Q287 VanDerWaalsContact C-N 3.27Å; P285-Q287 PolarHBondContact O-N 2.87Å
286Y51.5Low44.4Very low13 Ų13104.6 Ų104.65%0.05155%0.554CS.*G310 helixtrans-76.2-12178.2-50.3-78.9000113.5D284 I288 L289 G290 W325 E326 G327 T328 E331D284-Y286 PolarHBondContact O-N 3.35Å; D284-Y286 VanDerWaalsContact OD1-CD2 3.27Å; D284-Y286 WeakPolarHBondContact OD1-CD2 3.27Å; Y286-I288 PolarHBondContact O-N 2.86Å; Y286-L289 PolarHBondContact O-N 2.93Å; Y286-G290 PolarHBondContact O-N 3.19Å; Y286-W325 VanDerWaalsContact CB-CD1 3.49Å; Y286-W325 HydrophobicContact CD1-CB 3.76Å; Y286-W325 AromaticContact CD1-CD2 3.21Å; Y286-W325 HydrophobicContact CD1-CD2 3.21Å; Y286-W325 AromaticContact CD1-CE2 3.92Å; Y286-W325 AromaticContact CD1-CE3 3.17Å; Y286-W325 HydrophobicContact CD1-CE3 3.17Å; Y286-W325 AromaticContact CD1-CG 3.5Å; Y286-W325 HydrophobicContact CD1-CG 3.5Å; Y286-W325 HydrophobicContact CD1-CH2 4.49Å; Y286-W325 AromaticContact CD1-CZ3 3.87Å; Y286-W325 HydrophobicContact CD1-CZ3 3.87Å; Y286-W325 HydrophobicContact CD2-CB 3.45Å; Y286-W325 VanDerWaalsContact CD2-CB 3.45Å; Y286-W325 HydrophobicContact CD2-CD2 4.38Å; Y286-W325 AromaticContact CD2-CG 3.77Å; Y286-W325 HydrophobicContact CD2-CG 3.77Å; Y286-W325 HydrophobicContact CE1-CB 3.83Å; Y286-W325 AromaticContact CE1-CD2 3.83Å; Y286-W325 HydrophobicContact CE1-CD2 3.83Å; Y286-W325 AromaticContact CE1-CE3 3.44Å; Y286-W325 HydrophobicContact CE1-CE3 3.44Å; Y286-W325 VanDerWaalsContact CE1-CE3 3.44Å; Y286-W325 HydrophobicContact CE1-CG 4.04Å; Y286-W325 HydrophobicContact CE1-CZ3 4.24Å; Y286-W325 HydrophobicContact CE2-CB 3.61Å; Y286-W325 HydrophobicContact CE2-CG 4.34Å; Y286-W325 HydrophobicContact CG-CB 3.54Å; Y286-W325 AromaticContact CG-CD1 3.77Å; Y286-W325 AromaticContact CG-CD2 3.52Å; Y286-W325 HydrophobicContact CG-CD2 3.52Å; Y286-W325 AromaticContact CG-CE3 3.99Å; Y286-W325 HydrophobicContact CG-CE3 3.99Å; Y286-W325 AromaticContact CG-CG 3.32Å; Y286-W325 HydrophobicContact CG-CG 3.32Å; Y286-E326 PolarHBondContact OH-O 3.2Å; Y286-G327 PolarHBondContact OH-N 2.93Å; Y286-G327 PolarHBondContact OH-O 2.95Å; Y286-T328 PolarHBondContact OH-N 3.09Å; Y286-E331 VanDerWaalsContact CE1-O 3.31Å; Y286-E331 WeakPolarHBondContact CE1-O 3.34Å; Y286-E331 PolarHBondContact OH-O 2.97Å
287Q52Low45.5Very low143 Ų14398.6 Ų98.667%0.66852%0.518SS*.G310 helixtrans-59.1-26.3172.1-71.8-171.8-5.600112.9D284 P285 L289 G290 P291D284-Q287 PolarHBondContact O-N 3.41Å; P285-Q287 VanDerWaalsContact C-N 3.27Å; P285-Q287 PolarHBondContact O-N 2.87Å; Q287-L289 VanDerWaalsContact C-N 3.27Å; Q287-L289 PolarHBondContact O-N 3.18Å; Q287-G290 PolarHBondContact O-N 3.01Å; Q287-P291 WeakPolarHBondContact O-CD 3.46Å
288I52.3Low46.8Very low127 Ų12795.5 Ų95.565%0.65151%0.508SS*.G310 helixtrans-64.1-33.8173.4-65.9168.3000111.3Y286 G290 T292Y286-I288 PolarHBondContact O-N 2.86Å; I288-G290 VanDerWaalsContact C-N 3.34Å; I288-T292 PolarHBondContact O-OG1 3.42Å
289L57.1Low48Very low14 Ų1492.6 Ų92.67%0.07350%0.504CS..Hα-helixtrans-80.8-11.5178.1-70.6171.2000113.1Y286 Q287 S293 W325 F385Y286-L289 PolarHBondContact O-N 2.93Å; Q287-L289 VanDerWaalsContact C-N 3.27Å; Q287-L289 PolarHBondContact O-N 3.18Å; L289-S293 WeakPolarHBondContact O-CB 3.34Å; L289-S293 PolarHBondContact O-N 3.22Å; L289-S293 PolarHBondContact O-OG 3.26Å; L289-W325 HydrophobicContact CB-CH2 4.32Å; L289-W325 HydrophobicContact CB-CZ2 4.06Å; L289-W325 HydrophobicContact CD1-CH2 3.42Å; L289-W325 VanDerWaalsContact CD1-CH2 3.42Å; L289-W325 HydrophobicContact CD1-CZ2 3.95Å; L289-W325 HydrophobicContact CD1-CZ3 3.97Å; L289-W325 HydrophobicContact CG-CH2 4.48Å; L289-F385 HydrophobicContact CD1-CE1 4.15Å; L289-F385 HydrophobicContact CD1-CZ 4.24Å; L289-F385 HydrophobicContact CD2-CE1 3.88Å; L289-F385 HydrophobicContact CG-CE1 4.22Å
290G54.5Low49Very low19 Ų1990.4 Ų90.420%0.19649%0.492CS..Hα-helixtrans-63.6-60.1175.600000113.3Y286 Q287 I288 T292 S293 S294Y286-G290 PolarHBondContact O-N 3.19Å; Q287-G290 PolarHBondContact O-N 3.01Å; I288-G290 VanDerWaalsContact C-N 3.34Å; G290-T292 PolarHBondContact O-N 3.44Å; G290-S293 PolarHBondContact O-N 3.3Å; G290-S293 PolarHBondContact O-OG 3.03Å; G290-S294 WeakPolarHBondContact O-CB 3.22Å; G290-S294 PolarHBondContact O-N 3.35Å
291P50.7Low50.6Low84 Ų8480.8 Ų80.855%0.54546%0.462SS..Hα-helixtrans-58.6-35.5175.5-26.135.1000113.3Q287 R295Q287-P291 WeakPolarHBondContact O-CD 3.46Å; P291-R295 WeakPolarHBondContact O-CG 3.14Å; P291-R295 PolarHBondContact O-N 3.27Å
292T53Low52.1Low50 Ų5077.4 Ų77.431%0.30745%0.448SS..Hα-helixtrans-65.7-59.3176-53.60000110.5I288 G290 S294 R295 L296I288-T292 PolarHBondContact O-OG1 3.42Å; G290-T292 PolarHBondContact O-N 3.44Å; T292-S294 VanDerWaalsContact C-N 3.31Å; T292-S294 PolarHBondContact O-N 3.25Å; T292-R295 PolarHBondContact O-N 3.32Å; T292-L296 HydrophobicContact CG2-CD1 3.52Å; T292-L296 HydrophobicContact CG2-CG 4.45Å; T292-L296 WeakPolarHBondContact O-CD1 3.35Å; T292-L296 WeakPolarHBondContact O-CG 3.46Å; T292-L296 PolarHBondContact O-N 3.45Å
293S54.1Low54.6Low3 Ų377.2 Ų77.22%0.02145%0.447CS..Hα-helixtrans-54.1-44.1178.6560000113.1L289 G290 R295 L296 A297 L311 S315L289-S293 WeakPolarHBondContact O-CB 3.34Å; L289-S293 PolarHBondContact O-N 3.22Å; L289-S293 PolarHBondContact O-OG 3.26Å; G290-S293 PolarHBondContact O-N 3.3Å; G290-S293 PolarHBondContact O-OG 3.03Å; S293-R295 VanDerWaalsContact C-N 3.3Å; S293-R295 PolarHBondContact O-N 3.33Å; S293-L296 PolarHBondContact O-N 3.38Å; S293-L296 VanDerWaalsContact O-N 3.1Å; S293-A297 PolarHBondContact O-N 3.38Å; S293-A297 VanDerWaalsContact O-N 3.13Å; S293-L311 WeakPolarHBondContact CB-O 3.35Å; S293-S315 WeakPolarHBondContact OG-CB 3.3Å
294S51Low57Low86 Ų8672.7 Ų72.760%0.60142%0.417SS*.Hα-helixtrans-62.7-29.3177.8179.60000114.3G290 T292G290-S294 WeakPolarHBondContact O-CB 3.22Å; G290-S294 PolarHBondContact O-N 3.35Å; T292-S294 VanDerWaalsContact C-N 3.31Å; T292-S294 PolarHBondContact O-N 3.25Å
295R55.1Low59.4Low221 Ų22172.7 Ų72.783%0.83442%0.415SS*.Hα-helixtrans-86.6-11.3175.5-72.5-176.9-176.1-88.44.9113.6P291 T292 S293P291-R295 WeakPolarHBondContact O-CG 3.14Å; P291-R295 PolarHBondContact O-N 3.27Å; T292-R295 PolarHBondContact O-N 3.32Å; S293-R295 VanDerWaalsContact C-N 3.3Å; S293-R295 PolarHBondContact O-N 3.33Å
296L57.2Low61.8Low40 Ų4069.6 Ų69.621%0.20939%0.394CS..Hα-helixtrans-106.5-22.3-171.7-66.8174000114.4T292 S293 Q308 L392T292-L296 HydrophobicContact CG2-CD1 3.52Å; T292-L296 HydrophobicContact CG2-CG 4.45Å; T292-L296 WeakPolarHBondContact O-CD1 3.35Å; T292-L296 WeakPolarHBondContact O-CG 3.46Å; T292-L296 PolarHBondContact O-N 3.45Å; S293-L296 PolarHBondContact O-N 3.38Å; S293-L296 VanDerWaalsContact O-N 3.1Å; L296-Q308 PolarHBondContact O-NE2 3.48Å; L296-L392 HydrophobicContact CD1-CD1 3.9Å; L296-L392 HydrophobicContact CD1-CD2 3.62Å; L296-L392 HydrophobicContact CD1-CG 4.36Å; L296-L392 HydrophobicContact CD2-CD1 4.14Å; L296-L392 HydrophobicContact CD2-CD2 3.23Å; L296-L392 HydrophobicContact CD2-CG 4.26Å; L296-L392 HydrophobicContact CG-CD2 3.98Å
297A53.4Low63.8Low8 Ų869 Ų697%0.06639%0.392CS..SBendtrans-84.7110.3165.400000109.2S293 P299 I304 E312S293-A297 PolarHBondContact O-N 3.38Å; S293-A297 VanDerWaalsContact O-N 3.13Å; A297-P299 WeakPolarHBondContact O-CD 3.11Å; A297-P299 VanDerWaalsContact O-N 3.15Å; A297-I304 HydrophobicContact CB-CD1 3.88Å; A297-E312 HydrophobicContact CB-CB 4.14Å; A297-E312 HydrophobicContact CB-CG 3.95Å; A297-E312 WeakPolarHBondContact CB-OE2 3.46Å
298N55.3Low65.7Low124 Ų12463.8 Ų63.866%0.66337%0.368SS*.  trans-64.5108159.6-88.5-29.7000107.2G300 S301N298-G300 PolarHBondContact O-N 3.01Å; N298-S301 WeakPolarHBondContact O-CB 3.34Å; N298-S301 PolarHBondContact O-N 3.32Å
299P54.3Low67.7Low121 Ų12157.8 Ų57.879%0.78634%0.337SS*.THydrogen-bonded Turntrans-63.4127.8-164-24.436.2000111.3A297 S301A297-P299 WeakPolarHBondContact O-CD 3.11Å; A297-P299 VanDerWaalsContact O-N 3.15Å; P299-S301 VanDerWaalsContact C-N 3.26Å; P299-S301 PolarHBondContact O-N 3Å
300G57.1Low69.6Low62 Ų6257.1 Ų57.164%0.63933%0.334SS*.THydrogen-bonded Turntrans75.7-0.8-178.100000116.1N298 G302N298-G300 PolarHBondContact O-N 3.01Å; G300-G302 PolarHBondContact O-N 2.96Å
301S62.2Low71.4Confident38 Ų3856.4 Ų56.427%0.26633%0.325SS..  trans-68.7115.6176.6179.80000111.8N298 P299 Q303 I304N298-S301 WeakPolarHBondContact O-CB 3.34Å; N298-S301 PolarHBondContact O-N 3.32Å; P299-S301 VanDerWaalsContact C-N 3.26Å; P299-S301 PolarHBondContact O-N 3Å; S301-Q303 PolarHBondContact O-N 2.85Å; S301-Q303 WeakPolarHBondContact OG-CB 3.41Å; S301-Q303 PolarHBondContact OG-N 2.9Å; S301-I304 WeakPolarHBondContact O-CB 3.19Å; S301-I304 VanDerWaalsContact O-CG2 3.3Å; S301-I304 WeakPolarHBondContact O-CG2 3.31Å; S301-I304 PolarHBondContact O-N 2.9Å; S301-I304 VanDerWaalsContact O-N 3.14Å
302G67.3Low73.2Confident46 Ų4654.2 Ų54.247%0.47431%0.308SS..THydrogen-bonded Turntrans-60.8-6.9172.300000114.3G300 K348G300-G302 PolarHBondContact O-N 2.96Å; G302-K348 WeakPolarHBondContact O-CE 3.36Å; G302-K348 PolarHBondContact O-NZ 2.99Å
303Q83.3Confident75.1Confident169 Ų16952.3 Ų52.379%0.7930%0.296SS*.THydrogen-bonded Turntrans-82.4-18.2176-161.2169.20.700113.4S301 K348S301-Q303 PolarHBondContact O-N 2.85Å; S301-Q303 WeakPolarHBondContact OG-CB 3.41Å; S301-Q303 PolarHBondContact OG-N 2.9Å; Q303-K348 VanDerWaalsContact C-NZ 3.29Å; Q303-K348 PolarHBondContact O-NZ 2.8Å
304I88.7Confident77Confident8 Ų852.6 Ų52.64%0.04130%0.297CS..  trans-46.3139.4-175.6-166.6171.1000114.8A297 S301 Q308 F309 E312 W344 R347 K348A297-I304 HydrophobicContact CB-CD1 3.88Å; S301-I304 WeakPolarHBondContact O-CB 3.19Å; S301-I304 VanDerWaalsContact O-CG2 3.3Å; S301-I304 WeakPolarHBondContact O-CG2 3.31Å; S301-I304 PolarHBondContact O-N 2.9Å; S301-I304 VanDerWaalsContact O-N 3.14Å; I304-Q308 HydrophobicContact CD1-CB 4Å; I304-Q308 HydrophobicContact CG1-CB 3.64Å; I304-F309 HydrophobicContact CD1-CB 4.17Å; I304-F309 HydrophobicContact CG1-CB 4.43Å; I304-E312 VanDerWaalsContact CD1-OE2 3.22Å; I304-E312 WeakPolarHBondContact CD1-OE2 3.27Å; I304-W344 HydrophobicContact CG2-CZ3 4.33Å; I304-W344 WeakPolarHBondContact O-CH2 3.36Å; I304-R347 HydrophobicContact CG2-CG 3.69Å; I304-K348 HydrophobicContact CG2-CD 4.43Å; I304-K348 PolarHBondContact O-NZ 3.11Å
305Q92.5Very high78.7Confident82 Ų8251.2 Ų51.238%0.38329%0.287SS..  trans-80.6157.5176.4-59.4-179.660.600111.9W307 Q308 F309Q305-W307 VanDerWaalsContact C-N 3.35Å; Q305-W307 VanDerWaalsContact CD-NE1 3.33Å; Q305-W307 PolarHBondContact O-N 2.9Å; Q305-Q308 HydrophobicContact CB-CG 4.31Å; Q305-Q308 VanDerWaalsContact CB-OE1 3.24Å; Q305-Q308 PolarHBondContact O-N 3.24Å; Q305-F309 WeakPolarHBondContact O-CB 3.45Å; Q305-F309 PolarHBondContact O-N 2.98Å
306L94.9Very high80.2Confident3 Ų344.3 Ų44.32%0.01627%0.267CS..Hα-helixtrans-61.8-40.9-178.1174.759.8000112.1Q308 F309 L310 W344 L358 A361 L362 Y365L306-Q308 PolarHBondContact O-N 3.23Å; L306-F309 HydrophobicContact CD1-CD1 4.21Å; L306-F309 PolarHBondContact O-N 2.85Å; L306-L310 HydrophobicContact CD1-CD1 4.3Å; L306-L310 HydrophobicContact CD1-CD2 4.26Å; L306-L310 HydrophobicContact CD1-CG 4.01Å; L306-L310 HydrophobicContact CG-CD1 4.44Å; L306-L310 WeakPolarHBondContact O-CG 3.35Å; L306-L310 PolarHBondContact O-N 2.95Å; L306-W344 HydrophobicContact CB-CH2 3.85Å; L306-W344 HydrophobicContact CB-CZ2 3.69Å; L306-W344 HydrophobicContact CB-CZ3 4.38Å; L306-W344 HydrophobicContact CD1-CD2 3.74Å; L306-W344 HydrophobicContact CD1-CE3 4.11Å; L306-W344 HydrophobicContact CD1-CG 3.99Å; L306-W344 HydrophobicContact CD1-CZ2 4.32Å; L306-W344 HydrophobicContact CG-CZ2 4.5Å; L306-L358 HydrophobicContact CD1-CD1 4.13Å; L306-L358 HydrophobicContact CD1-CG 4.11Å; L306-L358 HydrophobicContact CD2-CD2 4.44Å; L306-L358 HydrophobicContact CD2-CG 4.15Å; L306-A361 HydrophobicContact CD2-CB 3.59Å; L306-L362 HydrophobicContact CD2-CD2 3.55Å; L306-L362 HydrophobicContact CD2-CG 4.18Å; L306-L362 HydrophobicContact CG-CD2 3.96Å; L306-Y365 HydrophobicContact CB-CE2 4.03Å; L306-Y365 HydrophobicContact CD2-CE2 4.33Å; L306-Y365 HydrophobicContact CG-CE2 4.29Å; L306-Y365 PolarHBondContact N-OH 2.77Å
307W94.3Very high81.7Confident0 Ų047.7 Ų47.70%029%0.293CS..Hα-helixtrans-64.7-37.8178.470.9-98.2000112.5Q305 L311 Y365 I370 M371 F383 I388 A391 L392Q305-W307 VanDerWaalsContact C-N 3.35Å; Q305-W307 VanDerWaalsContact CD-NE1 3.33Å; Q305-W307 PolarHBondContact O-N 2.9Å; W307-L311 HydrophobicContact CE3-CD1 3.81Å; W307-L311 HydrophobicContact CZ3-CD1 3.82Å; W307-L311 WeakPolarHBondContact O-CG 3.14Å; W307-L311 PolarHBondContact O-N 3.24Å; W307-L311 VanDerWaalsContact O-N 3.16Å; W307-Y365 HydrophobicContact CB-CD2 4.4Å; W307-Y365 HydrophobicContact CB-CE2 3.96Å; W307-Y365 AromaticContact CD1-CE1 3.75Å; W307-Y365 AromaticContact CD1-CZ 3.67Å; W307-I370 HydrophobicContact CB-CG2 3.71Å; W307-I370 HydrophobicContact CD2-CG2 4.39Å; W307-I370 HydrophobicContact CG-CG2 3.82Å; W307-M371 HydrophobicContact CB-CE 3.84Å; W307-F383 HydrophobicContact CB-CE1 4.3Å; W307-I388 HydrophobicContact CD2-CD1 4.01Å; W307-I388 HydrophobicContact CE3-CD1 3.35Å; W307-I388 HydrophobicContact CZ3-CD1 3.67Å; W307-I388 HydrophobicContact CZ3-CG2 4.49Å; W307-A391 HydrophobicContact CH2-CB 4.46Å; W307-A391 HydrophobicContact CZ2-CB 3.84Å; W307-L392 HydrophobicContact CH2-CD2 3.67Å; W307-L392 HydrophobicContact CZ3-CD2 4.48Å
308Q92.1Very high83.5Confident34 Ų3451 Ų5116%0.15932%0.321CS..Hα-helixtrans-65.9-43.8173.8-65171.2-69.700111.2L296 I304 Q305 L306 L310 L311 E312L296-Q308 PolarHBondContact O-NE2 3.48Å; I304-Q308 HydrophobicContact CD1-CB 4Å; I304-Q308 HydrophobicContact CG1-CB 3.64Å; Q305-Q308 HydrophobicContact CB-CG 4.31Å; Q305-Q308 VanDerWaalsContact CB-OE1 3.24Å; Q305-Q308 PolarHBondContact O-N 3.24Å; L306-Q308 PolarHBondContact O-N 3.23Å; Q308-L310 PolarHBondContact O-N 3.06Å; Q308-L311 WeakPolarHBondContact O-CB 3.28Å; Q308-L311 PolarHBondContact O-N 3.13Å; Q308-E312 WeakPolarHBondContact O-CB 2.98Å; Q308-E312 PolarHBondContact O-N 3.19Å
309F94.5Very high85.3Confident2 Ų246.1 Ų46.11%0.00930%0.295CS..Hα-helixtrans-64-37.8178.7168.6-98.6000112.9I304 Q305 L306 E312 L313 R343 W344 R347I304-F309 HydrophobicContact CD1-CB 4.17Å; I304-F309 HydrophobicContact CG1-CB 4.43Å; Q305-F309 WeakPolarHBondContact O-CB 3.45Å; Q305-F309 PolarHBondContact O-N 2.98Å; L306-F309 HydrophobicContact CD1-CD1 4.21Å; L306-F309 PolarHBondContact O-N 2.85Å; F309-E312 WeakPolarHBondContact O-CB 3.4Å; F309-E312 PolarHBondContact O-N 3.46Å; F309-L313 HydrophobicContact CD1-CD1 4.46Å; F309-L313 HydrophobicContact CE1-CD1 3.68Å; F309-L313 HydrophobicContact CE1-CG 4.33Å; F309-L313 HydrophobicContact CE2-CD1 4.34Å; F309-L313 HydrophobicContact CE2-CD2 4.45Å; F309-L313 HydrophobicContact CE2-CG 4.26Å; F309-L313 HydrophobicContact CZ-CD1 3.62Å; F309-L313 HydrophobicContact CZ-CD2 4.4Å; F309-L313 HydrophobicContact CZ-CG 4.04Å; F309-L313 PolarHBondContact O-N 3.19Å; F309-R343 HydrophobicContact CZ-CB 3.78Å; F309-W344 HydrophobicContact CB-CE3 3.92Å; F309-W344 HydrophobicContact CB-CZ3 3.77Å; F309-W344 HydrophobicContact CD1-CB 4.24Å; F309-W344 HydrophobicContact CD1-CD2 4.24Å; F309-W344 AromaticContact CD1-CE3 3.53Å; F309-W344 HydrophobicContact CD1-CE3 3.53Å; F309-W344 HydrophobicContact CD1-CZ3 4.26Å; F309-W344 HydrophobicContact CD2-CE3 4.23Å; F309-W344 HydrophobicContact CE1-CB 3.68Å; F309-W344 HydrophobicContact CE1-CE3 4.08Å; F309-W344 HydrophobicContact CE1-CG 4.44Å; F309-W344 AromaticContact CG-CE3 3.61Å; F309-W344 HydrophobicContact CG-CE3 3.61Å; F309-W344 AromaticContact CG-CZ3 3.98Å; F309-W344 HydrophobicContact CG-CZ3 3.98Å; F309-W344 HydrophobicContact CZ-CB 4.2Å; F309-R347 HydrophobicContact CD2-CB 4.24Å; F309-R347 HydrophobicContact CD2-CG 3.91Å; F309-R347 HydrophobicContact CE2-CB 3.99Å; F309-R347 HydrophobicContact CE2-CG 4.13Å
310L95.6Very high87.1Confident0 Ų042.2 Ų42.20%027%0.273CS..Hα-helixtrans-68.2-39.7174.3-65.8-176.6000111.6L306 Q308 E312 L313 L314 I323 F332 M334 V340 L362 M371 F383L306-L310 HydrophobicContact CD1-CD1 4.3Å; L306-L310 HydrophobicContact CD1-CD2 4.26Å; L306-L310 HydrophobicContact CD1-CG 4.01Å; L306-L310 HydrophobicContact CG-CD1 4.44Å; L306-L310 WeakPolarHBondContact O-CG 3.35Å; L306-L310 PolarHBondContact O-N 2.95Å; Q308-L310 PolarHBondContact O-N 3.06Å; L310-E312 VanDerWaalsContact C-N 3.34Å; L310-L313 PolarHBondContact O-N 2.83Å; L310-L314 VanDerWaalsContact O-CB 3.26Å; L310-L314 WeakPolarHBondContact O-CB 3.1Å; L310-L314 WeakPolarHBondContact O-CD1 3.41Å; L310-L314 VanDerWaalsContact O-CG 3.27Å; L310-L314 WeakPolarHBondContact O-CG 3.43Å; L310-L314 PolarHBondContact O-N 2.7Å; L310-I323 HydrophobicContact CB-CD1 4.36Å; L310-I323 HydrophobicContact CD2-CD1 3.76Å; L310-F332 HydrophobicContact CD1-CE2 4.23Å; L310-F332 HydrophobicContact CD1-CZ 4.01Å; L310-M334 HydrophobicContact CD1-CE 3.68Å; L310-M334 HydrophobicContact CD2-CE 3.86Å; L310-M334 HydrophobicContact CG-CE 4.46Å; L310-V340 HydrophobicContact CD2-CG1 3.66Å; L310-L362 HydrophobicContact CD1-CD2 3.66Å; L310-M371 HydrophobicContact CD1-CE 4.49Å; L310-F383 HydrophobicContact CB-CZ 4.24Å
311L92.1Very high88.9Confident3 Ų342.4 Ų42.42%0.01628%0.275CS..Hα-helixtrans-61.9-39.4171.4-76.7177.7000112.4S293 W307 Q308 L314 S315 W325 F383 I388S293-L311 WeakPolarHBondContact CB-O 3.35Å; W307-L311 HydrophobicContact CE3-CD1 3.81Å; W307-L311 HydrophobicContact CZ3-CD1 3.82Å; W307-L311 WeakPolarHBondContact O-CG 3.14Å; W307-L311 PolarHBondContact O-N 3.24Å; W307-L311 VanDerWaalsContact O-N 3.16Å; Q308-L311 WeakPolarHBondContact O-CB 3.28Å; Q308-L311 PolarHBondContact O-N 3.13Å; L311-L314 CarbonylContact O-C 3.59Å; L311-L314 PolarHBondContact O-N 2.97Å; L311-S315 PolarHBondContact O-N 2.9Å; L311-W325 HydrophobicContact CD2-CH2 3.76Å; L311-W325 HydrophobicContact CD2-CZ2 4.27Å; L311-F383 HydrophobicContact CD1-CE1 4.38Å; L311-F383 HydrophobicContact CD2-CD2 3.92Å; L311-F383 HydrophobicContact CD2-CE1 4.13Å; L311-F383 HydrophobicContact CD2-CE2 3.5Å; L311-F383 HydrophobicContact CD2-CG 4.41Å; L311-F383 HydrophobicContact CD2-CZ 3.62Å; L311-F383 HydrophobicContact CG-CE1 3.9Å; L311-F383 HydrophobicContact CG-CE2 4.04Å; L311-F383 HydrophobicContact CG-CZ 3.6Å; L311-I388 HydrophobicContact CD1-CD1 4.42Å
312E90Very high90.6Very high39 Ų3940.9 Ų40.918%0.18226%0.264CS..Hα-helixtrans-61-50.1175.8-173-163.6118.900111.6A297 I304 Q308 F309 L310 L314 S315 R347A297-E312 HydrophobicContact CB-CB 4.14Å; A297-E312 HydrophobicContact CB-CG 3.95Å; A297-E312 WeakPolarHBondContact CB-OE2 3.46Å; I304-E312 VanDerWaalsContact CD1-OE2 3.22Å; I304-E312 WeakPolarHBondContact CD1-OE2 3.27Å; Q308-E312 WeakPolarHBondContact O-CB 2.98Å; Q308-E312 PolarHBondContact O-N 3.19Å; F309-E312 WeakPolarHBondContact O-CB 3.4Å; F309-E312 PolarHBondContact O-N 3.46Å; L310-E312 VanDerWaalsContact C-N 3.34Å; E312-L314 VanDerWaalsContact C-N 3.31Å; E312-L314 PolarHBondContact O-N 3.39Å; E312-S315 WeakPolarHBondContact O-CB 3.49Å; E312-S315 PolarHBondContact O-N 3.29Å; E312-S315 VanDerWaalsContact O-N 3.16Å; E312-S315 PolarHBondContact O-OG 3.24Å; E312-R347 IonicContact OE1-CZ 3.25Å; E312-R347 VanDerWaalsContact OE1-CZ 3.22Å; E312-R347 IonicContact OE1-NH1 2.7Å; E312-R347 PolarHBondContact OE1-NH1 3.34Å; E312-R347 IonicContact OE1-NH2 3.5Å; E312-R347 PolarHBondContact OE1-NH2 3.16Å; E312-R347 IonicContact OE2-CZ 2.87Å; E312-R347 IonicContact OE2-NH1 2.68Å; E312-R347 PolarHBondContact OE2-NH1 2.88Å; E312-R347 IonicContact OE2-NH2 3.4Å
313L92.9Very high92Very high10 Ų1038.8 Ų38.85%0.05224%0.242CC..Hα-helixtrans-61-41175.3-68.6-178.8000112F309 L310 S315 D316 N319 I323F309-L313 HydrophobicContact CD1-CD1 4.46Å; F309-L313 HydrophobicContact CE1-CD1 3.68Å; F309-L313 HydrophobicContact CE1-CG 4.33Å; F309-L313 HydrophobicContact CE2-CD1 4.34Å; F309-L313 HydrophobicContact CE2-CD2 4.45Å; F309-L313 HydrophobicContact CE2-CG 4.26Å; F309-L313 HydrophobicContact CZ-CD1 3.62Å; F309-L313 HydrophobicContact CZ-CD2 4.4Å; F309-L313 HydrophobicContact CZ-CG 4.04Å; F309-L313 PolarHBondContact O-N 3.19Å; L310-L313 PolarHBondContact O-N 2.83Å; L313-S315 PolarHBondContact O-N 2.84Å; L313-D316 PolarHBondContact O-N 3.07Å; L313-N319 WeakPolarHBondContact O-CB 3.4Å; L313-N319 PolarHBondContact O-ND2 3.12Å; L313-I323 HydrophobicContact CB-CG2 3.59Å; L313-I323 HydrophobicContact CD1-CG2 4.01Å; L313-I323 HydrophobicContact CG-CG2 4.45Å
314L93.1Very high92.5Very high8 Ų832.7 Ų32.74%0.04222%0.217CC..Hα-helixtrans-71.4-12.1178.4-78.8167.3000114.2L310 L311 E312 D316 I323 T324 W325 F332 F383L310-L314 VanDerWaalsContact O-CB 3.26Å; L310-L314 WeakPolarHBondContact O-CB 3.1Å; L310-L314 WeakPolarHBondContact O-CD1 3.41Å; L310-L314 VanDerWaalsContact O-CG 3.27Å; L310-L314 WeakPolarHBondContact O-CG 3.43Å; L310-L314 PolarHBondContact O-N 2.7Å; L311-L314 CarbonylContact O-C 3.59Å; L311-L314 PolarHBondContact O-N 2.97Å; E312-L314 VanDerWaalsContact C-N 3.31Å; E312-L314 PolarHBondContact O-N 3.39Å; L314-D316 VanDerWaalsContact C-N 3.3Å; L314-I323 HydrophobicContact CD1-CD1 4.11Å; L314-I323 HydrophobicContact CD1-CG1 4.4Å; L314-I323 HydrophobicContact CD2-CD1 4.42Å; L314-I323 HydrophobicContact CD2-CG1 3.88Å; L314-I323 HydrophobicContact CG-CD1 4Å; L314-I323 HydrophobicContact CG-CG1 4Å; L314-T324 VanDerWaalsContact CD2-C 3.45Å; L314-W325 HydrophobicContact CB-CD2 4.37Å; L314-W325 HydrophobicContact CB-CH2 4.25Å; L314-W325 HydrophobicContact CB-CZ2 3.55Å; L314-W325 HydrophobicContact CD1-CD2 4.35Å; L314-W325 HydrophobicContact CD1-CE3 4.21Å; L314-W325 HydrophobicContact CD1-CH2 3.84Å; L314-W325 HydrophobicContact CD1-CZ2 4Å; L314-W325 HydrophobicContact CD1-CZ3 3.96Å; L314-W325 HydrophobicContact CD2-CD2 3.89Å; L314-W325 HydrophobicContact CD2-CE3 4.38Å; L314-W325 HydrophobicContact CD2-CG 4.03Å; L314-W325 HydrophobicContact CG-CD2 4.44Å; L314-W325 HydrophobicContact CG-CZ2 4.24Å; L314-W325 PolarHBondContact O-NE1 3.35Å; L314-F332 HydrophobicContact CD1-CB 3.83Å; L314-F332 HydrophobicContact CD1-CD1 4.09Å; L314-F332 HydrophobicContact CD1-CD2 3.86Å; L314-F332 HydrophobicContact CD1-CE2 4.39Å; L314-F332 HydrophobicContact CD1-CG 3.67Å; L314-F332 HydrophobicContact CD2-CB 4.09Å; L314-F383 HydrophobicContact CD1-CE2 3.96Å
315S86.6Confident92.8Very high57 Ų5734.1 Ų34.140%0.39922%0.222SC..Hα-helixtrans-72-25.8176.5780000113S293 L311 E312 L313S293-S315 WeakPolarHBondContact OG-CB 3.3Å; L311-S315 PolarHBondContact O-N 2.9Å; E312-S315 WeakPolarHBondContact O-CB 3.49Å; E312-S315 PolarHBondContact O-N 3.29Å; E312-S315 VanDerWaalsContact O-N 3.16Å; E312-S315 PolarHBondContact O-OG 3.24Å; L313-S315 PolarHBondContact O-N 2.84Å
316D86.3Confident92.5Very high77 Ų7732.8 Ų32.841%0.41222%0.215SC..SBendtrans-116.6115.9-178.716822.9000110.6L313 L314 A318 N319L313-D316 PolarHBondContact O-N 3.07Å; L314-D316 VanDerWaalsContact C-N 3.3Å; D316-A318 PolarHBondContact O-N 3.25Å; D316-A318 VanDerWaalsContact O-N 3.13Å; D316-A318 VanDerWaalsContact OD1-CB 3.32Å; D316-A318 WeakPolarHBondContact OD1-CB 3.29Å; D316-A318 PolarHBondContact OD1-N 3.2Å; D316-N319 WeakPolarHBondContact O-CB 3.19Å; D316-N319 PolarHBondContact O-N 3.5Å; D316-N319 PolarHBondContact O-ND2 3.09Å; D316-N319 PolarHBondContact OD2-ND2 3.42Å
317S88.4Confident91.7Very high110 Ų11034.9 Ų34.977%0.76924%0.238SC*.G310 helixtrans-60.1-19.1179.462.40000114.7N319 A320S317-N319 PolarHBondContact O-N 3.28Å; S317-A320 WeakPolarHBondContact O-CB 3.4Å; S317-A320 PolarHBondContact O-N 3Å
318A91.5Very high91Very high79 Ų7938.8 Ų38.865%0.65326%0.262SS*.G310 helixtrans-62.4-21.3173.200000112.6D316 A320D316-A318 PolarHBondContact O-N 3.25Å; D316-A318 VanDerWaalsContact O-N 3.13Å; D316-A318 VanDerWaalsContact OD1-CB 3.32Å; D316-A318 WeakPolarHBondContact OD1-CB 3.29Å; D316-A318 PolarHBondContact OD1-N 3.2Å; A318-A320 VanDerWaalsContact C-N 3.26Å; A318-A320 PolarHBondContact O-N 3.47Å
319N92.6Very high90.2Very high20 Ų2042 Ų4211%0.10728%0.28CS..G310 helixtrans-79.5-1.8175.8-59-58.9000114L313 D316 S317 G321 C322 I323 R343L313-N319 WeakPolarHBondContact O-CB 3.4Å; L313-N319 PolarHBondContact O-ND2 3.12Å; D316-N319 WeakPolarHBondContact O-CB 3.19Å; D316-N319 PolarHBondContact O-N 3.5Å; D316-N319 PolarHBondContact O-ND2 3.09Å; D316-N319 PolarHBondContact OD2-ND2 3.42Å; S317-N319 PolarHBondContact O-N 3.28Å; N319-G321 PolarHBondContact O-N 3.16Å; N319-C322 PolarHBondContact O-N 3.44Å; N319-C322 PolarHBondContact O-SG 2.83Å; N319-I323 CarbonylContact C-O 3.43Å; N319-I323 HydrophobicContact CB-CG2 4.29Å; N319-I323 PolarHBondContact O-N 3.04Å; N319-I323 VanDerWaalsContact O-O 3.05Å; N319-R343 PolarHBondContact OD1-NH1 3.16Å
320A93.4Very high89.8Confident39 Ų3942 Ų4232%0.32228%0.28SS..G310 helixtrans-56-22-17800000114.6S317 A318 C322 I323 T335S317-A320 WeakPolarHBondContact O-CB 3.4Å; S317-A320 PolarHBondContact O-N 3Å; A318-A320 VanDerWaalsContact C-N 3.26Å; A318-A320 PolarHBondContact O-N 3.47Å; A320-C322 VanDerWaalsContact C-N 3.25Å; A320-C322 PolarHBondContact O-N 3.04Å; A320-I323 VanDerWaalsContact CA-O 3.31Å; A320-I323 WeakPolarHBondContact CA-O 3.31Å; A320-I323 PolarHBondContact N-O 3.27Å; A320-T335 PolarHBondContact O-OG1 3.4Å
321G95Very high89.8Confident67 Ų6742.9 Ų42.969%0.69128%0.284SS*.G310 helixtrans-61-27.6171.600000114.5N319 T335N319-G321 PolarHBondContact O-N 3.16Å; G321-T335 PolarHBondContact O-OG1 3.5Å
322C96.6Very high90Very high5 Ų542.7 Ų42.73%0.03428%0.284CS..THydrogen-bonded Turntrans-122-28.5176.6670000115N319 A320 M334 T335 D336 E339 V340N319-C322 PolarHBondContact O-N 3.44Å; N319-C322 PolarHBondContact O-SG 2.83Å; A320-C322 VanDerWaalsContact C-N 3.25Å; A320-C322 PolarHBondContact O-N 3.04Å; C322-M334 CarbonylContact O-C 3.56Å; C322-M334 WeakPolarHBondContact O-CA 3.46Å; C322-T335 VanDerWaalsContact CA-OG1 3.3Å; C322-T335 WeakPolarHBondContact CA-OG1 3.3Å; C322-T335 PolarHBondContact N-OG1 3Å; C322-T335 PolarHBondContact O-N 3.07Å; C322-T335 PolarHBondContact O-OG1 3.41Å; C322-D336 HydrophobicContact CB-CB 3.83Å; C322-D336 PolarHBondContact O-N 3.48Å; C322-E339 HydrophobicContact CB-CB 3.88Å; C322-E339 HydrophobicContact CB-CG 3.65Å; C322-V340 HydrophobicContact CB-CG2 4.03Å; C322-V340 WeakPolarHBondContact O-CG2 3.26Å
323I97.1Very high90.3Very high2 Ų243.8 Ų43.81%0.0129%0.288CS..EExtended strand (participates in β ladder)trans-148.9133.3175.3-167.3172.9000111.6L310 L313 L314 N319 A320 F332 K333 M334 T335 V340L310-I323 HydrophobicContact CB-CD1 4.36Å; L310-I323 HydrophobicContact CD2-CD1 3.76Å; L313-I323 HydrophobicContact CB-CG2 3.59Å; L313-I323 HydrophobicContact CD1-CG2 4.01Å; L313-I323 HydrophobicContact CG-CG2 4.45Å; L314-I323 HydrophobicContact CD1-CD1 4.11Å; L314-I323 HydrophobicContact CD1-CG1 4.4Å; L314-I323 HydrophobicContact CD2-CD1 4.42Å; L314-I323 HydrophobicContact CD2-CG1 3.88Å; L314-I323 HydrophobicContact CG-CD1 4Å; L314-I323 HydrophobicContact CG-CG1 4Å; N319-I323 CarbonylContact C-O 3.43Å; N319-I323 HydrophobicContact CB-CG2 4.29Å; N319-I323 PolarHBondContact O-N 3.04Å; N319-I323 VanDerWaalsContact O-O 3.05Å; A320-I323 VanDerWaalsContact CA-O 3.31Å; A320-I323 WeakPolarHBondContact CA-O 3.31Å; A320-I323 PolarHBondContact N-O 3.27Å; I323-F332 HydrophobicContact CD1-CD2 3.93Å; I323-F332 HydrophobicContact CD1-CE2 3.92Å; I323-F332 HydrophobicContact CG1-CD2 4.06Å; I323-F332 HydrophobicContact CG1-CE2 4.49Å; I323-K333 WeakPolarHBondContact CA-O 3.33Å; I323-K333 WeakPolarHBondContact CG1-O 3.43Å; I323-M334 HydrophobicContact CD1-CE 4.38Å; I323-M334 HydrophobicContact CD1-CG 4.19Å; I323-M334 HydrophobicContact CG1-CG 4.2Å; I323-T335 PolarHBondContact N-OG1 3.35Å; I323-V340 HydrophobicContact CB-CG2 3.81Å; I323-V340 HydrophobicContact CG2-CG2 4.32Å
324T94.9Very high90.5Very high41 Ų4143.4 Ų43.425%0.25229%0.286SS..EExtended strand (participates in β ladder)trans-148.8153.4-176.2-165.20000112L314 F332 K333 T335L314-T324 VanDerWaalsContact CD2-C 3.45Å; T324-F332 CarbonylContact O-C 3.6Å; T324-F332 WeakPolarHBondContact O-CA 3.14Å; T324-F332 WeakPolarHBondContact O-CB 3.33Å; T324-K333 HydrophobicContact CG2-CD 4.36Å; T324-K333 HydrophobicContact CG2-CG 3.91Å; T324-K333 PolarHBondContact N-O 3.33Å; T324-K333 PolarHBondContact O-N 2.88Å; T324-T335 HydrophobicContact CG2-CG2 4.15Å
325W93.6Very high90.7Very high39 Ų3946.2 Ų46.215%0.14830%0.303CS..EExtended strand (participates in β ladder)trans-67.1148.9172.6-63.8113.1000111.3Y286 L289 L311 L314 F332 F383Y286-W325 VanDerWaalsContact CB-CD1 3.49Å; Y286-W325 HydrophobicContact CD1-CB 3.76Å; Y286-W325 AromaticContact CD1-CD2 3.21Å; Y286-W325 HydrophobicContact CD1-CD2 3.21Å; Y286-W325 AromaticContact CD1-CE2 3.92Å; Y286-W325 AromaticContact CD1-CE3 3.17Å; Y286-W325 HydrophobicContact CD1-CE3 3.17Å; Y286-W325 AromaticContact CD1-CG 3.5Å; Y286-W325 HydrophobicContact CD1-CG 3.5Å; Y286-W325 HydrophobicContact CD1-CH2 4.49Å; Y286-W325 AromaticContact CD1-CZ3 3.87Å; Y286-W325 HydrophobicContact CD1-CZ3 3.87Å; Y286-W325 HydrophobicContact CD2-CB 3.45Å; Y286-W325 VanDerWaalsContact CD2-CB 3.45Å; Y286-W325 HydrophobicContact CD2-CD2 4.38Å; Y286-W325 AromaticContact CD2-CG 3.77Å; Y286-W325 HydrophobicContact CD2-CG 3.77Å; Y286-W325 HydrophobicContact CE1-CB 3.83Å; Y286-W325 AromaticContact CE1-CD2 3.83Å; Y286-W325 HydrophobicContact CE1-CD2 3.83Å; Y286-W325 AromaticContact CE1-CE3 3.44Å; Y286-W325 HydrophobicContact CE1-CE3 3.44Å; Y286-W325 VanDerWaalsContact CE1-CE3 3.44Å; Y286-W325 HydrophobicContact CE1-CG 4.04Å; Y286-W325 HydrophobicContact CE1-CZ3 4.24Å; Y286-W325 HydrophobicContact CE2-CB 3.61Å; Y286-W325 HydrophobicContact CE2-CG 4.34Å; Y286-W325 HydrophobicContact CG-CB 3.54Å; Y286-W325 AromaticContact CG-CD1 3.77Å; Y286-W325 AromaticContact CG-CD2 3.52Å; Y286-W325 HydrophobicContact CG-CD2 3.52Å; Y286-W325 AromaticContact CG-CE3 3.99Å; Y286-W325 HydrophobicContact CG-CE3 3.99Å; Y286-W325 AromaticContact CG-CG 3.32Å; Y286-W325 HydrophobicContact CG-CG 3.32Å; L289-W325 HydrophobicContact CB-CH2 4.32Å; L289-W325 HydrophobicContact CB-CZ2 4.06Å; L289-W325 HydrophobicContact CD1-CH2 3.42Å; L289-W325 VanDerWaalsContact CD1-CH2 3.42Å; L289-W325 HydrophobicContact CD1-CZ2 3.95Å; L289-W325 HydrophobicContact CD1-CZ3 3.97Å; L289-W325 HydrophobicContact CG-CH2 4.48Å; L311-W325 HydrophobicContact CD2-CH2 3.76Å; L311-W325 HydrophobicContact CD2-CZ2 4.27Å; L314-W325 HydrophobicContact CB-CD2 4.37Å; L314-W325 HydrophobicContact CB-CH2 4.25Å; L314-W325 HydrophobicContact CB-CZ2 3.55Å; L314-W325 HydrophobicContact CD1-CD2 4.35Å; L314-W325 HydrophobicContact CD1-CE3 4.21Å; L314-W325 HydrophobicContact CD1-CH2 3.84Å; L314-W325 HydrophobicContact CD1-CZ2 4Å; L314-W325 HydrophobicContact CD1-CZ3 3.96Å; L314-W325 HydrophobicContact CD2-CD2 3.89Å; L314-W325 HydrophobicContact CD2-CE3 4.38Å; L314-W325 HydrophobicContact CD2-CG 4.03Å; L314-W325 HydrophobicContact CG-CD2 4.44Å; L314-W325 HydrophobicContact CG-CZ2 4.24Å; L314-W325 PolarHBondContact O-NE1 3.35Å; W325-F332 HydrophobicContact CE3-CB 3.76Å; W325-F332 HydrophobicContact CZ3-CB 4.16Å; W325-F332 HydrophobicContact CZ3-CD1 4.4Å; W325-F383 HydrophobicContact CH2-CD2 4.04Å; W325-F383 HydrophobicContact CH2-CE2 4.01Å; W325-F383 AromaticContact CZ3-CD2 3.93Å; W325-F383 HydrophobicContact CZ3-CD2 3.93Å; W325-F383 HydrophobicContact CZ3-CE2 4.1Å
326E87.1Confident91.3Very high53 Ų5346.7 Ų46.725%0.24830%0.301CS..  trans-154.1142.8178.1-168.9-171.112500111.5Y286 T328 E331 K333 K377Y286-E326 PolarHBondContact OH-O 3.2Å; E326-T328 PolarHBondContact O-N 3.11Å; E326-E331 PolarHBondContact N-O 3.5Å; E326-E331 CarbonylContact O-C 3.59Å; E326-E331 VanDerWaalsContact O-C 3.23Å; E326-E331 WeakPolarHBondContact O-CB 3.4Å; E326-E331 WeakPolarHBondContact O-CG 3.44Å; E326-K333 HydrophobicContact CB-CG 4.28Å; E326-K333 VanDerWaalsContact OE2-CD 3.22Å; E326-K333 WeakPolarHBondContact OE2-CD 3.19Å; E326-K333 WeakPolarHBondContact OE2-CE 3.39Å; E326-K333 WeakPolarHBondContact OE2-CG 3.34Å; E326-K333 IonicContact OE2-NZ 3.22Å; E326-K333 PolarHBondContact OE2-NZ 2.89Å; E326-K377 WeakPolarHBondContact OE1-CD 3.41Å; E326-K377 VanDerWaalsContact OE1-CE 3.27Å; E326-K377 WeakPolarHBondContact OE1-CE 3.28Å; E326-K377 IonicContact OE1-NZ 2.64Å; E326-K377 PolarHBondContact OE1-NZ 2.81Å
327G78.6Confident91.8Very high48 Ų4843.6 Ų43.650%0.49529%0.285SS..SBendtrans84-115.4170.800000112.5Y286Y286-G327 PolarHBondContact OH-N 2.93Å; Y286-G327 PolarHBondContact OH-O 2.95Å
328T78.7Confident92.3Very high82 Ų8243 Ų4350%0.50327%0.274SS..SBendtrans-144.6150.6-177.556.80000113Y286 E326 E331 K382Y286-T328 PolarHBondContact OH-N 3.09Å; E326-T328 PolarHBondContact O-N 3.11Å; T328-E331 WeakPolarHBondContact O-CB 3.13Å; T328-E331 PolarHBondContact O-N 3.37Å; T328-K382 PolarHBondContact O-NZ 3.14Å
329N76.1Confident92.6Very high101 Ų10141.4 Ų41.454%0.5425%0.253SS..THydrogen-bonded Turntrans44.772.4166.5-63.135.3000114E331 K382 F385N329-E331 VanDerWaalsContact C-N 3.29Å; N329-E331 PolarHBondContact O-N 2.89Å; N329-K382 WeakPolarHBondContact O-CE 3.47Å; N329-K382 PolarHBondContact O-NZ 3.28Å; N329-F385 HydrophobicContact CB-CE2 4.25Å
330G86.1Confident92.9Very high1 Ų140.4 Ų40.41%0.0125%0.247CC..THydrogen-bonded Turntrans75.99.2174.200000115.7K382 F383G330-K382 WeakPolarHBondContact O-CA 3.29Å; G330-F383 PolarHBondContact O-N 2.98Å
331E94.5Very high93.1Very high19 Ų1938.6 Ų38.69%0.08923%0.233CC..EExtended strand (participates in β ladder)trans-78.8137.6169-179.2179.5164.700111.8Y286 E326 T328 N329 V374 K377 Y381 K382Y286-E331 VanDerWaalsContact CE1-O 3.31Å; Y286-E331 WeakPolarHBondContact CE1-O 3.34Å; Y286-E331 PolarHBondContact OH-O 2.97Å; E326-E331 PolarHBondContact N-O 3.5Å; E326-E331 CarbonylContact O-C 3.59Å; E326-E331 VanDerWaalsContact O-C 3.23Å; E326-E331 WeakPolarHBondContact O-CB 3.4Å; E326-E331 WeakPolarHBondContact O-CG 3.44Å; T328-E331 WeakPolarHBondContact O-CB 3.13Å; T328-E331 PolarHBondContact O-N 3.37Å; N329-E331 VanDerWaalsContact C-N 3.29Å; N329-E331 PolarHBondContact O-N 2.89Å; E331-V374 HydrophobicContact CG-CG2 3.89Å; E331-K377 WeakPolarHBondContact OE1-CE 3.46Å; E331-K377 IonicContact OE1-NZ 2.67Å; E331-K377 PolarHBondContact OE1-NZ 2.91Å; E331-Y381 CarbonylContact C-O 3.49Å; E331-Y381 WeakPolarHBondContact CA-O 3.12Å; E331-K382 HydrophobicContact CB-CB 4.19Å; E331-K382 HydrophobicContact CB-CD 4.16Å; E331-K382 HydrophobicContact CB-CG 4.07Å
332F96.3Very high93.3Very high0 Ų040.7 Ų40.70%022%0.219CC..EExtended strand (participates in β ladder)trans-146.8163-177.671.5-86.9000111.7L310 L314 I323 T324 W325 M334 A380 Y381 F383L310-F332 HydrophobicContact CD1-CE2 4.23Å; L310-F332 HydrophobicContact CD1-CZ 4.01Å; L314-F332 HydrophobicContact CD1-CB 3.83Å; L314-F332 HydrophobicContact CD1-CD1 4.09Å; L314-F332 HydrophobicContact CD1-CD2 3.86Å; L314-F332 HydrophobicContact CD1-CE2 4.39Å; L314-F332 HydrophobicContact CD1-CG 3.67Å; L314-F332 HydrophobicContact CD2-CB 4.09Å; I323-F332 HydrophobicContact CD1-CD2 3.93Å; I323-F332 HydrophobicContact CD1-CE2 3.92Å; I323-F332 HydrophobicContact CG1-CD2 4.06Å; I323-F332 HydrophobicContact CG1-CE2 4.49Å; T324-F332 CarbonylContact O-C 3.6Å; T324-F332 WeakPolarHBondContact O-CA 3.14Å; T324-F332 WeakPolarHBondContact O-CB 3.33Å; W325-F332 HydrophobicContact CE3-CB 3.76Å; W325-F332 HydrophobicContact CZ3-CB 4.16Å; W325-F332 HydrophobicContact CZ3-CD1 4.4Å; F332-M334 HydrophobicContact CE2-CE 4.01Å; F332-A380 CarbonylContact O-C 3.56Å; F332-A380 VanDerWaalsContact O-CA 3.28Å; F332-A380 WeakPolarHBondContact O-CA 3.44Å; F332-Y381 WeakPolarHBondContact CD1-O 3.39Å; F332-Y381 HydrophobicContact CE2-CD2 4.39Å; F332-Y381 VanDerWaalsContact CZ-CB 3.49Å; F332-Y381 HydrophobicContact CZ-CD2 4.48Å; F332-Y381 HydrophobicContact CZ-CG 4.26Å; F332-Y381 PolarHBondContact N-O 3.18Å; F332-Y381 PolarHBondContact O-N 2.75Å; F332-Y381 VanDerWaalsContact O-O 3.07Å; F332-F383 AromaticContact CD1-CD2 3.71Å; F332-F383 HydrophobicContact CD1-CD2 3.71Å; F332-F383 AromaticContact CD1-CE2 3.49Å; F332-F383 HydrophobicContact CD1-CE2 3.49Å; F332-F383 VanDerWaalsContact CD1-CE2 3.49Å; F332-F383 HydrophobicContact CD1-CZ 4.42Å; F332-F383 AromaticContact CE1-CD2 3.6Å; F332-F383 HydrophobicContact CE1-CD2 3.6Å; F332-F383 HydrophobicContact CE1-CE1 4.5Å; F332-F383 AromaticContact CE1-CE2 3.23Å; F332-F383 HydrophobicContact CE1-CE2 3.23Å; F332-F383 HydrophobicContact CE1-CG 4.38Å; F332-F383 AromaticContact CE1-CZ 3.74Å; F332-F383 HydrophobicContact CE1-CZ 3.74Å; F332-F383 HydrophobicContact CG-CE2 4.46Å; F332-F383 HydrophobicContact CZ-CE2 4.03Å; F332-F383 HydrophobicContact CZ-CZ 4.18Å
333K96.9Very high93.3Very high61 Ų6143.9 Ų43.927%0.26523%0.231SC..EExtended strand (participates in β ladder)trans-129.3151.8170.760.1150.6175.8-87.80112.3I323 T324 E326 T335 Y379 A380I323-K333 WeakPolarHBondContact CA-O 3.33Å; I323-K333 WeakPolarHBondContact CG1-O 3.43Å; T324-K333 HydrophobicContact CG2-CD 4.36Å; T324-K333 HydrophobicContact CG2-CG 3.91Å; T324-K333 PolarHBondContact N-O 3.33Å; T324-K333 PolarHBondContact O-N 2.88Å; E326-K333 HydrophobicContact CB-CG 4.28Å; E326-K333 VanDerWaalsContact OE2-CD 3.22Å; E326-K333 WeakPolarHBondContact OE2-CD 3.19Å; E326-K333 WeakPolarHBondContact OE2-CE 3.39Å; E326-K333 WeakPolarHBondContact OE2-CG 3.34Å; E326-K333 IonicContact OE2-NZ 3.22Å; E326-K333 PolarHBondContact OE2-NZ 2.89Å; K333-T335 HydrophobicContact CD-CG2 3.84Å; K333-T335 VanDerWaalsContact CE-CG2 3.41Å; K333-Y379 WeakPolarHBondContact CA-O 3.38Å; K333-A380 HydrophobicContact CB-CB 4.3Å
334M97.8Very high93.2Very high3 Ų344.9 Ų44.92%0.01523%0.234CC..EExtended strand (participates in β ladder)trans-90.1111.6163.2-55174.7-176.900108L310 C322 I323 F332 P337 V340 Y355 L358 L362 Y379L310-M334 HydrophobicContact CD1-CE 3.68Å; L310-M334 HydrophobicContact CD2-CE 3.86Å; L310-M334 HydrophobicContact CG-CE 4.46Å; C322-M334 CarbonylContact O-C 3.56Å; C322-M334 WeakPolarHBondContact O-CA 3.46Å; I323-M334 HydrophobicContact CD1-CE 4.38Å; I323-M334 HydrophobicContact CD1-CG 4.19Å; I323-M334 HydrophobicContact CG1-CG 4.2Å; F332-M334 HydrophobicContact CE2-CE 4.01Å; M334-P337 HydrophobicContact CB-CB 4.14Å; M334-V340 HydrophobicContact CB-CG2 4.39Å; M334-V340 HydrophobicContact CE-CG1 4.07Å; M334-V340 HydrophobicContact CG-CG1 4.47Å; M334-V340 HydrophobicContact CG-CG2 4.27Å; M334-V340 HydrophobicContact SD-CB 4.29Å; M334-V340 HydrophobicContact SD-CG1 3.92Å; M334-Y355 HydrophobicContact SD-CE2 4.2Å; M334-L358 HydrophobicContact CE-CD2 3.95Å; M334-L358 HydrophobicContact SD-CD2 4.27Å; M334-L362 HydrophobicContact CE-CD1 3.91Å; M334-Y379 PolarHBondContact N-O 2.94Å; M334-Y379 WeakPolarHBondContact O-CB 3.3Å
335T97.6Very high93.3Very high66 Ų6643.1 Ų43.141%0.40522%0.224SC..SBendtrans-73.3-37.9174.530.20000111.1A320 G321 C322 I323 T324 K333A320-T335 PolarHBondContact O-OG1 3.4Å; G321-T335 PolarHBondContact O-OG1 3.5Å; C322-T335 VanDerWaalsContact CA-OG1 3.3Å; C322-T335 WeakPolarHBondContact CA-OG1 3.3Å; C322-T335 PolarHBondContact N-OG1 3Å; C322-T335 PolarHBondContact O-N 3.07Å; C322-T335 PolarHBondContact O-OG1 3.41Å; I323-T335 PolarHBondContact N-OG1 3.35Å; T324-T335 HydrophobicContact CG2-CG2 4.15Å; K333-T335 HydrophobicContact CD-CG2 3.84Å; K333-T335 VanDerWaalsContact CE-CG2 3.41Å
336D98Very high93.3Very high67 Ų6747.1 Ų47.136%0.35825%0.245SC..SBendtrans-124.194.5166.9-174-22.7000108.8C322 D338 E339 V340C322-D336 HydrophobicContact CB-CB 3.83Å; C322-D336 PolarHBondContact O-N 3.48Å; D336-D338 PolarHBondContact O-N 3.26Å; D336-D338 PolarHBondContact OD1-N 2.85Å; D336-E339 HydrophobicContact CB-CB 4.05Å; D336-E339 PolarHBondContact OD1-N 3.37Å; D336-V340 WeakPolarHBondContact O-CG2 3.37Å; D336-V340 PolarHBondContact O-N 2.71Å
337P97.8Very high93.6Very high12 Ų1247.6 Ų47.68%0.07824%0.244CC..Hα-helixtrans-67.9-19.9-179.128.1-34.8000113.7M334 A341 Y355 Y379M334-P337 HydrophobicContact CB-CB 4.14Å; P337-A341 WeakPolarHBondContact O-CB 3.37Å; P337-A341 PolarHBondContact O-N 2.95Å; P337-A341 VanDerWaalsContact O-N 3.14Å; P337-Y355 HydrophobicContact CB-CD2 3.48Å; P337-Y355 VanDerWaalsContact CB-CD2 3.48Å; P337-Y355 HydrophobicContact CB-CE2 3.94Å; P337-Y355 HydrophobicContact CB-CG 3.89Å; P337-Y379 HydrophobicContact CB-CD1 3.93Å; P337-Y379 HydrophobicContact CB-CE1 4.22Å; P337-Y379 HydrophobicContact CB-CG 4.26Å; P337-Y379 HydrophobicContact CG-CD1 3.96Å; P337-Y379 HydrophobicContact CG-CD2 4.22Å; P337-Y379 HydrophobicContact CG-CE1 3.88Å; P337-Y379 HydrophobicContact CG-CE2 4.16Å; P337-Y379 HydrophobicContact CG-CG 4.13Å
338D98.3Very high94.2Very high98 Ų9847.7 Ų47.752%0.52423%0.231SC..Hα-helixtrans-88.4-35.8-178.2-72.3-52000111.4D336 A341 R342D336-D338 PolarHBondContact O-N 3.26Å; D336-D338 PolarHBondContact OD1-N 2.85Å; D338-A341 CarbonylContact O-C 3.45Å; D338-A341 PolarHBondContact O-N 3.49Å; D338-R342 WeakPolarHBondContact O-CB 3.48Å; D338-R342 PolarHBondContact O-N 3.13Å
339E98.1Very high94.9Very high45 Ų4549 Ų4921%0.2124%0.243CC..Hα-helixtrans-64.5-39.4167.3172.859.6-173.300111.6C322 D336 A341 R342 R343C322-E339 HydrophobicContact CB-CB 3.88Å; C322-E339 HydrophobicContact CB-CG 3.65Å; D336-E339 HydrophobicContact CB-CB 4.05Å; D336-E339 PolarHBondContact OD1-N 3.37Å; E339-A341 VanDerWaalsContact C-N 3.3Å; E339-A341 PolarHBondContact O-N 2.92Å; E339-R342 PolarHBondContact O-N 3.1Å; E339-R342 IonicContact OE1-CZ 3.52Å; E339-R342 IonicContact OE1-NE 2.74Å; E339-R342 IonicContact OE1-NH2 3.46Å; E339-R342 PolarHBondContact OE1-NH2 3.16Å; E339-R342 IonicContact OE2-CZ 3.4Å; E339-R342 IonicContact OE2-NE 2.81Å; E339-R342 PolarHBondContact OE2-NE 3.1Å; E339-R342 IonicContact OE2-NH2 3.73Å; E339-R342 PolarHBondContact OE2-NH2 2.92Å; E339-R343 WeakPolarHBondContact O-CG 3.37Å; E339-R343 PolarHBondContact O-N 2.91Å; E339-R343 WeakPolarHBondContact OE1-CG 3.48Å; E339-R343 IonicContact OE1-CZ 3.8Å; E339-R343 IonicContact OE1-NE 2.65Å; E339-R343 PolarHBondContact OE1-NE 3.28Å; E339-R343 IonicContact OE1-NH2 3.55Å; E339-R343 PolarHBondContact OE1-NH2 3.48Å
340V98.1Very high95.8Very high0 Ų049.6 Ų49.60%024%0.241CC..Hα-helixtrans-61-41.3171.8174.40000110.9L310 C322 I323 M334 D336 W344 L358L310-V340 HydrophobicContact CD2-CG1 3.66Å; C322-V340 HydrophobicContact CB-CG2 4.03Å; C322-V340 WeakPolarHBondContact O-CG2 3.26Å; I323-V340 HydrophobicContact CB-CG2 3.81Å; I323-V340 HydrophobicContact CG2-CG2 4.32Å; M334-V340 HydrophobicContact CB-CG2 4.39Å; M334-V340 HydrophobicContact CE-CG1 4.07Å; M334-V340 HydrophobicContact CG-CG1 4.47Å; M334-V340 HydrophobicContact CG-CG2 4.27Å; M334-V340 HydrophobicContact SD-CB 4.29Å; M334-V340 HydrophobicContact SD-CG1 3.92Å; D336-V340 WeakPolarHBondContact O-CG2 3.37Å; D336-V340 PolarHBondContact O-N 2.71Å; V340-W344 WeakPolarHBondContact O-CB 3.47Å; V340-W344 PolarHBondContact O-N 3.17Å; V340-L358 HydrophobicContact CG1-CD1 4.04Å
341A98.3Very high95.9Very high1 Ų155.4 Ų55.41%0.00828%0.279CS..Hα-helixtrans-68.4-36.5175.400000113.1P337 D338 E339 W344 G345 M353 N354 L358P337-A341 WeakPolarHBondContact O-CB 3.37Å; P337-A341 PolarHBondContact O-N 2.95Å; P337-A341 VanDerWaalsContact O-N 3.14Å; D338-A341 CarbonylContact O-C 3.45Å; D338-A341 PolarHBondContact O-N 3.49Å; E339-A341 VanDerWaalsContact C-N 3.3Å; E339-A341 PolarHBondContact O-N 2.92Å; A341-W344 PolarHBondContact O-N 3.05Å; A341-G345 PolarHBondContact O-N 2.64Å; A341-M353 HydrophobicContact CB-CG 4.48Å; A341-M353 WeakPolarHBondContact O-CG 3.22Å; A341-N354 VanDerWaalsContact CB-C 3.42Å; A341-L358 HydrophobicContact CB-CB 4.42Å; A341-L358 HydrophobicContact CB-CD1 4.13Å
342R98Very high96Very high110 Ų11060.8 Ų60.842%0.41531%0.308SS..Hα-helixtrans-63.3-50.6174.9-168.7-161.163.668.17.4110.7D338 E339 W344 G345 E346D338-R342 WeakPolarHBondContact O-CB 3.48Å; D338-R342 PolarHBondContact O-N 3.13Å; E339-R342 PolarHBondContact O-N 3.1Å; E339-R342 IonicContact OE1-CZ 3.52Å; E339-R342 IonicContact OE1-NE 2.74Å; E339-R342 IonicContact OE1-NH2 3.46Å; E339-R342 PolarHBondContact OE1-NH2 3.16Å; E339-R342 IonicContact OE2-CZ 3.4Å; E339-R342 IonicContact OE2-NE 2.81Å; E339-R342 PolarHBondContact OE2-NE 3.1Å; E339-R342 IonicContact OE2-NH2 3.73Å; E339-R342 PolarHBondContact OE2-NH2 2.92Å; R342-W344 VanDerWaalsContact C-N 3.31Å; R342-W344 PolarHBondContact O-N 3.4Å; R342-G345 WeakPolarHBondContact O-CA 3.44Å; R342-G345 PolarHBondContact O-N 3.33Å; R342-G345 VanDerWaalsContact O-N 3.08Å; R342-E346 IonicContact CZ-OE2 2.69Å; R342-E346 VanDerWaalsContact NH1-CD 3.33Å; R342-E346 IonicContact NH1-OE1 2.61Å; R342-E346 PolarHBondContact NH1-OE1 3.08Å; R342-E346 IonicContact NH1-OE2 3.96Å; R342-E346 PolarHBondContact NH1-OE2 2.85Å; R342-E346 IonicContact NH2-OE2 2.68Å; R342-E346 WeakPolarHBondContact O-CB 3.27Å; R342-E346 PolarHBondContact O-N 3.02Å
343R96.8Very high96Very high73 Ų7362.3 Ų62.328%0.27532%0.316SS..Hα-helixtrans-61.8-36.4176.8-68.3-176.5-176.4-159.55.8112.6F309 N319 E339 R347F309-R343 HydrophobicContact CZ-CB 3.78Å; N319-R343 PolarHBondContact OD1-NH1 3.16Å; E339-R343 WeakPolarHBondContact O-CG 3.37Å; E339-R343 PolarHBondContact O-N 2.91Å; E339-R343 WeakPolarHBondContact OE1-CG 3.48Å; E339-R343 IonicContact OE1-CZ 3.8Å; E339-R343 IonicContact OE1-NE 2.65Å; E339-R343 PolarHBondContact OE1-NE 3.28Å; E339-R343 IonicContact OE1-NH2 3.55Å; E339-R343 PolarHBondContact OE1-NH2 3.48Å; R343-R347 VanDerWaalsContact O-CB 3.28Å; R343-R347 WeakPolarHBondContact O-CB 3.47Å; R343-R347 PolarHBondContact O-N 3.14Å
344W96.3Very high96.1Very high22 Ų2261.9 Ų61.98%0.08332%0.317CS..Hα-helixtrans-68.2-37.4172.6177.2-124.2000112.5I304 L306 F309 V340 A341 R342 K348 L358I304-W344 HydrophobicContact CG2-CZ3 4.33Å; I304-W344 WeakPolarHBondContact O-CH2 3.36Å; L306-W344 HydrophobicContact CB-CH2 3.85Å; L306-W344 HydrophobicContact CB-CZ2 3.69Å; L306-W344 HydrophobicContact CB-CZ3 4.38Å; L306-W344 HydrophobicContact CD1-CD2 3.74Å; L306-W344 HydrophobicContact CD1-CE3 4.11Å; L306-W344 HydrophobicContact CD1-CG 3.99Å; L306-W344 HydrophobicContact CD1-CZ2 4.32Å; L306-W344 HydrophobicContact CG-CZ2 4.5Å; F309-W344 HydrophobicContact CB-CE3 3.92Å; F309-W344 HydrophobicContact CB-CZ3 3.77Å; F309-W344 HydrophobicContact CD1-CB 4.24Å; F309-W344 HydrophobicContact CD1-CD2 4.24Å; F309-W344 AromaticContact CD1-CE3 3.53Å; F309-W344 HydrophobicContact CD1-CE3 3.53Å; F309-W344 HydrophobicContact CD1-CZ3 4.26Å; F309-W344 HydrophobicContact CD2-CE3 4.23Å; F309-W344 HydrophobicContact CE1-CB 3.68Å; F309-W344 HydrophobicContact CE1-CE3 4.08Å; F309-W344 HydrophobicContact CE1-CG 4.44Å; F309-W344 AromaticContact CG-CE3 3.61Å; F309-W344 HydrophobicContact CG-CE3 3.61Å; F309-W344 AromaticContact CG-CZ3 3.98Å; F309-W344 HydrophobicContact CG-CZ3 3.98Å; F309-W344 HydrophobicContact CZ-CB 4.2Å; V340-W344 WeakPolarHBondContact O-CB 3.47Å; V340-W344 PolarHBondContact O-N 3.17Å; A341-W344 PolarHBondContact O-N 3.05Å; R342-W344 VanDerWaalsContact C-N 3.31Å; R342-W344 PolarHBondContact O-N 3.4Å; W344-K348 HydrophobicContact CD2-CG 3.93Å; W344-K348 HydrophobicContact CE3-CD 4.28Å; W344-K348 HydrophobicContact CE3-CG 3.76Å; W344-K348 HydrophobicContact CH2-CD 3.54Å; W344-K348 HydrophobicContact CH2-CG 3.57Å; W344-K348 HydrophobicContact CZ2-CD 4.15Å; W344-K348 HydrophobicContact CZ2-CG 3.73Å; W344-K348 HydrophobicContact CZ3-CD 3.63Å; W344-K348 HydrophobicContact CZ3-CG 3.59Å; W344-K348 WeakPolarHBondContact O-CG 3.47Å; W344-K348 PolarHBondContact O-N 3.23Å; W344-L358 HydrophobicContact CB-CD1 3.85Å; W344-L358 HydrophobicContact CG-CD1 4.06Å
345G96.1Very high96.1Very high4 Ų463.6 Ų63.64%0.04132%0.323CS..Hα-helixtrans-60-51.8171.900000111.5A341 R342 K348 S349 K350 M353A341-G345 PolarHBondContact O-N 2.64Å; R342-G345 WeakPolarHBondContact O-CA 3.44Å; R342-G345 PolarHBondContact O-N 3.33Å; R342-G345 VanDerWaalsContact O-N 3.08Å; G345-K348 CarbonylContact O-C 3.52Å; G345-K348 PolarHBondContact O-N 3Å; G345-S349 WeakPolarHBondContact O-CA 3.44Å; G345-S349 PolarHBondContact O-N 3.39Å; G345-K350 WeakPolarHBondContact CA-O 3.32Å; G345-K350 PolarHBondContact O-N 2.98Å; G345-M353 VanDerWaalsContact CA-CB 3.46Å
346E94.8Very high96.1Very high124 Ų12465.7 Ų65.758%0.57933%0.332SS*.Hα-helixtrans-54.8-52.4174.6-179.1165.3-126.600111.8R342 K348 S349R342-E346 IonicContact CZ-OE2 2.69Å; R342-E346 VanDerWaalsContact NH1-CD 3.33Å; R342-E346 IonicContact NH1-OE1 2.61Å; R342-E346 PolarHBondContact NH1-OE1 3.08Å; R342-E346 IonicContact NH1-OE2 3.96Å; R342-E346 PolarHBondContact NH1-OE2 2.85Å; R342-E346 IonicContact NH2-OE2 2.68Å; R342-E346 WeakPolarHBondContact O-CB 3.27Å; R342-E346 PolarHBondContact O-N 3.02Å; E346-K348 PolarHBondContact O-N 3Å; E346-S349 PolarHBondContact O-N 3.22Å
347R93.3Very high96.1Very high63 Ų6367.9 Ų67.924%0.23834%0.338CS..Hα-helixtrans-59.4-22178.7-175.657.665.583.16.7114.5I304 F309 E312 R343I304-R347 HydrophobicContact CG2-CG 3.69Å; F309-R347 HydrophobicContact CD2-CB 4.24Å; F309-R347 HydrophobicContact CD2-CG 3.91Å; F309-R347 HydrophobicContact CE2-CB 3.99Å; F309-R347 HydrophobicContact CE2-CG 4.13Å; E312-R347 IonicContact OE1-CZ 3.25Å; E312-R347 VanDerWaalsContact OE1-CZ 3.22Å; E312-R347 IonicContact OE1-NH1 2.7Å; E312-R347 PolarHBondContact OE1-NH1 3.34Å; E312-R347 IonicContact OE1-NH2 3.5Å; E312-R347 PolarHBondContact OE1-NH2 3.16Å; E312-R347 IonicContact OE2-CZ 2.87Å; E312-R347 IonicContact OE2-NH1 2.68Å; E312-R347 PolarHBondContact OE2-NH1 2.88Å; E312-R347 IonicContact OE2-NH2 3.4Å; R343-R347 VanDerWaalsContact O-CB 3.28Å; R343-R347 WeakPolarHBondContact O-CB 3.47Å; R343-R347 PolarHBondContact O-N 3.14Å
348K91.6Very high96.1Very high49 Ų4967.3 Ų67.321%0.21333%0.334CS..THydrogen-bonded Turntrans-118.211.9-178-54.6-63.8-75.7-171.50113.3G302 Q303 I304 W344 G345 E346 K350G302-K348 WeakPolarHBondContact O-CE 3.36Å; G302-K348 PolarHBondContact O-NZ 2.99Å; Q303-K348 VanDerWaalsContact C-NZ 3.29Å; Q303-K348 PolarHBondContact O-NZ 2.8Å; I304-K348 HydrophobicContact CG2-CD 4.43Å; I304-K348 PolarHBondContact O-NZ 3.11Å; W344-K348 HydrophobicContact CD2-CG 3.93Å; W344-K348 HydrophobicContact CE3-CD 4.28Å; W344-K348 HydrophobicContact CE3-CG 3.76Å; W344-K348 HydrophobicContact CH2-CD 3.54Å; W344-K348 HydrophobicContact CH2-CG 3.57Å; W344-K348 HydrophobicContact CZ2-CD 4.15Å; W344-K348 HydrophobicContact CZ2-CG 3.73Å; W344-K348 HydrophobicContact CZ3-CD 3.63Å; W344-K348 HydrophobicContact CZ3-CG 3.59Å; W344-K348 WeakPolarHBondContact O-CG 3.47Å; W344-K348 PolarHBondContact O-N 3.23Å; G345-K348 CarbonylContact O-C 3.52Å; G345-K348 PolarHBondContact O-N 3Å; E346-K348 PolarHBondContact O-N 3Å; K348-K350 VanDerWaalsContact C-N 3.26Å; K348-K350 HydrophobicContact CB-CD 4.15Å; K348-K350 HydrophobicContact CB-CG 4.41Å; K348-K350 PolarHBondContact O-N 2.88Å
349S92.9Very high96.1Very high109 Ų10962.8 Ų62.876%0.76231%0.31SS*.THydrogen-bonded Turntrans5040.8-175.2-54.80000114.3G345 E346 P351G345-S349 WeakPolarHBondContact O-CA 3.44Å; G345-S349 PolarHBondContact O-N 3.39Å; E346-S349 PolarHBondContact O-N 3.22Å; S349-P351 WeakPolarHBondContact O-CD 3.19Å
350K93.6Very high96.1Very high114 Ų11466 Ų6650%0.49632%0.321SS..  trans-112.587.8-179.5-74.4173.4-174.6-174.50109.9G345 K348 N352 M353G345-K350 WeakPolarHBondContact CA-O 3.32Å; G345-K350 PolarHBondContact O-N 2.98Å; K348-K350 VanDerWaalsContact C-N 3.26Å; K348-K350 HydrophobicContact CB-CD 4.15Å; K348-K350 HydrophobicContact CB-CG 4.41Å; K348-K350 PolarHBondContact O-N 2.88Å; K350-N352 PolarHBondContact O-N 3.33Å; K350-M353 HydrophobicContact CB-CE 3.96Å; K350-M353 HydrophobicContact CD-CE 3.69Å; K350-M353 HydrophobicContact CG-CE 4.45Å; K350-M353 WeakPolarHBondContact O-CB 3.4Å; K350-M353 PolarHBondContact O-N 3.14Å
351P89.8Confident96Very high123 Ų12367.4 Ų67.480%0.79933%0.332SS*.THydrogen-bonded Turntrans-63.3-30.4-173.824.5-34.5000113.2S349 M353S349-P351 WeakPolarHBondContact O-CD 3.19Å; P351-M353 VanDerWaalsContact C-N 3.27Å; P351-M353 PolarHBondContact O-N 2.95Å
352N95.2Very high96Very high132 Ų13267.4 Ų67.471%0.70633%0.332SS*.THydrogen-bonded Turntrans-90.734.6178-62.9-27.3000112.6K350 K357K350-N352 PolarHBondContact O-N 3.33Å; N352-K357 WeakPolarHBondContact O-CD 3.37Å; N352-K357 PolarHBondContact O-NZ 2.96Å
353M97.9Very high95.9Very high33 Ų3367.6 Ų67.616%0.16333%0.333CS..  trans-80143172.2-169.460.868.600110.5A341 G345 K350 P351 K357A341-M353 HydrophobicContact CB-CG 4.48Å; A341-M353 WeakPolarHBondContact O-CG 3.22Å; G345-M353 VanDerWaalsContact CA-CB 3.46Å; K350-M353 HydrophobicContact CB-CE 3.96Å; K350-M353 HydrophobicContact CD-CE 3.69Å; K350-M353 HydrophobicContact CG-CE 4.45Å; K350-M353 WeakPolarHBondContact O-CB 3.4Å; K350-M353 PolarHBondContact O-N 3.14Å; P351-M353 VanDerWaalsContact C-N 3.27Å; P351-M353 PolarHBondContact O-N 2.95Å; M353-K357 HydrophobicContact SD-CB 3.86Å
354N98.1Very high95.9Very high52 Ų5270.7 Ų70.728%0.27835%0.345SS..  trans-152.1171.1175.774.8-22000110.2A341 D356 K357 L358A341-N354 VanDerWaalsContact CB-C 3.42Å; N354-D356 VanDerWaalsContact C-N 3.28Å; N354-D356 PolarHBondContact ND2-OD2 3.47Å; N354-D356 PolarHBondContact O-N 3.3Å; N354-K357 PolarHBondContact O-N 3.38Å; N354-K357 WeakPolarHBondContact OD1-CB 3.32Å; N354-K357 VanDerWaalsContact OD1-CD 3.29Å; N354-K357 WeakPolarHBondContact OD1-CD 3.46Å; N354-K357 VanDerWaalsContact OD1-CG 3.25Å; N354-K357 WeakPolarHBondContact OD1-CG 3.4Å; N354-K357 PolarHBondContact OD1-N 2.72Å; N354-K357 VanDerWaalsContact OD1-N 3.12Å; N354-L358 PolarHBondContact O-N 3.24Å
355Y98.1Very high95.9Very high39 Ų3971 Ų7115%0.15335%0.347CS..Hα-helixtrans-61.1-31-178.2176.8-101000113.9M334 P337 K357 L358 S359 Y379 Y381M334-Y355 HydrophobicContact SD-CE2 4.2Å; P337-Y355 HydrophobicContact CB-CD2 3.48Å; P337-Y355 VanDerWaalsContact CB-CD2 3.48Å; P337-Y355 HydrophobicContact CB-CE2 3.94Å; P337-Y355 HydrophobicContact CB-CG 3.89Å; Y355-K357 PolarHBondContact O-N 3.05Å; Y355-L358 PolarHBondContact O-N 2.92Å; Y355-S359 WeakPolarHBondContact O-CB 3.47Å; Y355-S359 PolarHBondContact O-N 2.71Å; Y355-S359 PolarHBondContact O-OG 2.68Å; Y355-Y379 HydrophobicContact CD1-CE1 4.16Å; Y355-Y379 AromaticContact CE1-CD1 3.89Å; Y355-Y379 HydrophobicContact CE1-CD1 3.89Å; Y355-Y379 AromaticContact CE1-CE1 3.68Å; Y355-Y379 HydrophobicContact CE1-CE1 3.68Å; Y355-Y379 AromaticContact CE2-CD1 3.95Å; Y355-Y379 HydrophobicContact CE2-CD1 3.95Å; Y355-Y379 HydrophobicContact CE2-CE1 4.46Å; Y355-Y379 AromaticContact CZ-CD1 3.53Å; Y355-Y379 AromaticContact CZ-CE1 3.85Å; Y355-Y381 PolarHBondContact OH-OH 2.77Å; Y355-Y381 VanDerWaalsContact OH-OH 3.08Å
356D97.6Very high95.9Very high109 Ų10973.9 Ų73.958%0.58336%0.357SS*.Hα-helixtrans-61.2-46.8175.2-60.3-68.1000112.1N354 S359 R360N354-D356 VanDerWaalsContact C-N 3.28Å; N354-D356 PolarHBondContact ND2-OD2 3.47Å; N354-D356 PolarHBondContact O-N 3.3Å; D356-S359 PolarHBondContact O-OG 3.38Å; D356-S359 VanDerWaalsContact O-OG 3.1Å; D356-R360 WeakPolarHBondContact O-CB 3.45Å; D356-R360 PolarHBondContact O-N 3.46Å
357K97.8Very high95.7Very high113 Ų11375 Ų7549%0.49137%0.367SS..Hα-helixtrans-68.4-41.4178.2-69.2162-171.5157.70111.5N352 M353 N354 Y355 R360 A361N352-K357 WeakPolarHBondContact O-CD 3.37Å; N352-K357 PolarHBondContact O-NZ 2.96Å; M353-K357 HydrophobicContact SD-CB 3.86Å; N354-K357 PolarHBondContact O-N 3.38Å; N354-K357 WeakPolarHBondContact OD1-CB 3.32Å; N354-K357 VanDerWaalsContact OD1-CD 3.29Å; N354-K357 WeakPolarHBondContact OD1-CD 3.46Å; N354-K357 VanDerWaalsContact OD1-CG 3.25Å; N354-K357 WeakPolarHBondContact OD1-CG 3.4Å; N354-K357 PolarHBondContact OD1-N 2.72Å; N354-K357 VanDerWaalsContact OD1-N 3.12Å; Y355-K357 PolarHBondContact O-N 3.05Å; K357-R360 PolarHBondContact O-N 3.26Å; K357-A361 PolarHBondContact O-N 2.98Å; K357-A361 VanDerWaalsContact O-N 3.16Å
358L98.1Very high95.5Very high0 Ų077.7 Ų77.70%038%0.38CS..Hα-helixtrans-63.2-50.9176-171.7151.5000110.8L306 M334 V340 A341 W344 N354 Y355 R360 A361 L362L306-L358 HydrophobicContact CD1-CD1 4.13Å; L306-L358 HydrophobicContact CD1-CG 4.11Å; L306-L358 HydrophobicContact CD2-CD2 4.44Å; L306-L358 HydrophobicContact CD2-CG 4.15Å; M334-L358 HydrophobicContact CE-CD2 3.95Å; M334-L358 HydrophobicContact SD-CD2 4.27Å; V340-L358 HydrophobicContact CG1-CD1 4.04Å; A341-L358 HydrophobicContact CB-CB 4.42Å; A341-L358 HydrophobicContact CB-CD1 4.13Å; W344-L358 HydrophobicContact CB-CD1 3.85Å; W344-L358 HydrophobicContact CG-CD1 4.06Å; N354-L358 PolarHBondContact O-N 3.24Å; Y355-L358 PolarHBondContact O-N 2.92Å; L358-R360 PolarHBondContact O-N 3Å; L358-A361 WeakPolarHBondContact O-CA 3.38Å; L358-A361 WeakPolarHBondContact O-CB 3.09Å; L358-A361 PolarHBondContact O-N 2.91Å; L358-L362 HydrophobicContact CD2-CD1 3.68Å; L358-L362 HydrophobicContact CD2-CD2 4.29Å; L358-L362 HydrophobicContact CD2-CG 3.9Å; L358-L362 PolarHBondContact O-N 3.28Å
359S98Very high95.6Very high3 Ų379.6 Ų79.62%0.02139%0.393CS..Hα-helixtrans-64.2-28.7177.674.20000112.4Y355 D356 A361 L362 R363Y355-S359 WeakPolarHBondContact O-CB 3.47Å; Y355-S359 PolarHBondContact O-N 2.71Å; Y355-S359 PolarHBondContact O-OG 2.68Å; D356-S359 PolarHBondContact O-OG 3.38Å; D356-S359 VanDerWaalsContact O-OG 3.1Å; S359-A361 VanDerWaalsContact C-N 3.29Å; S359-L362 PolarHBondContact O-N 2.87Å; S359-R363 WeakPolarHBondContact O-CG 3.35Å; S359-R363 PolarHBondContact O-N 3.29Å; S359-R363 VanDerWaalsContact O-N 3.14Å; S359-R363 PolarHBondContact O-NH1 3.44Å; S359-R363 PolarHBondContact OG-NH1 3Å
360R97.8Very high95.6Very high113 Ų11374.5 Ų74.543%0.42636%0.357SS..Hα-helixtrans-66.9-32.8172.2-176.861.9-167.793.8-12.3111.7D356 K357 L358 Y364D356-R360 WeakPolarHBondContact O-CB 3.45Å; D356-R360 PolarHBondContact O-N 3.46Å; K357-R360 PolarHBondContact O-N 3.26Å; L358-R360 PolarHBondContact O-N 3Å; R360-Y364 VanDerWaalsContact NH2-CE1 3.26Å; R360-Y364 PolarHBondContact NH2-OH 3.1Å; R360-Y364 WeakPolarHBondContact O-CD2 3.22Å
361A95.8Very high95.6Very high30 Ų3069 Ų6925%0.24833%0.333CS..Hα-helixtrans-71.3-42.3171.200000112.3L306 K357 L358 S359 R363 Y364L306-A361 HydrophobicContact CD2-CB 3.59Å; K357-A361 PolarHBondContact O-N 2.98Å; K357-A361 VanDerWaalsContact O-N 3.16Å; L358-A361 WeakPolarHBondContact O-CA 3.38Å; L358-A361 WeakPolarHBondContact O-CB 3.09Å; L358-A361 PolarHBondContact O-N 2.91Å; S359-A361 VanDerWaalsContact C-N 3.29Å; A361-R363 VanDerWaalsContact C-N 3.26Å; A361-R363 PolarHBondContact O-N 3.35Å; A361-Y364 WeakPolarHBondContact O-CB 3.47Å; A361-Y364 PolarHBondContact O-N 3.48Å
362L97.6Very high95.9Very high0 Ų066.4 Ų66.40%032%0.315CS..Hα-helixtrans-57.7-37.6175.9-58.8179.9000112.7L306 L310 M334 L358 S359 Y364 Y365 Y366 M371 Y381L306-L362 HydrophobicContact CD2-CD2 3.55Å; L306-L362 HydrophobicContact CD2-CG 4.18Å; L306-L362 HydrophobicContact CG-CD2 3.96Å; L310-L362 HydrophobicContact CD1-CD2 3.66Å; M334-L362 HydrophobicContact CE-CD1 3.91Å; L358-L362 HydrophobicContact CD2-CD1 3.68Å; L358-L362 HydrophobicContact CD2-CD2 4.29Å; L358-L362 HydrophobicContact CD2-CG 3.9Å; L358-L362 PolarHBondContact O-N 3.28Å; S359-L362 PolarHBondContact O-N 2.87Å; L362-Y364 PolarHBondContact O-N 3.22Å; L362-Y365 HydrophobicContact CD2-CD2 4.43Å; L362-Y365 WeakPolarHBondContact O-CB 3.33Å; L362-Y365 PolarHBondContact O-N 3.12Å; L362-Y366 WeakPolarHBondContact O-CD1 3.44Å; L362-Y366 WeakPolarHBondContact O-CE1 3.15Å; L362-M371 HydrophobicContact CB-SD 4.31Å; L362-M371 HydrophobicContact CD2-CE 4.19Å; L362-M371 HydrophobicContact CD2-SD 3.68Å; L362-M371 HydrophobicContact CG-SD 4.47Å; L362-Y381 HydrophobicContact CB-CE1 4.12Å; L362-Y381 HydrophobicContact CD1-CD1 4.27Å; L362-Y381 HydrophobicContact CD1-CD2 4.14Å; L362-Y381 HydrophobicContact CD1-CE1 3.78Å; L362-Y381 HydrophobicContact CD1-CE2 3.63Å; L362-Y381 HydrophobicContact CD1-CG 4.44Å; L362-Y381 VanDerWaalsContact CD1-CZ 3.43Å
363R96.9Very high96Very high115 Ų11564.3 Ų64.343%0.43430%0.299SS..G310 helixtrans-59.3-27.1175.1-71.2173-173.589.6-17.8113.7S359 A361 Y365 Y366S359-R363 WeakPolarHBondContact O-CG 3.35Å; S359-R363 PolarHBondContact O-N 3.29Å; S359-R363 VanDerWaalsContact O-N 3.14Å; S359-R363 PolarHBondContact O-NH1 3.44Å; S359-R363 PolarHBondContact OG-NH1 3Å; A361-R363 VanDerWaalsContact C-N 3.26Å; A361-R363 PolarHBondContact O-N 3.35Å; R363-Y365 PolarHBondContact O-N 2.77Å; R363-Y366 HydrophobicContact CB-CE2 4.18Å; R363-Y366 HydrophobicContact CG-CE2 3.88Å
364Y96.3Very high95.9Very high137 Ų13763.9 Ų63.954%0.53730%0.299SS..G310 helixtrans-76.5-5.8175.7-66.2-58.5000113.6R360 A361 L362R360-Y364 VanDerWaalsContact NH2-CE1 3.26Å; R360-Y364 PolarHBondContact NH2-OH 3.1Å; R360-Y364 WeakPolarHBondContact O-CD2 3.22Å; A361-Y364 WeakPolarHBondContact O-CB 3.47Å; A361-Y364 PolarHBondContact O-N 3.48Å; L362-Y364 PolarHBondContact O-N 3.22Å
365Y96.4Very high95.7Very high28 Ų2868.7 Ų68.711%0.1132%0.319CS..G310 helixtrans-94.7-8.9177.3-66.3-44.7000114.1L306 W307 L362 R363 K368 N369 I370 M371L306-Y365 HydrophobicContact CB-CE2 4.03Å; L306-Y365 HydrophobicContact CD2-CE2 4.33Å; L306-Y365 HydrophobicContact CG-CE2 4.29Å; L306-Y365 PolarHBondContact N-OH 2.77Å; W307-Y365 HydrophobicContact CB-CD2 4.4Å; W307-Y365 HydrophobicContact CB-CE2 3.96Å; W307-Y365 AromaticContact CD1-CE1 3.75Å; W307-Y365 AromaticContact CD1-CZ 3.67Å; L362-Y365 HydrophobicContact CD2-CD2 4.43Å; L362-Y365 WeakPolarHBondContact O-CB 3.33Å; L362-Y365 PolarHBondContact O-N 3.12Å; R363-Y365 PolarHBondContact O-N 2.77Å; Y365-K368 PolarHBondContact O-N 3.23Å; Y365-N369 PolarHBondContact O-N 2.98Å; Y365-I370 HydrophobicContact CD1-CB 4.19Å; Y365-I370 HydrophobicContact CD1-CD1 3.89Å; Y365-I370 HydrophobicContact CD1-CG2 3.99Å; Y365-I370 HydrophobicContact CD2-CG2 4.45Å; Y365-I370 HydrophobicContact CE1-CD1 4.27Å; Y365-I370 HydrophobicContact CG-CB 4.28Å; Y365-I370 HydrophobicContact CG-CG2 3.92Å; Y365-I370 PolarHBondContact O-N 3.16Å; Y365-I370 VanDerWaalsContact O-N 3.16Å; Y365-M371 CarbonylContact C-O 3.59Å; Y365-M371 HydrophobicContact CD2-CE 3.8Å; Y365-M371 HydrophobicContact CD2-CG 4.28Å; Y365-M371 HydrophobicContact CD2-SD 3.97Å; Y365-M371 HydrophobicContact CE2-CE 4.37Å; Y365-M371 HydrophobicContact CG-CG 4.36Å; Y365-M371 PolarHBondContact O-N 3.25Å
366Y95.6Very high95.5Very high66 Ų6671.2 Ų71.226%0.25936%0.357SS..THydrogen-bonded Turntrans-66.3-55.4179.2-56.6-7.4000110.2L362 R363 K368 N369 M371 K373 Y381L362-Y366 WeakPolarHBondContact O-CD1 3.44Å; L362-Y366 WeakPolarHBondContact O-CE1 3.15Å; R363-Y366 HydrophobicContact CB-CE2 4.18Å; R363-Y366 HydrophobicContact CG-CE2 3.88Å; Y366-K368 PolarHBondContact O-N 3.44Å; Y366-K368 VanDerWaalsContact O-N 3.09Å; Y366-N369 PolarHBondContact O-N 3.26Å; Y366-N369 VanDerWaalsContact O-N 3.16Å; Y366-M371 WeakPolarHBondContact CA-O 3.42Å; Y366-M371 WeakPolarHBondContact CD1-O 3.4Å; Y366-K373 HydrophobicContact CE1-CB 4.37Å; Y366-Y381 HydrophobicContact CE1-CE1 4.39Å
367D91.6Very high95.3Very high147 Ų14769.6 Ų69.679%0.78635%0.345SS*.THydrogen-bonded Turntrans-70.5-5.1179.2-43.1-38.1000113.2
368K89.2Confident95.2Very high119 Ų11973.3 Ų73.352%0.51736%0.356SS..THydrogen-bonded Turntrans-1034.3176.6-69.5-158.470.5179.10113.6Y365 Y366 I370Y365-K368 PolarHBondContact O-N 3.23Å; Y366-K368 PolarHBondContact O-N 3.44Å; Y366-K368 VanDerWaalsContact O-N 3.09Å; K368-I370 HydrophobicContact CB-CD1 4.04Å; K368-I370 HydrophobicContact CB-CG1 4.3Å; K368-I370 HydrophobicContact CD-CD1 4.41Å; K368-I370 PolarHBondContact O-N 3.02Å
369N92.7Very high95.2Very high89 Ų8976.6 Ų76.648%0.47637%0.369SS..THydrogen-bonded Turntrans54.822.5-176-6990.8000114.6Y365 Y366 D384 G387Y365-N369 PolarHBondContact O-N 2.98Å; Y366-N369 PolarHBondContact O-N 3.26Å; Y366-N369 VanDerWaalsContact O-N 3.16Å; N369-D384 PolarHBondContact ND2-OD2 3.44Å; N369-D384 VanDerWaalsContact O-CB 3.27Å; N369-D384 WeakPolarHBondContact O-CB 3.37Å; N369-G387 WeakPolarHBondContact O-CA 3.5Å; N369-G387 PolarHBondContact O-N 2.87Å
370I92.7Very high95.1Very high2 Ų276.5 Ų76.51%0.0137%0.368CS..SBendtrans-88.1-39-179.1-77.9167.2000110.4W307 Y365 K368 D384 I388 A391W307-I370 HydrophobicContact CB-CG2 3.71Å; W307-I370 HydrophobicContact CD2-CG2 4.39Å; W307-I370 HydrophobicContact CG-CG2 3.82Å; Y365-I370 HydrophobicContact CD1-CB 4.19Å; Y365-I370 HydrophobicContact CD1-CD1 3.89Å; Y365-I370 HydrophobicContact CD1-CG2 3.99Å; Y365-I370 HydrophobicContact CD2-CG2 4.45Å; Y365-I370 HydrophobicContact CE1-CD1 4.27Å; Y365-I370 HydrophobicContact CG-CB 4.28Å; Y365-I370 HydrophobicContact CG-CG2 3.92Å; Y365-I370 PolarHBondContact O-N 3.16Å; Y365-I370 VanDerWaalsContact O-N 3.16Å; K368-I370 HydrophobicContact CB-CD1 4.04Å; K368-I370 HydrophobicContact CB-CG1 4.3Å; K368-I370 HydrophobicContact CD-CD1 4.41Å; K368-I370 PolarHBondContact O-N 3.02Å; I370-D384 PolarHBondContact O-N 3.26Å; I370-D384 VanDerWaalsContact O-N 3.11Å; I370-I388 HydrophobicContact CG2-CD1 4Å; I370-A391 HydrophobicContact CD1-CB 4.04Å; I370-A391 HydrophobicContact CG1-CB 4.26Å
371M95.2Very high95.1Very high0 Ų071.3 Ų71.30%035%0.349CS..EExtended strand (participates in β ladder)trans-159.6160.7172.561.7178.37000111.2W307 L310 L362 Y365 Y366 K382 F383W307-M371 HydrophobicContact CB-CE 3.84Å; L310-M371 HydrophobicContact CD1-CE 4.49Å; L362-M371 HydrophobicContact CB-SD 4.31Å; L362-M371 HydrophobicContact CD2-CE 4.19Å; L362-M371 HydrophobicContact CD2-SD 3.68Å; L362-M371 HydrophobicContact CG-SD 4.47Å; Y365-M371 CarbonylContact C-O 3.59Å; Y365-M371 HydrophobicContact CD2-CE 3.8Å; Y365-M371 HydrophobicContact CD2-CG 4.28Å; Y365-M371 HydrophobicContact CD2-SD 3.97Å; Y365-M371 HydrophobicContact CE2-CE 4.37Å; Y365-M371 HydrophobicContact CG-CG 4.36Å; Y365-M371 PolarHBondContact O-N 3.25Å; Y366-M371 WeakPolarHBondContact CA-O 3.42Å; Y366-M371 WeakPolarHBondContact CD1-O 3.4Å; M371-K382 CarbonylContact C-O 3.23Å; M371-K382 WeakPolarHBondContact CA-O 3.37Å; M371-K382 WeakPolarHBondContact CB-O 3.25Å; M371-F383 HydrophobicContact CB-CD1 4.29Å; M371-F383 HydrophobicContact CE-CD1 4.09Å; M371-F383 HydrophobicContact CE-CE1 3.55Å; M371-F383 HydrophobicContact CE-CZ 4.21Å
372T96.3Very high95.1Very high67 Ų6772.5 Ų72.541%0.41135%0.348SS..EExtended strand (participates in β ladder)trans-123.1163.9172.656.70000110.6Y381 K382T372-Y381 CarbonylContact O-C 3.51Å; T372-Y381 WeakPolarHBondContact O-CA 3.5Å; T372-K382 PolarHBondContact N-O 3.24Å; T372-K382 PolarHBondContact O-N 2.77Å
373K96Very high95Very high88 Ų8872.9 Ų72.938%0.38335%0.35SS..EExtended strand (participates in β ladder)trans-84.6136.9170.4-171.5-173174.5-1700109.8Y366 H375 Y381Y366-K373 HydrophobicContact CE1-CB 4.37Å; K373-H375 PolarHBondContact O-CD2 3.4Å; K373-Y381 HydrophobicContact CB-CD1 4.3Å; K373-Y381 HydrophobicContact CB-CE1 4.21Å; K373-Y381 HydrophobicContact CG-CD1 4.43Å; K373-Y381 HydrophobicContact CG-CE1 4.14Å
374V96.1Very high94.7Very high24 Ų2469.2 Ų69.215%0.14534%0.339CS..PPolyproline II helixtrans-83.1120.1167.4-178.60000109.2E331 K377 A380 K382E331-V374 HydrophobicContact CG-CG2 3.89Å; V374-K377 HydrophobicContact CG1-CB 4.25Å; V374-K377 HydrophobicContact CG1-CD 3.95Å; V374-K377 HydrophobicContact CG1-CG 4.16Å; V374-A380 HydrophobicContact CB-CB 3.97Å; V374-A380 PolarHBondContact N-O 2.88Å; V374-K382 HydrophobicContact CG2-CB 4.01Å
375H94.3Very high94.1Very high153 Ų15366.7 Ų66.771%0.70833%0.331SS*.SBendtrans-80.6155.7176.7-73.2-114.7000110.6K373 K377K373-H375 PolarHBondContact O-CD2 3.4Å; H375-K377 PolarHBondContact O-N 2.7Å; H375-K377 VanDerWaalsContact O-N 3.13Å
376G93.6Very high93.5Very high93 Ų9371.2 Ų71.296%0.95935%0.353SS*.SBendtrans78.4-24.8-173.500000115.2
377K93.3Very high93.1Very high75 Ų7568.2 Ų68.233%0.32634%0.342SS..SBendtrans-101.1148.9176.7-64.6-173.4-175.4-1770112.6E326 E331 V374 H375 A380E326-K377 WeakPolarHBondContact OE1-CD 3.41Å; E326-K377 VanDerWaalsContact OE1-CE 3.27Å; E326-K377 WeakPolarHBondContact OE1-CE 3.28Å; E326-K377 IonicContact OE1-NZ 2.64Å; E326-K377 PolarHBondContact OE1-NZ 2.81Å; E331-K377 WeakPolarHBondContact OE1-CE 3.46Å; E331-K377 IonicContact OE1-NZ 2.67Å; E331-K377 PolarHBondContact OE1-NZ 2.91Å; V374-K377 HydrophobicContact CG1-CB 4.25Å; V374-K377 HydrophobicContact CG1-CD 3.95Å; V374-K377 HydrophobicContact CG1-CG 4.16Å; H375-K377 PolarHBondContact O-N 2.7Å; H375-K377 VanDerWaalsContact O-N 3.13Å; K377-A380 HydrophobicContact CB-CB 3.54Å; K377-A380 HydrophobicContact CD-CB 4.13Å; K377-A380 HydrophobicContact CG-CB 4.49Å
378R95.6Very high92.8Very high190 Ų19061.8 Ų61.872%0.71731%0.307SS*.SBendtrans-84.4136.8172.1-72.9-175.168178.30.2110.1A380R378-A380 PolarHBondContact O-N 3.4Å
379Y97.7Very high92.4Very high69 Ų6957.8 Ų57.827%0.27130%0.296SS..SBendtrans52.623.9174.9-46.4-68.7000115.6K333 M334 P337 Y355K333-Y379 WeakPolarHBondContact CA-O 3.38Å; M334-Y379 PolarHBondContact N-O 2.94Å; M334-Y379 WeakPolarHBondContact O-CB 3.3Å; P337-Y379 HydrophobicContact CB-CD1 3.93Å; P337-Y379 HydrophobicContact CB-CE1 4.22Å; P337-Y379 HydrophobicContact CB-CG 4.26Å; P337-Y379 HydrophobicContact CG-CD1 3.96Å; P337-Y379 HydrophobicContact CG-CD2 4.22Å; P337-Y379 HydrophobicContact CG-CE1 3.88Å; P337-Y379 HydrophobicContact CG-CE2 4.16Å; P337-Y379 HydrophobicContact CG-CG 4.13Å; Y355-Y379 HydrophobicContact CD1-CE1 4.16Å; Y355-Y379 AromaticContact CE1-CD1 3.89Å; Y355-Y379 HydrophobicContact CE1-CD1 3.89Å; Y355-Y379 AromaticContact CE1-CE1 3.68Å; Y355-Y379 HydrophobicContact CE1-CE1 3.68Å; Y355-Y379 AromaticContact CE2-CD1 3.95Å; Y355-Y379 HydrophobicContact CE2-CD1 3.95Å; Y355-Y379 HydrophobicContact CE2-CE1 4.46Å; Y355-Y379 AromaticContact CZ-CD1 3.53Å; Y355-Y379 AromaticContact CZ-CE1 3.85Å
380A97Very high91.9Very high1 Ų159.9 Ų59.91%0.00830%0.303CS..EExtended strand (participates in β ladder)trans-104.2140.8-176.700000112.2F332 K333 V374 K377 R378F332-A380 CarbonylContact O-C 3.56Å; F332-A380 VanDerWaalsContact O-CA 3.28Å; F332-A380 WeakPolarHBondContact O-CA 3.44Å; K333-A380 HydrophobicContact CB-CB 4.3Å; V374-A380 HydrophobicContact CB-CB 3.97Å; V374-A380 PolarHBondContact N-O 2.88Å; K377-A380 HydrophobicContact CB-CB 3.54Å; K377-A380 HydrophobicContact CD-CB 4.13Å; K377-A380 HydrophobicContact CG-CB 4.49Å; R378-A380 PolarHBondContact O-N 3.4Å
381Y97.4Very high91.2Very high4 Ų461.2 Ų61.22%0.01632%0.315CS..EExtended strand (participates in β ladder)trans-145.4159-171.3-68-85000109.4E331 F332 Y355 L362 Y366 T372 K373E331-Y381 CarbonylContact C-O 3.49Å; E331-Y381 WeakPolarHBondContact CA-O 3.12Å; F332-Y381 WeakPolarHBondContact CD1-O 3.39Å; F332-Y381 HydrophobicContact CE2-CD2 4.39Å; F332-Y381 VanDerWaalsContact CZ-CB 3.49Å; F332-Y381 HydrophobicContact CZ-CD2 4.48Å; F332-Y381 HydrophobicContact CZ-CG 4.26Å; F332-Y381 PolarHBondContact N-O 3.18Å; F332-Y381 PolarHBondContact O-N 2.75Å; F332-Y381 VanDerWaalsContact O-O 3.07Å; Y355-Y381 PolarHBondContact OH-OH 2.77Å; Y355-Y381 VanDerWaalsContact OH-OH 3.08Å; L362-Y381 HydrophobicContact CB-CE1 4.12Å; L362-Y381 HydrophobicContact CD1-CD1 4.27Å; L362-Y381 HydrophobicContact CD1-CD2 4.14Å; L362-Y381 HydrophobicContact CD1-CE1 3.78Å; L362-Y381 HydrophobicContact CD1-CE2 3.63Å; L362-Y381 HydrophobicContact CD1-CG 4.44Å; L362-Y381 VanDerWaalsContact CD1-CZ 3.43Å; Y366-Y381 HydrophobicContact CE1-CE1 4.39Å; T372-Y381 CarbonylContact O-C 3.51Å; T372-Y381 WeakPolarHBondContact O-CA 3.5Å; K373-Y381 HydrophobicContact CB-CD1 4.3Å; K373-Y381 HydrophobicContact CB-CE1 4.21Å; K373-Y381 HydrophobicContact CG-CD1 4.43Å; K373-Y381 HydrophobicContact CG-CE1 4.14Å
382K95.3Very high90.3Very high56 Ų5664.2 Ų64.224%0.24333%0.33CS..EExtended strand (participates in β ladder)trans-137.6121.8-179.9-177169.7-176.4126.30110.5T328 N329 G330 E331 M371 T372 V374T328-K382 PolarHBondContact O-NZ 3.14Å; N329-K382 WeakPolarHBondContact O-CE 3.47Å; N329-K382 PolarHBondContact O-NZ 3.28Å; G330-K382 WeakPolarHBondContact O-CA 3.29Å; E331-K382 HydrophobicContact CB-CB 4.19Å; E331-K382 HydrophobicContact CB-CD 4.16Å; E331-K382 HydrophobicContact CB-CG 4.07Å; M371-K382 CarbonylContact C-O 3.23Å; M371-K382 WeakPolarHBondContact CA-O 3.37Å; M371-K382 WeakPolarHBondContact CB-O 3.25Å; T372-K382 PolarHBondContact N-O 3.24Å; T372-K382 PolarHBondContact O-N 2.77Å; V374-K382 HydrophobicContact CG2-CB 4.01Å
383F95.1Very high89.2Confident7 Ų767 Ų673%0.03134%0.339CS..EExtended strand (participates in β ladder)trans-65.3143.6171.5-69.1-78.2000110.4W307 L310 L311 L314 W325 G330 F332 M371 I388W307-F383 HydrophobicContact CB-CE1 4.3Å; L310-F383 HydrophobicContact CB-CZ 4.24Å; L311-F383 HydrophobicContact CD1-CE1 4.38Å; L311-F383 HydrophobicContact CD2-CD2 3.92Å; L311-F383 HydrophobicContact CD2-CE1 4.13Å; L311-F383 HydrophobicContact CD2-CE2 3.5Å; L311-F383 HydrophobicContact CD2-CG 4.41Å; L311-F383 HydrophobicContact CD2-CZ 3.62Å; L311-F383 HydrophobicContact CG-CE1 3.9Å; L311-F383 HydrophobicContact CG-CE2 4.04Å; L311-F383 HydrophobicContact CG-CZ 3.6Å; L314-F383 HydrophobicContact CD1-CE2 3.96Å; W325-F383 HydrophobicContact CH2-CD2 4.04Å; W325-F383 HydrophobicContact CH2-CE2 4.01Å; W325-F383 AromaticContact CZ3-CD2 3.93Å; W325-F383 HydrophobicContact CZ3-CD2 3.93Å; W325-F383 HydrophobicContact CZ3-CE2 4.1Å; G330-F383 PolarHBondContact O-N 2.98Å; F332-F383 AromaticContact CD1-CD2 3.71Å; F332-F383 HydrophobicContact CD1-CD2 3.71Å; F332-F383 AromaticContact CD1-CE2 3.49Å; F332-F383 HydrophobicContact CD1-CE2 3.49Å; F332-F383 VanDerWaalsContact CD1-CE2 3.49Å; F332-F383 HydrophobicContact CD1-CZ 4.42Å; F332-F383 AromaticContact CE1-CD2 3.6Å; F332-F383 HydrophobicContact CE1-CD2 3.6Å; F332-F383 HydrophobicContact CE1-CE1 4.5Å; F332-F383 AromaticContact CE1-CE2 3.23Å; F332-F383 HydrophobicContact CE1-CE2 3.23Å; F332-F383 HydrophobicContact CE1-CG 4.38Å; F332-F383 AromaticContact CE1-CZ 3.74Å; F332-F383 HydrophobicContact CE1-CZ 3.74Å; F332-F383 HydrophobicContact CG-CE2 4.46Å; F332-F383 HydrophobicContact CZ-CE2 4.03Å; F332-F383 HydrophobicContact CZ-CZ 4.18Å; M371-F383 HydrophobicContact CB-CD1 4.29Å; M371-F383 HydrophobicContact CE-CD1 4.09Å; M371-F383 HydrophobicContact CE-CE1 3.55Å; M371-F383 HydrophobicContact CE-CZ 4.21Å; F383-I388 HydrophobicContact CB-CG1 4.49Å; F383-I388 HydrophobicContact CD1-CD1 3.87Å; F383-I388 HydrophobicContact CD1-CG1 4.25Å; F383-I388 HydrophobicContact CE1-CD1 4.37Å
384D90.9Very high87.3Confident38 Ų3868.4 Ų68.420%0.20336%0.357CS..  trans-106.7117.1168.9169.911.8000108.3N369 I370 H386 G387 I388N369-D384 PolarHBondContact ND2-OD2 3.44Å; N369-D384 VanDerWaalsContact O-CB 3.27Å; N369-D384 WeakPolarHBondContact O-CB 3.37Å; I370-D384 PolarHBondContact O-N 3.26Å; I370-D384 VanDerWaalsContact O-N 3.11Å; D384-H386 PolarHBondContact O-N 3.01Å; D384-H386 IonicContact OD1-CE1 3.5Å; D384-H386 IonicContact OD1-CG 2.62Å; D384-H386 PolarHBondContact OD1-N 3.31Å; D384-H386 VanDerWaalsContact OD1-N 3.09Å; D384-H386 IonicContact OD1-ND1 3.53Å; D384-H386 PolarHBondContact OD1-ND1 3.18Å; D384-G387 PolarHBondContact O-N 3.29Å; D384-I388 WeakPolarHBondContact O-CB 3.42Å; D384-I388 VanDerWaalsContact O-CG1 3.3Å; D384-I388 WeakPolarHBondContact O-CG1 3.43Å; D384-I388 PolarHBondContact O-N 3.46Å
385F85.3Confident85Confident84 Ų8474.7 Ų74.737%0.36838%0.384SS..Hα-helixtrans-61.1-26.9-173.5-65.5-94.8000112.3L289 N329 A389L289-F385 HydrophobicContact CD1-CE1 4.15Å; L289-F385 HydrophobicContact CD1-CZ 4.24Å; L289-F385 HydrophobicContact CD2-CE1 3.88Å; L289-F385 HydrophobicContact CG-CE1 4.22Å; N329-F385 HydrophobicContact CB-CE2 4.25Å; F385-A389 VanDerWaalsContact O-CB 3.29Å; F385-A389 WeakPolarHBondContact O-CB 3.34Å; F385-A389 PolarHBondContact O-N 2.85Å
386H83.8Confident82.4Confident124 Ų12472.4 Ų72.457%0.57438%0.383SS*.Hα-helixtrans-71.7-52.4-178.6-54.190.8000111.9D384 I388 A389 Q390D384-H386 PolarHBondContact O-N 3.01Å; D384-H386 IonicContact OD1-CE1 3.5Å; D384-H386 IonicContact OD1-CG 2.62Å; D384-H386 PolarHBondContact OD1-N 3.31Å; D384-H386 VanDerWaalsContact OD1-N 3.09Å; D384-H386 IonicContact OD1-ND1 3.53Å; D384-H386 PolarHBondContact OD1-ND1 3.18Å; H386-I388 VanDerWaalsContact C-N 3.31Å; H386-A389 PolarHBondContact O-N 3.08Å; H386-Q390 WeakPolarHBondContact O-CG 3.5Å; H386-Q390 PolarHBondContact O-N 2.8Å
387G85.4Confident79.9Confident2 Ų274.2 Ų74.22%0.02138%0.375CS..Hα-helixtrans-74.3-22.6177.600000112.9N369 D384 A391N369-G387 WeakPolarHBondContact O-CA 3.5Å; N369-G387 PolarHBondContact O-N 2.87Å; D384-G387 PolarHBondContact O-N 3.29Å; G387-A391 WeakPolarHBondContact O-CB 3.36Å; G387-A391 PolarHBondContact O-N 3.24Å
388I86.3Confident77Confident12 Ų1278.9 Ų78.96%0.06240%0.399CS..Hα-helixtrans-61.6-55.5162.6-70-71.7000110.1W307 L311 I370 F383 D384 H386 Q390 A391 L392W307-I388 HydrophobicContact CD2-CD1 4.01Å; W307-I388 HydrophobicContact CE3-CD1 3.35Å; W307-I388 HydrophobicContact CZ3-CD1 3.67Å; W307-I388 HydrophobicContact CZ3-CG2 4.49Å; L311-I388 HydrophobicContact CD1-CD1 4.42Å; I370-I388 HydrophobicContact CG2-CD1 4Å; F383-I388 HydrophobicContact CB-CG1 4.49Å; F383-I388 HydrophobicContact CD1-CD1 3.87Å; F383-I388 HydrophobicContact CD1-CG1 4.25Å; F383-I388 HydrophobicContact CE1-CD1 4.37Å; D384-I388 WeakPolarHBondContact O-CB 3.42Å; D384-I388 VanDerWaalsContact O-CG1 3.3Å; D384-I388 WeakPolarHBondContact O-CG1 3.43Å; D384-I388 PolarHBondContact O-N 3.46Å; H386-I388 VanDerWaalsContact C-N 3.31Å; I388-Q390 PolarHBondContact O-N 2.95Å; I388-A391 CarbonylContact O-C 3.6Å; I388-A391 WeakPolarHBondContact O-CA 3.41Å; I388-A391 PolarHBondContact O-N 3.18Å; I388-L392 HydrophobicContact CG2-CD1 4.46Å; I388-L392 WeakPolarHBondContact O-CG 3.37Å; I388-L392 PolarHBondContact O-N 2.74Å; I388-L392 VanDerWaalsContact O-N 3.1Å
389A80.8Confident74.1Confident35 Ų3574.2 Ų74.229%0.28940%0.395SS..Hα-helixtrans-59.4-30.5-179.900000113.7F385 H386 Q393F385-A389 VanDerWaalsContact O-CB 3.29Å; F385-A389 WeakPolarHBondContact O-CB 3.34Å; F385-A389 PolarHBondContact O-N 2.85Å; H386-A389 PolarHBondContact O-N 3.08Å; A389-Q393 PolarHBondContact O-NE2 3.07Å
390Q82.1Confident71.4Confident133 Ų13376.7 Ų76.762%0.62142%0.422SS*.Hα-helixtrans-71.8-42.4170.2-69.4176.415.400112.5H386 I388 L392 Q393H386-Q390 WeakPolarHBondContact O-CG 3.5Å; H386-Q390 PolarHBondContact O-N 2.8Å; I388-Q390 PolarHBondContact O-N 2.95Å; Q390-L392 PolarHBondContact O-N 3.2Å; Q390-L392 VanDerWaalsContact O-N 3.11Å; Q390-Q393 PolarHBondContact O-N 3.24Å; Q390-Q393 VanDerWaalsContact O-N 3.09Å
391A78.2Confident68.4Low30 Ų3084.8 Ų84.825%0.24846%0.462CS..Hα-helixtrans-68-3.6175.100000114.1W307 I370 G387 I388W307-A391 HydrophobicContact CH2-CB 4.46Å; W307-A391 HydrophobicContact CZ2-CB 3.84Å; I370-A391 HydrophobicContact CD1-CB 4.04Å; I370-A391 HydrophobicContact CG1-CB 4.26Å; G387-A391 WeakPolarHBondContact O-CB 3.36Å; G387-A391 PolarHBondContact O-N 3.24Å; I388-A391 CarbonylContact O-C 3.6Å; I388-A391 WeakPolarHBondContact O-CA 3.41Å; I388-A391 PolarHBondContact O-N 3.18Å
392L75.3Confident65.4Low64 Ų6494.9 Ų94.934%0.33550%0.501SS..THydrogen-bonded Turntrans-96.2-11.2171.6-65.4-171.1000114.9L296 W307 I388 Q390L296-L392 HydrophobicContact CD1-CD1 3.9Å; L296-L392 HydrophobicContact CD1-CD2 3.62Å; L296-L392 HydrophobicContact CD1-CG 4.36Å; L296-L392 HydrophobicContact CD2-CD1 4.14Å; L296-L392 HydrophobicContact CD2-CD2 3.23Å; L296-L392 HydrophobicContact CD2-CG 4.26Å; L296-L392 HydrophobicContact CG-CD2 3.98Å; W307-L392 HydrophobicContact CH2-CD2 3.67Å; W307-L392 HydrophobicContact CZ3-CD2 4.48Å; I388-L392 HydrophobicContact CG2-CD1 4.46Å; I388-L392 WeakPolarHBondContact O-CG 3.37Å; I388-L392 PolarHBondContact O-N 2.74Å; I388-L392 VanDerWaalsContact O-N 3.1Å; Q390-L392 PolarHBondContact O-N 3.2Å; Q390-L392 VanDerWaalsContact O-N 3.11Å
393Q74.1Confident62.4Low125 Ų125102.1 Ų102.158%0.58453%0.533SS*.SBendtrans-66.4134.9175.9-60.6-53.6-52.100109.6A389 Q390 H395A389-Q393 PolarHBondContact O-NE2 3.07Å; Q390-Q393 PolarHBondContact O-N 3.24Å; Q390-Q393 VanDerWaalsContact O-N 3.09Å; Q393-H395 PolarHBondContact O-N 3.28Å
394P56.5Low59.3Low117 Ų117111.1 Ų111.176%0.7657%0.568SS**  trans-66.5101.8175.527.6-33000108.6
395H46.5Very low56.6Low157 Ų157114.5 Ų114.573%0.72759%0.592SS**  trans-57.6127.1168.3-77.5-58.7000108.4Q393Q393-H395 PolarHBondContact O-N 3.28Å
396P40.8Very low54.1Low104 Ų104116.4 Ų116.468%0.67562%0.616SS**  trans-58.2146.117226.3-34000108.8E398P396-E398 PolarHBondContact O-N 2.7Å
397T40.8Very low51.9Low131 Ų131116.8 Ų116.880%0.80462%0.622SS**  trans-73.777.7-175.750.30000111.2S399T397-S399 PolarHBondContact O-N 2.72Å; T397-S399 PolarHBondContact O-OG 3.41Å
398E32.4Very low49.5Very low174 Ų174124.3 Ų124.381%0.81366%0.661SS**  trans-53.688.7160-80.9-68.3140.800108.1P396 S400P396-E398 PolarHBondContact O-N 2.7Å; E398-S400 PolarHBondContact O-N 2.71Å
399S35.4Very low47.1Very low92 Ų92127.5 Ų127.564%0.64369%0.69SS**  trans-67.5128.2-179.2-66.10000107.4T397 M401T397-S399 PolarHBondContact O-N 2.72Å; T397-S399 PolarHBondContact O-OG 3.41Å; S399-M401 PolarHBondContact O-N 3.17Å
400S40.6Very low45.1Very low120 Ų120136.1 Ų136.184%0.83972%0.716SS**  trans-71.249.7178.3-56.20000112.6E398 Y402E398-S400 PolarHBondContact O-N 2.71Å; S400-Y402 PolarHBondContact O-N 3.11Å
401M33.6Very low43.1Very low171 Ų171135.8 Ų135.884%0.84272%0.723SS**  trans-72.1116.4173.8-164169.583.700107.7S399 K403S399-M401 PolarHBondContact O-N 3.17Å; M401-K403 PolarHBondContact O-N 3.42Å; M401-K403 VanDerWaalsContact O-N 3.11Å
402Y34.1Very low41.2Very low216 Ų216138.9 Ų138.985%0.84774%0.74SS**  trans-53.6118.4-175-88.9-110.4000111S400 Y404S400-Y402 PolarHBondContact O-N 3.11Å; Y402-Y404 PolarHBondContact O-N 3.34Å
403K31.6Very low39Very low208 Ų208141.7 Ų141.790%0.90477%0.766SS**  trans-7381.5173.4-170.7172.4-176.7173.30109.8M401M401-K403 PolarHBondContact O-N 3.42Å; M401-K403 VanDerWaalsContact O-N 3.11Å
404Y30.5Very low37Very low197 Ų197146.7 Ų146.777%0.77378%0.781SS**  trans-59.2132.6168.4-131.4-85.8000109Y402 S406Y402-Y404 PolarHBondContact O-N 3.34Å; Y404-S406 PolarHBondContact O-N 3.12Å; Y404-S406 VanDerWaalsContact O-N 3.12Å
405P34.6Very low36.1Very low108 Ų108150 Ų15070%0.70179%0.786SS**  trans-71.6105.8174.5-16.731.3000110.1D407P405-D407 PolarHBondContact O-N 2.86Å
406S32.2Very low35.4Very low125 Ų125146.6 Ų146.687%0.87478%0.784SS**  trans-81104.5164.4-590000108.4Y404Y404-S406 PolarHBondContact O-N 3.12Å; Y404-S406 VanDerWaalsContact O-N 3.12Å
407D38.1Very low34.9Very low132 Ų132149.5 Ų149.571%0.70679%0.788SS**  trans-108.2145.7-175.4-151.1-19.7000111.1P405P405-D407 PolarHBondContact O-N 2.86Å
408L35.6Very low34.6Very low159 Ų159150.1 Ų150.183%0.83278%0.782SS**  trans61.5150.4173.4-68.8141.9000117
409A36.3Very low34.7Very low80 Ų80150 Ų15066%0.66178%0.782SS**  cis-148.4157.6-10.900000111.4
410Y37.3Very low34.7Very low215 Ų215154.8 Ų154.884%0.84379%0.791SS**  trans-80.2125.3173.7174.4-87.7000111.3P412Y410-P412 HydrophobicContact CE1-CG 4.14Å
411V40.8Very low34.5Very low127 Ų127155.7 Ų155.777%0.7779%0.791SS**  trans-137.7130.9169-810000110.9
412P38.7Very low34.8Very low94 Ų94154.2 Ų154.261%0.6179%0.787SS**PPolyproline II helixtrans-78147-175.4-15.631.4000114.2Y410Y410-P412 HydrophobicContact CE1-CG 4.14Å
413S29Very low34.8Very low124 Ų124153.1 Ų153.187%0.86779%0.787SS**PPolyproline II helixtrans-75.8123.3174.7-49.30000112.2
414Y32Very low35Very low230 Ų230149.5 Ų149.590%0.90278%0.782SS**PPolyproline II helixtrans-102.2164163.9-90.7-85.5000111.8
415H37.9Very low35.3Very low187 Ų187144.7 Ų144.787%0.86678%0.777SS**PPolyproline II helixtrans-101.3154.5-155.5-142-66.5000113.9
416A30.5Very low36Very low84 Ų84145.6 Ų145.669%0.69478%0.783SS**  trans92.1127.2143.100000122.4
417H31.3Very low36.2Very low165 Ų165148 Ų14876%0.76478%0.78SS**  trans93.5154.7138-139.575000121.3
418Q33.4Very low37.2Very low145 Ų145147.4 Ų147.468%0.67878%0.783SS**  trans-86.7-179.9-163.3-46.7173.1-3.700111.9
419Q34.4Very low38.1Very low172 Ų172145.3 Ų145.380%0.80478%0.779SS**  cis-149.3-174.331.4-75.6-164-15.800114.7
420K36.7Very low37.9Very low192 Ų192146.6 Ų146.684%0.83578%0.783SS**  trans-101.1138.8-172.9155.6-160.7172.6-172.90112.7
421V35.8Very low37.7Very low138 Ų138144.4 Ų144.484%0.83678%0.782SS**  trans-167.5155141.6-91.90000112.1
422N39.3Very low38.1Very low141 Ų141143.3 Ų143.375%0.75478%0.778SS**  trans-104.5157.6162.6-82.412.9000109.8
423F35.2Very low37.7Very low193 Ų193144.1 Ų144.185%0.84678%0.781SS**  157.2125.2120.1-99.8-97.3000114.6
424V35.8Very low37.9Very low132 Ų132144.1 Ų144.180%0.878%0.776SS**  trans68.6143.1144.3167.40000122.5
425S36.9Very low38.2Very low95 Ų95137.9 Ų137.966%0.66477%0.766SS**  trans-93.8173.9179.2-38.30000114.2
426P47.8Very low38Very low128 Ų128134 Ų13483%0.83176%0.76SS**  -148.8175.2108.337.3-20000117.1
427H37.1Very low38.6Very low176 Ų176137.5 Ų137.582%0.81577%0.767SS**  trans-103-164172.1-48.3-84.7000110.1
428P60.1Low38.8Very low118 Ų118138.6 Ų138.677%0.76677%0.77SS**  cis-121.1-147.6-4.446.5-28.6000110.5
429P53.5Low38.9Very low115 Ų115140.7 Ų140.775%0.74778%0.777SS**  cis-115.8-148.9-8.823.64.3000111.6
430S32Very low38.7Very low107 Ų107135.8 Ų135.875%0.74877%0.772SS**  cis-157-173.122-59.60000113.7
431M34.3Very low39.4Very low169 Ų169132.1 Ų132.183%0.83377%0.768SS**  trans-145.7173.7-176.4-87.3-109.2-79.300108.7
432P47.8Very low39.2Very low104 Ų104131.6 Ų131.668%0.67577%0.766SS**  cis-156.9167.935.741.6-17.2000122.7
433V31.6Very low38.8Very low111 Ų111129 Ų12967%0.67376%0.763SS**  trans71.5133.9141-67.30000128.3
434T33.3Very low38.6Very low125 Ų125126.7 Ų126.777%0.76776%0.755SS**  trans74.3145.7136.850.40000122.3
435S36.5Very low38.4Very low98 Ų98129.9 Ų129.969%0.68575%0.754SS**  cis-174.6172.7-13.954.70000115.1
436S34.8Very low38.3Very low105 Ų105137 Ų13773%0.73477%0.767SS**  trans97.9123145.2-54.30000121.4
437N42.2Very low37.4Very low158 Ų158135.8 Ų135.885%0.84576%0.762SS**  trans-99150.9163.6-65.833.1000110.9
438F36.7Very low37.4Very low188 Ų188132.9 Ų132.983%0.82576%0.761SS**  trans-147.5106.5165-112.4-97.7000114.3
439F35.3Very low36.8Very low189 Ų189133.4 Ų133.483%0.82976%0.764SS**  trans61.7154.9149.9-69.2-102.5000124.2
440G30.1Very low35.9Very low69 Ų69134.8 Ų134.871%0.71177%0.771SS**  trans-105.4-139.7170.500000112.3
441P51.1Low36Very low116 Ų116134.3 Ų134.375%0.75377%0.774SS**  cis-145.4-159.314.844.4-23.2000116.3
442T31.6Very low36Very low127 Ų127129.5 Ų129.578%0.77977%0.768SS**  trans66.1131.2166.548.40000117.9
443A30.6Very low35.3Very low85 Ų85132.9 Ų132.970%0.70278%0.778SS**  76146.250.500000112.5
444Q32Very low35.6Very low145 Ų145137.6 Ų137.668%0.67879%0.785SS**  cis-170179.221.6-156.7168.64.300112
445Y31.2Very low36.1Very low199 Ų199137.7 Ų137.778%0.7879%0.788SS**  trans90.2177.8156.7-62.2-59.7000122.7
446W34.2Very low36.1Very low244 Ų244138.9 Ų138.992%0.92479%0.787SS**  trans-134.4-177.2-144.3-128.468.8000111.2
447S29.1Very low37Very low104 Ų104139 Ų13973%0.72779%0.785SS**  trans82.7131.6154740000121.1
448S38Very low36.5Very low115 Ų115138.4 Ų138.480%0.80478%0.782SS**  trans-88161.3155.5-43.20000110
449P46.8Very low36.9Very low128 Ų128135.3 Ų135.383%0.83178%0.778SS**  -145.4-179.7124.437.2-21.8000115.7
450T35.8Very low37.7Very low144 Ų144131.7 Ų131.788%0.88377%0.773SS**  trans-91135.6-166.6-440000115.2
451A33.2Very low38.3Very low98 Ų98139.3 Ų139.381%0.8178%0.781SS**  trans175.4148.9142.800000109.8
452G33.6Very low37.7Very low68 Ų68142.3 Ų142.370%0.70178%0.784SS**  cis123.496.6-6.200000113.8
453I33.3Very low38.6Very low174 Ų174141.6 Ų141.689%0.89278%0.782SS**  trans-166.6144.3160.5-98.7144.9000109.1
454Y37.7Very low38.8Very low210 Ų210144 Ų14482%0.82478%0.783SS**  trans-108.3156.4179.2-101.5-75.3000109.5
455P45Very low39.1Very low127 Ų127143.9 Ų143.983%0.82579%0.792SS**  -146.9157.37337.3-17.5000118.4
456N35.9Very low39.5Very low124 Ų124142 Ų14266%0.66379%0.79SS**  trans-109.4152.1158.1-160.519.7000105.5N458N456-N458 PolarHBondContact OD1-N 3.49Å
457P54.3Low40.2Very low106 Ų106137.1 Ų137.169%0.68879%0.787SS**  -147.7148.867.738.2-18.9000116.8
458N31.6Very low41.1Very low147 Ų147137.9 Ų137.979%0.78679%0.789SS**  -175.7137.6110.3-99.6-13.9000114.8N456N456-N458 PolarHBondContact OD1-N 3.49Å
459V44.5Very low41.1Very low122 Ų122138.2 Ų138.274%0.73979%0.792SS**  trans-137.3154.3158.2-143.30000105.4
460P52.1Low40.9Very low113 Ų113140.9 Ų140.973%0.73479%0.793SS**  -149.817190.836-16.8000116
461R43.3Very low41.3Very low230 Ų230142.9 Ų142.987%0.86880%0.797SS**  trans-76.8166.3166.4-65.6171.5164.4135-9111.5
462H36.9Very low41.7Very low179 Ų179141.9 Ų141.983%0.82980%0.796SS**  trans-131.9162.5152.4-95-94.2000111.8
463P50.7Low42.1Very low112 Ų112143.8 Ų143.873%0.72780%0.799SS**  trans-129.6-178.1-15244-29.6000117.4
464N36.1Very low42.5Very low136 Ų136145.7 Ų145.773%0.72780%0.796SS**  trans-2.2141158.8-89.617.2000121.4
465T37.6Very low42.9Very low141 Ų141149.8 Ų149.887%0.86581%0.812SS**  trans-145.5149.5137.9-57.80000110.5
466H39.9Very low42.8Very low159 Ų159151 Ų15174%0.73681%0.812SS**  trans-99.7155176.7-65-124.5000112.6
467V48.5Very low43.2Very low143 Ų143152.4 Ų152.487%0.86782%0.82SS**  trans-143.1151.2149-76.70000110.8
468P47.6Very low42.5Very low119 Ų119154.9 Ų154.977%0.77383%0.827SS**  trans-109.8171.1-167.240.9-34.1000115.8
469S38Very low43.2Very low122 Ų122155.4 Ų155.485%0.85383%0.829SS**  trans-64.3147.3175.4-39.40000113.7
470H44Very low43.1Very low185 Ų185157.5 Ų157.586%0.85684%0.835SS**  trans-114.1124.5165.646.7-92.5000110.8
471L42.8Very low42.5Very low185 Ų185160.5 Ų160.597%0.96984%0.842SS**  trans-88.8136.1166.1-94.7160.8000108.9
472G42.8Very low42.5Very low77 Ų77155.5 Ų155.579%0.79484%0.84SS**  trans-142.8101175.700000110.3
473S42.1Very low42.9Very low109 Ų109153.7 Ų153.776%0.76284%0.841SS**  trans-101133.5166.6177.30000108.1
474Y41Very low42.2Very low214 Ų214157.2 Ų157.284%0.83985%0.85SS**  trans-177.1131.3144.6-97.7-60.3000110.4
475Y46.3Very low42.8Very low296 Ų296159.1 Ų159.1100%1.16186%0.861SS**  trans67.20178.4-69.6-81.5000117.5

Retrieved 475 of 475 residues in 137.5 ms (Link to these results)