A0A061IQ70_CRIGR Loading...

Vang-like protein

AlphaFold DB , UniProt , Accession A0A061IQ70, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Vangl1, Length 526 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
1M38.7Very low34.3Very low236 Ų236150.2 Ų150.2100%1.16382%0.82SS**  0970-97.5-170169.800105.7
2D36.9Very low33.8Very low147 Ų147152.2 Ų152.279%0.78681%0.809SS**  trans-102148.2-160.5-48.3-93.6000107.9
3T41.5Very low33.3Very low151 Ų151156.8 Ų156.893%0.92681%0.811SS**  trans-142.1129.9153.531.70000108.6
4E38.3Very low33Very low173 Ų173152.9 Ų152.981%0.80880%0.803SS**  trans-95.4156.2-163.5-61.2169102.100113.4
5S37.7Very low32.5Very low108 Ų108148.5 Ų148.576%0.75579%0.79SS**  trans69.1144.9144.279.30000118
6T32.5Very low32.3Very low133 Ų133150.6 Ų150.682%0.81679%0.794SS**  -157.914378.5-60.70000111.5
7Y33.3Very low32.1Very low217 Ų217147 Ų14785%0.85178%0.784SS**  trans-80139.9175.8173-85.1000111.8
8S33.3Very low32Very low118 Ų118149.8 Ų149.883%0.82579%0.788SS**  trans-149.1130159.557.40000113.4
9G28.2Very low31.9Very low50 Ų50151.7 Ų151.752%0.51579%0.789SS.*  trans-126.7-176.2162.100000109.8
10Y29.2Very low31.9Very low214 Ų214150.3 Ų150.384%0.83979%0.793SS**  trans68.1147.8-167.4-83.9-102.7000114.1Y12Y10-Y12 HydrophobicContact CD1-CD2 4.25Å; Y10-Y12 AromaticContact CE1-CD2 3.99Å; Y10-Y12 HydrophobicContact CE1-CD2 3.99Å; Y10-Y12 HydrophobicContact CE1-CE2 4.34Å
11S28.1Very low31.9Very low105 Ų105150.1 Ų150.173%0.73479%0.787SS**  cis-146.7146.411.140.70000109.5
12Y27.5Very low31.5Very low174 Ų174151 Ų15168%0.68278%0.777SS**  77.7125.268.3-108.7-63.2000117.2Y10Y10-Y12 HydrophobicContact CD1-CD2 4.25Å; Y10-Y12 AromaticContact CE1-CD2 3.99Å; Y10-Y12 HydrophobicContact CE1-CD2 3.99Å; Y10-Y12 HydrophobicContact CE1-CE2 4.34Å
13Y28.2Very low31.3Very low213 Ų213151.3 Ų151.384%0.83577%0.774SS**  trans64.8149.9171.7-77-79.6000116.9
14S28.3Very low30.7Very low101 Ų101148 Ų14871%0.70677%0.769SS**  cis-160.4177.4-3.4100.20000107.9
15S26.6Very low30.4Very low87 Ų87147 Ų14761%0.60877%0.765SS**  cis-176.3172.9-22.6550000109
16H28.9Very low30Very low183 Ų183152.4 Ų152.485%0.84777%0.769SS**  trans64.1152.9173.2-77.2-85.5000117.4
17S28.9Very low29.9Very low89 Ų89152.5 Ų152.562%0.62277%0.769SS**  cis-158.3167.6-8.852.70000107
18K29.8Very low30.1Very low198 Ų198153.7 Ų153.786%0.86177%0.772SS**  cis-156.6141.945.5-67.7176176.7171.80111.9
19K30.5Very low30Very low186 Ų186155.7 Ų155.781%0.80977%0.769SS**PPolyproline II helixtrans-81.3147.8155.3-80.1177171177.70109.3
20S32.6Very low30.5Very low123 Ų123164.8 Ų164.886%0.8679%0.787SS**PPolyproline II helixtrans-100116.7156.647.60000109.7
21H30.9Very low30.7Very low146 Ų146161.9 Ų161.968%0.67678%0.781SS**PPolyproline II helixtrans-87.9138.4167.1-108.3-97.7000109
22R31.1Very low31Very low255 Ų255166.9 Ų166.996%0.96279%0.79SS**  trans-126126145.5-103.6-175.4172.6178.2-1.9107.8
23Q31.5Very low31.1Very low154 Ų154164 Ų16472%0.7280%0.795SS**  trans-119.5134.1-174.9-174.4174.9-0.500107.6
24G29.5Very low31.5Very low80 Ų80160 Ų16083%0.82580%0.795SS**  trans-150.9100.317600000108
25E31.4Very low31.6Very low152 Ų152165.6 Ų165.671%0.7180%0.801SS**  trans-86.9172179.4-75.2-169127.100112.5
26R30.6Very low31.8Very low222 Ų222167.2 Ų167.284%0.83881%0.812SS**  trans82.6135.4168.2-50-179.8-177.7-177.1-0.5113.3
27T29.3Very low32Very low135 Ų135166.6 Ų166.683%0.82881%0.807SS**  cis-152.5165.64.2-10.20000111
28R38.5Very low32.1Very low242 Ų242170.5 Ų170.591%0.91382%0.821SS**  trans-57.1138.2167.8-73.3170.4164155.8-6110.8
29E29.9Very low32.2Very low160 Ų160163.9 Ų163.975%0.74881%0.809SS**  trans-152.4139.8137.8-127.9172.4-137.600113.2H31E29-H31 IonicContact OE2-CD2 3.6Å; E29-H31 IonicContact OE2-CE1 3.71Å; E29-H31 IonicContact OE2-NE2 3.33Å; E29-H31 PolarHBondContact OE2-NE2 3.39Å
30R39.4Very low32.2Very low241 Ų241167.5 Ų167.591%0.90982%0.818SS**  trans-86.6121.1169.7-84.2174162.2175.9-4.6107.5
31H34.3Very low32.1Very low154 Ų154165.4 Ų165.471%0.71382%0.816SS**  trans-119.5112.8160.9-79.7-63.9000112E29E29-H31 IonicContact OE2-CD2 3.6Å; E29-H31 IonicContact OE2-CE1 3.71Å; E29-H31 IonicContact OE2-NE2 3.33Å; E29-H31 PolarHBondContact OE2-NE2 3.39Å
32K33Very low32.2Very low210 Ų210163.8 Ų163.891%0.91382%0.821SS**  trans-70139.9158.8-71170.3170.7174.80107.6
33S30.5Very low32.3Very low113 Ų113160.8 Ų160.879%0.7982%0.818SS**  trans-110.6152.415657.10000109.8
34P36Very low32.4Very low128 Ų128162.4 Ų162.483%0.83182%0.823SS**  trans-94.2156.5-149.735.1-36.1000115.2
35R30.1Very low32.5Very low219 Ų219164.3 Ų164.383%0.82682%0.823SS**  trans-75.7113.6172.6-174.3-173.9-162171.45.5109.5
36S31.6Very low32.4Very low122 Ų122162.1 Ų162.185%0.85382%0.82SS**  trans-73.3137157.952.70000108.8
37K31.8Very low32.5Very low169 Ų169158.3 Ų158.374%0.73582%0.821SS**  trans-147.388.5-177-172.4-160.6176.8-169.10110.5
38D32.8Very low32.5Very low171 Ų171158.9 Ų158.991%0.91482%0.818SS**  trans-127140.2152.4-68.1-56.7000106.2
39G30.6Very low32.2Very low60 Ų60156.1 Ų156.162%0.61982%0.815SS**  cis156.3122.4-1.600000108.8
40R31.6Very low32.1Very low261 Ų261152.9 Ų152.999%0.98582%0.816SS**  trans73137.3-172-46.2169.4-178-135.9-1.9113.8
41G30.6Very low31.8Very low80 Ų80147.2 Ų147.283%0.82581%0.81SS**  cis139.6104.2-9.200000113
42S31.8Very low32Very low112 Ų112147 Ų14778%0.78382%0.82SS**  trans-174118.8145.6-1730000109.2
43E34.3Very low31.7Very low191 Ų191140.4 Ų140.489%0.89381%0.812SS**  trans-76.5136.5163-63.5169153.400108.7
44K33.3Very low32Very low189 Ų189144.3 Ų144.382%0.82282%0.817SS**  trans-164.789.4155.2-111.3166.5-171.4-177.70110V46K44-V46 PolarHBondContact O-N 3.16Å
45S31.8Very low31.8Very low119 Ų119143.8 Ų143.883%0.83281%0.814SS**  trans-68.1121.1162.250.50000109.2
46V27.8Very low31.7Very low107 Ų107140.8 Ų140.865%0.64881%0.813SS**  trans-127.9106.3167.7-173.20000108.3K44 I48K44-V46 PolarHBondContact O-N 3.16Å; V46-I48 HydrophobicContact CG1-CD1 4.29Å; V46-I48 HydrophobicContact CG1-CG1 3.75Å; V46-I48 PolarHBondContact O-N 3.39Å
47T33.5Very low31.9Very low141 Ų141142.7 Ų142.787%0.86581%0.813SS**  trans-75.3110.3168.1-50.80000107.7
48I29.8Very low31.6Very low148 Ų148139.4 Ų139.476%0.75982%0.818SS**PPolyproline II helixtrans-101.3116.2172.7-57.6-175.9000108.5V46V46-I48 HydrophobicContact CG1-CD1 4.29Å; V46-I48 HydrophobicContact CG1-CG1 3.75Å; V46-I48 PolarHBondContact O-N 3.39Å
49Q30.7Very low31.4Very low184 Ų184138.6 Ų138.686%0.8681%0.813SS**PPolyproline II helixtrans-79118.2175.3-160166.37.100108
50A29.2Very low31.2Very low91 Ų91143.4 Ų143.475%0.75283%0.825SS**PPolyproline II helixtrans-77.5132.3179.900000110.6
51P31.8Very low31.1Very low123 Ų123136.6 Ų136.680%0.79982%0.817SS**PPolyproline II helixtrans-76.7154.9173.532.6-34.5000111.5
52T38.6Very low30.9Very low150 Ų150136.7 Ų136.792%0.9281%0.81SS**PPolyproline II helixtrans-62.5130.4168.741.40000111.6
53G28.4Very low30.8Very low71 Ų71137.5 Ų137.573%0.73281%0.813SS**  trans-155.4118.7169.100000110.7
54E34.9Very low30.6Very low194 Ų194135.3 Ų135.391%0.90781%0.813SS**  trans-66.8153.5165.3-61.7-178.7137.600110.2
55P32.2Very low30.4Very low117 Ų117129.4 Ų129.476%0.7681%0.805SS**  -140.2121.4127.831.9-16.8000114.1
56L27.9Very low30.4Very low156 Ų156128.1 Ų128.182%0.81780%0.802SS**  27.5115.7127.6-63.7170.2000119.4
57L35.6Very low30.7Very low163 Ų163131.2 Ų131.285%0.85381%0.809SS**  trans34.3106.2136-64.7172.8000118.8
58A25.7Very low30.5Very low100 Ų100133.5 Ų133.583%0.82681%0.81SS**  trans-133.4118.6146.200000109
59N29.1Very low30.9Very low154 Ų154131.7 Ų131.782%0.82481%0.806SS**  trans-70.4131.1166-90-9.3000108.7
60D26.5Very low31.4Very low160 Ų160129.7 Ų129.786%0.85680%0.796SS**  -162.5151122.9-103.4-24.5000111.7A62D60-A62 PolarHBondContact O-N 2.98Å
61S30.3Very low32.2Very low119 Ų119131.4 Ų131.483%0.83279%0.793SS**  trans-59117.3-164.154.50000115.5
62A25.7Very low33.3Very low81 Ų81127.4 Ų127.467%0.66977%0.765SS**  trans-104.4140151.900000108.7D60 T64D60-A62 PolarHBondContact O-N 2.98Å; A62-T64 PolarHBondContact O-N 3.49Å
63P30.4Very low34.2Very low130 Ų130122.6 Ų122.684%0.84473%0.734SS**  trans-69.5124.7-179.228-33.2000110.3G65P63-G65 PolarHBondContact O-N 3.39Å
64T29.4Very low35.9Very low145 Ų145126.9 Ų126.989%0.8973%0.728SS**  trans-67.878.9175.8-41.10000110.4A62 A66A62-T64 PolarHBondContact O-N 3.49Å; T64-A66 PolarHBondContact O-N 3.46Å
65G29.8Very low36.9Very low65 Ų65118.8 Ų118.867%0.6770%0.697SS**  trans-69.8105162.100000108.1P63 E67P63-G65 PolarHBondContact O-N 3.39Å; G65-E67 PolarHBondContact O-N 2.99Å
66A30.2Very low37.7Very low91 Ų91117.8 Ų117.875%0.75268%0.682SS**  trans-61.2104.9170.700000108.7T64 E68T64-A66 PolarHBondContact O-N 3.46Å; A66-E68 PolarHBondContact O-N 2.98Å; A66-E68 VanDerWaalsContact O-N 3.14Å
67E35.5Very low38.6Very low172 Ų172117 Ų11780%0.80468%0.684SS**  trans-71.5101.1161.6-70.4-168.1144.500106.9G65 V69G65-E67 PolarHBondContact O-N 2.99Å; E67-V69 HydrophobicContact CB-CG2 3.85Å; E67-V69 PolarHBondContact O-N 3.1Å
68E29.8Very low38.8Very low189 Ų189115.2 Ų115.288%0.88368%0.679SS**  trans-63.684.4158.4-71.5-175.5147.600107.8A66 Q70A66-E68 PolarHBondContact O-N 2.98Å; A66-E68 VanDerWaalsContact O-N 3.14Å; E68-Q70 PolarHBondContact O-N 3.41Å
69V38.1Very low39.4Very low111 Ų111117 Ų11767%0.67368%0.68SS**  trans-74.781.5174.6-176.20000108E67 D71E67-V69 HydrophobicContact CB-CG2 3.85Å; E67-V69 PolarHBondContact O-N 3.1Å; V69-D71 PolarHBondContact O-N 2.89Å; V69-D71 VanDerWaalsContact O-N 3.13Å
70Q40.3Very low39.7Very low141 Ų141114.2 Ų114.266%0.65968%0.679SS**  trans-66.1108.2166.7-171.6170-17.100108.4E68 D72E68-Q70 PolarHBondContact O-N 3.41Å; Q70-D72 PolarHBondContact NE2-OD2 3.45Å; Q70-D72 PolarHBondContact O-N 3.05Å
71D45.7Very low40.2Very low127 Ų127114.6 Ų114.668%0.67968%0.679SS**  trans-78.564-172.2-166.317.8000112.6V69 N73V69-D71 PolarHBondContact O-N 2.89Å; V69-D71 VanDerWaalsContact O-N 3.13Å; D71-N73 PolarHBondContact O-N 3.26Å
72D54.3Low40.4Very low40 Ų40115.5 Ų115.521%0.21468%0.68CS.*  trans-77.360.3176.1-79.9-48.5000111.4Q70 W74 Q408Q70-D72 PolarHBondContact NE2-OD2 3.45Å; Q70-D72 PolarHBondContact O-N 3.05Å; D72-W74 VanDerWaalsContact C-CD1 3.49Å; D72-W74 VanDerWaalsContact C-N 3.35Å; D72-W74 PolarHBondContact O-N 3.2Å; D72-W74 PolarHBondContact OD1-NE1 3.47Å; D72-Q408 PolarHBondContact O-NE2 3.08Å
73N59.2Low41.3Very low49 Ų49115 Ų11526%0.26268%0.683SS.*  trans-93.236.6-177-148.610.4000115.6D71 G75 E76 Q408 R412D71-N73 PolarHBondContact O-N 3.26Å; N73-G75 PolarHBondContact O-N 2.95Å; N73-E76 PolarHBondContact ND2-OE2 2.85Å; N73-E76 PolarHBondContact O-N 2.89Å; N73-E76 WeakPolarHBondContact OD1-CB 3.37Å; N73-E76 WeakPolarHBondContact OD1-CG 3.48Å; N73-E76 PolarHBondContact OD1-OE2 2.83Å; N73-Q408 PolarHBondContact OD1-NE2 2.65Å; N73-R412 PolarHBondContact OD1-NH2 3.23Å
74W63.3Low41.2Very low160 Ų160115.2 Ų115.261%0.60668%0.682SS**THydrogen-bonded Turntrans-60.111.5-178.5-48.493.6000117D72 M422D72-W74 VanDerWaalsContact C-CD1 3.49Å; D72-W74 VanDerWaalsContact C-N 3.35Å; D72-W74 PolarHBondContact O-N 3.2Å; D72-W74 PolarHBondContact OD1-NE1 3.47Å; W74-M422 HydrophobicContact CB-SD 3.84Å; W74-M422 HydrophobicContact CD2-CB 4.17Å; W74-M422 HydrophobicContact CD2-SD 3.54Å; W74-M422 VanDerWaalsContact CD2-SD 3.54Å; W74-M422 HydrophobicContact CE3-SD 3.38Å; W74-M422 HydrophobicContact CG-CB 4.18Å; W74-M422 HydrophobicContact CG-SD 3.75Å; W74-M422 HydrophobicContact CZ3-SD 4.14Å
75G56.8Low41.9Very low25 Ų25113.9 Ų113.926%0.25868%0.678SS.*THydrogen-bonded Turntrans-140.88.6-174.900000115.4N73N73-G75 PolarHBondContact O-N 2.95Å
76E47.9Very low42Very low96 Ų96119.1 Ų119.145%0.44969%0.685SS.*SBendtrans-129.4112.2176.5-63.9173.5-176.700108.7N73 R412N73-E76 PolarHBondContact ND2-OE2 2.85Å; N73-E76 PolarHBondContact O-N 2.89Å; N73-E76 WeakPolarHBondContact OD1-CB 3.37Å; N73-E76 WeakPolarHBondContact OD1-CG 3.48Å; N73-E76 PolarHBondContact OD1-OE2 2.83Å; E76-R412 IonicContact OE1-CZ 3.76Å; E76-R412 IonicContact OE1-NH1 2.69Å; E76-R412 PolarHBondContact OE1-NH1 3.43Å; E76-R412 IonicContact OE2-NH1 3.22Å
77T47.1Very low42.2Very low139 Ų139124.4 Ų124.485%0.85369%0.694SS**  trans-74.6134.1178.237.10000111.4
78T40.4Very low42.2Very low125 Ų125121.4 Ų121.477%0.76769%0.692SS**  trans83.394.5162.3-43.30000117.4
79T38.8Very low42.8Very low137 Ų137118.7 Ų118.784%0.8468%0.682SS**  -167.7141.1111.528.40000112.7
80A34.8Very low42.9Very low96 Ų96115.5 Ų115.579%0.79367%0.665SS**  trans29.1117159.100000121.1
81I36.6Very low43Very low169 Ų169117 Ų11787%0.86767%0.672SS**  trans-81125.6162.4-62.7164.9000109.5
82T33.5Very low43.3Very low137 Ų137117.7 Ų117.784%0.8467%0.671SS**  trans-133.7110.515537.30000108.5
83G44.9Very low43.1Very low71 Ų71118.9 Ų118.973%0.73268%0.678SS**  trans-87.8134.8175.700000111.7
84T29.6Very low42.9Very low135 Ų135121.3 Ų121.383%0.82869%0.69SS**  trans-139.3134.4156.444.40000107.9
85S44.2Very low42.3Very low117 Ų117116.7 Ų116.782%0.81869%0.685SS**  trans-106.7118.5-176.854.50000110.6
86E31.1Very low42.2Very low175 Ų175122.9 Ų122.982%0.81870%0.701SS**  trans-136.3102.3172-66.7-167.2-173.900111.2
87H33.5Very low42.4Very low201 Ų201122.2 Ų122.293%0.93170%0.699SS**  trans-82.8112.5158.1-94.2-40.8000108.1
88S36.1Very low42.6Very low109 Ų109118.4 Ų118.476%0.76268%0.678SS**  trans-121.7102.9166.552.90000110
89I42.6Very low43.1Very low132 Ų132119.3 Ų119.368%0.67767%0.672SS**  trans-83.5128.1167.1-64.9175000107I94I89-I94 HydrophobicContact CG2-CG1 4.27Å
90S40.5Very low43.6Very low44 Ų44116.1 Ų116.131%0.30865%0.65SS.*  trans-70.6146.6-175.787.60000111.8E92 D93 I94S90-E92 PolarHBondContact O-N 3.28Å; S90-E92 PolarHBondContact OG-N 3.07Å; S90-D93 PolarHBondContact O-N 3.4Å; S90-D93 PolarHBondContact OG-N 3.45Å; S90-D93 PolarHBondContact OG-OD2 3.39Å; S90-I94 PolarHBondContact O-N 3.32Å
91Q42.5Very low44.2Very low173 Ų173117.1 Ų117.181%0.80864%0.639SS**Hα-helixtrans-64-21.5176.5-167.8174.40.700112.2A95Q91-A95 PolarHBondContact O-N 2.92Å
92E51.5Low44.6Very low141 Ų141116.1 Ų116.166%0.65963%0.631SS**Hα-helixtrans-75.7-32.2178.8-67.9160.3-17200112.1S90 R96S90-E92 PolarHBondContact O-N 3.28Å; S90-E92 PolarHBondContact OG-N 3.07Å; E92-R96 WeakPolarHBondContact O-CG 3.33Å; E92-R96 PolarHBondContact O-N 3.29Å
93D49.6Very low45.5Very low66 Ų66114.9 Ų114.935%0.35362%0.619SS.*Hα-helixtrans-72.2-39.5173.7-62.4-48.5000111.2S90 A95 R96 I97S90-D93 PolarHBondContact O-N 3.4Å; S90-D93 PolarHBondContact OG-N 3.45Å; S90-D93 PolarHBondContact OG-OD2 3.39Å; D93-A95 VanDerWaalsContact C-N 3.31Å; D93-A95 PolarHBondContact O-N 3.45Å; D93-R96 PolarHBondContact O-N 3.27Å; D93-R96 IonicContact OD1-NH1 3.36Å; D93-R96 PolarHBondContact OD1-NH1 3.45Å; D93-I97 WeakPolarHBondContact O-CD1 3.44Å; D93-I97 VanDerWaalsContact O-CG1 3.23Å; D93-I97 WeakPolarHBondContact O-CG1 3.27Å; D93-I97 PolarHBondContact O-N 3.3Å
94I54.7Low45.9Very low100 Ų100114.3 Ų114.351%0.51360%0.604SS.*Hα-helixtrans-61-41.1174.4-59.7173.8000110.8I89 S90 R96 I97 S98I89-I94 HydrophobicContact CG2-CG1 4.27Å; S90-I94 PolarHBondContact O-N 3.32Å; I94-R96 PolarHBondContact O-N 3.47Å; I94-I97 PolarHBondContact O-N 2.89Å; I94-S98 PolarHBondContact O-N 3.35Å
95A51.8Low46.8Very low63 Ų63113.1 Ų113.152%0.52160%0.596SS.*Hα-helixtrans-66.8-33.2177.400000113.3Q91 D93 K99Q91-A95 PolarHBondContact O-N 2.92Å; D93-A95 VanDerWaalsContact C-N 3.31Å; D93-A95 PolarHBondContact O-N 3.45Å; A95-K99 PolarHBondContact O-N 2.93Å
96R54.3Low46.7Very low155 Ų155110 Ų11059%0.58558%0.583SS**Hα-helixtrans-69.2-49.3171.7-72175.5-177.5138.42.8111.3E92 D93 I94 S98 K99 D100E92-R96 WeakPolarHBondContact O-CG 3.33Å; E92-R96 PolarHBondContact O-N 3.29Å; D93-R96 PolarHBondContact O-N 3.27Å; D93-R96 IonicContact OD1-NH1 3.36Å; D93-R96 PolarHBondContact OD1-NH1 3.45Å; I94-R96 PolarHBondContact O-N 3.47Å; R96-S98 VanDerWaalsContact C-N 3.3Å; R96-S98 PolarHBondContact O-N 3.01Å; R96-K99 PolarHBondContact O-N 3.33Å; R96-D100 PolarHBondContact O-N 2.94Å
97I53.1Low47.6Very low81 Ų81107 Ų10742%0.41557%0.572SS.*Hα-helixtrans-56-43.8178.9-68.5162.7000111.3D93 I94 K99 M101 W460D93-I97 WeakPolarHBondContact O-CD1 3.44Å; D93-I97 VanDerWaalsContact O-CG1 3.23Å; D93-I97 WeakPolarHBondContact O-CG1 3.27Å; D93-I97 PolarHBondContact O-N 3.3Å; I94-I97 PolarHBondContact O-N 2.89Å; I97-K99 VanDerWaalsContact C-N 3.29Å; I97-K99 PolarHBondContact O-N 3.42Å; I97-M101 WeakPolarHBondContact O-CB 3.38Å; I97-M101 PolarHBondContact O-N 3.05Å; I97-M101 VanDerWaalsContact O-N 3.09Å; I97-W460 HydrophobicContact CG1-CH2 4.33Å
98S49.9Very low48.5Very low59 Ų59100.4 Ų100.441%0.41354%0.543SS..Hα-helixtrans-62.5-35.9177.3-167.90000112.7I94 R96 E102I94-S98 PolarHBondContact O-N 3.35Å; R96-S98 VanDerWaalsContact C-N 3.3Å; R96-S98 PolarHBondContact O-N 3.01Å; S98-E102 PolarHBondContact O-N 3.35Å
99K50.8Low49.3Very low145 Ų145100.1 Ų100.163%0.6354%0.54SS*.Hα-helixtrans-76.4-40-177.6-174.3163.8-176.8156.70112.5A95 R96 I97 M101 E102 D103A95-K99 PolarHBondContact O-N 2.93Å; R96-K99 PolarHBondContact O-N 3.33Å; I97-K99 VanDerWaalsContact C-N 3.29Å; I97-K99 PolarHBondContact O-N 3.42Å; K99-M101 PolarHBondContact O-N 3.46Å; K99-E102 PolarHBondContact O-N 3.03Å; K99-D103 PolarHBondContact O-N 3.45Å
100D50.9Low50Low69 Ų69101.7 Ų101.737%0.36954%0.542SS..Hα-helixtrans-67.6-26.1173.6-70.1-47000112R96 S104R96-D100 PolarHBondContact O-N 2.94Å; D100-S104 WeakPolarHBondContact O-CB 3.5Å; D100-S104 PolarHBondContact O-N 3.06Å; D100-S104 PolarHBondContact O-OG 2.95Å
101M46.9Very low51Low117 Ų117105.4 Ų105.458%0.57655%0.549SS*.Hα-helixtrans-73.8-33.2174.5-169.2159.558.900113.4I97 K99 S104 V105I97-M101 WeakPolarHBondContact O-CB 3.38Å; I97-M101 PolarHBondContact O-N 3.05Å; I97-M101 VanDerWaalsContact O-N 3.09Å; K99-M101 PolarHBondContact O-N 3.46Å; M101-S104 WeakPolarHBondContact CA-OG 3.39Å; M101-S104 PolarHBondContact O-OG 3.32Å; M101-S104 VanDerWaalsContact O-OG 3.08Å; M101-V105 WeakPolarHBondContact O-CG2 3.34Å
102E45.2Very low52.1Low148 Ų148103.7 Ų103.769%0.69254%0.537SS*.Hα-helixtrans-71.7-41.1174-71.2-174.913600112.2S98 K99 S104S98-E102 PolarHBondContact O-N 3.35Å; K99-E102 PolarHBondContact O-N 3.03Å; E102-S104 VanDerWaalsContact C-N 3.31Å; E102-S104 PolarHBondContact O-N 3.17Å
103D52.4Low53Low112 Ų112102 Ų10260%0.59953%0.532SS*.Hα-helixtrans-66.9-29.1178.4-91.3-17.4000113K99K99-D103 PolarHBondContact O-N 3.45Å
104S52.5Low54.1Low58 Ų58100.8 Ų100.841%0.40653%0.534SS..Hα-helixtrans-75.9-39.9-179.740.60000113.1D100 M101 E102 G106 L107D100-S104 WeakPolarHBondContact O-CB 3.5Å; D100-S104 PolarHBondContact O-N 3.06Å; D100-S104 PolarHBondContact O-OG 2.95Å; M101-S104 WeakPolarHBondContact CA-OG 3.39Å; M101-S104 PolarHBondContact O-OG 3.32Å; M101-S104 VanDerWaalsContact O-OG 3.08Å; E102-S104 VanDerWaalsContact C-N 3.31Å; E102-S104 PolarHBondContact O-N 3.17Å; S104-G106 VanDerWaalsContact C-N 3.27Å; S104-G106 PolarHBondContact O-N 3.04Å; S104-L107 PolarHBondContact O-N 2.76Å; S104-L107 VanDerWaalsContact O-N 3.17Å
105V48.3Very low55.1Low110 Ų110101 Ų10167%0.66754%0.536SS*.Hα-helixtrans-63.2-32.8177.9176.50000112M101 L107M101-V105 WeakPolarHBondContact O-CG2 3.34Å; V105-L107 VanDerWaalsContact C-N 3.3Å; V105-L107 PolarHBondContact O-N 2.84Å
106G43.4Very low56.4Low53 Ų53101.7 Ų101.755%0.54653%0.534SS..Hα-helixtrans-70.7-18.1177.300000115.4S104S104-G106 VanDerWaalsContact C-N 3.27Å; S104-G106 PolarHBondContact O-N 3.04Å
107L49.6Very low57.7Low112 Ų11298.1 Ų98.159%0.58653%0.529SS*.Hα-helixtrans-93.3-33.2-175.2-72.7168.8000113.4S104 V105 C109 K110 R111S104-L107 PolarHBondContact O-N 2.76Å; S104-L107 VanDerWaalsContact O-N 3.17Å; V105-L107 VanDerWaalsContact C-N 3.3Å; V105-L107 PolarHBondContact O-N 2.84Å; L107-C109 PolarHBondContact O-N 3.17Å; L107-K110 PolarHBondContact O-N 3.39Å; L107-R111 PolarHBondContact O-N 3.03Å
108D51.5Low59.1Low61 Ų6195.2 Ų95.233%0.32652%0.517SS..Hα-helixtrans-66.2-33.2-175-89.4-35.3000113.4K110 R111 Y112D108-K110 VanDerWaalsContact C-N 3.29Å; D108-K110 PolarHBondContact O-N 3.3Å; D108-R111 VanDerWaalsContact O-CB 3.31Å; D108-R111 WeakPolarHBondContact O-CB 3.34Å; D108-R111 PolarHBondContact O-N 3.28Å; D108-R111 WeakPolarHBondContact OD1-CD 3.23Å; D108-R111 IonicContact OD1-CZ 2.68Å; D108-R111 IonicContact OD1-NE 3.32Å; D108-R111 IonicContact OD1-NH1 3.26Å; D108-R111 PolarHBondContact OD1-NH1 3.38Å; D108-Y112 HydrophobicContact CB-CD2 4.45Å; D108-Y112 HydrophobicContact CB-CE2 4.2Å; D108-Y112 WeakPolarHBondContact O-CD2 3.48Å; D108-Y112 PolarHBondContact O-N 3.49Å
109C53.1Low60.7Low103 Ų10394.5 Ų94.570%0.69652%0.515SS*.Hα-helixtrans-59.9-38.3177.4-170.20000112.4L107 L113L107-C109 PolarHBondContact O-N 3.17Å; C109-L113 PolarHBondContact O-N 3.49Å
110K58Low62.4Low165 Ų16594 Ų9472%0.71751%0.512SS*.Hα-helixtrans-72.7-29.7174.8-71177179.4168.90112.8L107 D108L107-K110 PolarHBondContact O-N 3.39Å; D108-K110 VanDerWaalsContact C-N 3.29Å; D108-K110 PolarHBondContact O-N 3.3Å
111R61.1Low64.2Low122 Ų12291.3 Ų91.346%0.4650%0.498SS..Hα-helixtrans-68.7-46.7177.8-175.5-172.4178.3-157.6-0.8111.4L107 D108 L113 G114 D180L107-R111 PolarHBondContact O-N 3.03Å; D108-R111 VanDerWaalsContact O-CB 3.31Å; D108-R111 WeakPolarHBondContact O-CB 3.34Å; D108-R111 PolarHBondContact O-N 3.28Å; D108-R111 WeakPolarHBondContact OD1-CD 3.23Å; D108-R111 IonicContact OD1-CZ 2.68Å; D108-R111 IonicContact OD1-NE 3.32Å; D108-R111 IonicContact OD1-NH1 3.26Å; D108-R111 PolarHBondContact OD1-NH1 3.38Å; R111-L113 PolarHBondContact O-N 3.29Å; R111-G114 PolarHBondContact O-N 3.08Å; R111-D180 IonicContact CZ-OD1 2.85Å; R111-D180 IonicContact CZ-OD2 3.05Å; R111-D180 IonicContact NE-OD1 3.34Å; R111-D180 PolarHBondContact NE-OD1 3.28Å; R111-D180 IonicContact NE-OD2 2.66Å; R111-D180 IonicContact NH2-OD1 2.69Å; R111-D180 PolarHBondContact NH2-OD1 3.35Å; R111-D180 IonicContact NH2-OD2 3.77Å; R111-D180 PolarHBondContact NH2-OD2 2.89Å
112Y65.8Low66.1Low137 Ų13787.4 Ų87.454%0.53749%0.488SS..Hα-helixtrans-64.3-38.3174.9-72.3-70000112.3D108 G114 L115 T116D108-Y112 HydrophobicContact CB-CD2 4.45Å; D108-Y112 HydrophobicContact CB-CE2 4.2Å; D108-Y112 WeakPolarHBondContact O-CD2 3.48Å; D108-Y112 PolarHBondContact O-N 3.49Å; Y112-G114 VanDerWaalsContact C-N 3.31Å; Y112-G114 PolarHBondContact O-N 2.83Å; Y112-L115 PolarHBondContact O-N 2.95Å; Y112-L115 VanDerWaalsContact O-N 3.09Å; Y112-T116 WeakPolarHBondContact O-CG2 3.41Å; Y112-T116 PolarHBondContact O-N 2.95Å; Y112-T116 PolarHBondContact O-OG1 3.29Å
113L70.8Confident68.2Low107 Ų10785.1 Ų85.156%0.5648%0.48SS*.Hα-helixtrans-55.6-41.8179.1-174.267.3000113.3C109 R111 T116 V117C109-L113 PolarHBondContact O-N 3.49Å; R111-L113 PolarHBondContact O-N 3.29Å; L113-T116 WeakPolarHBondContact CA-OG1 3.37Å; L113-T116 PolarHBondContact O-OG1 2.99Å; L113-T116 VanDerWaalsContact O-OG1 3.14Å; L113-V117 HydrophobicContact CD1-CG2 4.38Å; L113-V117 WeakPolarHBondContact O-CB 3.3Å; L113-V117 VanDerWaalsContact O-CG2 3.25Å; L113-V117 WeakPolarHBondContact O-CG2 3.47Å; L113-V117 PolarHBondContact O-N 3.1Å; L113-V117 VanDerWaalsContact O-N 3.08Å
114G72.8Confident70Confident39 Ų3982.4 Ų82.440%0.40247%0.465SS..Hα-helixtrans-66-38.6177.400000113R111 Y112 A118R111-G114 PolarHBondContact O-N 3.08Å; Y112-G114 VanDerWaalsContact C-N 3.31Å; Y112-G114 PolarHBondContact O-N 2.83Å; G114-A118 WeakPolarHBondContact O-CB 3.46Å; G114-A118 PolarHBondContact O-N 3.14Å
115L75.4Confident71.8Confident105 Ų10580.1 Ų80.155%0.5545%0.449SS..Hα-helixtrans-72.5-42.3178.3-177.462.8000111.9Y112 A118 A119Y112-L115 PolarHBondContact O-N 2.95Å; Y112-L115 VanDerWaalsContact O-N 3.09Å; L115-A118 PolarHBondContact O-N 2.85Å; L115-A119 VanDerWaalsContact O-CB 3.28Å; L115-A119 WeakPolarHBondContact O-CB 3.37Å; L115-A119 PolarHBondContact O-N 3.42Å
116T79.2Confident73.9Confident78 Ų7878.1 Ų78.148%0.47943%0.431SS..Hα-helixtrans-67.2-40.9179.255.10000111.8Y112 L113 A119 F120Y112-T116 WeakPolarHBondContact O-CG2 3.41Å; Y112-T116 PolarHBondContact O-N 2.95Å; Y112-T116 PolarHBondContact O-OG1 3.29Å; L113-T116 WeakPolarHBondContact CA-OG1 3.37Å; L113-T116 PolarHBondContact O-OG1 2.99Å; L113-T116 VanDerWaalsContact O-OG1 3.14Å; T116-A119 PolarHBondContact O-N 3.32Å; T116-F120 VanDerWaalsContact O-CB 3.23Å; T116-F120 WeakPolarHBondContact O-CB 3.4Å; T116-F120 PolarHBondContact O-N 3.49Å
117V81.6Confident76.3Confident80 Ų8079.5 Ų79.549%0.48543%0.425SS..Hα-helixtrans-62.9-44.1174.2170.40000111.3L113 L121L113-V117 HydrophobicContact CD1-CG2 4.38Å; L113-V117 WeakPolarHBondContact O-CB 3.3Å; L113-V117 VanDerWaalsContact O-CG2 3.25Å; L113-V117 WeakPolarHBondContact O-CG2 3.47Å; L113-V117 PolarHBondContact O-N 3.1Å; L113-V117 VanDerWaalsContact O-N 3.08Å; V117-L121 WeakPolarHBondContact O-CB 3.33Å; V117-L121 PolarHBondContact O-N 3.41Å
118A81.8Confident78.4Confident19 Ų1974.3 Ų74.316%0.15740%0.398CS..Hα-helixtrans-65.8-41.1177.500000112.5G114 L115 G122 L192G114-A118 WeakPolarHBondContact O-CB 3.46Å; G114-A118 PolarHBondContact O-N 3.14Å; L115-A118 PolarHBondContact O-N 2.85Å; A118-G122 PolarHBondContact O-N 3.09Å; A118-L192 HydrophobicContact CB-CD1 4.28Å; A118-L192 HydrophobicContact CB-CD2 4.35Å
119A83.9Confident80.4Confident44 Ų4471.4 Ų71.436%0.36438%0.383SS..Hα-helixtrans-66.8-43.1176.900000112.1L115 T116 G122 L123L115-A119 VanDerWaalsContact O-CB 3.28Å; L115-A119 WeakPolarHBondContact O-CB 3.37Å; L115-A119 PolarHBondContact O-N 3.42Å; T116-A119 PolarHBondContact O-N 3.32Å; A119-G122 PolarHBondContact O-N 3.2Å; A119-L123 WeakPolarHBondContact O-CB 3.29Å; A119-L123 PolarHBondContact O-N 2.96Å
120F87.3Confident82.3Confident134 Ų13469 Ų6959%0.58836%0.362SS*.Hα-helixtrans-63.2-45.2176.1179.4-105.3000111.7T116 G122 L123 L124T116-F120 VanDerWaalsContact O-CB 3.23Å; T116-F120 WeakPolarHBondContact O-CB 3.4Å; T116-F120 PolarHBondContact O-N 3.49Å; F120-G122 VanDerWaalsContact C-N 3.35Å; F120-G122 PolarHBondContact O-N 3.11Å; F120-L123 WeakPolarHBondContact O-CB 3.21Å; F120-L123 PolarHBondContact O-N 3.19Å; F120-L124 HydrophobicContact CD1-CD1 3.98Å; F120-L124 HydrophobicContact CE1-CD1 3.48Å; F120-L124 VanDerWaalsContact CE1-CD1 3.48Å; F120-L124 HydrophobicContact CE1-CG 4.17Å; F120-L124 HydrophobicContact CZ-CD1 3.9Å; F120-L124 HydrophobicContact CZ-CD2 4.39Å; F120-L124 HydrophobicContact CZ-CG 4.21Å; F120-L124 WeakPolarHBondContact O-CG 3.46Å; F120-L124 PolarHBondContact O-N 3.17Å
121L87.6Confident84Confident14 Ų1462.5 Ų62.57%0.07334%0.34CS..Hα-helixtrans-65.7-38.2176.2-169.367000111.9V117 L124 V125 L192 I195 F196V117-L121 WeakPolarHBondContact O-CB 3.33Å; V117-L121 PolarHBondContact O-N 3.41Å; L121-L124 PolarHBondContact O-N 2.93Å; L121-V125 WeakPolarHBondContact O-CB 3.36Å; L121-V125 VanDerWaalsContact O-CG2 3.25Å; L121-V125 WeakPolarHBondContact O-CG2 3.47Å; L121-V125 PolarHBondContact O-N 3.19Å; L121-L192 HydrophobicContact CD2-CB 4.15Å; L121-L192 HydrophobicContact CD2-CD2 3.84Å; L121-L192 VanDerWaalsContact CD2-O 3.3Å; L121-L192 WeakPolarHBondContact CD2-O 3.34Å; L121-I195 HydrophobicContact CD1-CG2 4.38Å; L121-I195 HydrophobicContact CD2-CB 4.18Å; L121-I195 HydrophobicContact CD2-CG2 3.82Å; L121-I195 HydrophobicContact CG-CG2 3.96Å; L121-F196 HydrophobicContact CD1-CB 4.16Å; L121-F196 HydrophobicContact CD1-CD2 4.13Å; L121-F196 HydrophobicContact CD2-CB 4.31Å
122G87.1Confident85.5Confident34 Ų3456.7 Ų56.735%0.35132%0.318SS..Hα-helixtrans-62.6-41.1173.700000113.2A118 A119 F120 V125 F126A118-G122 PolarHBondContact O-N 3.09Å; A119-G122 PolarHBondContact O-N 3.2Å; F120-G122 VanDerWaalsContact C-N 3.35Å; F120-G122 PolarHBondContact O-N 3.11Å; G122-V125 PolarHBondContact O-N 3.49Å; G122-F126 PolarHBondContact O-N 3.32Å
123L89.1Confident86.7Confident101 Ų10150.9 Ų50.953%0.52930%0.296SS..Hα-helixtrans-61.9-47.9172.9-172.195.3000111A119 F120 V125 F126 L127A119-L123 WeakPolarHBondContact O-CB 3.29Å; A119-L123 PolarHBondContact O-N 2.96Å; F120-L123 WeakPolarHBondContact O-CB 3.21Å; F120-L123 PolarHBondContact O-N 3.19Å; L123-V125 PolarHBondContact O-N 3Å; L123-F126 PolarHBondContact O-N 3.21Å; L123-L127 HydrophobicContact CD1-CD1 4.45Å; L123-L127 HydrophobicContact CD2-CD1 3.83Å; L123-L127 HydrophobicContact CG-CD1 3.77Å; L123-L127 HydrophobicContact CG-CG 4.37Å; L123-L127 WeakPolarHBondContact O-CB 3.25Å; L123-L127 WeakPolarHBondContact O-CG 3.41Å; L123-L127 PolarHBondContact O-N 3.44Å
124L90.1Very high87.7Confident55 Ų5550.3 Ų50.329%0.28829%0.293SS..Hα-helixtrans-56-51.8175.7-73.8177.5000110.8F120 L121 F126 L127 T128F120-L124 HydrophobicContact CD1-CD1 3.98Å; F120-L124 HydrophobicContact CE1-CD1 3.48Å; F120-L124 VanDerWaalsContact CE1-CD1 3.48Å; F120-L124 HydrophobicContact CE1-CG 4.17Å; F120-L124 HydrophobicContact CZ-CD1 3.9Å; F120-L124 HydrophobicContact CZ-CD2 4.39Å; F120-L124 HydrophobicContact CZ-CG 4.21Å; F120-L124 WeakPolarHBondContact O-CG 3.46Å; F120-L124 PolarHBondContact O-N 3.17Å; L121-L124 PolarHBondContact O-N 2.93Å; L124-F126 PolarHBondContact O-N 3.49Å; L124-F126 VanDerWaalsContact O-N 3.14Å; L124-L127 PolarHBondContact O-N 3.4Å; L124-T128 VanDerWaalsContact O-CG2 3.29Å; L124-T128 WeakPolarHBondContact O-CG2 3.37Å; L124-T128 PolarHBondContact O-N 3Å; L124-T128 PolarHBondContact O-OG1 3.36Å
125V91.5Very high88.5Confident10 Ų1050.7 Ų50.76%0.06129%0.286CS..Hα-helixtrans-53.1-35.3178.9162.80000113.5L121 G122 L123 P129 L165 I195 V199 L232L121-V125 WeakPolarHBondContact O-CB 3.36Å; L121-V125 VanDerWaalsContact O-CG2 3.25Å; L121-V125 WeakPolarHBondContact O-CG2 3.47Å; L121-V125 PolarHBondContact O-N 3.19Å; G122-V125 PolarHBondContact O-N 3.49Å; L123-V125 PolarHBondContact O-N 3Å; V125-P129 WeakPolarHBondContact O-CD 3.17Å; V125-L165 HydrophobicContact CG1-CD2 3.97Å; V125-I195 HydrophobicContact CG2-CG2 3.29Å; V125-V199 HydrophobicContact CG2-CG2 3.96Å; V125-L232 HydrophobicContact CG1-CD1 4.02Å; V125-L232 HydrophobicContact CG1-CD2 3.92Å; V125-L232 HydrophobicContact CG1-CG 4.45Å; V125-L232 HydrophobicContact CG2-CD2 4.15Å
126F91.6Very high89.1Confident67 Ų6745.7 Ų45.729%0.29426%0.259SS..Hα-helixtrans-80.1-36.9176.5-173.8-98.3000112.8G122 L123 L124 P129 I130 L162 L166G122-F126 PolarHBondContact O-N 3.32Å; L123-F126 PolarHBondContact O-N 3.21Å; L124-F126 PolarHBondContact O-N 3.49Å; L124-F126 VanDerWaalsContact O-N 3.14Å; F126-P129 WeakPolarHBondContact O-CD 3.47Å; F126-I130 HydrophobicContact CD1-CD1 4Å; F126-I130 HydrophobicContact CE1-CD1 3.62Å; F126-I130 HydrophobicContact CZ-CD1 4.1Å; F126-I130 WeakPolarHBondContact O-CD1 3.46Å; F126-L162 HydrophobicContact CD2-CD2 4.47Å; F126-L162 HydrophobicContact CE2-CB 4.19Å; F126-L166 HydrophobicContact CD2-CB 4.37Å; F126-L166 HydrophobicContact CD2-CD1 4.29Å; F126-L166 HydrophobicContact CE2-CB 4.05Å; F126-L166 HydrophobicContact CE2-CD1 4.28Å; F126-L166 HydrophobicContact CE2-CD2 4.28Å; F126-L166 HydrophobicContact CE2-CG 4.44Å; F126-L166 HydrophobicContact CZ-CD2 4.48Å
127L93.1Very high89.4Confident82 Ų8243.8 Ų43.843%0.42925%0.248SC..Hα-helixtrans-79.1-28.5-178.4-68.3177.1000113.7L123 L124 I130 A131L123-L127 HydrophobicContact CD1-CD1 4.45Å; L123-L127 HydrophobicContact CD2-CD1 3.83Å; L123-L127 HydrophobicContact CG-CD1 3.77Å; L123-L127 HydrophobicContact CG-CG 4.37Å; L123-L127 WeakPolarHBondContact O-CB 3.25Å; L123-L127 WeakPolarHBondContact O-CG 3.41Å; L123-L127 PolarHBondContact O-N 3.44Å; L124-L127 PolarHBondContact O-N 3.4Å; L127-I130 PolarHBondContact O-N 3.38Å; L127-A131 WeakPolarHBondContact O-CB 3.23Å; L127-A131 PolarHBondContact O-N 3.08Å
128T94.1Very high89.7Confident3 Ų346.3 Ų46.32%0.01826%0.257CS..Hα-helixtrans-62.9-42.4-175.452.60000114.6L124 I130 A131 F132 V199 W203L124-T128 VanDerWaalsContact O-CG2 3.29Å; L124-T128 WeakPolarHBondContact O-CG2 3.37Å; L124-T128 PolarHBondContact O-N 3Å; L124-T128 PolarHBondContact O-OG1 3.36Å; T128-I130 VanDerWaalsContact C-N 3.33Å; T128-I130 PolarHBondContact O-N 3.31Å; T128-A131 PolarHBondContact O-N 3.42Å; T128-F132 WeakPolarHBondContact O-CD1 3.26Å; T128-F132 WeakPolarHBondContact O-CG 3.29Å; T128-F132 PolarHBondContact O-N 3.09Å; T128-V199 HydrophobicContact CG2-CG1 3.95Å; T128-W203 HydrophobicContact CG2-CZ2 4.22Å
129P93.8Very high89.9Confident0 Ų050.6 Ų50.60%028%0.277CS..Hα-helixtrans-72.4-31.4179.4-17.235.2000111.6V125 F126 F132 I133 L162 L228 V229 L232V125-P129 WeakPolarHBondContact O-CD 3.17Å; F126-P129 WeakPolarHBondContact O-CD 3.47Å; P129-F132 PolarHBondContact O-N 3.26Å; P129-I133 WeakPolarHBondContact O-CG1 3.25Å; P129-I133 PolarHBondContact O-N 2.91Å; P129-L162 HydrophobicContact CB-CD2 4.3Å; P129-L162 HydrophobicContact CG-CD2 4.07Å; P129-L228 HydrophobicContact CG-CD2 4.07Å; P129-L228 HydrophobicContact CG-CG 4.39Å; P129-V229 HydrophobicContact CB-CG2 3.47Å; P129-V229 VanDerWaalsContact CB-CG2 3.47Å; P129-V229 HydrophobicContact CG-CG2 3.65Å; P129-L232 HydrophobicContact CG-CD1 4.36Å
130I93.1Very high90Very high52 Ų5249.4 Ų49.427%0.26726%0.263SS..Hα-helixtrans-65.4-45.4173.4-59.5174000109.7F126 L127 T128 F132 I133 L134 L162F126-I130 HydrophobicContact CD1-CD1 4Å; F126-I130 HydrophobicContact CE1-CD1 3.62Å; F126-I130 HydrophobicContact CZ-CD1 4.1Å; F126-I130 WeakPolarHBondContact O-CD1 3.46Å; L127-I130 PolarHBondContact O-N 3.38Å; T128-I130 VanDerWaalsContact C-N 3.33Å; T128-I130 PolarHBondContact O-N 3.31Å; I130-F132 PolarHBondContact O-N 3.16Å; I130-I133 PolarHBondContact O-N 3.33Å; I130-L134 HydrophobicContact CG2-CD1 3.67Å; I130-L134 HydrophobicContact CG2-CG 4.25Å; I130-L134 WeakPolarHBondContact O-CG 3.17Å; I130-L134 PolarHBondContact O-N 3.18Å; I130-L162 HydrophobicContact CD1-CD1 4.41Å; I130-L162 HydrophobicContact CG1-CD1 3.88Å
131A92.8Very high89.6Confident29 Ų2951.8 Ų51.824%0.2427%0.268CS..Hα-helixtrans-60.5-44.7176.200000111.9L127 T128 I133 L134 L135 W203L127-A131 WeakPolarHBondContact O-CB 3.23Å; L127-A131 PolarHBondContact O-N 3.08Å; T128-A131 PolarHBondContact O-N 3.42Å; A131-I133 PolarHBondContact O-N 3.07Å; A131-L134 PolarHBondContact O-N 2.77Å; A131-L135 WeakPolarHBondContact O-CB 3.41Å; A131-L135 PolarHBondContact O-N 3.14Å; A131-W203 HydrophobicContact CB-CH2 4.33Å; A131-W203 HydrophobicContact CB-CZ2 4.33Å
132F93.2Very high89.1Confident0 Ų059.5 Ų59.50%030%0.304CS..Hα-helixtrans-61.3-27.9178.8-72.63.2000113.6T128 P129 I130 P136 W203 Y206 I221 Y224 A225 L228T128-F132 WeakPolarHBondContact O-CD1 3.26Å; T128-F132 WeakPolarHBondContact O-CG 3.29Å; T128-F132 PolarHBondContact O-N 3.09Å; P129-F132 PolarHBondContact O-N 3.26Å; I130-F132 PolarHBondContact O-N 3.16Å; F132-P136 WeakPolarHBondContact O-CD 3.45Å; F132-W203 HydrophobicContact CD1-CH2 4.42Å; F132-W203 HydrophobicContact CD1-CZ2 4.49Å; F132-W203 AromaticContact CE1-CD2 3.67Å; F132-W203 HydrophobicContact CE1-CD2 3.67Å; F132-W203 AromaticContact CE1-CE2 3.77Å; F132-W203 AromaticContact CE1-CE3 3.78Å; F132-W203 HydrophobicContact CE1-CE3 3.78Å; F132-W203 HydrophobicContact CE1-CG 4.23Å; F132-W203 HydrophobicContact CE1-CH2 4.07Å; F132-W203 AromaticContact CE1-CZ2 3.97Å; F132-W203 HydrophobicContact CE1-CZ2 3.97Å; F132-W203 AromaticContact CE1-CZ3 3.98Å; F132-W203 HydrophobicContact CE1-CZ3 3.98Å; F132-W203 HydrophobicContact CZ-CD2 4.17Å; F132-W203 HydrophobicContact CZ-CG 4.25Å; F132-Y206 HydrophobicContact CB-CD2 4.12Å; F132-Y206 HydrophobicContact CB-CE2 3.65Å; F132-Y206 AromaticContact CD1-CD1 3.83Å; F132-Y206 HydrophobicContact CD1-CD1 3.83Å; F132-Y206 AromaticContact CD1-CD2 3.69Å; F132-Y206 HydrophobicContact CD1-CD2 3.69Å; F132-Y206 AromaticContact CD1-CE1 3.89Å; F132-Y206 HydrophobicContact CD1-CE1 3.89Å; F132-Y206 AromaticContact CD1-CE2 3.79Å; F132-Y206 HydrophobicContact CD1-CE2 3.79Å; F132-Y206 AromaticContact CD1-CG 3.74Å; F132-Y206 HydrophobicContact CD1-CG 3.74Å; F132-Y206 AromaticContact CD1-CZ 3.9Å; F132-Y206 AromaticContact CD2-CD2 3.77Å; F132-Y206 HydrophobicContact CD2-CD2 3.77Å; F132-Y206 HydrophobicContact CD2-CE2 4.21Å; F132-Y206 HydrophobicContact CD2-CG 4.32Å; F132-Y206 AromaticContact CE1-CD1 3.75Å; F132-Y206 HydrophobicContact CE1-CD1 3.75Å; F132-Y206 AromaticContact CE1-CD2 3.97Å; F132-Y206 HydrophobicContact CE1-CD2 3.97Å; F132-Y206 HydrophobicContact CE1-CE1 4.27Å; F132-Y206 HydrophobicContact CE1-CE2 4.49Å; F132-Y206 AromaticContact CE1-CG 3.6Å; F132-Y206 HydrophobicContact CE1-CG 3.6Å; F132-Y206 HydrophobicContact CE2-CD2 4.05Å; F132-Y206 HydrophobicContact CE2-CG 4.2Å; F132-Y206 AromaticContact CG-CD2 3.59Å; F132-Y206 HydrophobicContact CG-CD2 3.59Å; F132-Y206 AromaticContact CG-CE2 3.63Å; F132-Y206 HydrophobicContact CG-CE2 3.63Å; F132-Y206 HydrophobicContact CG-CG 4.11Å; F132-Y206 HydrophobicContact CZ-CD1 4.42Å; F132-Y206 HydrophobicContact CZ-CD2 4.15Å; F132-Y206 AromaticContact CZ-CG 3.85Å; F132-Y206 HydrophobicContact CZ-CG 3.85Å; F132-Y206 PolarHBondContact O-OH 2.84Å; F132-Y206 VanDerWaalsContact O-OH 3.1Å; F132-I221 WeakPolarHBondContact O-CG2 3.5Å; F132-Y224 HydrophobicContact CD2-CD1 4.12Å; F132-Y224 HydrophobicContact CD2-CE1 4.04Å; F132-Y224 HydrophobicContact CE2-CD1 4.27Å; F132-Y224 AromaticContact CE2-CE1 3.71Å; F132-Y224 HydrophobicContact CE2-CE1 3.71Å; F132-A225 HydrophobicContact CB-CB 4.1Å; F132-L228 HydrophobicContact CD2-CD2 3.99Å; F132-L228 HydrophobicContact CE2-CD2 3.64Å; F132-L228 HydrophobicContact CZ-CD2 4.37Å
133I91.7Very high88.7Confident16 Ų1661.6 Ų61.68%0.08231%0.305CS..Hα-helixtrans-85.9-41.4178.6-65.4170.3000111.2P129 I130 A131 P137 L155 V158 Y218 A225P129-I133 WeakPolarHBondContact O-CG1 3.25Å; P129-I133 PolarHBondContact O-N 2.91Å; I130-I133 PolarHBondContact O-N 3.33Å; A131-I133 PolarHBondContact O-N 3.07Å; I133-P137 WeakPolarHBondContact O-CD 3.38Å; I133-L155 HydrophobicContact CD1-CD2 4.16Å; I133-L155 HydrophobicContact CG2-CD2 3.69Å; I133-V158 HydrophobicContact CD1-CB 4.39Å; I133-V158 HydrophobicContact CD1-CG1 3.87Å; I133-V158 HydrophobicContact CD1-CG2 4.25Å; I133-Y218 VanDerWaalsContact CG2-OH 3.31Å; I133-Y218 WeakPolarHBondContact CG2-OH 3.46Å; I133-A225 HydrophobicContact CD1-CB 4.04Å; I133-A225 HydrophobicContact CG1-CB 3.73Å
134L91Very high88.4Confident94 Ų9458.3 Ų58.349%0.49229%0.287SS..Hα-helixtrans-84.6-26.9-174.4-65-178000114.5I130 A131 P137 I138I130-L134 HydrophobicContact CG2-CD1 3.67Å; I130-L134 HydrophobicContact CG2-CG 4.25Å; I130-L134 WeakPolarHBondContact O-CG 3.17Å; I130-L134 PolarHBondContact O-N 3.18Å; A131-L134 PolarHBondContact O-N 2.77Å; L134-P137 VanDerWaalsContact O-CD 3.28Å; L134-P137 WeakPolarHBondContact O-CD 3.5Å; L134-P137 WeakPolarHBondContact O-CG 3.42Å; L134-I138 HydrophobicContact CB-CD1 4.31Å; L134-I138 VanDerWaalsContact O-CD1 3.3Å; L134-I138 WeakPolarHBondContact O-CD1 3.27Å; L134-I138 WeakPolarHBondContact O-CG1 3.42Å; L134-I138 PolarHBondContact O-N 2.99Å
135L90.2Very high88.1Confident48 Ų4861 Ų6125%0.25130%0.297SS..Hα-helixtrans-70.8-36.5-170.2-169.2146.5000113.9A131 I138 L139 Y206 L211A131-L135 WeakPolarHBondContact O-CB 3.41Å; A131-L135 PolarHBondContact O-N 3.14Å; L135-I138 PolarHBondContact O-N 3.41Å; L135-L139 HydrophobicContact CD2-CD1 3.48Å; L135-L139 VanDerWaalsContact CD2-CD1 3.48Å; L135-L139 HydrophobicContact CD2-CG 4.39Å; L135-L139 HydrophobicContact CG-CD1 4.19Å; L135-L139 WeakPolarHBondContact O-CG 3.44Å; L135-L139 PolarHBondContact O-N 3.34Å; L135-L139 VanDerWaalsContact O-N 3.14Å; L135-Y206 HydrophobicContact CD2-CE1 4.32Å; L135-L211 HydrophobicContact CD2-CD1 3.99Å; L135-L211 HydrophobicContact CD2-CD2 3.36Å; L135-L211 HydrophobicContact CD2-CG 4.33Å
136P87.7Confident87.5Confident0 Ų066.7 Ų66.70%033%0.334CS..Hα-helixtrans-63.7-50.3173.3-23.136.2000114.6F132 I138 L139 W140 L144 Y206 I221F132-P136 WeakPolarHBondContact O-CD 3.45Å; P136-I138 PolarHBondContact O-N 3.19Å; P136-L139 PolarHBondContact O-N 3.06Å; P136-W140 HydrophobicContact CB-CH2 4.05Å; P136-W140 HydrophobicContact CB-CZ2 3.92Å; P136-W140 PolarHBondContact O-N 3.42Å; P136-L144 HydrophobicContact CB-CD1 4.22Å; P136-L144 HydrophobicContact CB-CD2 4.35Å; P136-Y206 VanDerWaalsContact CD-OH 3.26Å; P136-Y206 WeakPolarHBondContact CD-OH 3.4Å; P136-Y206 VanDerWaalsContact CG-OH 3.25Å; P136-Y206 WeakPolarHBondContact CG-OH 3.43Å; P136-I221 HydrophobicContact CB-CD1 4.01Å; P136-I221 HydrophobicContact CG-CD1 3.87Å; P136-I221 HydrophobicContact CG-CG2 4.11Å
137P85.7Confident87.1Confident38 Ų3865.3 Ų65.325%0.24733%0.332CS..Hα-helixtrans-69.5-9.9177.428-35.1000114.2I133 L134 R141 L144I133-P137 WeakPolarHBondContact O-CD 3.38Å; L134-P137 VanDerWaalsContact O-CD 3.28Å; L134-P137 WeakPolarHBondContact O-CD 3.5Å; L134-P137 WeakPolarHBondContact O-CG 3.42Å; P137-R141 WeakPolarHBondContact O-CB 3.4Å; P137-L144 HydrophobicContact CB-CD1 4.22Å
138I88.1Confident86.8Confident132 Ų13263.5 Ų63.568%0.67733%0.334SS*.Hα-helixtrans-82.2-38.2168-70.8167.4000111.4L134 L135 P136L134-I138 HydrophobicContact CB-CD1 4.31Å; L134-I138 VanDerWaalsContact O-CD1 3.3Å; L134-I138 WeakPolarHBondContact O-CD1 3.27Å; L134-I138 WeakPolarHBondContact O-CG1 3.42Å; L134-I138 PolarHBondContact O-N 2.99Å; L135-I138 PolarHBondContact O-N 3.41Å; P136-I138 PolarHBondContact O-N 3.19Å
139L85.8Confident86.4Confident109 Ų10967.1 Ų67.157%0.57136%0.364SS*.Hα-helixtrans-89.1-37.2-173.2-69.9176000114.8L135 P136 L211L135-L139 HydrophobicContact CD2-CD1 3.48Å; L135-L139 VanDerWaalsContact CD2-CD1 3.48Å; L135-L139 HydrophobicContact CD2-CG 4.39Å; L135-L139 HydrophobicContact CG-CD1 4.19Å; L135-L139 WeakPolarHBondContact O-CG 3.44Å; L135-L139 PolarHBondContact O-N 3.34Å; L135-L139 VanDerWaalsContact O-N 3.14Å; P136-L139 PolarHBondContact O-N 3.06Å; L139-L211 HydrophobicContact CD1-CD2 4.4Å
140W86Confident86.2Confident20 Ų2073.1 Ų73.18%0.07640%0.395CS..  trans-14850.7-172.832.8-87.5000112.5P136 E142 E143 L144 R214 D215 I221P136-W140 HydrophobicContact CB-CH2 4.05Å; P136-W140 HydrophobicContact CB-CZ2 3.92Å; P136-W140 PolarHBondContact O-N 3.42Å; W140-E142 VanDerWaalsContact C-N 3.3Å; W140-E142 PolarHBondContact O-N 3.36Å; W140-E143 HydrophobicContact CB-CB 4.44Å; W140-E143 HydrophobicContact CE3-CB 4.39Å; W140-E143 PolarHBondContact O-N 3.44Å; W140-L144 HydrophobicContact CE3-CD1 3.96Å; W140-L144 HydrophobicContact CE3-CD2 4.22Å; W140-L144 HydrophobicContact CE3-CG 3.74Å; W140-L144 HydrophobicContact CH2-CD2 4.41Å; W140-L144 HydrophobicContact CZ3-CD1 4.26Å; W140-L144 HydrophobicContact CZ3-CD2 3.71Å; W140-L144 HydrophobicContact CZ3-CG 3.75Å; W140-R214 HydrophobicContact CZ2-CB 4.4Å; W140-D215 WeakPolarHBondContact CH2-O 3.43Å; W140-D215 VanDerWaalsContact CZ3-O 3.27Å; W140-D215 WeakPolarHBondContact CZ3-O 3.05Å; W140-I221 HydrophobicContact CH2-CD1 4.02Å
141R78.3Confident86Confident183 Ų18370.8 Ų70.869%0.69138%0.383SS*.G310 helixtrans-47.7-44.7-176.8-162.5-179.8-135.4-153.71.5114.9P137 E143 L144P137-R141 WeakPolarHBondContact O-CB 3.4Å; R141-E143 VanDerWaalsContact C-N 3.25Å; R141-E143 PolarHBondContact O-N 2.66Å; R141-L144 PolarHBondContact O-N 3.34Å
142E78Confident85.8Confident177 Ų17774.5 Ų74.583%0.82740%0.396SS*.G310 helixtrans-73-15.2-174.9-53-55.7143.100113.4W140W140-E142 VanDerWaalsContact C-N 3.3Å; W140-E142 PolarHBondContact O-N 3.36Å
143E78.1Confident85.7Confident78 Ų7876.4 Ų76.436%0.36442%0.415SS..G310 helixtrans-94.8-7.3179.9-62.5178.7-159.200112.7W140 R141 R214 Q216W140-E143 HydrophobicContact CB-CB 4.44Å; W140-E143 HydrophobicContact CE3-CB 4.39Å; W140-E143 PolarHBondContact O-N 3.44Å; R141-E143 VanDerWaalsContact C-N 3.25Å; R141-E143 PolarHBondContact O-N 2.66Å; E143-R214 IonicContact OE1-NH1 3.51Å; E143-R214 IonicContact OE2-NH1 3.88Å; E143-Q216 WeakPolarHBondContact O-CB 3.46Å; E143-Q216 VanDerWaalsContact O-CG 3.23Å; E143-Q216 WeakPolarHBondContact O-CG 3.17Å
144L82.8Confident85.7Confident31 Ų3177.5 Ų77.516%0.16242%0.421CS..SBendtrans-87.6131.9-174.8-80.3143.5000112.8P136 P137 W140 R141 Y218 I221P136-L144 HydrophobicContact CB-CD1 4.22Å; P136-L144 HydrophobicContact CB-CD2 4.35Å; P137-L144 HydrophobicContact CB-CD1 4.22Å; W140-L144 HydrophobicContact CE3-CD1 3.96Å; W140-L144 HydrophobicContact CE3-CD2 4.22Å; W140-L144 HydrophobicContact CE3-CG 3.74Å; W140-L144 HydrophobicContact CH2-CD2 4.41Å; W140-L144 HydrophobicContact CZ3-CD1 4.26Å; W140-L144 HydrophobicContact CZ3-CD2 3.71Å; W140-L144 HydrophobicContact CZ3-CG 3.75Å; R141-L144 PolarHBondContact O-N 3.34Å; L144-Y218 HydrophobicContact CD2-CD2 3.91Å; L144-Y218 HydrophobicContact CD2-CG 4.3Å; L144-I221 HydrophobicContact CD2-CD1 4.37Å
145K82.8Confident85.7Confident111 Ų11175.2 Ų75.248%0.48341%0.409SS..PPolyproline II helixtrans-69.9141.9172.7-65.4172.1-169.3162.80110.8Q216 N217K145-Q216 PolarHBondContact N-O 2.99Å; K145-Q216 VanDerWaalsContact N-O 3.11Å; K145-N217 PolarHBondContact NZ-OD1 3.23Å
146P79.4Confident85.8Confident130 Ų13077.7 Ų77.784%0.84442%0.421SS*.PPolyproline II helixtrans-61.7139.6179.824.8-33.8000112.4G148P146-G148 PolarHBondContact O-N 3.26Å
147C83Confident86.1Confident38 Ų3879.6 Ų79.626%0.25744%0.435SS..PPolyproline II helixtrans-69.2120175.6-174.10000109.5C151 E152 Y218C147-C151 HydrophobicContact CB-CB 4.11Å; C147-C151 WeakPolarHBondContact CB-SG 3.01Å; C147-C151 WeakPolarHBondContact SG-CB 3.43Å; C147-C151 CovalentContact SG-SG 2.04Å; C147-C151 PolarHBondContact SG-SG 2.9Å; C147-E152 PolarHBondContact SG-N 2.68Å; C147-E152 VanDerWaalsContact SG-N 3.4Å; C147-Y218 HydrophobicContact CB-CD1 3.85Å; C147-Y218 HydrophobicContact CB-CE1 4.13Å
148G86.9Confident86.5Confident45 Ų4578 Ų7846%0.46442%0.424SS..PPolyproline II helixtrans-86.6171.4170.800000112.5P146 I150 C151 E152P146-G148 PolarHBondContact O-N 3.26Å; G148-I150 PolarHBondContact O-N 3.34Å; G148-C151 WeakPolarHBondContact O-CA 3.18Å; G148-C151 VanDerWaalsContact O-CB 3.3Å; G148-C151 WeakPolarHBondContact O-CB 3.38Å; G148-C151 PolarHBondContact O-N 3.12Å; G148-E152 PolarHBondContact O-N 2.83Å; G148-E152 VanDerWaalsContact O-N 3.1Å
149A87.3Confident86.7Confident79 Ų7975.4 Ų75.465%0.65342%0.417SS*.Hα-helixtrans-50.4-32.6-174.800000115.6E152 G153A149-E152 PolarHBondContact O-N 2.82Å; A149-G153 PolarHBondContact O-N 2.98Å
150I88.3Confident87.1Confident125 Ų12576.6 Ų76.664%0.64142%0.418SS*.Hα-helixtrans-64.7-42.2174.5-60.3173.2000111.1G148 G153 L154G148-I150 PolarHBondContact O-N 3.34Å; I150-G153 PolarHBondContact O-N 3.43Å; I150-L154 WeakPolarHBondContact O-CG 3.35Å; I150-L154 PolarHBondContact O-N 3.19Å; I150-L154 VanDerWaalsContact O-N 3.12Å
151C88.9Confident87.5Confident3 Ų377.5 Ų77.52%0.0242%0.423CS..Hα-helixtrans-69.6-38.2177.7159.50000111.1C147 G148 G153 L154 L155 Y218 K219C147-C151 HydrophobicContact CB-CB 4.11Å; C147-C151 WeakPolarHBondContact CB-SG 3.01Å; C147-C151 WeakPolarHBondContact SG-CB 3.43Å; C147-C151 CovalentContact SG-SG 2.04Å; C147-C151 PolarHBondContact SG-SG 2.9Å; G148-C151 WeakPolarHBondContact O-CA 3.18Å; G148-C151 VanDerWaalsContact O-CB 3.3Å; G148-C151 WeakPolarHBondContact O-CB 3.38Å; G148-C151 PolarHBondContact O-N 3.12Å; C151-G153 PolarHBondContact O-N 2.83Å; C151-L154 WeakPolarHBondContact O-CB 3.34Å; C151-L154 PolarHBondContact O-N 2.87Å; C151-L155 PolarHBondContact O-N 3.48Å; C151-Y218 VanDerWaalsContact SG-CD1 3.59Å; C151-K219 HydrophobicContact CB-CB 4.31Å; C151-K219 HydrophobicContact CB-CG 4.34Å
152E89.1Confident88.2Confident108 Ų10869.5 Ų69.551%0.50539%0.394SS..Hα-helixtrans-62.1-42.6172.2-61.6-179.5145.100111.7C147 G148 A149 L154 L155 I156C147-E152 PolarHBondContact SG-N 2.68Å; C147-E152 VanDerWaalsContact SG-N 3.4Å; G148-E152 PolarHBondContact O-N 2.83Å; G148-E152 VanDerWaalsContact O-N 3.1Å; A149-E152 PolarHBondContact O-N 2.82Å; E152-L154 VanDerWaalsContact C-N 3.29Å; E152-L154 PolarHBondContact O-N 3.29Å; E152-L155 WeakPolarHBondContact O-CB 3.22Å; E152-L155 PolarHBondContact O-N 3.39Å; E152-L155 VanDerWaalsContact O-N 3.15Å; E152-I156 WeakPolarHBondContact O-CG1 3.28Å; E152-I156 PolarHBondContact O-N 2.99Å
153G91.6Very high88.9Confident39 Ų3965.5 Ų65.540%0.40238%0.377SS..Hα-helixtrans-59.7-36.3173.200000113.5A149 I150 C151 S157A149-G153 PolarHBondContact O-N 2.98Å; I150-G153 PolarHBondContact O-N 3.43Å; C151-G153 PolarHBondContact O-N 2.83Å; G153-S157 WeakPolarHBondContact O-CB 3.47Å; G153-S157 PolarHBondContact O-N 3.36Å
154L92Very high89.6Confident39 Ų3965.7 Ų65.720%0.20438%0.38CS..Hα-helixtrans-67.9-39.9173.5-67.9174.5000112.2I150 C151 E152 I156 S157 V158 V222 Q223 V226I150-L154 WeakPolarHBondContact O-CG 3.35Å; I150-L154 PolarHBondContact O-N 3.19Å; I150-L154 VanDerWaalsContact O-N 3.12Å; C151-L154 WeakPolarHBondContact O-CB 3.34Å; C151-L154 PolarHBondContact O-N 2.87Å; E152-L154 VanDerWaalsContact C-N 3.29Å; E152-L154 PolarHBondContact O-N 3.29Å; L154-I156 PolarHBondContact O-N 2.91Å; L154-S157 WeakPolarHBondContact O-CB 3.21Å; L154-S157 PolarHBondContact O-N 2.95Å; L154-S157 VanDerWaalsContact O-N 3.17Å; L154-V158 WeakPolarHBondContact O-CG2 3.49Å; L154-V158 PolarHBondContact O-N 3.27Å; L154-V222 HydrophobicContact CB-CG1 3.65Å; L154-V222 HydrophobicContact CD1-CG1 4.43Å; L154-Q223 HydrophobicContact CD1-CB 4.21Å; L154-V226 HydrophobicContact CB-CG2 4.07Å; L154-V226 HydrophobicContact CD2-CG2 4.15Å
155L90.8Very high90Very high47 Ų4764.5 Ų64.525%0.24637%0.374CS..Hα-helixtrans-62.6-40.7175.2-68.4171.4000112.3I133 C151 E152 S157 V158 S159 Y218 V222I133-L155 HydrophobicContact CD1-CD2 4.16Å; I133-L155 HydrophobicContact CG2-CD2 3.69Å; C151-L155 PolarHBondContact O-N 3.48Å; E152-L155 WeakPolarHBondContact O-CB 3.22Å; E152-L155 PolarHBondContact O-N 3.39Å; E152-L155 VanDerWaalsContact O-N 3.15Å; L155-S157 VanDerWaalsContact C-N 3.34Å; L155-V158 PolarHBondContact O-N 3.41Å; L155-S159 PolarHBondContact O-N 2.93Å; L155-S159 PolarHBondContact O-OG 2.87Å; L155-Y218 HydrophobicContact CD1-CE1 4.4Å; L155-V222 HydrophobicContact CD2-CG1 3.88Å; L155-V222 HydrophobicContact CD2-CG2 3.86Å; L155-V222 HydrophobicContact CG-CG1 4.12Å; L155-V222 HydrophobicContact CG-CG2 4.42Å
156I92.3Very high90.3Very high99 Ų9963.1 Ų63.151%0.50837%0.371SS..Hα-helixtrans-62.2-44.2172.6-65.2166.9000109.8E152 L154 S159 F160E152-I156 WeakPolarHBondContact O-CG1 3.28Å; E152-I156 PolarHBondContact O-N 2.99Å; L154-I156 PolarHBondContact O-N 2.91Å; I156-S159 WeakPolarHBondContact O-CB 3.21Å; I156-S159 PolarHBondContact O-N 3.36Å; I156-F160 HydrophobicContact CG2-CD2 3.85Å; I156-F160 HydrophobicContact CG2-CE2 3.7Å; I156-F160 WeakPolarHBondContact O-CD2 3.3Å; I156-F160 PolarHBondContact O-N 3.29Å; I156-F160 VanDerWaalsContact O-N 3.14Å
157S93.3Very high90.8Very high41 Ų4161.7 Ų61.729%0.28736%0.356SS..Hα-helixtrans-59.8-46.7177.1-165.70000112.5G153 L154 L155 S159 F160 K161G153-S157 WeakPolarHBondContact O-CB 3.47Å; G153-S157 PolarHBondContact O-N 3.36Å; L154-S157 WeakPolarHBondContact O-CB 3.21Å; L154-S157 PolarHBondContact O-N 2.95Å; L154-S157 VanDerWaalsContact O-N 3.17Å; L155-S157 VanDerWaalsContact C-N 3.34Å; S157-S159 VanDerWaalsContact C-N 3.31Å; S157-S159 PolarHBondContact O-N 2.94Å; S157-F160 PolarHBondContact O-N 3.38Å; S157-K161 WeakPolarHBondContact O-CB 3.35Å; S157-K161 VanDerWaalsContact O-CG 3.23Å; S157-K161 WeakPolarHBondContact O-CG 3.4Å; S157-K161 PolarHBondContact O-N 2.9Å; S157-K161 VanDerWaalsContact OG-CE 3.31Å; S157-K161 WeakPolarHBondContact OG-CE 3.33Å
158V93.8Very high90.9Very high4 Ų460.5 Ų60.52%0.02435%0.349CS..Hα-helixtrans-56.8-45.2174171.50000111.1I133 L154 L155 F160 K161 L162 V226 V229I133-V158 HydrophobicContact CD1-CB 4.39Å; I133-V158 HydrophobicContact CD1-CG1 3.87Å; I133-V158 HydrophobicContact CD1-CG2 4.25Å; L154-V158 WeakPolarHBondContact O-CG2 3.49Å; L154-V158 PolarHBondContact O-N 3.27Å; L155-V158 PolarHBondContact O-N 3.41Å; V158-F160 PolarHBondContact O-N 3.22Å; V158-K161 PolarHBondContact O-N 3.03Å; V158-L162 HydrophobicContact CG1-CD1 3.65Å; V158-L162 HydrophobicContact CG1-CG 4.02Å; V158-L162 WeakPolarHBondContact O-CB 3.45Å; V158-L162 WeakPolarHBondContact O-CG 3.46Å; V158-L162 PolarHBondContact O-N 3.1Å; V158-V226 HydrophobicContact CG2-CB 4.3Å; V158-V226 HydrophobicContact CG2-CG2 3.39Å; V158-V229 HydrophobicContact CG1-CG2 4.39Å
159S93.1Very high90.6Very high77 Ų7759.9 Ų59.954%0.53834%0.337SS..Hα-helixtrans-59.5-46.8-178-56.80000112.1L155 I156 S157 L163L155-S159 PolarHBondContact O-N 2.93Å; L155-S159 PolarHBondContact O-OG 2.87Å; I156-S159 WeakPolarHBondContact O-CB 3.21Å; I156-S159 PolarHBondContact O-N 3.36Å; S157-S159 VanDerWaalsContact C-N 3.31Å; S157-S159 PolarHBondContact O-N 2.94Å; S159-L163 PolarHBondContact O-N 3.44Å; S159-L163 VanDerWaalsContact O-N 3.12Å
160F93.9Very high90.5Very high134 Ų13464.3 Ų64.359%0.58834%0.337SS*.Hα-helixtrans-67.7-40.6175.2-77.6-70.5000112.9I156 S157 V158 L163 I164I156-F160 HydrophobicContact CG2-CD2 3.85Å; I156-F160 HydrophobicContact CG2-CE2 3.7Å; I156-F160 WeakPolarHBondContact O-CD2 3.3Å; I156-F160 PolarHBondContact O-N 3.29Å; I156-F160 VanDerWaalsContact O-N 3.14Å; S157-F160 PolarHBondContact O-N 3.38Å; V158-F160 PolarHBondContact O-N 3.22Å; F160-L163 WeakPolarHBondContact O-CB 3.35Å; F160-L163 PolarHBondContact O-N 3.33Å; F160-I164 WeakPolarHBondContact O-CG1 3.37Å; F160-I164 PolarHBondContact O-N 3.31Å
161K94.8Very high90.1Very high40 Ų4060.5 Ų60.517%0.17432%0.324CS..Hα-helixtrans-64.1-40.5178.4-73.4174.5-179.2-177.80112.2S157 V158 I164 L165 V229 D230 L233S157-K161 WeakPolarHBondContact O-CB 3.35Å; S157-K161 VanDerWaalsContact O-CG 3.23Å; S157-K161 WeakPolarHBondContact O-CG 3.4Å; S157-K161 PolarHBondContact O-N 2.9Å; S157-K161 VanDerWaalsContact OG-CE 3.31Å; S157-K161 WeakPolarHBondContact OG-CE 3.33Å; V158-K161 PolarHBondContact O-N 3.03Å; K161-I164 PolarHBondContact O-N 2.7Å; K161-L165 WeakPolarHBondContact O-CB 3.28Å; K161-L165 PolarHBondContact O-N 2.95Å; K161-V229 HydrophobicContact CB-CG1 3.47Å; K161-V229 VanDerWaalsContact CB-CG1 3.47Å; K161-V229 HydrophobicContact CD-CG1 4.24Å; K161-V229 HydrophobicContact CG-CG1 4.45Å; K161-D230 WeakPolarHBondContact CD-OD1 3.34Å; K161-D230 WeakPolarHBondContact CE-OD1 3.37Å; K161-D230 IonicContact NZ-OD1 3.48Å; K161-D230 PolarHBondContact NZ-OD1 2.77Å; K161-D230 IonicContact NZ-OD2 2.98Å; K161-D230 PolarHBondContact NZ-OD2 3.46Å; K161-L233 HydrophobicContact CB-CD1 3.75Å; K161-L233 HydrophobicContact CD-CD1 4.26Å; K161-L233 HydrophobicContact CG-CD1 3.78Å
162L92.6Very high89.3Confident15 Ų1561.3 Ų61.38%0.07933%0.328CS..Hα-helixtrans-65.9-38.1174.1-74.2177.2000112.3F126 P129 I130 V158 L165 L166 V229F126-L162 HydrophobicContact CD2-CD2 4.47Å; F126-L162 HydrophobicContact CE2-CB 4.19Å; P129-L162 HydrophobicContact CB-CD2 4.3Å; P129-L162 HydrophobicContact CG-CD2 4.07Å; I130-L162 HydrophobicContact CD1-CD1 4.41Å; I130-L162 HydrophobicContact CG1-CD1 3.88Å; V158-L162 HydrophobicContact CG1-CD1 3.65Å; V158-L162 HydrophobicContact CG1-CG 4.02Å; V158-L162 WeakPolarHBondContact O-CB 3.45Å; V158-L162 WeakPolarHBondContact O-CG 3.46Å; V158-L162 PolarHBondContact O-N 3.1Å; L162-L165 PolarHBondContact O-N 3.45Å; L162-L166 WeakPolarHBondContact O-CB 3.19Å; L162-L166 PolarHBondContact O-N 3.18Å; L162-V229 HydrophobicContact CD2-CG1 4.37Å; L162-V229 HydrophobicContact CD2-CG2 4.08Å; L162-V229 HydrophobicContact CG-CG2 4.43Å
163L92.8Very high88.3Confident92 Ų9259 Ų5948%0.48232%0.317SS..Hα-helixtrans-60.5-46.3173.3-174.578.3000111.4S159 F160 L166 I167S159-L163 PolarHBondContact O-N 3.44Å; S159-L163 VanDerWaalsContact O-N 3.12Å; F160-L163 WeakPolarHBondContact O-CB 3.35Å; F160-L163 PolarHBondContact O-N 3.33Å; L163-L166 PolarHBondContact O-N 2.88Å; L163-I167 HydrophobicContact CG-CD1 4.13Å; L163-I167 WeakPolarHBondContact O-CG1 3.18Å; L163-I167 PolarHBondContact O-N 3.44Å
164I92.2Very high87Confident83 Ų8363.8 Ų63.843%0.42633%0.327SS..Hα-helixtrans-61.7-45.4176.7-67165.3000110.5F160 K161 L166 I167 G168 L233F160-I164 WeakPolarHBondContact O-CG1 3.37Å; F160-I164 PolarHBondContact O-N 3.31Å; K161-I164 PolarHBondContact O-N 2.7Å; I164-L166 VanDerWaalsContact C-N 3.34Å; I164-L166 PolarHBondContact O-N 2.88Å; I164-I167 PolarHBondContact O-N 3.17Å; I164-G168 PolarHBondContact O-N 3.25Å; I164-L233 HydrophobicContact CG2-CD2 4.02Å
165L90.8Very high85.8Confident6 Ų669.7 Ų69.73%0.03135%0.346CS..Hα-helixtrans-63.1-38178.2-170.867.1000112.1V125 K161 L162 T169 L232 L233 H236V125-L165 HydrophobicContact CG1-CD2 3.97Å; K161-L165 WeakPolarHBondContact O-CB 3.28Å; K161-L165 PolarHBondContact O-N 2.95Å; L162-L165 PolarHBondContact O-N 3.45Å; L165-T169 HydrophobicContact CD1-CG2 4.4Å; L165-T169 HydrophobicContact CG-CG2 4.47Å; L165-T169 WeakPolarHBondContact O-CB 3.41Å; L165-T169 VanDerWaalsContact O-CG2 3.28Å; L165-T169 WeakPolarHBondContact O-CG2 3.48Å; L165-T169 PolarHBondContact O-N 2.98Å; L165-T169 PolarHBondContact O-OG1 3.37Å; L165-L232 HydrophobicContact CD2-CB 4.05Å; L165-L232 HydrophobicContact CD2-CD1 4.38Å; L165-L233 HydrophobicContact CB-CD2 4.09Å; L165-L233 HydrophobicContact CD1-CD2 4.12Å; L165-H236 HydrophobicContact CD1-CB 3.97Å
166L89.7Confident84.2Confident81 Ų8176.3 Ų76.342%0.42437%0.373SS..Hα-helixtrans-64.7-48.9175.8-178.466000111.8F126 L162 L163 I164 G168 T169 W170F126-L166 HydrophobicContact CD2-CB 4.37Å; F126-L166 HydrophobicContact CD2-CD1 4.29Å; F126-L166 HydrophobicContact CE2-CB 4.05Å; F126-L166 HydrophobicContact CE2-CD1 4.28Å; F126-L166 HydrophobicContact CE2-CD2 4.28Å; F126-L166 HydrophobicContact CE2-CG 4.44Å; F126-L166 HydrophobicContact CZ-CD2 4.48Å; L162-L166 WeakPolarHBondContact O-CB 3.19Å; L162-L166 PolarHBondContact O-N 3.18Å; L163-L166 PolarHBondContact O-N 2.88Å; I164-L166 VanDerWaalsContact C-N 3.34Å; I164-L166 PolarHBondContact O-N 2.88Å; L166-G168 VanDerWaalsContact C-N 3.34Å; L166-G168 PolarHBondContact O-N 3.44Å; L166-T169 PolarHBondContact O-OG1 3.42Å; L166-T169 VanDerWaalsContact O-OG1 3.09Å; L166-W170 WeakPolarHBondContact O-CB 3.33Å; L166-W170 PolarHBondContact O-N 3.39Å
167I88.9Confident82.4Confident101 Ų10177.1 Ų77.152%0.51837%0.374SS..Hα-helixtrans-62.6-43.4177.6-66167.3000110.4L163 I164 W170 A171L163-I167 HydrophobicContact CG-CD1 4.13Å; L163-I167 WeakPolarHBondContact O-CG1 3.18Å; L163-I167 PolarHBondContact O-N 3.44Å; I164-I167 PolarHBondContact O-N 3.17Å; I167-W170 PolarHBondContact O-N 2.89Å; I167-A171 WeakPolarHBondContact O-CB 3.26Å; I167-A171 PolarHBondContact O-N 3.4Å
168G85.2Confident80.6Confident12 Ų1285.6 Ų85.612%0.12440%0.4CS..Hα-helixtrans-65.3-45.417900000113.4I164 L166 A171 L172 H236I164-G168 PolarHBondContact O-N 3.25Å; L166-G168 VanDerWaalsContact C-N 3.34Å; L166-G168 PolarHBondContact O-N 3.44Å; G168-A171 PolarHBondContact O-N 3.44Å; G168-L172 PolarHBondContact O-N 3.04Å; G168-H236 VanDerWaalsContact CA-CE1 3.5Å; G168-H236 WeakPolarHBondContact CA-CE1 3.38Å; G168-H236 VanDerWaalsContact CA-NE2 3.35Å; G168-H236 WeakPolarHBondContact CA-NE2 3.42Å; G168-H236 PolarHBondContact O-CE1 2.87Å; G168-H236 VanDerWaalsContact O-CE1 3.3Å
169T82.5Confident78.9Confident32 Ų3287 Ų8720%0.19641%0.412CS..Hα-helixtrans-66.1-39.1176.549.80000111.8L165 L166 L172 F173L165-T169 HydrophobicContact CD1-CG2 4.4Å; L165-T169 HydrophobicContact CG-CG2 4.47Å; L165-T169 WeakPolarHBondContact O-CB 3.41Å; L165-T169 VanDerWaalsContact O-CG2 3.28Å; L165-T169 WeakPolarHBondContact O-CG2 3.48Å; L165-T169 PolarHBondContact O-N 2.98Å; L165-T169 PolarHBondContact O-OG1 3.37Å; L166-T169 PolarHBondContact O-OG1 3.42Å; L166-T169 VanDerWaalsContact O-OG1 3.09Å; T169-L172 PolarHBondContact O-N 3.47Å; T169-F173 WeakPolarHBondContact O-CB 3.42Å; T169-F173 WeakPolarHBondContact O-CD2 3.41Å; T169-F173 PolarHBondContact O-N 2.87Å
170W84Confident77.1Confident172 Ų17288.1 Ų88.165%0.65241%0.412SS*.Iπ-helixtrans-57.8-49.6170.2179.779.4000112L166 I167 L172 F174L166-W170 WeakPolarHBondContact O-CB 3.33Å; L166-W170 PolarHBondContact O-N 3.39Å; I167-W170 PolarHBondContact O-N 2.89Å; W170-L172 PolarHBondContact O-N 2.83Å; W170-F174 HydrophobicContact CG-CB 4.34Å; W170-F174 WeakPolarHBondContact O-CA 3.15Å; W170-F174 WeakPolarHBondContact O-CB 3.5Å; W170-F174 PolarHBondContact O-N 3.4Å
171A79.7Confident75.5Confident46 Ų4684.3 Ų84.338%0.3840%0.4SS..Iπ-helixtrans-63.2-34.5-179.200000114.1I167 G168 R175I167-A171 WeakPolarHBondContact O-CB 3.26Å; I167-A171 PolarHBondContact O-N 3.4Å; G168-A171 PolarHBondContact O-N 3.44Å; A171-R175 WeakPolarHBondContact O-CB 3.25Å
172L72.3Confident73.6Confident20 Ų2088 Ų8811%0.10543%0.428CS..Iπ-helixtrans-85.9-37.8179.7-70.6-173.7000114.4G168 T169 W170 H236 A239 I240 E244G168-L172 PolarHBondContact O-N 3.04Å; T169-L172 PolarHBondContact O-N 3.47Å; W170-L172 PolarHBondContact O-N 2.83Å; L172-H236 WeakPolarHBondContact CD1-CE1 3.46Å; L172-A239 HydrophobicContact CD1-CB 4.07Å; L172-I240 HydrophobicContact CD1-CG1 4.15Å; L172-I240 HydrophobicContact CD2-CG1 4.49Å; L172-E244 HydrophobicContact CD2-CG 4.31Å
173F67.7Low72.2Confident60 Ų6094 Ų9426%0.26345%0.449SS..Iπ-helixtrans-106.6-31.8-169.6-66.9-82.6000114.3T169 L192T169-F173 WeakPolarHBondContact O-CB 3.42Å; T169-F173 WeakPolarHBondContact O-CD2 3.41Å; T169-F173 PolarHBondContact O-N 2.87Å; F173-L192 HydrophobicContact CE1-CD2 4.4Å
174F65.1Low70.8Confident139 Ų13994.4 Ų94.461%0.6146%0.455SS*.Iπ-helixtrans-94.5-3.7-179.7-72.4-94.3000113.7W170 K176W170-F174 HydrophobicContact CG-CB 4.34Å; W170-F174 WeakPolarHBondContact O-CA 3.15Å; W170-F174 WeakPolarHBondContact O-CB 3.5Å; W170-F174 PolarHBondContact O-N 3.4Å; F174-K176 PolarHBondContact O-N 3.09Å; F174-K176 VanDerWaalsContact O-N 3.15Å
175R67.2Low69.7Low163 Ų16393 Ų9362%0.61545%0.446SS*.SBendtrans-62.4114.5171.1-172.9177.5-172.2-1703.9110A171 Q177A171-R175 WeakPolarHBondContact O-CB 3.25Å; R175-Q177 PolarHBondContact O-N 3.2Å
176K55.5Low69Low186 Ų18696.9 Ų96.981%0.80947%0.47SS*.  trans-46.5112.7-179-174.3175.1-177.3177.70110.9F174 R178F174-K176 PolarHBondContact O-N 3.09Å; F174-K176 VanDerWaalsContact O-N 3.15Å; K176-R178 PolarHBondContact O-N 2.91Å
177Q56.2Low68.4Low115 Ų11596.5 Ų96.554%0.53747%0.465SS..  trans-66.2125.9173.4-59.3-164.6-10400108.1R175R175-Q177 PolarHBondContact O-N 3.2Å
178R54.9Low68Low220 Ų22094.8 Ų94.883%0.8345%0.452SS*.SBendtrans-81.1-17.4-173.9-68.2-177.8176.1179.7-4113.8K176K176-R178 PolarHBondContact O-N 2.91Å
179A58.6Low67.9Low32 Ų3296 Ų9626%0.26446%0.461SS..SBendtrans-145.6142.5175.900000109.7L279A179-L279 HydrophobicContact CB-CD1 3.91Å; A179-L279 HydrophobicContact CB-CD2 3.84Å; A179-L279 HydrophobicContact CB-CG 4.4Å
180D54.7Low68.1Low101 Ų10199.3 Ų99.354%0.5448%0.477SS..  trans-80132.6175.1-71.7-70.5000111.2R111R111-D180 IonicContact CZ-OD1 2.85Å; R111-D180 IonicContact CZ-OD2 3.05Å; R111-D180 IonicContact NE-OD1 3.34Å; R111-D180 PolarHBondContact NE-OD1 3.28Å; R111-D180 IonicContact NE-OD2 2.66Å; R111-D180 IonicContact NH2-OD1 2.69Å; R111-D180 PolarHBondContact NH2-OD1 3.35Å; R111-D180 IonicContact NH2-OD2 3.77Å; R111-D180 PolarHBondContact NH2-OD2 2.89Å
181V59.3Low68.2Low55 Ų5591.3 Ų91.333%0.33345%0.447SS..  trans-109.1122.2173.4-790000109.1R183 Q275 L279V181-R183 PolarHBondContact O-N 3.19Å; V181-Q275 HydrophobicContact CG1-CG 4.21Å; V181-L279 HydrophobicContact CG1-CD1 3.45Å; V181-L279 VanDerWaalsContact CG1-CD1 3.45Å
182P56.1Low68.5Low117 Ų11790.8 Ų90.876%0.7644%0.437SS*.SBendtrans-66.36.4179.923.7-36.3000115.4Q275P182-Q275 VanDerWaalsContact CD-NE2 3.31Å
183R63.4Low69.4Low140 Ų14093.9 Ų93.953%0.52846%0.457SS..SBendtrans-142.2140.2-178.2-64.3-172.7-179.6-1711111.4V181V181-R183 PolarHBondContact O-N 3.19Å
184V62.8Low70.5Confident101 Ų10193.4 Ų93.461%0.61246%0.457SS*.  trans-68.1134.1176.8-174.60000109.9V186 A189V184-V186 PolarHBondContact O-N 3.45Å; V184-A189 HydrophobicContact CG1-CB 4.04Å
185F69.9Low71.8Confident53 Ų5388 Ų8823%0.23243%0.434CS..  trans-69.3122.6177.9-171.6-118.9000110.7F187 R188 A189 L243F185-F187 VanDerWaalsContact C-N 3.31Å; F185-F187 HydrophobicContact CD1-CB 3.98Å; F185-F187 HydrophobicContact CD1-CD2 4.4Å; F185-F187 HydrophobicContact CE1-CB 3.71Å; F185-F187 AromaticContact CE1-CD2 3.65Å; F185-F187 HydrophobicContact CE1-CD2 3.65Å; F185-F187 HydrophobicContact CE1-CG 4.13Å; F185-F187 HydrophobicContact CE2-CD2 4.33Å; F185-F187 AromaticContact CZ-CD2 3.61Å; F185-F187 HydrophobicContact CZ-CD2 3.61Å; F185-F187 HydrophobicContact CZ-CE2 4.36Å; F185-F187 PolarHBondContact O-N 3.14Å; F185-R188 HydrophobicContact CB-CB 4.29Å; F185-R188 HydrophobicContact CB-CG 4.44Å; F185-R188 HydrophobicContact CD1-CB 4.46Å; F185-R188 HydrophobicContact CD1-CG 4.14Å; F185-R188 WeakPolarHBondContact O-CA 3.28Å; F185-R188 WeakPolarHBondContact O-CB 3.44Å; F185-R188 PolarHBondContact O-N 3.47Å; F185-A189 PolarHBondContact O-N 3.01Å; F185-L243 HydrophobicContact CD1-CD2 3.83Å; F185-L243 HydrophobicContact CE1-CD2 3.58Å
186V76.3Confident72.9Confident89 Ų8985.6 Ų85.654%0.53943%0.428SS..Hα-helixtrans-54.1-42.9-171.3-178.20000112.6V184 R188 A189 L190V184-V186 PolarHBondContact O-N 3.45Å; V186-R188 PolarHBondContact O-N 3.35Å; V186-A189 PolarHBondContact O-N 2.91Å; V186-L190 WeakPolarHBondContact O-CB 3.33Å; V186-L190 PolarHBondContact O-N 3.37Å
187F76.8Confident74.7Confident72 Ų7281.6 Ų81.632%0.31642%0.416SS..Hα-helixtrans-67-34.8177.3-62.7-82.4000113F185 L191 L242 L243F185-F187 VanDerWaalsContact C-N 3.31Å; F185-F187 HydrophobicContact CD1-CB 3.98Å; F185-F187 HydrophobicContact CD1-CD2 4.4Å; F185-F187 HydrophobicContact CE1-CB 3.71Å; F185-F187 AromaticContact CE1-CD2 3.65Å; F185-F187 HydrophobicContact CE1-CD2 3.65Å; F185-F187 HydrophobicContact CE1-CG 4.13Å; F185-F187 HydrophobicContact CE2-CD2 4.33Å; F185-F187 AromaticContact CZ-CD2 3.61Å; F185-F187 HydrophobicContact CZ-CD2 3.61Å; F185-F187 HydrophobicContact CZ-CE2 4.36Å; F185-F187 PolarHBondContact O-N 3.14Å; F187-L191 WeakPolarHBondContact O-CB 3.14Å; F187-L191 WeakPolarHBondContact O-CD1 3.39Å; F187-L191 WeakPolarHBondContact O-CG 3.31Å; F187-L191 PolarHBondContact O-N 3.23Å; F187-L242 HydrophobicContact CD1-CD1 4.39Å; F187-L243 HydrophobicContact CB-CD2 4.18Å
188R80.8Confident76.5Confident66 Ų6679.6 Ų79.625%0.24941%0.405CS..Hα-helixtrans-66.5-42.9173.1-80.2178.4178.8-174.9-3.5110.7F185 V186 L191 L192 L243F185-R188 HydrophobicContact CB-CB 4.29Å; F185-R188 HydrophobicContact CB-CG 4.44Å; F185-R188 HydrophobicContact CD1-CB 4.46Å; F185-R188 HydrophobicContact CD1-CG 4.14Å; F185-R188 WeakPolarHBondContact O-CA 3.28Å; F185-R188 WeakPolarHBondContact O-CB 3.44Å; F185-R188 PolarHBondContact O-N 3.47Å; V186-R188 PolarHBondContact O-N 3.35Å; R188-L191 PolarHBondContact O-N 3Å; R188-L192 VanDerWaalsContact O-CG 3.28Å; R188-L192 WeakPolarHBondContact O-CG 3.44Å; R188-L192 PolarHBondContact O-N 3.32Å; R188-L243 HydrophobicContact CG-CD1 3.97Å; R188-L243 HydrophobicContact CG-CD2 3.95Å
189A82.6Confident78.3Confident38 Ų3869.4 Ų69.431%0.31437%0.367SS..Hα-helixtrans-61.2-46.1175.400000111.9V184 F185 V186 L191 L192 V193V184-A189 HydrophobicContact CG1-CB 4.04Å; F185-A189 PolarHBondContact O-N 3.01Å; V186-A189 PolarHBondContact O-N 2.91Å; A189-L191 PolarHBondContact O-N 2.83Å; A189-L192 PolarHBondContact O-N 3.48Å; A189-V193 WeakPolarHBondContact O-CG2 3.37Å; A189-V193 PolarHBondContact O-N 3.5Å
190L85.6Confident80Confident100 Ų10070.6 Ų70.652%0.52437%0.371SS..Hα-helixtrans-60.8-43.4176.7-174.4153.7000111.8V186 V193 L194V186-L190 WeakPolarHBondContact O-CB 3.33Å; V186-L190 PolarHBondContact O-N 3.37Å; L190-V193 PolarHBondContact O-N 3.35Å; L190-L194 WeakPolarHBondContact O-CB 3.48Å; L190-L194 PolarHBondContact O-N 3.34Å
191L86.7Confident81.9Confident5 Ų568.6 Ų68.63%0.02637%0.365CS..Hα-helixtrans-63.8-42175.8-72.9163.2000112F187 R188 A189 L194 I195 I235 A239 L243F187-L191 WeakPolarHBondContact O-CB 3.14Å; F187-L191 WeakPolarHBondContact O-CD1 3.39Å; F187-L191 WeakPolarHBondContact O-CG 3.31Å; F187-L191 PolarHBondContact O-N 3.23Å; R188-L191 PolarHBondContact O-N 3Å; A189-L191 PolarHBondContact O-N 2.83Å; L191-L194 PolarHBondContact O-N 3.49Å; L191-I195 WeakPolarHBondContact O-CB 3.37Å; L191-I195 WeakPolarHBondContact O-CD1 3.33Å; L191-I195 WeakPolarHBondContact O-CG1 3.47Å; L191-I195 PolarHBondContact O-N 3.21Å; L191-I235 HydrophobicContact CD2-CG2 4.15Å; L191-A239 HydrophobicContact CD1-CB 3.65Å; L191-A239 HydrophobicContact CD2-CB 4.22Å; L191-L243 HydrophobicContact CD1-CD1 4.2Å; L191-L243 HydrophobicContact CD1-CD2 4.42Å; L191-L243 HydrophobicContact CD1-CG 4.24Å
192L87Confident83.5Confident34 Ų3468 Ų6818%0.17836%0.357CS..Hα-helixtrans-64.1-41.7175.6-69.4169.2000111.8A118 L121 F173 R188 A189 I195 F196A118-L192 HydrophobicContact CB-CD1 4.28Å; A118-L192 HydrophobicContact CB-CD2 4.35Å; L121-L192 HydrophobicContact CD2-CB 4.15Å; L121-L192 HydrophobicContact CD2-CD2 3.84Å; L121-L192 VanDerWaalsContact CD2-O 3.3Å; L121-L192 WeakPolarHBondContact CD2-O 3.34Å; F173-L192 HydrophobicContact CE1-CD2 4.4Å; R188-L192 VanDerWaalsContact O-CG 3.28Å; R188-L192 WeakPolarHBondContact O-CG 3.44Å; R188-L192 PolarHBondContact O-N 3.32Å; A189-L192 PolarHBondContact O-N 3.48Å; L192-I195 PolarHBondContact O-N 3.25Å; L192-F196 WeakPolarHBondContact O-CB 3.48Å; L192-F196 PolarHBondContact O-N 3.21Å
193V89.9Confident85.4Confident86 Ų8667 Ų6752%0.52134%0.338SS..Hα-helixtrans-63.7-43.3174.5171.10000111.2A189 L190 F196 L197A189-V193 WeakPolarHBondContact O-CG2 3.37Å; A189-V193 PolarHBondContact O-N 3.5Å; L190-V193 PolarHBondContact O-N 3.35Å; V193-F196 PolarHBondContact O-N 2.97Å; V193-L197 HydrophobicContact CG1-CD1 4.06Å; V193-L197 HydrophobicContact CG1-CG 4.42Å; V193-L197 WeakPolarHBondContact O-CG 3.35Å; V193-L197 PolarHBondContact O-N 2.98Å
194L91.3Very high86.8Confident50 Ų5066 Ų6626%0.26234%0.343SS..Hα-helixtrans-60.2-48.4176.5-174.467.7000111.3L190 L191 F196 L197 F198 I235L190-L194 WeakPolarHBondContact O-CB 3.48Å; L190-L194 PolarHBondContact O-N 3.34Å; L191-L194 PolarHBondContact O-N 3.49Å; L194-F196 VanDerWaalsContact C-N 3.34Å; L194-F196 PolarHBondContact O-N 2.86Å; L194-L197 PolarHBondContact O-N 3.01Å; L194-F198 HydrophobicContact CD1-CD2 3.99Å; L194-F198 HydrophobicContact CD1-CE2 3.75Å; L194-F198 HydrophobicContact CG-CD2 4.2Å; L194-F198 HydrophobicContact CG-CE2 4.25Å; L194-F198 WeakPolarHBondContact O-CD2 3.31Å; L194-F198 PolarHBondContact O-N 2.61Å; L194-I235 HydrophobicContact CD2-CD1 4.35Å; L194-I235 HydrophobicContact CD2-CG1 4.1Å; L194-I235 HydrophobicContact CD2-CG2 4.25Å; L194-I235 HydrophobicContact CG-CD1 4.28Å
195I91.6Very high88.3Confident25 Ų2566.2 Ų66.213%0.12834%0.336CS..Hα-helixtrans-57.1-47.4175.4-72.2167.2000110.8L121 V125 L191 L192 F198 V199 I235L121-I195 HydrophobicContact CD1-CG2 4.38Å; L121-I195 HydrophobicContact CD2-CB 4.18Å; L121-I195 HydrophobicContact CD2-CG2 3.82Å; L121-I195 HydrophobicContact CG-CG2 3.96Å; V125-I195 HydrophobicContact CG2-CG2 3.29Å; L191-I195 WeakPolarHBondContact O-CB 3.37Å; L191-I195 WeakPolarHBondContact O-CD1 3.33Å; L191-I195 WeakPolarHBondContact O-CG1 3.47Å; L191-I195 PolarHBondContact O-N 3.21Å; L192-I195 PolarHBondContact O-N 3.25Å; I195-F198 PolarHBondContact O-N 3.21Å; I195-V199 HydrophobicContact CG2-CG2 4.38Å; I195-V199 WeakPolarHBondContact O-CB 3.23Å; I195-V199 WeakPolarHBondContact O-CG2 3.44Å; I195-V199 PolarHBondContact O-N 2.77Å; I195-I235 HydrophobicContact CD1-CG2 4.17Å; I195-I235 HydrophobicContact CG1-CG2 3.72Å
196F92.1Very high89.4Confident112 Ų11263.7 Ų63.749%0.49133%0.325SS..Hα-helixtrans-60.3-46.7178.8175.6-99.6000112.3L121 L192 V193 L194 F198 V199 V200L121-F196 HydrophobicContact CD1-CB 4.16Å; L121-F196 HydrophobicContact CD1-CD2 4.13Å; L121-F196 HydrophobicContact CD2-CB 4.31Å; L192-F196 WeakPolarHBondContact O-CB 3.48Å; L192-F196 PolarHBondContact O-N 3.21Å; V193-F196 PolarHBondContact O-N 2.97Å; L194-F196 VanDerWaalsContact C-N 3.34Å; L194-F196 PolarHBondContact O-N 2.86Å; F196-F198 PolarHBondContact O-N 3.4Å; F196-V199 PolarHBondContact O-N 3.42Å; F196-V200 HydrophobicContact CD1-CG2 4.46Å; F196-V200 HydrophobicContact CD2-CG2 4.21Å; F196-V200 HydrophobicContact CE1-CG2 4.08Å; F196-V200 HydrophobicContact CE2-CG2 3.8Å; F196-V200 HydrophobicContact CZ-CG2 3.74Å; F196-V200 WeakPolarHBondContact O-CB 3.42Å; F196-V200 WeakPolarHBondContact O-CG2 3.19Å; F196-V200 PolarHBondContact O-N 3.33Å
197L93.3Very high90.1Very high103 Ų10360.7 Ų60.754%0.53931%0.312SS..Hα-helixtrans-61.9-41.7178.1-70.5173.5000112.2V193 L194 S201V193-L197 HydrophobicContact CG1-CD1 4.06Å; V193-L197 HydrophobicContact CG1-CG 4.42Å; V193-L197 WeakPolarHBondContact O-CG 3.35Å; V193-L197 PolarHBondContact O-N 2.98Å; L194-L197 PolarHBondContact O-N 3.01Å; L197-S201 WeakPolarHBondContact O-CB 3.42Å; L197-S201 PolarHBondContact O-N 2.88Å; L197-S201 PolarHBondContact O-OG 3.3Å
198F92.6Very high90.8Very high72 Ų7261.7 Ų61.732%0.31632%0.324SS..Hα-helixtrans-64.5-46.9174.5-92.7-101.8000111.9L194 I195 F196 V200 S201 Y202 A231 I235L194-F198 HydrophobicContact CD1-CD2 3.99Å; L194-F198 HydrophobicContact CD1-CE2 3.75Å; L194-F198 HydrophobicContact CG-CD2 4.2Å; L194-F198 HydrophobicContact CG-CE2 4.25Å; L194-F198 WeakPolarHBondContact O-CD2 3.31Å; L194-F198 PolarHBondContact O-N 2.61Å; I195-F198 PolarHBondContact O-N 3.21Å; F196-F198 PolarHBondContact O-N 3.4Å; F198-V200 VanDerWaalsContact C-N 3.34Å; F198-V200 PolarHBondContact O-N 3.36Å; F198-S201 PolarHBondContact O-N 3.43Å; F198-S201 PolarHBondContact O-OG 3.46Å; F198-S201 VanDerWaalsContact O-OG 3.05Å; F198-Y202 HydrophobicContact CD1-CD2 4.47Å; F198-Y202 HydrophobicContact CD1-CE2 4.01Å; F198-Y202 WeakPolarHBondContact O-CB 3.47Å; F198-Y202 VanDerWaalsContact O-CD2 3.29Å; F198-Y202 WeakPolarHBondContact O-CD2 3.41Å; F198-Y202 PolarHBondContact O-N 2.89Å; F198-A231 HydrophobicContact CD1-CB 4.16Å; F198-A231 HydrophobicContact CE1-CB 4.17Å; F198-I235 HydrophobicContact CB-CD1 4.42Å; F198-I235 HydrophobicContact CD1-CD1 4.33Å; F198-I235 HydrophobicContact CD2-CD1 4.03Å; F198-I235 HydrophobicContact CE2-CD1 4.38Å; F198-I235 HydrophobicContact CG-CD1 4Å
199V92.8Very high91.2Very high7 Ų765.9 Ų65.94%0.04234%0.34CS..Hα-helixtrans-61.1-43.7179.4168.40000111.2V125 T128 I195 F196 W203 L232V125-V199 HydrophobicContact CG2-CG2 3.96Å; T128-V199 HydrophobicContact CG2-CG1 3.95Å; I195-V199 HydrophobicContact CG2-CG2 4.38Å; I195-V199 WeakPolarHBondContact O-CB 3.23Å; I195-V199 WeakPolarHBondContact O-CG2 3.44Å; I195-V199 PolarHBondContact O-N 2.77Å; F196-V199 PolarHBondContact O-N 3.42Å; V199-W203 VanDerWaalsContact O-CD1 3.31Å; V199-W203 PolarHBondContact O-N 2.99Å; V199-L232 HydrophobicContact CG2-CD2 4.47Å
200V94Very high91.4Very high56 Ų5664.5 Ų64.534%0.33933%0.327SS..Hα-helixtrans-67.5-43.6178.6172.70000111.8F196 F198 Y202 W203 L204F196-V200 HydrophobicContact CD1-CG2 4.46Å; F196-V200 HydrophobicContact CD2-CG2 4.21Å; F196-V200 HydrophobicContact CE1-CG2 4.08Å; F196-V200 HydrophobicContact CE2-CG2 3.8Å; F196-V200 HydrophobicContact CZ-CG2 3.74Å; F196-V200 WeakPolarHBondContact O-CB 3.42Å; F196-V200 WeakPolarHBondContact O-CG2 3.19Å; F196-V200 PolarHBondContact O-N 3.33Å; F198-V200 VanDerWaalsContact C-N 3.34Å; F198-V200 PolarHBondContact O-N 3.36Å; V200-Y202 VanDerWaalsContact C-N 3.34Å; V200-Y202 PolarHBondContact O-N 2.89Å; V200-W203 PolarHBondContact O-N 2.8Å; V200-L204 HydrophobicContact CG1-CD1 4.02Å; V200-L204 HydrophobicContact CG1-CG 4.39Å; V200-L204 WeakPolarHBondContact O-CG 3.41Å; V200-L204 PolarHBondContact O-N 2.88Å
201S94.3Very high91.5Very high60 Ų6062.1 Ų62.142%0.4231%0.314SS..Hα-helixtrans-64.7-38.9179.967.20000112.3L197 F198 L204 F205L197-S201 WeakPolarHBondContact O-CB 3.42Å; L197-S201 PolarHBondContact O-N 2.88Å; L197-S201 PolarHBondContact O-OG 3.3Å; F198-S201 PolarHBondContact O-N 3.43Å; F198-S201 PolarHBondContact O-OG 3.46Å; F198-S201 VanDerWaalsContact O-OG 3.05Å; S201-L204 PolarHBondContact O-N 2.82Å; S201-F205 PolarHBondContact O-N 3Å; S201-F205 VanDerWaalsContact O-N 3.1Å
202Y94.8Very high91.5Very high43 Ų4368.3 Ų68.317%0.16935%0.347CS..Hα-helixtrans-66.5-39.6173.9-89-102000112.5F198 V200 Y206 Y224 L228F198-Y202 HydrophobicContact CD1-CD2 4.47Å; F198-Y202 HydrophobicContact CD1-CE2 4.01Å; F198-Y202 WeakPolarHBondContact O-CB 3.47Å; F198-Y202 VanDerWaalsContact O-CD2 3.29Å; F198-Y202 WeakPolarHBondContact O-CD2 3.41Å; F198-Y202 PolarHBondContact O-N 2.89Å; V200-Y202 VanDerWaalsContact C-N 3.34Å; V200-Y202 PolarHBondContact O-N 2.89Å; Y202-Y206 WeakPolarHBondContact O-CB 3.31Å; Y202-Y206 PolarHBondContact O-N 3.41Å; Y202-Y224 WeakPolarHBondContact CA-OH 3.18Å; Y202-Y224 AromaticContact CD1-CE1 3.87Å; Y202-Y224 HydrophobicContact CD1-CE1 3.87Å; Y202-Y224 HydrophobicContact CD1-CE2 4.02Å; Y202-Y224 AromaticContact CD1-CZ 3.45Å; Y202-Y224 VanDerWaalsContact CD1-CZ 3.45Å; Y202-Y224 WeakPolarHBondContact CD1-OH 3.4Å; Y202-Y224 HydrophobicContact CE1-CE2 4.05Å; Y202-Y224 AromaticContact CE1-CZ 3.96Å; Y202-Y224 PolarHBondContact O-OH 2.67Å; Y202-Y224 VanDerWaalsContact O-OH 3.06Å; Y202-L228 HydrophobicContact CD1-CB 3.68Å; Y202-L228 HydrophobicContact CD1-CD1 3.96Å; Y202-L228 HydrophobicContact CD1-CD2 4.49Å; Y202-L228 HydrophobicContact CD1-CG 4.24Å; Y202-L228 HydrophobicContact CD2-CD1 4.05Å; Y202-L228 HydrophobicContact CE1-CB 3.71Å; Y202-L228 HydrophobicContact CE1-CD1 4.36Å; Y202-L228 HydrophobicContact CE2-CD1 4.44Å; Y202-L228 HydrophobicContact CG-CB 4.39Å; Y202-L228 HydrophobicContact CG-CD1 3.78Å; Y202-L228 HydrophobicContact CG-CG 4.49Å
203W94.8Very high91.4Very high94 Ų9470.3 Ų70.336%0.35636%0.364SS..Hα-helixtrans-62.5-43.6173.4-95109.3000113.3T128 A131 F132 V199 V200 Y206 G207T128-W203 HydrophobicContact CG2-CZ2 4.22Å; A131-W203 HydrophobicContact CB-CH2 4.33Å; A131-W203 HydrophobicContact CB-CZ2 4.33Å; F132-W203 HydrophobicContact CD1-CH2 4.42Å; F132-W203 HydrophobicContact CD1-CZ2 4.49Å; F132-W203 AromaticContact CE1-CD2 3.67Å; F132-W203 HydrophobicContact CE1-CD2 3.67Å; F132-W203 AromaticContact CE1-CE2 3.77Å; F132-W203 AromaticContact CE1-CE3 3.78Å; F132-W203 HydrophobicContact CE1-CE3 3.78Å; F132-W203 HydrophobicContact CE1-CG 4.23Å; F132-W203 HydrophobicContact CE1-CH2 4.07Å; F132-W203 AromaticContact CE1-CZ2 3.97Å; F132-W203 HydrophobicContact CE1-CZ2 3.97Å; F132-W203 AromaticContact CE1-CZ3 3.98Å; F132-W203 HydrophobicContact CE1-CZ3 3.98Å; F132-W203 HydrophobicContact CZ-CD2 4.17Å; F132-W203 HydrophobicContact CZ-CG 4.25Å; V199-W203 VanDerWaalsContact O-CD1 3.31Å; V199-W203 PolarHBondContact O-N 2.99Å; V200-W203 PolarHBondContact O-N 2.8Å; W203-Y206 HydrophobicContact CE3-CD1 4.42Å; W203-Y206 HydrophobicContact CZ3-CD1 4.34Å; W203-Y206 PolarHBondContact O-N 2.88Å; W203-G207 PolarHBondContact O-N 3.24Å
204L93.8Very high91Very high121 Ų12172.6 Ų72.663%0.63436%0.363SS*.Hα-helixtrans-63-45.3179.2-70.8170.9000111.3V200 S201 G207 V208V200-L204 HydrophobicContact CG1-CD1 4.02Å; V200-L204 HydrophobicContact CG1-CG 4.39Å; V200-L204 WeakPolarHBondContact O-CG 3.41Å; V200-L204 PolarHBondContact O-N 2.88Å; S201-L204 PolarHBondContact O-N 2.82Å; L204-G207 PolarHBondContact O-N 3.4Å; L204-V208 WeakPolarHBondContact O-CG2 3.42Å; L204-V208 PolarHBondContact O-N 3.38Å; L204-V208 VanDerWaalsContact O-N 3.16Å
205F93.4Very high90.6Very high105 Ų10572.7 Ų72.746%0.46136%0.364SS..Hα-helixtrans-67.3-41.6177.3-172.5-85000111.7S201 G207 V208 R209 Y224S201-F205 PolarHBondContact O-N 3Å; S201-F205 VanDerWaalsContact O-N 3.1Å; F205-G207 PolarHBondContact O-N 3.13Å; F205-V208 PolarHBondContact O-N 3.47Å; F205-R209 HydrophobicContact CD1-CB 4.13Å; F205-R209 HydrophobicContact CD1-CG 4.11Å; F205-R209 HydrophobicContact CD2-CG 4.18Å; F205-R209 HydrophobicContact CE1-CB 3.92Å; F205-R209 HydrophobicContact CE1-CG 3.82Å; F205-R209 HydrophobicContact CE2-CG 3.9Å; F205-R209 HydrophobicContact CG-CG 4.3Å; F205-R209 HydrophobicContact CZ-CB 4.31Å; F205-R209 HydrophobicContact CZ-CG 3.72Å; F205-R209 VanDerWaalsContact O-CB 3.27Å; F205-R209 WeakPolarHBondContact O-CB 3.32Å; F205-R209 PolarHBondContact O-N 3.4Å; F205-Y224 HydrophobicContact CD1-CD2 4.43Å; F205-Y224 AromaticContact CD1-CE2 3.54Å; F205-Y224 HydrophobicContact CD1-CE2 3.54Å; F205-Y224 AromaticContact CD1-CZ 3.62Å; F205-Y224 WeakPolarHBondContact CD1-OH 3.28Å; F205-Y224 HydrophobicContact CE1-CD2 4.36Å; F205-Y224 AromaticContact CE1-CE2 3.8Å; F205-Y224 HydrophobicContact CE1-CE2 3.8Å
206Y93.1Very high90.2Very high0 Ų075.6 Ų75.60%038%0.377CS..Hα-helixtrans-58.1-45.4174.2-176-92.8000112.3F132 L135 P136 Y202 W203 I210 L211 I221 Y224F132-Y206 HydrophobicContact CB-CD2 4.12Å; F132-Y206 HydrophobicContact CB-CE2 3.65Å; F132-Y206 AromaticContact CD1-CD1 3.83Å; F132-Y206 HydrophobicContact CD1-CD1 3.83Å; F132-Y206 AromaticContact CD1-CD2 3.69Å; F132-Y206 HydrophobicContact CD1-CD2 3.69Å; F132-Y206 AromaticContact CD1-CE1 3.89Å; F132-Y206 HydrophobicContact CD1-CE1 3.89Å; F132-Y206 AromaticContact CD1-CE2 3.79Å; F132-Y206 HydrophobicContact CD1-CE2 3.79Å; F132-Y206 AromaticContact CD1-CG 3.74Å; F132-Y206 HydrophobicContact CD1-CG 3.74Å; F132-Y206 AromaticContact CD1-CZ 3.9Å; F132-Y206 AromaticContact CD2-CD2 3.77Å; F132-Y206 HydrophobicContact CD2-CD2 3.77Å; F132-Y206 HydrophobicContact CD2-CE2 4.21Å; F132-Y206 HydrophobicContact CD2-CG 4.32Å; F132-Y206 AromaticContact CE1-CD1 3.75Å; F132-Y206 HydrophobicContact CE1-CD1 3.75Å; F132-Y206 AromaticContact CE1-CD2 3.97Å; F132-Y206 HydrophobicContact CE1-CD2 3.97Å; F132-Y206 HydrophobicContact CE1-CE1 4.27Å; F132-Y206 HydrophobicContact CE1-CE2 4.49Å; F132-Y206 AromaticContact CE1-CG 3.6Å; F132-Y206 HydrophobicContact CE1-CG 3.6Å; F132-Y206 HydrophobicContact CE2-CD2 4.05Å; F132-Y206 HydrophobicContact CE2-CG 4.2Å; F132-Y206 AromaticContact CG-CD2 3.59Å; F132-Y206 HydrophobicContact CG-CD2 3.59Å; F132-Y206 AromaticContact CG-CE2 3.63Å; F132-Y206 HydrophobicContact CG-CE2 3.63Å; F132-Y206 HydrophobicContact CG-CG 4.11Å; F132-Y206 HydrophobicContact CZ-CD1 4.42Å; F132-Y206 HydrophobicContact CZ-CD2 4.15Å; F132-Y206 AromaticContact CZ-CG 3.85Å; F132-Y206 HydrophobicContact CZ-CG 3.85Å; F132-Y206 PolarHBondContact O-OH 2.84Å; F132-Y206 VanDerWaalsContact O-OH 3.1Å; L135-Y206 HydrophobicContact CD2-CE1 4.32Å; P136-Y206 VanDerWaalsContact CD-OH 3.26Å; P136-Y206 WeakPolarHBondContact CD-OH 3.4Å; P136-Y206 VanDerWaalsContact CG-OH 3.25Å; P136-Y206 WeakPolarHBondContact CG-OH 3.43Å; Y202-Y206 WeakPolarHBondContact O-CB 3.31Å; Y202-Y206 PolarHBondContact O-N 3.41Å; W203-Y206 HydrophobicContact CE3-CD1 4.42Å; W203-Y206 HydrophobicContact CZ3-CD1 4.34Å; W203-Y206 PolarHBondContact O-N 2.88Å; Y206-I210 HydrophobicContact CD2-CB 4.16Å; Y206-I210 HydrophobicContact CD2-CD1 3.44Å; Y206-I210 VanDerWaalsContact CD2-CD1 3.44Å; Y206-I210 HydrophobicContact CD2-CG1 4.37Å; Y206-I210 HydrophobicContact CD2-CG2 4.37Å; Y206-I210 HydrophobicContact CE2-CB 4.13Å; Y206-I210 HydrophobicContact CE2-CD1 3.75Å; Y206-I210 HydrophobicContact CE2-CG2 3.83Å; Y206-I210 HydrophobicContact CG-CD1 4.34Å; Y206-I210 WeakPolarHBondContact O-CA 3.15Å; Y206-I210 WeakPolarHBondContact O-CB 3.32Å; Y206-I210 PolarHBondContact O-N 3.34Å; Y206-L211 HydrophobicContact CD1-CD1 4.04Å; Y206-L211 HydrophobicContact CD1-CD2 4.47Å; Y206-L211 HydrophobicContact CD1-CG 3.98Å; Y206-L211 HydrophobicContact CE1-CD1 3.83Å; Y206-L211 HydrophobicContact CE1-CD2 3.68Å; Y206-L211 HydrophobicContact CE1-CG 3.67Å; Y206-L211 PolarHBondContact O-N 3Å; Y206-I221 HydrophobicContact CE2-CG2 4.36Å; Y206-Y224 HydrophobicContact CD2-CD1 4.04Å; Y206-Y224 HydrophobicContact CD2-CE1 4.03Å
207G90.6Very high90.1Very high26 Ų2672.8 Ų72.827%0.26837%0.368SS..Iπ-helixtrans-57.5-51.8176.400000112.6W203 L204 F205 L211 D212W203-G207 PolarHBondContact O-N 3.24Å; L204-G207 PolarHBondContact O-N 3.4Å; F205-G207 PolarHBondContact O-N 3.13Å; G207-L211 WeakPolarHBondContact O-CB 3.3Å; G207-L211 PolarHBondContact O-N 2.88Å; G207-D212 PolarHBondContact O-N 2.94Å
208V92.4Very high89.8Confident92 Ų9269.5 Ų69.556%0.55835%0.348SS*.Iπ-helixtrans-74.9-35-176.31780000113.2L204 F205L204-V208 WeakPolarHBondContact O-CG2 3.42Å; L204-V208 PolarHBondContact O-N 3.38Å; L204-V208 VanDerWaalsContact O-N 3.16Å; F205-V208 PolarHBondContact O-N 3.47Å
209R87.8Confident89.7Confident155 Ų15570.6 Ų70.659%0.58535%0.353SS*.Iπ-helixtrans-100.8-17.4-171.5-69.4-66.6-165.5162.50115.7F205 S213F205-R209 HydrophobicContact CD1-CB 4.13Å; F205-R209 HydrophobicContact CD1-CG 4.11Å; F205-R209 HydrophobicContact CD2-CG 4.18Å; F205-R209 HydrophobicContact CE1-CB 3.92Å; F205-R209 HydrophobicContact CE1-CG 3.82Å; F205-R209 HydrophobicContact CE2-CG 3.9Å; F205-R209 HydrophobicContact CG-CG 4.3Å; F205-R209 HydrophobicContact CZ-CB 4.31Å; F205-R209 HydrophobicContact CZ-CG 3.72Å; F205-R209 VanDerWaalsContact O-CB 3.27Å; F205-R209 WeakPolarHBondContact O-CB 3.32Å; F205-R209 PolarHBondContact O-N 3.4Å; R209-S213 PolarHBondContact O-OG 2.93Å
210I87.5Confident89.5Confident9 Ų973.1 Ų73.15%0.04637%0.366CS..Iπ-helixtrans-120.3-41.2-177.6-65.9162.2000110.8Y206 R214 D215 I221 Y224Y206-I210 HydrophobicContact CD2-CB 4.16Å; Y206-I210 HydrophobicContact CD2-CD1 3.44Å; Y206-I210 VanDerWaalsContact CD2-CD1 3.44Å; Y206-I210 HydrophobicContact CD2-CG1 4.37Å; Y206-I210 HydrophobicContact CD2-CG2 4.37Å; Y206-I210 HydrophobicContact CE2-CB 4.13Å; Y206-I210 HydrophobicContact CE2-CD1 3.75Å; Y206-I210 HydrophobicContact CE2-CG2 3.83Å; Y206-I210 HydrophobicContact CG-CD1 4.34Å; Y206-I210 WeakPolarHBondContact O-CA 3.15Å; Y206-I210 WeakPolarHBondContact O-CB 3.32Å; Y206-I210 PolarHBondContact O-N 3.34Å; I210-R214 WeakPolarHBondContact O-CA 3.43Å; I210-R214 PolarHBondContact O-N 2.87Å; I210-D215 PolarHBondContact O-N 2.85Å; I210-I221 HydrophobicContact CG1-CG1 4.48Å; I210-I221 HydrophobicContact CG2-CD1 3.79Å; I210-I221 HydrophobicContact CG2-CG1 3.9Å; I210-I221 HydrophobicContact CG2-CG2 4.46Å; I210-Y224 HydrophobicContact CD1-CD1 3.84Å; I210-Y224 HydrophobicContact CD1-CE1 4.42Å; I210-Y224 HydrophobicContact CD1-CG 4.16Å
211L87Confident89.4Confident49 Ų4970.5 Ų70.526%0.25735%0.35SS..Iπ-helixtrans-83.4-48.4-179.6-56.7-176.1000113.5L135 L139 Y206 G207L135-L211 HydrophobicContact CD2-CD1 3.99Å; L135-L211 HydrophobicContact CD2-CD2 3.36Å; L135-L211 HydrophobicContact CD2-CG 4.33Å; L139-L211 HydrophobicContact CD1-CD2 4.4Å; Y206-L211 HydrophobicContact CD1-CD1 4.04Å; Y206-L211 HydrophobicContact CD1-CD2 4.47Å; Y206-L211 HydrophobicContact CD1-CG 3.98Å; Y206-L211 HydrophobicContact CE1-CD1 3.83Å; Y206-L211 HydrophobicContact CE1-CD2 3.68Å; Y206-L211 HydrophobicContact CE1-CG 3.67Å; Y206-L211 PolarHBondContact O-N 3Å; G207-L211 WeakPolarHBondContact O-CB 3.3Å; G207-L211 PolarHBondContact O-N 2.88Å
212D87.7Confident89.2Confident136 Ų13667.6 Ų67.673%0.72733%0.33SS*.Iπ-helixtrans-69.1-47-178.2-163.638.8000111.4G207 R214G207-D212 PolarHBondContact O-N 2.94Å; D212-R214 PolarHBondContact O-N 3.43Å
213S84.2Confident89.1Confident76 Ų7670.5 Ų70.553%0.53135%0.345SS..THydrogen-bonded Turntrans-85.62.8177.949.70000116R209 D215R209-S213 PolarHBondContact O-OG 2.93Å; S213-D215 PolarHBondContact O-N 3.14Å
214R82.7Confident89Confident133 Ų13367.8 Ų67.850%0.50234%0.335SS..THydrogen-bonded Turntrans41.166.5177.8-60.4-173-174.8-171.12.2114.7W140 E143 I210 D212 Q216W140-R214 HydrophobicContact CZ2-CB 4.4Å; E143-R214 IonicContact OE1-NH1 3.51Å; E143-R214 IonicContact OE2-NH1 3.88Å; I210-R214 WeakPolarHBondContact O-CA 3.43Å; I210-R214 PolarHBondContact O-N 2.87Å; D212-R214 PolarHBondContact O-N 3.43Å; R214-Q216 PolarHBondContact O-N 2.9Å
215D81.6Confident89Confident52 Ų5262 Ų6228%0.27831%0.305SS..  trans-69.6105.2-174.1-168.9-11.4000113.1W140 I210 S213 N217W140-D215 WeakPolarHBondContact CH2-O 3.43Å; W140-D215 VanDerWaalsContact CZ3-O 3.27Å; W140-D215 WeakPolarHBondContact CZ3-O 3.05Å; I210-D215 PolarHBondContact O-N 2.85Å; S213-D215 PolarHBondContact O-N 3.14Å; D215-N217 PolarHBondContact O-N 3.33Å; D215-N217 VanDerWaalsContact O-N 3.09Å; D215-N217 WeakPolarHBondContact OD1-CB 3.49Å; D215-N217 PolarHBondContact OD1-N 3.42Å
216Q84.6Confident89.1Confident86 Ų8657.5 Ų57.540%0.40229%0.286SS..  trans-65.8-11.3-177.7-61.8-172.3-16.200114.6E143 K145 R214 Y218E143-Q216 WeakPolarHBondContact O-CB 3.46Å; E143-Q216 VanDerWaalsContact O-CG 3.23Å; E143-Q216 WeakPolarHBondContact O-CG 3.17Å; K145-Q216 PolarHBondContact N-O 2.99Å; K145-Q216 VanDerWaalsContact N-O 3.11Å; R214-Q216 PolarHBondContact O-N 2.9Å; Q216-Y218 PolarHBondContact O-N 3.48Å
217N88.4Confident89.2Confident54 Ų5459.6 Ų59.629%0.28930%0.3SS..  trans-84.385.7178.5-69.5-9000111.8K145 D215 K219 D220 I221K145-N217 PolarHBondContact NZ-OD1 3.23Å; D215-N217 PolarHBondContact O-N 3.33Å; D215-N217 VanDerWaalsContact O-N 3.09Å; D215-N217 WeakPolarHBondContact OD1-CB 3.49Å; D215-N217 PolarHBondContact OD1-N 3.42Å; N217-K219 PolarHBondContact O-N 2.9Å; N217-D220 HydrophobicContact CB-CB 4.13Å; N217-D220 WeakPolarHBondContact CB-OD2 3.41Å; N217-D220 PolarHBondContact ND2-OD2 2.89Å; N217-D220 PolarHBondContact O-N 3.38Å; N217-I221 PolarHBondContact O-N 2.92Å
218Y88.3Confident89.3Confident33 Ų3358.4 Ų58.413%0.12929%0.288CS..Hα-helixtrans-54.1-31.2178.6-173.2-112.8000114.4I133 L144 C147 C151 L155 Q216 D220 I221 V222I133-Y218 VanDerWaalsContact CG2-OH 3.31Å; I133-Y218 WeakPolarHBondContact CG2-OH 3.46Å; L144-Y218 HydrophobicContact CD2-CD2 3.91Å; L144-Y218 HydrophobicContact CD2-CG 4.3Å; C147-Y218 HydrophobicContact CB-CD1 3.85Å; C147-Y218 HydrophobicContact CB-CE1 4.13Å; C151-Y218 VanDerWaalsContact SG-CD1 3.59Å; L155-Y218 HydrophobicContact CD1-CE1 4.4Å; Q216-Y218 PolarHBondContact O-N 3.48Å; Y218-D220 VanDerWaalsContact C-N 3.31Å; Y218-D220 PolarHBondContact O-N 3.41Å; Y218-I221 PolarHBondContact O-N 2.84Å; Y218-V222 HydrophobicContact CD1-CG2 4.01Å; Y218-V222 HydrophobicContact CD2-CG2 4.46Å; Y218-V222 HydrophobicContact CE1-CG2 3.61Å; Y218-V222 HydrophobicContact CE2-CG2 4.11Å; Y218-V222 HydrophobicContact CG-CG2 4.43Å; Y218-V222 WeakPolarHBondContact O-CG2 3.31Å; Y218-V222 PolarHBondContact O-N 3.42Å
219K89.7Confident89.5Confident95 Ų9554 Ų5441%0.41326%0.261SS..Hα-helixtrans-56.6-44173.1-178.1-161.7167.1-157.60112.2C151 N217 V222 Q223C151-K219 HydrophobicContact CB-CB 4.31Å; C151-K219 HydrophobicContact CB-CG 4.34Å; N217-K219 PolarHBondContact O-N 2.9Å; K219-V222 PolarHBondContact O-N 3.13Å; K219-Q223 WeakPolarHBondContact O-CB 3.49Å; K219-Q223 PolarHBondContact O-N 2.8Å
220D89.3Confident89.8Confident61 Ų6148.8 Ų48.833%0.32625%0.245SC..Hα-helixtrans-74.2-34.6-173.3-59.2-25.9000110.1N217 Y218 Q223 Y224N217-D220 HydrophobicContact CB-CB 4.13Å; N217-D220 WeakPolarHBondContact CB-OD2 3.41Å; N217-D220 PolarHBondContact ND2-OD2 2.89Å; N217-D220 PolarHBondContact O-N 3.38Å; Y218-D220 VanDerWaalsContact C-N 3.31Å; Y218-D220 PolarHBondContact O-N 3.41Å; D220-Q223 PolarHBondContact O-N 3.32Å; D220-Y224 WeakPolarHBondContact O-CB 3.46Å; D220-Y224 PolarHBondContact O-N 3.35Å
221I90.8Very high90.1Very high0 Ų049.2 Ų49.20%025%0.25CC..Hα-helixtrans-60.2-51.1168.5-57.4179.9000111.4F132 P136 W140 L144 Y206 I210 N217 Y218 Q223 Y224 A225F132-I221 WeakPolarHBondContact O-CG2 3.5Å; P136-I221 HydrophobicContact CB-CD1 4.01Å; P136-I221 HydrophobicContact CG-CD1 3.87Å; P136-I221 HydrophobicContact CG-CG2 4.11Å; W140-I221 HydrophobicContact CH2-CD1 4.02Å; L144-I221 HydrophobicContact CD2-CD1 4.37Å; Y206-I221 HydrophobicContact CE2-CG2 4.36Å; I210-I221 HydrophobicContact CG1-CG1 4.48Å; I210-I221 HydrophobicContact CG2-CD1 3.79Å; I210-I221 HydrophobicContact CG2-CG1 3.9Å; I210-I221 HydrophobicContact CG2-CG2 4.46Å; N217-I221 PolarHBondContact O-N 2.92Å; Y218-I221 PolarHBondContact O-N 2.84Å; I221-Q223 VanDerWaalsContact C-N 3.32Å; I221-Q223 PolarHBondContact O-N 3.14Å; I221-Y224 WeakPolarHBondContact O-CB 3.46Å; I221-Y224 PolarHBondContact O-N 3.15Å; I221-A225 PolarHBondContact O-N 2.73Å
222V91.6Very high90.4Very high0 Ų047.2 Ų47.20%024%0.239CC..Hα-helixtrans-62.9-41178.9173.20000110.5L154 L155 Y218 K219 Y224 A225 V226L154-V222 HydrophobicContact CB-CG1 3.65Å; L154-V222 HydrophobicContact CD1-CG1 4.43Å; L155-V222 HydrophobicContact CD2-CG1 3.88Å; L155-V222 HydrophobicContact CD2-CG2 3.86Å; L155-V222 HydrophobicContact CG-CG1 4.12Å; L155-V222 HydrophobicContact CG-CG2 4.42Å; Y218-V222 HydrophobicContact CD1-CG2 4.01Å; Y218-V222 HydrophobicContact CD2-CG2 4.46Å; Y218-V222 HydrophobicContact CE1-CG2 3.61Å; Y218-V222 HydrophobicContact CE2-CG2 4.11Å; Y218-V222 HydrophobicContact CG-CG2 4.43Å; Y218-V222 WeakPolarHBondContact O-CG2 3.31Å; Y218-V222 PolarHBondContact O-N 3.42Å; K219-V222 PolarHBondContact O-N 3.13Å; V222-Y224 VanDerWaalsContact C-N 3.32Å; V222-Y224 PolarHBondContact O-N 3.09Å; V222-A225 PolarHBondContact O-N 2.88Å; V222-V226 HydrophobicContact CG1-CG2 4.44Å; V222-V226 WeakPolarHBondContact O-CG2 3.18Å; V222-V226 PolarHBondContact O-N 2.73Å
223Q92.4Very high90.6Very high103 Ų10341.2 Ų41.248%0.48121%0.207SC..Hα-helixtrans-62.9-37.1175.2-176.1171.7-26.800112.2L154 K219 D220 I221 V226 S227L154-Q223 HydrophobicContact CD1-CB 4.21Å; K219-Q223 WeakPolarHBondContact O-CB 3.49Å; K219-Q223 PolarHBondContact O-N 2.8Å; D220-Q223 PolarHBondContact O-N 3.32Å; I221-Q223 VanDerWaalsContact C-N 3.32Å; I221-Q223 PolarHBondContact O-N 3.14Å; Q223-V226 PolarHBondContact O-N 2.88Å; Q223-S227 PolarHBondContact O-N 3.18Å; Q223-S227 VanDerWaalsContact O-N 3.1Å
224Y92.8Very high91.1Very high38 Ų3844.7 Ų44.715%0.14921%0.213CC..Hα-helixtrans-64.5-45.5172.8-175.7-102.8000111.9F132 Y202 F205 Y206 I210 D220 I221 V222 V226 S227 L228F132-Y224 HydrophobicContact CD2-CD1 4.12Å; F132-Y224 HydrophobicContact CD2-CE1 4.04Å; F132-Y224 HydrophobicContact CE2-CD1 4.27Å; F132-Y224 AromaticContact CE2-CE1 3.71Å; F132-Y224 HydrophobicContact CE2-CE1 3.71Å; Y202-Y224 WeakPolarHBondContact CA-OH 3.18Å; Y202-Y224 AromaticContact CD1-CE1 3.87Å; Y202-Y224 HydrophobicContact CD1-CE1 3.87Å; Y202-Y224 HydrophobicContact CD1-CE2 4.02Å; Y202-Y224 AromaticContact CD1-CZ 3.45Å; Y202-Y224 VanDerWaalsContact CD1-CZ 3.45Å; Y202-Y224 WeakPolarHBondContact CD1-OH 3.4Å; Y202-Y224 HydrophobicContact CE1-CE2 4.05Å; Y202-Y224 AromaticContact CE1-CZ 3.96Å; Y202-Y224 PolarHBondContact O-OH 2.67Å; Y202-Y224 VanDerWaalsContact O-OH 3.06Å; F205-Y224 HydrophobicContact CD1-CD2 4.43Å; F205-Y224 AromaticContact CD1-CE2 3.54Å; F205-Y224 HydrophobicContact CD1-CE2 3.54Å; F205-Y224 AromaticContact CD1-CZ 3.62Å; F205-Y224 WeakPolarHBondContact CD1-OH 3.28Å; F205-Y224 HydrophobicContact CE1-CD2 4.36Å; F205-Y224 AromaticContact CE1-CE2 3.8Å; F205-Y224 HydrophobicContact CE1-CE2 3.8Å; Y206-Y224 HydrophobicContact CD2-CD1 4.04Å; Y206-Y224 HydrophobicContact CD2-CE1 4.03Å; I210-Y224 HydrophobicContact CD1-CD1 3.84Å; I210-Y224 HydrophobicContact CD1-CE1 4.42Å; I210-Y224 HydrophobicContact CD1-CG 4.16Å; D220-Y224 WeakPolarHBondContact O-CB 3.46Å; D220-Y224 PolarHBondContact O-N 3.35Å; I221-Y224 WeakPolarHBondContact O-CB 3.46Å; I221-Y224 PolarHBondContact O-N 3.15Å; V222-Y224 VanDerWaalsContact C-N 3.32Å; V222-Y224 PolarHBondContact O-N 3.09Å; Y224-V226 PolarHBondContact O-N 3.18Å; Y224-S227 PolarHBondContact O-N 2.04Å; Y224-S227 VanDerWaalsContact O-N 3.13Å; Y224-S227 PolarHBondContact O-OG 3.49Å; Y224-L228 PolarHBondContact O-N 3.31Å
225A93.8Very high91.5Very high0 Ų039 Ų390%019%0.192CC..Hα-helixtrans-61.4-39.8174.800000112.5F132 I133 I221 V222 S227 L228 V229F132-A225 HydrophobicContact CB-CB 4.1Å; I133-A225 HydrophobicContact CD1-CB 4.04Å; I133-A225 HydrophobicContact CG1-CB 3.73Å; I221-A225 PolarHBondContact O-N 2.73Å; V222-A225 PolarHBondContact O-N 2.88Å; A225-S227 VanDerWaalsContact C-N 3.31Å; A225-S227 PolarHBondContact O-N 3.4Å; A225-L228 PolarHBondContact O-N 2.98Å; A225-V229 WeakPolarHBondContact O-CG2 3.45Å; A225-V229 PolarHBondContact O-N 3.09Å
226V94.4Very high91.9Very high10 Ų1037.2 Ų37.26%0.06118%0.182CC..Hα-helixtrans-57-45.2172.3174.50000110.8L154 V158 V222 Q223 Y224 L228 V229 D230L154-V226 HydrophobicContact CB-CG2 4.07Å; L154-V226 HydrophobicContact CD2-CG2 4.15Å; V158-V226 HydrophobicContact CG2-CB 4.3Å; V158-V226 HydrophobicContact CG2-CG2 3.39Å; V222-V226 HydrophobicContact CG1-CG2 4.44Å; V222-V226 WeakPolarHBondContact O-CG2 3.18Å; V222-V226 PolarHBondContact O-N 2.73Å; Q223-V226 PolarHBondContact O-N 2.88Å; Y224-V226 PolarHBondContact O-N 3.18Å; V226-L228 VanDerWaalsContact C-N 3.3Å; V226-L228 PolarHBondContact O-N 3.39Å; V226-V229 PolarHBondContact O-N 3.39Å; V226-V229 VanDerWaalsContact O-N 3.14Å; V226-D230 WeakPolarHBondContact CG1-OD2 3.45Å; V226-D230 PolarHBondContact O-N 2.84Å
227S95Very high92.1Very high43 Ų4338.4 Ų38.430%0.30118%0.184SC..Hα-helixtrans-63.8-33.5-178.779.90000113.4Q223 Y224 A225 A231Q223-S227 PolarHBondContact O-N 3.18Å; Q223-S227 VanDerWaalsContact O-N 3.1Å; Y224-S227 PolarHBondContact O-N 2.04Å; Y224-S227 VanDerWaalsContact O-N 3.13Å; Y224-S227 PolarHBondContact O-OG 3.49Å; A225-S227 VanDerWaalsContact C-N 3.31Å; A225-S227 PolarHBondContact O-N 3.4Å; S227-A231 PolarHBondContact O-N 3.42Å
228L94.1Very high92.1Very high1 Ų139.6 Ų39.61%0.00519%0.19CC..Hα-helixtrans-64.8-47.4172172.858.5000110.8P129 F132 Y202 Y224 A225 V226 D230 A231 L232P129-L228 HydrophobicContact CG-CD2 4.07Å; P129-L228 HydrophobicContact CG-CG 4.39Å; F132-L228 HydrophobicContact CD2-CD2 3.99Å; F132-L228 HydrophobicContact CE2-CD2 3.64Å; F132-L228 HydrophobicContact CZ-CD2 4.37Å; Y202-L228 HydrophobicContact CD1-CB 3.68Å; Y202-L228 HydrophobicContact CD1-CD1 3.96Å; Y202-L228 HydrophobicContact CD1-CD2 4.49Å; Y202-L228 HydrophobicContact CD1-CG 4.24Å; Y202-L228 HydrophobicContact CD2-CD1 4.05Å; Y202-L228 HydrophobicContact CE1-CB 3.71Å; Y202-L228 HydrophobicContact CE1-CD1 4.36Å; Y202-L228 HydrophobicContact CE2-CD1 4.44Å; Y202-L228 HydrophobicContact CG-CB 4.39Å; Y202-L228 HydrophobicContact CG-CD1 3.78Å; Y202-L228 HydrophobicContact CG-CG 4.49Å; Y224-L228 PolarHBondContact O-N 3.31Å; A225-L228 PolarHBondContact O-N 2.98Å; V226-L228 VanDerWaalsContact C-N 3.3Å; V226-L228 PolarHBondContact O-N 3.39Å; L228-D230 VanDerWaalsContact C-N 3.3Å; L228-D230 PolarHBondContact O-N 3.48Å; L228-A231 PolarHBondContact O-N 2.97Å; L228-L232 HydrophobicContact CD1-CD1 3.87Å; L228-L232 HydrophobicContact CD1-CG 4.06Å; L228-L232 HydrophobicContact CG-CD1 3.87Å; L228-L232 HydrophobicContact CG-CG 4.49Å; L228-L232 WeakPolarHBondContact O-CB 3.43Å; L228-L232 VanDerWaalsContact O-CG 3.26Å; L228-L232 WeakPolarHBondContact O-CG 3.4Å; L228-L232 PolarHBondContact O-N 2.82Å
229V95.1Very high92Very high0 Ų038.3 Ų38.30%019%0.186CC..Hα-helixtrans-63-38.2179.2-1780000111.3P129 V158 K161 L162 A225 V226 L232 L233P129-V229 HydrophobicContact CB-CG2 3.47Å; P129-V229 VanDerWaalsContact CB-CG2 3.47Å; P129-V229 HydrophobicContact CG-CG2 3.65Å; V158-V229 HydrophobicContact CG1-CG2 4.39Å; K161-V229 HydrophobicContact CB-CG1 3.47Å; K161-V229 VanDerWaalsContact CB-CG1 3.47Å; K161-V229 HydrophobicContact CD-CG1 4.24Å; K161-V229 HydrophobicContact CG-CG1 4.45Å; L162-V229 HydrophobicContact CD2-CG1 4.37Å; L162-V229 HydrophobicContact CD2-CG2 4.08Å; L162-V229 HydrophobicContact CG-CG2 4.43Å; A225-V229 WeakPolarHBondContact O-CG2 3.45Å; A225-V229 PolarHBondContact O-N 3.09Å; V226-V229 PolarHBondContact O-N 3.39Å; V226-V229 VanDerWaalsContact O-N 3.14Å; V229-L232 PolarHBondContact O-N 2.9Å; V229-L233 HydrophobicContact CG1-CD1 4.35Å; V229-L233 WeakPolarHBondContact O-CB 3Å; V229-L233 WeakPolarHBondContact O-CG 3.41Å; V229-L233 PolarHBondContact O-N 2.88Å
230D94.5Very high91.9Very high46 Ų4636.4 Ų36.425%0.24618%0.18CC..Hα-helixtrans-64.7-45.3175-74.3-32.9000111.9K161 V226 L228 L232 L233 F234K161-D230 WeakPolarHBondContact CD-OD1 3.34Å; K161-D230 WeakPolarHBondContact CE-OD1 3.37Å; K161-D230 IonicContact NZ-OD1 3.48Å; K161-D230 PolarHBondContact NZ-OD1 2.77Å; K161-D230 IonicContact NZ-OD2 2.98Å; K161-D230 PolarHBondContact NZ-OD2 3.46Å; V226-D230 WeakPolarHBondContact CG1-OD2 3.45Å; V226-D230 PolarHBondContact O-N 2.84Å; L228-D230 VanDerWaalsContact C-N 3.3Å; L228-D230 PolarHBondContact O-N 3.48Å; D230-L232 VanDerWaalsContact C-N 3.33Å; D230-L232 PolarHBondContact O-N 3.35Å; D230-L233 PolarHBondContact O-N 2.75Å; D230-F234 HydrophobicContact CB-CE2 4.44Å; D230-F234 WeakPolarHBondContact O-CD2 3.3Å; D230-F234 PolarHBondContact O-N 2.88Å
231A94.1Very high91.6Very high18 Ų1837 Ų3715%0.14919%0.185CC..Hα-helixtrans-59-42.917400000112.2F198 S227 L228 F234 I235F198-A231 HydrophobicContact CD1-CB 4.16Å; F198-A231 HydrophobicContact CE1-CB 4.17Å; S227-A231 PolarHBondContact O-N 3.42Å; L228-A231 PolarHBondContact O-N 2.97Å; A231-F234 PolarHBondContact O-N 2.86Å; A231-I235 WeakPolarHBondContact O-CG1 3.38Å; A231-I235 PolarHBondContact O-N 2.89Å
232L92.7Very high91.1Very high6 Ų638.9 Ų38.93%0.03120%0.195CC..Hα-helixtrans-64.2-40.1176.3-69.5166.6000112.3V125 P129 L165 V199 L228 V229 D230 I235 H236V125-L232 HydrophobicContact CG1-CD1 4.02Å; V125-L232 HydrophobicContact CG1-CD2 3.92Å; V125-L232 HydrophobicContact CG1-CG 4.45Å; V125-L232 HydrophobicContact CG2-CD2 4.15Å; P129-L232 HydrophobicContact CG-CD1 4.36Å; L165-L232 HydrophobicContact CD2-CB 4.05Å; L165-L232 HydrophobicContact CD2-CD1 4.38Å; V199-L232 HydrophobicContact CG2-CD2 4.47Å; L228-L232 HydrophobicContact CD1-CD1 3.87Å; L228-L232 HydrophobicContact CD1-CG 4.06Å; L228-L232 HydrophobicContact CG-CD1 3.87Å; L228-L232 HydrophobicContact CG-CG 4.49Å; L228-L232 WeakPolarHBondContact O-CB 3.43Å; L228-L232 VanDerWaalsContact O-CG 3.26Å; L228-L232 WeakPolarHBondContact O-CG 3.4Å; L228-L232 PolarHBondContact O-N 2.82Å; V229-L232 PolarHBondContact O-N 2.9Å; D230-L232 VanDerWaalsContact C-N 3.33Å; D230-L232 PolarHBondContact O-N 3.35Å; L232-I235 PolarHBondContact O-N 2.86Å; L232-H236 WeakPolarHBondContact O-CB 3.14Å; L232-H236 PolarHBondContact O-N 3.01Å
233L93.3Very high90.4Very high11 Ų1139 Ų396%0.05820%0.196CC..Hα-helixtrans-65.4-41.3173.6-79.5173.6000112.1K161 I164 L165 V229 D230 I235 H236 Y237K161-L233 HydrophobicContact CB-CD1 3.75Å; K161-L233 HydrophobicContact CD-CD1 4.26Å; K161-L233 HydrophobicContact CG-CD1 3.78Å; I164-L233 HydrophobicContact CG2-CD2 4.02Å; L165-L233 HydrophobicContact CB-CD2 4.09Å; L165-L233 HydrophobicContact CD1-CD2 4.12Å; V229-L233 HydrophobicContact CG1-CD1 4.35Å; V229-L233 WeakPolarHBondContact O-CB 3Å; V229-L233 WeakPolarHBondContact O-CG 3.41Å; V229-L233 PolarHBondContact O-N 2.88Å; D230-L233 PolarHBondContact O-N 2.75Å; L233-I235 PolarHBondContact O-N 3.22Å; L233-H236 CarbonylContact O-C 3.57Å; L233-H236 WeakPolarHBondContact O-CB 3.46Å; L233-H236 PolarHBondContact O-N 2.86Å; L233-H236 VanDerWaalsContact O-N 3.14Å; L233-Y237 HydrophobicContact CB-CE2 4.19Å; L233-Y237 WeakPolarHBondContact O-CD2 3.34Å; L233-Y237 PolarHBondContact O-N 3.02Å
234F93.3Very high89.7Confident148 Ų14837 Ų3765%0.64919%0.187SC*.Hα-helixtrans-62.5-41.3174.3-75.1-61.2000112.4D230 A231 H236 Y237 L238D230-F234 HydrophobicContact CB-CE2 4.44Å; D230-F234 WeakPolarHBondContact O-CD2 3.3Å; D230-F234 PolarHBondContact O-N 2.88Å; A231-F234 PolarHBondContact O-N 2.86Å; F234-H236 VanDerWaalsContact C-N 3.3Å; F234-H236 PolarHBondContact O-N 3.46Å; F234-Y237 PolarHBondContact O-N 3.32Å; F234-L238 WeakPolarHBondContact O-CB 3.22Å; F234-L238 PolarHBondContact O-N 2.86Å
235I91.4Very high88.9Confident13 Ų1339.8 Ų39.87%0.06720%0.203CC..Hα-helixtrans-64.1-37.1173.3-64.8164.9000110.8L191 L194 I195 F198 A231 L232 L233 L238 A239L191-I235 HydrophobicContact CD2-CG2 4.15Å; L194-I235 HydrophobicContact CD2-CD1 4.35Å; L194-I235 HydrophobicContact CD2-CG1 4.1Å; L194-I235 HydrophobicContact CD2-CG2 4.25Å; L194-I235 HydrophobicContact CG-CD1 4.28Å; I195-I235 HydrophobicContact CD1-CG2 4.17Å; I195-I235 HydrophobicContact CG1-CG2 3.72Å; F198-I235 HydrophobicContact CB-CD1 4.42Å; F198-I235 HydrophobicContact CD1-CD1 4.33Å; F198-I235 HydrophobicContact CD2-CD1 4.03Å; F198-I235 HydrophobicContact CE2-CD1 4.38Å; F198-I235 HydrophobicContact CG-CD1 4Å; A231-I235 WeakPolarHBondContact O-CG1 3.38Å; A231-I235 PolarHBondContact O-N 2.89Å; L232-I235 PolarHBondContact O-N 2.86Å; L233-I235 PolarHBondContact O-N 3.22Å; I235-L238 PolarHBondContact O-N 2.8Å; I235-A239 WeakPolarHBondContact O-CB 3.45Å; I235-A239 PolarHBondContact O-N 2.9Å
236H89.6Confident87.8Confident15 Ų1545.3 Ų45.37%0.06922%0.224CC..Hα-helixtrans-65.9-43.4175.2-176.567.5000112.8L165 G168 L172 L232 L233 F234 A239 I240L165-H236 HydrophobicContact CD1-CB 3.97Å; G168-H236 VanDerWaalsContact CA-CE1 3.5Å; G168-H236 WeakPolarHBondContact CA-CE1 3.38Å; G168-H236 VanDerWaalsContact CA-NE2 3.35Å; G168-H236 WeakPolarHBondContact CA-NE2 3.42Å; G168-H236 PolarHBondContact O-CE1 2.87Å; G168-H236 VanDerWaalsContact O-CE1 3.3Å; L172-H236 WeakPolarHBondContact CD1-CE1 3.46Å; L232-H236 WeakPolarHBondContact O-CB 3.14Å; L232-H236 PolarHBondContact O-N 3.01Å; L233-H236 CarbonylContact O-C 3.57Å; L233-H236 WeakPolarHBondContact O-CB 3.46Å; L233-H236 PolarHBondContact O-N 2.86Å; L233-H236 VanDerWaalsContact O-N 3.14Å; F234-H236 VanDerWaalsContact C-N 3.3Å; F234-H236 PolarHBondContact O-N 3.46Å; H236-A239 WeakPolarHBondContact O-CA 3.22Å; H236-A239 VanDerWaalsContact O-CB 3.31Å; H236-A239 WeakPolarHBondContact O-CB 3.48Å; H236-A239 PolarHBondContact O-N 3.24Å; H236-A239 VanDerWaalsContact O-N 3.13Å; H236-I240 PolarHBondContact O-N 3.35Å
237Y90.1Very high86.7Confident112 Ų11246.1 Ų46.144%0.43923%0.227SC..Hα-helixtrans-63.5-41.1173.8-64-47.3000111.8L233 F234 A239 I240 V241L233-Y237 HydrophobicContact CB-CE2 4.19Å; L233-Y237 WeakPolarHBondContact O-CD2 3.34Å; L233-Y237 PolarHBondContact O-N 3.02Å; F234-Y237 PolarHBondContact O-N 3.32Å; Y237-A239 VanDerWaalsContact C-N 3.28Å; Y237-A239 PolarHBondContact O-N 3.42Å; Y237-I240 HydrophobicContact CD1-CD1 4.32Å; Y237-I240 PolarHBondContact O-N 2.84Å; Y237-V241 WeakPolarHBondContact O-CG2 3.36Å; Y237-V241 PolarHBondContact O-N 3Å
238L88.6Confident85.6Confident78 Ų7850.2 Ų50.241%0.40825%0.245SC..Hα-helixtrans-59.8-39171.7-179.762.4000111.6F234 I235 V241 L242F234-L238 WeakPolarHBondContact O-CB 3.22Å; F234-L238 PolarHBondContact O-N 2.86Å; I235-L238 PolarHBondContact O-N 2.8Å; L238-V241 PolarHBondContact O-N 2.84Å; L238-L242 HydrophobicContact CD1-CD1 3.91Å; L238-L242 HydrophobicContact CD1-CG 4.03Å; L238-L242 HydrophobicContact CG-CD1 3.87Å; L238-L242 HydrophobicContact CG-CG 4.36Å; L238-L242 WeakPolarHBondContact O-CB 3.35Å; L238-L242 VanDerWaalsContact O-CG 3.32Å; L238-L242 WeakPolarHBondContact O-CG 3.33Å; L238-L242 PolarHBondContact O-N 3.2Å
239A86.4Confident84.8Confident6 Ų657 Ų575%0.0528%0.277CS..Hα-helixtrans-62.1-44.517400000111.9L172 L191 I235 H236 Y237 V241 L242 L243L172-A239 HydrophobicContact CD1-CB 4.07Å; L191-A239 HydrophobicContact CD1-CB 3.65Å; L191-A239 HydrophobicContact CD2-CB 4.22Å; I235-A239 WeakPolarHBondContact O-CB 3.45Å; I235-A239 PolarHBondContact O-N 2.9Å; H236-A239 WeakPolarHBondContact O-CA 3.22Å; H236-A239 VanDerWaalsContact O-CB 3.31Å; H236-A239 WeakPolarHBondContact O-CB 3.48Å; H236-A239 PolarHBondContact O-N 3.24Å; H236-A239 VanDerWaalsContact O-N 3.13Å; Y237-A239 VanDerWaalsContact C-N 3.28Å; Y237-A239 PolarHBondContact O-N 3.42Å; A239-V241 VanDerWaalsContact C-N 3.33Å; A239-V241 PolarHBondContact O-N 2.93Å; A239-L242 PolarHBondContact O-N 3.33Å; A239-L243 HydrophobicContact CB-CD1 4.38Å; A239-L243 WeakPolarHBondContact O-CB 3.3Å; A239-L243 WeakPolarHBondContact O-CG 3.38Å; A239-L243 PolarHBondContact O-N 3.43Å
240I85.8Confident84.1Confident56 Ų5660.8 Ų60.829%0.28730%0.302SS..Hα-helixtrans-59.1-44.9174.8-65.8167.2000110.9L172 H236 Y237 E244 L245L172-I240 HydrophobicContact CD1-CG1 4.15Å; L172-I240 HydrophobicContact CD2-CG1 4.49Å; H236-I240 PolarHBondContact O-N 3.35Å; Y237-I240 HydrophobicContact CD1-CD1 4.32Å; Y237-I240 PolarHBondContact O-N 2.84Å; I240-E244 PolarHBondContact O-N 3Å; I240-L245 HydrophobicContact CG2-CD1 4.38Å; I240-L245 PolarHBondContact O-N 2.75Å
241V83.8Confident83.7Confident73 Ų7361.4 Ų61.444%0.44230%0.304SS..Iπ-helixtrans-62.1-47179.3174.10000111.9Y237 L238 A239 L245 R246Y237-V241 WeakPolarHBondContact O-CG2 3.36Å; Y237-V241 PolarHBondContact O-N 3Å; L238-V241 PolarHBondContact O-N 2.84Å; A239-V241 VanDerWaalsContact C-N 3.33Å; A239-V241 PolarHBondContact O-N 2.93Å; V241-L245 HydrophobicContact CB-CD1 4.46Å; V241-L245 HydrophobicContact CG2-CD1 3.89Å; V241-R246 PolarHBondContact O-N 3.39Å
242L79.6Confident83.6Confident39 Ų3961 Ų6120%0.20430%0.298CS..Iπ-helixtrans-75.6-33.5-177.4-67.5176.1000113.7F187 L238 A239F187-L242 HydrophobicContact CD1-CD1 4.39Å; L238-L242 HydrophobicContact CD1-CD1 3.91Å; L238-L242 HydrophobicContact CD1-CG 4.03Å; L238-L242 HydrophobicContact CG-CD1 3.87Å; L238-L242 HydrophobicContact CG-CG 4.36Å; L238-L242 WeakPolarHBondContact O-CB 3.35Å; L238-L242 VanDerWaalsContact O-CG 3.32Å; L238-L242 WeakPolarHBondContact O-CG 3.33Å; L238-L242 PolarHBondContact O-N 3.2Å; A239-L242 PolarHBondContact O-N 3.33Å
243L78.3Confident83.6Confident4 Ų462.8 Ų62.82%0.02131%0.31CS..Iπ-helixtrans-95.6-29.3-171.9-59.6-176.9000114.4F185 F187 R188 L191 A239 Q247F185-L243 HydrophobicContact CD1-CD2 3.83Å; F185-L243 HydrophobicContact CE1-CD2 3.58Å; F187-L243 HydrophobicContact CB-CD2 4.18Å; R188-L243 HydrophobicContact CG-CD1 3.97Å; R188-L243 HydrophobicContact CG-CD2 3.95Å; L191-L243 HydrophobicContact CD1-CD1 4.2Å; L191-L243 HydrophobicContact CD1-CD2 4.42Å; L191-L243 HydrophobicContact CD1-CG 4.24Å; A239-L243 HydrophobicContact CB-CD1 4.38Å; A239-L243 WeakPolarHBondContact O-CB 3.3Å; A239-L243 WeakPolarHBondContact O-CG 3.38Å; A239-L243 PolarHBondContact O-N 3.43Å; L243-Q247 VanDerWaalsContact O-CD 3.24Å; L243-Q247 PolarHBondContact O-NE2 3.13Å; L243-Q247 PolarHBondContact O-OE1 2.96Å
244E77.3Confident83.7Confident61 Ų6162.2 Ų62.229%0.28531%0.307SS..Iπ-helixtrans-117.1-61.3-176.9-60.3-66.5145.500111.5L172 I240 R246 Q247L172-E244 HydrophobicContact CD2-CG 4.31Å; I240-E244 PolarHBondContact O-N 3Å; E244-R246 PolarHBondContact O-N 3.25Å; E244-Q247 PolarHBondContact O-N 3.43Å; E244-Q247 VanDerWaalsContact O-N 3.09Å
245L75.1Confident83.8Confident95 Ų9558.1 Ų58.150%0.49729%0.29SS..Iπ-helixtrans-58.9-42.2-171-77.9160.9000113.6I240 V241 Q247 L248I240-L245 HydrophobicContact CG2-CD1 4.38Å; I240-L245 PolarHBondContact O-N 2.75Å; V241-L245 HydrophobicContact CB-CD1 4.46Å; V241-L245 HydrophobicContact CG2-CD1 3.89Å; L245-Q247 PolarHBondContact O-N 3.19Å; L245-Q247 VanDerWaalsContact O-N 3.08Å; L245-L248 HydrophobicContact CD2-CD1 4.47Å; L245-L248 PolarHBondContact O-N 3.23Å
246R71.6Confident84Confident117 Ų11757.5 Ų57.544%0.44229%0.287SS..Hα-helixtrans-59.6-21.3-179.8-171.1177.8179.1174.54.4114.2V241 E244 H271V241-R246 PolarHBondContact O-N 3.39Å; E244-R246 PolarHBondContact O-N 3.25Å; R246-H271 HydrophobicContact CG-CB 4.12Å
247Q71.4Confident84.2Confident26 Ų2658.7 Ų58.712%0.12130%0.295CS..Hα-helixtrans-97.4-15.2-173.8-65.9161.231.300113.3L243 E244 L245 L272L243-Q247 VanDerWaalsContact O-CD 3.24Å; L243-Q247 PolarHBondContact O-NE2 3.13Å; L243-Q247 PolarHBondContact O-OE1 2.96Å; E244-Q247 PolarHBondContact O-N 3.43Å; E244-Q247 VanDerWaalsContact O-N 3.09Å; L245-Q247 PolarHBondContact O-N 3.19Å; L245-Q247 VanDerWaalsContact O-N 3.08Å; Q247-L272 HydrophobicContact CB-CD2 4.13Å; Q247-L272 HydrophobicContact CG-CD2 3.7Å
248L72.7Confident84.3Confident130 Ų13053.4 Ų53.468%0.68127%0.274SS*.Hα-helixtrans-75-25.9-177.5-66.6173.8000113.4L245 P250L245-L248 HydrophobicContact CD2-CD1 4.47Å; L245-L248 PolarHBondContact O-N 3.23Å; L248-P250 WeakPolarHBondContact O-CD 3.43Å
249Q76.3Confident84.3Confident142 Ų14252.7 Ų52.766%0.66428%0.276SS*.SBendtrans-80.5115.1176.1-70.1-174.3-16.600110.2M251 G270Q249-M251 PolarHBondContact O-N 2.89Å; Q249-G270 WeakPolarHBondContact O-CA 3.12Å
250P80.8Confident84.2Confident81 Ų8154.4 Ų54.453%0.52629%0.286SS..  trans-68.3125.5175.828.8-33.4000109.9L248 I499L248-P250 WeakPolarHBondContact O-CD 3.43Å; P250-I499 HydrophobicContact CB-CD1 4.11Å
251M85.6Confident84Confident59 Ų5955 Ų5529%0.29129%0.289SS..  trans-123.8-19.1176.1-176169.3-64.300112.6Q249 L269 H271 K498 I499Q249-M251 PolarHBondContact O-N 2.89Å; M251-L269 PolarHBondContact N-O 3.43Å; M251-H271 WeakPolarHBondContact CE-NE2 3.41Å; M251-H271 PolarHBondContact SD-CE1 3.12Å; M251-H271 PolarHBondContact SD-NE2 2.98Å; M251-K498 HydrophobicContact CG-CG 4.28Å; M251-I499 PolarHBondContact O-N 3.4Å
252F91.3Very high84.1Confident8 Ų853.6 Ų53.64%0.03529%0.29CS..EExtended strand (participates in β ladder)trans-125.4140.7-178.2-56.5-80.6000110.9L254 S268 L269 H271 L477 V496 K497 K498F252-L254 HydrophobicContact CB-CD1 4.38Å; F252-S268 CarbonylContact O-C 3.6Å; F252-S268 WeakPolarHBondContact O-CA 3.42Å; F252-L269 PolarHBondContact N-O 3.35Å; F252-L269 PolarHBondContact O-N 3.37Å; F252-H271 AromaticContact CE2-ND1 3.92Å; F252-L477 HydrophobicContact CB-CD1 4.4Å; F252-L477 HydrophobicContact CD2-CB 3.88Å; F252-L477 HydrophobicContact CD2-CD1 4.13Å; F252-L477 HydrophobicContact CE2-CB 3.88Å; F252-L477 HydrophobicContact CG-CB 4.21Å; F252-L477 HydrophobicContact CG-CD1 4.39Å; F252-L477 HydrophobicContact CZ-CB 4.21Å; F252-L477 WeakPolarHBondContact CZ-O 3.38Å; F252-V496 HydrophobicContact CB-CG1 4.04Å; F252-V496 HydrophobicContact CD1-CG1 3.86Å; F252-V496 HydrophobicContact CG-CG1 4.14Å; F252-K497 CarbonylContact C-O 3.57Å; F252-K497 VanDerWaalsContact CA-O 3.28Å; F252-K497 WeakPolarHBondContact CA-O 3.46Å; F252-K498 HydrophobicContact CD1-CB 4.26Å; F252-K498 HydrophobicContact CE1-CB 4.28Å; F252-K498 HydrophobicContact CE1-CG 4.4Å
253T93.4Very high84.6Confident44 Ų4453.1 Ų53.127%0.2729%0.287SS..EExtended strand (participates in β ladder)trans-105.8122.9165.4-56.80000108F266 Y267 K497 I499T253-F266 HydrophobicContact CG2-CB 4.28Å; T253-F266 HydrophobicContact CG2-CD1 4.2Å; T253-Y267 CarbonylContact C-O 3.6Å; T253-Y267 WeakPolarHBondContact CA-O 3.21Å; T253-K497 PolarHBondContact N-O 3.14Å; T253-K497 PolarHBondContact O-N 3.12Å; T253-I499 WeakPolarHBondContact OG1-CG1 3.44Å
254L94.9Very high85.2Confident0 Ų055.3 Ų55.30%030%0.302CS..EExtended strand (participates in β ladder)trans-101123176.7-60.987.2000108.6F252 F266 Y267 L269 A277 V281 L477 F483 V494 N495 V496F252-L254 HydrophobicContact CB-CD1 4.38Å; L254-F266 WeakPolarHBondContact O-CA 3.48Å; L254-Y267 PolarHBondContact N-O 3.41Å; L254-Y267 PolarHBondContact O-N 3.26Å; L254-L269 HydrophobicContact CD1-CB 3.74Å; L254-L269 HydrophobicContact CD1-CD1 3.49Å; L254-L269 VanDerWaalsContact CD1-CD1 3.49Å; L254-L269 HydrophobicContact CD1-CG 3.56Å; L254-L269 HydrophobicContact CD2-CD1 4.05Å; L254-L269 HydrophobicContact CG-CD1 4.44Å; L254-A277 HydrophobicContact CD2-CB 4.33Å; L254-V281 HydrophobicContact CD2-CG2 4.38Å; L254-L477 HydrophobicContact CD1-CD1 4.38Å; L254-L477 HydrophobicContact CD2-CD1 4.42Å; L254-F483 HydrophobicContact CD2-CE1 4Å; L254-F483 HydrophobicContact CD2-CZ 4.09Å; L254-V494 HydrophobicContact CB-CG1 3.9Å; L254-V494 HydrophobicContact CD2-CG1 3.65Å; L254-V494 HydrophobicContact CG-CG1 4.29Å; L254-N495 CarbonylContact C-O 3.48Å; L254-N495 WeakPolarHBondContact CA-O 3.36Å; L254-V496 HydrophobicContact CD2-CG2 3.99Å; L254-V496 HydrophobicContact CG-CG2 4.18Å
255Q95.6Very high86Confident61 Ų6157 Ų5729%0.28531%0.306SS..EExtended strand (participates in β ladder)trans-89.1112166.6-176.9179.54.500107.9V257 F266 V494 N495Q255-V257 HydrophobicContact CG-CG2 3.93Å; Q255-F266 HydrophobicContact CB-CD1 3.88Å; Q255-F266 HydrophobicContact CB-CE1 3.63Å; Q255-F266 HydrophobicContact CG-CD1 4.1Å; Q255-F266 HydrophobicContact CG-CE1 3.51Å; Q255-F266 HydrophobicContact CG-CZ 3.89Å; Q255-V494 WeakPolarHBondContact O-CA 3.36Å; Q255-N495 HydrophobicContact CB-CB 4.45Å; Q255-N495 PolarHBondContact N-O 3.02Å; Q255-N495 PolarHBondContact O-N 2.83Å
256V95.6Very high86.9Confident0 Ų058.8 Ų58.80%031%0.31CS..EExtended strand (participates in β ladder)trans-100.1123.5176.2-1780000107.5S264 R265 Y267 V281 F289 L492 V494V256-S264 CarbonylContact O-C 3.5Å; V256-S264 WeakPolarHBondContact O-CA 3.42Å; V256-S264 WeakPolarHBondContact O-CB 3.13Å; V256-R265 PolarHBondContact N-O 2.97Å; V256-R265 PolarHBondContact O-N 2.84Å; V256-Y267 HydrophobicContact CB-CD2 4.41Å; V256-Y267 HydrophobicContact CB-CE2 4.18Å; V256-Y267 HydrophobicContact CG2-CD2 3.64Å; V256-Y267 HydrophobicContact CG2-CE2 3.82Å; V256-V281 HydrophobicContact CB-CG1 4.41Å; V256-V281 HydrophobicContact CG1-CG1 3.81Å; V256-V281 HydrophobicContact CG2-CB 4.38Å; V256-V281 HydrophobicContact CG2-CG1 3.65Å; V256-V281 HydrophobicContact CG2-CG2 3.81Å; V256-F289 HydrophobicContact CB-CE2 4.48Å; V256-F289 HydrophobicContact CB-CZ 4.05Å; V256-F289 HydrophobicContact CG1-CE2 4.17Å; V256-F289 HydrophobicContact CG1-CZ 3.69Å; V256-L492 HydrophobicContact CG1-CB 4.04Å; V256-L492 HydrophobicContact CG1-CD1 4.37Å; V256-L492 HydrophobicContact CG1-CD2 4.46Å; V256-V494 HydrophobicContact CG1-CG2 4.35Å; V256-V494 HydrophobicContact CG2-CG1 4.03Å; V256-V494 HydrophobicContact CG2-CG2 4.16Å
257V94.7Very high87.9Confident41 Ų4154.2 Ų54.225%0.24829%0.293CS..EExtended strand (participates in β ladder)trans-124.6127.6-179.5-170.40000109.6Q255 E263 L492 V493Q255-V257 HydrophobicContact CG-CG2 3.93Å; V257-E263 WeakPolarHBondContact CA-O 3.38Å; V257-L492 CarbonylContact O-C 3.56Å; V257-L492 WeakPolarHBondContact O-CA 3.36Å; V257-V493 PolarHBondContact N-O 3Å; V257-V493 PolarHBondContact O-N 3.21Å
258R91.2Very high88.9Confident0 Ų056.7 Ų56.70%031%0.313CS..EExtended strand (participates in β ladder)trans-77125.7171.7179.9161.362-153.3-0.8109.9T260 D261 G262 E263 Y285 F289 T290 F490 L492R258-T260 PolarHBondContact O-N 3.02Å; R258-D261 WeakPolarHBondContact CB-OD1 3.19Å; R258-D261 WeakPolarHBondContact CG-OD1 3.42Å; R258-D261 IonicContact CZ-OD1 3.96Å; R258-D261 IonicContact CZ-OD2 3.84Å; R258-D261 VanDerWaalsContact NE-CG 3.33Å; R258-D261 IonicContact NE-OD1 3.92Å; R258-D261 PolarHBondContact NE-OD1 3.45Å; R258-D261 IonicContact NE-OD2 2.83Å; R258-D261 PolarHBondContact NE-OD2 2.69Å; R258-D261 IonicContact NH2-OD1 3.18Å; R258-D261 IonicContact NH2-OD2 2.69Å; R258-D261 PolarHBondContact NH2-OD2 3.3Å; R258-G262 WeakPolarHBondContact O-CA 3.49Å; R258-G262 PolarHBondContact O-N 2.87Å; R258-E263 IonicContact CZ-OE2 3.47Å; R258-E263 PolarHBondContact N-O 3.36Å; R258-E263 IonicContact NH2-OE2 3.07Å; R258-E263 PolarHBondContact NH2-OE2 2.89Å; R258-Y285 PolarHBondContact NH1-OH 3.29Å; R258-F289 HydrophobicContact CB-CE1 4.33Å; R258-T290 PolarHBondContact NH1-O 2.92Å; R258-T290 PolarHBondContact NH2-O 3.02Å; R258-T290 PolarHBondContact NH2-OG1 3.04Å; R258-F490 HydrophobicContact CG-CD2 3.74Å; R258-F490 HydrophobicContact CG-CE2 4.18Å; R258-F490 HydrophobicContact CG-CG 4.43Å; R258-L492 HydrophobicContact CB-CD2 3.88Å; R258-L492 HydrophobicContact CG-CD2 4.27Å
259S88.9Confident89.7Confident63 Ų6351.4 Ų51.444%0.44129%0.285SS..THydrogen-bonded Turntrans-70.9-14.2-168.359.90000115.4S491S259-S491 WeakPolarHBondContact CB-O 3.38Å; S259-S491 VanDerWaalsContact CB-OG 3.32Å; S259-S491 WeakPolarHBondContact CB-OG 3.37Å; S259-S491 PolarHBondContact N-O 3.33Å; S259-S491 PolarHBondContact OG-N 2.95Å; S259-S491 PolarHBondContact OG-O 3.3Å; S259-S491 PolarHBondContact OG-OG 3.49Å
260T83.9Confident90.2Very high43 Ų4344.8 Ų44.826%0.26426%0.256SS..THydrogen-bonded Turntrans-95.3-39.4-173.743.50000113.7R258 Y292 L297 F490R258-T260 PolarHBondContact O-N 3.02Å; T260-Y292 HydrophobicContact CG2-CE2 4.11Å; T260-Y292 WeakPolarHBondContact OG1-CE2 3.35Å; T260-L297 VanDerWaalsContact O-CD1 3.25Å; T260-L297 WeakPolarHBondContact O-CD1 3.4Å; T260-L297 WeakPolarHBondContact O-CD2 3.17Å; T260-F490 HydrophobicContact CG2-CB 3.51Å
261D82.8Confident90.3Very high67 Ų6744 Ų4436%0.35824%0.244SC..THydrogen-bonded Turntrans-121.5-8.6-177.666.4-16.9000114.4R258 E263 L297R258-D261 WeakPolarHBondContact CB-OD1 3.19Å; R258-D261 WeakPolarHBondContact CG-OD1 3.42Å; R258-D261 IonicContact CZ-OD1 3.96Å; R258-D261 IonicContact CZ-OD2 3.84Å; R258-D261 VanDerWaalsContact NE-CG 3.33Å; R258-D261 IonicContact NE-OD1 3.92Å; R258-D261 PolarHBondContact NE-OD1 3.45Å; R258-D261 IonicContact NE-OD2 2.83Å; R258-D261 PolarHBondContact NE-OD2 2.69Å; R258-D261 IonicContact NH2-OD1 3.18Å; R258-D261 IonicContact NH2-OD2 2.69Å; R258-D261 PolarHBondContact NH2-OD2 3.3Å; D261-E263 VanDerWaalsContact C-N 3.3Å; D261-E263 PolarHBondContact O-N 3.37Å; D261-E263 PolarHBondContact OD1-N 3.31Å; D261-L297 HydrophobicContact CB-CD1 4.45Å; D261-L297 HydrophobicContact CB-CD2 4.03Å
262G85.9Confident90.2Very high44 Ų4441.8 Ų41.845%0.45423%0.234SC..  trans7511.718000000114.8R258 S264R258-G262 WeakPolarHBondContact O-CA 3.49Å; R258-G262 PolarHBondContact O-N 2.87Å; G262-S264 PolarHBondContact O-N 2.96Å
263E88.3Confident90.1Very high30 Ų3042 Ų4214%0.1424%0.236CC..  trans-57.2129.2170.7-172.8179.5176.300108.2V257 R258 D261 R265 F289 T290V257-E263 WeakPolarHBondContact CA-O 3.38Å; R258-E263 IonicContact CZ-OE2 3.47Å; R258-E263 PolarHBondContact N-O 3.36Å; R258-E263 IonicContact NH2-OE2 3.07Å; R258-E263 PolarHBondContact NH2-OE2 2.89Å; D261-E263 VanDerWaalsContact C-N 3.3Å; D261-E263 PolarHBondContact O-N 3.37Å; D261-E263 PolarHBondContact OD1-N 3.31Å; E263-R265 IonicContact OE1-CZ 2.73Å; E263-R265 IonicContact OE1-NE 3.47Å; E263-R265 PolarHBondContact OE1-NE 3.39Å; E263-R265 IonicContact OE1-NH2 3Å; E263-R265 PolarHBondContact OE1-NH2 3.45Å; E263-F289 HydrophobicContact CB-CD1 4.22Å; E263-F289 HydrophobicContact CB-CE1 4.35Å; E263-F289 HydrophobicContact CG-CD1 3.96Å; E263-F289 HydrophobicContact CG-CE1 4.21Å; E263-F289 WeakPolarHBondContact O-CE1 3.14Å; E263-T290 PolarHBondContact OE1-N 3.5Å; E263-T290 WeakPolarHBondContact OE2-CB 3.37Å; E263-T290 PolarHBondContact OE2-N 3.4Å; E263-T290 PolarHBondContact OE2-OG1 3.5Å
264S92.8Very high89.9Confident49 Ų4939.9 Ų39.934%0.34322%0.223SC..EExtended strand (participates in β ladder)trans-131.7142-178.267.90000113V256 G262V256-S264 CarbonylContact O-C 3.5Å; V256-S264 WeakPolarHBondContact O-CA 3.42Å; V256-S264 WeakPolarHBondContact O-CB 3.13Å; G262-S264 PolarHBondContact O-N 2.96Å
265R93.1Very high89.6Confident98 Ų9841 Ų4137%0.3723%0.229SC..EExtended strand (participates in β ladder)trans-133.8154.7176.9-60-63.9177.5137.64.4109.9V256 E263 Y267 D288 F289V256-R265 PolarHBondContact N-O 2.97Å; V256-R265 PolarHBondContact O-N 2.84Å; E263-R265 IonicContact OE1-CZ 2.73Å; E263-R265 IonicContact OE1-NE 3.47Å; E263-R265 PolarHBondContact OE1-NE 3.39Å; E263-R265 IonicContact OE1-NH2 3Å; E263-R265 PolarHBondContact OE1-NH2 3.45Å; R265-Y267 HydrophobicContact CB-CE2 3.88Å; R265-D288 PolarHBondContact NH2-O 3.17Å; R265-F289 HydrophobicContact CB-CD2 4.46Å; R265-F289 HydrophobicContact CB-CE2 3.65Å; R265-F289 HydrophobicContact CB-CZ 3.88Å; R265-F289 HydrophobicContact CG-CD2 3.79Å; R265-F289 HydrophobicContact CG-CE1 4.3Å; R265-F289 HydrophobicContact CG-CE2 3.41Å; R265-F289 VanDerWaalsContact CG-CE2 3.41Å; R265-F289 HydrophobicContact CG-CG 4.41Å; R265-F289 HydrophobicContact CG-CZ 3.69Å
266F93.9Very high89.2Confident131 Ų13142.2 Ų42.258%0.57523%0.231SC*.EExtended strand (participates in β ladder)trans-116.5133179.9-63.9-89.1000110.1T253 L254 Q255T253-F266 HydrophobicContact CG2-CB 4.28Å; T253-F266 HydrophobicContact CG2-CD1 4.2Å; L254-F266 WeakPolarHBondContact O-CA 3.48Å; Q255-F266 HydrophobicContact CB-CD1 3.88Å; Q255-F266 HydrophobicContact CB-CE1 3.63Å; Q255-F266 HydrophobicContact CG-CD1 4.1Å; Q255-F266 HydrophobicContact CG-CE1 3.51Å; Q255-F266 HydrophobicContact CG-CZ 3.89Å
267Y93.3Very high88.9Confident22 Ų2242.2 Ų42.29%0.08623%0.231CC..EExtended strand (participates in β ladder)trans-129.8133.2-179.4-59.4-64.4000111.3T253 L254 V256 R265 N284 D288 F289T253-Y267 CarbonylContact C-O 3.6Å; T253-Y267 WeakPolarHBondContact CA-O 3.21Å; L254-Y267 PolarHBondContact N-O 3.41Å; L254-Y267 PolarHBondContact O-N 3.26Å; V256-Y267 HydrophobicContact CB-CD2 4.41Å; V256-Y267 HydrophobicContact CB-CE2 4.18Å; V256-Y267 HydrophobicContact CG2-CD2 3.64Å; V256-Y267 HydrophobicContact CG2-CE2 3.82Å; R265-Y267 HydrophobicContact CB-CE2 3.88Å; Y267-N284 HydrophobicContact CD1-CB 4.14Å; Y267-N284 WeakPolarHBondContact CD1-ND2 3.47Å; Y267-N284 HydrophobicContact CE1-CB 3.53Å; Y267-N284 HydrophobicContact CE2-CB 4.08Å; Y267-N284 VanDerWaalsContact CZ-CB 3.48Å; Y267-N284 PolarHBondContact OH-O 2.96Å; Y267-D288 VanDerWaalsContact CE1-OD2 3.29Å; Y267-D288 WeakPolarHBondContact CE1-OD2 3.39Å; Y267-D288 PolarHBondContact OH-OD2 3.4Å; Y267-F289 HydrophobicContact CE2-CE2 4.22Å; Y267-F289 WeakPolarHBondContact OH-CE2 3.33Å
268S91.5Very high88.8Confident78 Ų7840.5 Ų40.555%0.54522%0.22SC..EExtended strand (participates in β ladder)trans-94121.7175-57.80000110.3F252F252-S268 CarbonylContact O-C 3.6Å; F252-S268 WeakPolarHBondContact O-CA 3.42Å
269L90Very high88.7Confident18 Ų1842.5 Ų42.59%0.09423%0.231CC..EExtended strand (participates in β ladder)trans-126.3152.4178.3-60.8-178.6000111.5M251 F252 L254 L272 A277 V280M251-L269 PolarHBondContact N-O 3.43Å; F252-L269 PolarHBondContact N-O 3.35Å; F252-L269 PolarHBondContact O-N 3.37Å; L254-L269 HydrophobicContact CD1-CB 3.74Å; L254-L269 HydrophobicContact CD1-CD1 3.49Å; L254-L269 VanDerWaalsContact CD1-CD1 3.49Å; L254-L269 HydrophobicContact CD1-CG 3.56Å; L254-L269 HydrophobicContact CD2-CD1 4.05Å; L254-L269 HydrophobicContact CG-CD1 4.44Å; L269-L272 HydrophobicContact CB-CD1 4.13Å; L269-L272 HydrophobicContact CD1-CD1 4.02Å; L269-L272 HydrophobicContact CD2-CD1 4.19Å; L269-L272 HydrophobicContact CG-CD1 4.34Å; L269-A277 HydrophobicContact CD1-CB 3.92Å; L269-V280 HydrophobicContact CD1-CB 4.49Å; L269-V280 HydrophobicContact CD2-CB 4.33Å; L269-V280 HydrophobicContact CD2-CG1 3.68Å
270G86.1Confident88.7Confident4 Ų441 Ų414%0.04122%0.219CC..  trans-84-158.2170.900000113.6Q249 L272Q249-G270 WeakPolarHBondContact O-CA 3.12Å; G270-L272 VanDerWaalsContact C-N 3.32Å; G270-L272 PolarHBondContact O-N 3.19Å
271H82.9Confident89.1Confident63 Ų6339 Ų3929%0.29221%0.207SC..SBendtrans-71.882.3177.9-72.5-70.9000112.5R246 M251 F252R246-H271 HydrophobicContact CG-CB 4.12Å; M251-H271 WeakPolarHBondContact CE-NE2 3.41Å; M251-H271 PolarHBondContact SD-CE1 3.12Å; M251-H271 PolarHBondContact SD-NE2 2.98Å; F252-H271 AromaticContact CE2-ND1 3.92Å
272L85Confident89.4Confident14 Ų1436.9 Ų36.97%0.07320%0.195CC..  trans-103.7161.4172.8-62.6173000110.8Q247 L269 G270 R276 A277 V280 G476 L477Q247-L272 HydrophobicContact CB-CD2 4.13Å; Q247-L272 HydrophobicContact CG-CD2 3.7Å; L269-L272 HydrophobicContact CB-CD1 4.13Å; L269-L272 HydrophobicContact CD1-CD1 4.02Å; L269-L272 HydrophobicContact CD2-CD1 4.19Å; L269-L272 HydrophobicContact CG-CD1 4.34Å; G270-L272 VanDerWaalsContact C-N 3.32Å; G270-L272 PolarHBondContact O-N 3.19Å; L272-R276 HydrophobicContact CB-CB 4.46Å; L272-R276 HydrophobicContact CD2-CG 4.02Å; L272-A277 HydrophobicContact CB-CB 4.37Å; L272-V280 HydrophobicContact CD1-CG2 4.43Å; L272-G476 CarbonylContact O-C 3.55Å; L272-G476 WeakPolarHBondContact O-CA 3.49Å; L272-L477 PolarHBondContact O-N 3.06Å
273S87.9Confident89.5Confident12 Ų1239.3 Ų39.38%0.08420%0.195CC..BIsolated β-bridgetrans-75.9157.2163.159.10000110.6Q275 R276 A277 N475S273-Q275 PolarHBondContact O-N 2.7Å; S273-R276 PolarHBondContact O-N 3.36Å; S273-R276 PolarHBondContact OG-N 3.03Å; S273-A277 WeakPolarHBondContact O-CB 3.37Å; S273-A277 PolarHBondContact O-N 2.78Å; S273-N475 CarbonylContact C-O 3.6Å; S273-N475 WeakPolarHBondContact CA-O 3.46Å; S273-N475 WeakPolarHBondContact CB-O 3.47Å
274I90.1Very high89.5Confident0 Ų039.6 Ų39.60%020%0.197CC..Hα-helixtrans-52.2-44.3175.6-59.3167.2000110.2R276 A277 A278 L467 E471 N475 L477 I481 F483I274-R276 PolarHBondContact O-N 3.43Å; I274-A277 PolarHBondContact O-N 2.98Å; I274-A278 VanDerWaalsContact O-CB 3.3Å; I274-A278 WeakPolarHBondContact O-CB 3.35Å; I274-A278 PolarHBondContact O-N 2.99Å; I274-L467 HydrophobicContact CG2-CD1 4.3Å; I274-L467 HydrophobicContact CG2-CD2 4.37Å; I274-E471 HydrophobicContact CD1-CB 3.94Å; I274-N475 PolarHBondContact N-O 3.48Å; I274-L477 HydrophobicContact CG1-CD2 4.3Å; I274-I481 HydrophobicContact CD1-CD1 4.14Å; I274-I481 HydrophobicContact CD1-CG2 4.33Å; I274-I481 HydrophobicContact CG1-CD1 4.44Å; I274-F483 HydrophobicContact CG2-CB 4.02Å; I274-F483 HydrophobicContact CG2-CD1 3.82Å; I274-F483 HydrophobicContact CG2-CD2 4.29Å; I274-F483 HydrophobicContact CG2-CE1 4.3Å; I274-F483 HydrophobicContact CG2-CG 3.8Å
275Q88.8Confident89.3Confident23 Ų2337.4 Ų37.411%0.10718%0.182CC..Hα-helixtrans-60.3-38.7176.5-174.4175.8800114.2V181 P182 S273 L279 L467 V473V181-Q275 HydrophobicContact CG1-CG 4.21Å; P182-Q275 VanDerWaalsContact CD-NE2 3.31Å; S273-Q275 PolarHBondContact O-N 2.7Å; Q275-L279 PolarHBondContact O-N 2.87Å; Q275-L467 HydrophobicContact CB-CD2 4.27Å; Q275-V473 HydrophobicContact CB-CB 4.33Å; Q275-V473 WeakPolarHBondContact CB-O 3.43Å; Q275-V473 PolarHBondContact N-O 3.34Å
276R86.1Confident88.9Confident87 Ų8734.4 Ų34.433%0.32817%0.171SC..Hα-helixtrans-81.6-33.7179.4-170.3168.3173.5-173.4-5.6111.9L272 S273 I274 A278 L279 V280L272-R276 HydrophobicContact CB-CB 4.46Å; L272-R276 HydrophobicContact CD2-CG 4.02Å; S273-R276 PolarHBondContact O-N 3.36Å; S273-R276 PolarHBondContact OG-N 3.03Å; I274-R276 PolarHBondContact O-N 3.43Å; R276-A278 VanDerWaalsContact C-N 3.33Å; R276-L279 PolarHBondContact O-N 3.49Å; R276-V280 PolarHBondContact O-N 3.02Å
277A90.5Very high88.4Confident0 Ų034.1 Ų34.10%017%0.169CC..Hα-helixtrans-61.7-42.3170.900000111.3L254 L269 L272 S273 I274 L279 V280 V281 L477 F483L254-A277 HydrophobicContact CD2-CB 4.33Å; L269-A277 HydrophobicContact CD1-CB 3.92Å; L272-A277 HydrophobicContact CB-CB 4.37Å; S273-A277 WeakPolarHBondContact O-CB 3.37Å; S273-A277 PolarHBondContact O-N 2.78Å; I274-A277 PolarHBondContact O-N 2.98Å; A277-L279 PolarHBondContact O-N 3.15Å; A277-V280 PolarHBondContact O-N 2.98Å; A277-V281 WeakPolarHBondContact O-CG2 3.5Å; A277-V281 PolarHBondContact O-N 2.94Å; A277-L477 HydrophobicContact CB-CD1 3.87Å; A277-L477 HydrophobicContact CB-CD2 3.9Å; A277-L477 HydrophobicContact CB-CG 4.14Å; A277-F483 HydrophobicContact CB-CZ 4.34Å
278A91.5Very high88Confident4 Ų435 Ų353%0.03318%0.176CC..Hα-helixtrans-54.8-46173.300000113.1I274 R276 V281 L282 L467 F483 L485I274-A278 VanDerWaalsContact O-CB 3.3Å; I274-A278 WeakPolarHBondContact O-CB 3.35Å; I274-A278 PolarHBondContact O-N 2.99Å; R276-A278 VanDerWaalsContact C-N 3.33Å; A278-V281 WeakPolarHBondContact O-CB 3.37Å; A278-V281 PolarHBondContact O-N 2.94Å; A278-L282 WeakPolarHBondContact O-CG 3.31Å; A278-L282 PolarHBondContact O-N 2.86Å; A278-L467 HydrophobicContact CB-CD1 4.1Å; A278-L467 HydrophobicContact CB-CD2 4.06Å; A278-F483 HydrophobicContact CB-CE2 3.92Å; A278-L485 HydrophobicContact CB-CD1 4.25Å; A278-L485 HydrophobicContact CB-CD2 3.78Å; A278-L485 HydrophobicContact CB-CG 4.42Å
279L89.2Confident87.8Confident42 Ų4231.4 Ų31.422%0.2215%0.15CC..Hα-helixtrans-62.8-43.2177-70.6175000112.5A179 V181 Q275 R276 A277 V281 L282 E283A179-L279 HydrophobicContact CB-CD1 3.91Å; A179-L279 HydrophobicContact CB-CD2 3.84Å; A179-L279 HydrophobicContact CB-CG 4.4Å; V181-L279 HydrophobicContact CG1-CD1 3.45Å; V181-L279 VanDerWaalsContact CG1-CD1 3.45Å; Q275-L279 PolarHBondContact O-N 2.87Å; R276-L279 PolarHBondContact O-N 3.49Å; A277-L279 PolarHBondContact O-N 3.15Å; L279-V281 VanDerWaalsContact C-N 3.3Å; L279-V281 PolarHBondContact O-N 2.96Å; L279-L282 PolarHBondContact O-N 3.04Å; L279-L282 VanDerWaalsContact O-N 3.13Å; L279-E283 WeakPolarHBondContact O-CG 3.43Å; L279-E283 PolarHBondContact O-N 3.47Å
280V89.4Confident87.5Confident33 Ų3332.7 Ų32.720%0.216%0.159CC..Hα-helixtrans-65.5-35.1176.3-179.50000111.5L269 L272 R276 A277 L282 E283 N284L269-V280 HydrophobicContact CD1-CB 4.49Å; L269-V280 HydrophobicContact CD2-CB 4.33Å; L269-V280 HydrophobicContact CD2-CG1 3.68Å; L272-V280 HydrophobicContact CD1-CG2 4.43Å; R276-V280 PolarHBondContact O-N 3.02Å; A277-V280 PolarHBondContact O-N 2.98Å; V280-L282 VanDerWaalsContact C-N 3.35Å; V280-E283 PolarHBondContact O-N 3.29Å; V280-N284 WeakPolarHBondContact O-CB 3.23Å; V280-N284 PolarHBondContact O-N 3.12Å; V280-N284 PolarHBondContact O-ND2 3.33Å
281V92.3Very high87.2Confident1 Ų133.3 Ų33.31%0.00616%0.161CC..Hα-helixtrans-63.2-39.5171.7166.70000111.4L254 V256 A277 A278 L279 Y285 L485 L492 V494L254-V281 HydrophobicContact CD2-CG2 4.38Å; V256-V281 HydrophobicContact CB-CG1 4.41Å; V256-V281 HydrophobicContact CG1-CG1 3.81Å; V256-V281 HydrophobicContact CG2-CB 4.38Å; V256-V281 HydrophobicContact CG2-CG1 3.65Å; V256-V281 HydrophobicContact CG2-CG2 3.81Å; A277-V281 WeakPolarHBondContact O-CG2 3.5Å; A277-V281 PolarHBondContact O-N 2.94Å; A278-V281 WeakPolarHBondContact O-CB 3.37Å; A278-V281 PolarHBondContact O-N 2.94Å; L279-V281 VanDerWaalsContact C-N 3.3Å; L279-V281 PolarHBondContact O-N 2.96Å; V281-Y285 VanDerWaalsContact O-CB 3.27Å; V281-Y285 WeakPolarHBondContact O-CB 3.35Å; V281-Y285 PolarHBondContact O-N 3.44Å; V281-L485 HydrophobicContact CB-CD1 4.14Å; V281-L485 HydrophobicContact CG1-CD1 3.72Å; V281-L492 HydrophobicContact CG1-CD1 4.47Å; V281-V494 HydrophobicContact CG1-CG2 4.09Å; V281-V494 HydrophobicContact CG2-CG1 4.4Å
282L89.5Confident86.9Confident21 Ų2131.6 Ų31.611%0.1115%0.152CC..Hα-helixtrans-68.7-45.6175.5-66.8178.2000112.2A278 L279 V280 N284 Y285 Y286 W465 L485 L492A278-L282 WeakPolarHBondContact O-CG 3.31Å; A278-L282 PolarHBondContact O-N 2.86Å; L279-L282 PolarHBondContact O-N 3.04Å; L279-L282 VanDerWaalsContact O-N 3.13Å; V280-L282 VanDerWaalsContact C-N 3.35Å; L282-N284 VanDerWaalsContact C-N 3.28Å; L282-N284 PolarHBondContact O-N 2.83Å; L282-Y285 WeakPolarHBondContact O-CB 3.47Å; L282-Y285 PolarHBondContact O-N 3.14Å; L282-Y285 VanDerWaalsContact O-N 3.08Å; L282-Y286 WeakPolarHBondContact O-CD2 3.5Å; L282-Y286 PolarHBondContact O-N 3.05Å; L282-Y286 VanDerWaalsContact O-N 3.12Å; L282-W465 HydrophobicContact CD1-CB 3.74Å; L282-W465 HydrophobicContact CD1-CD2 4.29Å; L282-W465 HydrophobicContact CD1-CG 3.68Å; L282-W465 HydrophobicContact CD2-CB 4.43Å; L282-W465 HydrophobicContact CD2-CD2 3.38Å; L282-W465 VanDerWaalsContact CD2-CE2 3.48Å; L282-W465 HydrophobicContact CD2-CE3 3.75Å; L282-W465 HydrophobicContact CD2-CG 3.7Å; L282-W465 HydrophobicContact CD2-CH2 4.16Å; L282-W465 HydrophobicContact CD2-CZ2 3.88Å; L282-W465 HydrophobicContact CD2-CZ3 4.11Å; L282-W465 HydrophobicContact CG-CD2 4.49Å; L282-W465 HydrophobicContact CG-CG 4.36Å; L282-L485 HydrophobicContact CD1-CD2 4.39Å; L282-L485 HydrophobicContact CD2-CB 4.46Å; L282-L485 HydrophobicContact CD2-CD1 3.93Å; L282-L485 HydrophobicContact CG-CD1 4.04Å; L282-L492 HydrophobicContact CD2-CD1 4.28Å
283E87.3Confident86.5Confident95 Ų9531.6 Ų31.644%0.44415%0.152SC..Hα-helixtrans-54.9-44.8174.6-72.3-179.4179.600111.3L279 V280L279-E283 WeakPolarHBondContact O-CG 3.43Å; L279-E283 PolarHBondContact O-N 3.47Å; V280-E283 PolarHBondContact O-N 3.29Å
284N88.7Confident85.9Confident36 Ų3632.9 Ų32.919%0.19316%0.16CC..Hα-helixtrans-74.2-29.5176.3-67.3-24.9000113.3Y267 V280 L282 K287 D288Y267-N284 HydrophobicContact CD1-CB 4.14Å; Y267-N284 WeakPolarHBondContact CD1-ND2 3.47Å; Y267-N284 HydrophobicContact CE1-CB 3.53Å; Y267-N284 HydrophobicContact CE2-CB 4.08Å; Y267-N284 VanDerWaalsContact CZ-CB 3.48Å; Y267-N284 PolarHBondContact OH-O 2.96Å; V280-N284 WeakPolarHBondContact O-CB 3.23Å; V280-N284 PolarHBondContact O-N 3.12Å; V280-N284 PolarHBondContact O-ND2 3.33Å; L282-N284 VanDerWaalsContact C-N 3.28Å; L282-N284 PolarHBondContact O-N 2.83Å; N284-K287 PolarHBondContact O-N 3.23Å; N284-D288 WeakPolarHBondContact O-CB 3.42Å; N284-D288 PolarHBondContact O-N 2.87Å
285Y87.9Confident85.1Confident4 Ų435.9 Ų35.92%0.01618%0.176CC..Hα-helixtrans-59.6-51.3175.3172.4-98.4000111R258 V281 L282 K287 F289 W465 F490 L492R258-Y285 PolarHBondContact NH1-OH 3.29Å; V281-Y285 VanDerWaalsContact O-CB 3.27Å; V281-Y285 WeakPolarHBondContact O-CB 3.35Å; V281-Y285 PolarHBondContact O-N 3.44Å; L282-Y285 WeakPolarHBondContact O-CB 3.47Å; L282-Y285 PolarHBondContact O-N 3.14Å; L282-Y285 VanDerWaalsContact O-N 3.08Å; Y285-K287 PolarHBondContact O-N 3.2Å; Y285-K287 VanDerWaalsContact O-N 3.16Å; Y285-F289 HydrophobicContact CD2-CB 3.65Å; Y285-F289 AromaticContact CD2-CD1 3.79Å; Y285-F289 HydrophobicContact CD2-CD1 3.79Å; Y285-F289 AromaticContact CD2-CD2 3.59Å; Y285-F289 HydrophobicContact CD2-CD2 3.59Å; Y285-F289 HydrophobicContact CD2-CE1 4.29Å; Y285-F289 HydrophobicContact CD2-CE2 4.11Å; Y285-F289 AromaticContact CD2-CG 3.4Å; Y285-F289 HydrophobicContact CD2-CG 3.4Å; Y285-F289 HydrophobicContact CD2-CZ 4.44Å; Y285-F289 HydrophobicContact CE2-CB 3.57Å; Y285-F289 AromaticContact CE2-CD1 3.72Å; Y285-F289 HydrophobicContact CE2-CD1 3.72Å; Y285-F289 HydrophobicContact CE2-CD2 4.29Å; Y285-F289 HydrophobicContact CE2-CE1 4.45Å; Y285-F289 AromaticContact CE2-CG 3.61Å; Y285-F289 HydrophobicContact CE2-CG 3.61Å; Y285-F289 HydrophobicContact CG-CB 4.48Å; Y285-F289 HydrophobicContact CG-CD2 4.37Å; Y285-F289 HydrophobicContact CG-CG 4.43Å; Y285-F289 WeakPolarHBondContact O-CB 3.33Å; Y285-F289 PolarHBondContact O-N 2.84Å; Y285-W465 HydrophobicContact CD1-CH2 4.44Å; Y285-W465 HydrophobicContact CD1-CZ2 4.05Å; Y285-W465 HydrophobicContact CE1-CH2 4.37Å; Y285-W465 HydrophobicContact CE1-CZ2 4.05Å; Y285-F490 HydrophobicContact CE1-CZ 4.2Å; Y285-F490 HydrophobicContact CE2-CE2 4.27Å; Y285-F490 AromaticContact CZ-CE2 3.92Å; Y285-F490 AromaticContact CZ-CZ 3.75Å; Y285-F490 WeakPolarHBondContact OH-CZ 3.26Å; Y285-L492 HydrophobicContact CD1-CD1 4.42Å; Y285-L492 HydrophobicContact CD2-CD1 3.57Å; Y285-L492 HydrophobicContact CD2-CD2 3.72Å; Y285-L492 HydrophobicContact CD2-CG 4.26Å; Y285-L492 HydrophobicContact CE2-CD1 4.25Å; Y285-L492 HydrophobicContact CE2-CD2 3.72Å; Y285-L492 HydrophobicContact CG-CD1 3.69Å
286Y84.5Confident84.3Confident35 Ų3538.6 Ų38.614%0.13719%0.191CC..Hα-helixtrans-63-22.6179.3-75.8-69.9000113.5L282 P451 T452 L453 S462 W465L282-Y286 WeakPolarHBondContact O-CD2 3.5Å; L282-Y286 PolarHBondContact O-N 3.05Å; L282-Y286 VanDerWaalsContact O-N 3.12Å; Y286-P451 WeakPolarHBondContact O-CB 3.43Å; Y286-T452 HydrophobicContact CD1-CG2 3.85Å; Y286-T452 HydrophobicContact CE1-CG2 4.06Å; Y286-T452 PolarHBondContact O-N 3.48Å; Y286-L453 WeakPolarHBondContact O-CD1 3.31Å; Y286-L453 WeakPolarHBondContact O-CG 3.48Å; Y286-L453 PolarHBondContact O-N 3.44Å; Y286-S462 PolarHBondContact OH-O 3.12Å; Y286-W465 AromaticContact CE2-NE1 3.87Å; Y286-W465 AromaticContact CZ-NE1 3.75Å; Y286-W465 PolarHBondContact OH-NE1 3.03Å
287K83.6Confident83.3Confident124 Ų12437.2 Ų37.254%0.53919%0.19SC..Hα-helixtrans-96.3-34.6-177-175.8-170.8155.1-93.70115.1N284 Y285 P451N284-K287 PolarHBondContact O-N 3.23Å; Y285-K287 PolarHBondContact O-N 3.2Å; Y285-K287 VanDerWaalsContact O-N 3.16Å; K287-P451 VanDerWaalsContact O-CB 3.31Å; K287-P451 WeakPolarHBondContact O-CB 3.41Å
288D86.2Confident82.2Confident42 Ų4239.7 Ų39.723%0.22521%0.205CC..Hα-helixtrans-119.1-18.6-167.8-54.7-39.3000114.4R265 Y267 N284R265-D288 PolarHBondContact NH2-O 3.17Å; Y267-D288 VanDerWaalsContact CE1-OD2 3.29Å; Y267-D288 WeakPolarHBondContact CE1-OD2 3.39Å; Y267-D288 PolarHBondContact OH-OD2 3.4Å; N284-D288 WeakPolarHBondContact O-CB 3.42Å; N284-D288 PolarHBondContact O-N 2.87Å
289F86.4Confident81Confident2 Ų239.6 Ų39.61%0.00921%0.205CC..SBendtrans-87.9143.8177.3-79.5-113.6000111.5V256 R258 E263 R265 Y267 Y285V256-F289 HydrophobicContact CB-CE2 4.48Å; V256-F289 HydrophobicContact CB-CZ 4.05Å; V256-F289 HydrophobicContact CG1-CE2 4.17Å; V256-F289 HydrophobicContact CG1-CZ 3.69Å; R258-F289 HydrophobicContact CB-CE1 4.33Å; E263-F289 HydrophobicContact CB-CD1 4.22Å; E263-F289 HydrophobicContact CB-CE1 4.35Å; E263-F289 HydrophobicContact CG-CD1 3.96Å; E263-F289 HydrophobicContact CG-CE1 4.21Å; E263-F289 WeakPolarHBondContact O-CE1 3.14Å; R265-F289 HydrophobicContact CB-CD2 4.46Å; R265-F289 HydrophobicContact CB-CE2 3.65Å; R265-F289 HydrophobicContact CB-CZ 3.88Å; R265-F289 HydrophobicContact CG-CD2 3.79Å; R265-F289 HydrophobicContact CG-CE1 4.3Å; R265-F289 HydrophobicContact CG-CE2 3.41Å; R265-F289 VanDerWaalsContact CG-CE2 3.41Å; R265-F289 HydrophobicContact CG-CG 4.41Å; R265-F289 HydrophobicContact CG-CZ 3.69Å; Y267-F289 HydrophobicContact CE2-CE2 4.22Å; Y267-F289 WeakPolarHBondContact OH-CE2 3.33Å; Y285-F289 HydrophobicContact CD2-CB 3.65Å; Y285-F289 AromaticContact CD2-CD1 3.79Å; Y285-F289 HydrophobicContact CD2-CD1 3.79Å; Y285-F289 AromaticContact CD2-CD2 3.59Å; Y285-F289 HydrophobicContact CD2-CD2 3.59Å; Y285-F289 HydrophobicContact CD2-CE1 4.29Å; Y285-F289 HydrophobicContact CD2-CE2 4.11Å; Y285-F289 AromaticContact CD2-CG 3.4Å; Y285-F289 HydrophobicContact CD2-CG 3.4Å; Y285-F289 HydrophobicContact CD2-CZ 4.44Å; Y285-F289 HydrophobicContact CE2-CB 3.57Å; Y285-F289 AromaticContact CE2-CD1 3.72Å; Y285-F289 HydrophobicContact CE2-CD1 3.72Å; Y285-F289 HydrophobicContact CE2-CD2 4.29Å; Y285-F289 HydrophobicContact CE2-CE1 4.45Å; Y285-F289 AromaticContact CE2-CG 3.61Å; Y285-F289 HydrophobicContact CE2-CG 3.61Å; Y285-F289 HydrophobicContact CG-CB 4.48Å; Y285-F289 HydrophobicContact CG-CD2 4.37Å; Y285-F289 HydrophobicContact CG-CG 4.43Å; Y285-F289 WeakPolarHBondContact O-CB 3.33Å; Y285-F289 PolarHBondContact O-N 2.84Å
290T83.6Confident79.9Confident45 Ų4540.6 Ų40.628%0.27622%0.215SC..BIsolated β-bridgetrans-67.1151.2171.5690000110.5R258 E263 Y292 A449R258-T290 PolarHBondContact NH1-O 2.92Å; R258-T290 PolarHBondContact NH2-O 3.02Å; R258-T290 PolarHBondContact NH2-OG1 3.04Å; E263-T290 PolarHBondContact OE1-N 3.5Å; E263-T290 WeakPolarHBondContact OE2-CB 3.37Å; E263-T290 PolarHBondContact OE2-N 3.4Å; E263-T290 PolarHBondContact OE2-OG1 3.5Å; T290-Y292 PolarHBondContact O-N 3.15Å; T290-A449 WeakPolarHBondContact CB-O 3.4Å; T290-A449 HydrophobicContact CG2-CB 4.35Å; T290-A449 WeakPolarHBondContact CG2-O 3.46Å
291I79.4Confident78.8Confident17 Ų1746.4 Ų46.49%0.08724%0.237CC..PPolyproline II helixtrans-60.4130.8179-173.2157.3000112.3N293 Y419 A449 Y455I291-N293 PolarHBondContact O-N 3.46Å; I291-Y419 HydrophobicContact CD1-CD1 3.92Å; I291-Y419 HydrophobicContact CD1-CE1 3.38Å; I291-Y419 HydrophobicContact CG1-CE1 4.01Å; I291-Y419 HydrophobicContact CG2-CE2 4.29Å; I291-A449 HydrophobicContact CG2-CB 4.33Å; I291-Y455 HydrophobicContact CB-CD2 4.17Å; I291-Y455 HydrophobicContact CB-CE2 4.4Å; I291-Y455 HydrophobicContact CD1-CD1 4.49Å; I291-Y455 HydrophobicContact CD1-CD2 3.55Å; I291-Y455 HydrophobicContact CD1-CE2 4.44Å; I291-Y455 HydrophobicContact CD1-CG 3.59Å; I291-Y455 HydrophobicContact CG1-CD2 4.48Å; I291-Y455 HydrophobicContact CG2-CD2 4.23Å; I291-Y455 HydrophobicContact CG2-CE2 4.06Å
292Y76.8Confident77.5Confident26 Ų2653 Ų5310%0.10227%0.266CS..PPolyproline II helixtrans-65.2118.5177.2172.4-120.1000111T260 T290 P294 L297 Y419 D489 F490T260-Y292 HydrophobicContact CG2-CE2 4.11Å; T260-Y292 WeakPolarHBondContact OG1-CE2 3.35Å; T290-Y292 PolarHBondContact O-N 3.15Å; Y292-P294 HydrophobicContact CE1-CB 3.96Å; Y292-P294 HydrophobicContact CE1-CG 4.24Å; Y292-L297 HydrophobicContact CE2-CD1 3.75Å; Y292-Y419 PolarHBondContact O-OH 2.97Å; Y292-D489 HydrophobicContact CE1-CB 3.96Å; Y292-F490 AromaticContact CD1-CD1 3.57Å; Y292-F490 HydrophobicContact CD1-CD1 3.57Å; Y292-F490 AromaticContact CD1-CE1 3.88Å; Y292-F490 HydrophobicContact CD1-CE1 3.88Å; Y292-F490 HydrophobicContact CD1-CG 4.49Å; Y292-F490 AromaticContact CE1-CD1 3.91Å; Y292-F490 HydrophobicContact CE1-CD1 3.91Å; Y292-F490 AromaticContact CG-CD1 3.97Å; Y292-F490 HydrophobicContact CG-CD1 3.97Å; Y292-F490 HydrophobicContact CG-CE1 4.15Å
293N77.8Confident76.5Confident14 Ų1454.8 Ų54.88%0.07527%0.271CS..  trans-113.995177.8-171.3-12.1000111I291 N295 L296 R415 Y419I291-N293 PolarHBondContact O-N 3.46Å; N293-N295 PolarHBondContact O-N 3.1Å; N293-N295 VanDerWaalsContact O-N 3.16Å; N293-N295 WeakPolarHBondContact OD1-CB 3.49Å; N293-N295 PolarHBondContact OD1-N 3.25Å; N293-N295 VanDerWaalsContact OD1-N 3.15Å; N293-L296 HydrophobicContact CB-CD1 4.12Å; N293-L296 HydrophobicContact CB-CG 4.31Å; N293-L296 PolarHBondContact O-N 3.14Å; N293-R415 PolarHBondContact ND2-O 3.47Å; N293-Y419 HydrophobicContact CB-CE2 4.48Å
294P73.9Confident75.5Confident40 Ų4051.6 Ų51.626%0.2626%0.261SS..Hα-helixtrans-60.8-27.2-179.224.7-34.1000112.6Y292 L296 L297 T298Y292-P294 HydrophobicContact CE1-CB 3.96Å; Y292-P294 HydrophobicContact CE1-CG 4.24Å; P294-L296 VanDerWaalsContact C-N 3.26Å; P294-L296 PolarHBondContact O-N 2.82Å; P294-L297 PolarHBondContact O-N 2.83Å; P294-T298 PolarHBondContact O-N 3.35Å
295N73Confident74.4Confident62 Ų6252.5 Ų52.533%0.33227%0.274SS..Hα-helixtrans-71.6-18.6-176.7-62.2-30.4000112.7N293 T298 R415N293-N295 PolarHBondContact O-N 3.1Å; N293-N295 VanDerWaalsContact O-N 3.16Å; N293-N295 WeakPolarHBondContact OD1-CB 3.49Å; N293-N295 PolarHBondContact OD1-N 3.25Å; N293-N295 VanDerWaalsContact OD1-N 3.15Å; N295-T298 PolarHBondContact O-OG1 3.31Å; N295-R415 HydrophobicContact CB-CB 4.18Å; N295-R415 WeakPolarHBondContact O-CD 3.43Å; N295-R415 PolarHBondContact O-NH1 3.16Å
296L71.8Confident73.3Confident81 Ų8160.3 Ų60.342%0.42431%0.308SS..Hα-helixtrans-74.4-37.2171.3-73.3175.6000111.9N293 P294 A299 T414 R415N293-L296 HydrophobicContact CB-CD1 4.12Å; N293-L296 HydrophobicContact CB-CG 4.31Å; N293-L296 PolarHBondContact O-N 3.14Å; P294-L296 VanDerWaalsContact C-N 3.26Å; P294-L296 PolarHBondContact O-N 2.82Å; L296-A299 WeakPolarHBondContact O-CB 3.29Å; L296-A299 PolarHBondContact O-N 3.44Å; L296-T414 WeakPolarHBondContact CD2-O 3.43Å; L296-R415 HydrophobicContact CD2-CB 4.37Å
297L66Low72.2Confident58 Ų5863.5 Ų63.530%0.30432%0.324SS..Hα-helixtrans-73.9-32.3-177.2-62173.7000113.2T260 D261 Y292 P294 A299 S300T260-L297 VanDerWaalsContact O-CD1 3.25Å; T260-L297 WeakPolarHBondContact O-CD1 3.4Å; T260-L297 WeakPolarHBondContact O-CD2 3.17Å; D261-L297 HydrophobicContact CB-CD1 4.45Å; D261-L297 HydrophobicContact CB-CD2 4.03Å; Y292-L297 HydrophobicContact CE2-CD1 3.75Å; P294-L297 PolarHBondContact O-N 2.83Å; L297-A299 VanDerWaalsContact C-N 3.32Å; L297-S300 PolarHBondContact O-OG 3.06Å
298T67.1Low71.1Confident51 Ų5163.1 Ų63.131%0.31333%0.326SS..Hα-helixtrans-75-23.7172.558.30000112.3P294 N295 S300 K301 F302P294-T298 PolarHBondContact O-N 3.35Å; N295-T298 PolarHBondContact O-OG1 3.31Å; T298-S300 VanDerWaalsContact C-N 3.34Å; T298-S300 PolarHBondContact O-N 3.06Å; T298-K301 PolarHBondContact O-N 2.68Å; T298-F302 WeakPolarHBondContact O-CD2 3.36Å; T298-F302 PolarHBondContact O-N 3.27Å
299A66.8Low70Confident3 Ų365.1 Ų65.13%0.02535%0.348CS..Hα-helixtrans-61.9-37.1-174.900000113.5L296 L297 R303L296-A299 WeakPolarHBondContact O-CB 3.29Å; L296-A299 PolarHBondContact O-N 3.44Å; L297-A299 VanDerWaalsContact C-N 3.32Å; A299-R303 WeakPolarHBondContact O-CD 3.28Å; A299-R303 WeakPolarHBondContact O-CG 3.38Å; A299-R303 PolarHBondContact O-N 2.84Å
300S65Low68.7Low62 Ų6268.1 Ų68.143%0.43438%0.379SS..Hα-helixtrans-66.1-45.8175.655.10000111.6L297 T298 F302 R303 A304L297-S300 PolarHBondContact O-OG 3.06Å; T298-S300 VanDerWaalsContact C-N 3.34Å; T298-S300 PolarHBondContact O-N 3.06Å; S300-F302 PolarHBondContact O-N 3.14Å; S300-R303 PolarHBondContact O-N 2.98Å; S300-A304 PolarHBondContact O-N 3.35Å
301K66.4Low67.4Low156 Ų15671.1 Ų71.168%0.67839%0.393SS*.Hα-helixtrans-60.5-43.2177.5-61.5-177.8-179.41790112.3T298 A305T298-K301 PolarHBondContact O-N 2.68Å; K301-A305 WeakPolarHBondContact O-CB 3.38Å; K301-A305 PolarHBondContact O-N 2.78Å
302F66.2Low66.4Low138 Ų13878.3 Ų78.361%0.60542%0.424SS*.Hα-helixtrans-68-34.2178-80.1-64.2000113.4T298 S300 K306T298-F302 WeakPolarHBondContact O-CD2 3.36Å; T298-F302 PolarHBondContact O-N 3.27Å; S300-F302 PolarHBondContact O-N 3.14Å; F302-K306 WeakPolarHBondContact O-CB 3.32Å; F302-K306 PolarHBondContact O-N 2.83Å; F302-K306 VanDerWaalsContact O-N 3.07Å
303R67.8Low65.3Low59 Ų5981.9 Ų81.922%0.22345%0.448CS..Hα-helixtrans-67.5-48.4174.3-66.6166-161.3167.27.2111.1A299 S300 A305 K306 H307 E348 H352A299-R303 WeakPolarHBondContact O-CD 3.28Å; A299-R303 WeakPolarHBondContact O-CG 3.38Å; A299-R303 PolarHBondContact O-N 2.84Å; S300-R303 PolarHBondContact O-N 2.98Å; R303-A305 VanDerWaalsContact C-N 3.32Å; R303-A305 PolarHBondContact O-N 2.91Å; R303-K306 WeakPolarHBondContact O-CB 3.35Å; R303-K306 PolarHBondContact O-N 2.92Å; R303-H307 PolarHBondContact O-N 3.37Å; R303-H307 VanDerWaalsContact O-N 3.13Å; R303-E348 WeakPolarHBondContact CB-OE2 3.26Å; R303-H352 PolarHBondContact NH2-CD2 3.45Å; R303-H352 PolarHBondContact NH2-CE1 3.5Å; R303-H352 PolarHBondContact NH2-ND1 3.23Å; R303-H352 PolarHBondContact NH2-NE2 3.37Å
304A65.6Low64.3Low28 Ų2889.7 Ų89.723%0.23148%0.478CS..Hα-helixtrans-51.5-48.6174.100000112.5S300 K306 M308 L345S300-A304 PolarHBondContact O-N 3.35Å; A304-K306 PolarHBondContact O-N 2.96Å; A304-M308 WeakPolarHBondContact O-CG 3.45Å; A304-M308 PolarHBondContact O-N 2.79Å; A304-L345 HydrophobicContact CB-CD2 3.61Å
305A65.9Low63.2Low56 Ų5695 Ų9546%0.46350%0.504SS..Hα-helixtrans-64.5-39.3178.800000112.5K301 R303 H307 M308 A309K301-A305 WeakPolarHBondContact O-CB 3.38Å; K301-A305 PolarHBondContact O-N 2.78Å; R303-A305 VanDerWaalsContact C-N 3.32Å; R303-A305 PolarHBondContact O-N 2.91Å; A305-H307 PolarHBondContact O-N 3.27Å; A305-M308 PolarHBondContact O-N 2.83Å; A305-A309 WeakPolarHBondContact O-CB 3.38Å; A305-A309 PolarHBondContact O-N 3.16Å
306K66.2Low62.5Low168 Ų16898.4 Ų98.473%0.7353%0.527SS*.Hα-helixtrans-64.5-39.9-179.9-175.4174.3-179.4174.50112.5F302 R303 A304 A309 G310F302-K306 WeakPolarHBondContact O-CB 3.32Å; F302-K306 PolarHBondContact O-N 2.83Å; F302-K306 VanDerWaalsContact O-N 3.07Å; R303-K306 WeakPolarHBondContact O-CB 3.35Å; R303-K306 PolarHBondContact O-N 2.92Å; A304-K306 PolarHBondContact O-N 2.96Å; K306-A309 PolarHBondContact O-N 3.4Å; K306-G310 PolarHBondContact O-N 3.11Å
307H61.6Low61.6Low101 Ų101101.4 Ų101.447%0.46854%0.543SS..Hα-helixtrans-69.8-40.2177.9-167.2-107.5000112R303 A305 A309 G310 E344R303-H307 PolarHBondContact O-N 3.37Å; R303-H307 VanDerWaalsContact O-N 3.13Å; A305-H307 PolarHBondContact O-N 3.27Å; H307-A309 VanDerWaalsContact C-N 3.27Å; H307-A309 PolarHBondContact O-N 3.44Å; H307-G310 PolarHBondContact O-N 3.21Å; H307-G310 VanDerWaalsContact O-N 3.11Å; H307-E344 VanDerWaalsContact CB-OE1 3.26Å; H307-E344 WeakPolarHBondContact CB-OE1 3.38Å; H307-E344 IonicContact CD2-OE1 3.49Å; H307-E344 IonicContact CE1-OE1 3.71Å; H307-E344 PolarHBondContact CE1-OE1 2.88Å; H307-E344 IonicContact CE1-OE2 3.87Å; H307-E344 PolarHBondContact CE1-OE2 2.94Å; H307-E344 IonicContact CG-OE1 3.97Å; H307-E344 IonicContact CG-OE2 2.78Å; H307-E344 IonicContact ND1-OE1 2.84Å; H307-E344 PolarHBondContact ND1-OE1 3.45Å; H307-E344 IonicContact ND1-OE2 2.77Å; H307-E344 PolarHBondContact ND1-OE2 2.86Å
308M60.6Low61.2Low117 Ų117101.3 Ų101.358%0.57656%0.556SS**Hα-helixtrans-60.1-35.9174.1-66.4-66.1151.700112.8A304 A305 S341A304-M308 WeakPolarHBondContact O-CG 3.45Å; A304-M308 PolarHBondContact O-N 2.79Å; A305-M308 PolarHBondContact O-N 2.83Å; M308-S341 VanDerWaalsContact CE-CB 3.44Å
309A61.5Low60.4Low83 Ų83106 Ų10669%0.68659%0.587SS**Hα-helixtrans-76.9-17.717700000114.4A305 K306 H307 L311A305-A309 WeakPolarHBondContact O-CB 3.38Å; A305-A309 PolarHBondContact O-N 3.16Å; K306-A309 PolarHBondContact O-N 3.4Å; H307-A309 VanDerWaalsContact C-N 3.27Å; H307-A309 PolarHBondContact O-N 3.44Å; A309-L311 VanDerWaalsContact C-N 3.34Å; A309-L311 PolarHBondContact O-N 3.32Å
310G60.1Low59.7Low65 Ų65110.5 Ų110.567%0.6762%0.618SS**THydrogen-bonded Turntrans-75.7-15.6-174.900000115.3K306 H307 K312K306-G310 PolarHBondContact O-N 3.11Å; H307-G310 PolarHBondContact O-N 3.21Å; H307-G310 VanDerWaalsContact O-N 3.11Å; G310-K312 PolarHBondContact O-N 3.43Å
311L56.4Low59.1Low108 Ų108115 Ų11557%0.56564%0.638SS**  trans-98.282.2-169.6-16872.4000112.8A309 V313A309-L311 VanDerWaalsContact C-N 3.34Å; A309-L311 PolarHBondContact O-N 3.32Å; L311-V313 PolarHBondContact O-N 3.04Å; L311-V313 VanDerWaalsContact O-N 3.16Å
312K57.4Low58.4Low169 Ų169113.3 Ų113.374%0.73564%0.636SS**  trans-67.2109.5166.7-75.2-173.5176.7-177.50110.2G310 Y314G310-K312 PolarHBondContact O-N 3.43Å; K312-Y314 HydrophobicContact CB-CE2 4.23Å; K312-Y314 PolarHBondContact O-N 3.4Å
313V54.1Low57.9Low100 Ų100109.9 Ų109.961%0.60663%0.633SS**  trans-81.2110.8172-179.80000108.7L311L311-V313 PolarHBondContact O-N 3.04Å; L311-V313 VanDerWaalsContact O-N 3.16Å
314Y57.2Low57.2Low179 Ų179113.1 Ų113.170%0.70266%0.66SS**  trans-83.2122.8167-63.3-84.8000108.8K312 V316K312-Y314 HydrophobicContact CB-CE2 4.23Å; K312-Y314 PolarHBondContact O-N 3.4Å; Y314-V316 PolarHBondContact O-N 3.31Å
315N51Low56.6Low152 Ų152114 Ų11481%0.81367%0.671SS**  trans-70.7112.7166-100.3-5.4000108
316V57Low56.1Low133 Ų133116.3 Ų116.381%0.80667%0.672SS**  trans-88.1-18.8-179.7178.50000111.9Y314Y314-V316 PolarHBondContact O-N 3.31Å
317D54.8Low55.6Low144 Ų144111.4 Ų111.477%0.7766%0.659SS**SBendtrans-97.7130.9179.1-63.5-47.1000112
318G56.3Low55.4Low56 Ų56116.5 Ų116.558%0.57767%0.674SS**  trans-66.1175.7172.800000113.3S320G318-S320 PolarHBondContact O-N 3.5Å
319P50.1Low55.4Low149 Ų149113.9 Ų113.997%0.96867%0.671SS**SBendtrans-67.698.5-167.128.3-35.5000111.9
320S51.7Low55.3Low97 Ų97115.8 Ų115.868%0.67867%0.667SS**  trans-130142174.7-166.40000111.7G318 N322G318-S320 PolarHBondContact O-N 3.5Å; S320-N322 PolarHBondContact O-N 3.13Å
321N52.6Low55.4Low158 Ų158118.4 Ų118.485%0.84567%0.665SS**SBendtrans-93.841.7-137.4-144.88000114.7
322N52.9Low55.7Low119 Ų119115.8 Ų115.864%0.63666%0.659SS**  trans-112.457.5-170.9-79.9-17.6000114S320 T324S320-N322 PolarHBondContact O-N 3.13Å; N322-T324 VanDerWaalsContact C-N 3.34Å; N322-T324 PolarHBondContact O-N 3.5Å
323A54.7Low55.8Low66 Ų66109.6 Ų109.655%0.54564%0.639SS.*Hα-helixtrans-60.2-34.6-175.800000114.9S327A323-S327 PolarHBondContact O-N 3.04Å; A323-S327 PolarHBondContact O-OG 3.21Å
324T54.1Low56.1Low128 Ų128107.5 Ų107.579%0.78563%0.632SS**Hα-helixtrans-74.7-32.6-172.651.60000114N322N322-T324 VanDerWaalsContact C-N 3.34Å; N322-T324 PolarHBondContact O-N 3.5Å
325G53.5Low56.2Low45 Ų45101.4 Ų101.446%0.46462%0.619SS.*Hα-helixtrans-73.5-38.4174.500000112.4S327 R328 A329G325-S327 PolarHBondContact O-N 3.05Å; G325-R328 PolarHBondContact O-N 3.07Å; G325-A329 WeakPolarHBondContact O-CB 3.37Å; G325-A329 PolarHBondContact O-N 3.3Å
326Q54.8Low56.7Low105 Ų105103.7 Ų103.749%0.49162%0.616SS.*Hα-helixtrans-62.5-42.3179.9-72.4179.3-13.100112.3R328 A329 M330Q326-R328 PolarHBondContact O-N 3.28Å; Q326-A329 PolarHBondContact O-N 3.25Å; Q326-M330 HydrophobicContact CB-CE 4.3Å; Q326-M330 WeakPolarHBondContact O-CB 3.34Å; Q326-M330 WeakPolarHBondContact O-CG 3.36Å; Q326-M330 PolarHBondContact O-N 3.03Å
327S56Low56.7Low65 Ų65103.8 Ų103.846%0.45560%0.602SS.*Hα-helixtrans-61.6-42.7176-56.90000112.6A323 G325 M330 I331A323-S327 PolarHBondContact O-N 3.04Å; A323-S327 PolarHBondContact O-OG 3.21Å; G325-S327 PolarHBondContact O-N 3.05Å; S327-M330 PolarHBondContact O-N 3.28Å; S327-I331 WeakPolarHBondContact O-CB 3.01Å; S327-I331 WeakPolarHBondContact O-CD1 3.25Å; S327-I331 WeakPolarHBondContact O-CG1 3.47Å; S327-I331 PolarHBondContact O-N 3.45Å
328R57.8Low56.9Low209 Ų209106.4 Ų106.479%0.78960%0.601SS**Hα-helixtrans-68.5-39.4178.7-121.2177.5177.2175.1-1.4112.1G325 Q326 I331 A332G325-R328 PolarHBondContact O-N 3.07Å; Q326-R328 PolarHBondContact O-N 3.28Å; R328-I331 PolarHBondContact O-N 2.89Å; R328-A332 WeakPolarHBondContact O-CB 3.47Å; R328-A332 PolarHBondContact O-N 2.97Å
329A60.4Low56.9Low61 Ų61109.5 Ų109.550%0.50460%0.604SS.*Hα-helixtrans-65.8-41.4173.900000112.2G325 Q326 A332 A333G325-A329 WeakPolarHBondContact O-CB 3.37Å; G325-A329 PolarHBondContact O-N 3.3Å; Q326-A329 PolarHBondContact O-N 3.25Å; A329-A332 PolarHBondContact O-N 2.85Å; A329-A333 VanDerWaalsContact O-CB 3.22Å; A329-A333 WeakPolarHBondContact O-CB 3.45Å; A329-A333 PolarHBondContact O-N 3.28Å
330M59.4Low57.4Low123 Ų123105.5 Ų105.561%0.60658%0.58SS**Hα-helixtrans-65.6-40.6174.5-80-165.1-88.100112.4Q326 S327 A333 A334Q326-M330 HydrophobicContact CB-CE 4.3Å; Q326-M330 WeakPolarHBondContact O-CB 3.34Å; Q326-M330 WeakPolarHBondContact O-CG 3.36Å; Q326-M330 PolarHBondContact O-N 3.03Å; S327-M330 PolarHBondContact O-N 3.28Å; M330-A333 PolarHBondContact O-N 3.08Å; M330-A334 WeakPolarHBondContact O-CB 3.4Å; M330-A334 PolarHBondContact O-N 2.95Å
331I60.5Low58Low121 Ų121102.1 Ų102.162%0.62156%0.557SS**Hα-helixtrans-65.6-43.1175.9-69.3163.7000110.8S327 R328 A334 A335S327-I331 WeakPolarHBondContact O-CB 3.01Å; S327-I331 WeakPolarHBondContact O-CD1 3.25Å; S327-I331 WeakPolarHBondContact O-CG1 3.47Å; S327-I331 PolarHBondContact O-N 3.45Å; R328-I331 PolarHBondContact O-N 2.89Å; I331-A334 PolarHBondContact O-N 3.09Å; I331-A335 WeakPolarHBondContact O-CB 3.4Å; I331-A335 PolarHBondContact O-N 3.17Å
332A62.7Low58.4Low53 Ų53101.6 Ų101.644%0.43855%0.549SS..Hα-helixtrans-66.9-36.7175.600000112.7R328 A329 R336R328-A332 WeakPolarHBondContact O-CB 3.47Å; R328-A332 PolarHBondContact O-N 2.97Å; A329-A332 PolarHBondContact O-N 2.85Å; A332-R336 WeakPolarHBondContact O-CG 3.27Å; A332-R336 PolarHBondContact O-N 3.26Å
333A61Low59.4Low39 Ų3999.9 Ų99.932%0.32254%0.54SS..Hα-helixtrans-68.7-39.7173.200000111.7A329 M330 R336 R337A329-A333 VanDerWaalsContact O-CB 3.22Å; A329-A333 WeakPolarHBondContact O-CB 3.45Å; A329-A333 PolarHBondContact O-N 3.28Å; M330-A333 PolarHBondContact O-N 3.08Å; A333-R336 PolarHBondContact O-N 3.38Å; A333-R337 VanDerWaalsContact O-CB 3.29Å; A333-R337 WeakPolarHBondContact O-CB 3.39Å; A333-R337 WeakPolarHBondContact O-CG 3.33Å; A333-R337 PolarHBondContact O-N 3.19Å
334A60Low60.2Low56 Ų5698.7 Ų98.746%0.46352%0.523SS..Hα-helixtrans-65.2-39.7175.100000111.8M330 I331 R337 R338M330-A334 WeakPolarHBondContact O-CB 3.4Å; M330-A334 PolarHBondContact O-N 2.95Å; I331-A334 PolarHBondContact O-N 3.09Å; A334-R337 PolarHBondContact O-N 3.31Å; A334-R338 PolarHBondContact O-N 3.26Å
335A58.9Low61.2Low51 Ų5195.5 Ų95.542%0.42150%0.5SS..Hα-helixtrans-60.9-52172.600000111.4I331 R337 R338 D339I331-A335 WeakPolarHBondContact O-CB 3.4Å; I331-A335 PolarHBondContact O-N 3.17Å; A335-R337 VanDerWaalsContact C-N 3.28Å; A335-R337 PolarHBondContact O-N 3.2Å; A335-R338 WeakPolarHBondContact O-CB 3.21Å; A335-R338 PolarHBondContact O-N 2.98Å; A335-D339 PolarHBondContact O-N 3.18Å; A335-D339 VanDerWaalsContact O-N 3.14Å
336R60.9Low62.4Low200 Ų200100.2 Ų100.276%0.75551%0.505SS*.Hα-helixtrans-62.3-32.1176.1-70.5178.4178.71780.4113.2A332 A333 S340A332-R336 WeakPolarHBondContact O-CG 3.27Å; A332-R336 PolarHBondContact O-N 3.26Å; A333-R336 PolarHBondContact O-N 3.38Å; R336-S340 WeakPolarHBondContact O-CB 3.09Å; R336-S340 PolarHBondContact O-N 3.31Å
337R57.3Low63.7Low134 Ų134102.1 Ų102.151%0.50651%0.509SS..Hα-helixtrans-69.3-36.3172.7-76.7170.9-176-161.62.3112.2A333 A334 A335 S340 S341A333-R337 VanDerWaalsContact O-CB 3.29Å; A333-R337 WeakPolarHBondContact O-CB 3.39Å; A333-R337 WeakPolarHBondContact O-CG 3.33Å; A333-R337 PolarHBondContact O-N 3.19Å; A334-R337 PolarHBondContact O-N 3.31Å; A335-R337 VanDerWaalsContact C-N 3.28Å; A335-R337 PolarHBondContact O-N 3.2Å; R337-S340 PolarHBondContact O-N 3.16Å; R337-S341 WeakPolarHBondContact O-CB 3.43Å; R337-S341 PolarHBondContact O-N 2.76Å
338R59.8Low64.9Low199 Ų199101.2 Ų101.275%0.75150%0.498SS*.Hα-helixtrans-62.1-45.8174.4-170.6176.1179.7174.2-0.8110.9A334 A335 S341A334-R338 PolarHBondContact O-N 3.26Å; A335-R338 WeakPolarHBondContact O-CB 3.21Å; A335-R338 PolarHBondContact O-N 2.98Å; R338-S341 PolarHBondContact O-N 3.02Å; R338-S341 PolarHBondContact O-OG 3.5Å
339D56.4Low66Low121 Ų12197.2 Ų97.265%0.64749%0.488SS*.Hα-helixtrans-66.3-39.6176-59.6-29.1000111.7A335 S341A335-D339 PolarHBondContact O-N 3.18Å; A335-D339 VanDerWaalsContact O-N 3.14Å; D339-S341 VanDerWaalsContact C-N 3.33Å; D339-S341 PolarHBondContact O-N 2.81Å
340S60.4Low67.2Low66 Ų6696.2 Ų96.246%0.46248%0.48SS..Hα-helixtrans-61.4-38.4173.3-169.40000112.8R336 R337 H342 N343 E344R336-S340 WeakPolarHBondContact O-CB 3.09Å; R336-S340 PolarHBondContact O-N 3.31Å; R337-S340 PolarHBondContact O-N 3.16Å; S340-H342 VanDerWaalsContact C-N 3.29Å; S340-H342 PolarHBondContact O-N 3.08Å; S340-N343 PolarHBondContact O-N 2.99Å; S340-E344 WeakPolarHBondContact O-CB 3.42Å; S340-E344 PolarHBondContact O-N 3.34Å
341S62.8Low68.5Low26 Ų2695 Ų9518%0.18247%0.472CS..Hα-helixtrans-65.4-31-17573.70000113.3M308 R337 R338 D339 E344 L345M308-S341 VanDerWaalsContact CE-CB 3.44Å; R337-S341 WeakPolarHBondContact O-CB 3.43Å; R337-S341 PolarHBondContact O-N 2.76Å; R338-S341 PolarHBondContact O-N 3.02Å; R338-S341 PolarHBondContact O-OG 3.5Å; D339-S341 VanDerWaalsContact C-N 3.33Å; D339-S341 PolarHBondContact O-N 2.81Å; S341-E344 PolarHBondContact O-N 3.15Å; S341-L345 WeakPolarHBondContact O-CG 3.36Å; S341-L345 PolarHBondContact O-N 3.24Å
342H62.9Low69.7Low147 Ų14790.8 Ų90.868%0.68145%0.45SS*.Hα-helixtrans-68.7-40.4175.2-173-78.7000111.8S340 E344 Y346S340-H342 VanDerWaalsContact C-N 3.29Å; S340-H342 PolarHBondContact O-N 3.08Å; H342-E344 VanDerWaalsContact C-N 3.3Å; H342-Y346 PolarHBondContact O-N 3.35Å
343N72.7Confident71Confident83 Ų8392.9 Ų92.944%0.44445%0.451SS..Hα-helixtrans-67.8-34.5177-163.328.5000111.5S340 Y346 Y347S340-N343 PolarHBondContact O-N 2.99Å; N343-Y346 WeakPolarHBondContact O-CB 3.08Å; N343-Y347 WeakPolarHBondContact O-CD2 3.49Å; N343-Y347 PolarHBondContact O-N 2.74Å
344E72.5Confident72.4Confident41 Ų41100.3 Ų100.319%0.19247%0.471CS..Hα-helixtrans-67.3-45.1177.5-162.7-161.2108.200112.7H307 S340 S341 H342 Y346 Y347 E348H307-E344 VanDerWaalsContact CB-OE1 3.26Å; H307-E344 WeakPolarHBondContact CB-OE1 3.38Å; H307-E344 IonicContact CD2-OE1 3.49Å; H307-E344 IonicContact CE1-OE1 3.71Å; H307-E344 PolarHBondContact CE1-OE1 2.88Å; H307-E344 IonicContact CE1-OE2 3.87Å; H307-E344 PolarHBondContact CE1-OE2 2.94Å; H307-E344 IonicContact CG-OE1 3.97Å; H307-E344 IonicContact CG-OE2 2.78Å; H307-E344 IonicContact ND1-OE1 2.84Å; H307-E344 PolarHBondContact ND1-OE1 3.45Å; H307-E344 IonicContact ND1-OE2 2.77Å; H307-E344 PolarHBondContact ND1-OE2 2.86Å; S340-E344 WeakPolarHBondContact O-CB 3.42Å; S340-E344 PolarHBondContact O-N 3.34Å; S341-E344 PolarHBondContact O-N 3.15Å; H342-E344 VanDerWaalsContact C-N 3.3Å; E344-Y346 VanDerWaalsContact C-N 3.27Å; E344-Y346 PolarHBondContact O-N 3.12Å; E344-Y347 PolarHBondContact O-N 3.34Å; E344-E348 PolarHBondContact O-N 3.04Å
345L73.4Confident73.8Confident61 Ų61102.2 Ų102.232%0.31947%0.466SS..Hα-helixtrans-57.3-40.1175-73.9167.1000112.4A304 S341 Y347 E348 E349A304-L345 HydrophobicContact CB-CD2 3.61Å; S341-L345 WeakPolarHBondContact O-CG 3.36Å; S341-L345 PolarHBondContact O-N 3.24Å; L345-Y347 PolarHBondContact O-N 3.13Å; L345-E348 PolarHBondContact O-N 3.18Å; L345-E349 WeakPolarHBondContact O-CB 3.18Å; L345-E349 PolarHBondContact O-N 2.96Å
346Y79.8Confident75.4Confident144 Ų144101.2 Ų101.257%0.56546%0.455SS*.Hα-helixtrans-60.3-42.9173.8170.7-98.7000112.1H342 N343 E344 E349 A350H342-Y346 PolarHBondContact O-N 3.35Å; N343-Y346 WeakPolarHBondContact O-CB 3.08Å; E344-Y346 VanDerWaalsContact C-N 3.27Å; E344-Y346 PolarHBondContact O-N 3.12Å; Y346-E349 PolarHBondContact O-N 2.9Å; Y346-A350 WeakPolarHBondContact O-CB 3.38Å; Y346-A350 PolarHBondContact O-N 3.46Å
347Y82Confident76.9Confident144 Ų14497.8 Ų97.857%0.56545%0.445SS*.Hα-helixtrans-68.6-37.6175.6-69.2-58.6000112.9N343 E344 L345 A350 E351N343-Y347 WeakPolarHBondContact O-CD2 3.49Å; N343-Y347 PolarHBondContact O-N 2.74Å; E344-Y347 PolarHBondContact O-N 3.34Å; L345-Y347 PolarHBondContact O-N 3.13Å; Y347-A350 PolarHBondContact O-N 3.44Å; Y347-E351 VanDerWaalsContact O-CB 3.32Å; Y347-E351 WeakPolarHBondContact O-CB 3.46Å; Y347-E351 PolarHBondContact O-N 3.3Å
348E80.6Confident78.7Confident47 Ų4797.3 Ų97.322%0.2245%0.447CS..Hα-helixtrans-64-39.5174.5-71-161119.200112.6R303 E344 L345 H352R303-E348 WeakPolarHBondContact CB-OE2 3.26Å; E344-E348 PolarHBondContact O-N 3.04Å; L345-E348 PolarHBondContact O-N 3.18Å; E348-H352 VanDerWaalsContact O-CB 3.27Å; E348-H352 WeakPolarHBondContact O-CB 3.41Å; E348-H352 PolarHBondContact O-N 3.34Å
349E82.3Confident80.4Confident124 Ų12491.8 Ų91.858%0.57943%0.426SS*.Hα-helixtrans-65.3-48.8174.6-176.7163.4-13400111L345 Y346 E351 H352 E353L345-E349 WeakPolarHBondContact O-CB 3.18Å; L345-E349 PolarHBondContact O-N 2.96Å; Y346-E349 PolarHBondContact O-N 2.9Å; E349-E351 VanDerWaalsContact C-N 3.32Å; E349-E351 PolarHBondContact O-N 3.45Å; E349-H352 CarbonylContact O-C 3.59Å; E349-H352 WeakPolarHBondContact O-CA 3.34Å; E349-H352 WeakPolarHBondContact O-CB 3.33Å; E349-H352 PolarHBondContact O-N 3.38Å; E349-H352 VanDerWaalsContact O-N 3.1Å; E349-E353 PolarHBondContact O-N 3Å
350A85.7Confident82.2Confident41 Ų4192.5 Ų92.534%0.33942%0.419SS..Hα-helixtrans-60.5-38.6175.100000112.7Y346 Y347 R354Y346-A350 WeakPolarHBondContact O-CB 3.38Å; Y346-A350 PolarHBondContact O-N 3.46Å; Y347-A350 PolarHBondContact O-N 3.44Å; A350-R354 WeakPolarHBondContact O-CB 3.5Å; A350-R354 PolarHBondContact O-N 2.69Å
351E86.6Confident83.8Confident96 Ų9692 Ų9245%0.44942%0.42SS..Hα-helixtrans-70.4-35175.1-155.5-131.2147.200111.6Y347 E349 R354 R355Y347-E351 VanDerWaalsContact O-CB 3.32Å; Y347-E351 WeakPolarHBondContact O-CB 3.46Å; Y347-E351 PolarHBondContact O-N 3.3Å; E349-E351 VanDerWaalsContact C-N 3.32Å; E349-E351 PolarHBondContact O-N 3.45Å; E351-R354 PolarHBondContact O-N 2.85Å; E351-R355 WeakPolarHBondContact O-CG 3.17Å; E351-R355 PolarHBondContact O-N 2.75Å; E351-R355 PolarHBondContact O-NE 3.07Å; E351-R355 IonicContact OE1-CZ 3.73Å; E351-R355 VanDerWaalsContact OE1-CZ 3.29Å; E351-R355 IonicContact OE1-NE 3.85Å; E351-R355 IonicContact OE1-NH1 2.85Å; E351-R355 PolarHBondContact OE1-NH1 3.16Å; E351-R355 IonicContact OE1-NH2 2.88Å; E351-R355 IonicContact OE2-CZ 3.29Å; E351-R355 IonicContact OE2-NH1 2.77Å; E351-R355 PolarHBondContact OE2-NH1 3.22Å; E351-R355 IonicContact OE2-NH2 3.72Å; E351-R355 PolarHBondContact OE2-NH2 3.33Å
352H85.8Confident85.3Confident34 Ų3497.3 Ų97.316%0.15744%0.435CS..Hα-helixtrans-64.8-48.4171.7-178.165.2000112.2R303 E348 E349 R354 R355 V356 T413R303-H352 PolarHBondContact NH2-CD2 3.45Å; R303-H352 PolarHBondContact NH2-CE1 3.5Å; R303-H352 PolarHBondContact NH2-ND1 3.23Å; R303-H352 PolarHBondContact NH2-NE2 3.37Å; E348-H352 VanDerWaalsContact O-CB 3.27Å; E348-H352 WeakPolarHBondContact O-CB 3.41Å; E348-H352 PolarHBondContact O-N 3.34Å; E349-H352 CarbonylContact O-C 3.59Å; E349-H352 WeakPolarHBondContact O-CA 3.34Å; E349-H352 WeakPolarHBondContact O-CB 3.33Å; E349-H352 PolarHBondContact O-N 3.38Å; E349-H352 VanDerWaalsContact O-N 3.1Å; H352-R354 VanDerWaalsContact C-N 3.28Å; H352-R354 PolarHBondContact O-N 3.43Å; H352-R355 WeakPolarHBondContact O-CA 3.29Å; H352-R355 WeakPolarHBondContact O-CB 3.4Å; H352-R355 PolarHBondContact O-N 3.17Å; H352-R355 VanDerWaalsContact O-N 3.08Å; H352-V356 WeakPolarHBondContact O-CG2 3.49Å; H352-V356 PolarHBondContact O-N 2.85Å; H352-T413 PolarHBondContact CE1-O 2.61Å
353E88.4Confident86.9Confident97 Ų9790.3 Ų90.345%0.45340%0.403SS..Hα-helixtrans-55.2-45.2172.3-74.5-156.9156.700111.5E349 R355 V356 K357E349-E353 PolarHBondContact O-N 3Å; E353-R355 VanDerWaalsContact C-N 3.28Å; E353-R355 PolarHBondContact O-N 3.22Å; E353-V356 PolarHBondContact O-N 3.35Å; E353-K357 HydrophobicContact CB-CD 4.48Å; E353-K357 WeakPolarHBondContact O-CB 3.22Å; E353-K357 VanDerWaalsContact O-CG 3.28Å; E353-K357 WeakPolarHBondContact O-CG 3.48Å; E353-K357 PolarHBondContact O-N 3.05Å; E353-K357 IonicContact OE2-NZ 2.72Å; E353-K357 PolarHBondContact OE2-NZ 2.99Å
354R90.6Very high88Confident195 Ų19588 Ų8874%0.73639%0.392SS*.Hα-helixtrans-61.3-38.2178.1-169.9-179.8-176.2-166.23111.4A350 E351 H352 K358A350-R354 WeakPolarHBondContact O-CB 3.5Å; A350-R354 PolarHBondContact O-N 2.69Å; E351-R354 PolarHBondContact O-N 2.85Å; H352-R354 VanDerWaalsContact C-N 3.28Å; H352-R354 PolarHBondContact O-N 3.43Å; R354-K358 WeakPolarHBondContact O-CB 3.33Å; R354-K358 PolarHBondContact O-N 3.28Å
355R90.9Very high89.1Confident95 Ų9589.4 Ų89.436%0.35840%0.403SS..Hα-helixtrans-64.4-48172.3-75.4176-72.2-137.51.5111.5E351 H352 E353 K358 R359 T413E351-R355 WeakPolarHBondContact O-CG 3.17Å; E351-R355 PolarHBondContact O-N 2.75Å; E351-R355 PolarHBondContact O-NE 3.07Å; E351-R355 IonicContact OE1-CZ 3.73Å; E351-R355 VanDerWaalsContact OE1-CZ 3.29Å; E351-R355 IonicContact OE1-NE 3.85Å; E351-R355 IonicContact OE1-NH1 2.85Å; E351-R355 PolarHBondContact OE1-NH1 3.16Å; E351-R355 IonicContact OE1-NH2 2.88Å; E351-R355 IonicContact OE2-CZ 3.29Å; E351-R355 IonicContact OE2-NH1 2.77Å; E351-R355 PolarHBondContact OE2-NH1 3.22Å; E351-R355 IonicContact OE2-NH2 3.72Å; E351-R355 PolarHBondContact OE2-NH2 3.33Å; H352-R355 WeakPolarHBondContact O-CA 3.29Å; H352-R355 WeakPolarHBondContact O-CB 3.4Å; H352-R355 PolarHBondContact O-N 3.17Å; H352-R355 VanDerWaalsContact O-N 3.08Å; E353-R355 VanDerWaalsContact C-N 3.28Å; E353-R355 PolarHBondContact O-N 3.22Å; R355-K358 PolarHBondContact O-N 3.45Å; R355-R359 VanDerWaalsContact O-CG 3.29Å; R355-R359 WeakPolarHBondContact O-CG 3.46Å; R355-R359 PolarHBondContact O-N 2.99Å; R355-T413 HydrophobicContact CB-CG2 4.49Å
356V91.3Very high90.2Very high31 Ų3187.1 Ų87.119%0.18839%0.393CS..Hα-helixtrans-59.9-50177176.40000110.8H352 E353 K358 R359 R360 Y410 T413 T414H352-V356 WeakPolarHBondContact O-CG2 3.49Å; H352-V356 PolarHBondContact O-N 2.85Å; E353-V356 PolarHBondContact O-N 3.35Å; V356-K358 VanDerWaalsContact C-N 3.33Å; V356-K358 PolarHBondContact O-N 3.47Å; V356-R359 PolarHBondContact O-N 2.81Å; V356-R359 VanDerWaalsContact O-N 3.13Å; V356-R360 WeakPolarHBondContact O-CB 3.2Å; V356-R360 PolarHBondContact O-N 3.23Å; V356-Y410 HydrophobicContact CG1-CE2 4.04Å; V356-T413 HydrophobicContact CG2-CG2 3.86Å; V356-T414 HydrophobicContact CG1-CG2 4.1Å; V356-T414 HydrophobicContact CG2-CG2 4.46Å
357K93.7Very high90.9Very high127 Ų12780.3 Ų80.355%0.55237%0.366SS*.Hα-helixtrans-56.6-43.5176.8-71.5163.5179.6167.70111.6E353 A361E353-K357 HydrophobicContact CB-CD 4.48Å; E353-K357 WeakPolarHBondContact O-CB 3.22Å; E353-K357 VanDerWaalsContact O-CG 3.28Å; E353-K357 WeakPolarHBondContact O-CG 3.48Å; E353-K357 PolarHBondContact O-N 3.05Å; E353-K357 IonicContact OE2-NZ 2.72Å; E353-K357 PolarHBondContact OE2-NZ 2.99Å; K357-A361 PolarHBondContact O-N 2.82Å
358K95.1Very high91.5Very high124 Ų12476.5 Ų76.554%0.53935%0.354SS..Hα-helixtrans-67.1-36.5175.4-177.6176.3-178.9176.20113.5R354 R355 V356 R362R354-K358 WeakPolarHBondContact O-CB 3.33Å; R354-K358 PolarHBondContact O-N 3.28Å; R355-K358 PolarHBondContact O-N 3.45Å; V356-K358 VanDerWaalsContact C-N 3.33Å; V356-K358 PolarHBondContact O-N 3.47Å; K358-R362 WeakPolarHBondContact O-CG 3.45Å; K358-R362 PolarHBondContact O-N 3.28Å
359R93.7Very high92.2Very high84 Ų8480.4 Ų80.432%0.31737%0.372SS..Hα-helixtrans-70.7-45175.2-68.9-68.1-176.8-154.1-5.1111.1R355 V356 A361 R362 L363 Y410R355-R359 VanDerWaalsContact O-CG 3.29Å; R355-R359 WeakPolarHBondContact O-CG 3.46Å; R355-R359 PolarHBondContact O-N 2.99Å; V356-R359 PolarHBondContact O-N 2.81Å; V356-R359 VanDerWaalsContact O-N 3.13Å; R359-A361 PolarHBondContact O-N 3.17Å; R359-R362 PolarHBondContact O-N 3.34Å; R359-L363 PolarHBondContact O-N 3.1Å; R359-Y410 HydrophobicContact CB-CD2 3.95Å
360R94.4Very high92.6Very high136 Ų13674.6 Ų74.651%0.51335%0.346SS..Hα-helixtrans-53.9-51.3174.9179.7174.1-177.6-1582.6111.6V356 R362 L363 V364 Y410 L447V356-R360 WeakPolarHBondContact O-CB 3.2Å; V356-R360 PolarHBondContact O-N 3.23Å; R360-R362 VanDerWaalsContact C-N 3.31Å; R360-R362 PolarHBondContact O-N 2.92Å; R360-L363 PolarHBondContact O-N 2.99Å; R360-V364 WeakPolarHBondContact O-CG2 3.41Å; R360-V364 PolarHBondContact O-N 3.2Å; R360-Y410 HydrophobicContact CB-CD2 4.31Å; R360-Y410 HydrophobicContact CB-CE2 3.9Å; R360-L447 HydrophobicContact CG-CD1 4.31Å; R360-L447 HydrophobicContact CG-CD2 3.88Å
361A94.9Very high92.9Very high56 Ų5673.1 Ų73.146%0.46333%0.332SS..Hα-helixtrans-59.1-41179.300000112.7K357 R359 V364 V365K357-A361 PolarHBondContact O-N 2.82Å; R359-A361 PolarHBondContact O-N 3.17Å; A361-V364 PolarHBondContact O-N 2.85Å; A361-V365 WeakPolarHBondContact O-CG2 3.37Å; A361-V365 PolarHBondContact O-N 2.89Å
362R95.3Very high93.1Very high136 Ų13672.2 Ų72.251%0.51333%0.329SS..Hα-helixtrans-67.9-36.9176.6-71.4172.7173.8-153.2-7.7113.1K358 R359 R360 A366K358-R362 WeakPolarHBondContact O-CG 3.45Å; K358-R362 PolarHBondContact O-N 3.28Å; R359-R362 PolarHBondContact O-N 3.34Å; R360-R362 VanDerWaalsContact C-N 3.31Å; R360-R362 PolarHBondContact O-N 2.92Å; R362-A366 WeakPolarHBondContact O-CB 3.43Å; R362-A366 PolarHBondContact O-N 3.31Å; R362-A366 VanDerWaalsContact O-N 3.1Å
363L95.4Very high93.3Very high0 Ų075.6 Ų75.60%034%0.344CS..Hα-helixtrans-66.8-44175.6173.157.8000111.3R359 R360 V365 A366 V367 A406 L407 Y410 L443 L447R359-L363 PolarHBondContact O-N 3.1Å; R360-L363 PolarHBondContact O-N 2.99Å; L363-V365 PolarHBondContact O-N 2.75Å; L363-A366 PolarHBondContact O-N 2.91Å; L363-V367 HydrophobicContact CD1-CG2 3.82Å; L363-V367 WeakPolarHBondContact O-CG2 3.43Å; L363-V367 PolarHBondContact O-N 3.24Å; L363-A406 HydrophobicContact CB-CB 4.48Å; L363-A406 HydrophobicContact CD1-CB 4.3Å; L363-L407 HydrophobicContact CD1-CB 3.82Å; L363-L407 HydrophobicContact CD1-CD1 4.06Å; L363-L407 HydrophobicContact CD2-CD1 3.81Å; L363-Y410 HydrophobicContact CD2-CD1 3.76Å; L363-Y410 HydrophobicContact CD2-CG 3.8Å; L363-L443 HydrophobicContact CD1-CD2 4.05Å; L363-L443 HydrophobicContact CD2-CD2 3.97Å; L363-L443 HydrophobicContact CG-CD2 3.66Å; L363-L447 HydrophobicContact CD2-CD2 4.02Å
364V95.8Very high93.1Very high34 Ų3471.4 Ų71.421%0.20633%0.325CS..Hα-helixtrans-56-52.6176.1172.10000110.8R360 A361 A366 V367 E368 L443 L447R360-V364 WeakPolarHBondContact O-CG2 3.41Å; R360-V364 PolarHBondContact O-N 3.2Å; A361-V364 PolarHBondContact O-N 2.85Å; V364-A366 PolarHBondContact O-N 2.85Å; V364-V367 PolarHBondContact O-N 3.5Å; V364-E368 HydrophobicContact CG1-CG 4.42Å; V364-E368 WeakPolarHBondContact O-CB 3.41Å; V364-E368 WeakPolarHBondContact O-CG 3.45Å; V364-E368 PolarHBondContact O-N 2.95Å; V364-L443 HydrophobicContact CB-CD1 4.38Å; V364-L443 HydrophobicContact CG2-CD1 4.05Å; V364-L447 HydrophobicContact CG2-CD1 4.08Å
365V95.9Very high92.8Very high71 Ų7168 Ų6843%0.4332%0.318SS..Hα-helixtrans-60.5-47.3180174.30000111.9A361 L363 V367 E368 E369A361-V365 WeakPolarHBondContact O-CG2 3.37Å; A361-V365 PolarHBondContact O-N 2.89Å; L363-V365 PolarHBondContact O-N 2.75Å; V365-V367 VanDerWaalsContact C-N 3.29Å; V365-V367 PolarHBondContact O-N 3.02Å; V365-E368 PolarHBondContact O-N 3.47Å; V365-E369 HydrophobicContact CG1-CG 4.35Å; V365-E369 WeakPolarHBondContact CG1-OE1 3.32Å; V365-E369 WeakPolarHBondContact O-CG 3.49Å; V365-E369 PolarHBondContact O-N 3.27Å
366A95.3Very high92.5Very high14 Ų1471 Ų7112%0.11633%0.329CS..Hα-helixtrans-63-33.6-178.700000113.2R362 L363 V364 A370 A406R362-A366 WeakPolarHBondContact O-CB 3.43Å; R362-A366 PolarHBondContact O-N 3.31Å; R362-A366 VanDerWaalsContact O-N 3.1Å; L363-A366 PolarHBondContact O-N 2.91Å; V364-A366 PolarHBondContact O-N 2.85Å; A366-A370 WeakPolarHBondContact O-CB 3.42Å; A366-A370 PolarHBondContact O-N 3.45Å; A366-A370 VanDerWaalsContact O-N 3.13Å; A366-A406 HydrophobicContact CB-CB 3.93Å
367V95.4Very high91.9Very high0 Ų071.8 Ų71.80%033%0.332CS..Hα-helixtrans-77.9-37.9175.5177.40000111.5L363 V364 V365 A370 F371 M403 P439 F442 L443L363-V367 HydrophobicContact CD1-CG2 3.82Å; L363-V367 WeakPolarHBondContact O-CG2 3.43Å; L363-V367 PolarHBondContact O-N 3.24Å; V364-V367 PolarHBondContact O-N 3.5Å; V365-V367 VanDerWaalsContact C-N 3.29Å; V365-V367 PolarHBondContact O-N 3.02Å; V367-A370 PolarHBondContact O-N 3.32Å; V367-F371 HydrophobicContact CG1-CD2 3.67Å; V367-F371 HydrophobicContact CG1-CE2 3.67Å; V367-F371 VanDerWaalsContact O-CD2 3.32Å; V367-F371 WeakPolarHBondContact O-CD2 3.47Å; V367-F371 PolarHBondContact O-N 2.93Å; V367-M403 HydrophobicContact CG1-CE 4.28Å; V367-M403 HydrophobicContact CG2-CB 4Å; V367-M403 HydrophobicContact CG2-CE 4.15Å; V367-M403 HydrophobicContact CG2-SD 3.95Å; V367-P439 HydrophobicContact CG1-CB 4.07Å; V367-F442 HydrophobicContact CG1-CD1 3.74Å; V367-F442 HydrophobicContact CG1-CE1 4.3Å; V367-F442 HydrophobicContact CG2-CD1 4.34Å; V367-F442 HydrophobicContact CG2-CE1 4.17Å; V367-L443 HydrophobicContact CB-CD1 4.18Å; V367-L443 HydrophobicContact CB-CD2 4.3Å; V367-L443 HydrophobicContact CB-CG 4.29Å; V367-L443 HydrophobicContact CG1-CD1 4.32Å; V367-L443 HydrophobicContact CG1-CG 4.15Å; V367-L443 HydrophobicContact CG2-CD2 3.87Å; V367-L443 HydrophobicContact CG2-CG 4.37Å
368E94.8Very high91.1Very high65 Ų6569.3 Ų69.330%0.30432%0.322SS..Hα-helixtrans-60.7-44.2173.6-74175.5163.100111.1V364 V365 F371 I372 P439V364-E368 HydrophobicContact CG1-CG 4.42Å; V364-E368 WeakPolarHBondContact O-CB 3.41Å; V364-E368 WeakPolarHBondContact O-CG 3.45Å; V364-E368 PolarHBondContact O-N 2.95Å; V365-E368 PolarHBondContact O-N 3.47Å; E368-F371 PolarHBondContact O-N 2.81Å; E368-I372 WeakPolarHBondContact O-CD1 3.05Å; E368-I372 VanDerWaalsContact O-CG1 3.26Å; E368-I372 WeakPolarHBondContact O-CG1 3.44Å; E368-I372 PolarHBondContact O-N 3.36Å; E368-I372 VanDerWaalsContact O-N 3.07Å; E368-P439 HydrophobicContact CG-CB 3.85Å; E368-P439 HydrophobicContact CG-CG 4.18Å
369E94.2Very high90.3Very high128 Ų12865.8 Ų65.860%0.59832%0.316SS*.Hα-helixtrans-60.9-45173.5-72.3172.8172.600112.5V365 I372 H373V365-E369 HydrophobicContact CG1-CG 4.35Å; V365-E369 WeakPolarHBondContact CG1-OE1 3.32Å; V365-E369 WeakPolarHBondContact O-CG 3.49Å; V365-E369 PolarHBondContact O-N 3.27Å; E369-I372 PolarHBondContact O-N 3.3Å; E369-H373 PolarHBondContact O-N 2.86Å
370A92.3Very high89.5Confident3 Ų367 Ų673%0.02533%0.325CS..Hα-helixtrans-64.6-39.5179.400000113.3A366 V367 H373 I374 I399 S402 M403A366-A370 WeakPolarHBondContact O-CB 3.42Å; A366-A370 PolarHBondContact O-N 3.45Å; A366-A370 VanDerWaalsContact O-N 3.13Å; V367-A370 PolarHBondContact O-N 3.32Å; A370-H373 VanDerWaalsContact O-CB 3.26Å; A370-H373 WeakPolarHBondContact O-CB 3.41Å; A370-H373 PolarHBondContact O-N 3.36Å; A370-I374 PolarHBondContact O-N 3.46Å; A370-I374 VanDerWaalsContact O-N 3.15Å; A370-I399 HydrophobicContact CB-CB 4.43Å; A370-I399 HydrophobicContact CB-CD1 4.21Å; A370-S402 WeakPolarHBondContact CB-OG 3.42Å; A370-M403 HydrophobicContact CB-CE 3.41Å; A370-M403 VanDerWaalsContact CB-CE 3.41Å
371F91.8Very high88.3Confident10 Ų1063 Ų634%0.04431%0.313CS..Hα-helixtrans-72.2-32.7176.5-88.7-111.2000112.5V367 E368 H373 I374 Q375 M403 L429 C432 M437 P439 F442V367-F371 HydrophobicContact CG1-CD2 3.67Å; V367-F371 HydrophobicContact CG1-CE2 3.67Å; V367-F371 VanDerWaalsContact O-CD2 3.32Å; V367-F371 WeakPolarHBondContact O-CD2 3.47Å; V367-F371 PolarHBondContact O-N 2.93Å; E368-F371 PolarHBondContact O-N 2.81Å; F371-H373 PolarHBondContact O-N 3.1Å; F371-I374 HydrophobicContact CD1-CD1 4.22Å; F371-I374 HydrophobicContact CD2-CD1 4.4Å; F371-I374 HydrophobicContact CG-CD1 4.16Å; F371-I374 PolarHBondContact O-N 3.37Å; F371-Q375 WeakPolarHBondContact O-CG 3.39Å; F371-Q375 PolarHBondContact O-N 3.18Å; F371-M403 HydrophobicContact CE2-CE 4.4Å; F371-L429 HydrophobicContact CE2-CD1 3.68Å; F371-L429 HydrophobicContact CZ-CD1 3.8Å; F371-C432 HydrophobicContact CZ-CB 4.27Å; F371-M437 WeakPolarHBondContact CE1-O 3.27Å; F371-P439 HydrophobicContact CB-CG 3.67Å; F371-P439 HydrophobicContact CD1-CG 4.13Å; F371-P439 HydrophobicContact CD2-CB 4.46Å; F371-P439 HydrophobicContact CD2-CG 4.4Å; F371-P439 HydrophobicContact CG-CB 4.35Å; F371-P439 HydrophobicContact CG-CG 3.82Å; F371-F442 HydrophobicContact CE2-CB 4.13Å; F371-F442 HydrophobicContact CE2-CD1 4.41Å; F371-F442 HydrophobicContact CE2-CG 4.23Å; F371-F442 HydrophobicContact CZ-CB 3.79Å; F371-F442 HydrophobicContact CZ-CG 4.21Å
372I90.8Very high86.9Confident76 Ų7668.3 Ų68.339%0.3933%0.328SS..Hα-helixtrans-62-35.1169.3-70.1164.1000110.4E368 E369 Q375 R376E368-I372 WeakPolarHBondContact O-CD1 3.05Å; E368-I372 VanDerWaalsContact O-CG1 3.26Å; E368-I372 WeakPolarHBondContact O-CG1 3.44Å; E368-I372 PolarHBondContact O-N 3.36Å; E368-I372 VanDerWaalsContact O-N 3.07Å; E369-I372 PolarHBondContact O-N 3.3Å; I372-Q375 PolarHBondContact O-N 3.08Å; I372-R376 WeakPolarHBondContact O-CG 3.33Å; I372-R376 PolarHBondContact O-N 3.18Å; I372-R376 VanDerWaalsContact O-N 3.12Å
373H88.6Confident85.5Confident105 Ų10570.1 Ų70.149%0.48634%0.342SS..Hα-helixtrans-63.7-44.2173.3-165.8-88.5000112.1E369 A370 F371 Q375 R376 L377E369-H373 PolarHBondContact O-N 2.86Å; A370-H373 VanDerWaalsContact O-CB 3.26Å; A370-H373 WeakPolarHBondContact O-CB 3.41Å; A370-H373 PolarHBondContact O-N 3.36Å; F371-H373 PolarHBondContact O-N 3.1Å; H373-Q375 PolarHBondContact O-N 3.19Å; H373-R376 PolarHBondContact O-N 3.2Å; H373-L377 WeakPolarHBondContact O-CG 3.48Å; H373-L377 PolarHBondContact O-N 3.46Å
374I85.1Confident83.8Confident10 Ų1077.4 Ų77.45%0.05137%0.374CS..Hα-helixtrans-58-48.3173.8-54.6165.2000110.9A370 F371 R376 L377 Q378 I399 I433A370-I374 PolarHBondContact O-N 3.46Å; A370-I374 VanDerWaalsContact O-N 3.15Å; F371-I374 HydrophobicContact CD1-CD1 4.22Å; F371-I374 HydrophobicContact CD2-CD1 4.4Å; F371-I374 HydrophobicContact CG-CD1 4.16Å; F371-I374 PolarHBondContact O-N 3.37Å; I374-R376 PolarHBondContact O-N 2.87Å; I374-L377 PolarHBondContact O-N 3.44Å; I374-L377 VanDerWaalsContact O-N 3.17Å; I374-Q378 HydrophobicContact CG2-CG 4.05Å; I374-Q378 WeakPolarHBondContact O-CB 3.32Å; I374-Q378 WeakPolarHBondContact O-CG 3.39Å; I374-Q378 PolarHBondContact O-N 2.89Å; I374-I399 HydrophobicContact CD1-CD1 3.31Å; I374-I399 HydrophobicContact CD1-CG1 4.4Å; I374-I399 HydrophobicContact CG1-CD1 3.68Å; I374-I399 HydrophobicContact CG1-CG1 4.42Å; I374-I399 HydrophobicContact CG1-CG2 3.88Å; I374-I433 HydrophobicContact CD1-CD1 3.81Å; I374-I433 HydrophobicContact CD1-CG1 3.7Å
375Q83.9Confident82Confident124 Ų12480.6 Ų80.658%0.57940%0.398SS*.Hα-helixtrans-61.3-32.7-177.8-72.9178.6-12.100112.5F371 I372 H373 A379F371-Q375 WeakPolarHBondContact O-CG 3.39Å; F371-Q375 PolarHBondContact O-N 3.18Å; I372-Q375 PolarHBondContact O-N 3.08Å; H373-Q375 PolarHBondContact O-N 3.19Å; Q375-A379 WeakPolarHBondContact O-CB 3.38Å; Q375-A379 PolarHBondContact O-N 2.62Å; Q375-A379 VanDerWaalsContact O-N 3.14Å
376R84.1Confident80Confident158 Ų15883.9 Ų83.960%0.59642%0.42SS*.Hα-helixtrans-70.4-48.9173-70.4172.8-174.3174.92.8111.7I372 H373 I374 Q378 A379 E380I372-R376 WeakPolarHBondContact O-CG 3.33Å; I372-R376 PolarHBondContact O-N 3.18Å; I372-R376 VanDerWaalsContact O-N 3.12Å; H373-R376 PolarHBondContact O-N 3.2Å; I374-R376 PolarHBondContact O-N 2.87Å; R376-Q378 VanDerWaalsContact C-N 3.32Å; R376-Q378 PolarHBondContact O-N 2.89Å; R376-A379 PolarHBondContact O-N 2.88Å; R376-A379 VanDerWaalsContact O-N 3.1Å; R376-E380 WeakPolarHBondContact O-CG 3.31Å; R376-E380 PolarHBondContact O-N 3.41Å
377L79.9Confident78.1Confident46 Ų4686.8 Ų86.824%0.24145%0.452CS..Hα-helixtrans-56.3-45.9175.9-69.8174.6000111.6H373 I374 A379 E380 E381H373-L377 WeakPolarHBondContact O-CG 3.48Å; H373-L377 PolarHBondContact O-N 3.46Å; I374-L377 PolarHBondContact O-N 3.44Å; I374-L377 VanDerWaalsContact O-N 3.17Å; L377-A379 VanDerWaalsContact C-N 3.33Å; L377-A379 PolarHBondContact O-N 3.41Å; L377-E380 PolarHBondContact O-N 2.94Å; L377-E381 WeakPolarHBondContact O-CB 3.32Å; L377-E381 WeakPolarHBondContact O-CG 3.47Å; L377-E381 PolarHBondContact O-N 3.38Å
378Q76.7Confident76.3Confident75 Ų7595.3 Ų95.335%0.3549%0.492SS..Hα-helixtrans-63-36176.9-72.5179.1-26.900112.9I374 R376 Q382I374-Q378 HydrophobicContact CG2-CG 4.05Å; I374-Q378 WeakPolarHBondContact O-CB 3.32Å; I374-Q378 WeakPolarHBondContact O-CG 3.39Å; I374-Q378 PolarHBondContact O-N 2.89Å; R376-Q378 VanDerWaalsContact C-N 3.32Å; R376-Q378 PolarHBondContact O-N 2.89Å; Q378-Q382 WeakPolarHBondContact O-CB 3.46Å; Q378-Q382 VanDerWaalsContact O-CG 3.22Å; Q378-Q382 WeakPolarHBondContact O-CG 3.34Å; Q378-Q382 PolarHBondContact O-N 2.91Å
379A79Confident74.8Confident50 Ų5098.7 Ų98.741%0.41352%0.516SS..Hα-helixtrans-71.9-34.7175.100000112.6Q375 R376 L377Q375-A379 WeakPolarHBondContact O-CB 3.38Å; Q375-A379 PolarHBondContact O-N 2.62Å; Q375-A379 VanDerWaalsContact O-N 3.14Å; R376-A379 PolarHBondContact O-N 2.88Å; R376-A379 VanDerWaalsContact O-N 3.1Å; L377-A379 VanDerWaalsContact C-N 3.33Å; L377-A379 PolarHBondContact O-N 3.41Å
380E76.8Confident73.5Confident109 Ų10995 Ų9551%0.50950%0.5SS..Hα-helixtrans-72-35.1174.5-71.1170.9-156.200112R376 L377 Q383R376-E380 WeakPolarHBondContact O-CG 3.31Å; R376-E380 PolarHBondContact O-N 3.41Å; L377-E380 PolarHBondContact O-N 2.94Å; E380-Q383 PolarHBondContact O-N 3.07Å
381E68.9Low73.1Confident53 Ų5399 Ų9925%0.24852%0.521CS..Hα-helixtrans-70.4-37.6173.4-76.8175.6-178.400112.5L377 Q383 K384 M390L377-E381 WeakPolarHBondContact O-CB 3.32Å; L377-E381 WeakPolarHBondContact O-CG 3.47Å; L377-E381 PolarHBondContact O-N 3.38Å; E381-Q383 PolarHBondContact O-N 3.23Å; E381-Q383 VanDerWaalsContact O-N 3.15Å; E381-K384 PolarHBondContact O-N 3.3Å; E381-M390 WeakPolarHBondContact OE1-CE 3.28Å
382Q64.4Low72.7Confident167 Ų167100.2 Ų100.278%0.7853%0.53SS*.THydrogen-bonded Turntrans-62.9-16.6173-77.1171.619.100113.7Q378Q378-Q382 WeakPolarHBondContact O-CB 3.46Å; Q378-Q382 VanDerWaalsContact O-CG 3.22Å; Q378-Q382 WeakPolarHBondContact O-CG 3.34Å; Q378-Q382 PolarHBondContact O-N 2.91Å
383Q65.9Low72.5Confident175 Ų175102.6 Ų102.682%0.81853%0.534SS*.THydrogen-bonded Turntrans-89.5-7.9171.6-70.8-174.6-11.600113.8E380 E381E380-Q383 PolarHBondContact O-N 3.07Å; E381-Q383 PolarHBondContact O-N 3.23Å; E381-Q383 VanDerWaalsContact O-N 3.15Å
384K61Low72.5Confident152 Ų152103 Ų10366%0.66154%0.536SS*.SBendtrans-95.8163.9177.5-69.3175.8-176.7169.40111.5E381E381-K384 PolarHBondContact O-N 3.3Å
385S56.1Low72.6Confident102 Ų102102.9 Ų102.971%0.71354%0.537SS*.  trans-61.1144.918047.10000112.3G387S385-G387 PolarHBondContact O-N 2.78Å
386P54.3Low72.9Confident139 Ų13997 Ų9790%0.90351%0.509SS*.THydrogen-bonded Turntrans-78.143.1-163.434.1-40000115.1
387G55.9Low73.2Confident76 Ų7694.9 Ų94.978%0.78451%0.506SS*.THydrogen-bonded Turntrans-109.2-17.7-176.400000115.7S385S385-G387 PolarHBondContact O-N 2.78Å
388E57.5Low73.6Confident179 Ų17995.9 Ų95.984%0.83652%0.521SS*.  trans-141.582.8-168.6-162.8165.5-140.800109.8
389V63.6Low74.2Confident135 Ų13592.6 Ų92.682%0.81851%0.506SS*.PPolyproline II helixtrans-87.4119.7170.7-1800000107.2D391V389-D391 PolarHBondContact O-N 3.19Å
390M67.1Low74.8Confident51 Ų5190.9 Ų90.925%0.25149%0.489SS..PPolyproline II helixtrans-57.5134.3-178.8-176.1-177.8-72.800111.5E381 E394 A395E381-M390 WeakPolarHBondContact OE1-CE 3.28Å; M390-E394 HydrophobicContact CG-CB 4.11Å; M390-E394 HydrophobicContact CG-CG 4.14Å; M390-A395 HydrophobicContact CG-CB 4.19Å; M390-A395 WeakPolarHBondContact SD-CA 3.47Å; M390-A395 HydrophobicContact SD-CB 3.59Å; M390-A395 VanDerWaalsContact SD-CB 3.59Å
391D82.8Confident75.5Confident86 Ų8690.2 Ų90.246%0.4649%0.494SS..PPolyproline II helixtrans-65.7133.7176.4179.357.1000110.2V389 R393 E394 A395V389-D391 PolarHBondContact O-N 3.19Å; D391-R393 PolarHBondContact O-N 2.79Å; D391-R393 WeakPolarHBondContact OD2-CB 3.34Å; D391-R393 PolarHBondContact OD2-N 3.02Å; D391-R393 VanDerWaalsContact OD2-N 3.17Å; D391-E394 HydrophobicContact CB-CB 4.28Å; D391-E394 WeakPolarHBondContact O-CA 3.34Å; D391-E394 WeakPolarHBondContact O-CB 3.39Å; D391-E394 PolarHBondContact O-N 3.48Å; D391-A395 PolarHBondContact O-N 3.24Å
392P84.4Confident76.5Confident37 Ų3791.2 Ų91.224%0.2451%0.507CS..Hα-helixtrans-57.4-21.5-179.6-30.437.4000115.3A396 A430 I433 T434P392-A396 WeakPolarHBondContact O-CB 3.47Å; P392-A396 PolarHBondContact O-N 2.91Å; P392-A396 VanDerWaalsContact O-N 3.16Å; P392-A430 WeakPolarHBondContact O-CB 3.37Å; P392-I433 HydrophobicContact CB-CB 4.5Å; P392-I433 HydrophobicContact CB-CG2 4.24Å; P392-T434 VanDerWaalsContact CB-OG1 3.28Å; P392-T434 WeakPolarHBondContact CB-OG1 3.32Å; P392-T434 WeakPolarHBondContact CG-OG1 3.26Å
393R87.4Confident77.9Confident126 Ų12683.3 Ų83.348%0.47547%0.47SS..Hα-helixtrans-76.5-39171.3-60.9177.1160.4-121.5-3.9112.2D391 A396 Q397 E423 A430D391-R393 PolarHBondContact O-N 2.79Å; D391-R393 WeakPolarHBondContact OD2-CB 3.34Å; D391-R393 PolarHBondContact OD2-N 3.02Å; D391-R393 VanDerWaalsContact OD2-N 3.17Å; R393-A396 WeakPolarHBondContact O-CB 3.46Å; R393-A396 PolarHBondContact O-N 3.26Å; R393-Q397 WeakPolarHBondContact O-CG 3.38Å; R393-Q397 PolarHBondContact O-N 3.14Å; R393-E423 IonicContact NH1-OE1 2.61Å; R393-E423 PolarHBondContact NH1-OE1 2.88Å; R393-A430 HydrophobicContact CG-CB 4.03Å
394E88.4Confident79Confident112 Ų11275.3 Ų75.352%0.52343%0.434SS..Hα-helixtrans-62.6-46.4174.1-176.2175.6-161.200110.5M390 D391 A396 Q397 A398M390-E394 HydrophobicContact CG-CB 4.11Å; M390-E394 HydrophobicContact CG-CG 4.14Å; D391-E394 HydrophobicContact CB-CB 4.28Å; D391-E394 WeakPolarHBondContact O-CA 3.34Å; D391-E394 WeakPolarHBondContact O-CB 3.39Å; D391-E394 PolarHBondContact O-N 3.48Å; E394-A396 VanDerWaalsContact C-N 3.3Å; E394-A396 PolarHBondContact O-N 3.36Å; E394-Q397 PolarHBondContact O-N 3.48Å; E394-Q397 VanDerWaalsContact O-N 3.15Å; E394-A398 WeakPolarHBondContact O-CB 3.5Å; E394-A398 PolarHBondContact O-N 3.03Å
395A86.9Confident80.5Confident9 Ų975.6 Ų75.67%0.07443%0.431CS..Hα-helixtrans-55.8-44.2173.200000112.1M390 D391 A398 I399 I433M390-A395 HydrophobicContact CG-CB 4.19Å; M390-A395 WeakPolarHBondContact SD-CA 3.47Å; M390-A395 HydrophobicContact SD-CB 3.59Å; M390-A395 VanDerWaalsContact SD-CB 3.59Å; D391-A395 PolarHBondContact O-N 3.24Å; A395-A398 PolarHBondContact O-N 3.49Å; A395-I399 WeakPolarHBondContact O-CG1 3.44Å; A395-I399 PolarHBondContact O-N 3.46Å; A395-I433 HydrophobicContact CB-CD1 4Å; A395-I433 HydrophobicContact CB-CG2 4.42Å
396A89.6Confident82.2Confident0 Ų071.7 Ų71.70%041%0.405CS..Hα-helixtrans-63.5-44176.200000112.6P392 R393 E394 F400 L429 A430 I433P392-A396 WeakPolarHBondContact O-CB 3.47Å; P392-A396 PolarHBondContact O-N 2.91Å; P392-A396 VanDerWaalsContact O-N 3.16Å; R393-A396 WeakPolarHBondContact O-CB 3.46Å; R393-A396 PolarHBondContact O-N 3.26Å; E394-A396 VanDerWaalsContact C-N 3.3Å; E394-A396 PolarHBondContact O-N 3.36Å; A396-F400 VanDerWaalsContact O-CB 3.26Å; A396-F400 WeakPolarHBondContact O-CB 3.23Å; A396-F400 PolarHBondContact O-N 2.69Å; A396-L429 HydrophobicContact CB-CB 4Å; A396-L429 HydrophobicContact CB-CD2 3.94Å; A396-L429 HydrophobicContact CB-CG 3.78Å; A396-A430 HydrophobicContact CB-CB 4.07Å; A396-I433 HydrophobicContact CB-CD1 3.97Å
397Q90.6Very high84Confident114 Ų11465.1 Ų65.153%0.53336%0.362SS..Hα-helixtrans-64.4-40.8177.9-74.5175.91.100112.1R393 E394 I399 P401 L426R393-Q397 WeakPolarHBondContact O-CG 3.38Å; R393-Q397 PolarHBondContact O-N 3.14Å; E394-Q397 PolarHBondContact O-N 3.48Å; E394-Q397 VanDerWaalsContact O-N 3.15Å; Q397-I399 PolarHBondContact O-N 3.34Å; Q397-P401 VanDerWaalsContact O-CD 3.22Å; Q397-P401 WeakPolarHBondContact O-CD 3.34Å; Q397-L426 HydrophobicContact CG-CD1 4.19Å; Q397-L426 HydrophobicContact CG-CD2 4.19Å
398A88.5Confident85.7Confident67 Ų6762.7 Ų62.755%0.55433%0.331SS*.Hα-helixtrans-61.9-41.4179.500000112.7E394 A395E394-A398 WeakPolarHBondContact O-CB 3.5Å; E394-A398 PolarHBondContact O-N 3.03Å; A395-A398 PolarHBondContact O-N 3.49Å
399I89.3Confident87.3Confident6 Ų656.6 Ų56.63%0.03130%0.301CS..Hα-helixtrans-88.3-24.4-17867157.3000114.3A370 I374 A395 Q397 P401 S402 M403 L429A370-I399 HydrophobicContact CB-CB 4.43Å; A370-I399 HydrophobicContact CB-CD1 4.21Å; I374-I399 HydrophobicContact CD1-CD1 3.31Å; I374-I399 HydrophobicContact CD1-CG1 4.4Å; I374-I399 HydrophobicContact CG1-CD1 3.68Å; I374-I399 HydrophobicContact CG1-CG1 4.42Å; I374-I399 HydrophobicContact CG1-CG2 3.88Å; A395-I399 WeakPolarHBondContact O-CG1 3.44Å; A395-I399 PolarHBondContact O-N 3.46Å; Q397-I399 PolarHBondContact O-N 3.34Å; I399-P401 VanDerWaalsContact C-CD 3.44Å; I399-S402 WeakPolarHBondContact O-CB 3.43Å; I399-S402 PolarHBondContact O-N 3.25Å; I399-S402 PolarHBondContact O-OG 2.93Å; I399-M403 HydrophobicContact CD1-CE 3.8Å; I399-M403 HydrophobicContact CG1-CE 4.44Å; I399-L429 HydrophobicContact CD1-CD1 4.05Å; I399-L429 HydrophobicContact CD1-CD2 3.95Å; I399-L429 HydrophobicContact CD1-CG 4.32Å; I399-L429 HydrophobicContact CG1-CD2 3.94Å
400F91.8Very high88.6Confident14 Ų1450.9 Ų50.96%0.06127%0.265CS..Hα-helixtrans-53-42.1-172.7175.4-110.3000114.2A396 S402 M403 A404 M422 I425 L426 L429A396-F400 VanDerWaalsContact O-CB 3.26Å; A396-F400 WeakPolarHBondContact O-CB 3.23Å; A396-F400 PolarHBondContact O-N 2.69Å; F400-S402 PolarHBondContact O-N 3Å; F400-S402 VanDerWaalsContact O-N 3.13Å; F400-M403 HydrophobicContact CD2-CG 4.32Å; F400-M403 VanDerWaalsContact O-CG 3.27Å; F400-M403 WeakPolarHBondContact O-CG 3.38Å; F400-M403 PolarHBondContact O-N 3.43Å; F400-M403 VanDerWaalsContact O-N 3.08Å; F400-A404 HydrophobicContact CD1-CB 4.17Å; F400-A404 HydrophobicContact CD2-CB 4.39Å; F400-A404 HydrophobicContact CE1-CB 3.8Å; F400-A404 HydrophobicContact CE2-CB 4.02Å; F400-A404 HydrophobicContact CG-CB 4.46Å; F400-A404 HydrophobicContact CZ-CB 3.72Å; F400-A404 VanDerWaalsContact O-CB 3.32Å; F400-A404 WeakPolarHBondContact O-CB 3.42Å; F400-A404 PolarHBondContact O-N 3.34Å; F400-M422 HydrophobicContact CD1-CE 4.03Å; F400-M422 HydrophobicContact CE1-CE 3.84Å; F400-M422 HydrophobicContact CE1-CG 3.87Å; F400-M422 HydrophobicContact CE1-SD 3.83Å; F400-M422 HydrophobicContact CZ-CG 4.18Å; F400-I425 HydrophobicContact CD2-CG2 4.13Å; F400-I425 HydrophobicContact CE2-CB 4.42Å; F400-I425 HydrophobicContact CE2-CG2 3.62Å; F400-L426 HydrophobicContact CB-CD2 3.64Å; F400-L426 HydrophobicContact CD1-CD2 4.1Å; F400-L426 HydrophobicContact CD2-CD2 4.28Å; F400-L426 HydrophobicContact CG-CD2 3.75Å; F400-L429 HydrophobicContact CB-CD2 4.33Å
401P92Very high89.7Confident94 Ų9448.7 Ų48.761%0.6126%0.255SS*.Hα-helixtrans-54.7-32.1177.1-28.736.5000114.9Q397 I399 M403Q397-P401 VanDerWaalsContact O-CD 3.22Å; Q397-P401 WeakPolarHBondContact O-CD 3.34Å; I399-P401 VanDerWaalsContact C-CD 3.44Å; P401-M403 VanDerWaalsContact C-N 3.33Å; P401-M403 PolarHBondContact O-N 2.96Å
402S89.9Confident90Very high75 Ų7549.1 Ų49.152%0.52425%0.25SC..Hα-helixtrans-66.3-33.7179.670.30000113A370 I399 F400A370-S402 WeakPolarHBondContact CB-OG 3.42Å; I399-S402 WeakPolarHBondContact O-CB 3.43Å; I399-S402 PolarHBondContact O-N 3.25Å; I399-S402 PolarHBondContact O-OG 2.93Å; F400-S402 PolarHBondContact O-N 3Å; F400-S402 VanDerWaalsContact O-N 3.13Å
403M92.3Very high90.1Very high0 Ų048.9 Ų48.90%025%0.248CC..Hα-helixtrans-102.4-23.4-178.764.1173.672.700113.9V367 A370 F371 I399 F400 P401 R405 A406 L407 L429 F442V367-M403 HydrophobicContact CG1-CE 4.28Å; V367-M403 HydrophobicContact CG2-CB 4Å; V367-M403 HydrophobicContact CG2-CE 4.15Å; V367-M403 HydrophobicContact CG2-SD 3.95Å; A370-M403 HydrophobicContact CB-CE 3.41Å; A370-M403 VanDerWaalsContact CB-CE 3.41Å; F371-M403 HydrophobicContact CE2-CE 4.4Å; I399-M403 HydrophobicContact CD1-CE 3.8Å; I399-M403 HydrophobicContact CG1-CE 4.44Å; F400-M403 HydrophobicContact CD2-CG 4.32Å; F400-M403 VanDerWaalsContact O-CG 3.27Å; F400-M403 WeakPolarHBondContact O-CG 3.38Å; F400-M403 PolarHBondContact O-N 3.43Å; F400-M403 VanDerWaalsContact O-N 3.08Å; P401-M403 VanDerWaalsContact C-N 3.33Å; P401-M403 PolarHBondContact O-N 2.96Å; M403-R405 VanDerWaalsContact C-N 3.34Å; M403-R405 PolarHBondContact O-N 3.2Å; M403-A406 WeakPolarHBondContact O-CA 3.44Å; M403-A406 WeakPolarHBondContact O-CB 3.4Å; M403-A406 PolarHBondContact O-N 3.39Å; M403-L407 PolarHBondContact O-N 2.61Å; M403-L429 HydrophobicContact CE-CD1 4.35Å; M403-L429 HydrophobicContact CE-CD2 4.35Å; M403-L429 HydrophobicContact SD-CD2 4.28Å; M403-F442 HydrophobicContact SD-CE1 3.82Å; M403-F442 HydrophobicContact SD-CZ 4Å
404A90.6Very high90Very high8 Ų843.6 Ų43.67%0.06623%0.23CC..Hα-helixtrans-51-48.5-170.400000112.9F400 A406 L407 Q408F400-A404 HydrophobicContact CD1-CB 4.17Å; F400-A404 HydrophobicContact CD2-CB 4.39Å; F400-A404 HydrophobicContact CE1-CB 3.8Å; F400-A404 HydrophobicContact CE2-CB 4.02Å; F400-A404 HydrophobicContact CG-CB 4.46Å; F400-A404 HydrophobicContact CZ-CB 3.72Å; F400-A404 VanDerWaalsContact O-CB 3.32Å; F400-A404 WeakPolarHBondContact O-CB 3.42Å; F400-A404 PolarHBondContact O-N 3.34Å; A404-A406 VanDerWaalsContact C-N 3.3Å; A404-A406 PolarHBondContact O-N 2.8Å; A404-L407 PolarHBondContact O-N 2.77Å; A404-Q408 VanDerWaalsContact O-CB 3.28Å; A404-Q408 WeakPolarHBondContact O-CB 3.28Å; A404-Q408 PolarHBondContact O-N 2.88Å
405R91.3Very high89.8Confident157 Ų15742.2 Ų42.259%0.59222%0.219SC*.Hα-helixtrans-66.1-28.8179.8-167.8-179.1-171.8-133.410.3113.5M403 K409M403-R405 VanDerWaalsContact C-N 3.34Å; M403-R405 PolarHBondContact O-N 3.2Å; R405-K409 HydrophobicContact CG-CD 4.37Å; R405-K409 WeakPolarHBondContact O-CB 3.37Å; R405-K409 VanDerWaalsContact O-CG 3.23Å; R405-K409 WeakPolarHBondContact O-CG 3.48Å; R405-K409 PolarHBondContact O-N 3.33Å
406A92.1Very high89.5Confident20 Ų2042.6 Ų42.617%0.16522%0.22CC..Hα-helixtrans-75.8-42.3175.100000110.7L363 A366 M403 A404 Y410L363-A406 HydrophobicContact CB-CB 4.48Å; L363-A406 HydrophobicContact CD1-CB 4.3Å; A366-A406 HydrophobicContact CB-CB 3.93Å; M403-A406 WeakPolarHBondContact O-CA 3.44Å; M403-A406 WeakPolarHBondContact O-CB 3.4Å; M403-A406 PolarHBondContact O-N 3.39Å; A404-A406 VanDerWaalsContact C-N 3.3Å; A404-A406 PolarHBondContact O-N 2.8Å; A406-Y410 PolarHBondContact O-N 2.72Å
407L92.3Very high89.2Confident2 Ų246.5 Ų46.51%0.0124%0.238CC..Hα-helixtrans-66.1-54.1178.7-177.960.1000111.6L363 M403 A404 K409 Y410 L411 I425 Y446L363-L407 HydrophobicContact CD1-CB 3.82Å; L363-L407 HydrophobicContact CD1-CD1 4.06Å; L363-L407 HydrophobicContact CD2-CD1 3.81Å; M403-L407 PolarHBondContact O-N 2.61Å; A404-L407 PolarHBondContact O-N 2.77Å; L407-K409 VanDerWaalsContact C-N 3.26Å; L407-K409 PolarHBondContact O-N 2.88Å; L407-Y410 CarbonylContact O-C 3.6Å; L407-Y410 WeakPolarHBondContact O-CA 3.48Å; L407-Y410 WeakPolarHBondContact O-CB 3.37Å; L407-Y410 PolarHBondContact O-N 3.02Å; L407-L411 HydrophobicContact CD1-CD1 4.1Å; L407-L411 HydrophobicContact CD1-CD2 4.49Å; L407-L411 HydrophobicContact CD1-CG 4.1Å; L407-L411 HydrophobicContact CG-CD1 3.99Å; L407-L411 HydrophobicContact CG-CG 4.36Å; L407-L411 WeakPolarHBondContact O-CG 3.46Å; L407-L411 PolarHBondContact O-N 3.05Å; L407-I425 HydrophobicContact CD2-CD1 3.98Å; L407-I425 HydrophobicContact CD2-CG1 4.39Å; L407-I425 HydrophobicContact CD2-CG2 3.78Å; L407-Y446 HydrophobicContact CD1-CD1 4.16Å; L407-Y446 HydrophobicContact CD1-CD2 4.24Å; L407-Y446 HydrophobicContact CD1-CG 3.93Å
408Q90.9Very high88.6Confident25 Ų2544.6 Ų44.612%0.11723%0.229CC..Hα-helixtrans-56.4-39.7178.2-165.3-162.729.100111.7D72 N73 A404 R412D72-Q408 PolarHBondContact O-NE2 3.08Å; N73-Q408 PolarHBondContact OD1-NE2 2.65Å; A404-Q408 VanDerWaalsContact O-CB 3.28Å; A404-Q408 WeakPolarHBondContact O-CB 3.28Å; A404-Q408 PolarHBondContact O-N 2.88Å; Q408-R412 VanDerWaalsContact NE2-NH2 3.19Å; Q408-R412 VanDerWaalsContact O-CB 3.32Å; Q408-R412 WeakPolarHBondContact O-CB 3.28Å; Q408-R412 WeakPolarHBondContact O-CG 3.38Å; Q408-R412 PolarHBondContact O-N 2.94Å
409K91.1Very high88.1Confident51 Ų5142.7 Ų42.722%0.22221%0.208CC..Hα-helixtrans-72.7-25.9175.8-72.3-176.4-177.6-169.70113.7R405 L407 T413R405-K409 HydrophobicContact CG-CD 4.37Å; R405-K409 WeakPolarHBondContact O-CB 3.37Å; R405-K409 VanDerWaalsContact O-CG 3.23Å; R405-K409 WeakPolarHBondContact O-CG 3.48Å; R405-K409 PolarHBondContact O-N 3.33Å; L407-K409 VanDerWaalsContact C-N 3.26Å; L407-K409 PolarHBondContact O-N 2.88Å; K409-T413 WeakPolarHBondContact O-CB 3.36Å; K409-T413 PolarHBondContact O-N 2.86Å; K409-T413 PolarHBondContact O-OG1 2.82Å
410Y92.1Very high87.8Confident14 Ų1442.9 Ų42.96%0.05521%0.208CC..Hα-helixtrans-71.2-56.5169.3178.7-102.9000109.8V356 R359 R360 L363 A406 L407 R412 T413 T414 Y446 L447V356-Y410 HydrophobicContact CG1-CE2 4.04Å; R359-Y410 HydrophobicContact CB-CD2 3.95Å; R360-Y410 HydrophobicContact CB-CD2 4.31Å; R360-Y410 HydrophobicContact CB-CE2 3.9Å; L363-Y410 HydrophobicContact CD2-CD1 3.76Å; L363-Y410 HydrophobicContact CD2-CG 3.8Å; A406-Y410 PolarHBondContact O-N 2.72Å; L407-Y410 CarbonylContact O-C 3.6Å; L407-Y410 WeakPolarHBondContact O-CA 3.48Å; L407-Y410 WeakPolarHBondContact O-CB 3.37Å; L407-Y410 PolarHBondContact O-N 3.02Å; Y410-R412 PolarHBondContact O-N 3.15Å; Y410-T413 CarbonylContact O-C 3.6Å; Y410-T413 WeakPolarHBondContact O-CA 3.34Å; Y410-T413 WeakPolarHBondContact O-CB 3.33Å; Y410-T413 PolarHBondContact O-N 3.1Å; Y410-T414 HydrophobicContact CD2-CG2 4.37Å; Y410-T414 HydrophobicContact CE1-CG2 4.11Å; Y410-T414 HydrophobicContact CE2-CG2 3.86Å; Y410-T414 PolarHBondContact O-N 3.16Å; Y410-T414 PolarHBondContact O-OG1 2.9Å; Y410-T414 VanDerWaalsContact O-OG1 3.08Å; Y410-Y446 WeakPolarHBondContact CE1-O 3.49Å; Y410-L447 HydrophobicContact CD1-CD2 4.27Å; Y410-L447 HydrophobicContact CE1-CD2 3.66Å; Y410-L447 HydrophobicContact CE2-CD2 4.1Å
411L89.6Confident87.5Confident6 Ų644.9 Ų44.93%0.03122%0.224CC..Hα-helixtrans-56.2-43-179-63.7178.8000113.3L407 T413 T414 R415 Q416 H420 Y446L407-L411 HydrophobicContact CD1-CD1 4.1Å; L407-L411 HydrophobicContact CD1-CD2 4.49Å; L407-L411 HydrophobicContact CD1-CG 4.1Å; L407-L411 HydrophobicContact CG-CD1 3.99Å; L407-L411 HydrophobicContact CG-CG 4.36Å; L407-L411 WeakPolarHBondContact O-CG 3.46Å; L407-L411 PolarHBondContact O-N 3.05Å; L411-T413 VanDerWaalsContact C-N 3.32Å; L411-T413 PolarHBondContact O-N 3.29Å; L411-T414 WeakPolarHBondContact CA-OG1 3.44Å; L411-T414 CarbonylContact O-C 3.54Å; L411-T414 PolarHBondContact O-N 3.29Å; L411-T414 PolarHBondContact O-OG1 3.36Å; L411-R415 WeakPolarHBondContact O-CA 3.2Å; L411-R415 PolarHBondContact O-N 3.35Å; L411-Q416 HydrophobicContact CB-CB 4.5Å; L411-Q416 HydrophobicContact CD2-CB 3.84Å; L411-Q416 PolarHBondContact O-N 2.84Å; L411-H420 HydrophobicContact CD1-CB 4.09Å; L411-Y446 HydrophobicContact CD2-CD1 4.33Å
412R87.9Confident87.3Confident94 Ų9443 Ų4336%0.35521%0.208SC..Hα-helixtrans-64.2-33.3173.1-75176.3172.3168.6-4.6112.7N73 E76 Q408 Y410N73-R412 PolarHBondContact OD1-NH2 3.23Å; E76-R412 IonicContact OE1-CZ 3.76Å; E76-R412 IonicContact OE1-NH1 2.69Å; E76-R412 PolarHBondContact OE1-NH1 3.43Å; E76-R412 IonicContact OE2-NH1 3.22Å; Q408-R412 VanDerWaalsContact NE2-NH2 3.19Å; Q408-R412 VanDerWaalsContact O-CB 3.32Å; Q408-R412 WeakPolarHBondContact O-CB 3.28Å; Q408-R412 WeakPolarHBondContact O-CG 3.38Å; Q408-R412 PolarHBondContact O-N 2.94Å; Y410-R412 PolarHBondContact O-N 3.15Å
413T88Confident87.2Confident33 Ų3344.1 Ų44.120%0.20221%0.205CC..Hα-helixtrans-74-36.8177.7-540000111.1H352 R355 V356 K409 Y410 L411 R415H352-T413 PolarHBondContact CE1-O 2.61Å; R355-T413 HydrophobicContact CB-CG2 4.49Å; V356-T413 HydrophobicContact CG2-CG2 3.86Å; K409-T413 WeakPolarHBondContact O-CB 3.36Å; K409-T413 PolarHBondContact O-N 2.86Å; K409-T413 PolarHBondContact O-OG1 2.82Å; Y410-T413 CarbonylContact O-C 3.6Å; Y410-T413 WeakPolarHBondContact O-CA 3.34Å; Y410-T413 WeakPolarHBondContact O-CB 3.33Å; Y410-T413 PolarHBondContact O-N 3.1Å; L411-T413 VanDerWaalsContact C-N 3.32Å; L411-T413 PolarHBondContact O-N 3.29Å; T413-R415 VanDerWaalsContact C-N 3.34Å
414T85.8Confident87Confident15 Ų1545.3 Ų45.39%0.09221%0.213CC..Hα-helixtrans-86.70.5176.550.80000113.8L296 V356 Y410 L411 Q416L296-T414 WeakPolarHBondContact CD2-O 3.43Å; V356-T414 HydrophobicContact CG1-CG2 4.1Å; V356-T414 HydrophobicContact CG2-CG2 4.46Å; Y410-T414 HydrophobicContact CD2-CG2 4.37Å; Y410-T414 HydrophobicContact CE1-CG2 4.11Å; Y410-T414 HydrophobicContact CE2-CG2 3.86Å; Y410-T414 PolarHBondContact O-N 3.16Å; Y410-T414 PolarHBondContact O-OG1 2.9Å; Y410-T414 VanDerWaalsContact O-OG1 3.08Å; L411-T414 WeakPolarHBondContact CA-OG1 3.44Å; L411-T414 CarbonylContact O-C 3.54Å; L411-T414 PolarHBondContact O-N 3.29Å; L411-T414 PolarHBondContact O-OG1 3.36Å; T414-Q416 VanDerWaalsContact C-N 3.31Å; T414-Q416 VanDerWaalsContact CB-OE1 3.26Å; T414-Q416 PolarHBondContact O-N 2.76Å; T414-Q416 PolarHBondContact OG1-OE1 3.15Å
415R83Confident87Confident82 Ų8245.4 Ų45.431%0.30921%0.212SC..THydrogen-bonded Turntrans54.742.6-177.2-63.6-178.3159.6-150.8-12.7112.9N293 N295 L296 L411 T413 H418N293-R415 PolarHBondContact ND2-O 3.47Å; N295-R415 HydrophobicContact CB-CB 4.18Å; N295-R415 WeakPolarHBondContact O-CD 3.43Å; N295-R415 PolarHBondContact O-NH1 3.16Å; L296-R415 HydrophobicContact CD2-CB 4.37Å; L411-R415 WeakPolarHBondContact O-CA 3.2Å; L411-R415 PolarHBondContact O-N 3.35Å; T413-R415 VanDerWaalsContact C-N 3.34Å; R415-H418 PolarHBondContact O-CE1 3.31Å; R415-H418 VanDerWaalsContact O-CE1 3.28Å
416Q81.8Confident87Confident18 Ų1838.6 Ų38.68%0.08419%0.188CC..  trans-108.32.3-178.5-73.4170.8-4700113.5L411 T414 H418 Y419 H420L411-Q416 HydrophobicContact CB-CB 4.5Å; L411-Q416 HydrophobicContact CD2-CB 3.84Å; L411-Q416 PolarHBondContact O-N 2.84Å; T414-Q416 VanDerWaalsContact C-N 3.31Å; T414-Q416 VanDerWaalsContact CB-OE1 3.26Å; T414-Q416 PolarHBondContact O-N 2.76Å; T414-Q416 PolarHBondContact OG1-OE1 3.15Å; Q416-H418 VanDerWaalsContact C-N 3.29Å; Q416-H418 PolarHBondContact O-N 2.85Å; Q416-Y419 HydrophobicContact CB-CD2 4.23Å; Q416-Y419 HydrophobicContact CG-CD2 4.39Å; Q416-Y419 PolarHBondContact O-N 3.26Å; Q416-Y419 VanDerWaalsContact O-N 3.07Å; Q416-H420 PolarHBondContact O-CD2 3.3Å
417Q82.1Confident87Confident81 Ų8143 Ų4338%0.37921%0.205SC..G310 helixtrans-57.4-37.9-171.565.9-74.6-1100113.7Y419 H420Q417-Y419 PolarHBondContact O-N 2.86Å; Q417-H420 PolarHBondContact O-N 3.03Å
418H78.9Confident86.9Confident74 Ų7444.1 Ų44.134%0.34321%0.21SC..G310 helixtrans-70.5-7.8-179.562.5-73.3000114.3R415 Q416R415-H418 PolarHBondContact O-CE1 3.31Å; R415-H418 VanDerWaalsContact O-CE1 3.28Å; Q416-H418 VanDerWaalsContact C-N 3.29Å; Q416-H418 PolarHBondContact O-N 2.85Å
419Y76.4Confident87Confident28 Ų2842.9 Ų42.911%0.1120%0.204CC..G310 helixtrans-94.1-9.7174.9-61.9-58.9000113.6I291 Y292 N293 Q416 Q417 Y455I291-Y419 HydrophobicContact CD1-CD1 3.92Å; I291-Y419 HydrophobicContact CD1-CE1 3.38Å; I291-Y419 HydrophobicContact CG1-CE1 4.01Å; I291-Y419 HydrophobicContact CG2-CE2 4.29Å; Y292-Y419 PolarHBondContact O-OH 2.97Å; N293-Y419 HydrophobicContact CB-CE2 4.48Å; Q416-Y419 HydrophobicContact CB-CD2 4.23Å; Q416-Y419 HydrophobicContact CG-CD2 4.39Å; Q416-Y419 PolarHBondContact O-N 3.26Å; Q416-Y419 VanDerWaalsContact O-N 3.07Å; Q417-Y419 PolarHBondContact O-N 2.86Å; Y419-Y455 HydrophobicContact CD1-CD1 4.05Å; Y419-Y455 HydrophobicContact CD1-CG 4.39Å; Y419-Y455 HydrophobicContact CG-CD1 4.11Å; Y419-Y455 HydrophobicContact CG-CE1 4.29Å
420H83.8Confident87Confident10 Ų1040.9 Ų40.95%0.04620%0.197CC..  trans-140.491.3-169.2-54.7-73.1000112.1L411 Q416 Q417 I425 Y446 Y455L411-H420 HydrophobicContact CD1-CB 4.09Å; Q416-H420 PolarHBondContact O-CD2 3.3Å; Q417-H420 PolarHBondContact O-N 3.03Å; H420-I425 HydrophobicContact CB-CD1 4.05Å; H420-I425 HydrophobicContact CB-CG1 4.13Å; H420-Y446 HydrophobicContact CB-CE1 4.42Å; H420-Y446 AromaticContact CE1-CD1 3.6Å; H420-Y446 AromaticContact CE1-CE1 3.83Å; H420-Y446 AromaticContact CG-CE1 3.93Å; H420-Y446 AromaticContact ND1-CD1 3.74Å; H420-Y446 AromaticContact ND1-CE1 3.54Å; H420-Y446 AromaticContact NE2-CD1 3.8Å; H420-Y455 AromaticContact CE1-CE1 3.64Å
421S86.4Confident87Confident56 Ų5645.4 Ų45.439%0.39222%0.217SC..  trans-68.4156.2168.366.70000111.7E423 S424 I425S421-E423 VanDerWaalsContact C-N 3.3Å; S421-E423 PolarHBondContact O-N 3.36Å; S421-S424 PolarHBondContact O-N 3.07Å; S421-S424 VanDerWaalsContact O-N 3.14Å; S421-S424 WeakPolarHBondContact OG-CB 3.29Å; S421-S424 PolarHBondContact OG-N 2.82Å; S421-I425 WeakPolarHBondContact O-CG1 3.35Å; S421-I425 PolarHBondContact O-N 2.98Å
422M87.4Confident87.2Confident55 Ų5545.1 Ų45.127%0.27122%0.216SC..Hα-helixtrans-55.6-43.5176.1176.4167.3163.800112.1W74 F400 S424 I425 L426W74-M422 HydrophobicContact CB-SD 3.84Å; W74-M422 HydrophobicContact CD2-CB 4.17Å; W74-M422 HydrophobicContact CD2-SD 3.54Å; W74-M422 VanDerWaalsContact CD2-SD 3.54Å; W74-M422 HydrophobicContact CE3-SD 3.38Å; W74-M422 HydrophobicContact CG-CB 4.18Å; W74-M422 HydrophobicContact CG-SD 3.75Å; W74-M422 HydrophobicContact CZ3-SD 4.14Å; F400-M422 HydrophobicContact CD1-CE 4.03Å; F400-M422 HydrophobicContact CE1-CE 3.84Å; F400-M422 HydrophobicContact CE1-CG 3.87Å; F400-M422 HydrophobicContact CE1-SD 3.83Å; F400-M422 HydrophobicContact CZ-CG 4.18Å; M422-S424 PolarHBondContact O-N 3.13Å; M422-I425 PolarHBondContact O-N 3.4Å; M422-I425 VanDerWaalsContact O-N 3.15Å; M422-L426 HydrophobicContact CE-CD1 3.83Å; M422-L426 HydrophobicContact CG-CD1 4.07Å; M422-L426 HydrophobicContact CG-CG 4.41Å; M422-L426 WeakPolarHBondContact O-CG 3.4Å; M422-L426 PolarHBondContact O-N 2.93Å
423E87.6Confident87.3Confident97 Ų9741.3 Ų41.345%0.45320%0.202SC..Hα-helixtrans-63.1-41.2177.2-177.361.2-166.100111.9R393 S421 I425 L426 Q427R393-E423 IonicContact NH1-OE1 2.61Å; R393-E423 PolarHBondContact NH1-OE1 2.88Å; S421-E423 VanDerWaalsContact C-N 3.3Å; S421-E423 PolarHBondContact O-N 3.36Å; E423-I425 VanDerWaalsContact C-N 3.26Å; E423-I425 PolarHBondContact O-N 3.45Å; E423-L426 PolarHBondContact O-N 3.18Å; E423-Q427 VanDerWaalsContact O-CB 3.28Å; E423-Q427 WeakPolarHBondContact O-CB 3.41Å; E423-Q427 PolarHBondContact O-N 3.23Å
424S87.6Confident87.4Confident26 Ų2643.9 Ų43.918%0.18222%0.218CC..Hα-helixtrans-65.2-30.8175.4-178.50000112.5S421 M422 H428 R445S421-S424 PolarHBondContact O-N 3.07Å; S421-S424 VanDerWaalsContact O-N 3.14Å; S421-S424 WeakPolarHBondContact OG-CB 3.29Å; S421-S424 PolarHBondContact OG-N 2.82Å; M422-S424 PolarHBondContact O-N 3.13Å; S424-H428 WeakPolarHBondContact O-CB 3.42Å; S424-H428 PolarHBondContact O-N 3.42Å; S424-H428 VanDerWaalsContact O-N 3.16Å; S424-R445 PolarHBondContact OG-NH2 3.39Å
425I90.7Very high87.7Confident10 Ų1047.2 Ų47.25%0.05124%0.235CC..Hα-helixtrans-73.7-45.4176.9-65.1160.7000110.2F400 L407 H420 S421 M422 E423 H428 L429 F442 Y446F400-I425 HydrophobicContact CD2-CG2 4.13Å; F400-I425 HydrophobicContact CE2-CB 4.42Å; F400-I425 HydrophobicContact CE2-CG2 3.62Å; L407-I425 HydrophobicContact CD2-CD1 3.98Å; L407-I425 HydrophobicContact CD2-CG1 4.39Å; L407-I425 HydrophobicContact CD2-CG2 3.78Å; H420-I425 HydrophobicContact CB-CD1 4.05Å; H420-I425 HydrophobicContact CB-CG1 4.13Å; S421-I425 WeakPolarHBondContact O-CG1 3.35Å; S421-I425 PolarHBondContact O-N 2.98Å; M422-I425 PolarHBondContact O-N 3.4Å; M422-I425 VanDerWaalsContact O-N 3.15Å; E423-I425 VanDerWaalsContact C-N 3.26Å; E423-I425 PolarHBondContact O-N 3.45Å; I425-H428 PolarHBondContact O-N 3.04Å; I425-L429 WeakPolarHBondContact O-CB 3.35Å; I425-L429 PolarHBondContact O-N 3.35Å; I425-F442 HydrophobicContact CG2-CZ 4.14Å; I425-Y446 HydrophobicContact CG1-CE1 3.97Å
426L91.6Very high88Confident14 Ų1448.4 Ų48.47%0.07326%0.256CS..Hα-helixtrans-62.7-42.6176-73174.5000111.9Q397 F400 M422 E423 H428 L429 A430Q397-L426 HydrophobicContact CG-CD1 4.19Å; Q397-L426 HydrophobicContact CG-CD2 4.19Å; F400-L426 HydrophobicContact CB-CD2 3.64Å; F400-L426 HydrophobicContact CD1-CD2 4.1Å; F400-L426 HydrophobicContact CD2-CD2 4.28Å; F400-L426 HydrophobicContact CG-CD2 3.75Å; M422-L426 HydrophobicContact CE-CD1 3.83Å; M422-L426 HydrophobicContact CG-CD1 4.07Å; M422-L426 HydrophobicContact CG-CG 4.41Å; M422-L426 WeakPolarHBondContact O-CG 3.4Å; M422-L426 PolarHBondContact O-N 2.93Å; E423-L426 PolarHBondContact O-N 3.18Å; L426-H428 VanDerWaalsContact C-N 3.35Å; L426-H428 PolarHBondContact O-N 3.46Å; L426-L429 PolarHBondContact O-N 3.2Å; L426-A430 WeakPolarHBondContact O-CB 3.39Å; L426-A430 PolarHBondContact O-N 2.93Å
427Q91.4Very high88.4Confident111 Ų11150.6 Ų50.652%0.51927%0.267SS..Hα-helixtrans-62.2-41.3175.3-172.2-178.81300111.8E423 F431E423-Q427 VanDerWaalsContact O-CB 3.28Å; E423-Q427 WeakPolarHBondContact O-CB 3.41Å; E423-Q427 PolarHBondContact O-N 3.23Å; Q427-F431 WeakPolarHBondContact O-CB 3.48Å; Q427-F431 PolarHBondContact O-N 2.98Å
428H91.1Very high89Confident26 Ų2650.7 Ų50.712%0.1227%0.274CS..Hα-helixtrans-66.5-39.9175-169.867.7000112S424 I425 L426 F431 C432 F442 R445S424-H428 WeakPolarHBondContact O-CB 3.42Å; S424-H428 PolarHBondContact O-N 3.42Å; S424-H428 VanDerWaalsContact O-N 3.16Å; I425-H428 PolarHBondContact O-N 3.04Å; L426-H428 VanDerWaalsContact C-N 3.35Å; L426-H428 PolarHBondContact O-N 3.46Å; H428-F431 PolarHBondContact O-N 3.47Å; H428-C432 PolarHBondContact O-N 3.04Å; H428-C432 PolarHBondContact O-SG 3.14Å; H428-F442 AromaticContact CD2-CD2 3.48Å; H428-F442 VanDerWaalsContact CD2-CD2 3.48Å; H428-F442 WeakPolarHBondContact CD2-CD2 3.25Å; H428-F442 AromaticContact CD2-CE2 3.75Å; H428-F442 PolarHBondContact NE2-O 3.46Å; H428-R445 WeakPolarHBondContact ND1-CD 3.38Å; H428-R445 PolarHBondContact ND1-NH1 3.42Å; H428-R445 VanDerWaalsContact ND1-NH1 3.16Å
429L92.6Very high89.6Confident0 Ų048.4 Ų48.40%027%0.265CS..Hα-helixtrans-65.6-47.2178-174.156.4000111.6F371 A396 I399 F400 M403 I425 L426 F431 C432 I433 F442F371-L429 HydrophobicContact CE2-CD1 3.68Å; F371-L429 HydrophobicContact CZ-CD1 3.8Å; A396-L429 HydrophobicContact CB-CB 4Å; A396-L429 HydrophobicContact CB-CD2 3.94Å; A396-L429 HydrophobicContact CB-CG 3.78Å; I399-L429 HydrophobicContact CD1-CD1 4.05Å; I399-L429 HydrophobicContact CD1-CD2 3.95Å; I399-L429 HydrophobicContact CD1-CG 4.32Å; I399-L429 HydrophobicContact CG1-CD2 3.94Å; F400-L429 HydrophobicContact CB-CD2 4.33Å; M403-L429 HydrophobicContact CE-CD1 4.35Å; M403-L429 HydrophobicContact CE-CD2 4.35Å; M403-L429 HydrophobicContact SD-CD2 4.28Å; I425-L429 WeakPolarHBondContact O-CB 3.35Å; I425-L429 PolarHBondContact O-N 3.35Å; L426-L429 PolarHBondContact O-N 3.2Å; L429-F431 VanDerWaalsContact C-N 3.34Å; L429-F431 PolarHBondContact O-N 3.42Å; L429-C432 WeakPolarHBondContact O-CB 3.44Å; L429-C432 PolarHBondContact O-N 3.44Å; L429-C432 VanDerWaalsContact O-N 3.14Å; L429-I433 HydrophobicContact CG-CD1 4.25Å; L429-I433 WeakPolarHBondContact O-CG1 3.42Å; L429-I433 PolarHBondContact O-N 3.23Å; L429-F442 HydrophobicContact CB-CD2 4.24Å; L429-F442 HydrophobicContact CB-CE2 3.69Å; L429-F442 HydrophobicContact CB-CZ 4.47Å; L429-F442 HydrophobicContact CD1-CD2 3.78Å; L429-F442 HydrophobicContact CD1-CE2 3.74Å; L429-F442 HydrophobicContact CD1-CG 4.31Å; L429-F442 HydrophobicContact CD1-CZ 4.21Å; L429-F442 HydrophobicContact CG-CE2 4.24Å
430A91.9Very high90.3Very high8 Ų854 Ų547%0.06629%0.29CS..Hα-helixtrans-57.5-46.4173.800000111.1P392 R393 A396 L426 C432 I433 T434P392-A430 WeakPolarHBondContact O-CB 3.37Å; R393-A430 HydrophobicContact CG-CB 4.03Å; A396-A430 HydrophobicContact CB-CB 4.07Å; L426-A430 WeakPolarHBondContact O-CB 3.39Å; L426-A430 PolarHBondContact O-N 2.93Å; A430-C432 VanDerWaalsContact C-N 3.33Å; A430-C432 PolarHBondContact O-N 3.13Å; A430-I433 PolarHBondContact O-N 3.33Å; A430-I433 VanDerWaalsContact O-N 3.11Å; A430-T434 PolarHBondContact O-N 2.92Å; A430-T434 PolarHBondContact O-OG1 3.21Å
431F92.1Very high90.7Very high110 Ų11055.3 Ų55.348%0.48230%0.302SS..Hα-helixtrans-59.3-40.4174.8177-97.7000112.9Q427 H428 L429 N435 M437Q427-F431 WeakPolarHBondContact O-CB 3.48Å; Q427-F431 PolarHBondContact O-N 2.98Å; H428-F431 PolarHBondContact O-N 3.47Å; L429-F431 VanDerWaalsContact C-N 3.34Å; L429-F431 PolarHBondContact O-N 3.42Å; F431-N435 WeakPolarHBondContact CD2-ND2 3.46Å; F431-N435 VanDerWaalsContact CE2-ND2 3.33Å; F431-N435 WeakPolarHBondContact CE2-ND2 3.27Å; F431-N435 PolarHBondContact O-N 2.84Å; F431-N435 PolarHBondContact O-ND2 3.3Å; F431-M437 HydrophobicContact CD1-CE 4.2Å; F431-M437 HydrophobicContact CD1-SD 4.5Å; F431-M437 HydrophobicContact CE1-CE 3.48Å; F431-M437 VanDerWaalsContact CE1-CE 3.48Å; F431-M437 HydrophobicContact CE1-SD 4.24Å; F431-M437 HydrophobicContact CZ-CE 4.04Å
432C92.7Very high90.9Very high0 Ų052.6 Ų52.60%028%0.284CS..Hα-helixtrans-63.8-39.3173.7-72.20000112.5F371 H428 L429 A430 S436 M437 F442F371-C432 HydrophobicContact CZ-CB 4.27Å; H428-C432 PolarHBondContact O-N 3.04Å; H428-C432 PolarHBondContact O-SG 3.14Å; L429-C432 WeakPolarHBondContact O-CB 3.44Å; L429-C432 PolarHBondContact O-N 3.44Å; L429-C432 VanDerWaalsContact O-N 3.14Å; A430-C432 VanDerWaalsContact C-N 3.33Å; A430-C432 PolarHBondContact O-N 3.13Å; C432-S436 PolarHBondContact O-N 2.95Å; C432-M437 HydrophobicContact CB-CB 4Å; C432-M437 HydrophobicContact CB-CG 4.49Å; C432-M437 HydrophobicContact CB-SD 4.45Å; C432-M437 WeakPolarHBondContact O-CB 3.32Å; C432-M437 PolarHBondContact O-N 3.42Å; C432-F442 HydrophobicContact CB-CB 4.39Å
433I90.3Very high91.2Very high13 Ų1350.1 Ų50.17%0.06727%0.272CS..Hα-helixtrans-66.6-49.1177.1-65.4165.3000110.7I374 P392 A395 A396 L429 A430 N435 S436I374-I433 HydrophobicContact CD1-CD1 3.81Å; I374-I433 HydrophobicContact CD1-CG1 3.7Å; P392-I433 HydrophobicContact CB-CB 4.5Å; P392-I433 HydrophobicContact CB-CG2 4.24Å; A395-I433 HydrophobicContact CB-CD1 4Å; A395-I433 HydrophobicContact CB-CG2 4.42Å; A396-I433 HydrophobicContact CB-CD1 3.97Å; L429-I433 HydrophobicContact CG-CD1 4.25Å; L429-I433 WeakPolarHBondContact O-CG1 3.42Å; L429-I433 PolarHBondContact O-N 3.23Å; A430-I433 PolarHBondContact O-N 3.33Å; A430-I433 VanDerWaalsContact O-N 3.11Å; I433-N435 PolarHBondContact O-N 3.45Å; I433-S436 PolarHBondContact O-N 2.93Å; I433-S436 VanDerWaalsContact O-N 3.07Å
434T90.9Very high91.3Very high88 Ų8849.7 Ų49.754%0.5427%0.27SS..Hα-helixtrans-56.7-33.7178.9-530000112.8P392 A430P392-T434 VanDerWaalsContact CB-OG1 3.28Å; P392-T434 WeakPolarHBondContact CB-OG1 3.32Å; P392-T434 WeakPolarHBondContact CG-OG1 3.26Å; A430-T434 PolarHBondContact O-N 2.92Å; A430-T434 PolarHBondContact O-OG1 3.21Å
435N91.3Very high91.2Very high84 Ų8451 Ų5145%0.44927%0.271SS..THydrogen-bonded Turntrans-99.913.8-178.5-66.8-84000113.4F431 I433 M437F431-N435 WeakPolarHBondContact CD2-ND2 3.46Å; F431-N435 VanDerWaalsContact CE2-ND2 3.33Å; F431-N435 WeakPolarHBondContact CE2-ND2 3.27Å; F431-N435 PolarHBondContact O-N 2.84Å; F431-N435 PolarHBondContact O-ND2 3.3Å; I433-N435 PolarHBondContact O-N 3.45Å; N435-M437 HydrophobicContact CB-CE 3.7Å; N435-M437 HydrophobicContact CB-CG 3.87Å; N435-M437 HydrophobicContact CB-SD 4.5Å; N435-M437 PolarHBondContact O-N 3.39Å; N435-M437 VanDerWaalsContact O-N 3.12Å
436S88.6Confident91.1Very high108 Ų10850.6 Ų50.676%0.75527%0.268SS*.THydrogen-bonded Turntrans50.437-179.3-60.30000114C432 I433C432-S436 PolarHBondContact O-N 2.95Å; I433-S436 PolarHBondContact O-N 2.93Å; I433-S436 VanDerWaalsContact O-N 3.07Å
437M91.6Very high90.9Very high63 Ų6351.7 Ų51.731%0.3127%0.274SS..  trans-74.2152.5-175.9-62.8-166.2176.200112.2F371 F431 C432 N435 A441F371-M437 WeakPolarHBondContact CE1-O 3.27Å; F431-M437 HydrophobicContact CD1-CE 4.2Å; F431-M437 HydrophobicContact CD1-SD 4.5Å; F431-M437 HydrophobicContact CE1-CE 3.48Å; F431-M437 VanDerWaalsContact CE1-CE 3.48Å; F431-M437 HydrophobicContact CE1-SD 4.24Å; F431-M437 HydrophobicContact CZ-CE 4.04Å; C432-M437 HydrophobicContact CB-CB 4Å; C432-M437 HydrophobicContact CB-CG 4.49Å; C432-M437 HydrophobicContact CB-SD 4.45Å; C432-M437 WeakPolarHBondContact O-CB 3.32Å; C432-M437 PolarHBondContact O-N 3.42Å; N435-M437 HydrophobicContact CB-CE 3.7Å; N435-M437 HydrophobicContact CB-CG 3.87Å; N435-M437 HydrophobicContact CB-SD 4.5Å; N435-M437 PolarHBondContact O-N 3.39Å; N435-M437 VanDerWaalsContact O-N 3.12Å; M437-A441 HydrophobicContact CB-CB 4.12Å; M437-A441 HydrophobicContact SD-CB 4.47Å
438T93.1Very high90.3Very high84 Ų8448.8 Ų48.852%0.51527%0.266SS..  trans-74.9158.217868.10000112.3K440 A441 F442T438-K440 PolarHBondContact O-N 2.82Å; T438-K440 VanDerWaalsContact O-N 3.08Å; T438-A441 WeakPolarHBondContact O-CB 3.22Å; T438-A441 PolarHBondContact O-N 3.22Å; T438-A441 PolarHBondContact OG1-N 2.87Å; T438-F442 PolarHBondContact O-N 3.11Å
439P92.4Very high89.2Confident25 Ų2549 Ų4916%0.16227%0.272CS..Hα-helixtrans-50-36.6172.4-28.234.2000113.3V367 E368 F371 F442 L443V367-P439 HydrophobicContact CG1-CB 4.07Å; E368-P439 HydrophobicContact CG-CB 3.85Å; E368-P439 HydrophobicContact CG-CG 4.18Å; F371-P439 HydrophobicContact CB-CG 3.67Å; F371-P439 HydrophobicContact CD1-CG 4.13Å; F371-P439 HydrophobicContact CD2-CB 4.46Å; F371-P439 HydrophobicContact CD2-CG 4.4Å; F371-P439 HydrophobicContact CG-CB 4.35Å; F371-P439 HydrophobicContact CG-CG 3.82Å; P439-F442 PolarHBondContact O-N 2.97Å; P439-L443 WeakPolarHBondContact O-CB 3.44Å; P439-L443 VanDerWaalsContact O-CG 3.25Å; P439-L443 WeakPolarHBondContact O-CG 3.48Å; P439-L443 PolarHBondContact O-N 3.15Å
440K91.6Very high88Confident146 Ų14649.3 Ų49.364%0.63528%0.275SS*.Hα-helixtrans-69.5-32.7-179.6-66.4176.8-1791710112.6T438 L443 E444T438-K440 PolarHBondContact O-N 2.82Å; T438-K440 VanDerWaalsContact O-N 3.08Å; K440-L443 PolarHBondContact O-N 2.9Å; K440-E444 PolarHBondContact O-N 3.3Å
441A90.7Very high87.1Confident37 Ų3750.9 Ų50.931%0.30629%0.285SS..Hα-helixtrans-73.4-37.6175.300000111.9M437 T438 L443 E444M437-A441 HydrophobicContact CB-CB 4.12Å; M437-A441 HydrophobicContact SD-CB 4.47Å; T438-A441 WeakPolarHBondContact O-CB 3.22Å; T438-A441 PolarHBondContact O-N 3.22Å; T438-A441 PolarHBondContact OG1-N 2.87Å; A441-L443 VanDerWaalsContact C-N 3.33Å; A441-E444 PolarHBondContact O-N 3.01Å
442F92.2Very high85.9Confident0 Ų046.3 Ų46.30%027%0.266CS..Hα-helixtrans-60.5-44.8169.1171.8-98.4000111.4V367 F371 M403 I425 H428 L429 C432 T438 P439 E444 Y446V367-F442 HydrophobicContact CG1-CD1 3.74Å; V367-F442 HydrophobicContact CG1-CE1 4.3Å; V367-F442 HydrophobicContact CG2-CD1 4.34Å; V367-F442 HydrophobicContact CG2-CE1 4.17Å; F371-F442 HydrophobicContact CE2-CB 4.13Å; F371-F442 HydrophobicContact CE2-CD1 4.41Å; F371-F442 HydrophobicContact CE2-CG 4.23Å; F371-F442 HydrophobicContact CZ-CB 3.79Å; F371-F442 HydrophobicContact CZ-CG 4.21Å; M403-F442 HydrophobicContact SD-CE1 3.82Å; M403-F442 HydrophobicContact SD-CZ 4Å; I425-F442 HydrophobicContact CG2-CZ 4.14Å; H428-F442 AromaticContact CD2-CD2 3.48Å; H428-F442 VanDerWaalsContact CD2-CD2 3.48Å; H428-F442 WeakPolarHBondContact CD2-CD2 3.25Å; H428-F442 AromaticContact CD2-CE2 3.75Å; H428-F442 PolarHBondContact NE2-O 3.46Å; L429-F442 HydrophobicContact CB-CD2 4.24Å; L429-F442 HydrophobicContact CB-CE2 3.69Å; L429-F442 HydrophobicContact CB-CZ 4.47Å; L429-F442 HydrophobicContact CD1-CD2 3.78Å; L429-F442 HydrophobicContact CD1-CE2 3.74Å; L429-F442 HydrophobicContact CD1-CG 4.31Å; L429-F442 HydrophobicContact CD1-CZ 4.21Å; L429-F442 HydrophobicContact CG-CE2 4.24Å; C432-F442 HydrophobicContact CB-CB 4.39Å; T438-F442 PolarHBondContact O-N 3.11Å; P439-F442 PolarHBondContact O-N 2.97Å; F442-E444 VanDerWaalsContact C-N 3.33Å; F442-E444 PolarHBondContact O-N 3.17Å; F442-Y446 HydrophobicContact CD1-CE2 4.23Å; F442-Y446 HydrophobicContact CD2-CE2 4.31Å; F442-Y446 HydrophobicContact CE1-CD2 4.33Å; F442-Y446 AromaticContact CE1-CE2 3.77Å; F442-Y446 HydrophobicContact CE1-CE2 3.77Å; F442-Y446 AromaticContact CE2-CE2 3.83Å; F442-Y446 HydrophobicContact CE2-CE2 3.83Å; F442-Y446 HydrophobicContact CG-CE2 4.49Å; F442-Y446 AromaticContact CZ-CE2 3.55Å; F442-Y446 HydrophobicContact CZ-CE2 3.55Å; F442-Y446 WeakPolarHBondContact O-CD2 3.28Å; F442-Y446 WeakPolarHBondContact O-CE2 3.33Å
443L92.5Very high84.6Confident3 Ų351.2 Ų51.22%0.01629%0.292CS..Hα-helixtrans-69.6-22.6-178.5-74.8170000114.9L363 V364 V367 P439 K440 A441 R445 Y446 L447L363-L443 HydrophobicContact CD1-CD2 4.05Å; L363-L443 HydrophobicContact CD2-CD2 3.97Å; L363-L443 HydrophobicContact CG-CD2 3.66Å; V364-L443 HydrophobicContact CB-CD1 4.38Å; V364-L443 HydrophobicContact CG2-CD1 4.05Å; V367-L443 HydrophobicContact CB-CD1 4.18Å; V367-L443 HydrophobicContact CB-CD2 4.3Å; V367-L443 HydrophobicContact CB-CG 4.29Å; V367-L443 HydrophobicContact CG1-CD1 4.32Å; V367-L443 HydrophobicContact CG1-CG 4.15Å; V367-L443 HydrophobicContact CG2-CD2 3.87Å; V367-L443 HydrophobicContact CG2-CG 4.37Å; P439-L443 WeakPolarHBondContact O-CB 3.44Å; P439-L443 VanDerWaalsContact O-CG 3.25Å; P439-L443 WeakPolarHBondContact O-CG 3.48Å; P439-L443 PolarHBondContact O-N 3.15Å; K440-L443 PolarHBondContact O-N 2.9Å; A441-L443 VanDerWaalsContact C-N 3.33Å; L443-R445 VanDerWaalsContact C-N 3.27Å; L443-R445 PolarHBondContact O-N 2.92Å; L443-Y446 PolarHBondContact O-N 3.2Å; L443-Y446 VanDerWaalsContact O-N 3.1Å; L443-L447 HydrophobicContact CB-CD1 3.85Å; L443-L447 HydrophobicContact CB-CG 4.14Å; L443-L447 HydrophobicContact CD1-CD1 4.36Å; L443-L447 HydrophobicContact CD2-CD1 4.41Å; L443-L447 HydrophobicContact CD2-CG 4.44Å; L443-L447 HydrophobicContact CG-CD1 4.45Å; L443-L447 WeakPolarHBondContact O-CB 3.21Å; L443-L447 WeakPolarHBondContact O-CG 3.44Å; L443-L447 PolarHBondContact O-N 3.49Å
444E89.9Confident83.3Confident88 Ų8854 Ų5441%0.41130%0.304SS..Hα-helixtrans-53.2-44.9-178.7-175.5-80.7158.900111.6K440 A441 F442 Y446 S448K440-E444 PolarHBondContact O-N 3.3Å; A441-E444 PolarHBondContact O-N 3.01Å; F442-E444 VanDerWaalsContact C-N 3.33Å; F442-E444 PolarHBondContact O-N 3.17Å; E444-Y446 PolarHBondContact O-N 3.16Å; E444-Y446 VanDerWaalsContact O-N 3.15Å; E444-S448 WeakPolarHBondContact O-CB 3.38Å; E444-S448 PolarHBondContact O-N 3.39Å; E444-S448 PolarHBondContact O-OG 3.1Å
445R86.3Confident82.1Confident54 Ų5451.4 Ų51.420%0.20429%0.285CS..Hα-helixtrans-62.1-21.5-179.3-172.1170.5-177-177.3-3.4114.9S424 H428 L443 Y455S424-R445 PolarHBondContact OG-NH2 3.39Å; H428-R445 WeakPolarHBondContact ND1-CD 3.38Å; H428-R445 PolarHBondContact ND1-NH1 3.42Å; H428-R445 VanDerWaalsContact ND1-NH1 3.16Å; L443-R445 VanDerWaalsContact C-N 3.27Å; L443-R445 PolarHBondContact O-N 2.92Å; R445-Y455 PolarHBondContact O-OH 2.95Å
446Y87.6Confident80.4Confident0 Ų050.5 Ų50.50%028%0.28CS..Hα-helixtrans-109.7-38.3-177.2-49.4-74.6000112.3L407 Y410 L411 H420 I425 F442 L443 E444L407-Y446 HydrophobicContact CD1-CD1 4.16Å; L407-Y446 HydrophobicContact CD1-CD2 4.24Å; L407-Y446 HydrophobicContact CD1-CG 3.93Å; Y410-Y446 WeakPolarHBondContact CE1-O 3.49Å; L411-Y446 HydrophobicContact CD2-CD1 4.33Å; H420-Y446 HydrophobicContact CB-CE1 4.42Å; H420-Y446 AromaticContact CE1-CD1 3.6Å; H420-Y446 AromaticContact CE1-CE1 3.83Å; H420-Y446 AromaticContact CG-CE1 3.93Å; H420-Y446 AromaticContact ND1-CD1 3.74Å; H420-Y446 AromaticContact ND1-CE1 3.54Å; H420-Y446 AromaticContact NE2-CD1 3.8Å; I425-Y446 HydrophobicContact CG1-CE1 3.97Å; F442-Y446 HydrophobicContact CD1-CE2 4.23Å; F442-Y446 HydrophobicContact CD2-CE2 4.31Å; F442-Y446 HydrophobicContact CE1-CD2 4.33Å; F442-Y446 AromaticContact CE1-CE2 3.77Å; F442-Y446 HydrophobicContact CE1-CE2 3.77Å; F442-Y446 AromaticContact CE2-CE2 3.83Å; F442-Y446 HydrophobicContact CE2-CE2 3.83Å; F442-Y446 HydrophobicContact CG-CE2 4.49Å; F442-Y446 AromaticContact CZ-CE2 3.55Å; F442-Y446 HydrophobicContact CZ-CE2 3.55Å; F442-Y446 WeakPolarHBondContact O-CD2 3.28Å; F442-Y446 WeakPolarHBondContact O-CE2 3.33Å; L443-Y446 PolarHBondContact O-N 3.2Å; L443-Y446 VanDerWaalsContact O-N 3.1Å; E444-Y446 PolarHBondContact O-N 3.16Å; E444-Y446 VanDerWaalsContact O-N 3.15Å
447L87.2Confident78.7Confident37 Ų3754.6 Ų54.619%0.19428%0.284CS..Hα-helixtrans-80-25.2-178-63.3-172.9000112.9R360 L363 V364 Y410 L443R360-L447 HydrophobicContact CG-CD1 4.31Å; R360-L447 HydrophobicContact CG-CD2 3.88Å; L363-L447 HydrophobicContact CD2-CD2 4.02Å; V364-L447 HydrophobicContact CG2-CD1 4.08Å; Y410-L447 HydrophobicContact CD1-CD2 4.27Å; Y410-L447 HydrophobicContact CE1-CD2 3.66Å; Y410-L447 HydrophobicContact CE2-CD2 4.1Å; L443-L447 HydrophobicContact CB-CD1 3.85Å; L443-L447 HydrophobicContact CB-CG 4.14Å; L443-L447 HydrophobicContact CD1-CD1 4.36Å; L443-L447 HydrophobicContact CD2-CD1 4.41Å; L443-L447 HydrophobicContact CD2-CG 4.44Å; L443-L447 HydrophobicContact CG-CD1 4.45Å; L443-L447 WeakPolarHBondContact O-CB 3.21Å; L443-L447 WeakPolarHBondContact O-CG 3.44Å; L443-L447 PolarHBondContact O-N 3.49Å
448S78.7Confident76.8Confident50 Ų5058.4 Ų58.435%0.3531%0.306SS..SBendtrans-108.5126.7167.4-0.10000107.4E444 G450E444-S448 WeakPolarHBondContact O-CB 3.38Å; E444-S448 PolarHBondContact O-N 3.39Å; E444-S448 PolarHBondContact O-OG 3.1Å; S448-G450 PolarHBondContact O-N 3.48Å
449A68.1Low75.1Confident31 Ų3159.2 Ų59.226%0.25630%0.3SS..  trans-69.39116400000107.4T290 I291T290-A449 WeakPolarHBondContact CB-O 3.4Å; T290-A449 HydrophobicContact CG2-CB 4.35Å; T290-A449 WeakPolarHBondContact CG2-O 3.46Å; I291-A449 HydrophobicContact CG2-CB 4.33Å
450G68.7Low73Confident6 Ų665.6 Ų65.66%0.06232%0.32CS..  trans-61.2176.9-178.400000113.5S448S448-G450 PolarHBondContact O-N 3.48Å
451P71.9Confident70.9Confident41 Ų4162.2 Ų62.227%0.26631%0.309SS..BIsolated β-bridgetrans-56.9146.7-17720.8-32000112.9Y286 K287 L453 Q454Y286-P451 WeakPolarHBondContact O-CB 3.43Å; K287-P451 VanDerWaalsContact O-CB 3.31Å; K287-P451 WeakPolarHBondContact O-CB 3.41Å; P451-L453 PolarHBondContact O-N 3.05Å; P451-Q454 HydrophobicContact CG-CG 4.15Å; P451-Q454 WeakPolarHBondContact O-CB 3.38Å; P451-Q454 PolarHBondContact O-N 2.93Å
452T67.2Low69.2Low15 Ų1561.8 Ų61.89%0.09230%0.304CS..G310 helixtrans-48.7-35.4-176.2-57.20000113Y286 Q454 Y455Y286-T452 HydrophobicContact CD1-CG2 3.85Å; Y286-T452 HydrophobicContact CE1-CG2 4.06Å; Y286-T452 PolarHBondContact O-N 3.48Å; T452-Q454 PolarHBondContact O-N 3.22Å; T452-Q454 VanDerWaalsContact O-N 3.1Å; T452-Y455 PolarHBondContact O-N 3.32Å
453L65.3Low67.8Low102 Ų10265.9 Ų65.953%0.53433%0.329SS..G310 helixtrans-54.7-22.7175.6-73.5161.7000115.7Y286 P451 Y455Y286-L453 WeakPolarHBondContact O-CD1 3.31Å; Y286-L453 WeakPolarHBondContact O-CG 3.48Å; Y286-L453 PolarHBondContact O-N 3.44Å; P451-L453 PolarHBondContact O-N 3.05Å; L453-Y455 PolarHBondContact O-N 3.31Å
454Q63.3Low67Low71 Ų7170.9 Ų70.933%0.33235%0.352SS..G310 helixtrans-73-10-176.8-70.1-177.4-10.100114.4P451 T452P451-Q454 HydrophobicContact CG-CG 4.15Å; P451-Q454 WeakPolarHBondContact O-CB 3.38Å; P451-Q454 PolarHBondContact O-N 2.93Å; T452-Q454 PolarHBondContact O-N 3.22Å; T452-Q454 VanDerWaalsContact O-N 3.1Å
455Y65Low66.8Low34 Ų3468.7 Ų68.713%0.13334%0.34CS..G310 helixtrans-125.314-167.8-58.3-82.1000113.2I291 Y419 H420 R445 T452 L453 K457I291-Y455 HydrophobicContact CB-CD2 4.17Å; I291-Y455 HydrophobicContact CB-CE2 4.4Å; I291-Y455 HydrophobicContact CD1-CD1 4.49Å; I291-Y455 HydrophobicContact CD1-CD2 3.55Å; I291-Y455 HydrophobicContact CD1-CE2 4.44Å; I291-Y455 HydrophobicContact CD1-CG 3.59Å; I291-Y455 HydrophobicContact CG1-CD2 4.48Å; I291-Y455 HydrophobicContact CG2-CD2 4.23Å; I291-Y455 HydrophobicContact CG2-CE2 4.06Å; Y419-Y455 HydrophobicContact CD1-CD1 4.05Å; Y419-Y455 HydrophobicContact CD1-CG 4.39Å; Y419-Y455 HydrophobicContact CG-CD1 4.11Å; Y419-Y455 HydrophobicContact CG-CE1 4.29Å; H420-Y455 AromaticContact CE1-CE1 3.64Å; R445-Y455 PolarHBondContact O-OH 2.95Å; T452-Y455 PolarHBondContact O-N 3.32Å; L453-Y455 PolarHBondContact O-N 3.31Å; Y455-K457 PolarHBondContact O-N 3.08Å
456D56.2Low67Low65 Ų6574.7 Ų74.735%0.34836%0.363SS..  trans-101.946-151.7-158.722.9000114.8
457K53.6Low67.2Low194 Ų19476.9 Ų76.984%0.84338%0.375SS*.SBendtrans-85.5-41.8177.4-89-170.2170.8-174.50114.3Y455Y455-K457 PolarHBondContact O-N 3.08Å
458D52.1Low67.4Low143 Ų14378.9 Ų78.977%0.76539%0.385SS*.SBendtrans-118.7-1-167.3-51.9-58.8000114.1W460D458-W460 VanDerWaalsContact C-N 3.33Å; D458-W460 PolarHBondContact O-N 3.4Å
459R56.3Low68Low102 Ų10277.8 Ų77.839%0.38538%0.377SS..  trans-91.940.2-175.8-71.5-173.6172.2-115.1-5.7114.3L461 S462R459-L461 VanDerWaalsContact C-N 3.25Å; R459-L461 PolarHBondContact O-N 2.97Å; R459-L461 VanDerWaalsContact O-N 3.15Å; R459-S462 VanDerWaalsContact O-CB 3.31Å; R459-S462 WeakPolarHBondContact O-CB 3.4Å; R459-S462 PolarHBondContact O-N 2.86Å; R459-S462 PolarHBondContact O-OG 2.64Å
460W49.6Very low69Low158 Ų15884.2 Ų84.260%0.59841%0.407SS*.G310 helixtrans-53.2-37.9-17869-80.8000113.8I97 D458 S462 T463I97-W460 HydrophobicContact CG1-CH2 4.33Å; D458-W460 VanDerWaalsContact C-N 3.33Å; D458-W460 PolarHBondContact O-N 3.4Å; W460-S462 PolarHBondContact O-N 3.08Å; W460-T463 WeakPolarHBondContact O-CB 3.5Å; W460-T463 WeakPolarHBondContact O-CG2 3.33Å; W460-T463 PolarHBondContact O-N 3.45Å; W460-T463 VanDerWaalsContact O-N 3.09Å; W460-T463 PolarHBondContact O-OG1 3.13Å
461L47.4Very low69.9Low75 Ų7586.8 Ų86.839%0.39342%0.417SS..G310 helixtrans-61.3-21.2175.1-75.1161.9000114.3R459 T463 L488R459-L461 VanDerWaalsContact C-N 3.25Å; R459-L461 PolarHBondContact O-N 2.97Å; R459-L461 VanDerWaalsContact O-N 3.15Å; L461-T463 PolarHBondContact O-N 3.33Å; L461-L488 HydrophobicContact CB-CD1 3.96Å; L461-L488 HydrophobicContact CD2-CD1 4.48Å
462S55.1Low70.6Confident28 Ų2887.2 Ų87.220%0.19642%0.424CS..G310 helixtrans-75.8-717676.40000113.9Y286 R459 W460 W465Y286-S462 PolarHBondContact OH-O 3.12Å; R459-S462 VanDerWaalsContact O-CB 3.31Å; R459-S462 WeakPolarHBondContact O-CB 3.4Å; R459-S462 PolarHBondContact O-N 2.86Å; R459-S462 PolarHBondContact O-OG 2.64Å; W460-S462 PolarHBondContact O-N 3.08Å; S462-W465 PolarHBondContact O-NE1 3.07Å
463T63Low71.4Confident87 Ų8787.8 Ų87.853%0.53443%0.427SS..G310 helixtrans-84.4-14.2178.467.10000113.8W460 L461 W465W460-T463 WeakPolarHBondContact O-CB 3.5Å; W460-T463 WeakPolarHBondContact O-CG2 3.33Å; W460-T463 PolarHBondContact O-N 3.45Å; W460-T463 VanDerWaalsContact O-N 3.09Å; W460-T463 PolarHBondContact O-OG1 3.13Å; L461-T463 PolarHBondContact O-N 3.33Å; T463-W465 VanDerWaalsContact O-CD1 3.29Å; T463-W465 PolarHBondContact O-N 3.04Å
464Q75.3Confident72.2Confident108 Ų10885.3 Ų85.351%0.50542%0.417SS..  trans-86.2102.1-179.1-162.8-175.916.800111
465W86Confident73.2Confident42 Ų4284.7 Ų84.716%0.15942%0.416CS..  trans-106.1130.9179.9-69.289000112.5L282 Y285 Y286 S462 T463 L485 C487 F490 L492L282-W465 HydrophobicContact CD1-CB 3.74Å; L282-W465 HydrophobicContact CD1-CD2 4.29Å; L282-W465 HydrophobicContact CD1-CG 3.68Å; L282-W465 HydrophobicContact CD2-CB 4.43Å; L282-W465 HydrophobicContact CD2-CD2 3.38Å; L282-W465 VanDerWaalsContact CD2-CE2 3.48Å; L282-W465 HydrophobicContact CD2-CE3 3.75Å; L282-W465 HydrophobicContact CD2-CG 3.7Å; L282-W465 HydrophobicContact CD2-CH2 4.16Å; L282-W465 HydrophobicContact CD2-CZ2 3.88Å; L282-W465 HydrophobicContact CD2-CZ3 4.11Å; L282-W465 HydrophobicContact CG-CD2 4.49Å; L282-W465 HydrophobicContact CG-CG 4.36Å; Y285-W465 HydrophobicContact CD1-CH2 4.44Å; Y285-W465 HydrophobicContact CD1-CZ2 4.05Å; Y285-W465 HydrophobicContact CE1-CH2 4.37Å; Y285-W465 HydrophobicContact CE1-CZ2 4.05Å; Y286-W465 AromaticContact CE2-NE1 3.87Å; Y286-W465 AromaticContact CZ-NE1 3.75Å; Y286-W465 PolarHBondContact OH-NE1 3.03Å; S462-W465 PolarHBondContact O-NE1 3.07Å; T463-W465 VanDerWaalsContact O-CD1 3.29Å; T463-W465 PolarHBondContact O-N 3.04Å; W465-L485 HydrophobicContact CE3-CB 3.78Å; W465-L485 HydrophobicContact CZ3-CB 4.04Å; W465-L485 WeakPolarHBondContact CZ3-O 3.26Å; W465-C487 HydrophobicContact CD2-CB 4.25Å; W465-C487 HydrophobicContact CE3-CB 3.91Å; W465-C487 HydrophobicContact CH2-CB 3.97Å; W465-C487 HydrophobicContact CZ2-CB 4.24Å; W465-C487 HydrophobicContact CZ3-CB 3.77Å; W465-F490 AromaticContact CH2-CE2 3.63Å; W465-F490 HydrophobicContact CH2-CE2 3.63Å; W465-F490 AromaticContact CH2-CZ 3.84Å; W465-F490 HydrophobicContact CH2-CZ 3.84Å; W465-F490 HydrophobicContact CZ2-CZ 4.3Å; W465-F490 HydrophobicContact CZ3-CE2 4.37Å; W465-L492 HydrophobicContact CH2-CD1 3.67Å; W465-L492 HydrophobicContact CH2-CG 3.82Å; W465-L492 HydrophobicContact CZ3-CD1 3.9Å; W465-L492 HydrophobicContact CZ3-CG 3.84Å
466R89Confident74.2Confident179 Ų17985.1 Ų85.168%0.67543%0.43SS*.EExtended strand (participates in β ladder)trans-101.9115.3172.5-170.4179.9-60.3-1781.8110.5I468 K486R466-I468 HydrophobicContact CG-CG1 4.31Å; R466-K486 PolarHBondContact N-O 2.85Å; R466-K486 PolarHBondContact O-N 3.26Å
467L91.6Very high75.8Confident47 Ų4782.4 Ų82.425%0.24642%0.415CS..EExtended strand (participates in β ladder)trans-76.1125.6169.7174.159.4000110.3I274 Q275 A278 V473 F483 L485I274-L467 HydrophobicContact CG2-CD1 4.3Å; I274-L467 HydrophobicContact CG2-CD2 4.37Å; Q275-L467 HydrophobicContact CB-CD2 4.27Å; A278-L467 HydrophobicContact CB-CD1 4.1Å; A278-L467 HydrophobicContact CB-CD2 4.06Å; L467-V473 HydrophobicContact CD2-CB 3.89Å; L467-V473 HydrophobicContact CD2-CG1 3.62Å; L467-V473 HydrophobicContact CG-CG1 3.9Å; L467-F483 HydrophobicContact CD1-CB 4.21Å; L467-F483 HydrophobicContact CD1-CD2 3.53Å; L467-F483 HydrophobicContact CD1-CE2 4.25Å; L467-F483 HydrophobicContact CD1-CG 4.2Å; L467-L485 HydrophobicContact CB-CD2 4.12Å; L467-L485 HydrophobicContact CD1-CD2 4.07Å
468I92.7Very high77.5Confident79 Ų7979 Ų7941%0.40540%0.398SS..EExtended strand (participates in β ladder)trans-122129175.9-55173.7000107.2R466 V484 K486R466-I468 HydrophobicContact CG-CG1 4.31Å; I468-V484 HydrophobicContact CB-CB 4.4Å; I468-V484 PolarHBondContact N-O 3.19Å; I468-V484 PolarHBondContact O-N 3.26Å; I468-K486 HydrophobicContact CD1-CB 4.03Å; I468-K486 HydrophobicContact CD1-CD 4.17Å
469S91.7Very high79.4Confident26 Ų2677.1 Ų77.118%0.18239%0.387CS..EExtended strand (participates in β ladder)trans-153.5141.7178.5-174.80000108.8E471S469-E471 VanDerWaalsContact C-N 3.26Å; S469-E471 WeakPolarHBondContact CB-O 3.32Å; S469-E471 PolarHBondContact OG-N 3.32Å; S469-E471 PolarHBondContact OG-O 3.5Å
470D88.7Confident81Confident166 Ų16674.8 Ų74.889%0.88840%0.395SS*.SBendtrans-71.8-26.3175.4-57.3-31.2000111.4
471E87.8Confident83.1Confident61 Ų6167.9 Ų67.929%0.28537%0.37SS..SBendtrans-90155.4171.6-61.1-157.2154.600112.1I274 S469 V473 R478 I481I274-E471 HydrophobicContact CD1-CB 3.94Å; S469-E471 VanDerWaalsContact C-N 3.26Å; S469-E471 WeakPolarHBondContact CB-O 3.32Å; S469-E471 PolarHBondContact OG-N 3.32Å; S469-E471 PolarHBondContact OG-O 3.5Å; E471-V473 PolarHBondContact O-N 2.89Å; E471-V473 VanDerWaalsContact O-N 3.12Å; E471-R478 IonicContact OE1-CZ 2.85Å; E471-R478 IonicContact OE1-NE 3.88Å; E471-R478 PolarHBondContact OE1-NE 3.34Å; E471-R478 IonicContact OE1-NH2 2.75Å; E471-R478 PolarHBondContact OE1-NH2 2.98Å; E471-R478 IonicContact OE2-CZ 3.18Å; E471-R478 IonicContact OE2-NE 3.46Å; E471-R478 PolarHBondContact OE2-NE 3.45Å; E471-R478 IonicContact OE2-NH2 3Å; E471-R478 PolarHBondContact OE2-NH2 2.69Å; E471-I481 WeakPolarHBondContact OE2-CD1 3.37Å
472A85.8Confident85.3Confident49 Ų4967.3 Ų67.341%0.40537%0.369SS..  trans-58.5119.4172.700000110.9T474 N475A472-T474 PolarHBondContact O-N 2.9Å; A472-N475 WeakPolarHBondContact O-CB 3.42Å; A472-N475 VanDerWaalsContact O-CG 3.31Å; A472-N475 PolarHBondContact O-N 3.07Å
473V84.8Confident87.2Confident27 Ų2766 Ų6616%0.16436%0.36CS..THydrogen-bonded Turntrans-57.6-16-174.2-60.60000115.5Q275 L467 E471Q275-V473 HydrophobicContact CB-CB 4.33Å; Q275-V473 WeakPolarHBondContact CB-O 3.43Å; Q275-V473 PolarHBondContact N-O 3.34Å; L467-V473 HydrophobicContact CD2-CB 3.89Å; L467-V473 HydrophobicContact CD2-CG1 3.62Å; L467-V473 HydrophobicContact CG-CG1 3.9Å; E471-V473 PolarHBondContact O-N 2.89Å; E471-V473 VanDerWaalsContact O-N 3.12Å
474T82.2Confident88.8Confident51 Ų5163.7 Ų63.731%0.31335%0.345SS..THydrogen-bonded Turntrans-78.2-17.9174.144.80000113.6A472A472-T474 PolarHBondContact O-N 2.9Å
475N84.4Confident89.6Confident58 Ų5858.7 Ų58.731%0.3132%0.322SS..SBendtrans-67152.1178.9-67.8-6.9000111.2S273 I274 A472S273-N475 CarbonylContact C-O 3.6Å; S273-N475 WeakPolarHBondContact CA-O 3.46Å; S273-N475 WeakPolarHBondContact CB-O 3.47Å; I274-N475 PolarHBondContact N-O 3.48Å; A472-N475 WeakPolarHBondContact O-CB 3.42Å; A472-N475 VanDerWaalsContact O-CG 3.31Å; A472-N475 PolarHBondContact O-N 3.07Å
476G85.9Confident89.8Confident42 Ų4262 Ų6243%0.43334%0.338SS..BIsolated β-bridgetrans-66.2151170.800000111.9L272L272-G476 CarbonylContact O-C 3.55Å; L272-G476 WeakPolarHBondContact O-CA 3.49Å
477L88.8Confident89.6Confident8 Ų853.9 Ų53.94%0.04231%0.308CS..PPolyproline II helixtrans-54139.5168.7-67.5178.6000111F252 L254 L272 I274 A277 F483 V496F252-L477 HydrophobicContact CB-CD1 4.4Å; F252-L477 HydrophobicContact CD2-CB 3.88Å; F252-L477 HydrophobicContact CD2-CD1 4.13Å; F252-L477 HydrophobicContact CE2-CB 3.88Å; F252-L477 HydrophobicContact CG-CB 4.21Å; F252-L477 HydrophobicContact CG-CD1 4.39Å; F252-L477 HydrophobicContact CZ-CB 4.21Å; F252-L477 WeakPolarHBondContact CZ-O 3.38Å; L254-L477 HydrophobicContact CD1-CD1 4.38Å; L254-L477 HydrophobicContact CD2-CD1 4.42Å; L272-L477 PolarHBondContact O-N 3.06Å; I274-L477 HydrophobicContact CG1-CD2 4.3Å; A277-L477 HydrophobicContact CB-CD1 3.87Å; A277-L477 HydrophobicContact CB-CD2 3.9Å; A277-L477 HydrophobicContact CB-CG 4.14Å; L477-F483 HydrophobicContact CD2-CE1 4.27Å; L477-V496 HydrophobicContact CB-CG1 4.36Å; L477-V496 HydrophobicContact CD2-CG1 4.31Å; L477-V496 HydrophobicContact CD2-CG2 3.95Å
478R89.6Confident89Confident124 Ų12457.1 Ų57.147%0.46833%0.325SS..  trans-132.4162.5172.8-60-174.2-89.9-1320.2109.1E471 I481 V496E471-R478 IonicContact OE1-CZ 2.85Å; E471-R478 IonicContact OE1-NE 3.88Å; E471-R478 PolarHBondContact OE1-NE 3.34Å; E471-R478 IonicContact OE1-NH2 2.75Å; E471-R478 PolarHBondContact OE1-NH2 2.98Å; E471-R478 IonicContact OE2-CZ 3.18Å; E471-R478 IonicContact OE2-NE 3.46Å; E471-R478 PolarHBondContact OE2-NE 3.45Å; E471-R478 IonicContact OE2-NH2 3Å; E471-R478 PolarHBondContact OE2-NH2 2.69Å; R478-I481 HydrophobicContact CB-CD1 3.72Å; R478-I481 HydrophobicContact CB-CG1 3.97Å; R478-I481 HydrophobicContact CG-CD1 4.17Å; R478-I481 VanDerWaalsContact N-CD1 3.34Å; R478-V496 VanDerWaalsContact O-CG1 3.3Å; R478-V496 WeakPolarHBondContact O-CG1 3.38Å
479D91.1Very high88.2Confident103 Ų10358.1 Ų58.155%0.55133%0.331SS*.THydrogen-bonded Turntrans-62.6139.1173.6-166.543.1000110.9I481 K497 K498D479-I481 VanDerWaalsContact C-N 3.27Å; D479-I481 PolarHBondContact O-N 3.02Å; D479-K497 WeakPolarHBondContact OD1-CA 3.48Å; D479-K498 HydrophobicContact CB-CB 3.95Å; D479-K498 PolarHBondContact OD1-N 3.24Å
480G90.4Very high87.9Confident53 Ų5357.9 Ų57.955%0.54633%0.327SS..THydrogen-bonded Turntrans76.60.1178.500000116V482 V496G480-V482 PolarHBondContact O-N 3.15Å; G480-V496 WeakPolarHBondContact CA-O 3.21Å; G480-V496 PolarHBondContact N-O 3.43Å
481I93.4Very high88Confident12 Ų1251.1 Ų51.16%0.06229%0.293CS..  trans-64.3133.9174-66.8-176000109.7I274 E471 R478 D479 F483 V496I274-I481 HydrophobicContact CD1-CD1 4.14Å; I274-I481 HydrophobicContact CD1-CG2 4.33Å; I274-I481 HydrophobicContact CG1-CD1 4.44Å; E471-I481 WeakPolarHBondContact OE2-CD1 3.37Å; R478-I481 HydrophobicContact CB-CD1 3.72Å; R478-I481 HydrophobicContact CB-CG1 3.97Å; R478-I481 HydrophobicContact CG-CD1 4.17Å; R478-I481 VanDerWaalsContact N-CD1 3.34Å; D479-I481 VanDerWaalsContact C-N 3.27Å; D479-I481 PolarHBondContact O-N 3.02Å; I481-F483 HydrophobicContact CG2-CD1 4.31Å; I481-V496 HydrophobicContact CB-CB 4.22Å; I481-V496 HydrophobicContact CB-CG2 4.16Å; I481-V496 HydrophobicContact CG2-CG2 4.38Å; I481-V496 WeakPolarHBondContact O-CB 3.24Å; I481-V496 WeakPolarHBondContact O-CG2 3.49Å; I481-V496 PolarHBondContact O-N 3.28Å
482V94.4Very high88.3Confident63 Ų6348.2 Ų48.238%0.38228%0.279SS..EExtended strand (participates in β ladder)trans-114.3134.3164.9-1770000108.8G480 V493 V494 N495G480-V482 PolarHBondContact O-N 3.15Å; V482-V493 HydrophobicContact CG1-CG1 3.94Å; V482-V494 VanDerWaalsContact CA-O 3.31Å; V482-V494 WeakPolarHBondContact CA-O 3.39Å; V482-N495 HydrophobicContact CG2-CB 4.49Å
483F95.4Very high88.7Confident1 Ų148.4 Ų48.40%0.00428%0.275CS..EExtended strand (participates in β ladder)trans-137.8156.817067.5-92.9000110.4L254 I274 A277 A278 L467 L477 I481 L485 V494 V496L254-F483 HydrophobicContact CD2-CE1 4Å; L254-F483 HydrophobicContact CD2-CZ 4.09Å; I274-F483 HydrophobicContact CG2-CB 4.02Å; I274-F483 HydrophobicContact CG2-CD1 3.82Å; I274-F483 HydrophobicContact CG2-CD2 4.29Å; I274-F483 HydrophobicContact CG2-CE1 4.3Å; I274-F483 HydrophobicContact CG2-CG 3.8Å; A277-F483 HydrophobicContact CB-CZ 4.34Å; A278-F483 HydrophobicContact CB-CE2 3.92Å; L467-F483 HydrophobicContact CD1-CB 4.21Å; L467-F483 HydrophobicContact CD1-CD2 3.53Å; L467-F483 HydrophobicContact CD1-CE2 4.25Å; L467-F483 HydrophobicContact CD1-CG 4.2Å; L477-F483 HydrophobicContact CD2-CE1 4.27Å; I481-F483 HydrophobicContact CG2-CD1 4.31Å; F483-L485 HydrophobicContact CE2-CD1 4.22Å; F483-L485 HydrophobicContact CE2-CG 4.36Å; F483-V494 HydrophobicContact CD1-CB 4.13Å; F483-V494 HydrophobicContact CD1-CG1 4.34Å; F483-V494 HydrophobicContact CD2-CB 4.02Å; F483-V494 HydrophobicContact CD2-CG2 4.08Å; F483-V494 HydrophobicContact CE1-CB 3.88Å; F483-V494 HydrophobicContact CE1-CG1 3.65Å; F483-V494 HydrophobicContact CE2-CB 3.75Å; F483-V494 HydrophobicContact CE2-CG1 4.09Å; F483-V494 HydrophobicContact CE2-CG2 3.64Å; F483-V494 HydrophobicContact CG-CB 4.21Å; F483-V494 HydrophobicContact CZ-CB 3.69Å; F483-V494 HydrophobicContact CZ-CG1 3.52Å; F483-V494 HydrophobicContact CZ-CG2 3.96Å; F483-V494 PolarHBondContact N-O 3.21Å; F483-V494 PolarHBondContact O-N 3.46Å; F483-V496 HydrophobicContact CD1-CG2 4.21Å; F483-V496 HydrophobicContact CE1-CG2 3.91Å
484V95.2Very high89.3Confident38 Ų3847.1 Ų47.123%0.2327%0.268CS..EExtended strand (participates in β ladder)trans-124.4129.9-173.4-1770000109.7I468 L492 V493I468-V484 HydrophobicContact CB-CB 4.4Å; I468-V484 PolarHBondContact N-O 3.19Å; I468-V484 PolarHBondContact O-N 3.26Å; V484-L492 WeakPolarHBondContact CA-O 3.43Å; V484-V493 HydrophobicContact CG2-CG2 4.36Å
485L93.2Very high89.9Confident3 Ų347.2 Ų47.22%0.01627%0.266CS..EExtended strand (participates in β ladder)trans-100.4110.5169.3-69.1161000107.6A278 V281 L282 W465 L467 F483 S491 L492 V494A278-L485 HydrophobicContact CB-CD1 4.25Å; A278-L485 HydrophobicContact CB-CD2 3.78Å; A278-L485 HydrophobicContact CB-CG 4.42Å; V281-L485 HydrophobicContact CB-CD1 4.14Å; V281-L485 HydrophobicContact CG1-CD1 3.72Å; L282-L485 HydrophobicContact CD1-CD2 4.39Å; L282-L485 HydrophobicContact CD2-CB 4.46Å; L282-L485 HydrophobicContact CD2-CD1 3.93Å; L282-L485 HydrophobicContact CG-CD1 4.04Å; W465-L485 HydrophobicContact CE3-CB 3.78Å; W465-L485 HydrophobicContact CZ3-CB 4.04Å; W465-L485 WeakPolarHBondContact CZ3-O 3.26Å; L467-L485 HydrophobicContact CB-CD2 4.12Å; L467-L485 HydrophobicContact CD1-CD2 4.07Å; F483-L485 HydrophobicContact CE2-CD1 4.22Å; F483-L485 HydrophobicContact CE2-CG 4.36Å; L485-S491 CarbonylContact O-C 3.55Å; L485-S491 WeakPolarHBondContact O-CA 3.4Å; L485-S491 WeakPolarHBondContact O-CB 3.48Å; L485-L492 HydrophobicContact CB-CB 4.25Å; L485-L492 PolarHBondContact N-O 3.43Å; L485-L492 PolarHBondContact O-N 2.85Å; L485-V494 HydrophobicContact CD1-CG2 4.38Å
486K90.1Very high90.4Very high113 Ų11344.5 Ų44.549%0.49125%0.251SS..EExtended strand (participates in β ladder)trans-99.8122-177.6-176.2168.5-178176.60110.5R466 I468R466-K486 PolarHBondContact N-O 2.85Å; R466-K486 PolarHBondContact O-N 3.26Å; I468-K486 HydrophobicContact CD1-CB 4.03Å; I468-K486 HydrophobicContact CD1-CD 4.17Å
487C84.8Confident90.8Very high7 Ų748.1 Ų48.15%0.04726%0.255CS..  trans-96.2-177.1163.9-167.10000108.4W465 F490W465-C487 HydrophobicContact CD2-CB 4.25Å; W465-C487 HydrophobicContact CE3-CB 3.91Å; W465-C487 HydrophobicContact CH2-CB 3.97Å; W465-C487 HydrophobicContact CZ2-CB 4.24Å; W465-C487 HydrophobicContact CZ3-CB 3.77Å; C487-F490 CarbonylContact C-O 3.53Å; C487-F490 WeakPolarHBondContact CB-O 3.46Å; C487-F490 PolarHBondContact N-O 3.17Å
488L77.9Confident90.9Very high115 Ų11553.5 Ų53.560%0.60228%0.278SS*.SBendtrans-63.7-51.6177.5-68.7168.6000111.9L461L461-L488 HydrophobicContact CB-CD1 3.96Å; L461-L488 HydrophobicContact CD2-CD1 4.48Å
489D76Confident90.9Very high100 Ų10050 Ų5054%0.53527%0.269SS..SBendtrans-89.9-24.5-170-59.8-25.8000114.4Y292Y292-D489 HydrophobicContact CE1-CB 3.96Å
490F85.6Confident90.8Very high21 Ų2149.8 Ų49.89%0.09227%0.273CS..  trans-156.2176.7-173.667.4-86.7000111.8R258 T260 Y285 Y292 W465 C487 L492R258-F490 HydrophobicContact CG-CD2 3.74Å; R258-F490 HydrophobicContact CG-CE2 4.18Å; R258-F490 HydrophobicContact CG-CG 4.43Å; T260-F490 HydrophobicContact CG2-CB 3.51Å; Y285-F490 HydrophobicContact CE1-CZ 4.2Å; Y285-F490 HydrophobicContact CE2-CE2 4.27Å; Y285-F490 AromaticContact CZ-CE2 3.92Å; Y285-F490 AromaticContact CZ-CZ 3.75Å; Y285-F490 WeakPolarHBondContact OH-CZ 3.26Å; Y292-F490 AromaticContact CD1-CD1 3.57Å; Y292-F490 HydrophobicContact CD1-CD1 3.57Å; Y292-F490 AromaticContact CD1-CE1 3.88Å; Y292-F490 HydrophobicContact CD1-CE1 3.88Å; Y292-F490 HydrophobicContact CD1-CG 4.49Å; Y292-F490 AromaticContact CE1-CD1 3.91Å; Y292-F490 HydrophobicContact CE1-CD1 3.91Å; Y292-F490 AromaticContact CG-CD1 3.97Å; Y292-F490 HydrophobicContact CG-CD1 3.97Å; Y292-F490 HydrophobicContact CG-CE1 4.15Å; W465-F490 AromaticContact CH2-CE2 3.63Å; W465-F490 HydrophobicContact CH2-CE2 3.63Å; W465-F490 AromaticContact CH2-CZ 3.84Å; W465-F490 HydrophobicContact CH2-CZ 3.84Å; W465-F490 HydrophobicContact CZ2-CZ 4.3Å; W465-F490 HydrophobicContact CZ3-CE2 4.37Å; C487-F490 CarbonylContact C-O 3.53Å; C487-F490 WeakPolarHBondContact CB-O 3.46Å; C487-F490 PolarHBondContact N-O 3.17Å; F490-L492 HydrophobicContact CD2-CD2 4.39Å; F490-L492 HydrophobicContact CE2-CD2 3.99Å; F490-L492 HydrophobicContact CE2-CG 4.35Å
491S91.4Very high90.4Very high24 Ų2456.3 Ų56.317%0.16829%0.286CS..EExtended strand (participates in β ladder)trans-132.7153173.5580000112.2S259 L485S259-S491 WeakPolarHBondContact CB-O 3.38Å; S259-S491 VanDerWaalsContact CB-OG 3.32Å; S259-S491 WeakPolarHBondContact CB-OG 3.37Å; S259-S491 PolarHBondContact N-O 3.33Å; S259-S491 PolarHBondContact OG-N 2.95Å; S259-S491 PolarHBondContact OG-O 3.3Å; S259-S491 PolarHBondContact OG-OG 3.49Å; L485-S491 CarbonylContact O-C 3.55Å; L485-S491 WeakPolarHBondContact O-CA 3.4Å; L485-S491 WeakPolarHBondContact O-CB 3.48Å
492L93.2Very high90Very high0 Ų062.2 Ų62.20%032%0.317CS..EExtended strand (participates in β ladder)trans-100.6116.2165.9-54.1174.4000107.7V256 V257 R258 V281 L282 Y285 W465 V484 L485 F490V256-L492 HydrophobicContact CG1-CB 4.04Å; V256-L492 HydrophobicContact CG1-CD1 4.37Å; V256-L492 HydrophobicContact CG1-CD2 4.46Å; V257-L492 CarbonylContact O-C 3.56Å; V257-L492 WeakPolarHBondContact O-CA 3.36Å; R258-L492 HydrophobicContact CB-CD2 3.88Å; R258-L492 HydrophobicContact CG-CD2 4.27Å; V281-L492 HydrophobicContact CG1-CD1 4.47Å; L282-L492 HydrophobicContact CD2-CD1 4.28Å; Y285-L492 HydrophobicContact CD1-CD1 4.42Å; Y285-L492 HydrophobicContact CD2-CD1 3.57Å; Y285-L492 HydrophobicContact CD2-CD2 3.72Å; Y285-L492 HydrophobicContact CD2-CG 4.26Å; Y285-L492 HydrophobicContact CE2-CD1 4.25Å; Y285-L492 HydrophobicContact CE2-CD2 3.72Å; Y285-L492 HydrophobicContact CG-CD1 3.69Å; W465-L492 HydrophobicContact CH2-CD1 3.67Å; W465-L492 HydrophobicContact CH2-CG 3.82Å; W465-L492 HydrophobicContact CZ3-CD1 3.9Å; W465-L492 HydrophobicContact CZ3-CG 3.84Å; V484-L492 WeakPolarHBondContact CA-O 3.43Å; L485-L492 HydrophobicContact CB-CB 4.25Å; L485-L492 PolarHBondContact N-O 3.43Å; L485-L492 PolarHBondContact O-N 2.85Å; F490-L492 HydrophobicContact CD2-CD2 4.39Å; F490-L492 HydrophobicContact CE2-CD2 3.99Å; F490-L492 HydrophobicContact CE2-CG 4.35Å
493V95.4Very high89.6Confident54 Ų5464.6 Ų64.633%0.32733%0.331SS..EExtended strand (participates in β ladder)trans-89.3123.9172.7-177.30000107.4V257 V482 V484V257-V493 PolarHBondContact N-O 3Å; V257-V493 PolarHBondContact O-N 3.21Å; V482-V493 HydrophobicContact CG1-CG1 3.94Å; V484-V493 HydrophobicContact CG2-CG2 4.36Å
494V96.1Very high89.4Confident0 Ų071.1 Ų71.10%037%0.365CS..EExtended strand (participates in β ladder)trans-114.8116.6-176.4-169.80000109.2L254 Q255 V256 V281 V482 F483 L485L254-V494 HydrophobicContact CB-CG1 3.9Å; L254-V494 HydrophobicContact CD2-CG1 3.65Å; L254-V494 HydrophobicContact CG-CG1 4.29Å; Q255-V494 WeakPolarHBondContact O-CA 3.36Å; V256-V494 HydrophobicContact CG1-CG2 4.35Å; V256-V494 HydrophobicContact CG2-CG1 4.03Å; V256-V494 HydrophobicContact CG2-CG2 4.16Å; V281-V494 HydrophobicContact CG1-CG2 4.09Å; V281-V494 HydrophobicContact CG2-CG1 4.4Å; V482-V494 VanDerWaalsContact CA-O 3.31Å; V482-V494 WeakPolarHBondContact CA-O 3.39Å; F483-V494 HydrophobicContact CD1-CB 4.13Å; F483-V494 HydrophobicContact CD1-CG1 4.34Å; F483-V494 HydrophobicContact CD2-CB 4.02Å; F483-V494 HydrophobicContact CD2-CG2 4.08Å; F483-V494 HydrophobicContact CE1-CB 3.88Å; F483-V494 HydrophobicContact CE1-CG1 3.65Å; F483-V494 HydrophobicContact CE2-CB 3.75Å; F483-V494 HydrophobicContact CE2-CG1 4.09Å; F483-V494 HydrophobicContact CE2-CG2 3.64Å; F483-V494 HydrophobicContact CG-CB 4.21Å; F483-V494 HydrophobicContact CZ-CB 3.69Å; F483-V494 HydrophobicContact CZ-CG1 3.52Å; F483-V494 HydrophobicContact CZ-CG2 3.96Å; F483-V494 PolarHBondContact N-O 3.21Å; F483-V494 PolarHBondContact O-N 3.46Å; L485-V494 HydrophobicContact CD1-CG2 4.38Å
495N95.6Very high89.1Confident53 Ų5374.4 Ų74.428%0.28339%0.39SS..EExtended strand (participates in β ladder)trans-106122.5176.9-174.9-29.2000109.5L254 Q255 V482L254-N495 CarbonylContact C-O 3.48Å; L254-N495 WeakPolarHBondContact CA-O 3.36Å; Q255-N495 HydrophobicContact CB-CB 4.45Å; Q255-N495 PolarHBondContact N-O 3.02Å; Q255-N495 PolarHBondContact O-N 2.83Å; V482-N495 HydrophobicContact CG2-CB 4.49Å
496V95.3Very high88.9Confident0 Ų082.7 Ų82.70%043%0.428CS..EExtended strand (participates in β ladder)trans-99121.7-175-174.30000109.7F252 L254 L477 R478 G480 I481 F483F252-V496 HydrophobicContact CB-CG1 4.04Å; F252-V496 HydrophobicContact CD1-CG1 3.86Å; F252-V496 HydrophobicContact CG-CG1 4.14Å; L254-V496 HydrophobicContact CD2-CG2 3.99Å; L254-V496 HydrophobicContact CG-CG2 4.18Å; L477-V496 HydrophobicContact CB-CG1 4.36Å; L477-V496 HydrophobicContact CD2-CG1 4.31Å; L477-V496 HydrophobicContact CD2-CG2 3.95Å; R478-V496 VanDerWaalsContact O-CG1 3.3Å; R478-V496 WeakPolarHBondContact O-CG1 3.38Å; G480-V496 WeakPolarHBondContact CA-O 3.21Å; G480-V496 PolarHBondContact N-O 3.43Å; I481-V496 HydrophobicContact CB-CB 4.22Å; I481-V496 HydrophobicContact CB-CG2 4.16Å; I481-V496 HydrophobicContact CG2-CG2 4.38Å; I481-V496 WeakPolarHBondContact O-CB 3.24Å; I481-V496 WeakPolarHBondContact O-CG2 3.49Å; I481-V496 PolarHBondContact O-N 3.28Å; F483-V496 HydrophobicContact CD1-CG2 4.21Å; F483-V496 HydrophobicContact CE1-CG2 3.91Å
497K93.6Very high88.9Confident119 Ų11985.6 Ų85.652%0.51744%0.444SS..EExtended strand (participates in β ladder)trans-119.3140.5171.6-66.2-172.7177.2-1780110.8F252 T253 D479F252-K497 CarbonylContact C-O 3.57Å; F252-K497 VanDerWaalsContact CA-O 3.28Å; F252-K497 WeakPolarHBondContact CA-O 3.46Å; T253-K497 PolarHBondContact N-O 3.14Å; T253-K497 PolarHBondContact O-N 3.12Å; D479-K497 WeakPolarHBondContact OD1-CA 3.48Å
498K92.3Very high89Confident120 Ų12093.9 Ų93.952%0.52248%0.479SS..EExtended strand (participates in β ladder)trans-73.8136.5172.1-172179177.3-174.40109.9M251 F252 D479M251-K498 HydrophobicContact CG-CG 4.28Å; F252-K498 HydrophobicContact CD1-CB 4.26Å; F252-K498 HydrophobicContact CE1-CB 4.28Å; F252-K498 HydrophobicContact CE1-CG 4.4Å; D479-K498 HydrophobicContact CB-CB 3.95Å; D479-K498 PolarHBondContact OD1-N 3.24Å
499I88.9Confident89.3Confident52 Ų5293 Ų9327%0.26748%0.475SS..PPolyproline II helixtrans-66.1128.3173.6-63.5172.6000108P250 M251 T253P250-I499 HydrophobicContact CB-CD1 4.11Å; M251-I499 PolarHBondContact O-N 3.4Å; T253-I499 WeakPolarHBondContact OG1-CG1 3.44Å
500P87.7Confident89.5Confident98 Ų9891.5 Ų91.564%0.63647%0.466SS*.PPolyproline II helixtrans-67.2152.1179.428.7-35.3000111.1I502P500-I502 PolarHBondContact O-N 3.1Å
501F82.7Confident89.3Confident189 Ų18995 Ų9583%0.82949%0.491SS*.  trans-73.5114.6170.5-177.4-111000109.2V503F501-V503 HydrophobicContact CD1-CG2 3.78Å; F501-V503 HydrophobicContact CE1-CG2 3.46Å; F501-V503 VanDerWaalsContact CE1-CG2 3.46Å; F501-V503 HydrophobicContact CZ-CG2 4.41Å
502I85.5Confident88.5Confident136 Ų136100.3 Ų100.370%0.69751%0.511SS*.PPolyproline II helixtrans-93.8117.3-178.9-57.6174.7000108.3P500P500-I502 PolarHBondContact O-N 3.1Å
503V86.5Confident87.4Confident113 Ų113104 Ų10469%0.68554%0.537SS*.PPolyproline II helixtrans-95.9117.1168.4-179.90000107.8F501F501-V503 HydrophobicContact CD1-CG2 3.78Å; F501-V503 HydrophobicContact CE1-CG2 3.46Å; F501-V503 VanDerWaalsContact CE1-CG2 3.46Å; F501-V503 HydrophobicContact CZ-CG2 4.41Å
504L89.8Confident86.1Confident138 Ų138107.2 Ų107.272%0.72355%0.548SS*.PPolyproline II helixtrans-95123.3170.6-174.866.9000108.7
505S89.6Confident84.9Confident107 Ų107114.8 Ų114.875%0.74858%0.581SS**PPolyproline II helixtrans-100.4125.2168.4550000109.3
506E89.9Confident83.8Confident177 Ų177121.5 Ų121.583%0.82761%0.608SS**PPolyproline II helixtrans-97.3127.8174.8-65.7179.8-170.800109.9
507E89.2Confident82.5Confident175 Ų175127.5 Ų127.582%0.81865%0.645SS**  trans-117.1119.3173.4-173.7176.3178.900109.1I509E507-I509 PolarHBondContact O-N 3.2Å
508F86.2Confident81.1Confident180 Ų180128.7 Ų128.779%0.78966%0.656SS**  trans-85.7106.6176.3179.9-95.8000110.3D510F508-D510 HydrophobicContact CE1-CB 4.49Å; F508-D510 PolarHBondContact O-N 3.38Å
509I84.3Confident79.7Confident98 Ų98133.5 Ų133.550%0.50367%0.671SS.*  trans-80.3110.1173.9-58.4176.3000108.7E507 S513E507-I509 PolarHBondContact O-N 3.2Å; I509-S513 WeakPolarHBondContact CG2-OG 3.45Å
510D81.3Confident78.7Confident68 Ų68138 Ų13836%0.36469%0.694SS.*  trans-57.6126.4172.8179.1-11.7000109.3F508 K512 S513F508-D510 HydrophobicContact CE1-CB 4.49Å; F508-D510 PolarHBondContact O-N 3.38Å; D510-K512 PolarHBondContact O-N 2.83Å; D510-K512 WeakPolarHBondContact OD1-CB 3.38Å; D510-K512 WeakPolarHBondContact OD1-CG 3.38Å; D510-K512 PolarHBondContact OD1-N 2.89Å; D510-S513 VanDerWaalsContact O-CB 3.24Å; D510-S513 WeakPolarHBondContact O-CB 3.22Å; D510-S513 PolarHBondContact O-N 2.92Å; D510-S513 PolarHBondContact O-OG 3.29Å
511P80.2Confident77.5Confident93 Ų93141 Ų14160%0.60470%0.7SS**G310 helixtrans-57.7-16.6176.722.4-34.4000114.4S513P511-S513 VanDerWaalsContact C-N 3.28Å; P511-S513 PolarHBondContact O-N 3.15Å
512K74.8Confident76.5Confident137 Ų137137.3 Ų137.360%0.59670%0.697SS**G310 helixtrans-70.1-20.9170.7-63.9171.9-169.9160.10113.5D510 H514 K515D510-K512 PolarHBondContact O-N 2.83Å; D510-K512 WeakPolarHBondContact OD1-CB 3.38Å; D510-K512 WeakPolarHBondContact OD1-CG 3.38Å; D510-K512 PolarHBondContact OD1-N 2.89Å; K512-H514 PolarHBondContact O-N 3.33Å; K512-K515 WeakPolarHBondContact O-CB 3.39Å; K512-K515 WeakPolarHBondContact O-CG 3.44Å; K512-K515 PolarHBondContact O-N 3.03Å
513S71Confident75.3Confident78 Ų78138.4 Ų138.455%0.54570%0.7SS.*G310 helixtrans-66.8-22.8178.669.30000112.8I509 D510 P511 K515I509-S513 WeakPolarHBondContact CG2-OG 3.45Å; D510-S513 VanDerWaalsContact O-CB 3.24Å; D510-S513 WeakPolarHBondContact O-CB 3.22Å; D510-S513 PolarHBondContact O-N 2.92Å; D510-S513 PolarHBondContact O-OG 3.29Å; P511-S513 VanDerWaalsContact C-N 3.28Å; P511-S513 PolarHBondContact O-N 3.15Å; S513-K515 PolarHBondContact O-N 2.79Å
514H67.3Low73.9Confident120 Ų120139.3 Ų139.356%0.55671%0.706SS**G310 helixtrans-80.49.3175-57.8-49.9000114.2K512 F516K512-H514 PolarHBondContact O-N 3.33Å; H514-F516 WeakPolarHBondContact O-CD2 3.35Å; H514-F516 PolarHBondContact O-N 3.2Å
515K71.1Confident72.1Confident159 Ų159138.1 Ų138.169%0.69171%0.709SS**  trans-81.295.8176.7-70.5-174.9177.4-170.60111.3K512 S513 V517K512-K515 WeakPolarHBondContact O-CB 3.39Å; K512-K515 WeakPolarHBondContact O-CG 3.44Å; K512-K515 PolarHBondContact O-N 3.03Å; S513-K515 PolarHBondContact O-N 2.79Å; K515-V517 PolarHBondContact O-N 3.22Å
516F72.2Confident70Confident195 Ų195143.4 Ų143.486%0.85574%0.736SS**  trans-65.8117.8171.4-59-81.2000111.2H514 L518H514-F516 WeakPolarHBondContact O-CD2 3.35Å; H514-F516 PolarHBondContact O-N 3.2Å; F516-L518 PolarHBondContact O-N 3.36Å
517V68.5Low69Low126 Ų126141.8 Ų141.876%0.76473%0.732SS**  trans-81.1105.4170.7178.50000108.7K515 R519K515-V517 PolarHBondContact O-N 3.22Å; V517-R519 HydrophobicContact CG1-CG 4.29Å; V517-R519 PolarHBondContact O-N 3.19Å
518L63.7Low68Low143 Ų143140 Ų14075%0.74973%0.727SS**  trans-75.189.5177.6-154.4156.7000109.2F516 L520F516-L518 PolarHBondContact O-N 3.36Å; L518-L520 HydrophobicContact CD2-CD1 3.6Å; L518-L520 HydrophobicContact CD2-CG 4.07Å; L518-L520 PolarHBondContact O-N 3.1Å; L518-L520 VanDerWaalsContact O-N 3.1Å
519R63.6Low67Low222 Ų222137.8 Ų137.884%0.83872%0.724SS**  trans-72.397.3172.8-72.5-173.5175.8178.5-1109.3V517 Q521V517-R519 HydrophobicContact CG1-CG 4.29Å; V517-R519 PolarHBondContact O-N 3.19Å; R519-Q521 PolarHBondContact O-N 2.72Å
520L66.9Low65.9Low146 Ų146140.1 Ų140.176%0.76474%0.737SS**  trans-66.2112.2160.6-73.692.3000107.8L518 S522L518-L520 HydrophobicContact CD2-CD1 3.6Å; L518-L520 HydrophobicContact CD2-CG 4.07Å; L518-L520 PolarHBondContact O-N 3.1Å; L518-L520 VanDerWaalsContact O-N 3.1Å; L520-S522 PolarHBondContact O-N 2.97Å
521Q62.5Low65Low160 Ų160144.6 Ų144.675%0.74876%0.76SS**  trans-68.9110.6162-73.4178.9-77.200107.4R519 E523R519-Q521 PolarHBondContact O-N 2.72Å; Q521-E523 PolarHBondContact O-N 2.91Å
522S63Low64Low112 Ų112148.1 Ų148.178%0.78377%0.77SS**  trans-76.855.6173.760.10000111.1L520 T524L520-S522 PolarHBondContact O-N 2.97Å; S522-T524 PolarHBondContact O-N 3.33Å
523E60.1Low63.2Low160 Ų160148.9 Ų148.975%0.74878%0.783SS**  trans-91.849.3170.8-72.8-176.4-159.100110.9Q521Q521-E523 PolarHBondContact O-N 2.91Å
524T56.3Low62.6Low132 Ų132154.3 Ų154.381%0.8180%0.801SS**  trans-136.288.4157.654.50000107.5S522S522-T524 PolarHBondContact O-N 3.33Å
525S52.7Low62.2Low112 Ų112157.2 Ų157.278%0.78382%0.822SS**  trans-79.1122.317353.30000110.7
526V45.8Very low61.4Low219 Ų219157 Ų157100%1.32783%0.834SS**  trans63.50166.8-170.70000115.7

Retrieved 526 of 526 residues in 636.5 ms (Link to these results)