A0A087YB70_POEFO Loading...

Metalloendopeptidase OMA1, mitochondrial

AlphaFold DB , UniProt , Accession A0A087YB70, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 508 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
1M42.4Very low35Very low202 Ų202144.6 Ų144.6100%0.99572%0.719SS**  0-67.30-66.6-45.2-175.100113.3F3 L4M1-F3 VanDerWaalsContact C-N 3.29Å; M1-F3 PolarHBondContact O-N 2.95Å; M1-F3 VanDerWaalsContact O-N 3.11Å; M1-L4 PolarHBondContact O-N 3.5Å
2A33.6Very low35.1Very low84 Ų84142.3 Ų142.369%0.69472%0.718SS**Hα-helixtrans-50.7-41.3-175.800000115.2L4 C5A2-L4 VanDerWaalsContact C-N 3.32Å; A2-L4 PolarHBondContact O-N 3.37Å; A2-C5 PolarHBondContact O-N 3.4Å
3F27.9Very low35Very low186 Ų186140.3 Ų140.382%0.81672%0.723SS**Hα-helixtrans-68.8-16.5-179.6-88.1-87000116.3M1 S6M1-F3 VanDerWaalsContact C-N 3.29Å; M1-F3 PolarHBondContact O-N 2.95Å; M1-F3 VanDerWaalsContact O-N 3.11Å; F3-S6 PolarHBondContact O-OG 3.17Å
4L34.8Very low34.9Very low121 Ų121137.7 Ų137.763%0.63472%0.724SS**Hα-helixtrans-83.4-27.3177.2-76.6164.8000112.3M1 A2M1-L4 PolarHBondContact O-N 3.5Å; A2-L4 VanDerWaalsContact C-N 3.32Å; A2-L4 PolarHBondContact O-N 3.37Å
5C32.6Very low34.4Very low77 Ų77141.5 Ų141.552%0.5273%0.733SS.*Hα-helixtrans-72-39.9-179-172.30000111.9A2 Y7 L9A2-C5 PolarHBondContact O-N 3.4Å; C5-Y7 VanDerWaalsContact C-N 3.27Å; C5-Y7 PolarHBondContact O-N 2.67Å; C5-L9 PolarHBondContact O-N 2.92Å
6S34.4Very low33.9Very low68 Ų68145.5 Ų145.548%0.47674%0.737SS.*Hα-helixtrans-67.7-22.117850.50000114.4F3F3-S6 PolarHBondContact O-OG 3.17Å
7Y31.4Very low33.4Very low184 Ų184148.1 Ų148.172%0.72274%0.743SS**Hα-helixtrans-79.9-43.1179.2-155.9-92.6000111.5C5 R10C5-Y7 VanDerWaalsContact C-N 3.27Å; C5-Y7 PolarHBondContact O-N 2.67Å; Y7-R10 PolarHBondContact O-N 3.48Å
8F34.4Very low33Very low165 Ų165149.1 Ų149.172%0.72474%0.744SS**Hα-helixtrans-66.2-39.9176.4-97.8-88.5000113R10F8-R10 PolarHBondContact O-N 2.98Å; F8-R10 VanDerWaalsContact O-N 3.17Å
9L39Very low32.8Very low137 Ų137147.2 Ų147.272%0.71774%0.741SS**THydrogen-bonded Turntrans-71-5.4-178.5-76.5168.9000114.9C5C5-L9 PolarHBondContact O-N 2.92Å
10R36.6Very low32.4Very low226 Ų226146.7 Ų146.785%0.85374%0.74SS**THydrogen-bonded Turntrans-104.5-6.3-174.6-135177.9-171.2-172.41.4114.8Y7 F8Y7-R10 PolarHBondContact O-N 3.48Å; F8-R10 PolarHBondContact O-N 2.98Å; F8-R10 VanDerWaalsContact O-N 3.17Å
11N37.9Very low32.2Very low141 Ų141146 Ų14675%0.75474%0.738SS**SBendtrans-124.74.5-166.5-129.745000115.2C13N11-C13 PolarHBondContact O-N 3.16Å
12T36.5Very low31.5Very low117 Ų117142.5 Ų142.572%0.71873%0.728SS**  trans-98.580178.244.50000111.9
13C34Very low31.3Very low116 Ų116147.1 Ų147.178%0.78473%0.728SS**  trans-70138.2164.6-74.10000111N11 F15N11-C13 PolarHBondContact O-N 3.16Å; C13-F15 PolarHBondContact O-N 2.71Å
14S33.5Very low31.3Very low104 Ų104147.3 Ų147.373%0.72773%0.731SS**  trans19.890.4165.2-59.70000118.8
15F27.3Very low30.9Very low195 Ų195148.5 Ų148.586%0.85573%0.731SS**  trans-104.7105.9148.9-92-92.2000109.4C13 F17C13-F15 PolarHBondContact O-N 2.71Å; F15-F17 PolarHBondContact O-N 3.33Å
16Y26.5Very low30.7Very low205 Ų205153.3 Ų153.380%0.80475%0.746SS**  trans-75.2117.6172.4-91-95.7000110H18Y16-H18 PolarHBondContact O-N 3.2Å
17F25.8Very low30.2Very low190 Ų190157.2 Ų157.283%0.83376%0.761SS**  trans-78.795.5171.9-106.4-91.7000110.6F15 V19F15-F17 PolarHBondContact O-N 3.33Å; F17-V19 PolarHBondContact O-N 3.2Å
18H25.7Very low30Very low165 Ų165154.2 Ų154.276%0.76477%0.765SS**  trans-79.3101166.7-109.9-81.6000110.1Y16 N20Y16-H18 PolarHBondContact O-N 3.2Å; H18-N20 PolarHBondContact O-N 3.29Å
19V28.4Very low29.6Very low113 Ų113155.9 Ų155.969%0.68577%0.772SS**  trans-82.390.4176.1-176.70000109.8F17 L21F17-V19 PolarHBondContact O-N 3.2Å; V19-L21 PolarHBondContact O-N 3.08Å
20N25.7Very low28.9Very low137 Ų137160.4 Ų160.473%0.73378%0.78SS**  trans-80.399.3169-93.4-23.8000110.3H18 T22H18-N20 PolarHBondContact O-N 3.29Å; N20-T22 PolarHBondContact O-N 3.11Å
21L27.4Very low28.5Very low133 Ų133153.7 Ų153.770%0.69677%0.773SS**  trans-88.668.5-177.6-167.179.1000112.4V19 R23V19-L21 PolarHBondContact O-N 3.08Å; L21-R23 VanDerWaalsContact C-N 3.27Å; L21-R23 HydrophobicContact CG-CG 4.37Å; L21-R23 PolarHBondContact O-N 3.4Å
22T28.9Very low28Very low128 Ų128154.2 Ų154.279%0.78578%0.776SS**  trans-76.972.2174.948.20000112.1N20 H24N20-T22 PolarHBondContact O-N 3.11Å; T22-H24 PolarHBondContact O-N 3.4Å
23R29.3Very low27.6Very low181 Ų181158.2 Ų158.268%0.68378%0.783SS**  trans-80.2108.2169.2-85-172.3168.5-173.5-5.1111.1L21 F25L21-R23 VanDerWaalsContact C-N 3.27Å; L21-R23 HydrophobicContact CG-CG 4.37Å; L21-R23 PolarHBondContact O-N 3.4Å; R23-F25 HydrophobicContact CB-CD2 4.24Å; R23-F25 PolarHBondContact O-N 2.82Å; R23-F25 VanDerWaalsContact O-N 3.11Å
24H27.3Very low27.5Very low190 Ų190158.3 Ų158.388%0.8878%0.782SS**  trans-7492.3162.1-88.4-79.9000110.4T22 Q26T22-H24 PolarHBondContact O-N 3.4Å; H24-Q26 PolarHBondContact O-N 2.96Å
25F26.7Very low27.4Very low146 Ų146161.3 Ų161.364%0.6479%0.789SS**  trans-80.5103166.2-94.6-75.9000110.4R23 L27R23-F25 HydrophobicContact CB-CD2 4.24Å; R23-F25 PolarHBondContact O-N 2.82Å; R23-F25 VanDerWaalsContact O-N 3.11Å; F25-L27 PolarHBondContact O-N 3.27Å
26Q27.3Very low27.6Very low178 Ų178161.5 Ų161.583%0.83279%0.79SS**  trans-85.393.4158.9-76.5-168.1-10.300109.4H24 C28H24-Q26 PolarHBondContact O-N 2.96Å; Q26-C28 VanDerWaalsContact C-N 3.34Å; Q26-C28 PolarHBondContact O-N 3.21Å
27L25.5Very low27.7Very low151 Ų151162 Ų16279%0.79180%0.796SS**  trans-77.281.7174-83.9164000110.8F25 K29F25-L27 PolarHBondContact O-N 3.27Å; L27-K29 VanDerWaalsContact C-N 3.28Å; L27-K29 PolarHBondContact O-N 3.27Å
28C27.1Very low27.8Very low121 Ų121162.8 Ų162.882%0.81880%0.799SS**  trans-66.787.1165.7-82.30000110.2Q26 R30Q26-C28 VanDerWaalsContact C-N 3.34Å; Q26-C28 PolarHBondContact O-N 3.21Å; C28-R30 PolarHBondContact O-N 2.93Å
29K25.9Very low27.9Very low199 Ų199161.2 Ų161.287%0.86580%0.801SS**  trans-74.292.8-177.3-159177.7-171.4-1780110.4L27 A31L27-K29 VanDerWaalsContact C-N 3.28Å; L27-K29 PolarHBondContact O-N 3.27Å; K29-A31 PolarHBondContact O-N 3.27Å
30R24.3Very low28.2Very low233 Ų233161.1 Ų161.188%0.87980%0.803SS**PPolyproline II helixtrans-56.4130.5171.9-158.1172.7-168.8154.21.4108.8C28C28-R30 PolarHBondContact O-N 2.93Å
31A27.3Very low28.1Very low85 Ų85164.5 Ų164.570%0.70281%0.812SS**PPolyproline II helixtrans-101.6118.3-176.200000110.5K29K29-A31 PolarHBondContact O-N 3.27Å
32D26.6Very low27.9Very low152 Ų152163.2 Ų163.281%0.81381%0.814SS**PPolyproline II helixtrans-76.7135.4177.5-62.4-55.7000111.9P34D32-P34 WeakPolarHBondContact O-CD 3.49Å
33F28.4Very low27.6Very low201 Ų201163.2 Ų163.288%0.88281%0.813SS**PPolyproline II helixtrans-97.1120.8174.6-95.4-89000111.3
34P32.8Very low27.2Very low117 Ų117160.6 Ų160.676%0.7682%0.821SS**PPolyproline II helixtrans-91.1163.5163.934.1-31.7000112.8D32D32-P34 WeakPolarHBondContact O-CD 3.49Å
35L31.8Very low27.1Very low168 Ų168156.9 Ų156.988%0.8882%0.817SS**PPolyproline II helixtrans-83.6153.6-164.5-77.9152.4000116.5
36K29.9Very low27.7Very low198 Ų198155.2 Ų155.286%0.86182%0.821SS**  trans-22.7136.3165.3-63.4169176.4170.70116.9
37K28.5Very low27.7Very low215 Ų215155.9 Ų155.994%0.93582%0.821SS**  trans-152.5172.2140.2-112161.9-171.2175.80111.9
38K29.1Very low27.7Very low207 Ų207155.6 Ų155.690%0.982%0.819SS**  trans-92.5160.7-158.5-62.7178.1177.3179.70114.6
39T27.3Very low27.7Very low132 Ų132155 Ų15581%0.8182%0.816SS**  trans-74.4161.7168.555.30000111.5
40P34.7Very low27.9Very low112 Ų112149.7 Ų149.773%0.72780%0.804SS**  -151.7148.878.238.2-17.8000119.2
41F23.8Very low28.2Very low207 Ų207145.6 Ų145.691%0.90880%0.799SS**  trans49.6159.3141.9-78.8-82.1000126.3
42S22.4Very low28.1Very low107 Ų107148 Ų14875%0.74880%0.8SS**  trans76108.6169.5-149.70000116.6
43V23.4Very low27.9Very low127 Ų127151.2 Ų151.277%0.7780%0.801SS**  78.3103.552.8-178.90000114.7
44C21.7Very low27.8Very low126 Ų126147.8 Ų147.885%0.85180%0.796SS**  trans-171.2141.2132.7-1010000112.1
45S23.7Very low27.3Very low113 Ų113147.9 Ų147.979%0.7980%0.798SS**  trans-114.8170.5167.2-520000109.2
46P39.7Very low27Very low110 Ų110143.9 Ų143.971%0.71479%0.789SS**  -154.5148.1105.235.1-16.2000118.4
47K27.7Very low26.9Very low193 Ų193140.9 Ų140.984%0.83979%0.787SS**  trans71.7153.1144.4-69.6172.4-177.8178.80117.7
48I26.4Very low26.8Very low145 Ų145141.7 Ų141.774%0.74478%0.784SS**  cis-152.31526.5-135160.7000112.4
49S25.6Very low26.7Very low108 Ų108140.5 Ų140.576%0.75578%0.782SS**  trans42.5144.5160-105.50000122.5
50S31.7Very low26.7Very low87 Ų87139.1 Ų139.161%0.60878%0.778SS**  cis-172.6149.5-9.532.30000111.7
51N28.9Very low26.3Very low147 Ų147143.6 Ų143.679%0.78679%0.786SS**  trans41136.7140.8-53-18.8000120.2
52L25.9Very low26.3Very low137 Ų137138.1 Ų138.172%0.71777%0.774SS**  cis-161.8-173.92.5-139.765.7000105.9
53R23.4Very low26.3Very low219 Ų219140.5 Ų140.583%0.82678%0.777SS**  cis-151.1-177.37.8-164.4-174.1-76.7-112.52.3107.9
54V25.7Very low26.3Very low128 Ų128140.6 Ų140.678%0.77678%0.782SS**  trans-128.1141.9-173.1175.10000113.1
55C22.2Very low26.4Very low120 Ų120138.1 Ų138.181%0.81178%0.777SS**  trans-162.6135.9144-98.20000106.3
56A25.7Very low26.7Very low83 Ų83140.7 Ų140.769%0.68678%0.782SS**  cis68129.141.600000111.7
57T26.4Very low26.2Very low135 Ų135142.4 Ų142.483%0.82879%0.791SS**  cis-144.9178.620.547.30000114.2
58R26.4Very low26.1Very low232 Ų232144.7 Ų144.788%0.87579%0.794SS**  trans-38.7144161.6-59.5166167.7172.7-6.9113.5
59Q27.1Very low26.2Very low182 Ų182142.3 Ų142.385%0.8580%0.796SS**  -173.6155.3101.2-104.2178-14.500112.7
60S29Very low26.2Very low104 Ų104144 Ų14473%0.72780%0.801SS**  trans-98.9133.5174.751.90000110.7
61F24.6Very low25.9Very low206 Ų206145.1 Ų145.190%0.90481%0.808SS**  trans-146.6157.5159.4-110-78.9000111.7
62S23.6Very low25.9Very low91 Ų91143.5 Ų143.564%0.63681%0.808SS**  trans-115.5141.7-179.4175.80000109.7
63L23.9Very low26Very low158 Ų158148.4 Ų148.483%0.82782%0.817SS**  167.4138.5118.4-104.1102.8000112.7
64C23.3Very low26.4Very low129 Ų129146 Ų14687%0.87282%0.819SS**  trans22.3128.3138.7-155.40000121.2
65G24.4Very low26.4Very low73 Ų73143.2 Ų143.275%0.75382%0.816SS**  trans172.3106.4162.400000115.9
66N28.5Very low26.7Very low167 Ų167142.7 Ų142.789%0.89381%0.813SS**  trans-57.6133.2179.1-76.1-43.4000115.1
67V28.8Very low27.1Very low147 Ų147145.1 Ų145.189%0.89182%0.82SS**  trans-138150.3146.8-174.20000109.6
68R27.1Very low27.4Very low240 Ų240146.4 Ų146.491%0.90682%0.816SS**  trans-63.4148.6-170.5-67.9173.8174.8149.8-1.9114.5
69A27.1Very low27.9Very low95 Ų95141 Ų14179%0.78581%0.809SS**  trans-75.4149.4167.300000112.8
70V26.4Very low28.5Very low144 Ų144140.6 Ų140.687%0.87381%0.807SS**  trans-126.5115.7153176.70000106.3
71C26.4Very low29Very low111 Ų111145.7 Ų145.775%0.7581%0.811SS**  trans-110.7108.4-173.7-173.40000110.6R73C71-R73 PolarHBondContact O-N 3.4Å
72S28Very low29.7Very low113 Ų113138.9 Ų138.979%0.7980%0.798SS**  trans-75.6109.9175.5-64.70000110.5I74S72-I74 PolarHBondContact O-N 2.96Å
73R27Very low30.8Very low240 Ų240140.8 Ų140.891%0.90680%0.797SS**  trans-70.6119.5178.1-66.3-179.8177.5-177.3-1.5111.1C71C71-R73 PolarHBondContact O-N 3.4Å
74I32.1Very low31.7Very low169 Ų169141.5 Ų141.587%0.86780%0.796SS**  trans-92.5119.9152-64.3175000106.3S72 S76S72-I74 PolarHBondContact O-N 2.96Å; I74-S76 PolarHBondContact O-N 3.12Å
75G26.3Very low32.8Very low68 Ų68144.3 Ų144.370%0.70179%0.794SS**  trans-80.7113.9-173.300000112.7
76S29.6Very low33.6Very low109 Ų109149.6 Ų149.676%0.76280%0.798SS**  trans-77.6119.9163.643.90000110I74 Q78I74-S76 PolarHBondContact O-N 3.12Å; S76-Q78 PolarHBondContact O-N 3.49Å
77V32.5Very low35Very low135 Ų135147.6 Ų147.682%0.81879%0.792SS**  trans-7594.7173.5178.80000108.6T79V77-T79 HydrophobicContact CG1-CG2 4.45Å; V77-T79 PolarHBondContact O-N 3.08Å
78Q33.8Very low36.3Very low162 Ų162145.5 Ų145.576%0.75778%0.784SS**  trans-86.292.5-178.5-168172.714.500110.6S76 Q80S76-Q78 PolarHBondContact O-N 3.49Å; Q78-Q80 PolarHBondContact O-N 3.31Å
79T36.8Very low37.4Very low119 Ų119139.9 Ų139.973%0.7378%0.777SS**  trans-6992.6175.550.80000111.1V77 W81V77-T79 HydrophobicContact CG1-CG2 4.45Å; V77-T79 PolarHBondContact O-N 3.08Å; T79-W81 PolarHBondContact O-N 3.43Å
80Q39.8Very low38.6Very low172 Ų172141.2 Ų141.280%0.80478%0.777SS**  trans-69.389.4172.2-76.3-172.8-4000111.3Q78Q78-Q80 PolarHBondContact O-N 3.31Å
81W40.1Very low39.8Very low212 Ų212145.6 Ų145.680%0.80378%0.778SS**  trans-115.951.3158.4-88.668.2000110T79 H83T79-W81 PolarHBondContact O-N 3.43Å; W81-H83 AromaticContact CE3-NE2 3.56Å; W81-H83 AromaticContact CZ3-NE2 3.76Å; W81-H83 PolarHBondContact O-N 3.06Å; W81-H83 VanDerWaalsContact O-N 3.1Å
82G39Very low41Very low62 Ų62152.2 Ų152.264%0.63979%0.787SS**  trans-7688.2171.400000110.5H84G82-H84 PolarHBondContact O-N 3.03Å
83H45.8Very low42.4Very low132 Ų132150.4 Ų150.461%0.61178%0.779SS**  trans-63.8105.5164.9-76.3-71.7000108.8W81 F85W81-H83 AromaticContact CE3-NE2 3.56Å; W81-H83 AromaticContact CZ3-NE2 3.76Å; W81-H83 PolarHBondContact O-N 3.06Å; W81-H83 VanDerWaalsContact O-N 3.1Å; H83-F85 HydrophobicContact CB-CE2 4.38Å; H83-F85 WeakPolarHBondContact O-CD2 3.49Å; H83-F85 PolarHBondContact O-N 2.04Å
84H42.1Very low44Very low173 Ų173144.5 Ų144.580%0.80177%0.765SS**  trans-65.896.2172.4-76.7-83.5000109.5G82 H86G82-H84 PolarHBondContact O-N 3.03Å; H84-H86 VanDerWaalsContact C-N 3.33Å; H84-H86 PolarHBondContact O-N 3.5Å
85F48.3Very low45.5Very low188 Ų188139.3 Ų139.383%0.82574%0.742SS**  trans-66.293.7168.8-74.3-84000109.2H83 T87H83-F85 HydrophobicContact CB-CE2 4.38Å; H83-F85 WeakPolarHBondContact O-CD2 3.49Å; H83-F85 PolarHBondContact O-N 2.04Å; F85-T87 VanDerWaalsContact C-N 3.27Å; F85-T87 PolarHBondContact O-N 3.01Å
86H41.1Very low47.4Very low183 Ų183139.4 Ų139.485%0.84774%0.736SS**  trans-6492163.2-92.2-80.5000108.9H84 S88H84-H86 VanDerWaalsContact C-N 3.33Å; H84-H86 PolarHBondContact O-N 3.5Å; H86-S88 PolarHBondContact O-N 2.98Å; H86-S88 VanDerWaalsContact O-N 3.12Å
87T57.2Low49.1Very low126 Ų126137.1 Ų137.177%0.77372%0.719SS**  trans-61.4111.7154.949.80000106.9F85 T89F85-T87 VanDerWaalsContact C-N 3.27Å; F85-T87 PolarHBondContact O-N 3.01Å; T87-T89 PolarHBondContact O-N 3.2Å
88S56.8Low50.8Low102 Ų102134.9 Ų134.971%0.71370%0.702SS**  trans-52139.1166.854.90000108.7H86H86-S88 PolarHBondContact O-N 2.98Å; H86-S88 VanDerWaalsContact O-N 3.12Å
89T50.2Low52.9Low123 Ų123131.5 Ų131.576%0.75569%0.689SS**  trans-48.6134170.241.70000109T87 R91T87-T89 PolarHBondContact O-N 3.2Å; T89-R91 PolarHBondContact O-N 3.16Å
90P52.2Low54.5Low123 Ų123130.7 Ų130.780%0.79967%0.672SS**  trans-60.4110.4-178.823.9-32.4000107.5R92P90-R92 PolarHBondContact O-N 3.38Å; P90-R92 VanDerWaalsContact O-N 3.09Å
91R50.8Low56.1Low236 Ų236128.9 Ų128.989%0.89167%0.666SS**  trans-53.4122.4168.1-73.7-175.3174.1-169.9-1.5105.6T89 A93T89-R91 PolarHBondContact O-N 3.16Å; R91-A93 VanDerWaalsContact C-N 3.33Å; R91-A93 PolarHBondContact O-N 2.87Å
92R52Low58Low249 Ų249123.4 Ų123.494%0.9466%0.655SS**  trans-52.9102175.5-72.9-177.8177.3174.4-2.4107.7P90P90-R92 PolarHBondContact O-N 3.38Å; P90-R92 VanDerWaalsContact O-N 3.09Å
93A58.2Low60.1Low76 Ų76123.2 Ų123.263%0.62864%0.639SS**PPolyproline II helixtrans-60.1152.7163.200000106.8R91R91-A93 VanDerWaalsContact C-N 3.33Å; R91-A93 PolarHBondContact O-N 2.87Å
94L58.9Low61.6Low116 Ų116119.4 Ų119.461%0.60762%0.621SS**PPolyproline II helixtrans-54.7130162.4-70.3169000106.8A96 L99L94-A96 PolarHBondContact O-N 2.73Å; L94-L99 HydrophobicContact CB-CD1 4.26Å; L94-L99 HydrophobicContact CB-CG 4.19Å
95P64.1Low63.4Low59 Ų59114.8 Ų114.838%0.38361%0.606SS.*PPolyproline II helixtrans-53.3135.7-173.821.1-33000108.9L98 L99P95-L98 HydrophobicContact CG-CD1 3.82Å; P95-L98 HydrophobicContact CG-CG 4.11Å; P95-L98 PolarHBondContact O-N 2.74Å; P95-L99 PolarHBondContact O-N 3.13Å
96A67.2Low65.2Low70 Ų70110.7 Ų110.758%0.57959%0.592SS**Hα-helixtrans-48.8-38.3-165.300000114.1L94 L98 L99 W100L94-A96 PolarHBondContact O-N 2.73Å; A96-L98 PolarHBondContact O-N 2.78Å; A96-L99 PolarHBondContact O-N 2.95Å; A96-W100 WeakPolarHBondContact O-CB 3.37Å; A96-W100 PolarHBondContact O-N 3.13Å
97P64.3Low67.4Low61 Ų61104.9 Ų104.940%0.39657%0.566SS.*Hα-helixtrans-53.7-45.1172.2-30.138.5000115.4W100 M101 L185P97-W100 PolarHBondContact O-N 2.93Å; P97-M101 WeakPolarHBondContact O-CB 2.8Å; P97-M101 PolarHBondContact O-N 3.06Å; P97-L185 HydrophobicContact CG-CD1 3.7Å
98L68.8Low68.5Low89 Ų89102.5 Ų102.547%0.46654%0.544SS..Hα-helixtrans-66.7-41.7-179.5-70.1-178000111.8P95 A96 W100 M101 V102P95-L98 HydrophobicContact CG-CD1 3.82Å; P95-L98 HydrophobicContact CG-CG 4.11Å; P95-L98 PolarHBondContact O-N 2.74Å; A96-L98 PolarHBondContact O-N 2.78Å; L98-W100 VanDerWaalsContact C-N 3.28Å; L98-W100 PolarHBondContact O-N 3.49Å; L98-M101 HydrophobicContact CD2-CE 4.28Å; L98-M101 PolarHBondContact O-N 3.03Å; L98-V102 PolarHBondContact O-N 2.92Å
99L76.8Confident69.9Low90 Ų90102 Ų10247%0.47153%0.534SS..Hα-helixtrans-60-41.7172.7-106.6166.5000110.9L94 P95 A96 L103L94-L99 HydrophobicContact CB-CD1 4.26Å; L94-L99 HydrophobicContact CB-CG 4.19Å; P95-L99 PolarHBondContact O-N 3.13Å; A96-L99 PolarHBondContact O-N 2.95Å; L99-L103 WeakPolarHBondContact O-CB 3.43Å; L99-L103 PolarHBondContact O-N 2.72Å
100W72.1Confident71.8Confident103 Ų103101.7 Ų101.739%0.3953%0.526SS..Hα-helixtrans-71.1-35.5-179.6-140.1-115.6000113.4A96 P97 L98 V102 L103 K104 H294A96-W100 WeakPolarHBondContact O-CB 3.37Å; A96-W100 PolarHBondContact O-N 3.13Å; P97-W100 PolarHBondContact O-N 2.93Å; L98-W100 VanDerWaalsContact C-N 3.28Å; L98-W100 PolarHBondContact O-N 3.49Å; W100-V102 VanDerWaalsContact C-N 3.28Å; W100-V102 PolarHBondContact O-N 2.94Å; W100-L103 HydrophobicContact CE3-CD2 3.86Å; W100-L103 HydrophobicContact CH2-CD2 4.22Å; W100-L103 HydrophobicContact CZ3-CD2 3.62Å; W100-L103 PolarHBondContact O-N 2.98Å; W100-K104 PolarHBondContact O-N 2.94Å; W100-H294 AromaticContact CD1-CE1 3.64Å; W100-H294 AromaticContact CE2-CE1 3.61Å; W100-H294 AromaticContact CE2-ND1 3.91Å; W100-H294 AromaticContact CZ2-ND1 3.84Å; W100-H294 AromaticContact NE1-CE1 2.95Å; W100-H294 PolarHBondContact NE1-CE1 3.41Å; W100-H294 AromaticContact NE1-ND1 3.58Å; W100-H294 AromaticContact NE1-NE2 3.61Å
101M72.3Confident73.5Confident134 Ų13496.1 Ų96.166%0.6649%0.491SS*.Hα-helixtrans-62.9-33.5177.2-167.5174.476.700112.2P97 L98 P105P97-M101 WeakPolarHBondContact O-CB 2.8Å; P97-M101 PolarHBondContact O-N 3.06Å; L98-M101 HydrophobicContact CD2-CE 4.28Å; L98-M101 PolarHBondContact O-N 3.03Å; M101-P105 WeakPolarHBondContact O-CD 3.05Å; M101-P105 VanDerWaalsContact O-CG 3.23Å; M101-P105 WeakPolarHBondContact O-CG 3.33Å
102V79.6Confident75.1Confident97 Ų9787.1 Ų87.159%0.58846%0.46SS*.Hα-helixtrans-82.6-38.2171.3-179.10000111.6L98 W100 P105 L106L98-V102 PolarHBondContact O-N 2.92Å; W100-V102 VanDerWaalsContact C-N 3.28Å; W100-V102 PolarHBondContact O-N 2.94Å; V102-P105 WeakPolarHBondContact O-CD 3.4Å; V102-P105 WeakPolarHBondContact O-CG 3.45Å; V102-L106 WeakPolarHBondContact O-CB 3.43Å; V102-L106 PolarHBondContact O-N 2.97Å
103L83Confident77Confident57 Ų5779.8 Ų79.830%0.29844%0.439SS..Hα-helixtrans-71.9-41.3-173.3-172.164.1000113.6L99 W100 L106 Q107L99-L103 WeakPolarHBondContact O-CB 3.43Å; L99-L103 PolarHBondContact O-N 2.72Å; W100-L103 HydrophobicContact CE3-CD2 3.86Å; W100-L103 HydrophobicContact CH2-CD2 4.22Å; W100-L103 HydrophobicContact CZ3-CD2 3.62Å; W100-L103 PolarHBondContact O-N 2.98Å; L103-L106 PolarHBondContact O-N 2.9Å; L103-Q107 HydrophobicContact CD1-CG 4.24Å; L103-Q107 HydrophobicContact CG-CG 4.2Å; L103-Q107 WeakPolarHBondContact O-CB 3.38Å; L103-Q107 VanDerWaalsContact O-CG 3.29Å; L103-Q107 WeakPolarHBondContact O-CG 3.38Å; L103-Q107 PolarHBondContact O-N 3.32Å
104K78.6Confident78.6Confident53 Ų5380.5 Ų80.523%0.2343%0.432CS..Hα-helixtrans-57.3-51.5178.1-78.7-159.6-179-1690113.4W100 L106 Q107 K108 H294 D297W100-K104 PolarHBondContact O-N 2.94Å; K104-L106 VanDerWaalsContact C-N 3.35Å; K104-Q107 PolarHBondContact O-N 3.3Å; K104-K108 PolarHBondContact O-N 3.03Å; K104-K108 VanDerWaalsContact O-N 3.15Å; K104-H294 PolarHBondContact NZ-NE2 2.91Å; K104-D297 VanDerWaalsContact CE-OD2 3.28Å; K104-D297 WeakPolarHBondContact CE-OD2 3.42Å; K104-D297 IonicContact NZ-OD2 3.52Å; K104-D297 PolarHBondContact NZ-OD2 2.88Å
105P80.3Confident80Confident76 Ų7675 Ų7549%0.49440%0.403SS..Hα-helixtrans-66.8-35177.124.4-32.2000112.2M101 V102 K108 L109M101-P105 WeakPolarHBondContact O-CD 3.05Å; M101-P105 VanDerWaalsContact O-CG 3.23Å; M101-P105 WeakPolarHBondContact O-CG 3.33Å; V102-P105 WeakPolarHBondContact O-CD 3.4Å; V102-P105 WeakPolarHBondContact O-CG 3.45Å; P105-K108 PolarHBondContact O-N 2.87Å; P105-L109 WeakPolarHBondContact O-CB 3.37Å; P105-L109 PolarHBondContact O-N 3.44Å
106L86.1Confident81.3Confident101 Ų10176.7 Ų76.753%0.52940%0.402SS..Hα-helixtrans-62.9-42.9175.6-172.271.9000112.2V102 L103 K104 L109 L110V102-L106 WeakPolarHBondContact O-CB 3.43Å; V102-L106 PolarHBondContact O-N 2.97Å; L103-L106 PolarHBondContact O-N 2.9Å; K104-L106 VanDerWaalsContact C-N 3.35Å; L106-L109 PolarHBondContact O-N 3.08Å; L106-L110 WeakPolarHBondContact O-CB 3.48Å; L106-L110 PolarHBondContact O-N 3.15Å
107Q85.4Confident82.4Confident62 Ų6277 Ų7729%0.2940%0.399SS..Hα-helixtrans-61.1-44.5174.9-76172.1-9.700111.8L103 K104 L110 A111 L301L103-Q107 HydrophobicContact CD1-CG 4.24Å; L103-Q107 HydrophobicContact CG-CG 4.2Å; L103-Q107 WeakPolarHBondContact O-CB 3.38Å; L103-Q107 VanDerWaalsContact O-CG 3.29Å; L103-Q107 WeakPolarHBondContact O-CG 3.38Å; L103-Q107 PolarHBondContact O-N 3.32Å; K104-Q107 PolarHBondContact O-N 3.3Å; Q107-L110 PolarHBondContact O-N 2.73Å; Q107-A111 PolarHBondContact O-N 2.91Å; Q107-L301 HydrophobicContact CB-CD1 4.02Å; Q107-L301 HydrophobicContact CB-CD2 4.26Å
108K82.1Confident83.8Confident75 Ų7577.6 Ų77.633%0.32640%0.399SS..Hα-helixtrans-66.5-40.4178.2-69.7179.7-179.3-176.40111.4K104 P105 A111 I112 D297 L301K104-K108 PolarHBondContact O-N 3.03Å; K104-K108 VanDerWaalsContact O-N 3.15Å; P105-K108 PolarHBondContact O-N 2.87Å; K108-A111 PolarHBondContact O-N 2.94Å; K108-I112 WeakPolarHBondContact O-CD1 3.02Å; K108-I112 VanDerWaalsContact O-CG1 3.25Å; K108-I112 WeakPolarHBondContact O-CG1 3.34Å; K108-I112 PolarHBondContact O-N 3.49Å; K108-I112 VanDerWaalsContact O-N 3.13Å; K108-D297 VanDerWaalsContact CE-OD1 3.32Å; K108-D297 WeakPolarHBondContact CE-OD1 3.49Å; K108-D297 IonicContact NZ-OD1 2.7Å; K108-D297 PolarHBondContact NZ-OD1 3Å; K108-L301 HydrophobicContact CB-CD2 4.47Å; K108-L301 HydrophobicContact CG-CD2 3.67Å
109L85.4Confident84.8Confident93 Ų9376.2 Ų76.249%0.48739%0.387SS..Hα-helixtrans-62.1-42.8172.1-177.264.6000112.2P105 L106 I112 L113P105-L109 WeakPolarHBondContact O-CB 3.37Å; P105-L109 PolarHBondContact O-N 3.44Å; L106-L109 PolarHBondContact O-N 3.08Å; L109-I112 WeakPolarHBondContact O-CB 3.47Å; L109-I112 PolarHBondContact O-N 3.48Å; L109-L113 HydrophobicContact CD1-CD1 4.42Å; L109-L113 HydrophobicContact CD1-CG 4.43Å; L109-L113 HydrophobicContact CG-CD1 4.04Å; L109-L113 HydrophobicContact CG-CG 4.45Å; L109-L113 WeakPolarHBondContact O-CG 3.49Å; L109-L113 PolarHBondContact O-N 3.15Å
110L89.8Confident85.5Confident115 Ų11580 Ų8060%0.60240%0.4SS*.Hα-helixtrans-64.1-40.4178.3-17662000112.2L106 Q107 L113 L114L106-L110 WeakPolarHBondContact O-CB 3.48Å; L106-L110 PolarHBondContact O-N 3.15Å; Q107-L110 PolarHBondContact O-N 2.73Å; L110-L113 PolarHBondContact O-N 2.93Å; L110-L114 VanDerWaalsContact O-CB 3.24Å; L110-L114 WeakPolarHBondContact O-CB 3.28Å; L110-L114 PolarHBondContact O-N 3.35Å
111A87.3Confident86.5Confident6 Ų681.1 Ų81.15%0.0540%0.404CS..Hα-helixtrans-60.5-43.4173.600000112.2Q107 K108 G115 L301 V304 T305Q107-A111 PolarHBondContact O-N 2.91Å; K108-A111 PolarHBondContact O-N 2.94Å; A111-G115 PolarHBondContact O-N 2.9Å; A111-L301 HydrophobicContact CB-CB 4.44Å; A111-L301 HydrophobicContact CB-CD2 4.29Å; A111-V304 HydrophobicContact CB-CG1 4.06Å; A111-T305 WeakPolarHBondContact CB-OG1 3.43Å
112I85.9Confident87.4Confident47 Ų4778.9 Ų78.924%0.24139%0.388CS..Hα-helixtrans-61.9-50175-66.3165.4000110.8K108 L109 L114 G115 R116 V304 W308K108-I112 WeakPolarHBondContact O-CD1 3.02Å; K108-I112 VanDerWaalsContact O-CG1 3.25Å; K108-I112 WeakPolarHBondContact O-CG1 3.34Å; K108-I112 PolarHBondContact O-N 3.49Å; K108-I112 VanDerWaalsContact O-N 3.13Å; L109-I112 WeakPolarHBondContact O-CB 3.47Å; L109-I112 PolarHBondContact O-N 3.48Å; I112-L114 VanDerWaalsContact C-N 3.35Å; I112-L114 PolarHBondContact O-N 2.9Å; I112-G115 PolarHBondContact O-N 3.39Å; I112-R116 HydrophobicContact CG2-CG 4.48Å; I112-R116 WeakPolarHBondContact O-CG 3.32Å; I112-R116 PolarHBondContact O-N 2.9Å; I112-V304 HydrophobicContact CG1-CG1 3.85Å; I112-W308 HydrophobicContact CB-CG 4.49Å; I112-W308 HydrophobicContact CG2-CD2 3.94Å; I112-W308 HydrophobicContact CG2-CE3 4.46Å; I112-W308 HydrophobicContact CG2-CG 4.24Å; I112-W308 HydrophobicContact CG2-CZ2 4.07Å
113L90.1Very high87.9Confident96 Ų9676.3 Ų76.350%0.50338%0.382SS..Hα-helixtrans-62.9-40180-71.3173000112L109 L110 R116 S117L109-L113 HydrophobicContact CD1-CD1 4.42Å; L109-L113 HydrophobicContact CD1-CG 4.43Å; L109-L113 HydrophobicContact CG-CD1 4.04Å; L109-L113 HydrophobicContact CG-CG 4.45Å; L109-L113 WeakPolarHBondContact O-CG 3.49Å; L109-L113 PolarHBondContact O-N 3.15Å; L110-L113 PolarHBondContact O-N 2.93Å; L113-R116 PolarHBondContact O-N 3.35Å; L113-S117 WeakPolarHBondContact O-CB 3.45Å; L113-S117 PolarHBondContact O-N 2.96Å
114L92.7Very high88.3Confident91 Ų9177.8 Ų77.848%0.47640%0.397SS..Hα-helixtrans-61.9-47.6175.4179.859.4000111.3L110 I112 S117 L118 T305L110-L114 VanDerWaalsContact O-CB 3.24Å; L110-L114 WeakPolarHBondContact O-CB 3.28Å; L110-L114 PolarHBondContact O-N 3.35Å; I112-L114 VanDerWaalsContact C-N 3.35Å; I112-L114 PolarHBondContact O-N 2.9Å; L114-S117 PolarHBondContact O-N 3.06Å; L114-L118 HydrophobicContact CD1-CD1 4.27Å; L114-L118 HydrophobicContact CD1-CG 4.44Å; L114-L118 HydrophobicContact CG-CD1 4.15Å; L114-L118 WeakPolarHBondContact O-CB 3.07Å; L114-L118 WeakPolarHBondContact O-CG 3.23Å; L114-L118 PolarHBondContact O-N 2.88Å; L114-T305 HydrophobicContact CB-CG2 4.32Å; L114-T305 HydrophobicContact CD2-CG2 3.91Å; L114-T305 HydrophobicContact CG-CG2 3.94Å
115G89.3Confident89.1Confident0 Ų076.3 Ų76.30%039%0.392CS..Hα-helixtrans-61.6-48.4175.800000112.7A111 I112 S117 L118 R119 W308 A309A111-G115 PolarHBondContact O-N 2.9Å; I112-G115 PolarHBondContact O-N 3.39Å; G115-S117 VanDerWaalsContact C-N 3.29Å; G115-S117 PolarHBondContact O-N 3.03Å; G115-L118 PolarHBondContact O-N 3.44Å; G115-R119 WeakPolarHBondContact O-CB 3.48Å; G115-R119 PolarHBondContact O-N 3.4Å; G115-W308 VanDerWaalsContact C-C 3.49Å; G115-W308 CarbonylContact C-O 3.56Å; G115-W308 VanDerWaalsContact C-O 3.27Å; G115-W308 CarbonylContact O-C 3.58Å; G115-A309 WeakPolarHBondContact O-CA 3.49Å
116R89.6Confident89.7Confident95 Ų9576 Ų7636%0.35839%0.389SS..Hα-helixtrans-58.4-40.1175.1-70.6-178.191.4114.29112.1I112 L113 K120 W308 D314I112-R116 HydrophobicContact CG2-CG 4.48Å; I112-R116 WeakPolarHBondContact O-CG 3.32Å; I112-R116 PolarHBondContact O-N 2.9Å; L113-R116 PolarHBondContact O-N 3.35Å; R116-K120 WeakPolarHBondContact O-CB 3.46Å; R116-K120 PolarHBondContact O-N 3.48Å; R116-W308 HydrophobicContact CG-CD2 4.2Å; R116-W308 HydrophobicContact CG-CE3 3.38Å; R116-W308 HydrophobicContact CG-CZ3 3.77Å; R116-W308 VanDerWaalsContact NH1-CH2 3.26Å; R116-D314 IonicContact CZ-OD1 2.84Å; R116-D314 IonicContact NH1-OD1 3.13Å; R116-D314 PolarHBondContact NH1-OD1 3.35Å; R116-D314 IonicContact NH2-OD1 2.65Å; R116-D314 PolarHBondContact NH2-OD1 2.85Å; R116-D314 IonicContact NH2-OD2 2.76Å; R116-D314 PolarHBondContact NH2-OD2 3.29Å; R116-D314 VanDerWaalsContact NH2-OD2 3.13Å
117S92Very high89.9Confident75 Ų7576 Ų7652%0.52439%0.39SS..Hα-helixtrans-65.7-47.9178.1-172.20000111.7L113 L114 G115 R119 K120 W121L113-S117 WeakPolarHBondContact O-CB 3.45Å; L113-S117 PolarHBondContact O-N 2.96Å; L114-S117 PolarHBondContact O-N 3.06Å; G115-S117 VanDerWaalsContact C-N 3.29Å; G115-S117 PolarHBondContact O-N 3.03Å; S117-R119 PolarHBondContact O-N 3.43Å; S117-K120 PolarHBondContact O-N 3.1Å; S117-W121 VanDerWaalsContact O-CB 3.26Å; S117-W121 WeakPolarHBondContact O-CB 3.39Å; S117-W121 PolarHBondContact O-N 3.43Å
118L92.9Very high90.3Very high75 Ų7578.2 Ų78.239%0.39340%0.404SS..Hα-helixtrans-56.6-46.7174.2-74.4165000111.7L114 G115 W121 W122 T305 A309L114-L118 HydrophobicContact CD1-CD1 4.27Å; L114-L118 HydrophobicContact CD1-CG 4.44Å; L114-L118 HydrophobicContact CG-CD1 4.15Å; L114-L118 WeakPolarHBondContact O-CB 3.07Å; L114-L118 WeakPolarHBondContact O-CG 3.23Å; L114-L118 PolarHBondContact O-N 2.88Å; G115-L118 PolarHBondContact O-N 3.44Å; L118-W121 PolarHBondContact O-N 3.42Å; L118-W122 WeakPolarHBondContact O-CB 3.19Å; L118-W122 PolarHBondContact O-N 3.46Å; L118-T305 HydrophobicContact CD1-CG2 4.43Å; L118-A309 HydrophobicContact CB-CB 4.32Å
119R89.6Confident90.8Very high59 Ų5982 Ų8222%0.22342%0.416CS..Hα-helixtrans-60.3-49.4176.8-167.7-161.3-56.9-168.3-10.9111.8G115 S117 W122 G123 W308 A309 C311 G313G115-R119 WeakPolarHBondContact O-CB 3.48Å; G115-R119 PolarHBondContact O-N 3.4Å; S117-R119 PolarHBondContact O-N 3.43Å; R119-W122 PolarHBondContact O-N 2.94Å; R119-G123 PolarHBondContact O-N 3.23Å; R119-W308 PolarHBondContact NE-O 3.13Å; R119-W308 PolarHBondContact NH2-O 2.88Å; R119-A309 WeakPolarHBondContact CB-O 3.29Å; R119-C311 PolarHBondContact NH1-O 3.3Å; R119-C311 PolarHBondContact NH2-O 3.37Å; R119-G313 PolarHBondContact NH1-O 3.01Å; R119-G313 VanDerWaalsContact NH1-O 3.14Å
120K91.1Very high91.1Very high171 Ų17180.2 Ų80.274%0.74340%0.403SS*.Hα-helixtrans-65.5-41.2-179.3-173.8176.1-179.3179.30111.6R116 S117 G123 S124R116-K120 WeakPolarHBondContact O-CB 3.46Å; R116-K120 PolarHBondContact O-N 3.48Å; S117-K120 PolarHBondContact O-N 3.1Å; K120-G123 PolarHBondContact O-N 3.37Å; K120-S124 WeakPolarHBondContact O-CB 3.4Å; K120-S124 PolarHBondContact O-N 2.95Å; K120-S124 PolarHBondContact O-OG 3.36Å
121W93.7Very high91.2Very high126 Ų12680.1 Ų80.148%0.47740%0.399SS..Hα-helixtrans-59.3-50.9173.816976000111.4S117 L118 G123 S124 L125S117-W121 VanDerWaalsContact O-CB 3.26Å; S117-W121 WeakPolarHBondContact O-CB 3.39Å; S117-W121 PolarHBondContact O-N 3.43Å; L118-W121 PolarHBondContact O-N 3.42Å; W121-G123 VanDerWaalsContact C-N 3.33Å; W121-G123 PolarHBondContact O-N 3.02Å; W121-S124 WeakPolarHBondContact CA-OG 3.21Å; W121-S124 PolarHBondContact O-N 3.14Å; W121-S124 VanDerWaalsContact O-N 3.08Å; W121-S124 PolarHBondContact O-OG 3.01Å; W121-L125 HydrophobicContact CD2-CD1 4.41Å; W121-L125 HydrophobicContact CH2-CD1 4.17Å; W121-L125 HydrophobicContact CZ2-CD1 3.86Å; W121-L125 PolarHBondContact O-N 3.28Å
122W91.2Very high91.5Very high86 Ų8684.8 Ų84.833%0.32642%0.423SS..Hα-helixtrans-60.3-41.7178.3-172.4-108.1000112.6L118 R119 L125 R130 V133 R134L118-W122 WeakPolarHBondContact O-CB 3.19Å; L118-W122 PolarHBondContact O-N 3.46Å; R119-W122 PolarHBondContact O-N 2.94Å; W122-L125 HydrophobicContact CE3-CD1 4.21Å; W122-L125 PolarHBondContact O-N 3.33Å; W122-R130 PolarHBondContact O-NE 3.18Å; W122-V133 HydrophobicContact CH2-CG1 4.35Å; W122-V133 HydrophobicContact CZ3-CB 4.08Å; W122-V133 HydrophobicContact CZ3-CG1 3.75Å; W122-R134 HydrophobicContact CH2-CG 4.11Å; W122-R134 HydrophobicContact CZ2-CG 4.41Å
123G89.4Confident91.8Very high44 Ų4484.4 Ų84.445%0.45442%0.423SS..Hα-helixtrans-62.1-39.3172.300000113.3R119 K120 W121 L125 R130R119-G123 PolarHBondContact O-N 3.23Å; K120-G123 PolarHBondContact O-N 3.37Å; W121-G123 VanDerWaalsContact C-N 3.33Å; W121-G123 PolarHBondContact O-N 3.02Å; G123-L125 VanDerWaalsContact C-N 3.3Å; G123-L125 PolarHBondContact O-N 3.47Å; G123-R130 PolarHBondContact O-NH2 3.34Å
124S92.4Very high91.8Very high88 Ų8886.3 Ų86.362%0.61542%0.423SS*.Hα-helixtrans-73-15.2-178.973.50000115.2K120 W121K120-S124 WeakPolarHBondContact O-CB 3.4Å; K120-S124 PolarHBondContact O-N 2.95Å; K120-S124 PolarHBondContact O-OG 3.36Å; W121-S124 WeakPolarHBondContact CA-OG 3.21Å; W121-S124 PolarHBondContact O-N 3.14Å; W121-S124 VanDerWaalsContact O-N 3.08Å; W121-S124 PolarHBondContact O-OG 3.01Å
125L93.8Very high91.9Very high22 Ų2284.5 Ų84.512%0.11541%0.412CS..SBendtrans-74.5133.8177.2-71.4170.8000110.8W121 W122 G123 R129 R130W121-L125 HydrophobicContact CD2-CD1 4.41Å; W121-L125 HydrophobicContact CH2-CD1 4.17Å; W121-L125 HydrophobicContact CZ2-CD1 3.86Å; W121-L125 PolarHBondContact O-N 3.28Å; W122-L125 HydrophobicContact CE3-CD1 4.21Å; W122-L125 PolarHBondContact O-N 3.33Å; G123-L125 VanDerWaalsContact C-N 3.3Å; G123-L125 PolarHBondContact O-N 3.47Å; L125-R129 HydrophobicContact CB-CB 4.46Å; L125-R129 HydrophobicContact CD2-CB 4.09Å; L125-R130 HydrophobicContact CB-CG 3.78Å; L125-R130 PolarHBondContact O-NE 3.13Å; L125-R130 PolarHBondContact O-NH2 2.91Å; L125-R130 VanDerWaalsContact O-NH2 3.13Å
126P93Very high92.2Very high68 Ų6890 Ų9044%0.44243%0.433SS..  trans-67.6154.9167.329.2-34.9000111N128 R129 R130P126-N128 VanDerWaalsContact C-N 3.32Å; P126-N128 WeakPolarHBondContact CG-OD1 3.26Å; P126-N128 PolarHBondContact O-N 2.77Å; P126-R129 HydrophobicContact CG-CB 4.25Å; P126-R129 HydrophobicContact CG-CG 4.03Å; P126-R129 WeakPolarHBondContact O-CA 3.22Å; P126-R129 WeakPolarHBondContact O-CB 3.2Å; P126-R129 PolarHBondContact O-N 2.94Å; P126-R130 PolarHBondContact O-N 3.32Å
127D91.6Very high92.3Very high102 Ų10289 Ų8955%0.54543%0.434SS..Hα-helixtrans-62.2-32.5-168.2-72.6-70000114.8R129 R130 Q131D127-R129 VanDerWaalsContact C-N 3.31Å; D127-R129 PolarHBondContact O-N 2.99Å; D127-R130 VanDerWaalsContact CG-NH1 3.27Å; D127-R130 PolarHBondContact O-N 2.92Å; D127-R130 WeakPolarHBondContact OD1-CD 3.33Å; D127-R130 IonicContact OD1-CZ 3.17Å; D127-R130 IonicContact OD1-NE 3.12Å; D127-R130 IonicContact OD1-NH1 3.14Å; D127-R130 PolarHBondContact OD1-NH1 3.23Å; D127-R130 IonicContact OD2-NH1 3.89Å; D127-R130 PolarHBondContact OD2-NH1 2.88Å; D127-Q131 WeakPolarHBondContact O-CB 3.35Å; D127-Q131 PolarHBondContact O-N 3.39Å
128N93.1Very high92.4Very high108 Ų10891.7 Ų91.758%0.57844%0.439SS*.Hα-helixtrans-60.1-39.2171.962.6-5.2000112.3P126 L132P126-N128 VanDerWaalsContact C-N 3.32Å; P126-N128 WeakPolarHBondContact CG-OD1 3.26Å; P126-N128 PolarHBondContact O-N 2.77Å; N128-L132 WeakPolarHBondContact O-CG 3.39Å; N128-L132 PolarHBondContact O-N 3.46Å
129R92.3Very high92.6Very high155 Ų15596.3 Ų96.359%0.58545%0.451SS*.Hα-helixtrans-74.1-37.4173.7-66.9-171-178.3-155.80.9112L125 P126 D127 Q131 L132 V133L125-R129 HydrophobicContact CB-CB 4.46Å; L125-R129 HydrophobicContact CD2-CB 4.09Å; P126-R129 HydrophobicContact CG-CB 4.25Å; P126-R129 HydrophobicContact CG-CG 4.03Å; P126-R129 WeakPolarHBondContact O-CA 3.22Å; P126-R129 WeakPolarHBondContact O-CB 3.2Å; P126-R129 PolarHBondContact O-N 2.94Å; D127-R129 VanDerWaalsContact C-N 3.31Å; D127-R129 PolarHBondContact O-N 2.99Å; R129-Q131 VanDerWaalsContact C-N 3.31Å; R129-Q131 PolarHBondContact O-N 3.45Å; R129-L132 PolarHBondContact O-N 3.03Å; R129-V133 WeakPolarHBondContact O-CG2 3.44Å; R129-V133 PolarHBondContact O-N 3.44Å
130R91.6Very high92.8Very high56 Ų5699.8 Ų99.821%0.21146%0.464CS..Hα-helixtrans-59.2-43.8173.1-63.6-176.9-172.5139.62.4110.8W122 G123 L125 P126 D127 V133 R134W122-R130 PolarHBondContact O-NE 3.18Å; G123-R130 PolarHBondContact O-NH2 3.34Å; L125-R130 HydrophobicContact CB-CG 3.78Å; L125-R130 PolarHBondContact O-NE 3.13Å; L125-R130 PolarHBondContact O-NH2 2.91Å; L125-R130 VanDerWaalsContact O-NH2 3.13Å; P126-R130 PolarHBondContact O-N 3.32Å; D127-R130 VanDerWaalsContact CG-NH1 3.27Å; D127-R130 PolarHBondContact O-N 2.92Å; D127-R130 WeakPolarHBondContact OD1-CD 3.33Å; D127-R130 IonicContact OD1-CZ 3.17Å; D127-R130 IonicContact OD1-NE 3.12Å; D127-R130 IonicContact OD1-NH1 3.14Å; D127-R130 PolarHBondContact OD1-NH1 3.23Å; D127-R130 IonicContact OD2-NH1 3.89Å; D127-R130 PolarHBondContact OD2-NH1 2.88Å; R130-V133 PolarHBondContact O-N 2.81Å; R130-R134 WeakPolarHBondContact O-CG 3.3Å; R130-R134 PolarHBondContact O-N 3.27Å
131Q91.9Very high93Very high112 Ų11299 Ų9952%0.52346%0.456SS..Hα-helixtrans-62.1-50.4175.5179.4174.6-21.300111.4D127 R129 V133 R134 E135D127-Q131 WeakPolarHBondContact O-CB 3.35Å; D127-Q131 PolarHBondContact O-N 3.39Å; R129-Q131 VanDerWaalsContact C-N 3.31Å; R129-Q131 PolarHBondContact O-N 3.45Å; Q131-V133 VanDerWaalsContact C-N 3.25Å; Q131-V133 PolarHBondContact O-N 2.95Å; Q131-R134 WeakPolarHBondContact O-CB 3.4Å; Q131-R134 PolarHBondContact O-N 3.18Å; Q131-E135 HydrophobicContact CG-CG 4.33Å; Q131-E135 VanDerWaalsContact CG-OE1 3.29Å; Q131-E135 WeakPolarHBondContact CG-OE1 3.39Å; Q131-E135 PolarHBondContact NE2-OE1 3.15Å; Q131-E135 WeakPolarHBondContact O-CG 3.5Å; Q131-E135 PolarHBondContact O-N 3.24Å
132L93.7Very high93.1Very high104 Ų104101.4 Ų101.455%0.54547%0.466SS..Hα-helixtrans-56.1-37.7176.5-73.8169.7000112.8N128 R129 W136N128-L132 WeakPolarHBondContact O-CG 3.39Å; N128-L132 PolarHBondContact O-N 3.46Å; R129-L132 PolarHBondContact O-N 3.03Å; L132-W136 VanDerWaalsContact O-CB 3.26Å; L132-W136 WeakPolarHBondContact O-CB 3.3Å; L132-W136 PolarHBondContact O-N 3.19Å
133V92Very high93.3Very high39 Ų39104 Ų10424%0.23648%0.481CS..Hα-helixtrans-71.7-39.6175.1179.30000111.9W122 R129 R130 Q131 W136 L137W122-V133 HydrophobicContact CH2-CG1 4.35Å; W122-V133 HydrophobicContact CZ3-CB 4.08Å; W122-V133 HydrophobicContact CZ3-CG1 3.75Å; R129-V133 WeakPolarHBondContact O-CG2 3.44Å; R129-V133 PolarHBondContact O-N 3.44Å; R130-V133 PolarHBondContact O-N 2.81Å; Q131-V133 VanDerWaalsContact C-N 3.25Å; Q131-V133 PolarHBondContact O-N 2.95Å; V133-W136 PolarHBondContact O-N 2.97Å; V133-L137 HydrophobicContact CG1-CD1 4.08Å; V133-L137 HydrophobicContact CG1-CG 4.34Å; V133-L137 WeakPolarHBondContact O-CB 3.48Å; V133-L137 VanDerWaalsContact O-CG 3.26Å; V133-L137 WeakPolarHBondContact O-CG 3.29Å; V133-L137 PolarHBondContact O-N 3.44Å
134R92.1Very high93.4Very high136 Ų136105.6 Ų105.651%0.51348%0.478SS..Hα-helixtrans-59.8-45.6172.6-70.2175.1-165.4178.85.3111.5W122 R130 Q131 L137 Q138W122-R134 HydrophobicContact CH2-CG 4.11Å; W122-R134 HydrophobicContact CZ2-CG 4.41Å; R130-R134 WeakPolarHBondContact O-CG 3.3Å; R130-R134 PolarHBondContact O-N 3.27Å; Q131-R134 WeakPolarHBondContact O-CB 3.4Å; Q131-R134 PolarHBondContact O-N 3.18Å; R134-L137 PolarHBondContact O-N 2.85Å; R134-Q138 WeakPolarHBondContact O-CB 3.47Å; R134-Q138 VanDerWaalsContact O-CG 3.32Å; R134-Q138 WeakPolarHBondContact O-CG 3.44Å; R134-Q138 PolarHBondContact O-N 2.84Å
135E94.2Very high93.5Very high53 Ų53104 Ų10425%0.24847%0.471CS..Hα-helixtrans-66.4-36.1177.1-69.7176.8-160.200112.5Q131 R139Q131-E135 HydrophobicContact CG-CG 4.33Å; Q131-E135 VanDerWaalsContact CG-OE1 3.29Å; Q131-E135 WeakPolarHBondContact CG-OE1 3.39Å; Q131-E135 PolarHBondContact NE2-OE1 3.15Å; Q131-E135 WeakPolarHBondContact O-CG 3.5Å; Q131-E135 PolarHBondContact O-N 3.24Å; E135-R139 VanDerWaalsContact O-CB 3.23Å; E135-R139 WeakPolarHBondContact O-CB 3.26Å; E135-R139 WeakPolarHBondContact O-CG 3.34Å; E135-R139 PolarHBondContact O-N 3.1Å; E135-R139 PolarHBondContact O-NE 3.48Å; E135-R139 IonicContact OE2-CZ 2.68Å; E135-R139 IonicContact OE2-NH2 3.06Å; E135-R139 PolarHBondContact OE2-NH2 3.05Å
136W94.4Very high93.6Very high117 Ų117107.2 Ų107.244%0.44349%0.492SS..Hα-helixtrans-65.4-44173.5-179.699.1000111.3L132 V133 R139 R140 L144L132-W136 VanDerWaalsContact O-CB 3.26Å; L132-W136 WeakPolarHBondContact O-CB 3.3Å; L132-W136 PolarHBondContact O-N 3.19Å; V133-W136 PolarHBondContact O-N 2.97Å; W136-R139 PolarHBondContact O-N 3.37Å; W136-R140 WeakPolarHBondContact O-CB 3Å; W136-R140 PolarHBondContact O-N 2.88Å; W136-L144 HydrophobicContact CZ3-CD1 4.31Å
137L93.2Very high93.7Very high72 Ų72106 Ų10638%0.37749%0.491SS..Hα-helixtrans-61.6-45.1174.5-73.7168.1000111.1V133 R134 R140 R141 L144V133-L137 HydrophobicContact CG1-CD1 4.08Å; V133-L137 HydrophobicContact CG1-CG 4.34Å; V133-L137 WeakPolarHBondContact O-CB 3.48Å; V133-L137 VanDerWaalsContact O-CG 3.26Å; V133-L137 WeakPolarHBondContact O-CG 3.29Å; V133-L137 PolarHBondContact O-N 3.44Å; R134-L137 PolarHBondContact O-N 2.85Å; L137-R140 CarbonylContact O-C 3.27Å; L137-R140 PolarHBondContact O-N 3.02Å; L137-R141 VanDerWaalsContact O-CA 3.29Å; L137-R141 WeakPolarHBondContact O-CA 3.36Å; L137-R141 WeakPolarHBondContact O-CB 3.44Å; L137-R141 PolarHBondContact O-N 2.74Å; L137-L144 HydrophobicContact CD2-CD1 3.7Å
138Q93.9Very high93.7Very high133 Ų133104.2 Ų104.262%0.62149%0.491SS*.Hα-helixtrans-63.9-47.1176.5-75.3173.4-14.800112R134 R140 R141R134-Q138 WeakPolarHBondContact O-CB 3.47Å; R134-Q138 VanDerWaalsContact O-CG 3.32Å; R134-Q138 WeakPolarHBondContact O-CG 3.44Å; R134-Q138 PolarHBondContact O-N 2.84Å; Q138-R140 VanDerWaalsContact C-N 3.3Å; Q138-R140 PolarHBondContact O-N 2.9Å; Q138-R141 WeakPolarHBondContact O-CB 3.28Å; Q138-R141 WeakPolarHBondContact O-CD 3.44Å; Q138-R141 VanDerWaalsContact O-CG 3.24Å; Q138-R141 WeakPolarHBondContact O-CG 3.49Å; Q138-R141 PolarHBondContact O-N 3Å
139R95.6Very high93.8Very high172 Ų172100.5 Ų100.565%0.64948%0.478SS*.Hα-helixtrans-63-34.1177.4-76-177.9-102.1-171.8-7.2112.5E135 W136E135-R139 VanDerWaalsContact O-CB 3.23Å; E135-R139 WeakPolarHBondContact O-CB 3.26Å; E135-R139 WeakPolarHBondContact O-CG 3.34Å; E135-R139 PolarHBondContact O-N 3.1Å; E135-R139 PolarHBondContact O-NE 3.48Å; E135-R139 IonicContact OE2-CZ 2.68Å; E135-R139 IonicContact OE2-NH2 3.06Å; E135-R139 PolarHBondContact OE2-NH2 3.05Å; W136-R139 PolarHBondContact O-N 3.37Å
140R95.5Very high94Very high131 Ų13197.1 Ų97.149%0.49447%0.474SS..THydrogen-bonded Turntrans-99.48.6178.4-62.9-166.7179-150.8-3.1114.8W136 L137 Q138 W142 H143 L144W136-R140 WeakPolarHBondContact O-CB 3Å; W136-R140 PolarHBondContact O-N 2.88Å; L137-R140 CarbonylContact O-C 3.27Å; L137-R140 PolarHBondContact O-N 3.02Å; Q138-R140 VanDerWaalsContact C-N 3.3Å; Q138-R140 PolarHBondContact O-N 2.9Å; R140-W142 PolarHBondContact O-N 3.02Å; R140-W142 VanDerWaalsContact O-N 3.09Å; R140-H143 PolarHBondContact O-N 3.19Å; R140-L144 HydrophobicContact CB-CD1 4.4Å; R140-L144 HydrophobicContact CB-CG 4.46Å; R140-L144 WeakPolarHBondContact O-CG 3.14Å; R140-L144 PolarHBondContact O-N 2.73Å
141R94.4Very high93.9Very high155 Ų15596.9 Ų96.959%0.58548%0.484SS*.Hα-helixtrans-53.2-38.4-172.770.7-173.5175.9146-3.2113.2L137 Q138 L144 A145L137-R141 VanDerWaalsContact O-CA 3.29Å; L137-R141 WeakPolarHBondContact O-CA 3.36Å; L137-R141 WeakPolarHBondContact O-CB 3.44Å; L137-R141 PolarHBondContact O-N 2.74Å; Q138-R141 WeakPolarHBondContact O-CB 3.28Å; Q138-R141 WeakPolarHBondContact O-CD 3.44Å; Q138-R141 VanDerWaalsContact O-CG 3.24Å; Q138-R141 WeakPolarHBondContact O-CG 3.49Å; Q138-R141 PolarHBondContact O-N 3Å; R141-L144 PolarHBondContact O-N 3.27Å; R141-A145 VanDerWaalsContact O-CB 3.3Å; R141-A145 WeakPolarHBondContact O-CB 3.45Å; R141-A145 PolarHBondContact O-N 3.04Å
142W95.5Very high93.9Very high177 Ų17797.4 Ų97.467%0.6749%0.49SS*.Hα-helixtrans-67.9-47.2177.3-65123.2000112.4R140 L144 A145 T146R140-W142 PolarHBondContact O-N 3.02Å; R140-W142 VanDerWaalsContact O-N 3.09Å; W142-L144 VanDerWaalsContact C-N 3.28Å; W142-L144 PolarHBondContact O-N 3.08Å; W142-A145 PolarHBondContact O-N 3.32Å; W142-T146 PolarHBondContact O-N 3.49Å; W142-T146 PolarHBondContact O-OG1 3.34Å
143H95.2Very high93.9Very high141 Ų14196.5 Ų96.565%0.65349%0.489SS*.Hα-helixtrans-61.8-36.2175.6-58.5-60.1000112.7R140 G147R140-H143 PolarHBondContact O-N 3.19Å; H143-G147 PolarHBondContact O-N 3.16Å
144L93Very high93.9Very high76 Ų7699 Ų9940%0.39850%0.5SS..Hα-helixtrans-69-42.4175.7-65.6170000111.4W136 L137 R140 R141 W142 G147 A148W136-L144 HydrophobicContact CZ3-CD1 4.31Å; L137-L144 HydrophobicContact CD2-CD1 3.7Å; R140-L144 HydrophobicContact CB-CD1 4.4Å; R140-L144 HydrophobicContact CB-CG 4.46Å; R140-L144 WeakPolarHBondContact O-CG 3.14Å; R140-L144 PolarHBondContact O-N 2.73Å; R141-L144 PolarHBondContact O-N 3.27Å; W142-L144 VanDerWaalsContact C-N 3.28Å; W142-L144 PolarHBondContact O-N 3.08Å; L144-G147 PolarHBondContact O-N 3.08Å; L144-A148 WeakPolarHBondContact O-CB 3.19Å; L144-A148 PolarHBondContact O-N 2.99Å
145A93.6Very high93.8Very high56 Ų5696.1 Ų96.146%0.46350%0.497SS..Hα-helixtrans-64.3-42.4174.200000112.2R141 W142 A148 G149R141-A145 VanDerWaalsContact O-CB 3.3Å; R141-A145 WeakPolarHBondContact O-CB 3.45Å; R141-A145 PolarHBondContact O-N 3.04Å; W142-A145 PolarHBondContact O-N 3.32Å; A145-A148 PolarHBondContact O-N 2.84Å; A145-G149 PolarHBondContact O-N 2.82Å
146T95.9Very high93.6Very high89 Ų8995.7 Ų95.755%0.54650%0.503SS..Hα-helixtrans-62.2-44.7173.2-55.50000111.2W142 G149 V150W142-T146 PolarHBondContact O-N 3.49Å; W142-T146 PolarHBondContact O-OG1 3.34Å; T146-G149 PolarHBondContact O-N 2.84Å; T146-V150 HydrophobicContact CG2-CG2 4.44Å; T146-V150 WeakPolarHBondContact O-CB 3.35Å; T146-V150 WeakPolarHBondContact O-CG2 3.29Å; T146-V150 PolarHBondContact O-N 3.2Å
147G95.1Very high93.5Very high42 Ų4295 Ų9543%0.43351%0.507SS..Hα-helixtrans-62.1-43.8177.300000113H143 L144 A151H143-G147 PolarHBondContact O-N 3.16Å; L144-G147 PolarHBondContact O-N 3.08Å; G147-A151 WeakPolarHBondContact O-CB 3.24Å; G147-A151 PolarHBondContact O-N 3.42Å
148A90.8Very high93.3Very high64 Ų6496.3 Ų96.353%0.52951%0.514SS..Hα-helixtrans-65.5-40.1174.300000112.3L144 A145 A151 L152L144-A148 WeakPolarHBondContact O-CB 3.19Å; L144-A148 PolarHBondContact O-N 2.99Å; A145-A148 PolarHBondContact O-N 2.84Å; A148-A151 PolarHBondContact O-N 2.9Å; A148-L152 WeakPolarHBondContact O-CB 3.25Å; A148-L152 PolarHBondContact O-N 3.09Å
149G95.3Very high93Very high31 Ų3192.8 Ų92.832%0.3250%0.499SS..Hα-helixtrans-63.5-44.2175.300000112.7A145 T146 L152 V153A145-G149 PolarHBondContact O-N 2.82Å; T146-G149 PolarHBondContact O-N 2.84Å; G149-L152 PolarHBondContact O-N 3.22Å; G149-V153 WeakPolarHBondContact O-CG2 3.39Å; G149-V153 PolarHBondContact O-N 3.45Å
150V96Very high92.8Very high83 Ų8389.8 Ų89.850%0.50350%0.495SS..Hα-helixtrans-63-42.8174.3169.40000111T146 L152 V153 I154T146-V150 HydrophobicContact CG2-CG2 4.44Å; T146-V150 WeakPolarHBondContact O-CB 3.35Å; T146-V150 WeakPolarHBondContact O-CG2 3.29Å; T146-V150 PolarHBondContact O-N 3.2Å; V150-L152 PolarHBondContact O-N 3.32Å; V150-V153 PolarHBondContact O-N 3.06Å; V150-I154 HydrophobicContact CG1-CD1 3.89Å; V150-I154 VanDerWaalsContact O-CG1 3.3Å; V150-I154 WeakPolarHBondContact O-CG1 3.43Å; V150-I154 PolarHBondContact O-N 2.97Å
151A91Very high92.4Very high51 Ų5188.6 Ų88.642%0.42150%0.503SS..Hα-helixtrans-61.8-42.1174.900000112.3G147 A148 I154 V155G147-A151 WeakPolarHBondContact O-CB 3.24Å; G147-A151 PolarHBondContact O-N 3.42Å; A148-A151 PolarHBondContact O-N 2.9Å; A151-I154 PolarHBondContact O-N 3.46Å; A151-V155 WeakPolarHBondContact O-CG2 3.45Å; A151-V155 PolarHBondContact O-N 3.34Å
152L91.1Very high92.2Very high124 Ų12485 Ų8565%0.64949%0.492SS*.Hα-helixtrans-64.7-40.5175.9-178.263.6000111.9A148 G149 V150 V155 A156A148-L152 WeakPolarHBondContact O-CB 3.25Å; A148-L152 PolarHBondContact O-N 3.09Å; G149-L152 PolarHBondContact O-N 3.22Å; V150-L152 PolarHBondContact O-N 3.32Å; L152-V155 PolarHBondContact O-N 2.89Å; L152-A156 WeakPolarHBondContact O-CB 3.27Å; L152-A156 PolarHBondContact O-N 2.71Å
153V94.3Very high92Very high84 Ų8480.9 Ų80.951%0.50948%0.483SS..Hα-helixtrans-64.1-40.7174.5168.10000111.3G149 V150 A156 L157G149-V153 WeakPolarHBondContact O-CG2 3.39Å; G149-V153 PolarHBondContact O-N 3.45Å; V150-V153 PolarHBondContact O-N 3.06Å; V153-A156 PolarHBondContact O-N 3.11Å; V153-L157 HydrophobicContact CG1-CD1 3.88Å; V153-L157 HydrophobicContact CG1-CG 4.34Å; V153-L157 WeakPolarHBondContact O-CB 3.48Å; V153-L157 VanDerWaalsContact O-CG 3.26Å; V153-L157 WeakPolarHBondContact O-CG 3.42Å; V153-L157 PolarHBondContact O-N 3.37Å
154I92.7Very high91.7Very high93 Ų9377.2 Ų77.248%0.47747%0.468SS..Hα-helixtrans-62.4-45.4174.9-69.3163.6000110.8V150 A151 L157 L158V150-I154 HydrophobicContact CG1-CD1 3.89Å; V150-I154 VanDerWaalsContact O-CG1 3.3Å; V150-I154 WeakPolarHBondContact O-CG1 3.43Å; V150-I154 PolarHBondContact O-N 2.97Å; A151-I154 PolarHBondContact O-N 3.46Å; I154-L157 PolarHBondContact O-N 3.47Å; I154-L158 HydrophobicContact CG2-CD1 4.13Å; I154-L158 WeakPolarHBondContact O-CG 3.39Å; I154-L158 PolarHBondContact O-N 2.91Å
155V88.4Confident91.6Very high74 Ų7479.6 Ų79.645%0.44848%0.477SS..Hα-helixtrans-63.6-41.7176.4172.30000111.4A151 L152 L158 L159A151-V155 WeakPolarHBondContact O-CG2 3.45Å; A151-V155 PolarHBondContact O-N 3.34Å; L152-V155 PolarHBondContact O-N 2.89Å; V155-L158 PolarHBondContact O-N 3.18Å; V155-L159 HydrophobicContact CG1-CD1 4.18Å; V155-L159 WeakPolarHBondContact O-CG 3.35Å; V155-L159 PolarHBondContact O-N 2.95Å
156A89.8Confident91.5Very high45 Ų4577 Ų7737%0.37246%0.456SS..Hα-helixtrans-62.8-44.4175.900000112L152 V153 L158 L159 L160L152-A156 WeakPolarHBondContact O-CB 3.27Å; L152-A156 PolarHBondContact O-N 2.71Å; V153-A156 PolarHBondContact O-N 3.11Å; A156-L158 VanDerWaalsContact C-N 3.34Å; A156-L158 PolarHBondContact O-N 3.13Å; A156-L159 PolarHBondContact O-N 3.44Å; A156-L160 VanDerWaalsContact O-CG 3.27Å; A156-L160 WeakPolarHBondContact O-CG 3.35Å; A156-L160 PolarHBondContact O-N 2.97Å
157L92.6Very high91Very high101 Ų10176.2 Ų76.253%0.52945%0.453SS..Hα-helixtrans-61.5-40.6175.7-73.4168.5000112.1V153 I154 L160 T161V153-L157 HydrophobicContact CG1-CD1 3.88Å; V153-L157 HydrophobicContact CG1-CG 4.34Å; V153-L157 WeakPolarHBondContact O-CB 3.48Å; V153-L157 VanDerWaalsContact O-CG 3.26Å; V153-L157 WeakPolarHBondContact O-CG 3.42Å; V153-L157 PolarHBondContact O-N 3.37Å; I154-L157 PolarHBondContact O-N 3.47Å; L157-L160 PolarHBondContact O-N 2.9Å; L157-T161 PolarHBondContact O-N 3.31Å; L157-T161 PolarHBondContact O-OG1 3.14Å
158L88.7Confident90.8Very high101 Ų10176.5 Ų76.553%0.52945%0.446SS..Hα-helixtrans-63.2-44.4174.7-71.9168.2000111.9I154 V155 A156 L160 T161 H162I154-L158 HydrophobicContact CG2-CD1 4.13Å; I154-L158 WeakPolarHBondContact O-CG 3.39Å; I154-L158 PolarHBondContact O-N 2.91Å; V155-L158 PolarHBondContact O-N 3.18Å; A156-L158 VanDerWaalsContact C-N 3.34Å; A156-L158 PolarHBondContact O-N 3.13Å; L158-L160 VanDerWaalsContact C-N 3.33Å; L158-L160 PolarHBondContact O-N 3.5Å; L158-T161 WeakPolarHBondContact CA-OG1 3.45Å; L158-T161 PolarHBondContact O-N 3.4Å; L158-T161 PolarHBondContact O-OG1 2.83Å; L158-H162 PolarHBondContact O-CD2 3.35Å; L158-H162 PolarHBondContact O-N 3.27Å
159L88.7Confident90.9Very high58 Ų5875.8 Ų75.830%0.30444%0.435SS..Hα-helixtrans-63.9-37.3175.4-68.7172.4000112V155 A156 T161 H162 L163 L174 V295V155-L159 HydrophobicContact CG1-CD1 4.18Å; V155-L159 WeakPolarHBondContact O-CG 3.35Å; V155-L159 PolarHBondContact O-N 2.95Å; A156-L159 PolarHBondContact O-N 3.44Å; L159-T161 VanDerWaalsContact C-N 3.32Å; L159-T161 PolarHBondContact O-N 3.29Å; L159-H162 CarbonylContact O-C 3.58Å; L159-H162 PolarHBondContact O-N 2.82Å; L159-L163 PolarHBondContact O-N 3.48Å; L159-L174 HydrophobicContact CD2-CD1 4.26Å; L159-L174 HydrophobicContact CD2-CD2 4.29Å; L159-V295 HydrophobicContact CD2-CG1 4.4Å; L159-V295 HydrophobicContact CD2-CG2 3.91Å
160L90.4Very high90.7Very high109 Ų10976.7 Ų76.757%0.57144%0.444SS*.Hα-helixtrans-64.1-33.2173.8-71.2170.7000112.6A156 L157 L158 H162 L163A156-L160 VanDerWaalsContact O-CG 3.27Å; A156-L160 WeakPolarHBondContact O-CG 3.35Å; A156-L160 PolarHBondContact O-N 2.97Å; L157-L160 PolarHBondContact O-N 2.9Å; L158-L160 VanDerWaalsContact C-N 3.33Å; L158-L160 PolarHBondContact O-N 3.5Å; L160-H162 PolarHBondContact O-N 3.08Å; L160-L163 HydrophobicContact CD2-CD1 3.76Å; L160-L163 PolarHBondContact O-N 2.89Å
161T89Confident90.6Very high107 Ų10775.3 Ų75.366%0.65643%0.43SS*.THydrogen-bonded Turntrans-74.3-6.1172.454.40000114.5L157 L158 L159L157-T161 PolarHBondContact O-N 3.31Å; L157-T161 PolarHBondContact O-OG1 3.14Å; L158-T161 WeakPolarHBondContact CA-OG1 3.45Å; L158-T161 PolarHBondContact O-N 3.4Å; L158-T161 PolarHBondContact O-OG1 2.83Å; L159-T161 VanDerWaalsContact C-N 3.32Å; L159-T161 PolarHBondContact O-N 3.29Å
162H89.1Confident90.6Very high78 Ų7877.1 Ų77.136%0.36144%0.436SS..THydrogen-bonded Turntrans-110.911175.6-83.4-79000113L158 L159 L160 L174 L175L158-H162 PolarHBondContact O-CD2 3.35Å; L158-H162 PolarHBondContact O-N 3.27Å; L159-H162 CarbonylContact O-C 3.58Å; L159-H162 PolarHBondContact O-N 2.82Å; L160-H162 PolarHBondContact O-N 3.08Å; H162-L174 HydrophobicContact CB-CD1 4.01Å; H162-L175 PolarHBondContact ND1-O 3.38Å; H162-L175 PolarHBondContact O-N 2.99Å
163L91.6Very high90.5Very high92 Ų9271.7 Ų71.748%0.48241%0.407SS..EExtended strand (participates in β ladder)trans-78.5136.1167.1-67.5-179.5000110.4L159 L160 R173 L174L159-L163 PolarHBondContact O-N 3.48Å; L160-L163 HydrophobicContact CD2-CD1 3.76Å; L160-L163 PolarHBondContact O-N 2.89Å; L163-R173 WeakPolarHBondContact CA-O 3.22Å; L163-L174 HydrophobicContact CD2-CB 4.28Å; L163-L174 HydrophobicContact CD2-CD1 4.03Å
164D89Confident90.2Very high63 Ų6368.9 Ų68.934%0.33739%0.389SS..EExtended strand (participates in β ladder)trans-130.7162179.3179.349.4000109.3T172 R173 L175D164-T172 CarbonylContact O-C 3.46Å; D164-T172 WeakPolarHBondContact O-CA 3.21Å; D164-R173 HydrophobicContact CB-CG 4.11Å; D164-R173 PolarHBondContact N-O 3.09Å; D164-R173 PolarHBondContact O-N 2.96Å; D164-R173 IonicContact OD2-CZ 3.68Å; D164-R173 IonicContact OD2-NE 3.75Å; D164-R173 PolarHBondContact OD2-NE 3Å; D164-R173 IonicContact OD2-NH2 3.69Å; D164-R173 PolarHBondContact OD2-NH2 3.5Å; D164-L175 HydrophobicContact CB-CD1 4.15Å; D164-L175 HydrophobicContact CB-CG 4.36Å; D164-L175 WeakPolarHBondContact OD2-CD1 3.38Å
165E90.9Very high90.1Very high126 Ų12665.6 Ų65.659%0.58937%0.372SS*.EExtended strand (participates in β ladder)trans-113.5126.4172.9-74-178.9177.200109.7T172E165-T172 HydrophobicContact CG-CG2 3.94Å
166S90.7Very high89.9Confident2 Ų264.5 Ų64.51%0.01437%0.366CS..  trans-55.4122.5174.1165.90000110.1V168 T169 G170 R171 L283S166-V168 VanDerWaalsContact C-N 3.26Å; S166-V168 PolarHBondContact O-N 3.19Å; S166-T169 WeakPolarHBondContact CB-OG1 3.42Å; S166-T169 PolarHBondContact O-N 3.41Å; S166-T169 PolarHBondContact OG-N 3.35Å; S166-T169 PolarHBondContact OG-OG1 3.05Å; S166-G170 WeakPolarHBondContact O-CA 3.39Å; S166-G170 PolarHBondContact O-N 3.04Å; S166-R171 PolarHBondContact N-O 3.16Å; S166-L283 WeakPolarHBondContact OG-CD2 3.48Å
167P86.3Confident89.4Confident73 Ų7365.3 Ų65.347%0.47436%0.361SS..THydrogen-bonded Turntrans-68.4-26.3-174.326.9-35.1000112.9E228P167-E228 VanDerWaalsContact CB-OE1 3.28Å; P167-E228 WeakPolarHBondContact CB-OE1 3.37Å; P167-E228 HydrophobicContact CG-CG 3.73Å; P167-E228 VanDerWaalsContact CG-OE1 3.28Å; P167-E228 WeakPolarHBondContact CG-OE1 3.37Å
168V90.3Very high88.8Confident47 Ų4762.9 Ų62.929%0.28535%0.352SS..THydrogen-bonded Turntrans-82.8-33.4-179.4-176.20000112.1S166 I226 E228 I282 L283 V347S166-V168 VanDerWaalsContact C-N 3.26Å; S166-V168 PolarHBondContact O-N 3.19Å; V168-I226 HydrophobicContact CG2-CG2 4.03Å; V168-E228 HydrophobicContact CG2-CB 4.48Å; V168-E228 HydrophobicContact CG2-CG 4.35Å; V168-I282 HydrophobicContact CG2-CD1 4.38Å; V168-L283 HydrophobicContact CB-CD2 3.9Å; V168-L283 HydrophobicContact CG1-CD2 4.46Å; V168-L283 HydrophobicContact CG2-CD2 4.35Å; V168-V347 HydrophobicContact CG1-CG1 4.1Å; V168-V347 HydrophobicContact CG1-CG2 4.17Å
169T92.6Very high88.4Confident50 Ų5063.5 Ų63.531%0.30735%0.347SS..THydrogen-bonded Turntrans-120.9-11.8-168.9610000115S166 R171 L283 E343 V347S166-T169 WeakPolarHBondContact CB-OG1 3.42Å; S166-T169 PolarHBondContact O-N 3.41Å; S166-T169 PolarHBondContact OG-N 3.35Å; S166-T169 PolarHBondContact OG-OG1 3.05Å; T169-R171 PolarHBondContact O-N 2.66Å; T169-L283 HydrophobicContact CG2-CD2 3.9Å; T169-E343 VanDerWaalsContact CB-OE1 3.23Å; T169-E343 WeakPolarHBondContact CB-OE1 3.43Å; T169-E343 HydrophobicContact CG2-CG 3.86Å; T169-E343 WeakPolarHBondContact CG2-OE1 3.39Å; T169-E343 PolarHBondContact OG1-OE1 3.37Å; T169-V347 HydrophobicContact CG2-CG2 3.58Å
170G91.8Very high88.2Confident50 Ų5068.3 Ų68.352%0.51537%0.368SS..  trans67.610.5-173.400000114.2S166S166-G170 WeakPolarHBondContact O-CA 3.39Å; S166-G170 PolarHBondContact O-N 3.04Å
171R92.9Very high87.9Confident53 Ų5369.3 Ų69.320%0.237%0.368CS..  trans-76.7129.9-179.7-175.3-178.658.980.1-9.7111S166 T169 R173 E288 L340 E343S166-R171 PolarHBondContact N-O 3.16Å; T169-R171 PolarHBondContact O-N 2.66Å; R171-R173 PolarHBondContact O-N 3.24Å; R171-E288 IonicContact CZ-OE1 2.69Å; R171-E288 IonicContact CZ-OE2 2.67Å; R171-E288 IonicContact NH1-OE1 2.76Å; R171-E288 PolarHBondContact NH1-OE1 3.39Å; R171-E288 IonicContact NH1-OE2 2.7Å; R171-E288 PolarHBondContact NH1-OE2 3.15Å; R171-E288 IonicContact NH2-OE1 3.55Å; R171-E288 IonicContact NH2-OE2 2.66Å; R171-E288 PolarHBondContact NH2-OE2 2.96Å; R171-L340 VanDerWaalsContact NH2-CD2 3.34Å; R171-E343 WeakPolarHBondContact CB-OE1 3.34Å; R171-E343 IonicContact CZ-OE2 2.96Å; R171-E343 IonicContact NE-OE1 3.87Å; R171-E343 PolarHBondContact NE-OE1 3.41Å; R171-E343 IonicContact NE-OE2 3.84Å; R171-E343 PolarHBondContact NE-OE2 3.42Å; R171-E343 IonicContact NH2-OE2 2.75Å; R171-E343 PolarHBondContact NH2-OE2 3.49Å
172T91.4Very high87.6Confident89 Ų8965.6 Ų65.655%0.54634%0.342SS..EExtended strand (participates in β ladder)trans-65.3130.4169.851.20000111.5D164 E165D164-T172 CarbonylContact O-C 3.46Å; D164-T172 WeakPolarHBondContact O-CA 3.21Å; E165-T172 HydrophobicContact CG-CG2 3.94Å
173R89.9Confident87.5Confident11 Ų1164.2 Ų64.24%0.04234%0.337CS..EExtended strand (participates in β ladder)trans-135.2161.4-178.255.1-176-172.9166.910.2110.6L163 D164 R171 L175 L283 D284 E288L163-R173 WeakPolarHBondContact CA-O 3.22Å; D164-R173 HydrophobicContact CB-CG 4.11Å; D164-R173 PolarHBondContact N-O 3.09Å; D164-R173 PolarHBondContact O-N 2.96Å; D164-R173 IonicContact OD2-CZ 3.68Å; D164-R173 IonicContact OD2-NE 3.75Å; D164-R173 PolarHBondContact OD2-NE 3Å; D164-R173 IonicContact OD2-NH2 3.69Å; D164-R173 PolarHBondContact OD2-NH2 3.5Å; R171-R173 PolarHBondContact O-N 3.24Å; R173-L175 HydrophobicContact CG-CG 4.43Å; R173-L283 VanDerWaalsContact NH1-C 3.29Å; R173-L283 PolarHBondContact NH1-O 3.23Å; R173-D284 IonicContact CZ-OD2 3.34Å; R173-D284 VanDerWaalsContact CZ-OD2 3.29Å; R173-D284 IonicContact NH1-OD2 2.89Å; R173-D284 PolarHBondContact NH1-OD2 2.89Å; R173-D284 IonicContact NH2-OD2 3.54Å; R173-D284 PolarHBondContact NH2-OD2 3.18Å; R173-E288 VanDerWaalsContact CB-CD 3.43Å; R173-E288 HydrophobicContact CB-CG 4.21Å; R173-E288 VanDerWaalsContact CB-OE1 3.24Å; R173-E288 WeakPolarHBondContact CB-OE1 3.04Å
174L88.4Confident87.3Confident25 Ų2565.7 Ų65.713%0.13134%0.341CS..EExtended strand (participates in β ladder)trans-109.1109.3178.5179.471.9000110L159 H162 L163 V176 S291 V295L159-L174 HydrophobicContact CD2-CD1 4.26Å; L159-L174 HydrophobicContact CD2-CD2 4.29Å; H162-L174 HydrophobicContact CB-CD1 4.01Å; L163-L174 HydrophobicContact CD2-CB 4.28Å; L163-L174 HydrophobicContact CD2-CD1 4.03Å; L174-V176 HydrophobicContact CG-CG2 4.29Å; L174-S291 WeakPolarHBondContact O-CB 3.28Å; L174-V295 HydrophobicContact CD2-CG2 4.2Å
175L88.7Confident87.2Confident24 Ų2465.8 Ų65.813%0.12634%0.341CS..  trans-113.596.4178.5-66.8-175.4000110.9H162 D164 R173 F177 A287 E288H162-L175 PolarHBondContact ND1-O 3.38Å; H162-L175 PolarHBondContact O-N 2.99Å; D164-L175 HydrophobicContact CB-CD1 4.15Å; D164-L175 HydrophobicContact CB-CG 4.36Å; D164-L175 WeakPolarHBondContact OD2-CD1 3.38Å; R173-L175 HydrophobicContact CG-CG 4.43Å; L175-F177 VanDerWaalsContact C-N 3.33Å; L175-A287 HydrophobicContact CD2-CB 4.2Å; L175-E288 HydrophobicContact CD2-CB 4.14Å
176V85.4Confident86.9Confident51 Ų5160 Ų6031%0.30932%0.315SS..  trans-76.4-27.2174179.20000110.7L174 S291 V295L174-V176 HydrophobicContact CG-CG2 4.29Å; V176-S291 PolarHBondContact N-OG 3.39Å; V176-V295 HydrophobicContact CG2-CG2 3.92Å
177F78.8Confident86.9Confident62 Ų6261.6 Ų61.627%0.27233%0.328SS..SBendtrans-91.4136.7173.2-65.6-73.6000111.7L175 A290 H294L175-F177 VanDerWaalsContact C-N 3.33Å; F177-A290 HydrophobicContact CD2-CB 4.49Å; F177-A290 HydrophobicContact CE2-CB 4.26Å; F177-H294 AromaticContact CZ-CE1 3.57Å; F177-H294 AromaticContact CZ-ND1 3.44Å; F177-H294 WeakPolarHBondContact CZ-ND1 3.37Å
178S81.1Confident87Confident49 Ų4961.6 Ų61.634%0.34332%0.324SS..  trans-71.4138.1166.455.50000110E180 K181 Y182S178-E180 PolarHBondContact O-N 3.05Å; S178-E180 VanDerWaalsContact O-N 3.13Å; S178-K181 PolarHBondContact O-N 3.39Å; S178-K181 WeakPolarHBondContact OG-CD 3.47Å; S178-Y182 PolarHBondContact O-N 3.25Å
179R80.3Confident86.8Confident114 Ų11461.6 Ų61.643%0.4332%0.324SS..Hα-helixtrans-46.8-45.7-177.7-164.3177-173.7-145.9-1.6111.9K181 Y182 M183 D284R179-K181 PolarHBondContact O-N 3.04Å; R179-Y182 CarbonylContact O-C 3.6Å; R179-Y182 WeakPolarHBondContact O-CA 3.46Å; R179-Y182 PolarHBondContact O-N 2.94Å; R179-M183 HydrophobicContact CG-CE 3.99Å; R179-M183 WeakPolarHBondContact O-CG 3.36Å; R179-M183 PolarHBondContact O-N 3.44Å; R179-D284 IonicContact NE-OD1 3.21Å
180E83.8Confident86.7Confident159 Ų15959.5 Ų59.574%0.74331%0.311SS*.Hα-helixtrans-47.6-51.4174.7-60.5171.4163.900114.1S178 Y182 M183 E184S178-E180 PolarHBondContact O-N 3.05Å; S178-E180 VanDerWaalsContact O-N 3.13Å; E180-Y182 VanDerWaalsContact C-N 3.29Å; E180-Y182 PolarHBondContact O-N 2.86Å; E180-M183 PolarHBondContact O-N 3.4Å; E180-E184 PolarHBondContact O-N 2.68Å
181K83.9Confident86.8Confident130 Ų13062.5 Ų62.557%0.56531%0.312SS*.Hα-helixtrans-71.8-27.1-178.7-68175.4-174.9166.30112.1S178 R179 L185S178-K181 PolarHBondContact O-N 3.39Å; S178-K181 WeakPolarHBondContact OG-CD 3.47Å; R179-K181 PolarHBondContact O-N 3.04Å; K181-L185 PolarHBondContact O-N 2.94Å; K181-L185 VanDerWaalsContact O-N 3.09Å
182Y82.9Confident86.6Confident30 Ų3062.5 Ų62.512%0.11832%0.323CS..Hα-helixtrans-76.5-31.9174.5-154.6-100.6000111.7S178 R179 E180 L185 A186 P250 S286 A287 A290S178-Y182 PolarHBondContact O-N 3.25Å; R179-Y182 CarbonylContact O-C 3.6Å; R179-Y182 WeakPolarHBondContact O-CA 3.46Å; R179-Y182 PolarHBondContact O-N 2.94Å; E180-Y182 VanDerWaalsContact C-N 3.29Å; E180-Y182 PolarHBondContact O-N 2.86Å; Y182-L185 HydrophobicContact CD2-CD2 4.26Å; Y182-L185 HydrophobicContact CE2-CD2 3.98Å; Y182-L185 PolarHBondContact O-N 3.48Å; Y182-A186 VanDerWaalsContact O-CB 3.32Å; Y182-A186 WeakPolarHBondContact O-CB 3.48Å; Y182-A186 PolarHBondContact O-N 2.8Å; Y182-P250 HydrophobicContact CD1-CG 4.06Å; Y182-P250 HydrophobicContact CE1-CG 3.75Å; Y182-S286 VanDerWaalsContact OH-CB 3.28Å; Y182-S286 WeakPolarHBondContact OH-CB 3.5Å; Y182-S286 PolarHBondContact OH-O 3.27Å; Y182-S286 VanDerWaalsContact OH-O 3.1Å; Y182-S286 PolarHBondContact OH-OG 3.46Å; Y182-A287 HydrophobicContact CD1-CB 3.46Å; Y182-A287 VanDerWaalsContact CD1-CB 3.46Å; Y182-A287 HydrophobicContact CD2-CB 3.92Å; Y182-A287 HydrophobicContact CE1-CB 3.62Å; Y182-A287 HydrophobicContact CE2-CB 4.09Å; Y182-A287 HydrophobicContact CG-CB 3.62Å; Y182-A290 HydrophobicContact CE2-CB 4.01Å
183M86.8Confident86.5Confident49 Ų4960.5 Ų60.524%0.24131%0.307CS..Hα-helixtrans-69.3-38.4169.7-61.7-60.3135.500112.1R179 E180 L185 A186 A187 P250R179-M183 HydrophobicContact CG-CE 3.99Å; R179-M183 WeakPolarHBondContact O-CG 3.36Å; R179-M183 PolarHBondContact O-N 3.44Å; E180-M183 PolarHBondContact O-N 3.4Å; M183-L185 VanDerWaalsContact C-N 3.33Å; M183-L185 PolarHBondContact O-N 3.3Å; M183-A186 PolarHBondContact O-N 2.82Å; M183-A187 WeakPolarHBondContact O-CB 3.4Å; M183-A187 PolarHBondContact O-N 2.9Å; M183-P250 HydrophobicContact CE-CB 3.48Å; M183-P250 VanDerWaalsContact CE-CB 3.48Å; M183-P250 HydrophobicContact SD-CB 3.96Å
184E88.1Confident86.7Confident123 Ų12362.2 Ų62.258%0.57532%0.317SS*.Hα-helixtrans-59.1-43.6170.8-174.3-175.8-174.700111.2E180 L188E180-E184 PolarHBondContact O-N 2.68Å; E184-L188 WeakPolarHBondContact O-CG 3.31Å; E184-L188 PolarHBondContact O-N 3.3Å
185L85.3Confident87.1Confident64 Ų6468.6 Ų68.634%0.33535%0.347SS..Hα-helixtrans-65.4-45174.3-178.160.1000112.2P97 K181 Y182 M183 A187 L188 T189P97-L185 HydrophobicContact CG-CD1 3.7Å; K181-L185 PolarHBondContact O-N 2.94Å; K181-L185 VanDerWaalsContact O-N 3.09Å; Y182-L185 HydrophobicContact CD2-CD2 4.26Å; Y182-L185 HydrophobicContact CE2-CD2 3.98Å; Y182-L185 PolarHBondContact O-N 3.48Å; M183-L185 VanDerWaalsContact C-N 3.33Å; M183-L185 PolarHBondContact O-N 3.3Å; L185-A187 VanDerWaalsContact C-N 3.29Å; L185-A187 PolarHBondContact O-N 2.91Å; L185-L188 PolarHBondContact O-N 2.9Å; L185-T189 WeakPolarHBondContact O-CB 3.25Å; L185-T189 PolarHBondContact O-N 3.06Å; L185-T189 PolarHBondContact O-OG1 3.12Å
186A86.5Confident87.3Confident5 Ų573.4 Ų73.44%0.04137%0.368CS..Hα-helixtrans-62.8-34178.700000112.5Y182 M183 S190 P250 N251Y182-A186 VanDerWaalsContact O-CB 3.32Å; Y182-A186 WeakPolarHBondContact O-CB 3.48Å; Y182-A186 PolarHBondContact O-N 2.8Å; M183-A186 PolarHBondContact O-N 2.82Å; A186-S190 VanDerWaalsContact O-CB 3.31Å; A186-S190 WeakPolarHBondContact O-CB 3.48Å; A186-S190 PolarHBondContact O-N 2.76Å; A186-S190 PolarHBondContact O-OG 2.58Å; A186-P250 HydrophobicContact CB-CB 4.39Å; A186-P250 HydrophobicContact CB-CG 4.26Å; A186-N251 HydrophobicContact CB-CB 4.4Å; A186-N251 PolarHBondContact O-ND2 3.47Å
187A90.6Very high87.8Confident36 Ų3672.2 Ų72.230%0.29836%0.359SS..Hα-helixtrans-60.6-55.2171.600000111.1M183 L185 T189 S190 E191M183-A187 WeakPolarHBondContact O-CB 3.4Å; M183-A187 PolarHBondContact O-N 2.9Å; L185-A187 VanDerWaalsContact C-N 3.29Å; L185-A187 PolarHBondContact O-N 2.91Å; A187-T189 VanDerWaalsContact C-N 3.33Å; A187-T189 PolarHBondContact O-N 3.36Å; A187-S190 PolarHBondContact O-N 2.93Å; A187-S190 PolarHBondContact O-OG 3.25Å; A187-E191 WeakPolarHBondContact O-CG 3.08Å; A187-E191 PolarHBondContact O-N 3.46Å
188L88.6Confident88.6Confident72 Ų7272 Ų7238%0.37737%0.369SS..Hα-helixtrans-59.5-40.2178.4-65.9170.9000112.6E184 L185 E191 A192E184-L188 WeakPolarHBondContact O-CG 3.31Å; E184-L188 PolarHBondContact O-N 3.3Å; L185-L188 PolarHBondContact O-N 2.9Å; L188-E191 PolarHBondContact O-N 2.84Å; L188-A192 WeakPolarHBondContact O-CB 3.2Å; L188-A192 PolarHBondContact O-N 3.37Å
189T85.3Confident89.4Confident47 Ų4779 Ų7929%0.28840%0.396SS..Hα-helixtrans-65.9-37.9174.3-67.50000111.8L185 A187 A192 H193 L249L185-T189 WeakPolarHBondContact O-CB 3.25Å; L185-T189 PolarHBondContact O-N 3.06Å; L185-T189 PolarHBondContact O-OG1 3.12Å; A187-T189 VanDerWaalsContact C-N 3.33Å; A187-T189 PolarHBondContact O-N 3.36Å; T189-A192 PolarHBondContact O-N 3.33Å; T189-H193 PolarHBondContact O-CD2 2.9Å; T189-H193 PolarHBondContact O-N 3.24Å; T189-L249 HydrophobicContact CG2-CD1 4.22Å; T189-L249 HydrophobicContact CG2-CD2 4.14Å
190S90.3Very high90.2Very high6 Ų677.3 Ų77.34%0.04240%0.395CS..Hα-helixtrans-69.9-35.1176.170.50000113.2A186 A187 L194 N251A186-S190 VanDerWaalsContact O-CB 3.31Å; A186-S190 WeakPolarHBondContact O-CB 3.48Å; A186-S190 PolarHBondContact O-N 2.76Å; A186-S190 PolarHBondContact O-OG 2.58Å; A187-S190 PolarHBondContact O-N 2.93Å; A187-S190 PolarHBondContact O-OG 3.25Å; S190-L194 WeakPolarHBondContact O-CB 3.39Å; S190-L194 WeakPolarHBondContact O-CG 3.37Å; S190-L194 PolarHBondContact O-N 3.28Å; S190-N251 PolarHBondContact OG-ND2 2.52Å
191E93.4Very high90.8Very high114 Ų11472.4 Ų72.453%0.53337%0.374SS..Hα-helixtrans-63.9-47.1172.4-70.8172.3166.700110.2A187 L188 H193 L194 E195A187-E191 WeakPolarHBondContact O-CG 3.08Å; A187-E191 PolarHBondContact O-N 3.46Å; L188-E191 PolarHBondContact O-N 2.84Å; E191-H193 PolarHBondContact O-N 2.81Å; E191-L194 PolarHBondContact O-N 3.17Å; E191-L194 VanDerWaalsContact O-N 3.13Å; E191-E195 PolarHBondContact O-N 3.45Å
192A89.7Confident91.5Very high52 Ų5267.1 Ų67.143%0.4335%0.352SS..Hα-helixtrans-59.6-42.9177.700000113.4L188 T189 L194 E195 E196L188-A192 WeakPolarHBondContact O-CB 3.2Å; L188-A192 PolarHBondContact O-N 3.37Å; T189-A192 PolarHBondContact O-N 3.33Å; A192-L194 VanDerWaalsContact C-N 3.35Å; A192-E195 PolarHBondContact O-N 2.96Å; A192-E196 VanDerWaalsContact O-CB 3.31Å; A192-E196 WeakPolarHBondContact O-CB 3.3Å; A192-E196 PolarHBondContact O-N 2.81Å
193H88.7Confident92.2Very high47 Ų4769.2 Ų69.222%0.21837%0.369CS..Hα-helixtrans-70.9-28.4175.8-71.4-51.9000113.3T189 E191 E196 F197 F255T189-H193 PolarHBondContact O-CD2 2.9Å; T189-H193 PolarHBondContact O-N 3.24Å; E191-H193 PolarHBondContact O-N 2.81Å; H193-E196 IonicContact CE1-OE2 3.52Å; H193-E196 IonicContact CG-OE2 3.65Å; H193-E196 IonicContact ND1-OE2 2.66Å; H193-E196 PolarHBondContact ND1-OE2 3.29Å; H193-F197 HydrophobicContact CB-CD2 4.17Å; H193-F197 HydrophobicContact CB-CE2 4.02Å; H193-F197 AromaticContact ND1-CE2 3.89Å; H193-F197 WeakPolarHBondContact O-CB 3.13Å; H193-F197 WeakPolarHBondContact O-CD2 3.24Å; H193-F197 PolarHBondContact O-N 3.39Å; H193-F255 HydrophobicContact CB-CE1 3.89Å; H193-F255 HydrophobicContact CB-CE2 4.31Å; H193-F255 HydrophobicContact CB-CZ 3.66Å
194L95.3Very high92.6Very high48 Ų4869.8 Ų69.825%0.25138%0.381SS..Hα-helixtrans-71.3-33.1172.9-75.5172.9000112.2S190 E191 A192 A198 L201 F255S190-L194 WeakPolarHBondContact O-CB 3.39Å; S190-L194 WeakPolarHBondContact O-CG 3.37Å; S190-L194 PolarHBondContact O-N 3.28Å; E191-L194 PolarHBondContact O-N 3.17Å; E191-L194 VanDerWaalsContact O-N 3.13Å; A192-L194 VanDerWaalsContact C-N 3.35Å; L194-A198 WeakPolarHBondContact O-CA 3.48Å; L194-A198 WeakPolarHBondContact O-CB 3.4Å; L194-A198 PolarHBondContact O-N 2.92Å; L194-L201 HydrophobicContact CD2-CD1 3.96Å; L194-F255 HydrophobicContact CD2-CE1 4.19Å; L194-F255 HydrophobicContact CD2-CZ 4.24Å; L194-F255 HydrophobicContact CG-CZ 4.2Å
195E95.8Very high93Very high159 Ų15969.4 Ų69.474%0.74339%0.388SS*.Hα-helixtrans-70.7-45169.6-68.9-177.5167.100111.6E191 A192 A198E191-E195 PolarHBondContact O-N 3.45Å; A192-E195 PolarHBondContact O-N 2.96Å; E195-A198 WeakPolarHBondContact O-CB 3.45Å; E195-A198 PolarHBondContact O-N 3.38Å
196E93.3Very high93.7Very high124 Ų12468.5 Ų68.558%0.57938%0.383SS*.Hα-helixtrans-59.5-45.9179.8-179.6178.1-15200113A192 H193A192-E196 VanDerWaalsContact O-CB 3.31Å; A192-E196 WeakPolarHBondContact O-CB 3.3Å; A192-E196 PolarHBondContact O-N 2.81Å; H193-E196 IonicContact CE1-OE2 3.52Å; H193-E196 IonicContact CG-OE2 3.65Å; H193-E196 IonicContact ND1-OE2 2.66Å; H193-E196 PolarHBondContact ND1-OE2 3.29Å
197F95.8Very high94.2Very high26 Ų2672.4 Ų72.411%0.11441%0.408CS..THydrogen-bonded Turntrans-94.36.6-177.7-55.9-50.9000113.8H193 E199 L200 L201 V239 F247 F255 F257H193-F197 HydrophobicContact CB-CD2 4.17Å; H193-F197 HydrophobicContact CB-CE2 4.02Å; H193-F197 AromaticContact ND1-CE2 3.89Å; H193-F197 WeakPolarHBondContact O-CB 3.13Å; H193-F197 WeakPolarHBondContact O-CD2 3.24Å; H193-F197 PolarHBondContact O-N 3.39Å; F197-E199 VanDerWaalsContact C-N 3.29Å; F197-E199 PolarHBondContact O-N 3.31Å; F197-E199 VanDerWaalsContact O-N 3.1Å; F197-L200 CarbonylContact O-C 3.59Å; F197-L200 WeakPolarHBondContact O-CA 3.27Å; F197-L200 PolarHBondContact O-N 3.2Å; F197-L201 HydrophobicContact CB-CD2 4.33Å; F197-L201 HydrophobicContact CB-CG 4.47Å; F197-L201 WeakPolarHBondContact O-CG 3.19Å; F197-L201 PolarHBondContact O-N 3.06Å; F197-L201 VanDerWaalsContact O-N 3.15Å; F197-V239 HydrophobicContact CB-CG1 4.27Å; F197-V239 HydrophobicContact CB-CG2 4.12Å; F197-V239 HydrophobicContact CD1-CG1 4.02Å; F197-V239 HydrophobicContact CD2-CG2 4.08Å; F197-V239 HydrophobicContact CG-CG1 4.14Å; F197-V239 HydrophobicContact CG-CG2 4.02Å; F197-F247 HydrophobicContact CE2-CE1 4.43Å; F197-F247 HydrophobicContact CE2-CZ 4.25Å; F197-F255 HydrophobicContact CD2-CD1 4Å; F197-F255 HydrophobicContact CD2-CE1 4.04Å; F197-F255 HydrophobicContact CE2-CD1 4.37Å; F197-F257 HydrophobicContact CE1-CE1 4.48Å; F197-F257 HydrophobicContact CE1-CZ 4.29Å; F197-F257 HydrophobicContact CE2-CZ 4.27Å; F197-F257 AromaticContact CZ-CZ 3.91Å; F197-F257 HydrophobicContact CZ-CZ 3.91Å
198A95.9Very high94.5Very high59 Ų5973.6 Ų73.649%0.48841%0.409SS..G310 helixtrans-50.9-41.3-169.500000114.7L194 E195 L200L194-A198 WeakPolarHBondContact O-CA 3.48Å; L194-A198 WeakPolarHBondContact O-CB 3.4Å; L194-A198 PolarHBondContact O-N 2.92Å; E195-A198 WeakPolarHBondContact O-CB 3.45Å; E195-A198 PolarHBondContact O-N 3.38Å; A198-L200 VanDerWaalsContact C-N 3.32Å
199E96.6Very high95Very high196 Ų19671 Ų7192%0.91640%0.395SS*.G310 helixtrans-79.4-11.7179.5-59.9-169.8160.600113.9F197F197-E199 VanDerWaalsContact C-N 3.29Å; F197-E199 PolarHBondContact O-N 3.31Å; F197-E199 VanDerWaalsContact O-N 3.1Å
200L97.3Very high95.6Very high78 Ų7872.5 Ų72.541%0.40840%0.399SS..G310 helixtrans-108.7-2.1-177.2-57.5179.4000113.3F197 A198 L202 V239 E240F197-L200 CarbonylContact O-C 3.59Å; F197-L200 WeakPolarHBondContact O-CA 3.27Å; F197-L200 PolarHBondContact O-N 3.2Å; A198-L200 VanDerWaalsContact C-N 3.32Å; L200-L202 PolarHBondContact O-N 3.43Å; L200-V239 HydrophobicContact CB-CG1 3.92Å; L200-V239 HydrophobicContact CD1-CG1 4.29Å; L200-E240 PolarHBondContact O-N 2.82Å
201L97.8Very high95.9Very high55 Ų5576.5 Ų76.529%0.28842%0.418SS..BIsolated β-bridgetrans-74118.2-178.9-71.8178.7000111.7L194 F197 H237 V238 V239L194-L201 HydrophobicContact CD2-CD1 3.96Å; F197-L201 HydrophobicContact CB-CD2 4.33Å; F197-L201 HydrophobicContact CB-CG 4.47Å; F197-L201 WeakPolarHBondContact O-CG 3.19Å; F197-L201 PolarHBondContact O-N 3.06Å; F197-L201 VanDerWaalsContact O-N 3.15Å; L201-H237 HydrophobicContact CD2-CB 3.95Å; L201-V238 WeakPolarHBondContact CA-O 3.36Å; L201-V239 HydrophobicContact CD2-CG2 4.12Å
202L97.8Very high96.2Very high20 Ų2071 Ų7111%0.10539%0.392CS..PPolyproline II helixtrans-66.4133.8171.6-64.8-174.3000110.4L200 D206 L208 H209 V238 E240 T258L200-L202 PolarHBondContact O-N 3.43Å; L202-D206 HydrophobicContact CB-CB 4.27Å; L202-L208 HydrophobicContact CD1-CB 4.25Å; L202-L208 HydrophobicContact CD1-CD1 4.15Å; L202-H209 PolarHBondContact O-ND1 3.37Å; L202-V238 HydrophobicContact CB-CB 4.32Å; L202-V238 HydrophobicContact CD1-CB 4.44Å; L202-V238 HydrophobicContact CD1-CG1 3.8Å; L202-V238 HydrophobicContact CG-CG1 4.34Å; L202-V238 PolarHBondContact N-O 2.86Å; L202-E240 HydrophobicContact CD2-CB 4Å; L202-E240 HydrophobicContact CG-CB 4.38Å; L202-T258 HydrophobicContact CD1-CG2 3.84Å
203P97.3Very high96.6Very high74 Ų7472 Ų7248%0.48139%0.388SS..PPolyproline II helixtrans-66.3154-178.229-35.9000111.5T205 D206 H209P203-T205 PolarHBondContact O-N 3.45Å; P203-D206 HydrophobicContact CG-CB 4.36Å; P203-D206 VanDerWaalsContact O-CB 3.27Å; P203-D206 WeakPolarHBondContact O-CB 3.27Å; P203-D206 PolarHBondContact O-N 3.1Å; P203-H209 WeakPolarHBondContact O-CB 3.45Å
204A95.8Very high97Very high60 Ų6075.8 Ų75.850%0.49641%0.406SS..THydrogen-bonded Turntrans-62.8-7.617800000114.6Q210A204-Q210 WeakPolarHBondContact O-CG 3.35Å; A204-Q210 PolarHBondContact O-NE2 2.87Å
205T97.2Very high97.2Very high116 Ų11673.6 Ų73.671%0.71240%0.395SS*.THydrogen-bonded Turntrans-86.3-8.6170.750.60000113.8P203P203-T205 PolarHBondContact O-N 3.45Å
206D98.3Very high97.3Very high44 Ų4466.2 Ų66.224%0.23536%0.36CS..SBendtrans-76.6136.8178.8-171.1-83.9000111.4L202 P203 L208 H209 Q210L202-D206 HydrophobicContact CB-CB 4.27Å; P203-D206 HydrophobicContact CG-CB 4.36Å; P203-D206 VanDerWaalsContact O-CB 3.27Å; P203-D206 WeakPolarHBondContact O-CB 3.27Å; P203-D206 PolarHBondContact O-N 3.1Å; D206-L208 VanDerWaalsContact C-N 3.25Å; D206-L208 PolarHBondContact O-N 3.12Å; D206-L208 VanDerWaalsContact OD1-CB 3.26Å; D206-L208 WeakPolarHBondContact OD1-CB 3.46Å; D206-L208 PolarHBondContact OD1-N 2.95Å; D206-H209 HydrophobicContact CB-CB 4.24Å; D206-H209 WeakPolarHBondContact O-CB 3.42Å; D206-H209 PolarHBondContact O-N 3.5Å; D206-H209 VanDerWaalsContact O-N 3.11Å; D206-Q210 WeakPolarHBondContact O-CG 3.2Å; D206-Q210 PolarHBondContact O-N 3.42Å
207P97.6Very high97.5Very high87 Ų8764.3 Ų64.357%0.56535%0.352SS*.Hα-helixtrans-61.4-27.7-179.324.6-36000114.2M211P207-M211 WeakPolarHBondContact O-CB 3.24Å; P207-M211 PolarHBondContact O-N 2.96Å
208L97.3Very high97.7Very high62 Ų6266 Ų6633%0.32536%0.361SS..Hα-helixtrans-71.8-41.7174.2-60.3-179.8000110.9L202 D206 M211 V212 T258 L261L202-L208 HydrophobicContact CD1-CB 4.25Å; L202-L208 HydrophobicContact CD1-CD1 4.15Å; D206-L208 VanDerWaalsContact C-N 3.25Å; D206-L208 PolarHBondContact O-N 3.12Å; D206-L208 VanDerWaalsContact OD1-CB 3.26Å; D206-L208 WeakPolarHBondContact OD1-CB 3.46Å; D206-L208 PolarHBondContact OD1-N 2.95Å; L208-M211 PolarHBondContact O-N 3.02Å; L208-V212 WeakPolarHBondContact O-CG2 3.43Å; L208-V212 PolarHBondContact O-N 3.48Å; L208-V212 VanDerWaalsContact O-N 3.12Å; L208-T258 HydrophobicContact CD1-CG2 4.11Å; L208-L261 HydrophobicContact CB-CD1 3.97Å; L208-L261 HydrophobicContact CD1-CD1 4.4Å; L208-L261 HydrophobicContact CD2-CD1 4.41Å; L208-L261 HydrophobicContact CG-CD1 4.5Å
209H98.4Very high97.8Very high18 Ų1863.2 Ų63.28%0.08334%0.338CS..Hα-helixtrans-59.4-49.1174-164.5125.5000110.5L202 P203 D206 M211 V212 E213 V236 V238L202-H209 PolarHBondContact O-ND1 3.37Å; P203-H209 WeakPolarHBondContact O-CB 3.45Å; D206-H209 HydrophobicContact CB-CB 4.24Å; D206-H209 WeakPolarHBondContact O-CB 3.42Å; D206-H209 PolarHBondContact O-N 3.5Å; D206-H209 VanDerWaalsContact O-N 3.11Å; H209-M211 VanDerWaalsContact C-N 3.35Å; H209-M211 PolarHBondContact O-N 3.33Å; H209-V212 PolarHBondContact O-N 2.94Å; H209-E213 WeakPolarHBondContact O-CB 3.49Å; H209-E213 PolarHBondContact O-N 3.3Å; H209-V236 PolarHBondContact CE1-O 3.47Å; H209-V236 PolarHBondContact NE2-O 3.16Å; H209-V238 HydrophobicContact CB-CG2 4.32Å
210Q98.2Very high97.8Very high78 Ų7854.7 Ų54.736%0.36430%0.302SS..Hα-helixtrans-64.2-36.2-179.8-68.31781.700113A204 D206 Q214A204-Q210 WeakPolarHBondContact O-CG 3.35Å; A204-Q210 PolarHBondContact O-NE2 2.87Å; D206-Q210 WeakPolarHBondContact O-CG 3.2Å; D206-Q210 PolarHBondContact O-N 3.42Å; Q210-Q214 VanDerWaalsContact O-CB 3.32Å; Q210-Q214 WeakPolarHBondContact O-CB 3.34Å; Q210-Q214 WeakPolarHBondContact O-CG 3.28Å; Q210-Q214 PolarHBondContact O-N 3.39Å
211M97.8Very high97.9Very high89 Ų8956.8 Ų56.844%0.43831%0.309SS..Hα-helixtrans-63.8-46.5175.4-174.1-172.7-56.900111.8P207 L208 H209 Q214 A215 L270P207-M211 WeakPolarHBondContact O-CB 3.24Å; P207-M211 PolarHBondContact O-N 2.96Å; L208-M211 PolarHBondContact O-N 3.02Å; H209-M211 VanDerWaalsContact C-N 3.35Å; H209-M211 PolarHBondContact O-N 3.33Å; M211-Q214 PolarHBondContact O-N 3.01Å; M211-A215 WeakPolarHBondContact O-CB 3.31Å; M211-A215 PolarHBondContact O-N 2.91Å; M211-L270 HydrophobicContact CG-CD2 4.15Å; M211-L270 HydrophobicContact SD-CD2 4.14Å
212V98.3Very high97.9Very high0 Ų059.5 Ų59.50%032%0.316CS..Hα-helixtrans-70.1-38.9179.9-179.80000111.1L208 H209 A215 V216 V236 V238 M256 L261 L270 L274L208-V212 WeakPolarHBondContact O-CG2 3.43Å; L208-V212 PolarHBondContact O-N 3.48Å; L208-V212 VanDerWaalsContact O-N 3.12Å; H209-V212 PolarHBondContact O-N 2.94Å; V212-A215 PolarHBondContact O-N 2.97Å; V212-V216 HydrophobicContact CG1-CG2 4.44Å; V212-V216 WeakPolarHBondContact O-CG2 3.43Å; V212-V216 PolarHBondContact O-N 3.23Å; V212-V236 HydrophobicContact CB-CG1 4.07Å; V212-V236 HydrophobicContact CG1-CG1 3.76Å; V212-V236 HydrophobicContact CG1-CG2 4.21Å; V212-V238 HydrophobicContact CB-CG2 4.16Å; V212-V238 HydrophobicContact CG2-CG2 4.19Å; V212-M256 HydrophobicContact CG1-CB 4.1Å; V212-M256 HydrophobicContact CG1-CG 4.17Å; V212-M256 HydrophobicContact CG2-CG 3.89Å; V212-L261 HydrophobicContact CG2-CD1 4.01Å; V212-L261 HydrophobicContact CG2-CD2 3.69Å; V212-L261 HydrophobicContact CG2-CG 4.47Å; V212-L270 HydrophobicContact CG2-CD2 4.37Å; V212-L274 HydrophobicContact CG1-CD1 4.26Å; V212-L274 HydrophobicContact CG1-CD2 4.24Å
213E98.3Very high97.9Very high71 Ų7158.6 Ų58.633%0.33231%0.311SS..Hα-helixtrans-61-48173.7-168.4-174.9-166.900111.7H209 A215 V216 Q217 V236H209-E213 WeakPolarHBondContact O-CB 3.49Å; H209-E213 PolarHBondContact O-N 3.3Å; E213-A215 VanDerWaalsContact C-N 3.3Å; E213-A215 PolarHBondContact O-N 3.12Å; E213-V216 PolarHBondContact O-N 3.41Å; E213-Q217 HydrophobicContact CG-CG 4.27Å; E213-Q217 WeakPolarHBondContact O-CB 3.36Å; E213-Q217 VanDerWaalsContact O-CG 3.26Å; E213-Q217 WeakPolarHBondContact O-CG 3.48Å; E213-Q217 PolarHBondContact O-N 2.82Å; E213-Q217 PolarHBondContact OE1-NE2 2.9Å; E213-V236 HydrophobicContact CB-CB 4.41Å; E213-V236 HydrophobicContact CB-CG2 4.42Å
214Q98.2Very high97.8Very high127 Ų12762.5 Ų62.559%0.59332%0.32SS*.Hα-helixtrans-61.5-37.7177-73168.130.400112.3Q210 M211 L218Q210-Q214 VanDerWaalsContact O-CB 3.32Å; Q210-Q214 WeakPolarHBondContact O-CB 3.34Å; Q210-Q214 WeakPolarHBondContact O-CG 3.28Å; Q210-Q214 PolarHBondContact O-N 3.39Å; M211-Q214 PolarHBondContact O-N 3.01Å; Q214-L218 VanDerWaalsContact O-CB 3.25Å; Q214-L218 WeakPolarHBondContact O-CB 3.33Å; Q214-L218 PolarHBondContact O-N 2.93Å
215A98.4Very high97.8Very high3 Ų364.9 Ų64.93%0.02533%0.325CS..Hα-helixtrans-64.4-49.1175.700000112.2M211 V212 E213 L218 L219 L267 L270 M271 L274M211-A215 WeakPolarHBondContact O-CB 3.31Å; M211-A215 PolarHBondContact O-N 2.91Å; V212-A215 PolarHBondContact O-N 2.97Å; E213-A215 VanDerWaalsContact C-N 3.3Å; E213-A215 PolarHBondContact O-N 3.12Å; A215-L218 PolarHBondContact O-N 3.47Å; A215-L219 WeakPolarHBondContact O-CG 3.37Å; A215-L219 PolarHBondContact O-N 2.81Å; A215-L267 HydrophobicContact CB-CD1 4.24Å; A215-L270 HydrophobicContact CB-CD2 4.43Å; A215-M271 HydrophobicContact CB-SD 3.61Å; A215-L274 HydrophobicContact CB-CD1 3.53Å
216V98.5Very high97.8Very high3 Ų360.8 Ų60.82%0.01830%0.298CS..Hα-helixtrans-63.5-43.3176.5173.60000111.4V212 E213 L218 L219 A220 W234 V236 V254 L274V212-V216 HydrophobicContact CG1-CG2 4.44Å; V212-V216 WeakPolarHBondContact O-CG2 3.43Å; V212-V216 PolarHBondContact O-N 3.23Å; E213-V216 PolarHBondContact O-N 3.41Å; V216-L218 VanDerWaalsContact C-N 3.35Å; V216-L218 PolarHBondContact O-N 3.38Å; V216-L219 PolarHBondContact O-N 2.42Å; V216-A220 WeakPolarHBondContact O-CB 3.21Å; V216-A220 PolarHBondContact O-N 2.93Å; V216-W234 HydrophobicContact CG1-CB 3.9Å; V216-W234 HydrophobicContact CG1-CG 4.31Å; V216-V236 HydrophobicContact CB-CG2 4Å; V216-V236 HydrophobicContact CG1-CG2 4.37Å; V216-V236 HydrophobicContact CG2-CG2 3.76Å; V216-V254 HydrophobicContact CG1-CG2 4.16Å; V216-V254 HydrophobicContact CG2-CG1 4.2Å; V216-V254 HydrophobicContact CG2-CG2 4.17Å; V216-L274 HydrophobicContact CG2-CD1 3.99Å; V216-L274 HydrophobicContact CG2-CD2 3.93Å; V216-L274 HydrophobicContact CG2-CG 4.46Å
217Q98.1Very high97.6Very high85 Ų8561.6 Ų61.640%0.39731%0.306SS..Hα-helixtrans-61.7-41.4175.8-73.8-176.716.300111.6E213 A220 Q221E213-Q217 HydrophobicContact CG-CG 4.27Å; E213-Q217 WeakPolarHBondContact O-CB 3.36Å; E213-Q217 VanDerWaalsContact O-CG 3.26Å; E213-Q217 WeakPolarHBondContact O-CG 3.48Å; E213-Q217 PolarHBondContact O-N 2.82Å; E213-Q217 PolarHBondContact OE1-NE2 2.9Å; Q217-A220 PolarHBondContact O-N 2.72Å; Q217-Q221 VanDerWaalsContact O-CB 3.28Å; Q217-Q221 WeakPolarHBondContact O-CB 3.42Å; Q217-Q221 WeakPolarHBondContact O-CG 3.15Å; Q217-Q221 PolarHBondContact O-N 2.41Å
218L98.1Very high97.4Very high61 Ų6158.8 Ų58.832%0.31929%0.285SS..Hα-helixtrans-65.8-44.4176.7-18060.7000111.6Q214 A215 V216 R222 M271 A355Q214-L218 VanDerWaalsContact O-CB 3.25Å; Q214-L218 WeakPolarHBondContact O-CB 3.33Å; Q214-L218 PolarHBondContact O-N 2.93Å; A215-L218 PolarHBondContact O-N 3.47Å; V216-L218 VanDerWaalsContact C-N 3.35Å; V216-L218 PolarHBondContact O-N 3.38Å; L218-R222 HydrophobicContact CD1-CG 3.73Å; L218-R222 HydrophobicContact CG-CG 4.42Å; L218-R222 WeakPolarHBondContact O-CB 3.38Å; L218-R222 WeakPolarHBondContact O-CG 3.23Å; L218-R222 PolarHBondContact O-N 2.59Å; L218-M271 HydrophobicContact CB-CE 4.25Å; L218-M271 HydrophobicContact CD2-CE 3.71Å; L218-M271 HydrophobicContact CG-CE 3.92Å; L218-A355 HydrophobicContact CG-CB 4.47Å
219L98.4Very high97.4Very high0 Ų055.9 Ų55.90%027%0.27CS..Hα-helixtrans-56.1-51.3173.4-78.1161.5000111.1A215 V216 R222 N223 M271 L274 M278 L351 A355A215-L219 WeakPolarHBondContact O-CG 3.37Å; A215-L219 PolarHBondContact O-N 2.81Å; V216-L219 PolarHBondContact O-N 2.42Å; L219-R222 PolarHBondContact O-N 3.43Å; L219-N223 WeakPolarHBondContact O-CB 3.36Å; L219-N223 PolarHBondContact O-N 3.42Å; L219-N223 VanDerWaalsContact O-N 3.16Å; L219-N223 PolarHBondContact O-ND2 3.16Å; L219-M271 HydrophobicContact CD1-CE 4.47Å; L219-M271 HydrophobicContact CD1-SD 4.1Å; L219-M271 HydrophobicContact CD2-CE 4Å; L219-M271 HydrophobicContact CG-CE 3.72Å; L219-M271 HydrophobicContact CG-SD 3.96Å; L219-L274 HydrophobicContact CD1-CB 3.52Å; L219-L274 HydrophobicContact CD1-CD1 4.5Å; L219-M278 HydrophobicContact CB-CE 4.06Å; L219-M278 HydrophobicContact CB-SD 3.67Å; L219-M278 HydrophobicContact CD1-SD 3.73Å; L219-M278 HydrophobicContact CG-SD 4.26Å; L219-L351 HydrophobicContact CD2-CB 4.24Å; L219-A355 HydrophobicContact CD2-CB 3.78Å; L219-A355 HydrophobicContact CG-CB 4.31Å
220A98.1Very high97.2Very high18 Ų1858.3 Ų58.315%0.14929%0.289CS..Hα-helixtrans-63.5-48.8-179.800000112.5V216 Q217 R222 N223 K224 V229 W234 M278V216-A220 WeakPolarHBondContact O-CB 3.21Å; V216-A220 PolarHBondContact O-N 2.93Å; Q217-A220 PolarHBondContact O-N 2.72Å; A220-R222 VanDerWaalsContact C-N 3.29Å; A220-R222 PolarHBondContact O-N 2.9Å; A220-N223 CarbonylContact O-C 3.6Å; A220-N223 PolarHBondContact O-N 2.93Å; A220-K224 PolarHBondContact O-N 2.92Å; A220-K224 VanDerWaalsContact O-N 3.08Å; A220-V229 HydrophobicContact CB-CG1 4.33Å; A220-W234 HydrophobicContact CB-CG 4.3Å; A220-M278 HydrophobicContact CB-CE 4.46Å
221Q97.6Very high97Very high122 Ų12260.9 Ų60.957%0.5730%0.301SS*.Hα-helixtrans-62.1-35.1-179.3-73.2172.935.800113.2Q217 K224Q217-Q221 VanDerWaalsContact O-CB 3.28Å; Q217-Q221 WeakPolarHBondContact O-CB 3.42Å; Q217-Q221 WeakPolarHBondContact O-CG 3.15Å; Q217-Q221 PolarHBondContact O-N 2.41Å; Q221-K224 WeakPolarHBondContact O-CD 3.45Å; Q221-K224 WeakPolarHBondContact O-CG 3.31Å
222R97.8Very high96.7Very high112 Ų11257.5 Ų57.542%0.42329%0.286SS..Hα-helixtrans-83.6-11.1-179.7-70.9-81.1-173.3156-0.6113.9L218 L219 A220 A355 C356L218-R222 HydrophobicContact CD1-CG 3.73Å; L218-R222 HydrophobicContact CG-CG 4.42Å; L218-R222 WeakPolarHBondContact O-CB 3.38Å; L218-R222 WeakPolarHBondContact O-CG 3.23Å; L218-R222 PolarHBondContact O-N 2.59Å; L219-R222 PolarHBondContact O-N 3.43Å; A220-R222 VanDerWaalsContact C-N 3.29Å; A220-R222 PolarHBondContact O-N 2.9Å; R222-A355 HydrophobicContact CB-CB 4.02Å; R222-A355 HydrophobicContact CG-CB 4.36Å; R222-C356 PolarHBondContact NH1-SG 3.4Å
223N97.8Very high96.5Very high1 Ų162.1 Ų62.11%0.00532%0.316CS..SBendtrans-11914.6178.9-69.6-76.4000113.6L219 A220 D225 I226 V229 L351 K354L219-N223 WeakPolarHBondContact O-CB 3.36Å; L219-N223 PolarHBondContact O-N 3.42Å; L219-N223 VanDerWaalsContact O-N 3.16Å; L219-N223 PolarHBondContact O-ND2 3.16Å; A220-N223 CarbonylContact O-C 3.6Å; A220-N223 PolarHBondContact O-N 2.93Å; N223-D225 WeakPolarHBondContact CA-OD1 3.32Å; N223-D225 PolarHBondContact O-N 3.27Å; N223-I226 HydrophobicContact CB-CD1 4.37Å; N223-I226 WeakPolarHBondContact O-CB 3.43Å; N223-I226 PolarHBondContact O-N 3.25Å; N223-V229 HydrophobicContact CB-CB 4.39Å; N223-V229 HydrophobicContact CB-CG1 4Å; N223-V229 HydrophobicContact CB-CG2 4.31Å; N223-L351 HydrophobicContact CB-CD2 3.75Å; N223-L351 PolarHBondContact ND2-O 2.72Å; N223-L351 WeakPolarHBondContact OD1-CD2 3.13Å; N223-K354 WeakPolarHBondContact OD1-CB 3.45Å; N223-K354 WeakPolarHBondContact OD1-CD 3.49Å; N223-K354 WeakPolarHBondContact OD1-CE 3.49Å; N223-K354 PolarHBondContact OD1-NZ 3.36Å
224K96.7Very high96.5Very high155 Ų15561 Ų6167%0.67431%0.308SS*.THydrogen-bonded Turntrans-61.2-7.1179.170.8179.5-178.4-179.80115.9A220 Q221 I226A220-K224 PolarHBondContact O-N 2.92Å; A220-K224 VanDerWaalsContact O-N 3.08Å; Q221-K224 WeakPolarHBondContact O-CD 3.45Å; Q221-K224 WeakPolarHBondContact O-CG 3.31Å; K224-I226 VanDerWaalsContact C-N 3.3Å
225D95.1Very high96.4Very high110 Ų11056.6 Ų56.659%0.58829%0.292SS*.THydrogen-bonded Turntrans-78.8-14.4170.158.5-58.8000112.8N223 K354N223-D225 WeakPolarHBondContact CA-OD1 3.32Å; N223-D225 PolarHBondContact O-N 3.27Å; D225-K354 WeakPolarHBondContact OD1-CE 3.26Å; D225-K354 IonicContact OD1-NZ 2.93Å; D225-K354 PolarHBondContact OD1-NZ 1.88Å; D225-K354 IonicContact OD2-NZ 3.78Å; D225-K354 PolarHBondContact OD2-NZ 3.5Å
226I96.1Very high96.4Very high30 Ų3057 Ų5715%0.15429%0.294CS..SBendtrans-92.8114.1170.8-55.5175.8000107.4V168 N223 K224 E228 V229 S230 L351V168-I226 HydrophobicContact CG2-CG2 4.03Å; N223-I226 HydrophobicContact CB-CD1 4.37Å; N223-I226 WeakPolarHBondContact O-CB 3.43Å; N223-I226 PolarHBondContact O-N 3.25Å; K224-I226 VanDerWaalsContact C-N 3.3Å; I226-E228 VanDerWaalsContact C-N 3.25Å; I226-E228 HydrophobicContact CG2-CB 4.33Å; I226-E228 VanDerWaalsContact CG2-OE2 3.31Å; I226-E228 WeakPolarHBondContact CG2-OE2 3.5Å; I226-E228 PolarHBondContact O-N 3.2Å; I226-V229 HydrophobicContact CB-CB 4.24Å; I226-V229 HydrophobicContact CB-CG2 3.96Å; I226-V229 HydrophobicContact CD1-CG2 4.39Å; I226-V229 HydrophobicContact CG2-CG2 3.97Å; I226-V229 PolarHBondContact O-N 3.42Å; I226-S230 PolarHBondContact O-N 2.97Å; I226-L351 HydrophobicContact CD1-CD2 3.8Å
227P94.6Very high96.4Very high62 Ų6258.3 Ų58.340%0.40330%0.299SS..Hα-helixtrans-51.9-45.3-179-28.235.8000112.5V229 S230 E231P227-V229 PolarHBondContact O-N 3.38Å; P227-V229 VanDerWaalsContact O-N 3.16Å; P227-S230 WeakPolarHBondContact CA-OG 3.43Å; P227-S230 PolarHBondContact O-N 3.17Å; P227-S230 PolarHBondContact O-OG 3.31Å; P227-E231 WeakPolarHBondContact O-CB 3.32Å; P227-E231 WeakPolarHBondContact O-CG 3.42Å; P227-E231 PolarHBondContact O-N 3.02Å
228E94.1Very high96.4Very high27 Ų2754.2 Ų54.213%0.12628%0.28CS..Hα-helixtrans-65.1-20.2-177.3-59.169-150.900113.3P167 V168 I226 V232 I282P167-E228 VanDerWaalsContact CB-OE1 3.28Å; P167-E228 WeakPolarHBondContact CB-OE1 3.37Å; P167-E228 HydrophobicContact CG-CG 3.73Å; P167-E228 VanDerWaalsContact CG-OE1 3.28Å; P167-E228 WeakPolarHBondContact CG-OE1 3.37Å; V168-E228 HydrophobicContact CG2-CB 4.48Å; V168-E228 HydrophobicContact CG2-CG 4.35Å; I226-E228 VanDerWaalsContact C-N 3.25Å; I226-E228 HydrophobicContact CG2-CB 4.33Å; I226-E228 VanDerWaalsContact CG2-OE2 3.31Å; I226-E228 WeakPolarHBondContact CG2-OE2 3.5Å; I226-E228 PolarHBondContact O-N 3.2Å; E228-V232 WeakPolarHBondContact O-CG2 3.49Å; E228-I282 HydrophobicContact CB-CB 3.88Å; E228-I282 HydrophobicContact CB-CG2 4.28Å; E228-I282 VanDerWaalsContact O-CG2 3.28Å; E228-I282 WeakPolarHBondContact O-CG2 3.33Å
229V96.1Very high96.4Very high1 Ų151.3 Ų51.31%0.00627%0.265CS..Hα-helixtrans-88.8-36.6169.5-179.40000111.1A220 N223 I226 P227 W234 M278 I282 L351A220-V229 HydrophobicContact CB-CG1 4.33Å; N223-V229 HydrophobicContact CB-CB 4.39Å; N223-V229 HydrophobicContact CB-CG1 4Å; N223-V229 HydrophobicContact CB-CG2 4.31Å; I226-V229 HydrophobicContact CB-CB 4.24Å; I226-V229 HydrophobicContact CB-CG2 3.96Å; I226-V229 HydrophobicContact CD1-CG2 4.39Å; I226-V229 HydrophobicContact CG2-CG2 3.97Å; I226-V229 PolarHBondContact O-N 3.42Å; P227-V229 PolarHBondContact O-N 3.38Å; P227-V229 VanDerWaalsContact O-N 3.16Å; V229-W234 HydrophobicContact CG1-CZ2 4.33Å; V229-W234 PolarHBondContact O-NE1 2.97Å; V229-M278 HydrophobicContact CG1-CE 4.27Å; V229-I282 HydrophobicContact CG2-CD1 3.67Å; V229-I282 HydrophobicContact CG2-CG2 4.06Å; V229-L351 HydrophobicContact CG2-CD2 4.07Å
230S95.8Very high96.4Very high69 Ų6957.3 Ų57.348%0.48329%0.293SS..Hα-helixtrans-77.9-27.5-174.974.90000114.9I226 P227I226-S230 PolarHBondContact O-N 2.97Å; P227-S230 WeakPolarHBondContact CA-OG 3.43Å; P227-S230 PolarHBondContact O-N 3.17Å; P227-S230 PolarHBondContact O-OG 3.31Å
231E92.8Very high96.2Very high132 Ų13257.6 Ų57.662%0.61729%0.294SS*.SBendtrans-84.3-14.4-178.9-69.7179.2173.800113.1P227P227-E231 WeakPolarHBondContact O-CB 3.32Å; P227-E231 WeakPolarHBondContact O-CG 3.42Å; P227-E231 PolarHBondContact O-N 3.02Å
232V92.3Very high95.9Very high19 Ų1957.7 Ų57.712%0.11531%0.305CS..SBendtrans-88.6127.3-173.8171.60000111.2E228 W234E228-V232 WeakPolarHBondContact O-CG2 3.49Å; V232-W234 VanDerWaalsContact C-N 3.34Å; V232-W234 HydrophobicContact CB-CD2 4.4Å; V232-W234 HydrophobicContact CB-CH2 4.39Å; V232-W234 HydrophobicContact CB-CZ2 3.74Å; V232-W234 HydrophobicContact CG1-CD2 3.78Å; V232-W234 HydrophobicContact CG1-CE3 3.98Å; V232-W234 HydrophobicContact CG1-CG 4.39Å; V232-W234 HydrophobicContact CG1-CH2 3.85Å; V232-W234 HydrophobicContact CG1-CZ2 3.61Å; V232-W234 HydrophobicContact CG1-CZ3 4.01Å; V232-W234 HydrophobicContact CG2-CZ2 4.36Å; V232-W234 PolarHBondContact O-N 3.44Å; V232-W234 PolarHBondContact O-NE1 3.01Å
233P94.3Very high95.4Very high97 Ų9755.9 Ų55.963%0.6330%0.302SS*.  trans-81.277.4178.933.5-34.9000111.4S235P233-S235 PolarHBondContact O-N 2.89Å
234W97.2Very high94.8Very high47 Ų4757.5 Ų57.518%0.17831%0.31CS..  trans-54.6128.5179.6-57.4102.6000112.8V216 A220 V229 V232 V248 G252 V254 M278 I282V216-W234 HydrophobicContact CG1-CB 3.9Å; V216-W234 HydrophobicContact CG1-CG 4.31Å; A220-W234 HydrophobicContact CB-CG 4.3Å; V229-W234 HydrophobicContact CG1-CZ2 4.33Å; V229-W234 PolarHBondContact O-NE1 2.97Å; V232-W234 VanDerWaalsContact C-N 3.34Å; V232-W234 HydrophobicContact CB-CD2 4.4Å; V232-W234 HydrophobicContact CB-CH2 4.39Å; V232-W234 HydrophobicContact CB-CZ2 3.74Å; V232-W234 HydrophobicContact CG1-CD2 3.78Å; V232-W234 HydrophobicContact CG1-CE3 3.98Å; V232-W234 HydrophobicContact CG1-CG 4.39Å; V232-W234 HydrophobicContact CG1-CH2 3.85Å; V232-W234 HydrophobicContact CG1-CZ2 3.61Å; V232-W234 HydrophobicContact CG1-CZ3 4.01Å; V232-W234 HydrophobicContact CG2-CZ2 4.36Å; V232-W234 PolarHBondContact O-N 3.44Å; V232-W234 PolarHBondContact O-NE1 3.01Å; W234-V248 HydrophobicContact CZ3-CG1 3.73Å; W234-G252 WeakPolarHBondContact CA-O 3.33Å; W234-V254 HydrophobicContact CE3-CG2 4.19Å; W234-M278 HydrophobicContact CD2-CE 3.92Å; W234-M278 HydrophobicContact CE3-CE 4.12Å; W234-M278 HydrophobicContact CE3-CG 4.4Å; W234-M278 HydrophobicContact CH2-CB 4.18Å; W234-M278 HydrophobicContact CH2-CE 3.83Å; W234-M278 HydrophobicContact CH2-CG 3.97Å; W234-M278 HydrophobicContact CZ2-CE 3.61Å; W234-M278 HydrophobicContact CZ3-CB 4.46Å; W234-M278 HydrophobicContact CZ3-CE 4.08Å; W234-M278 HydrophobicContact CZ3-CG 3.82Å; W234-I282 HydrophobicContact CH2-CG2 4.05Å; W234-I282 HydrophobicContact CZ2-CG2 4.06Å
235S97.1Very high94.3Very high35 Ų3550.4 Ų50.425%0.24528%0.28CS..EExtended strand (participates in β ladder)trans-148.3138.817450.10000111.5P233 G252 K253 V254P233-S235 PolarHBondContact O-N 2.89Å; S235-G252 PolarHBondContact N-O 3.1Å; S235-K253 WeakPolarHBondContact OG-CD 3.48Å; S235-K253 WeakPolarHBondContact OG-CE 3.35Å; S235-K253 PolarHBondContact OG-NZ 3.11Å; S235-V254 PolarHBondContact O-N 3.2Å
236V98.3Very high94.1Very high11 Ų1145.2 Ų45.27%0.06725%0.252CS..EExtended strand (participates in β ladder)trans-102140-170.7167.80000112.3H209 V212 E213 V216 V238 V254H209-V236 PolarHBondContact CE1-O 3.47Å; H209-V236 PolarHBondContact NE2-O 3.16Å; V212-V236 HydrophobicContact CB-CG1 4.07Å; V212-V236 HydrophobicContact CG1-CG1 3.76Å; V212-V236 HydrophobicContact CG1-CG2 4.21Å; E213-V236 HydrophobicContact CB-CB 4.41Å; E213-V236 HydrophobicContact CB-CG2 4.42Å; V216-V236 HydrophobicContact CB-CG2 4Å; V216-V236 HydrophobicContact CG1-CG2 4.37Å; V216-V236 HydrophobicContact CG2-CG2 3.76Å; V236-V238 HydrophobicContact CG1-CG2 3.86Å; V236-V254 HydrophobicContact CG2-CB 4.15Å; V236-V254 HydrophobicContact CG2-CG1 4.45Å; V236-V254 HydrophobicContact CG2-CG2 4.48Å
237H98.1Very high93.9Very high30 Ų3045.5 Ų45.514%0.13925%0.252CS..EExtended strand (participates in β ladder)trans-134.8107.6175.9-59.3-62.9000108L201 K253 V254 F255 M256L201-H237 HydrophobicContact CD2-CB 3.95Å; H237-K253 VanDerWaalsContact NE2-CD 3.32Å; H237-K253 WeakPolarHBondContact NE2-CD 3.46Å; H237-K253 PolarHBondContact NE2-NZ 3.25Å; H237-K253 VanDerWaalsContact NE2-NZ 3.13Å; H237-V254 PolarHBondContact N-O 3.41Å; H237-F255 HydrophobicContact CB-CD1 3.9Å; H237-F255 HydrophobicContact CB-CE1 4.02Å; H237-F255 HydrophobicContact CB-CG 4.44Å; H237-F255 WeakPolarHBondContact O-CA 2.85Å; H237-M256 PolarHBondContact O-N 3.02Å
238V98.4Very high93.8Very high0 Ų043.3 Ų43.30%024%0.237CC..EExtended strand (participates in β ladder)trans-96.1124.5177.5-176.30000109.8L201 L202 H209 V212 V236 M256 T258 L261L201-V238 WeakPolarHBondContact CA-O 3.36Å; L202-V238 HydrophobicContact CB-CB 4.32Å; L202-V238 HydrophobicContact CD1-CB 4.44Å; L202-V238 HydrophobicContact CD1-CG1 3.8Å; L202-V238 HydrophobicContact CG-CG1 4.34Å; L202-V238 PolarHBondContact N-O 2.86Å; H209-V238 HydrophobicContact CB-CG2 4.32Å; V212-V238 HydrophobicContact CB-CG2 4.16Å; V212-V238 HydrophobicContact CG2-CG2 4.19Å; V236-V238 HydrophobicContact CG1-CG2 3.86Å; V238-M256 CarbonylContact C-O 3.55Å; V238-M256 VanDerWaalsContact CA-O 3.24Å; V238-M256 WeakPolarHBondContact CA-O 3.34Å; V238-M256 WeakPolarHBondContact CG1-O 3.49Å; V238-M256 HydrophobicContact CG2-CB 4.41Å; V238-T258 HydrophobicContact CG1-CG2 4.22Å; V238-L261 HydrophobicContact CG1-CD1 4.05Å
239V97.8Very high93.6Very high0 Ų043 Ų430%024%0.237CC..EExtended strand (participates in β ladder)trans-102.2122.7-175.7-175.10000109.6F197 L200 L201 S241 F255 M256 F257 T258F197-V239 HydrophobicContact CB-CG1 4.27Å; F197-V239 HydrophobicContact CB-CG2 4.12Å; F197-V239 HydrophobicContact CD1-CG1 4.02Å; F197-V239 HydrophobicContact CD2-CG2 4.08Å; F197-V239 HydrophobicContact CG-CG1 4.14Å; F197-V239 HydrophobicContact CG-CG2 4.02Å; L200-V239 HydrophobicContact CB-CG1 3.92Å; L200-V239 HydrophobicContact CD1-CG1 4.29Å; L201-V239 HydrophobicContact CD2-CG2 4.12Å; V239-S241 PolarHBondContact O-N 2.91Å; V239-F255 HydrophobicContact CG2-CD1 4.36Å; V239-M256 PolarHBondContact N-O 3.28Å; V239-F257 HydrophobicContact CB-CD1 4.24Å; V239-F257 HydrophobicContact CB-CD2 4.4Å; V239-F257 HydrophobicContact CB-CE1 4.39Å; V239-F257 HydrophobicContact CB-CG 4.21Å; V239-F257 HydrophobicContact CG1-CD1 4.22Å; V239-F257 HydrophobicContact CG1-CE1 4.14Å; V239-F257 HydrophobicContact CG2-CE2 4.32Å; V239-F257 HydrophobicContact CG2-CZ 4.43Å; V239-F257 WeakPolarHBondContact O-CA 3.28Å; V239-T258 PolarHBondContact O-N 3.33Å
240E97.9Very high93.3Very high125 Ų12543.5 Ų43.558%0.58424%0.24SC*.  trans-73.491.4172.7-170.5168.1-153.900110.1L200 L202L200-E240 PolarHBondContact O-N 2.82Å; L202-E240 HydrophobicContact CD2-CB 4Å; L202-E240 HydrophobicContact CG-CB 4.38Å
241S94.7Very high93.1Very high25 Ų2541.7 Ų41.718%0.17522%0.224CC..  trans-155.3135.1179.3167.40000110V239 Q243 T258 G259V239-S241 PolarHBondContact O-N 2.91Å; S241-Q243 PolarHBondContact O-N 2.78Å; S241-Q243 VanDerWaalsContact O-N 3.12Å; S241-Q243 PolarHBondContact OG-N 2.79Å; S241-T258 PolarHBondContact N-OG1 2.91Å; S241-T258 PolarHBondContact O-N 2.99Å; S241-T258 PolarHBondContact O-OG1 3.26Å; S241-T258 VanDerWaalsContact O-OG1 3.14Å; S241-G259 PolarHBondContact O-N 2.88Å
242P91.9Very high93.1Very high123 Ų12335.4 Ų35.480%0.79920%0.195SC*.SBendtrans-71.9-0.7179.732.5-37.3000113.4I244P242-I244 PolarHBondContact O-N 2.96Å
243Q85.6Confident93.3Very high74 Ų7436.7 Ų36.735%0.34620%0.199SC..SBendtrans-63.6126.8173.6-162.3-170.618.600109.7S241 N245 F257 G259S241-Q243 PolarHBondContact O-N 2.78Å; S241-Q243 VanDerWaalsContact O-N 3.12Å; S241-Q243 PolarHBondContact OG-N 2.79Å; Q243-N245 HydrophobicContact CB-CB 4.31Å; Q243-N245 HydrophobicContact CG-CB 3.93Å; Q243-N245 PolarHBondContact O-N 2.75Å; Q243-N245 PolarHBondContact OE1-ND2 3.35Å; Q243-F257 HydrophobicContact CB-CD1 4.09Å; Q243-F257 VanDerWaalsContact O-CB 3.29Å; Q243-F257 WeakPolarHBondContact O-CB 3.36Å; Q243-F257 VanDerWaalsContact OE1-CE1 3.29Å; Q243-G259 WeakPolarHBondContact O-CA 3.45Å
244I86.3Confident93.4Very high35 Ų3532.1 Ų32.118%0.17917%0.17CC..  trans-68.899.2165.9-59175.5000105.7P242 M260 A263 L369 P382P242-I244 PolarHBondContact O-N 2.96Å; I244-M260 HydrophobicContact CG2-CE 3.54Å; I244-M260 HydrophobicContact CG2-SD 4.12Å; I244-A263 HydrophobicContact CD1-CB 4.24Å; I244-A263 HydrophobicContact CG1-CB 4.3Å; I244-A263 HydrophobicContact CG2-CB 4.14Å; I244-L369 HydrophobicContact CG2-CD2 4.47Å; I244-P382 HydrophobicContact CG2-CG 4.36Å; I244-P382 WeakPolarHBondContact O-CB 3.48Å; I244-P382 WeakPolarHBondContact O-CG 3.37Å
245N87Confident93.4Very high7 Ų729.9 Ų29.94%0.03716%0.161CC..  trans-156.9145.6-174.9-167.61.4000111.6Q243 F257 M260 W384Q243-N245 HydrophobicContact CB-CB 4.31Å; Q243-N245 HydrophobicContact CG-CB 3.93Å; Q243-N245 PolarHBondContact O-N 2.75Å; Q243-N245 PolarHBondContact OE1-ND2 3.35Å; N245-F257 HydrophobicContact CB-CB 4.11Å; N245-F257 HydrophobicContact CB-CD1 3.92Å; N245-F257 HydrophobicContact CB-CD2 3.66Å; N245-F257 HydrophobicContact CB-CE1 4.27Å; N245-F257 HydrophobicContact CB-CE2 4.05Å; N245-F257 HydrophobicContact CB-CG 3.64Å; N245-F257 HydrophobicContact CB-CZ 4.35Å; N245-F257 WeakPolarHBondContact ND2-CZ 3.41Å; N245-F257 VanDerWaalsContact O-CB 3.25Å; N245-F257 WeakPolarHBondContact O-CB 3.33Å; N245-F257 WeakPolarHBondContact O-CD2 3.37Å; N245-F257 PolarHBondContact O-N 2.77Å; N245-M260 WeakPolarHBondContact O-CB 3.43Å; N245-W384 PolarHBondContact OD1-NE1 2.96Å
246A90.9Very high93.3Very high1 Ų128.2 Ų28.21%0.00815%0.149CC..EExtended strand (participates in β ladder)trans-159.2141.9171.800000106.6F255 M256 M260 V273 E277 W384A246-F255 CarbonylContact C-O 3.58Å; A246-F255 VanDerWaalsContact CA-O 3.27Å; A246-F255 WeakPolarHBondContact CA-O 3.15Å; A246-M256 HydrophobicContact CB-CE 3.62Å; A246-M256 HydrophobicContact CB-SD 3.9Å; A246-M260 HydrophobicContact CB-CG 4.25Å; A246-V273 HydrophobicContact CB-CG1 4.39Å; A246-E277 HydrophobicContact CB-CG 4.41Å; A246-W384 PolarHBondContact O-NE1 2.83Å
247F91.2Very high93.2Very high36 Ų3627.9 Ų27.916%0.15815%0.147CC..EExtended strand (participates in β ladder)trans-154156.1173.364.9-94.3000110.9F197 L249 F255 F257F197-F247 HydrophobicContact CE2-CE1 4.43Å; F197-F247 HydrophobicContact CE2-CZ 4.25Å; F247-L249 HydrophobicContact CD2-CD2 4.18Å; F247-L249 HydrophobicContact CD2-CG 4.29Å; F247-L249 HydrophobicContact CE2-CD1 4.49Å; F247-L249 HydrophobicContact CE2-CD2 4.16Å; F247-L249 HydrophobicContact CE2-CG 4.16Å; F247-F255 HydrophobicContact CD1-CB 3.98Å; F247-F255 HydrophobicContact CD2-CB 4.17Å; F247-F255 AromaticContact CD2-CD2 3.95Å; F247-F255 HydrophobicContact CD2-CD2 3.95Å; F247-F255 HydrophobicContact CD2-CG 4.38Å; F247-F255 HydrophobicContact CE1-CB 3.67Å; F247-F255 HydrophobicContact CE1-CG 4.11Å; F247-F255 HydrophobicContact CE2-CB 3.88Å; F247-F255 AromaticContact CE2-CD2 3.28Å; F247-F255 HydrophobicContact CE2-CD2 3.28Å; F247-F255 AromaticContact CE2-CE2 3.92Å; F247-F255 HydrophobicContact CE2-CE2 3.92Å; F247-F255 AromaticContact CE2-CG 3.7Å; F247-F255 HydrophobicContact CE2-CG 3.7Å; F247-F255 HydrophobicContact CG-CB 4.22Å; F247-F255 HydrophobicContact CZ-CB 3.63Å; F247-F255 HydrophobicContact CZ-CD1 4.16Å; F247-F255 AromaticContact CZ-CD2 3.63Å; F247-F255 HydrophobicContact CZ-CD2 3.63Å; F247-F255 HydrophobicContact CZ-CE2 4.3Å; F247-F255 AromaticContact CZ-CG 3.54Å; F247-F255 HydrophobicContact CZ-CG 3.54Å; F247-F255 PolarHBondContact N-O 3.37Å; F247-F255 PolarHBondContact O-N 3.01Å; F247-F257 HydrophobicContact CD1-CE2 4.13Å; F247-F257 AromaticContact CE1-CE2 3.83Å; F247-F257 HydrophobicContact CE1-CE2 3.83Å; F247-F257 HydrophobicContact CE1-CZ 4.19Å
248V91.8Very high93.2Very high15 Ų1528 Ų289%0.09115%0.15CC..EExtended strand (participates in β ladder)trans-129125.7179.4175.50000109.8W234 K253 V254 E277 A281W234-V248 HydrophobicContact CZ3-CG1 3.73Å; V248-K253 WeakPolarHBondContact CA-O 3.32Å; V248-V254 HydrophobicContact CG1-CG2 4.42Å; V248-V254 HydrophobicContact CG2-CB 4.17Å; V248-V254 HydrophobicContact CG2-CG1 3.93Å; V248-V254 HydrophobicContact CG2-CG2 3.96Å; V248-E277 HydrophobicContact CB-CB 3.95Å; V248-E277 HydrophobicContact CG2-CB 3.41Å; V248-E277 VanDerWaalsContact CG2-CB 3.41Å; V248-E277 HydrophobicContact CG2-CG 4.5Å; V248-A281 HydrophobicContact CB-CB 4.3Å; V248-A281 HydrophobicContact CG1-CB 3.55Å
249L90.8Very high92.9Very high22 Ų2228.6 Ų28.612%0.11516%0.156CC..  trans-85.3151.7175.7-58.7175.4000110.9T189 F247 N251 G252 K253 F255T189-L249 HydrophobicContact CG2-CD1 4.22Å; T189-L249 HydrophobicContact CG2-CD2 4.14Å; F247-L249 HydrophobicContact CD2-CD2 4.18Å; F247-L249 HydrophobicContact CD2-CG 4.29Å; F247-L249 HydrophobicContact CE2-CD1 4.49Å; F247-L249 HydrophobicContact CE2-CD2 4.16Å; F247-L249 HydrophobicContact CE2-CG 4.16Å; L249-N251 WeakPolarHBondContact CB-OD1 3.42Å; L249-N251 PolarHBondContact O-N 2.73Å; L249-G252 PolarHBondContact O-N 2.77Å; L249-K253 HydrophobicContact CB-CB 4.21Å; L249-K253 HydrophobicContact CD1-CB 4.26Å; L249-K253 PolarHBondContact N-O 2.98Å; L249-F255 HydrophobicContact CD1-CE2 3.95Å; L249-F255 HydrophobicContact CG-CE2 4.49Å
250P89.6Confident92.7Very high10 Ų1028.6 Ų28.67%0.06516%0.156CC..THydrogen-bonded Turntrans-57.8-18.5-176.6-22.929.5000115.8Y182 M183 A186 G252Y182-P250 HydrophobicContact CD1-CG 4.06Å; Y182-P250 HydrophobicContact CE1-CG 3.75Å; M183-P250 HydrophobicContact CE-CB 3.48Å; M183-P250 VanDerWaalsContact CE-CB 3.48Å; M183-P250 HydrophobicContact SD-CB 3.96Å; A186-P250 HydrophobicContact CB-CB 4.39Å; A186-P250 HydrophobicContact CB-CG 4.26Å; P250-G252 VanDerWaalsContact C-N 3.29Å; P250-G252 PolarHBondContact O-N 3.37Å
251N91.4Very high92.6Very high31 Ų3124 Ų2417%0.16614%0.135CC..THydrogen-bonded Turntrans-8713175.967.1-15000113.9A186 S190 L249 K253A186-N251 HydrophobicContact CB-CB 4.4Å; A186-N251 PolarHBondContact O-ND2 3.47Å; S190-N251 PolarHBondContact OG-ND2 2.52Å; L249-N251 WeakPolarHBondContact CB-OD1 3.42Å; L249-N251 PolarHBondContact O-N 2.73Å; N251-K253 WeakPolarHBondContact OD1-CB 3.44Å; N251-K253 VanDerWaalsContact OD1-CG 3.3Å; N251-K253 WeakPolarHBondContact OD1-CG 3.42Å
252G93.4Very high92.5Very high0 Ų026.1 Ų26.10%016%0.161CC..SBendtrans85.68.1176.300000115.2W234 S235 L249 P250 V254W234-G252 WeakPolarHBondContact CA-O 3.33Å; S235-G252 PolarHBondContact N-O 3.1Å; L249-G252 PolarHBondContact O-N 2.77Å; P250-G252 VanDerWaalsContact C-N 3.29Å; P250-G252 PolarHBondContact O-N 3.37Å; G252-V254 PolarHBondContact O-N 3.12Å
253K95.8Very high92.5Very high47 Ų4721.4 Ų21.420%0.20413%0.133CC..EExtended strand (participates in β ladder)trans-81.1108.2179.2-67.6-79.6169.9-160.80110.2S235 H237 V248 L249 N251 F255S235-K253 WeakPolarHBondContact OG-CD 3.48Å; S235-K253 WeakPolarHBondContact OG-CE 3.35Å; S235-K253 PolarHBondContact OG-NZ 3.11Å; H237-K253 VanDerWaalsContact NE2-CD 3.32Å; H237-K253 WeakPolarHBondContact NE2-CD 3.46Å; H237-K253 PolarHBondContact NE2-NZ 3.25Å; H237-K253 VanDerWaalsContact NE2-NZ 3.13Å; V248-K253 WeakPolarHBondContact CA-O 3.32Å; L249-K253 HydrophobicContact CB-CB 4.21Å; L249-K253 HydrophobicContact CD1-CB 4.26Å; L249-K253 PolarHBondContact N-O 2.98Å; N251-K253 WeakPolarHBondContact OD1-CB 3.44Å; N251-K253 VanDerWaalsContact OD1-CG 3.3Å; N251-K253 WeakPolarHBondContact OD1-CG 3.42Å; K253-F255 HydrophobicContact CB-CE2 3.94Å
254V96.8Very high92.9Very high1 Ų118.9 Ų18.91%0.00612%0.122CC..EExtended strand (participates in β ladder)trans-95.5120.1179.7-1760000109.4V216 W234 S235 V236 H237 V248 G252 L274V216-V254 HydrophobicContact CG1-CG2 4.16Å; V216-V254 HydrophobicContact CG2-CG1 4.2Å; V216-V254 HydrophobicContact CG2-CG2 4.17Å; W234-V254 HydrophobicContact CE3-CG2 4.19Å; S235-V254 PolarHBondContact O-N 3.2Å; V236-V254 HydrophobicContact CG2-CB 4.15Å; V236-V254 HydrophobicContact CG2-CG1 4.45Å; V236-V254 HydrophobicContact CG2-CG2 4.48Å; H237-V254 PolarHBondContact N-O 3.41Å; V248-V254 HydrophobicContact CG1-CG2 4.42Å; V248-V254 HydrophobicContact CG2-CB 4.17Å; V248-V254 HydrophobicContact CG2-CG1 3.93Å; V248-V254 HydrophobicContact CG2-CG2 3.96Å; G252-V254 PolarHBondContact O-N 3.12Å; V254-L274 HydrophobicContact CG1-CD2 3.92Å
255F96Very high93.2Very high0 Ų020.5 Ų20.50%014%0.141CC..EExtended strand (participates in β ladder)trans-108.6126.8171.9-67.9-96.4000109.5H193 L194 F197 H237 V239 A246 F247 L249 K253 F257H193-F255 HydrophobicContact CB-CE1 3.89Å; H193-F255 HydrophobicContact CB-CE2 4.31Å; H193-F255 HydrophobicContact CB-CZ 3.66Å; L194-F255 HydrophobicContact CD2-CE1 4.19Å; L194-F255 HydrophobicContact CD2-CZ 4.24Å; L194-F255 HydrophobicContact CG-CZ 4.2Å; F197-F255 HydrophobicContact CD2-CD1 4Å; F197-F255 HydrophobicContact CD2-CE1 4.04Å; F197-F255 HydrophobicContact CE2-CD1 4.37Å; H237-F255 HydrophobicContact CB-CD1 3.9Å; H237-F255 HydrophobicContact CB-CE1 4.02Å; H237-F255 HydrophobicContact CB-CG 4.44Å; H237-F255 WeakPolarHBondContact O-CA 2.85Å; V239-F255 HydrophobicContact CG2-CD1 4.36Å; A246-F255 CarbonylContact C-O 3.58Å; A246-F255 VanDerWaalsContact CA-O 3.27Å; A246-F255 WeakPolarHBondContact CA-O 3.15Å; F247-F255 HydrophobicContact CD1-CB 3.98Å; F247-F255 HydrophobicContact CD2-CB 4.17Å; F247-F255 AromaticContact CD2-CD2 3.95Å; F247-F255 HydrophobicContact CD2-CD2 3.95Å; F247-F255 HydrophobicContact CD2-CG 4.38Å; F247-F255 HydrophobicContact CE1-CB 3.67Å; F247-F255 HydrophobicContact CE1-CG 4.11Å; F247-F255 HydrophobicContact CE2-CB 3.88Å; F247-F255 AromaticContact CE2-CD2 3.28Å; F247-F255 HydrophobicContact CE2-CD2 3.28Å; F247-F255 AromaticContact CE2-CE2 3.92Å; F247-F255 HydrophobicContact CE2-CE2 3.92Å; F247-F255 AromaticContact CE2-CG 3.7Å; F247-F255 HydrophobicContact CE2-CG 3.7Å; F247-F255 HydrophobicContact CG-CB 4.22Å; F247-F255 HydrophobicContact CZ-CB 3.63Å; F247-F255 HydrophobicContact CZ-CD1 4.16Å; F247-F255 AromaticContact CZ-CD2 3.63Å; F247-F255 HydrophobicContact CZ-CD2 3.63Å; F247-F255 HydrophobicContact CZ-CE2 4.3Å; F247-F255 AromaticContact CZ-CG 3.54Å; F247-F255 HydrophobicContact CZ-CG 3.54Å; F247-F255 PolarHBondContact N-O 3.37Å; F247-F255 PolarHBondContact O-N 3.01Å; L249-F255 HydrophobicContact CD1-CE2 3.95Å; L249-F255 HydrophobicContact CG-CE2 4.49Å; K253-F255 HydrophobicContact CB-CE2 3.94Å; F255-F257 HydrophobicContact CB-CE2 4.46Å
256M96.6Very high93.6Very high0 Ų023.4 Ų23.40%016%0.156CC..EExtended strand (participates in β ladder)trans-133.2125.7-176.317458.968.400109.8V212 H237 V238 V239 A246 M260 L261 L270 V273 L274V212-M256 HydrophobicContact CG1-CB 4.1Å; V212-M256 HydrophobicContact CG1-CG 4.17Å; V212-M256 HydrophobicContact CG2-CG 3.89Å; H237-M256 PolarHBondContact O-N 3.02Å; V238-M256 CarbonylContact C-O 3.55Å; V238-M256 VanDerWaalsContact CA-O 3.24Å; V238-M256 WeakPolarHBondContact CA-O 3.34Å; V238-M256 WeakPolarHBondContact CG1-O 3.49Å; V238-M256 HydrophobicContact CG2-CB 4.41Å; V239-M256 PolarHBondContact N-O 3.28Å; A246-M256 HydrophobicContact CB-CE 3.62Å; A246-M256 HydrophobicContact CB-SD 3.9Å; M256-M260 HydrophobicContact CE-CG 4.22Å; M256-M260 HydrophobicContact SD-CB 3.7Å; M256-M260 HydrophobicContact SD-CG 3.52Å; M256-M260 VanDerWaalsContact SD-CG 3.52Å; M256-L261 HydrophobicContact CG-CD1 4.17Å; M256-L261 HydrophobicContact CG-CD2 3.71Å; M256-L261 HydrophobicContact CG-CG 3.87Å; M256-L261 HydrophobicContact SD-CD2 3.77Å; M256-L261 HydrophobicContact SD-CG 4.1Å; M256-L270 HydrophobicContact CE-CD1 3.87Å; M256-V273 HydrophobicContact CE-CG1 4.49Å; M256-L274 HydrophobicContact CE-CD2 3.62Å; M256-L274 HydrophobicContact CE-CG 4.11Å
257F96Very high93.8Very high4 Ų427.6 Ų27.62%0.01818%0.178CC..EExtended strand (participates in β ladder)trans-97.5144-173.9-66.8-128000110.1F197 V239 Q243 N245 F247 F255 G259 M260 L261F197-F257 HydrophobicContact CE1-CE1 4.48Å; F197-F257 HydrophobicContact CE1-CZ 4.29Å; F197-F257 HydrophobicContact CE2-CZ 4.27Å; F197-F257 AromaticContact CZ-CZ 3.91Å; F197-F257 HydrophobicContact CZ-CZ 3.91Å; V239-F257 HydrophobicContact CB-CD1 4.24Å; V239-F257 HydrophobicContact CB-CD2 4.4Å; V239-F257 HydrophobicContact CB-CE1 4.39Å; V239-F257 HydrophobicContact CB-CG 4.21Å; V239-F257 HydrophobicContact CG1-CD1 4.22Å; V239-F257 HydrophobicContact CG1-CE1 4.14Å; V239-F257 HydrophobicContact CG2-CE2 4.32Å; V239-F257 HydrophobicContact CG2-CZ 4.43Å; V239-F257 WeakPolarHBondContact O-CA 3.28Å; Q243-F257 HydrophobicContact CB-CD1 4.09Å; Q243-F257 VanDerWaalsContact O-CB 3.29Å; Q243-F257 WeakPolarHBondContact O-CB 3.36Å; Q243-F257 VanDerWaalsContact OE1-CE1 3.29Å; N245-F257 HydrophobicContact CB-CB 4.11Å; N245-F257 HydrophobicContact CB-CD1 3.92Å; N245-F257 HydrophobicContact CB-CD2 3.66Å; N245-F257 HydrophobicContact CB-CE1 4.27Å; N245-F257 HydrophobicContact CB-CE2 4.05Å; N245-F257 HydrophobicContact CB-CG 3.64Å; N245-F257 HydrophobicContact CB-CZ 4.35Å; N245-F257 WeakPolarHBondContact ND2-CZ 3.41Å; N245-F257 VanDerWaalsContact O-CB 3.25Å; N245-F257 WeakPolarHBondContact O-CB 3.33Å; N245-F257 WeakPolarHBondContact O-CD2 3.37Å; N245-F257 PolarHBondContact O-N 2.77Å; F247-F257 HydrophobicContact CD1-CE2 4.13Å; F247-F257 AromaticContact CE1-CE2 3.83Å; F247-F257 HydrophobicContact CE1-CE2 3.83Å; F247-F257 HydrophobicContact CE1-CZ 4.19Å; F255-F257 HydrophobicContact CB-CE2 4.46Å; F257-G259 PolarHBondContact O-N 3.2Å; F257-G259 VanDerWaalsContact O-N 3.16Å; F257-M260 WeakPolarHBondContact O-CA 3.39Å; F257-M260 WeakPolarHBondContact O-CB 3.17Å; F257-M260 PolarHBondContact O-N 3.05Å; F257-L261 PolarHBondContact O-N 3.31Å
258T96.9Very high94.1Very high33 Ų3328.4 Ų28.420%0.20218%0.184CC..Hα-helixtrans-61.1-26.3-179.952.80000113L202 L208 V238 V239 S241 L261 G262L202-T258 HydrophobicContact CD1-CG2 3.84Å; L208-T258 HydrophobicContact CD1-CG2 4.11Å; V238-T258 HydrophobicContact CG1-CG2 4.22Å; V239-T258 PolarHBondContact O-N 3.33Å; S241-T258 PolarHBondContact N-OG1 2.91Å; S241-T258 PolarHBondContact O-N 2.99Å; S241-T258 PolarHBondContact O-OG1 3.26Å; S241-T258 VanDerWaalsContact O-OG1 3.14Å; T258-L261 PolarHBondContact O-N 3.5Å; T258-G262 PolarHBondContact O-N 3.07Å
259G92.9Very high94.3Very high12 Ų1227.8 Ų27.812%0.12418%0.18CC..Hα-helixtrans-63.6-34.4169.100000114.3S241 Q243 F257 G262 A263S241-G259 PolarHBondContact O-N 2.88Å; Q243-G259 WeakPolarHBondContact O-CA 3.45Å; F257-G259 PolarHBondContact O-N 3.2Å; F257-G259 VanDerWaalsContact O-N 3.16Å; G259-G262 PolarHBondContact O-N 3.37Å; G259-A263 PolarHBondContact O-N 2.35Å
260M92.8Very high94.7Very high0 Ų026.8 Ų26.80%018%0.175CC..Hα-helixtrans-70.7-40.8171.8178.158.571.900111.4I244 N245 A246 M256 F257 G262 A263 V264 V273 F365 W384I244-M260 HydrophobicContact CG2-CE 3.54Å; I244-M260 HydrophobicContact CG2-SD 4.12Å; N245-M260 WeakPolarHBondContact O-CB 3.43Å; A246-M260 HydrophobicContact CB-CG 4.25Å; M256-M260 HydrophobicContact CE-CG 4.22Å; M256-M260 HydrophobicContact SD-CB 3.7Å; M256-M260 HydrophobicContact SD-CG 3.52Å; M256-M260 VanDerWaalsContact SD-CG 3.52Å; F257-M260 WeakPolarHBondContact O-CA 3.39Å; F257-M260 WeakPolarHBondContact O-CB 3.17Å; F257-M260 PolarHBondContact O-N 3.05Å; M260-G262 PolarHBondContact O-N 2.97Å; M260-A263 WeakPolarHBondContact O-CB 3.28Å; M260-A263 PolarHBondContact O-N 2.91Å; M260-A263 HydrophobicContact SD-CB 4.45Å; M260-V264 PolarHBondContact O-N 3.48Å; M260-V264 VanDerWaalsContact O-N 3.16Å; M260-V264 HydrophobicContact SD-CG1 4.46Å; M260-V273 HydrophobicContact CG-CG1 4.43Å; M260-V273 HydrophobicContact SD-CG1 4.26Å; M260-F365 HydrophobicContact CE-CZ 4.45Å; M260-F365 HydrophobicContact SD-CE2 4.25Å; M260-F365 HydrophobicContact SD-CZ 3.83Å; M260-W384 HydrophobicContact CE-CZ2 3.69Å
261L95.4Very high95.1Very high27 Ų2726.5 Ų26.514%0.14117%0.173CC..Hα-helixtrans-63.4-25.4174.6-60.5-179.7000112.7L208 V212 V238 M256 F257 T258 L270L208-L261 HydrophobicContact CB-CD1 3.97Å; L208-L261 HydrophobicContact CD1-CD1 4.4Å; L208-L261 HydrophobicContact CD2-CD1 4.41Å; L208-L261 HydrophobicContact CG-CD1 4.5Å; V212-L261 HydrophobicContact CG2-CD1 4.01Å; V212-L261 HydrophobicContact CG2-CD2 3.69Å; V212-L261 HydrophobicContact CG2-CG 4.47Å; V238-L261 HydrophobicContact CG1-CD1 4.05Å; M256-L261 HydrophobicContact CG-CD1 4.17Å; M256-L261 HydrophobicContact CG-CD2 3.71Å; M256-L261 HydrophobicContact CG-CG 3.87Å; M256-L261 HydrophobicContact SD-CD2 3.77Å; M256-L261 HydrophobicContact SD-CG 4.1Å; F257-L261 PolarHBondContact O-N 3.31Å; T258-L261 PolarHBondContact O-N 3.5Å; L261-L270 HydrophobicContact CD2-CD1 3.77Å; L261-L270 HydrophobicContact CD2-CD2 4.34Å
262G93.8Very high95.3Very high70 Ų7025.3 Ų25.372%0.72217%0.167SC*.THydrogen-bonded Turntrans-82.6-10.1169.500000115.4T258 G259 M260T258-G262 PolarHBondContact O-N 3.07Å; G259-G262 PolarHBondContact O-N 3.37Å; M260-G262 PolarHBondContact O-N 2.97Å
263A90.7Very high95.4Very high25 Ų2525.5 Ų25.521%0.20717%0.167CC..THydrogen-bonded Turntrans-96.8-28.1179.400000113.2I244 G259 M260I244-A263 HydrophobicContact CD1-CB 4.24Å; I244-A263 HydrophobicContact CG1-CB 4.3Å; I244-A263 HydrophobicContact CG2-CB 4.14Å; G259-A263 PolarHBondContact O-N 2.35Å; M260-A263 WeakPolarHBondContact O-CB 3.28Å; M260-A263 PolarHBondContact O-N 2.91Å; M260-A263 HydrophobicContact SD-CB 4.45Å
264V94.4Very high95.5Very high21 Ų2123.3 Ų23.313%0.12716%0.158CC..  trans-78.4138.9171.6-65.40000111.2M260 Q269 L270 V273 F365M260-V264 PolarHBondContact O-N 3.48Å; M260-V264 VanDerWaalsContact O-N 3.16Å; M260-V264 HydrophobicContact SD-CG1 4.46Å; V264-Q269 HydrophobicContact CB-CB 4Å; V264-Q269 HydrophobicContact CG1-CB 4.05Å; V264-L270 HydrophobicContact CG2-CB 4.32Å; V264-V273 HydrophobicContact CG1-CG2 4.13Å; V264-F365 HydrophobicContact CG1-CD2 4.03Å; V264-F365 HydrophobicContact CG1-CE2 3.66Å; V264-F365 HydrophobicContact CG1-CZ 4.45Å
265A92.7Very high95.5Very high69 Ų6923.3 Ų23.357%0.5716%0.158SC*.  trans-86.2-24.7-178.400000113.9
266D94.6Very high95.4Very high67 Ų6723.5 Ų23.536%0.35816%0.159SC..SBendtrans-158.7176.2-172.356.455.1000112D268 Q269 L270D266-D268 VanDerWaalsContact C-N 3.31Å; D266-D268 PolarHBondContact O-N 3.07Å; D266-D268 WeakPolarHBondContact OD1-CA 3.25Å; D266-D268 WeakPolarHBondContact OD1-CB 3.4Å; D266-D268 PolarHBondContact OD1-N 3.11Å; D266-Q269 WeakPolarHBondContact OD1-CG 3.24Å; D266-Q269 PolarHBondContact OD1-N 2.81Å; D266-L270 PolarHBondContact O-N 2.75Å
267L96.2Very high95.3Very high89 Ų8923.9 Ų23.947%0.46616%0.161SC..Hα-helixtrans-67.4-29.1178.5-178.460.4000112.5A215 L270 M271A215-L267 HydrophobicContact CB-CD1 4.24Å; L267-L270 HydrophobicContact CD1-CD2 4.13Å; L267-L270 PolarHBondContact O-N 3.39Å; L267-M271 HydrophobicContact CD1-CG 4.1Å; L267-M271 HydrophobicContact CG-CG 4.18Å; L267-M271 WeakPolarHBondContact O-CB 3.48Å; L267-M271 WeakPolarHBondContact O-CG 3.21Å; L267-M271 PolarHBondContact O-N 3.09Å
268D97.5Very high95.4Very high53 Ų5323.7 Ų23.728%0.28316%0.16SC..Hα-helixtrans-68.5-40.5-180-66.5-54.2000110.7D266 M271 I272 A357 D358 A361D266-D268 VanDerWaalsContact C-N 3.31Å; D266-D268 PolarHBondContact O-N 3.07Å; D266-D268 WeakPolarHBondContact OD1-CA 3.25Å; D266-D268 WeakPolarHBondContact OD1-CB 3.4Å; D266-D268 PolarHBondContact OD1-N 3.11Å; D268-M271 PolarHBondContact O-N 3.48Å; D268-I272 WeakPolarHBondContact O-CD1 3.38Å; D268-I272 VanDerWaalsContact O-CG1 3.24Å; D268-I272 WeakPolarHBondContact O-CG1 3.41Å; D268-I272 PolarHBondContact O-N 3.35Å; D268-I272 VanDerWaalsContact O-N 3.13Å; D268-A357 WeakPolarHBondContact OD1-CA 3.24Å; D268-D358 HydrophobicContact CB-CB 4.08Å; D268-D358 VanDerWaalsContact CG-N 3.27Å; D268-D358 PolarHBondContact OD1-N 2.95Å; D268-A361 HydrophobicContact CB-CB 4.08Å
269Q96.8Very high95.3Very high3 Ų322.1 Ų22.11%0.01415%0.15CC..Hα-helixtrans-64.2-45170.4-66.9-167.1-14.900112.5V264 D266 M271 I272 V273 A361 F365V264-Q269 HydrophobicContact CB-CB 4Å; V264-Q269 HydrophobicContact CG1-CB 4.05Å; D266-Q269 WeakPolarHBondContact OD1-CG 3.24Å; D266-Q269 PolarHBondContact OD1-N 2.81Å; Q269-M271 VanDerWaalsContact C-N 3.29Å; Q269-M271 PolarHBondContact O-N 2.95Å; Q269-I272 PolarHBondContact O-N 3.13Å; Q269-I272 VanDerWaalsContact O-N 3.11Å; Q269-V273 WeakPolarHBondContact O-CG2 3.46Å; Q269-V273 PolarHBondContact O-N 3.25Å; Q269-A361 HydrophobicContact CG-CB 3.76Å; Q269-F365 HydrophobicContact CG-CB 4.22Å
270L97.5Very high95.3Very high1 Ų122.9 Ų22.91%0.00515%0.151CC..Hα-helixtrans-57.9-42.4176.4178.958.4000111.8M211 V212 A215 M256 L261 V264 D266 L267 I272 V273 L274M211-L270 HydrophobicContact CG-CD2 4.15Å; M211-L270 HydrophobicContact SD-CD2 4.14Å; V212-L270 HydrophobicContact CG2-CD2 4.37Å; A215-L270 HydrophobicContact CB-CD2 4.43Å; M256-L270 HydrophobicContact CE-CD1 3.87Å; L261-L270 HydrophobicContact CD2-CD1 3.77Å; L261-L270 HydrophobicContact CD2-CD2 4.34Å; V264-L270 HydrophobicContact CG2-CB 4.32Å; D266-L270 PolarHBondContact O-N 2.75Å; L267-L270 HydrophobicContact CD1-CD2 4.13Å; L267-L270 PolarHBondContact O-N 3.39Å; L270-I272 VanDerWaalsContact C-N 3.31Å; L270-I272 PolarHBondContact O-N 2.95Å; L270-V273 PolarHBondContact O-N 2.92Å; L270-L274 HydrophobicContact CD1-CD1 3.88Å; L270-L274 HydrophobicContact CD1-CG 4.1Å; L270-L274 HydrophobicContact CG-CD1 3.88Å; L270-L274 WeakPolarHBondContact O-CB 3.38Å; L270-L274 WeakPolarHBondContact O-CG 3.34Å; L270-L274 PolarHBondContact O-N 3.11Å
271M98.1Very high95.2Very high4 Ų423.2 Ų23.22%0.0215%0.153CC..Hα-helixtrans-66.5-30.2177.2-69.9-76.6-7400112.9A215 L218 L219 L267 D268 Q269 G275 A355 A357A215-M271 HydrophobicContact CB-SD 3.61Å; L218-M271 HydrophobicContact CB-CE 4.25Å; L218-M271 HydrophobicContact CD2-CE 3.71Å; L218-M271 HydrophobicContact CG-CE 3.92Å; L219-M271 HydrophobicContact CD1-CE 4.47Å; L219-M271 HydrophobicContact CD1-SD 4.1Å; L219-M271 HydrophobicContact CD2-CE 4Å; L219-M271 HydrophobicContact CG-CE 3.72Å; L219-M271 HydrophobicContact CG-SD 3.96Å; L267-M271 HydrophobicContact CD1-CG 4.1Å; L267-M271 HydrophobicContact CG-CG 4.18Å; L267-M271 WeakPolarHBondContact O-CB 3.48Å; L267-M271 WeakPolarHBondContact O-CG 3.21Å; L267-M271 PolarHBondContact O-N 3.09Å; D268-M271 PolarHBondContact O-N 3.48Å; Q269-M271 VanDerWaalsContact C-N 3.29Å; Q269-M271 PolarHBondContact O-N 2.95Å; M271-G275 PolarHBondContact O-N 3.01Å; M271-A355 HydrophobicContact CE-CB 3.42Å; M271-A355 VanDerWaalsContact CE-CB 3.42Å; M271-A357 HydrophobicContact CB-CB 3.55Å; M271-A357 HydrophobicContact CG-CB 4.12Å
272I96.4Very high95.1Very high6 Ų622 Ų223%0.03115%0.147CC..Hα-helixtrans-76.8-40.1175.8-67.7164.2000111.2D268 Q269 L270 G275 H276 A352 A361 G362D268-I272 WeakPolarHBondContact O-CD1 3.38Å; D268-I272 VanDerWaalsContact O-CG1 3.24Å; D268-I272 WeakPolarHBondContact O-CG1 3.41Å; D268-I272 PolarHBondContact O-N 3.35Å; D268-I272 VanDerWaalsContact O-N 3.13Å; Q269-I272 PolarHBondContact O-N 3.13Å; Q269-I272 VanDerWaalsContact O-N 3.11Å; L270-I272 VanDerWaalsContact C-N 3.31Å; L270-I272 PolarHBondContact O-N 2.95Å; I272-G275 PolarHBondContact O-N 2.9Å; I272-H276 PolarHBondContact O-N 2.99Å; I272-A352 HydrophobicContact CG1-CB 3.86Å; I272-A361 HydrophobicContact CD1-CB 4.28Å; I272-G362 VanDerWaalsContact CD1-N 3.3Å
273V94.9Very high95.1Very high3 Ų318.7 Ų18.72%0.01811%0.113CC..Hα-helixtrans-63.2-51173174.10000110.5A246 M256 M260 V264 Q269 L270 G275 H276 E277 F365A246-V273 HydrophobicContact CB-CG1 4.39Å; M256-V273 HydrophobicContact CE-CG1 4.49Å; M260-V273 HydrophobicContact CG-CG1 4.43Å; M260-V273 HydrophobicContact SD-CG1 4.26Å; V264-V273 HydrophobicContact CG1-CG2 4.13Å; Q269-V273 WeakPolarHBondContact O-CG2 3.46Å; Q269-V273 PolarHBondContact O-N 3.25Å; L270-V273 PolarHBondContact O-N 2.92Å; V273-G275 VanDerWaalsContact C-N 3.3Å; V273-G275 PolarHBondContact O-N 3.02Å; V273-H276 WeakPolarHBondContact O-CB 3.46Å; V273-H276 PolarHBondContact O-N 3.18Å; V273-H276 VanDerWaalsContact O-N 3.12Å; V273-E277 PolarHBondContact O-N 2.82Å; V273-F365 HydrophobicContact CG2-CD1 3.98Å; V273-F365 HydrophobicContact CG2-CD2 4.48Å; V273-F365 HydrophobicContact CG2-CE1 3.51Å; V273-F365 HydrophobicContact CG2-CE2 4.06Å; V273-F365 HydrophobicContact CG2-CG 4.44Å; V273-F365 HydrophobicContact CG2-CZ 3.54Å
274L97.6Very high95Very high2 Ų217.9 Ų17.91%0.0111%0.105CC..Hα-helixtrans-61.9-37.6176.4-71.1169.4000112.1V212 A215 V216 L219 V254 M256 L270 H276 E277 M278V212-L274 HydrophobicContact CG1-CD1 4.26Å; V212-L274 HydrophobicContact CG1-CD2 4.24Å; A215-L274 HydrophobicContact CB-CD1 3.53Å; V216-L274 HydrophobicContact CG2-CD1 3.99Å; V216-L274 HydrophobicContact CG2-CD2 3.93Å; V216-L274 HydrophobicContact CG2-CG 4.46Å; L219-L274 HydrophobicContact CD1-CB 3.52Å; L219-L274 HydrophobicContact CD1-CD1 4.5Å; V254-L274 HydrophobicContact CG1-CD2 3.92Å; M256-L274 HydrophobicContact CE-CD2 3.62Å; M256-L274 HydrophobicContact CE-CG 4.11Å; L270-L274 HydrophobicContact CD1-CD1 3.88Å; L270-L274 HydrophobicContact CD1-CG 4.1Å; L270-L274 HydrophobicContact CG-CD1 3.88Å; L270-L274 WeakPolarHBondContact O-CB 3.38Å; L270-L274 WeakPolarHBondContact O-CG 3.34Å; L270-L274 PolarHBondContact O-N 3.11Å; L274-H276 PolarHBondContact O-N 3.31Å; L274-E277 PolarHBondContact O-N 2.62Å; L274-M278 VanDerWaalsContact O-CB 3.31Å; L274-M278 WeakPolarHBondContact O-CB 3.23Å; L274-M278 WeakPolarHBondContact O-CG 3.27Å; L274-M278 PolarHBondContact O-N 3.48Å
275G97.2Very high94.8Very high0 Ų017 Ų170%010%0.099CC..Hα-helixtrans-60.2-41.9172.700000112.9M271 I272 V273 A279 G348M271-G275 PolarHBondContact O-N 3.01Å; I272-G275 PolarHBondContact O-N 2.9Å; V273-G275 VanDerWaalsContact C-N 3.3Å; V273-G275 PolarHBondContact O-N 3.02Å; G275-A279 WeakPolarHBondContact O-CB 3.38Å; G275-A279 PolarHBondContact O-N 3.29Å; G275-G348 WeakPolarHBondContact O-CA 3.34Å
276H95.5Very high94.3Very high4 Ų415.7 Ų15.72%0.0199%0.086CC..Hα-helixtrans-63.5-46.8176.2-179.759.5000112.2I272 V273 L274 A279 H280 E341 A344 D345 W384 R394I272-H276 PolarHBondContact O-N 2.99Å; V273-H276 WeakPolarHBondContact O-CB 3.46Å; V273-H276 PolarHBondContact O-N 3.18Å; V273-H276 VanDerWaalsContact O-N 3.12Å; L274-H276 PolarHBondContact O-N 3.31Å; H276-A279 WeakPolarHBondContact O-CB 3.26Å; H276-A279 PolarHBondContact O-N 3.14Å; H276-H280 AromaticContact CD2-NE2 3.43Å; H276-H280 PolarHBondContact CD2-NE2 3.36Å; H276-H280 AromaticContact CE1-CD2 3.76Å; H276-H280 AromaticContact CE1-NE2 2.59Å; H276-H280 PolarHBondContact CE1-NE2 2.87Å; H276-H280 AromaticContact ND1-NE2 3.66Å; H276-H280 AromaticContact NE2-CD2 3.71Å; H276-H280 AromaticContact NE2-NE2 2.41Å; H276-H280 PolarHBondContact NE2-NE2 2.92Å; H276-H280 PolarHBondContact O-CD2 2.99Å; H276-H280 PolarHBondContact O-N 3.16Å; H276-H280 VanDerWaalsContact O-N 3.1Å; H276-E341 IonicContact CE1-OE2 2.77Å; H276-E341 PolarHBondContact CE1-OE2 3.05Å; H276-E341 IonicContact NE2-OE2 3.51Å; H276-E341 PolarHBondContact NE2-OE2 2.89Å; H276-A344 VanDerWaalsContact CE1-CB 3.49Å; H276-A344 WeakPolarHBondContact CE1-CB 3.47Å; H276-A344 VanDerWaalsContact ND1-C 3.3Å; H276-A344 WeakPolarHBondContact ND1-CB 3.31Å; H276-A344 PolarHBondContact ND1-O 3.31Å; H276-D345 IonicContact ND1-OD1 3.66Å; H276-W384 AromaticContact CD2-CZ3 3.84Å; H276-W384 AromaticContact NE2-CZ3 3.9Å; H276-R394 PolarHBondContact CE1-NH2 2.88Å; H276-R394 PolarHBondContact NE2-NH2 3.44Å
277E94.4Very high93.9Very high8 Ų812.7 Ų12.74%0.0377%0.07CC..Hα-helixtrans-67.9-40.2178.1-59.7-50.7126.200112.4A246 V248 V273 L274 A279 H280 A281A246-E277 HydrophobicContact CB-CG 4.41Å; V248-E277 HydrophobicContact CB-CB 3.95Å; V248-E277 HydrophobicContact CG2-CB 3.41Å; V248-E277 VanDerWaalsContact CG2-CB 3.41Å; V248-E277 HydrophobicContact CG2-CG 4.5Å; V273-E277 PolarHBondContact O-N 2.82Å; L274-E277 PolarHBondContact O-N 2.62Å; E277-A279 VanDerWaalsContact C-N 3.26Å; E277-A279 PolarHBondContact O-N 2.94Å; E277-H280 PolarHBondContact O-N 2.9Å; E277-A281 PolarHBondContact O-N 3.45Å
278M96.3Very high93.4Very high1 Ų18.4 Ų8.41%0.0055%0.048CC..Hα-helixtrans-61-36.3171.9-72.5177.175.300111.6L219 A220 V229 W234 L274 A281 I282 L351L219-M278 HydrophobicContact CB-CE 4.06Å; L219-M278 HydrophobicContact CB-SD 3.67Å; L219-M278 HydrophobicContact CD1-SD 3.73Å; L219-M278 HydrophobicContact CG-SD 4.26Å; A220-M278 HydrophobicContact CB-CE 4.46Å; V229-M278 HydrophobicContact CG1-CE 4.27Å; W234-M278 HydrophobicContact CD2-CE 3.92Å; W234-M278 HydrophobicContact CE3-CE 4.12Å; W234-M278 HydrophobicContact CE3-CG 4.4Å; W234-M278 HydrophobicContact CH2-CB 4.18Å; W234-M278 HydrophobicContact CH2-CE 3.83Å; W234-M278 HydrophobicContact CH2-CG 3.97Å; W234-M278 HydrophobicContact CZ2-CE 3.61Å; W234-M278 HydrophobicContact CZ3-CB 4.46Å; W234-M278 HydrophobicContact CZ3-CE 4.08Å; W234-M278 HydrophobicContact CZ3-CG 3.82Å; L274-M278 VanDerWaalsContact O-CB 3.31Å; L274-M278 WeakPolarHBondContact O-CB 3.23Å; L274-M278 WeakPolarHBondContact O-CG 3.27Å; L274-M278 PolarHBondContact O-N 3.48Å; M278-A281 PolarHBondContact O-N 3.2Å; M278-I282 WeakPolarHBondContact O-CG1 3.45Å; M278-I282 WeakPolarHBondContact O-CG2 3.49Å; M278-I282 PolarHBondContact O-N 3.03Å; M278-L351 HydrophobicContact CB-CD1 4.05Å
279A95.5Very high92.7Very high0 Ų09.3 Ų9.30%05%0.05CC..Hα-helixtrans-62.4-46.5174.800000111.9G275 H276 E277 A281 I282 L283 A344 V347 L351G275-A279 WeakPolarHBondContact O-CB 3.38Å; G275-A279 PolarHBondContact O-N 3.29Å; H276-A279 WeakPolarHBondContact O-CB 3.26Å; H276-A279 PolarHBondContact O-N 3.14Å; E277-A279 VanDerWaalsContact C-N 3.26Å; E277-A279 PolarHBondContact O-N 2.94Å; A279-A281 PolarHBondContact O-N 2.92Å; A279-I282 PolarHBondContact O-N 3.2Å; A279-L283 HydrophobicContact CB-CD1 4.31Å; A279-L283 VanDerWaalsContact O-CB 3.25Å; A279-L283 WeakPolarHBondContact O-CB 3.41Å; A279-L283 WeakPolarHBondContact O-CD1 3.21Å; A279-L283 WeakPolarHBondContact O-CG 3.21Å; A279-L283 PolarHBondContact O-N 3.45Å; A279-A344 HydrophobicContact CB-CB 4.09Å; A279-V347 HydrophobicContact CB-CB 3.9Å; A279-V347 HydrophobicContact CB-CG1 3.78Å; A279-L351 HydrophobicContact CB-CD1 4.5Å
280H93.1Very high91.8Very high28 Ų2810.3 Ų10.313%0.136%0.059CC..Hα-helixtrans-55.8-38.9175.1-80.7-62.2000113.1H276 E277 H285 E341 H388H276-H280 AromaticContact CD2-NE2 3.43Å; H276-H280 PolarHBondContact CD2-NE2 3.36Å; H276-H280 AromaticContact CE1-CD2 3.76Å; H276-H280 AromaticContact CE1-NE2 2.59Å; H276-H280 PolarHBondContact CE1-NE2 2.87Å; H276-H280 AromaticContact ND1-NE2 3.66Å; H276-H280 AromaticContact NE2-CD2 3.71Å; H276-H280 AromaticContact NE2-NE2 2.41Å; H276-H280 PolarHBondContact NE2-NE2 2.92Å; H276-H280 PolarHBondContact O-CD2 2.99Å; H276-H280 PolarHBondContact O-N 3.16Å; H276-H280 VanDerWaalsContact O-N 3.1Å; E277-H280 PolarHBondContact O-N 2.9Å; H280-H285 AromaticContact CE1-ND1 3.76Å; H280-H285 AromaticContact CG-ND1 3.9Å; H280-H285 AromaticContact ND1-CE1 3.98Å; H280-H285 AromaticContact ND1-CG 3.72Å; H280-H285 AromaticContact ND1-ND1 2.91Å; H280-H285 PolarHBondContact ND1-ND1 3.06Å; H280-H285 PolarHBondContact O-N 3.47Å; H280-H285 VanDerWaalsContact O-N 3.12Å; H280-E341 IonicContact CE1-OE1 3.87Å; H280-E341 PolarHBondContact CE1-OE1 3.5Å; H280-E341 IonicContact CE1-OE2 2.35Å; H280-E341 PolarHBondContact CE1-OE2 3.27Å; H280-E341 IonicContact NE2-OE1 3.95Å; H280-E341 IonicContact NE2-OE2 3.6Å; H280-E341 PolarHBondContact NE2-OE2 3.03Å; H280-H388 AromaticContact NE2-CE1 3.48Å; H280-H388 PolarHBondContact NE2-CE1 3.42Å
281A91.5Very high91.2Very high6 Ų610.3 Ų10.35%0.056%0.059CC..Hα-helixtrans-71.2-48.7178.600000113.1V248 E277 M278 A279 L283 D284V248-A281 HydrophobicContact CB-CB 4.3Å; V248-A281 HydrophobicContact CG1-CB 3.55Å; E277-A281 PolarHBondContact O-N 3.45Å; M278-A281 PolarHBondContact O-N 3.2Å; A279-A281 PolarHBondContact O-N 2.92Å; A281-L283 VanDerWaalsContact C-N 3.29Å; A281-L283 PolarHBondContact O-N 3.41Å; A281-D284 PolarHBondContact O-N 3.35Å
282I93.4Very high90.5Very high3 Ų312.4 Ų12.42%0.0157%0.07CC..Hα-helixtrans-73.6-19.3-178.270.2-178000113.7V168 E228 V229 W234 M278 A279 D284 V347 L351V168-I282 HydrophobicContact CG2-CD1 4.38Å; E228-I282 HydrophobicContact CB-CB 3.88Å; E228-I282 HydrophobicContact CB-CG2 4.28Å; E228-I282 VanDerWaalsContact O-CG2 3.28Å; E228-I282 WeakPolarHBondContact O-CG2 3.33Å; V229-I282 HydrophobicContact CG2-CD1 3.67Å; V229-I282 HydrophobicContact CG2-CG2 4.06Å; W234-I282 HydrophobicContact CH2-CG2 4.05Å; W234-I282 HydrophobicContact CZ2-CG2 4.06Å; M278-I282 WeakPolarHBondContact O-CG1 3.45Å; M278-I282 WeakPolarHBondContact O-CG2 3.49Å; M278-I282 PolarHBondContact O-N 3.03Å; A279-I282 PolarHBondContact O-N 3.2Å; I282-D284 VanDerWaalsContact C-N 3.33Å; I282-V347 HydrophobicContact CD1-CG1 4.15Å; I282-L351 HydrophobicContact CD1-CD1 4.13Å; I282-L351 HydrophobicContact CD1-CD2 4.47Å
283L92.3Very high89.6Confident0 Ų013.5 Ų13.50%08%0.079CC..THydrogen-bonded Turntrans-90.15.9174.6-62.3168.6000113S166 V168 T169 R173 A279 A281 H285 E343 V347S166-L283 WeakPolarHBondContact OG-CD2 3.48Å; V168-L283 HydrophobicContact CB-CD2 3.9Å; V168-L283 HydrophobicContact CG1-CD2 4.46Å; V168-L283 HydrophobicContact CG2-CD2 4.35Å; T169-L283 HydrophobicContact CG2-CD2 3.9Å; R173-L283 VanDerWaalsContact NH1-C 3.29Å; R173-L283 PolarHBondContact NH1-O 3.23Å; A279-L283 HydrophobicContact CB-CD1 4.31Å; A279-L283 VanDerWaalsContact O-CB 3.25Å; A279-L283 WeakPolarHBondContact O-CB 3.41Å; A279-L283 WeakPolarHBondContact O-CD1 3.21Å; A279-L283 WeakPolarHBondContact O-CG 3.21Å; A279-L283 PolarHBondContact O-N 3.45Å; A281-L283 VanDerWaalsContact C-N 3.29Å; A281-L283 PolarHBondContact O-N 3.41Å; L283-H285 VanDerWaalsContact CB-CD2 3.46Å; L283-H285 WeakPolarHBondContact CB-CD2 3.3Å; L283-H285 WeakPolarHBondContact CB-NE2 3.09Å; L283-H285 VanDerWaalsContact CD1-CE1 3.43Å; L283-H285 WeakPolarHBondContact CD1-CE1 3.39Å; L283-H285 PolarHBondContact O-N 3.35Å; L283-H285 VanDerWaalsContact O-N 3.1Å; L283-E343 HydrophobicContact CD1-CG 3.94Å; L283-V347 HydrophobicContact CD1-CB 4.26Å; L283-V347 HydrophobicContact CD1-CG2 4.13Å
284D89.7Confident88.9Confident7 Ų715.4 Ų15.44%0.0379%0.087CC..THydrogen-bonded Turntrans4732.1-174.3-46.7-84000113.8R173 R179 A281 I282 S286 A287 E288R173-D284 IonicContact CZ-OD2 3.34Å; R173-D284 VanDerWaalsContact CZ-OD2 3.29Å; R173-D284 IonicContact NH1-OD2 2.89Å; R173-D284 PolarHBondContact NH1-OD2 2.89Å; R173-D284 IonicContact NH2-OD2 3.54Å; R173-D284 PolarHBondContact NH2-OD2 3.18Å; R179-D284 IonicContact NE-OD1 3.21Å; A281-D284 PolarHBondContact O-N 3.35Å; I282-D284 VanDerWaalsContact C-N 3.33Å; D284-S286 VanDerWaalsContact C-N 3.25Å; D284-S286 PolarHBondContact O-N 2.88Å; D284-S286 VanDerWaalsContact O-N 3.15Å; D284-A287 HydrophobicContact CB-CB 3.94Å; D284-A287 WeakPolarHBondContact O-CA 3.35Å; D284-A287 VanDerWaalsContact O-CB 3.29Å; D284-A287 WeakPolarHBondContact O-CB 3.25Å; D284-A287 PolarHBondContact O-N 2.9Å; D284-E288 PolarHBondContact O-N 3.38Å
285H89.3Confident88.1Confident4 Ų416.8 Ų16.82%0.01910%0.095CC..Hα-helixtrans-58.1-35.4-170.1-78.6173.7000113.6H280 L283 E288 Q289 L340 E343H280-H285 AromaticContact CE1-ND1 3.76Å; H280-H285 AromaticContact CG-ND1 3.9Å; H280-H285 AromaticContact ND1-CE1 3.98Å; H280-H285 AromaticContact ND1-CG 3.72Å; H280-H285 AromaticContact ND1-ND1 2.91Å; H280-H285 PolarHBondContact ND1-ND1 3.06Å; H280-H285 PolarHBondContact O-N 3.47Å; H280-H285 VanDerWaalsContact O-N 3.12Å; L283-H285 VanDerWaalsContact CB-CD2 3.46Å; L283-H285 WeakPolarHBondContact CB-CD2 3.3Å; L283-H285 WeakPolarHBondContact CB-NE2 3.09Å; L283-H285 VanDerWaalsContact CD1-CE1 3.43Å; L283-H285 WeakPolarHBondContact CD1-CE1 3.39Å; L283-H285 PolarHBondContact O-N 3.35Å; L283-H285 VanDerWaalsContact O-N 3.1Å; H285-E288 PolarHBondContact O-N 3.49Å; H285-Q289 WeakPolarHBondContact O-CB 3.39Å; H285-Q289 PolarHBondContact O-N 2.95Å; H285-L340 HydrophobicContact CB-CD1 4.29Å; H285-L340 PolarHBondContact CE1-O 3.02Å; H285-E343 IonicContact CE1-OE2 3.29Å; H285-E343 IonicContact NE2-OE2 2.79Å; H285-E343 PolarHBondContact NE2-OE2 2.98Å; H285-E343 VanDerWaalsContact NE2-OE2 3.12Å
286S83.4Confident87.3Confident40 Ų4018.2 Ų18.228%0.2810%0.104SC..Hα-helixtrans-68.8-32.7174.652.30000112.9Y182 D284 A290Y182-S286 VanDerWaalsContact OH-CB 3.28Å; Y182-S286 WeakPolarHBondContact OH-CB 3.5Å; Y182-S286 PolarHBondContact OH-O 3.27Å; Y182-S286 VanDerWaalsContact OH-O 3.1Å; Y182-S286 PolarHBondContact OH-OG 3.46Å; D284-S286 VanDerWaalsContact C-N 3.25Å; D284-S286 PolarHBondContact O-N 2.88Å; D284-S286 VanDerWaalsContact O-N 3.15Å; S286-A290 WeakPolarHBondContact O-CB 3.37Å; S286-A290 PolarHBondContact O-N 3.36Å
287A84.4Confident86.3Confident4 Ų419 Ų193%0.03311%0.108CC..Hα-helixtrans-71.2-37.2173.100000112.1L175 Y182 D284 S291L175-A287 HydrophobicContact CD2-CB 4.2Å; Y182-A287 HydrophobicContact CD1-CB 3.46Å; Y182-A287 VanDerWaalsContact CD1-CB 3.46Å; Y182-A287 HydrophobicContact CD2-CB 3.92Å; Y182-A287 HydrophobicContact CE1-CB 3.62Å; Y182-A287 HydrophobicContact CE2-CB 4.09Å; Y182-A287 HydrophobicContact CG-CB 3.62Å; D284-A287 HydrophobicContact CB-CB 3.94Å; D284-A287 WeakPolarHBondContact O-CA 3.35Å; D284-A287 VanDerWaalsContact O-CB 3.29Å; D284-A287 WeakPolarHBondContact O-CB 3.25Å; D284-A287 PolarHBondContact O-N 2.9Å; A287-S291 VanDerWaalsContact O-CB 3.27Å; A287-S291 WeakPolarHBondContact O-CB 3.35Å; A287-S291 PolarHBondContact O-N 2.84Å; A287-S291 PolarHBondContact O-OG 3.46Å
288E87.3Confident85.7Confident0 Ų024 Ų240%014%0.135CC..Hα-helixtrans-67.6-48.2175.5-175.1174.5-178.100111.2R171 R173 L175 D284 H285 A290 S291 L292 Y336R171-E288 IonicContact CZ-OE1 2.69Å; R171-E288 IonicContact CZ-OE2 2.67Å; R171-E288 IonicContact NH1-OE1 2.76Å; R171-E288 PolarHBondContact NH1-OE1 3.39Å; R171-E288 IonicContact NH1-OE2 2.7Å; R171-E288 PolarHBondContact NH1-OE2 3.15Å; R171-E288 IonicContact NH2-OE1 3.55Å; R171-E288 IonicContact NH2-OE2 2.66Å; R171-E288 PolarHBondContact NH2-OE2 2.96Å; R173-E288 VanDerWaalsContact CB-CD 3.43Å; R173-E288 HydrophobicContact CB-CG 4.21Å; R173-E288 VanDerWaalsContact CB-OE1 3.24Å; R173-E288 WeakPolarHBondContact CB-OE1 3.04Å; L175-E288 HydrophobicContact CD2-CB 4.14Å; D284-E288 PolarHBondContact O-N 3.38Å; H285-E288 PolarHBondContact O-N 3.49Å; E288-A290 PolarHBondContact O-N 3.39Å; E288-S291 WeakPolarHBondContact O-CB 3.35Å; E288-S291 PolarHBondContact O-N 2.91Å; E288-L292 WeakPolarHBondContact O-CB 3.27Å; E288-L292 PolarHBondContact O-N 2.99Å; E288-Y336 HydrophobicContact CG-CE1 4.15Å; E288-Y336 PolarHBondContact OE1-OH 2.87Å
289Q81.8Confident84.9Confident71 Ų7128.4 Ų28.433%0.33216%0.158SC..Hα-helixtrans-62-41.1174.7-169.5179.79.100111.7H285 S293H285-Q289 WeakPolarHBondContact O-CB 3.39Å; H285-Q289 PolarHBondContact O-N 2.95Å; Q289-S293 WeakPolarHBondContact O-CB 3.29Å; Q289-S293 PolarHBondContact O-N 2.94Å
290A79.1Confident84Confident25 Ų2529.2 Ų29.221%0.20716%0.163CC..Hα-helixtrans-64.1-41.7174.200000112.5F177 Y182 S286 E288 S293 H294F177-A290 HydrophobicContact CD2-CB 4.49Å; F177-A290 HydrophobicContact CE2-CB 4.26Å; Y182-A290 HydrophobicContact CE2-CB 4.01Å; S286-A290 WeakPolarHBondContact O-CB 3.37Å; S286-A290 PolarHBondContact O-N 3.36Å; E288-A290 PolarHBondContact O-N 3.39Å; A290-S293 WeakPolarHBondContact O-CB 3.41Å; A290-S293 PolarHBondContact O-N 2.85Å; A290-H294 PolarHBondContact O-CD2 2.94Å; A290-H294 VanDerWaalsContact O-CD2 3.31Å; A290-H294 PolarHBondContact O-N 3.44Å
291S84.8Confident83.5Confident0 Ų029.1 Ų29.10%016%0.164CC..Hα-helixtrans-61.1-49.8176.6-67.60000111.7L174 V176 A287 E288 H294 V295L174-S291 WeakPolarHBondContact O-CB 3.28Å; V176-S291 PolarHBondContact N-OG 3.39Å; A287-S291 VanDerWaalsContact O-CB 3.27Å; A287-S291 WeakPolarHBondContact O-CB 3.35Å; A287-S291 PolarHBondContact O-N 2.84Å; A287-S291 PolarHBondContact O-OG 3.46Å; E288-S291 WeakPolarHBondContact O-CB 3.35Å; E288-S291 PolarHBondContact O-N 2.91Å; S291-H294 PolarHBondContact O-N 2.88Å; S291-V295 PolarHBondContact O-N 2.94Å
292L82.2Confident83.1Confident49 Ų4934.4 Ų34.426%0.25719%0.19SC..Hα-helixtrans-66.3-41.1179.6-153.9159.3000111E288 H294 V295 V296 Y336E288-L292 WeakPolarHBondContact O-CB 3.27Å; E288-L292 PolarHBondContact O-N 2.99Å; L292-H294 VanDerWaalsContact C-N 3.3Å; L292-H294 PolarHBondContact O-N 3.43Å; L292-V295 PolarHBondContact O-N 2.96Å; L292-V296 HydrophobicContact CD2-CG2 3.84Å; L292-V296 WeakPolarHBondContact O-CG2 3.2Å; L292-V296 PolarHBondContact O-N 2.9Å; L292-Y336 HydrophobicContact CD1-CD1 3.94Å; L292-Y336 HydrophobicContact CD1-CD2 3.9Å; L292-Y336 HydrophobicContact CD1-CE1 3.6Å; L292-Y336 HydrophobicContact CD1-CE2 3.52Å; L292-Y336 HydrophobicContact CD1-CG 4.07Å
293S78.4Confident82.5Confident29 Ų2938.2 Ų38.220%0.20321%0.213CC..Hα-helixtrans-54.6-43.1172.6171.30000112.6Q289 A290 V296 D297 M331Q289-S293 WeakPolarHBondContact O-CB 3.29Å; Q289-S293 PolarHBondContact O-N 2.94Å; A290-S293 WeakPolarHBondContact O-CB 3.41Å; A290-S293 PolarHBondContact O-N 2.85Å; S293-V296 PolarHBondContact O-N 2.83Å; S293-D297 WeakPolarHBondContact O-CB 3.38Å; S293-D297 PolarHBondContact O-N 2.82Å; S293-M331 VanDerWaalsContact OG-CE 3.28Å; S293-M331 WeakPolarHBondContact OG-CE 3.31Å
294H79Confident81.9Confident43 Ų4339.8 Ų39.820%0.19922%0.223CC..Hα-helixtrans-69.9-34.2178.5-83.8-138.3000113.7W100 K104 F177 A290 S291 L292 L298W100-H294 AromaticContact CD1-CE1 3.64Å; W100-H294 AromaticContact CE2-CE1 3.61Å; W100-H294 AromaticContact CE2-ND1 3.91Å; W100-H294 AromaticContact CZ2-ND1 3.84Å; W100-H294 AromaticContact NE1-CE1 2.95Å; W100-H294 PolarHBondContact NE1-CE1 3.41Å; W100-H294 AromaticContact NE1-ND1 3.58Å; W100-H294 AromaticContact NE1-NE2 3.61Å; K104-H294 PolarHBondContact NZ-NE2 2.91Å; F177-H294 AromaticContact CZ-CE1 3.57Å; F177-H294 AromaticContact CZ-ND1 3.44Å; F177-H294 WeakPolarHBondContact CZ-ND1 3.37Å; A290-H294 PolarHBondContact O-CD2 2.94Å; A290-H294 VanDerWaalsContact O-CD2 3.31Å; A290-H294 PolarHBondContact O-N 3.44Å; S291-H294 PolarHBondContact O-N 2.88Å; L292-H294 VanDerWaalsContact C-N 3.3Å; L292-H294 PolarHBondContact O-N 3.43Å; H294-L298 WeakPolarHBondContact O-CB 3.47Å; H294-L298 PolarHBondContact O-N 2.86Å; H294-L298 VanDerWaalsContact O-N 3.08Å
295V81.8Confident81.7Confident30 Ų3040.7 Ų40.718%0.18223%0.229CC..Hα-helixtrans-66.2-43.2172.2175.80000110.7L159 L174 V176 S291 L292 L298 L299L159-V295 HydrophobicContact CD2-CG1 4.4Å; L159-V295 HydrophobicContact CD2-CG2 3.91Å; L174-V295 HydrophobicContact CD2-CG2 4.2Å; V176-V295 HydrophobicContact CG2-CG2 3.92Å; S291-V295 PolarHBondContact O-N 2.94Å; L292-V295 PolarHBondContact O-N 2.96Å; V295-L298 PolarHBondContact O-N 3.26Å; V295-L299 HydrophobicContact CG1-CD1 4.09Å; V295-L299 WeakPolarHBondContact O-CG 3.28Å; V295-L299 PolarHBondContact O-N 3.1Å
296V79.4Confident81.5Confident30 Ų3042.6 Ų42.618%0.18225%0.245CC..Hα-helixtrans-65.6-42.2178.1168.90000111.7L292 S293 L298 L299 S300 L327 M331L292-V296 HydrophobicContact CD2-CG2 3.84Å; L292-V296 WeakPolarHBondContact O-CG2 3.2Å; L292-V296 PolarHBondContact O-N 2.9Å; S293-V296 PolarHBondContact O-N 2.83Å; V296-L298 VanDerWaalsContact C-N 3.35Å; V296-L298 PolarHBondContact O-N 2.87Å; V296-L299 PolarHBondContact O-N 3.21Å; V296-S300 PolarHBondContact O-N 3.05Å; V296-L327 HydrophobicContact CG1-CD1 3.37Å; V296-L327 HydrophobicContact CG1-CG 4.1Å; V296-M331 HydrophobicContact CB-CE 4.33Å; V296-M331 HydrophobicContact CB-SD 3.69Å; V296-M331 HydrophobicContact CG1-CE 4.1Å; V296-M331 HydrophobicContact CG1-CG 4.17Å; V296-M331 HydrophobicContact CG1-SD 3.53Å; V296-M331 VanDerWaalsContact CG1-SD 3.53Å; V296-M331 HydrophobicContact CG2-SD 4.11Å
297D76.2Confident81.5Confident21 Ų2142.2 Ų42.211%0.11224%0.24CC..Hα-helixtrans-60-43.2173.8-119.3-19.7000111.4K104 K108 S293 S300K104-D297 VanDerWaalsContact CE-OD2 3.28Å; K104-D297 WeakPolarHBondContact CE-OD2 3.42Å; K104-D297 IonicContact NZ-OD2 3.52Å; K104-D297 PolarHBondContact NZ-OD2 2.88Å; K108-D297 VanDerWaalsContact CE-OD1 3.32Å; K108-D297 WeakPolarHBondContact CE-OD1 3.49Å; K108-D297 IonicContact NZ-OD1 2.7Å; K108-D297 PolarHBondContact NZ-OD1 3Å; S293-D297 WeakPolarHBondContact O-CB 3.38Å; S293-D297 PolarHBondContact O-N 2.82Å; D297-S300 WeakPolarHBondContact O-CB 3.44Å; D297-S300 PolarHBondContact O-N 2.89Å; D297-S300 PolarHBondContact O-OG 2.96Å
298L80.2Confident81.4Confident113 Ų11343.2 Ų43.259%0.59224%0.243SC*.Hα-helixtrans-63.8-44.3178.2-179.563.3000112.1H294 V295 V296 S300 L301H294-L298 WeakPolarHBondContact O-CB 3.47Å; H294-L298 PolarHBondContact O-N 2.86Å; H294-L298 VanDerWaalsContact O-N 3.08Å; V295-L298 PolarHBondContact O-N 3.26Å; V296-L298 VanDerWaalsContact C-N 3.35Å; V296-L298 PolarHBondContact O-N 2.87Å; L298-S300 VanDerWaalsContact C-N 3.29Å; L298-S300 PolarHBondContact O-N 3.35Å; L298-L301 HydrophobicContact CD1-CD1 4.35Å; L298-L301 WeakPolarHBondContact O-CB 3.39Å; L298-L301 PolarHBondContact O-N 2.97Å
299L79.8Confident81.3Confident93 Ų9344.5 Ų44.549%0.48725%0.254SS..Hα-helixtrans-64.3-33.9175.3-69.1171.1000111.9V295 V296 L301 I302V295-L299 HydrophobicContact CG1-CD1 4.09Å; V295-L299 WeakPolarHBondContact O-CG 3.28Å; V295-L299 PolarHBondContact O-N 3.1Å; V296-L299 PolarHBondContact O-N 3.21Å; L299-L301 PolarHBondContact O-N 2.9Å; L299-I302 HydrophobicContact CD2-CD1 4.38Å; L299-I302 WeakPolarHBondContact O-CB 3.46Å; L299-I302 PolarHBondContact O-N 3.42Å; L299-I302 VanDerWaalsContact O-N 3.13Å
300S76.6Confident81.4Confident17 Ų1747.7 Ų47.712%0.11927%0.272CS..Hα-helixtrans-59.3-31.7177.785.70000112.9V296 D297 L298 I302 V303 V304V296-S300 PolarHBondContact O-N 3.05Å; D297-S300 WeakPolarHBondContact O-CB 3.44Å; D297-S300 PolarHBondContact O-N 2.89Å; D297-S300 PolarHBondContact O-OG 2.96Å; L298-S300 VanDerWaalsContact C-N 3.29Å; L298-S300 PolarHBondContact O-N 3.35Å; S300-I302 VanDerWaalsContact C-N 3.27Å; S300-I302 PolarHBondContact O-N 3.49Å; S300-V303 PolarHBondContact O-N 3Å; S300-V303 VanDerWaalsContact O-N 3.17Å; S300-V304 WeakPolarHBondContact O-CB 3.34Å; S300-V304 WeakPolarHBondContact O-CG2 3.24Å; S300-V304 PolarHBondContact O-N 3.37Å
301L81.9Confident81.5Confident27 Ų2749.2 Ų49.214%0.14128%0.28CS..Hα-helixtrans-62.3-33.6178.4-59.5179.7000112.4Q107 K108 A111 L298 L299 T305Q107-L301 HydrophobicContact CB-CD1 4.02Å; Q107-L301 HydrophobicContact CB-CD2 4.26Å; K108-L301 HydrophobicContact CB-CD2 4.47Å; K108-L301 HydrophobicContact CG-CD2 3.67Å; A111-L301 HydrophobicContact CB-CB 4.44Å; A111-L301 HydrophobicContact CB-CD2 4.29Å; L298-L301 HydrophobicContact CD1-CD1 4.35Å; L298-L301 WeakPolarHBondContact O-CB 3.39Å; L298-L301 PolarHBondContact O-N 2.97Å; L299-L301 PolarHBondContact O-N 2.9Å; L301-T305 WeakPolarHBondContact O-CB 3.45Å; L301-T305 PolarHBondContact O-N 2.67Å; L301-T305 PolarHBondContact O-OG1 2.95Å
302I83.6Confident80.8Confident116 Ų11654.7 Ų54.760%0.59532%0.316SS*.Hα-helixtrans-67.5-46.6176.3-54.5176000109.5L299 S300 T305 A306L299-I302 HydrophobicContact CD2-CD1 4.38Å; L299-I302 WeakPolarHBondContact O-CB 3.46Å; L299-I302 PolarHBondContact O-N 3.42Å; L299-I302 VanDerWaalsContact O-N 3.13Å; S300-I302 VanDerWaalsContact C-N 3.27Å; S300-I302 PolarHBondContact O-N 3.49Å; I302-T305 PolarHBondContact O-N 2.66Å; I302-A306 WeakPolarHBondContact O-CB 3.27Å; I302-A306 PolarHBondContact O-N 3.12Å
303V80.6Confident80Confident83 Ų8354.4 Ų54.450%0.50333%0.325SS..Hα-helixtrans-63.1-46.9179-178.90000110.9S300 T305 A306 I307S300-V303 PolarHBondContact O-N 3Å; S300-V303 VanDerWaalsContact O-N 3.17Å; V303-T305 PolarHBondContact O-N 2.8Å; V303-A306 PolarHBondContact O-N 3.14Å; V303-I307 HydrophobicContact CG1-CD1 3.82Å; V303-I307 WeakPolarHBondContact O-CD1 3.36Å; V303-I307 VanDerWaalsContact O-CG1 3.31Å; V303-I307 WeakPolarHBondContact O-CG1 3.35Å; V303-I307 PolarHBondContact O-N 3.3Å
304V81.1Confident79.1Confident34 Ų3458 Ų5821%0.20634%0.342CS..Hα-helixtrans-58.8-46.3174.9170.20000111A111 I112 S300 A306 I307 W308A111-V304 HydrophobicContact CB-CG1 4.06Å; I112-V304 HydrophobicContact CG1-CG1 3.85Å; S300-V304 WeakPolarHBondContact O-CB 3.34Å; S300-V304 WeakPolarHBondContact O-CG2 3.24Å; S300-V304 PolarHBondContact O-N 3.37Å; V304-A306 VanDerWaalsContact C-N 3.34Å; V304-A306 PolarHBondContact O-N 3.04Å; V304-I307 PolarHBondContact O-N 3.18Å; V304-W308 VanDerWaalsContact O-CD1 3.27Å; V304-W308 PolarHBondContact O-N 2.8Å
305T85.4Confident78Confident25 Ų2558.2 Ų58.215%0.15335%0.348CS..Hα-helixtrans-61.4-41.9177.4-56.50000111.5A111 L114 L118 L301 I302 V303 W308 A309A111-T305 WeakPolarHBondContact CB-OG1 3.43Å; L114-T305 HydrophobicContact CB-CG2 4.32Å; L114-T305 HydrophobicContact CD2-CG2 3.91Å; L114-T305 HydrophobicContact CG-CG2 3.94Å; L118-T305 HydrophobicContact CD1-CG2 4.43Å; L301-T305 WeakPolarHBondContact O-CB 3.45Å; L301-T305 PolarHBondContact O-N 2.67Å; L301-T305 PolarHBondContact O-OG1 2.95Å; I302-T305 PolarHBondContact O-N 2.66Å; V303-T305 PolarHBondContact O-N 2.8Å; T305-W308 PolarHBondContact O-N 3.36Å; T305-A309 WeakPolarHBondContact O-CB 3.46Å; T305-A309 PolarHBondContact O-N 3.32Å
306A84.4Confident76.7Confident44 Ų4462.2 Ų62.236%0.36437%0.368SS..Hα-helixtrans-65.8-45.3179.200000112.4I302 V303 V304 W308 A309 L310I302-A306 WeakPolarHBondContact O-CB 3.27Å; I302-A306 PolarHBondContact O-N 3.12Å; V303-A306 PolarHBondContact O-N 3.14Å; V304-A306 VanDerWaalsContact C-N 3.34Å; V304-A306 PolarHBondContact O-N 3.04Å; A306-W308 VanDerWaalsContact C-N 3.31Å; A306-W308 PolarHBondContact O-N 3.31Å; A306-A309 PolarHBondContact O-N 3.37Å; A306-A309 VanDerWaalsContact O-N 3.16Å; A306-L310 WeakPolarHBondContact O-CB 3.41Å; A306-L310 VanDerWaalsContact O-CG 3.31Å; A306-L310 WeakPolarHBondContact O-CG 3.46Å; A306-L310 PolarHBondContact O-N 3.44Å
307I82.8Confident75.5Confident33 Ų3364.7 Ų64.717%0.16939%0.392CS..Hα-helixtrans-55.1-48.8172.6-71.9160.6000110.3V303 V304 A309 L310 C311 V319V303-I307 HydrophobicContact CG1-CD1 3.82Å; V303-I307 WeakPolarHBondContact O-CD1 3.36Å; V303-I307 VanDerWaalsContact O-CG1 3.31Å; V303-I307 WeakPolarHBondContact O-CG1 3.35Å; V303-I307 PolarHBondContact O-N 3.3Å; V304-I307 PolarHBondContact O-N 3.18Å; I307-A309 VanDerWaalsContact C-N 3.31Å; I307-A309 PolarHBondContact O-N 3.46Å; I307-L310 PolarHBondContact O-N 2.73Å; I307-C311 PolarHBondContact O-N 3.32Å; I307-V319 HydrophobicContact CD1-CG1 3.78Å; I307-V319 HydrophobicContact CG1-CG1 4.42Å; I307-V319 HydrophobicContact CG2-CG1 3.84Å
308W82.3Confident74.3Confident24 Ų2470.6 Ų70.69%0.09142%0.423CS..Hα-helixtrans-71.2-23.4179.9-80.7100.3000113.8I112 G115 R116 R119 V304 T305 A306 L316I112-W308 HydrophobicContact CB-CG 4.49Å; I112-W308 HydrophobicContact CG2-CD2 3.94Å; I112-W308 HydrophobicContact CG2-CE3 4.46Å; I112-W308 HydrophobicContact CG2-CG 4.24Å; I112-W308 HydrophobicContact CG2-CZ2 4.07Å; G115-W308 VanDerWaalsContact C-C 3.49Å; G115-W308 CarbonylContact C-O 3.56Å; G115-W308 VanDerWaalsContact C-O 3.27Å; G115-W308 CarbonylContact O-C 3.58Å; R116-W308 HydrophobicContact CG-CD2 4.2Å; R116-W308 HydrophobicContact CG-CE3 3.38Å; R116-W308 HydrophobicContact CG-CZ3 3.77Å; R116-W308 VanDerWaalsContact NH1-CH2 3.26Å; R119-W308 PolarHBondContact NE-O 3.13Å; R119-W308 PolarHBondContact NH2-O 2.88Å; V304-W308 VanDerWaalsContact O-CD1 3.27Å; V304-W308 PolarHBondContact O-N 2.8Å; T305-W308 PolarHBondContact O-N 3.36Å; A306-W308 VanDerWaalsContact C-N 3.31Å; A306-W308 PolarHBondContact O-N 3.31Å; W308-L316 HydrophobicContact CH2-CD1 3.61Å; W308-L316 HydrophobicContact CZ2-CD1 3.54Å
309A86.1Confident73.2Confident28 Ų2867.2 Ų67.223%0.23141%0.407CS..Hα-helixtrans-74.4-36.8169.900000113G115 L118 R119 T305 A306 I307G115-A309 WeakPolarHBondContact O-CA 3.49Å; L118-A309 HydrophobicContact CB-CB 4.32Å; R119-A309 WeakPolarHBondContact CB-O 3.29Å; T305-A309 WeakPolarHBondContact O-CB 3.46Å; T305-A309 PolarHBondContact O-N 3.32Å; A306-A309 PolarHBondContact O-N 3.37Å; A306-A309 VanDerWaalsContact O-N 3.16Å; I307-A309 VanDerWaalsContact C-N 3.31Å; I307-A309 PolarHBondContact O-N 3.46Å
310L83.7Confident72Confident137 Ų13764.9 Ų64.972%0.71741%0.405SS*.Hα-helixtrans-101.2-40.8-165.6-63.8173.7000115.6A306 I307 P312A306-L310 WeakPolarHBondContact O-CB 3.41Å; A306-L310 VanDerWaalsContact O-CG 3.31Å; A306-L310 WeakPolarHBondContact O-CG 3.46Å; A306-L310 PolarHBondContact O-N 3.44Å; I307-L310 PolarHBondContact O-N 2.73Å; L310-P312 VanDerWaalsContact O-CD 3.25Å; L310-P312 WeakPolarHBondContact O-CD 3.5Å
311C81Confident71Confident57 Ų5765.1 Ų65.139%0.38541%0.41SS..  trans-94.6104.1-164.7-60.50000112.9R119 I307R119-C311 PolarHBondContact NH1-O 3.3Å; R119-C311 PolarHBondContact NH2-O 3.37Å; I307-C311 PolarHBondContact O-N 3.32Å
312P69.7Low69.9Low116 Ų11671.7 Ų71.775%0.75343%0.433SS*.  trans-63144.5-178.827.7-35.4000112.6L310L310-P312 VanDerWaalsContact O-CD 3.25Å; L310-P312 WeakPolarHBondContact O-CD 3.5Å
313G65.8Low68.6Low43 Ų4367.7 Ų67.744%0.44342%0.417SS..SBendtrans107.7164.4-17300000113.4R119R119-G313 PolarHBondContact NH1-O 3.01Å; R119-G313 VanDerWaalsContact NH1-O 3.14Å
314D60.3Low67.3Low104 Ų10469.5 Ų69.556%0.55642%0.418SS*.  trans-9759.5169.9-84.7-66.5000109.3R116 L316R116-D314 IonicContact CZ-OD1 2.84Å; R116-D314 IonicContact NH1-OD1 3.13Å; R116-D314 PolarHBondContact NH1-OD1 3.35Å; R116-D314 IonicContact NH2-OD1 2.65Å; R116-D314 PolarHBondContact NH2-OD1 2.85Å; R116-D314 IonicContact NH2-OD2 2.76Å; R116-D314 PolarHBondContact NH2-OD2 3.29Å; R116-D314 VanDerWaalsContact NH2-OD2 3.13Å; D314-L316 PolarHBondContact O-N 2.86Å
315S56.1Low66.1Low47 Ų4771.7 Ų71.733%0.32943%0.429SS..  trans-74.743.6-178.761.20000113A317 V319S315-A317 VanDerWaalsContact C-N 3.35Å; S315-A317 PolarHBondContact O-N 3.36Å; S315-V319 PolarHBondContact O-N 3Å
316L54.2Low64.6Low115 Ų11574.4 Ų74.460%0.60244%0.438SS*.Hα-helixtrans-53.9-48.2-172.7-131.282.5000111.9W308 D314 G320W308-L316 HydrophobicContact CH2-CD1 3.61Å; W308-L316 HydrophobicContact CZ2-CD1 3.54Å; D314-L316 PolarHBondContact O-N 2.86Å; L316-G320 VanDerWaalsContact O-CA 3.29Å; L316-G320 WeakPolarHBondContact O-CA 3.31Å; L316-G320 PolarHBondContact O-N 3.33Å
317A53.6Low63.1Low82 Ų8274.4 Ų74.468%0.67843%0.432SS*.Hα-helixtrans-69.9-54.7-174.200000112.4S315 V319 G321S315-A317 VanDerWaalsContact C-N 3.35Å; S315-A317 PolarHBondContact O-N 3.36Å; A317-V319 PolarHBondContact O-N 2.98Å; A317-G321 PolarHBondContact O-N 2.92Å
318L51.8Low61.7Low145 Ų14575.8 Ų75.876%0.75944%0.442SS*.Hα-helixtrans-62.8-47.5-175-111.975.2000112.3W322L318-W322 WeakPolarHBondContact O-CB 3.26Å; L318-W322 PolarHBondContact O-N 2.98Å
319V55.8Low60.2Low42 Ų4278.7 Ų78.726%0.25546%0.457SS..Hα-helixtrans-86.4-31.4-174-166.40000111.7I307 S315 A317 A323I307-V319 HydrophobicContact CD1-CG1 3.78Å; I307-V319 HydrophobicContact CG1-CG1 4.42Å; I307-V319 HydrophobicContact CG2-CG1 3.84Å; S315-V319 PolarHBondContact O-N 3Å; A317-V319 PolarHBondContact O-N 2.98Å; V319-A323 WeakPolarHBondContact O-CB 3.41Å; V319-A323 PolarHBondContact O-N 3.4Å
320G55.8Low58.4Low44 Ų4481.9 Ų81.945%0.45447%0.469SS..Hα-helixtrans-65.4-44.2171.700000112.3L316 K324L316-G320 VanDerWaalsContact O-CA 3.29Å; L316-G320 WeakPolarHBondContact O-CA 3.31Å; L316-G320 PolarHBondContact O-N 3.33Å; G320-K324 WeakPolarHBondContact O-CB 3.5Å; G320-K324 PolarHBondContact O-N 2.86Å; G320-K324 VanDerWaalsContact O-N 3.11Å
321G55.4Low56.7Low22 Ų2277.1 Ų77.123%0.22744%0.444CS..Hα-helixtrans-61.3-67.2170.900000111.1A317 A323 K324 D325A317-G321 PolarHBondContact O-N 2.92Å; G321-A323 VanDerWaalsContact C-N 3.3Å; G321-A323 PolarHBondContact O-N 3.35Å; G321-A323 VanDerWaalsContact O-N 3.14Å; G321-K324 CarbonylContact O-C 3.49Å; G321-K324 PolarHBondContact O-N 3.01Å; G321-D325 WeakPolarHBondContact O-CB 3.34Å; G321-D325 PolarHBondContact O-N 2.97Å; G321-D325 VanDerWaalsContact O-OD2 3.07Å
322W57.8Low55.2Low165 Ų16578.8 Ų78.863%0.62545%0.445SS*.Hα-helixtrans-52.5-43-176179.487.5000113.7L318 K326L318-W322 WeakPolarHBondContact O-CB 3.26Å; L318-W322 PolarHBondContact O-N 2.98Å; W322-K326 HydrophobicContact CZ2-CG 4.28Å; W322-K326 WeakPolarHBondContact O-CB 3.33Å; W322-K326 PolarHBondContact O-N 3.25Å
323A57.3Low54.3Low31 Ų3177.9 Ų77.926%0.25643%0.433SS..Hα-helixtrans-70.8-39.5178.600000112.1V319 G321 L327V319-A323 WeakPolarHBondContact O-CB 3.41Å; V319-A323 PolarHBondContact O-N 3.4Å; G321-A323 VanDerWaalsContact C-N 3.3Å; G321-A323 PolarHBondContact O-N 3.35Å; G321-A323 VanDerWaalsContact O-N 3.14Å; A323-L327 WeakPolarHBondContact O-CB 3.49Å; A323-L327 PolarHBondContact O-N 3.04Å
324K52.9Low54Low121 Ų12179.5 Ų79.553%0.52643%0.43SS..Hα-helixtrans-63.1-48.8173.3-173.9-165.567.964.90110.4G320 G321 L327 T328G320-K324 WeakPolarHBondContact O-CB 3.5Å; G320-K324 PolarHBondContact O-N 2.86Å; G320-K324 VanDerWaalsContact O-N 3.11Å; G321-K324 CarbonylContact O-C 3.49Å; G321-K324 PolarHBondContact O-N 3.01Å; K324-L327 WeakPolarHBondContact O-CB 3.41Å; K324-L327 PolarHBondContact O-N 3.45Å; K324-L327 VanDerWaalsContact O-N 3.17Å; K324-T328 WeakPolarHBondContact O-CB 3.47Å; K324-T328 PolarHBondContact O-N 3.22Å; K324-T328 PolarHBondContact O-OG1 2.76Å; K324-T328 VanDerWaalsContact O-OG1 3.05Å
325D55.8Low53.9Low80 Ų8077.9 Ų77.943%0.42842%0.424SS..Hα-helixtrans-69.9-40.9-172.8-59.9-33.5000111.4G321 L327 T328 E329G321-D325 WeakPolarHBondContact O-CB 3.34Å; G321-D325 PolarHBondContact O-N 2.97Å; G321-D325 VanDerWaalsContact O-OD2 3.07Å; D325-L327 VanDerWaalsContact C-N 3.34Å; D325-L327 PolarHBondContact O-N 3.32Å; D325-T328 PolarHBondContact O-N 3.27Å; D325-E329 VanDerWaalsContact O-CB 3.31Å; D325-E329 WeakPolarHBondContact O-CB 3.27Å; D325-E329 PolarHBondContact O-N 3.25Å
326K54.5Low54.5Low82 Ų8278.6 Ų78.636%0.35742%0.421SS..Hα-helixtrans-68-29.6169.9-83.5-66.3-179.5-150.50113.5W322 E329 L330W322-K326 HydrophobicContact CZ2-CG 4.28Å; W322-K326 WeakPolarHBondContact O-CB 3.33Å; W322-K326 PolarHBondContact O-N 3.25Å; K326-E329 WeakPolarHBondContact CD-OE2 3.39Å; K326-E329 WeakPolarHBondContact CE-OE2 3.36Å; K326-E329 IonicContact NZ-OE1 3.84Å; K326-E329 PolarHBondContact NZ-OE1 2.87Å; K326-E329 IonicContact NZ-OE2 2.71Å; K326-E329 PolarHBondContact NZ-OE2 3.27Å; K326-L330 WeakPolarHBondContact O-CB 3.34Å; K326-L330 PolarHBondContact O-N 3.41Å
327L53.4Low55.5Low45 Ų4573.5 Ų73.524%0.23639%0.394CS..Hα-helixtrans-69.5-45.4172.8-161.572.1000110.8V296 A323 K324 D325 L330 M331V296-L327 HydrophobicContact CG1-CD1 3.37Å; V296-L327 HydrophobicContact CG1-CG 4.1Å; A323-L327 WeakPolarHBondContact O-CB 3.49Å; A323-L327 PolarHBondContact O-N 3.04Å; K324-L327 WeakPolarHBondContact O-CB 3.41Å; K324-L327 PolarHBondContact O-N 3.45Å; K324-L327 VanDerWaalsContact O-N 3.17Å; D325-L327 VanDerWaalsContact C-N 3.34Å; D325-L327 PolarHBondContact O-N 3.32Å; L327-L330 PolarHBondContact O-N 2.83Å; L327-M331 WeakPolarHBondContact O-CB 3.3Å; L327-M331 WeakPolarHBondContact O-CG 3.5Å; L327-M331 PolarHBondContact O-N 3.42Å
328T51.5Low56.7Low61 Ų6174.5 Ų74.537%0.37438%0.381SS..Hα-helixtrans-58.2-47.7173-61.90000110.4K324 D325 L330 M331 F332K324-T328 WeakPolarHBondContact O-CB 3.47Å; K324-T328 PolarHBondContact O-N 3.22Å; K324-T328 PolarHBondContact O-OG1 2.76Å; K324-T328 VanDerWaalsContact O-OG1 3.05Å; D325-T328 PolarHBondContact O-N 3.27Å; T328-L330 PolarHBondContact O-N 2.87Å; T328-M331 PolarHBondContact O-N 3Å; T328-M331 VanDerWaalsContact O-N 3.1Å; T328-F332 HydrophobicContact CG2-CD2 3.71Å; T328-F332 HydrophobicContact CG2-CE2 4.23Å; T328-F332 VanDerWaalsContact O-CD2 3.31Å; T328-F332 WeakPolarHBondContact O-CD2 3.35Å; T328-F332 PolarHBondContact O-N 3.36Å
329E51.4Low58.2Low86 Ų8674 Ų7440%0.40237%0.372SS..Hα-helixtrans-59.7-41.9174.4-167.5-170.4129.800112.2D325 K326 M331 N333D325-E329 VanDerWaalsContact O-CB 3.31Å; D325-E329 WeakPolarHBondContact O-CB 3.27Å; D325-E329 PolarHBondContact O-N 3.25Å; K326-E329 WeakPolarHBondContact CD-OE2 3.39Å; K326-E329 WeakPolarHBondContact CE-OE2 3.36Å; K326-E329 IonicContact NZ-OE1 3.84Å; K326-E329 PolarHBondContact NZ-OE1 2.87Å; K326-E329 IonicContact NZ-OE2 2.71Å; K326-E329 PolarHBondContact NZ-OE2 3.27Å; E329-M331 VanDerWaalsContact C-N 3.26Å; E329-M331 PolarHBondContact O-N 3.13Å; E329-N333 HydrophobicContact CG-CB 4.32Å; E329-N333 WeakPolarHBondContact O-CA 3.46Å; E329-N333 WeakPolarHBondContact O-CB 3.32Å; E329-N333 PolarHBondContact O-N 2.89Å
330L48.2Very low59.7Low95 Ų9572.2 Ų72.250%0.49736%0.361SS..Hα-helixtrans-67.8-20.9175.4-114.885000114.4K326 L327 T328 H334K326-L330 WeakPolarHBondContact O-CB 3.34Å; K326-L330 PolarHBondContact O-N 3.41Å; L327-L330 PolarHBondContact O-N 2.83Å; T328-L330 PolarHBondContact O-N 2.87Å; L330-H334 VanDerWaalsContact O-CB 3.23Å; L330-H334 WeakPolarHBondContact O-CB 3.44Å; L330-H334 PolarHBondContact O-CD2 3.25Å; L330-H334 VanDerWaalsContact O-CD2 3.26Å
331M47.5Very low61.2Low37 Ų3770.5 Ų70.518%0.18234%0.341CS..Hα-helixtrans-100.9-33.4-173.7-66.3-103.9-93.300112.3S293 V296 L327 T328 E329S293-M331 VanDerWaalsContact OG-CE 3.28Å; S293-M331 WeakPolarHBondContact OG-CE 3.31Å; V296-M331 HydrophobicContact CB-CE 4.33Å; V296-M331 HydrophobicContact CB-SD 3.69Å; V296-M331 HydrophobicContact CG1-CE 4.1Å; V296-M331 HydrophobicContact CG1-CG 4.17Å; V296-M331 HydrophobicContact CG1-SD 3.53Å; V296-M331 VanDerWaalsContact CG1-SD 3.53Å; V296-M331 HydrophobicContact CG2-SD 4.11Å; L327-M331 WeakPolarHBondContact O-CB 3.3Å; L327-M331 WeakPolarHBondContact O-CG 3.5Å; L327-M331 PolarHBondContact O-N 3.42Å; T328-M331 PolarHBondContact O-N 3Å; T328-M331 VanDerWaalsContact O-N 3.1Å; E329-M331 VanDerWaalsContact C-N 3.26Å; E329-M331 PolarHBondContact O-N 3.13Å
332F50Low62.8Low91 Ų9170.6 Ų70.640%0.39934%0.34SS..Hα-helixtrans-110.8-25.7-173.8-61.7-76.2000113.7T328 T387T328-F332 HydrophobicContact CG2-CD2 3.71Å; T328-F332 HydrophobicContact CG2-CE2 4.23Å; T328-F332 VanDerWaalsContact O-CD2 3.31Å; T328-F332 WeakPolarHBondContact O-CD2 3.35Å; T328-F332 PolarHBondContact O-N 3.36Å; F332-T387 HydrophobicContact CB-CG2 4.22Å; F332-T387 HydrophobicContact CD1-CG2 3.86Å; F332-T387 WeakPolarHBondContact O-CB 3.32Å
333N51.5Low64.5Low97 Ų9763.6 Ų63.652%0.51931%0.314SS..SBendtrans-102.711.9176.5-67-19.5000113.5E329 R338E329-N333 HydrophobicContact CG-CB 4.32Å; E329-N333 WeakPolarHBondContact O-CA 3.46Å; E329-N333 WeakPolarHBondContact O-CB 3.32Å; E329-N333 PolarHBondContact O-N 2.89Å; N333-R338 PolarHBondContact O-NH1 2.98Å
334H60Low66.2Low78 Ų7862.1 Ų62.136%0.36130%0.302SS..SBendtrans-75.9153.3-170.7-139.1-118.7000112.9L330 Y336 S337 R338L330-H334 VanDerWaalsContact O-CB 3.23Å; L330-H334 WeakPolarHBondContact O-CB 3.44Å; L330-H334 PolarHBondContact O-CD2 3.25Å; L330-H334 VanDerWaalsContact O-CD2 3.26Å; H334-Y336 PolarHBondContact O-N 3.18Å; H334-S337 PolarHBondContact O-N 2.87Å; H334-S337 PolarHBondContact O-OG 3.35Å; H334-R338 PolarHBondContact O-NH1 3.31Å
335P57.8Low68.1Low69 Ų6956.5 Ų56.545%0.44828%0.278SS..THydrogen-bonded Turntrans-61.53.4164.927-36.8000114.4K339P335-K339 WeakPolarHBondContact O-CG 2.98Å
336Y68.1Low70Confident63 Ų6356.2 Ų56.225%0.24727%0.274CS..THydrogen-bonded Turntrans-82-51.9171.7-157.5-88.6000112.2E288 L292 H334 R338 K339 L340E288-Y336 HydrophobicContact CG-CE1 4.15Å; E288-Y336 PolarHBondContact OE1-OH 2.87Å; L292-Y336 HydrophobicContact CD1-CD1 3.94Å; L292-Y336 HydrophobicContact CD1-CD2 3.9Å; L292-Y336 HydrophobicContact CD1-CE1 3.6Å; L292-Y336 HydrophobicContact CD1-CE2 3.52Å; L292-Y336 HydrophobicContact CD1-CG 4.07Å; H334-Y336 PolarHBondContact O-N 3.18Å; Y336-R338 PolarHBondContact O-N 3.48Å; Y336-K339 WeakPolarHBondContact O-CA 3.5Å; Y336-K339 WeakPolarHBondContact O-CB 3.06Å; Y336-K339 PolarHBondContact O-N 2.95Å; Y336-L340 HydrophobicContact CD1-CD1 4.27Å; Y336-L340 HydrophobicContact CD1-CD2 4.49Å; Y336-L340 HydrophobicContact CD1-CG 4.32Å; Y336-L340 HydrophobicContact CE1-CD1 4.31Å; Y336-L340 HydrophobicContact CE1-CD2 4.11Å; Y336-L340 HydrophobicContact CE1-CG 4.39Å; Y336-L340 PolarHBondContact O-N 2.81Å
337S75.1Confident72Confident7 Ų752.7 Ų52.75%0.04926%0.259CS..Hα-helixtrans-57.7-42.8174.271.90000109.8H334 K339 L340 E341 T387H334-S337 PolarHBondContact O-N 2.87Å; H334-S337 PolarHBondContact O-OG 3.35Å; S337-K339 PolarHBondContact O-N 3.1Å; S337-L340 CarbonylContact O-C 3.5Å; S337-L340 WeakPolarHBondContact O-CA 3.28Å; S337-L340 WeakPolarHBondContact O-CB 3.33Å; S337-L340 PolarHBondContact O-N 3.41Å; S337-E341 WeakPolarHBondContact O-CG 3.5Å; S337-E341 PolarHBondContact O-N 3.17Å; S337-T387 PolarHBondContact OG-O 3.01Å; S337-T387 VanDerWaalsContact OG-O 3.07Å
338R78.7Confident74.1Confident104 Ų10450.6 Ų50.639%0.39225%0.249SC..Hα-helixtrans-56.4-19.9173.9-62.3-163.6-75.5-78.19.3115.3N333 H334 Y336 A342 P389N333-R338 PolarHBondContact O-NH1 2.98Å; H334-R338 PolarHBondContact O-NH1 3.31Å; Y336-R338 PolarHBondContact O-N 3.48Å; R338-A342 VanDerWaalsContact O-CB 3.3Å; R338-A342 WeakPolarHBondContact O-CB 3.15Å; R338-A342 PolarHBondContact O-N 2.88Å; R338-P389 HydrophobicContact CG-CB 4.09Å; R338-P389 HydrophobicContact CG-CG 4.19Å
339K84.3Confident76.2Confident135 Ų13547.8 Ų47.859%0.58723%0.231SC*.Hα-helixtrans-83-42.5170.2-75.6176177.1-170.20111.9P335 Y336 S337 E341 A342 E343P335-K339 WeakPolarHBondContact O-CG 2.98Å; Y336-K339 WeakPolarHBondContact O-CA 3.5Å; Y336-K339 WeakPolarHBondContact O-CB 3.06Å; Y336-K339 PolarHBondContact O-N 2.95Å; S337-K339 PolarHBondContact O-N 3.1Å; K339-E341 VanDerWaalsContact C-N 3.25Å; K339-E341 PolarHBondContact O-N 3.35Å; K339-A342 PolarHBondContact O-N 3.15Å; K339-E343 WeakPolarHBondContact O-CB 3.19Å; K339-E343 PolarHBondContact O-N 2.83Å
340L87.4Confident78.4Confident4 Ų445.6 Ų45.62%0.02122%0.221CC..Hα-helixtrans-58.7-42172.9-50.9-175.5000109.7R171 H285 Y336 S337 E343 A344R171-L340 VanDerWaalsContact NH2-CD2 3.34Å; H285-L340 HydrophobicContact CB-CD1 4.29Å; H285-L340 PolarHBondContact CE1-O 3.02Å; Y336-L340 HydrophobicContact CD1-CD1 4.27Å; Y336-L340 HydrophobicContact CD1-CD2 4.49Å; Y336-L340 HydrophobicContact CD1-CG 4.32Å; Y336-L340 HydrophobicContact CE1-CD1 4.31Å; Y336-L340 HydrophobicContact CE1-CD2 4.11Å; Y336-L340 HydrophobicContact CE1-CG 4.39Å; Y336-L340 PolarHBondContact O-N 2.81Å; S337-L340 CarbonylContact O-C 3.5Å; S337-L340 WeakPolarHBondContact O-CA 3.28Å; S337-L340 WeakPolarHBondContact O-CB 3.33Å; S337-L340 PolarHBondContact O-N 3.41Å; L340-E343 PolarHBondContact O-N 2.85Å; L340-A344 VanDerWaalsContact O-CB 3.32Å; L340-A344 WeakPolarHBondContact O-CB 3.11Å; L340-A344 PolarHBondContact O-N 3.09Å
341E86.9Confident80.8Confident8 Ų841.1 Ų41.14%0.03720%0.197CC..Hα-helixtrans-64.6-45.2173.9-59-32.7121.500113.4H276 H280 S337 K339 E343 A344 D345 H388H276-E341 IonicContact CE1-OE2 2.77Å; H276-E341 PolarHBondContact CE1-OE2 3.05Å; H276-E341 IonicContact NE2-OE2 3.51Å; H276-E341 PolarHBondContact NE2-OE2 2.89Å; H280-E341 IonicContact CE1-OE1 3.87Å; H280-E341 PolarHBondContact CE1-OE1 3.5Å; H280-E341 IonicContact CE1-OE2 2.35Å; H280-E341 PolarHBondContact CE1-OE2 3.27Å; H280-E341 IonicContact NE2-OE1 3.95Å; H280-E341 IonicContact NE2-OE2 3.6Å; H280-E341 PolarHBondContact NE2-OE2 3.03Å; S337-E341 WeakPolarHBondContact O-CG 3.5Å; S337-E341 PolarHBondContact O-N 3.17Å; K339-E341 VanDerWaalsContact C-N 3.25Å; K339-E341 PolarHBondContact O-N 3.35Å; E341-E343 PolarHBondContact O-N 2.99Å; E341-A344 PolarHBondContact O-N 2.9Å; E341-D345 VanDerWaalsContact O-CB 3.27Å; E341-D345 WeakPolarHBondContact O-CB 3.33Å; E341-D345 PolarHBondContact O-N 3.49Å; E341-H388 HydrophobicContact CG-CB 4.34Å; E341-H388 WeakPolarHBondContact CG-ND1 3.48Å; E341-H388 IonicContact OE1-CE1 2.68Å; E341-H388 IonicContact OE1-NE2 3.8Å; E341-H388 IonicContact OE2-CE1 3.37Å; E341-H388 PolarHBondContact OE2-CE1 3.19Å; E341-H388 IonicContact OE2-CG 3.94Å; E341-H388 IonicContact OE2-ND1 2.73Å; E341-H388 PolarHBondContact OE2-ND1 3.3Å; E341-H388 IonicContact OE2-NE2 3.59Å
342A88.8Confident83.2Confident24 Ų2439.4 Ų39.420%0.19819%0.189CC..Hα-helixtrans-60.9-32.3177.300000112.4R338 K339 Q346 Q397R338-A342 VanDerWaalsContact O-CB 3.3Å; R338-A342 WeakPolarHBondContact O-CB 3.15Å; R338-A342 PolarHBondContact O-N 2.88Å; K339-A342 PolarHBondContact O-N 3.15Å; A342-Q346 WeakPolarHBondContact O-CB 3.44Å; A342-Q346 PolarHBondContact O-N 3.01Å; A342-Q397 VanDerWaalsContact CA-NE2 3.26Å; A342-Q397 VanDerWaalsContact CB-NE2 3.26Å; A342-Q397 PolarHBondContact O-NE2 2.91Å
343E92.7Very high85.5Confident17 Ų1735 Ų358%0.07917%0.17CC..Hα-helixtrans-81.5-41.7179-168.7173.2-137.200112.3T169 R171 L283 H285 K339 L340 E341 Q346 V347T169-E343 VanDerWaalsContact CB-OE1 3.23Å; T169-E343 WeakPolarHBondContact CB-OE1 3.43Å; T169-E343 HydrophobicContact CG2-CG 3.86Å; T169-E343 WeakPolarHBondContact CG2-OE1 3.39Å; T169-E343 PolarHBondContact OG1-OE1 3.37Å; R171-E343 WeakPolarHBondContact CB-OE1 3.34Å; R171-E343 IonicContact CZ-OE2 2.96Å; R171-E343 IonicContact NE-OE1 3.87Å; R171-E343 PolarHBondContact NE-OE1 3.41Å; R171-E343 IonicContact NE-OE2 3.84Å; R171-E343 PolarHBondContact NE-OE2 3.42Å; R171-E343 IonicContact NH2-OE2 2.75Å; R171-E343 PolarHBondContact NH2-OE2 3.49Å; L283-E343 HydrophobicContact CD1-CG 3.94Å; H285-E343 IonicContact CE1-OE2 3.29Å; H285-E343 IonicContact NE2-OE2 2.79Å; H285-E343 PolarHBondContact NE2-OE2 2.98Å; H285-E343 VanDerWaalsContact NE2-OE2 3.12Å; K339-E343 WeakPolarHBondContact O-CB 3.19Å; K339-E343 PolarHBondContact O-N 2.83Å; L340-E343 PolarHBondContact O-N 2.85Å; E341-E343 PolarHBondContact O-N 2.99Å; E343-Q346 PolarHBondContact O-N 3.37Å; E343-V347 WeakPolarHBondContact O-CB 3.3Å; E343-V347 WeakPolarHBondContact O-CG2 3.49Å; E343-V347 PolarHBondContact O-N 3.3Å
344A93.2Very high87.7Confident0 Ų031.3 Ų31.30%015%0.149CC..Hα-helixtrans-71.2-31.5175.300000112.4H276 A279 L340 E341 G348H276-A344 VanDerWaalsContact CE1-CB 3.49Å; H276-A344 WeakPolarHBondContact CE1-CB 3.47Å; H276-A344 VanDerWaalsContact ND1-C 3.3Å; H276-A344 WeakPolarHBondContact ND1-CB 3.31Å; H276-A344 PolarHBondContact ND1-O 3.31Å; A279-A344 HydrophobicContact CB-CB 4.09Å; L340-A344 VanDerWaalsContact O-CB 3.32Å; L340-A344 WeakPolarHBondContact O-CB 3.11Å; L340-A344 PolarHBondContact O-N 3.09Å; E341-A344 PolarHBondContact O-N 2.9Å; A344-G348 WeakPolarHBondContact O-CA 3.49Å; A344-G348 PolarHBondContact O-N 3.46Å
345D93.1Very high89.5Confident3 Ų327.7 Ų27.72%0.01613%0.133CC..Hα-helixtrans-61.9-44.7166.7-87.5-30.1000110.4H276 E341 L349 R394 M398H276-D345 IonicContact ND1-OD1 3.66Å; E341-D345 VanDerWaalsContact O-CB 3.27Å; E341-D345 WeakPolarHBondContact O-CB 3.33Å; E341-D345 PolarHBondContact O-N 3.49Å; D345-L349 VanDerWaalsContact O-CB 3.24Å; D345-L349 WeakPolarHBondContact O-CB 3.43Å; D345-L349 PolarHBondContact O-N 3.09Å; D345-R394 VanDerWaalsContact CG-NH2 3.28Å; D345-R394 IonicContact OD1-CZ 3.21Å; D345-R394 IonicContact OD1-NE 2.78Å; D345-R394 IonicContact OD1-NH2 3.5Å; D345-R394 PolarHBondContact OD1-NH2 2.82Å; D345-R394 IonicContact OD2-CZ 3.99Å; D345-R394 IonicContact OD2-NE 1.88Å; D345-R394 PolarHBondContact OD2-NE 3.22Å; D345-R394 IonicContact OD2-NH2 2.72Å; D345-R394 PolarHBondContact OD2-NH2 2.89Å; D345-M398 HydrophobicContact CB-CE 3.81Å; D345-M398 HydrophobicContact CB-SD 4.42Å; D345-M398 WeakPolarHBondContact OD1-CE 3.41Å
346Q95.2Very high91.5Very high75 Ų7525.7 Ų25.735%0.3512%0.12SC..Hα-helixtrans-67.5-53.3-179.8-179.8-177.5-3500112.7A342 E343 L349 H350 L401A342-Q346 WeakPolarHBondContact O-CB 3.44Å; A342-Q346 PolarHBondContact O-N 3.01Å; E343-Q346 PolarHBondContact O-N 3.37Å; Q346-L349 PolarHBondContact O-N 3Å; Q346-H350 PolarHBondContact O-CD2 3.38Å; Q346-H350 VanDerWaalsContact O-CD2 3.23Å; Q346-H350 PolarHBondContact O-N 3.35Å; Q346-H350 VanDerWaalsContact O-N 3.09Å; Q346-L401 HydrophobicContact CB-CD1 3.96Å; Q346-L401 HydrophobicContact CG-CD1 4.34Å; Q346-L401 HydrophobicContact CG-CD2 4.29Å
347V96.9Very high92.9Very high8 Ų822.8 Ų22.85%0.04811%0.109CC..Hα-helixtrans-66.7-41.7-179.31730000110.2V168 T169 A279 I282 L283 E343 L349 H350 L351V168-V347 HydrophobicContact CG1-CG1 4.1Å; V168-V347 HydrophobicContact CG1-CG2 4.17Å; T169-V347 HydrophobicContact CG2-CG2 3.58Å; A279-V347 HydrophobicContact CB-CB 3.9Å; A279-V347 HydrophobicContact CB-CG1 3.78Å; I282-V347 HydrophobicContact CD1-CG1 4.15Å; L283-V347 HydrophobicContact CD1-CB 4.26Å; L283-V347 HydrophobicContact CD1-CG2 4.13Å; E343-V347 WeakPolarHBondContact O-CB 3.3Å; E343-V347 WeakPolarHBondContact O-CG2 3.49Å; E343-V347 PolarHBondContact O-N 3.3Å; V347-L349 PolarHBondContact O-N 3.48Å; V347-H350 CarbonylContact O-C 3.53Å; V347-H350 WeakPolarHBondContact O-CA 3.47Å; V347-H350 WeakPolarHBondContact O-CB 3.29Å; V347-H350 PolarHBondContact O-N 2.83Å; V347-H350 VanDerWaalsContact O-N 3.08Å; V347-L351 HydrophobicContact CG1-CD1 4.35Å; V347-L351 HydrophobicContact CG1-CG 4.3Å; V347-L351 WeakPolarHBondContact O-CG 3.3Å; V347-L351 PolarHBondContact O-N 3.26Å
348G96.8Very high93.9Very high1 Ų123 Ų231%0.0111%0.11CC..Hα-helixtrans-61.4-40.9177.100000113.4G275 A344 H350 L351 A352G275-G348 WeakPolarHBondContact O-CA 3.34Å; A344-G348 WeakPolarHBondContact O-CA 3.49Å; A344-G348 PolarHBondContact O-N 3.46Å; G348-H350 VanDerWaalsContact C-N 3.32Å; G348-H350 PolarHBondContact O-N 2.89Å; G348-L351 PolarHBondContact O-N 2.89Å; G348-A352 WeakPolarHBondContact O-CB 3.45Å; G348-A352 PolarHBondContact O-N 2.91Å
349L97.2Very high94.8Very high1 Ų118.1 Ų18.11%0.0059%0.091CC..Hα-helixtrans-65.2-34.8173.6-163.573.7000112.1D345 Q346 V347 A353 V359 M398 L401 I402 A405D345-L349 VanDerWaalsContact O-CB 3.24Å; D345-L349 WeakPolarHBondContact O-CB 3.43Å; D345-L349 PolarHBondContact O-N 3.09Å; Q346-L349 PolarHBondContact O-N 3Å; V347-L349 PolarHBondContact O-N 3.48Å; L349-A353 VanDerWaalsContact O-CB 3.28Å; L349-A353 WeakPolarHBondContact O-CB 3.39Å; L349-A353 PolarHBondContact O-N 2.91Å; L349-V359 HydrophobicContact CD1-CB 3.66Å; L349-V359 HydrophobicContact CD1-CG1 3.79Å; L349-V359 HydrophobicContact CG-CB 4.12Å; L349-V359 HydrophobicContact CG-CG1 4.01Å; L349-M398 HydrophobicContact CB-SD 3.97Å; L349-M398 HydrophobicContact CD1-CG 4.24Å; L349-M398 HydrophobicContact CD1-SD 3.69Å; L349-M398 HydrophobicContact CD2-CG 4.35Å; L349-M398 HydrophobicContact CD2-SD 3.75Å; L349-M398 HydrophobicContact CG-SD 4Å; L349-L401 HydrophobicContact CD2-CB 3.62Å; L349-I402 HydrophobicContact CD2-CD1 4.3Å; L349-A405 HydrophobicContact CD2-CB 3.7Å; L349-A405 HydrophobicContact CG-CB 3.91Å
350H97.5Very high95.5Very high40 Ų4012.7 Ų12.719%0.1857%0.067CC..Hα-helixtrans-69.4-41.5174.4-71.5-166.4000112Q346 V347 G348 A353 K354 Q404 L408Q346-H350 PolarHBondContact O-CD2 3.38Å; Q346-H350 VanDerWaalsContact O-CD2 3.23Å; Q346-H350 PolarHBondContact O-N 3.35Å; Q346-H350 VanDerWaalsContact O-N 3.09Å; V347-H350 CarbonylContact O-C 3.53Å; V347-H350 WeakPolarHBondContact O-CA 3.47Å; V347-H350 WeakPolarHBondContact O-CB 3.29Å; V347-H350 PolarHBondContact O-N 2.83Å; V347-H350 VanDerWaalsContact O-N 3.08Å; G348-H350 VanDerWaalsContact C-N 3.32Å; G348-H350 PolarHBondContact O-N 2.89Å; H350-A353 PolarHBondContact O-N 3.25Å; H350-K354 WeakPolarHBondContact O-CG 3.5Å; H350-K354 PolarHBondContact O-N 3.29Å; H350-Q404 PolarHBondContact CE1-OE1 3.23Å; H350-Q404 PolarHBondContact NE2-OE1 2.85Å; H350-L408 HydrophobicContact CB-CD2 3.79Å
351L98.2Very high95.9Very high2 Ų212.7 Ų12.71%0.017%0.067CC..Hα-helixtrans-60.2-46.3174.4-66177000110.9L219 N223 I226 V229 M278 A279 I282 V347 G348 K354 A355L219-L351 HydrophobicContact CD2-CB 4.24Å; N223-L351 HydrophobicContact CB-CD2 3.75Å; N223-L351 PolarHBondContact ND2-O 2.72Å; N223-L351 WeakPolarHBondContact OD1-CD2 3.13Å; I226-L351 HydrophobicContact CD1-CD2 3.8Å; V229-L351 HydrophobicContact CG2-CD2 4.07Å; M278-L351 HydrophobicContact CB-CD1 4.05Å; A279-L351 HydrophobicContact CB-CD1 4.5Å; I282-L351 HydrophobicContact CD1-CD1 4.13Å; I282-L351 HydrophobicContact CD1-CD2 4.47Å; V347-L351 HydrophobicContact CG1-CD1 4.35Å; V347-L351 HydrophobicContact CG1-CG 4.3Å; V347-L351 WeakPolarHBondContact O-CG 3.3Å; V347-L351 PolarHBondContact O-N 3.26Å; G348-L351 PolarHBondContact O-N 2.89Å; L351-K354 PolarHBondContact O-N 3.05Å; L351-A355 VanDerWaalsContact O-CB 3.31Å; L351-A355 WeakPolarHBondContact O-CB 3.47Å; L351-A355 PolarHBondContact O-N 3Å
352A98.4Very high96.2Very high0 Ų012.3 Ų12.30%07%0.066CC..Hα-helixtrans-64.8-40.7177.100000112.6I272 G348 A355 C356 A357I272-A352 HydrophobicContact CG1-CB 3.86Å; G348-A352 WeakPolarHBondContact O-CB 3.45Å; G348-A352 PolarHBondContact O-N 2.91Å; A352-A355 CarbonylContact O-C 3.54Å; A352-A355 PolarHBondContact O-N 3.38Å; A352-C356 PolarHBondContact O-N 3.45Å; A352-C356 VanDerWaalsContact O-N 3.14Å; A352-A357 HydrophobicContact CB-CB 4.28Å; A352-A357 PolarHBondContact O-N 3.46Å
353A98.3Very high96.4Very high0 Ų011.1 Ų11.10%06%0.056CC..Hα-helixtrans-59-50.5174.200000112.2L349 H350 A355 C356 V359 A405 L408 R409 C414L349-A353 VanDerWaalsContact O-CB 3.28Å; L349-A353 WeakPolarHBondContact O-CB 3.39Å; L349-A353 PolarHBondContact O-N 2.91Å; H350-A353 PolarHBondContact O-N 3.25Å; A353-A355 PolarHBondContact O-N 3.33Å; A353-C356 WeakPolarHBondContact O-CA 3.44Å; A353-C356 PolarHBondContact O-N 3.33Å; A353-V359 HydrophobicContact CB-CG1 3.89Å; A353-A405 HydrophobicContact CB-CB 4.23Å; A353-A405 WeakPolarHBondContact CB-O 3.39Å; A353-L408 HydrophobicContact CB-CB 4.32Å; A353-L408 HydrophobicContact CB-CD2 4.17Å; A353-L408 HydrophobicContact CB-CG 4.33Å; A353-R409 HydrophobicContact CB-CG 4.06Å; A353-R409 WeakPolarHBondContact O-CG 3.45Å; A353-C414 PolarHBondContact O-SG 3.49Å
354K98Very high96.5Very high18 Ų1810.7 Ų10.78%0.0786%0.055CC..Hα-helixtrans-63.6-32.6177.8-68.7175.154.8-168.70112.2N223 D225 H350 L351 C356 L408N223-K354 WeakPolarHBondContact OD1-CB 3.45Å; N223-K354 WeakPolarHBondContact OD1-CD 3.49Å; N223-K354 WeakPolarHBondContact OD1-CE 3.49Å; N223-K354 PolarHBondContact OD1-NZ 3.36Å; D225-K354 WeakPolarHBondContact OD1-CE 3.26Å; D225-K354 IonicContact OD1-NZ 2.93Å; D225-K354 PolarHBondContact OD1-NZ 1.88Å; D225-K354 IonicContact OD2-NZ 3.78Å; D225-K354 PolarHBondContact OD2-NZ 3.5Å; H350-K354 WeakPolarHBondContact O-CG 3.5Å; H350-K354 PolarHBondContact O-N 3.29Å; L351-K354 PolarHBondContact O-N 3.05Å; K354-C356 PolarHBondContact O-N 3.08Å; K354-L408 HydrophobicContact CD-CD1 4.35Å; K354-L408 HydrophobicContact CD-CD2 4.13Å; K354-L408 HydrophobicContact CD-CG 4.44Å; K354-L408 HydrophobicContact CG-CD1 4.04Å; K354-L408 HydrophobicContact CG-CD2 3.79Å; K354-L408 HydrophobicContact CG-CG 3.78Å
355A98.1Very high96.4Very high3 Ų310.8 Ų10.83%0.0256%0.055CC..THydrogen-bonded Turntrans-77.22.8172.800000114.7L218 L219 R222 M271 L351 A352 A353L218-A355 HydrophobicContact CG-CB 4.47Å; L219-A355 HydrophobicContact CD2-CB 3.78Å; L219-A355 HydrophobicContact CG-CB 4.31Å; R222-A355 HydrophobicContact CB-CB 4.02Å; R222-A355 HydrophobicContact CG-CB 4.36Å; M271-A355 HydrophobicContact CE-CB 3.42Å; M271-A355 VanDerWaalsContact CE-CB 3.42Å; L351-A355 VanDerWaalsContact O-CB 3.31Å; L351-A355 WeakPolarHBondContact O-CB 3.47Å; L351-A355 PolarHBondContact O-N 3Å; A352-A355 CarbonylContact O-C 3.54Å; A352-A355 PolarHBondContact O-N 3.38Å; A353-A355 PolarHBondContact O-N 3.33Å
356C97.8Very high96.2Very high26 Ų2610.8 Ų10.818%0.1766%0.055CC..THydrogen-bonded Turntrans65.827.2177.3-520000116R222 A352 A353 K354 R409 C414R222-C356 PolarHBondContact NH1-SG 3.4Å; A352-C356 PolarHBondContact O-N 3.45Å; A352-C356 VanDerWaalsContact O-N 3.14Å; A353-C356 WeakPolarHBondContact O-CA 3.44Å; A353-C356 PolarHBondContact O-N 3.33Å; K354-C356 PolarHBondContact O-N 3.08Å; C356-R409 PolarHBondContact O-NH1 3.41Å; C356-C414 WeakPolarHBondContact CA-SG 3.39Å; C356-C414 HydrophobicContact CB-CB 3.63Å; C356-C414 WeakPolarHBondContact CB-SG 3.24Å; C356-C414 WeakPolarHBondContact SG-CA 3.33Å; C356-C414 WeakPolarHBondContact SG-CB 3.49Å; C356-C414 CovalentContact SG-SG 2.04Å; C356-C414 PolarHBondContact SG-SG 3.12Å
357A97.8Very high95.9Very high2 Ų29.7 Ų9.72%0.0175%0.049CC..  trans-79.5145.416700000112.4D268 M271 A352 V359 R409D268-A357 WeakPolarHBondContact OD1-CA 3.24Å; M271-A357 HydrophobicContact CB-CB 3.55Å; M271-A357 HydrophobicContact CG-CB 4.12Å; A352-A357 HydrophobicContact CB-CB 4.28Å; A352-A357 PolarHBondContact O-N 3.46Å; A357-V359 PolarHBondContact O-N 3.47Å; A357-R409 PolarHBondContact O-NH1 3.33Å
358D97.8Very high95.5Very high13 Ų1311.7 Ų11.77%0.076%0.058CC..  trans-70.689.8176.2-169.2-6.1000111.4D268 R360 A361 L417D268-D358 HydrophobicContact CB-CB 4.08Å; D268-D358 VanDerWaalsContact CG-N 3.27Å; D268-D358 PolarHBondContact OD1-N 2.95Å; D358-R360 PolarHBondContact O-N 3.2Å; D358-R360 WeakPolarHBondContact OD1-CB 3.46Å; D358-R360 VanDerWaalsContact OD1-CG 3.23Å; D358-R360 WeakPolarHBondContact OD1-CG 3.48Å; D358-R360 IonicContact OD1-CZ 3.85Å; D358-R360 PolarHBondContact OD1-N 3.06Å; D358-R360 IonicContact OD1-NE 3.33Å; D358-R360 PolarHBondContact OD1-NE 3.44Å; D358-R360 IonicContact OD1-NH2 3.95Å; D358-R360 IonicContact OD2-CZ 3.25Å; D358-R360 VanDerWaalsContact OD2-CZ 3.25Å; D358-R360 IonicContact OD2-NE 3.44Å; D358-R360 PolarHBondContact OD2-NE 3.03Å; D358-R360 IonicContact OD2-NH2 2.67Å; D358-R360 PolarHBondContact OD2-NH2 3.06Å; D358-A361 VanDerWaalsContact O-CB 3.25Å; D358-A361 WeakPolarHBondContact O-CB 3.46Å; D358-A361 PolarHBondContact O-N 3.17Å; D358-L417 HydrophobicContact CB-CD2 3.62Å; D358-L417 WeakPolarHBondContact OD1-CD1 3.47Å
359V97.5Very high94.9Very high0 Ų011.9 Ų11.90%06%0.059CC..THydrogen-bonded Turntrans-50.1-23.5177-670000114.6L349 A353 A357 A361 G362 P363 I402 A405 L406L349-V359 HydrophobicContact CD1-CB 3.66Å; L349-V359 HydrophobicContact CD1-CG1 3.79Å; L349-V359 HydrophobicContact CG-CB 4.12Å; L349-V359 HydrophobicContact CG-CG1 4.01Å; A353-V359 HydrophobicContact CB-CG1 3.89Å; A357-V359 PolarHBondContact O-N 3.47Å; V359-A361 PolarHBondContact O-N 2.7Å; V359-G362 PolarHBondContact O-N 2.94Å; V359-G362 VanDerWaalsContact O-N 3.13Å; V359-P363 WeakPolarHBondContact O-CD 3.43Å; V359-I402 HydrophobicContact CB-CD1 4.16Å; V359-I402 HydrophobicContact CG2-CD1 4.25Å; V359-I402 WeakPolarHBondContact O-CD1 3.19Å; V359-A405 HydrophobicContact CB-CB 4.15Å; V359-A405 HydrophobicContact CG1-CB 4.06Å; V359-A405 HydrophobicContact CG2-CB 3.92Å; V359-L406 HydrophobicContact CG2-CD2 3.85Å; V359-L406 HydrophobicContact CG2-CG 4.22Å
360R97.1Very high94.2Very high22 Ų2213.6 Ų13.68%0.0837%0.067CC..THydrogen-bonded Turntrans-64.3-19.9175-55.4175.3-61.3172.78112.6D358 G362 I402 S418 V420 P422 R423D358-R360 PolarHBondContact O-N 3.2Å; D358-R360 WeakPolarHBondContact OD1-CB 3.46Å; D358-R360 VanDerWaalsContact OD1-CG 3.23Å; D358-R360 WeakPolarHBondContact OD1-CG 3.48Å; D358-R360 IonicContact OD1-CZ 3.85Å; D358-R360 PolarHBondContact OD1-N 3.06Å; D358-R360 IonicContact OD1-NE 3.33Å; D358-R360 PolarHBondContact OD1-NE 3.44Å; D358-R360 IonicContact OD1-NH2 3.95Å; D358-R360 IonicContact OD2-CZ 3.25Å; D358-R360 VanDerWaalsContact OD2-CZ 3.25Å; D358-R360 IonicContact OD2-NE 3.44Å; D358-R360 PolarHBondContact OD2-NE 3.03Å; D358-R360 IonicContact OD2-NH2 2.67Å; D358-R360 PolarHBondContact OD2-NH2 3.06Å; R360-G362 VanDerWaalsContact C-N 3.33Å; R360-I402 HydrophobicContact CG-CG2 4.14Å; R360-S418 PolarHBondContact NH1-O 3.46Å; R360-S418 PolarHBondContact NH2-O 3.41Å; R360-V420 PolarHBondContact NH1-O 3.13Å; R360-V420 PolarHBondContact NH2-O 2.96Å; R360-V420 VanDerWaalsContact NH2-O 3.17Å; R360-P422 HydrophobicContact CB-CG 3.63Å; R360-R423 VanDerWaalsContact O-CG 3.26Å; R360-R423 WeakPolarHBondContact O-CG 3.23Å
361A96.3Very high93.5Very high3 Ų314.4 Ų14.43%0.0257%0.072CC..Hα-helixtrans-73.2-21175.300000113.4D268 Q269 I272 D358 V359 V364 F365D268-A361 HydrophobicContact CB-CB 4.08Å; Q269-A361 HydrophobicContact CG-CB 3.76Å; I272-A361 HydrophobicContact CD1-CB 4.28Å; D358-A361 VanDerWaalsContact O-CB 3.25Å; D358-A361 WeakPolarHBondContact O-CB 3.46Å; D358-A361 PolarHBondContact O-N 3.17Å; V359-A361 PolarHBondContact O-N 2.7Å; A361-V364 WeakPolarHBondContact O-CB 3.49Å; A361-V364 PolarHBondContact O-N 3.23Å; A361-V364 VanDerWaalsContact O-N 3.15Å; A361-F365 PolarHBondContact O-N 2.64Å
362G93.6Very high92.7Very high0 Ų016.8 Ų16.80%09%0.087CC..Hα-helixtrans-63.6-50.3-178.400000114.3I272 V359 R360 V364 F365 W366I272-G362 VanDerWaalsContact CD1-N 3.3Å; V359-G362 PolarHBondContact O-N 2.94Å; V359-G362 VanDerWaalsContact O-N 3.13Å; R360-G362 VanDerWaalsContact C-N 3.33Å; G362-V364 PolarHBondContact O-N 3.13Å; G362-F365 PolarHBondContact O-N 3.01Å; G362-W366 VanDerWaalsContact O-CD1 3.23Å; G362-W366 PolarHBondContact O-N 3.36Å
363P93.8Very high91.6Very high0 Ų018.2 Ų18.20%09%0.094CC..Hα-helixtrans-56.6-32.6170.4-25.833.8000113.4V359 Q367 M398 D399 I402 R423V359-P363 WeakPolarHBondContact O-CD 3.43Å; P363-Q367 VanDerWaalsContact O-CG 3.27Å; P363-Q367 WeakPolarHBondContact O-CG 3.41Å; P363-Q367 PolarHBondContact O-N 3.25Å; P363-M398 HydrophobicContact CG-CB 4Å; P363-M398 HydrophobicContact CG-CG 3.89Å; P363-D399 WeakPolarHBondContact CG-OD1 3.44Å; P363-I402 HydrophobicContact CG-CD1 4.01Å; P363-I402 HydrophobicContact CG-CG1 4.16Å; P363-R423 HydrophobicContact CB-CG 4.36Å
364V94.1Very high90.6Very high8 Ų824.8 Ų24.85%0.04812%0.123CC..Hα-helixtrans-69.1-46178-1780000111.3A361 G362 W366 Q367 Q368 P422 R423 F426A361-V364 WeakPolarHBondContact O-CB 3.49Å; A361-V364 PolarHBondContact O-N 3.23Å; A361-V364 VanDerWaalsContact O-N 3.15Å; G362-V364 PolarHBondContact O-N 3.13Å; V364-W366 PolarHBondContact O-N 3.32Å; V364-Q367 CarbonylContact O-C 3.5Å; V364-Q367 PolarHBondContact O-N 2.69Å; V364-Q367 VanDerWaalsContact O-N 3.1Å; V364-Q368 HydrophobicContact CG1-CG 4.34Å; V364-Q368 WeakPolarHBondContact O-CG 3.21Å; V364-Q368 PolarHBondContact O-N 2.76Å; V364-Q368 PolarHBondContact O-OE1 2.88Å; V364-P422 HydrophobicContact CG2-CB 4.33Å; V364-R423 HydrophobicContact CG2-CB 4.21Å; V364-R423 HydrophobicContact CG2-CG 3.68Å; V364-F426 HydrophobicContact CG1-CB 3.75Å; V364-F426 HydrophobicContact CG1-CD1 4.25Å; V364-F426 HydrophobicContact CG1-CD2 3.7Å; V364-F426 HydrophobicContact CG1-CE2 4.36Å; V364-F426 HydrophobicContact CG1-CG 3.62Å; V364-F426 HydrophobicContact CG2-CB 4.24Å
365F91.7Very high89.6Confident1 Ų130.7 Ų30.70%0.00416%0.155CC..Hα-helixtrans-55.8-47.5177.3176.7-104.4000112.2M260 V264 Q269 V273 A361 G362 Q367 Q368 L369M260-F365 HydrophobicContact CE-CZ 4.45Å; M260-F365 HydrophobicContact SD-CE2 4.25Å; M260-F365 HydrophobicContact SD-CZ 3.83Å; V264-F365 HydrophobicContact CG1-CD2 4.03Å; V264-F365 HydrophobicContact CG1-CE2 3.66Å; V264-F365 HydrophobicContact CG1-CZ 4.45Å; Q269-F365 HydrophobicContact CG-CB 4.22Å; V273-F365 HydrophobicContact CG2-CD1 3.98Å; V273-F365 HydrophobicContact CG2-CD2 4.48Å; V273-F365 HydrophobicContact CG2-CE1 3.51Å; V273-F365 HydrophobicContact CG2-CE2 4.06Å; V273-F365 HydrophobicContact CG2-CG 4.44Å; V273-F365 HydrophobicContact CG2-CZ 3.54Å; A361-F365 PolarHBondContact O-N 2.64Å; G362-F365 PolarHBondContact O-N 3.01Å; F365-Q367 VanDerWaalsContact C-N 3.34Å; F365-Q367 PolarHBondContact O-N 3.1Å; F365-Q368 WeakPolarHBondContact O-CB 3.41Å; F365-Q368 PolarHBondContact O-N 2.95Å; F365-L369 HydrophobicContact CD1-CD1 4.33Å; F365-L369 HydrophobicContact CE1-CD1 3.61Å; F365-L369 HydrophobicContact CE1-CG 4.39Å; F365-L369 HydrophobicContact CE2-CD1 4.37Å; F365-L369 HydrophobicContact CE2-CG 4.44Å; F365-L369 HydrophobicContact CZ-CD1 3.64Å; F365-L369 HydrophobicContact CZ-CG 4.19Å; F365-L369 PolarHBondContact O-N 2.78Å
366W87.8Confident88.3Confident4 Ų433.5 Ų33.52%0.01517%0.172CC..Hα-helixtrans-64-37176.5-65.4121.3000112.7G362 V364 L369 E370 W384 L385 H391 R394G362-W366 VanDerWaalsContact O-CD1 3.23Å; G362-W366 PolarHBondContact O-N 3.36Å; V364-W366 PolarHBondContact O-N 3.32Å; W366-L369 HydrophobicContact CE3-CD1 3.95Å; W366-L369 HydrophobicContact CZ3-CD1 3.82Å; W366-L369 PolarHBondContact O-N 3.39Å; W366-E370 PolarHBondContact O-N 2.83Å; W366-W384 AromaticContact CH2-CH2 3.78Å; W366-W384 HydrophobicContact CH2-CH2 3.78Å; W366-W384 AromaticContact CH2-CZ3 3.98Å; W366-W384 HydrophobicContact CH2-CZ3 3.98Å; W366-W384 HydrophobicContact CZ3-CH2 4.32Å; W366-L385 HydrophobicContact CH2-CD1 4.17Å; W366-L385 HydrophobicContact CZ3-CD1 3.82Å; W366-L385 HydrophobicContact CZ3-CD2 4.46Å; W366-H391 AromaticContact CE3-ND1 3.91Å; W366-H391 WeakPolarHBondContact O-CB 3.41Å; W366-R394 HydrophobicContact CD2-CB 4.33Å; W366-R394 HydrophobicContact CG-CB 4.16Å
367Q89.3Confident86.6Confident51 Ų5135.4 Ų35.424%0.23820%0.195CC..Hα-helixtrans-70.6-31174.8-68.6172.915.600112.8P363 V364 F365 E370 I371 S395 F426P363-Q367 VanDerWaalsContact O-CG 3.27Å; P363-Q367 WeakPolarHBondContact O-CG 3.41Å; P363-Q367 PolarHBondContact O-N 3.25Å; V364-Q367 CarbonylContact O-C 3.5Å; V364-Q367 PolarHBondContact O-N 2.69Å; V364-Q367 VanDerWaalsContact O-N 3.1Å; F365-Q367 VanDerWaalsContact C-N 3.34Å; F365-Q367 PolarHBondContact O-N 3.1Å; Q367-E370 PolarHBondContact O-N 2.98Å; Q367-I371 WeakPolarHBondContact O-CG1 3.38Å; Q367-I371 PolarHBondContact O-N 2.97Å; Q367-I371 VanDerWaalsContact O-N 3.16Å; Q367-S395 PolarHBondContact NE2-OG 3.49Å; Q367-F426 HydrophobicContact CB-CD1 4.33Å; Q367-F426 HydrophobicContact CB-CE1 3.46Å; Q367-F426 VanDerWaalsContact CB-CE1 3.46Å; Q367-F426 HydrophobicContact CB-CZ 3.86Å; Q367-F426 HydrophobicContact CG-CE1 4.39Å; Q367-F426 VanDerWaalsContact OE1-CE1 3.23Å
368Q88.4Confident84.6Confident50 Ų5041 Ų4123%0.23423%0.225CC..Hα-helixtrans-64.2-48.3172.5-75165.4-62.100110.8V364 F365 E370 I371 V372 F426V364-Q368 HydrophobicContact CG1-CG 4.34Å; V364-Q368 WeakPolarHBondContact O-CG 3.21Å; V364-Q368 PolarHBondContact O-N 2.76Å; V364-Q368 PolarHBondContact O-OE1 2.88Å; F365-Q368 WeakPolarHBondContact O-CB 3.41Å; F365-Q368 PolarHBondContact O-N 2.95Å; Q368-E370 VanDerWaalsContact C-N 3.32Å; Q368-E370 PolarHBondContact O-N 3.11Å; Q368-I371 WeakPolarHBondContact O-CB 3.42Å; Q368-I371 PolarHBondContact O-N 2.95Å; Q368-V372 WeakPolarHBondContact O-CG2 3.39Å; Q368-V372 PolarHBondContact O-N 3.14Å; Q368-F426 HydrophobicContact CG-CD2 4.14Å; Q368-F426 HydrophobicContact CG-CE2 3.43Å; Q368-F426 VanDerWaalsContact CG-CE2 3.43Å; Q368-F426 HydrophobicContact CG-CZ 3.98Å
369L83.9Confident82.6Confident6 Ų645.2 Ų45.23%0.03125%0.253CS..Hα-helixtrans-61.7-37.7174.4-66.3-179.2000112.3I244 F365 W366 I371 V372 D373 L385 H391I244-L369 HydrophobicContact CG2-CD2 4.47Å; F365-L369 HydrophobicContact CD1-CD1 4.33Å; F365-L369 HydrophobicContact CE1-CD1 3.61Å; F365-L369 HydrophobicContact CE1-CG 4.39Å; F365-L369 HydrophobicContact CE2-CD1 4.37Å; F365-L369 HydrophobicContact CE2-CG 4.44Å; F365-L369 HydrophobicContact CZ-CD1 3.64Å; F365-L369 HydrophobicContact CZ-CG 4.19Å; F365-L369 PolarHBondContact O-N 2.78Å; W366-L369 HydrophobicContact CE3-CD1 3.95Å; W366-L369 HydrophobicContact CZ3-CD1 3.82Å; W366-L369 PolarHBondContact O-N 3.39Å; L369-I371 PolarHBondContact O-N 2.94Å; L369-V372 PolarHBondContact O-N 3.32Å; L369-D373 PolarHBondContact O-N 2.99Å; L369-L385 HydrophobicContact CD1-CD2 4.44Å; L369-H391 WeakPolarHBondContact CB-CE1 3.28Å
370E83.5Confident80.4Confident36 Ų3647.5 Ų47.517%0.16827%0.267CS..Hα-helixtrans-61.9-25.9173.6-154.8-166.2147.400113.2W366 Q367 Q368 K374 H391 R392W366-E370 PolarHBondContact O-N 2.83Å; Q367-E370 PolarHBondContact O-N 2.98Å; Q368-E370 VanDerWaalsContact C-N 3.32Å; Q368-E370 PolarHBondContact O-N 3.11Å; E370-K374 VanDerWaalsContact CD-NZ 3.31Å; E370-K374 WeakPolarHBondContact O-CD 3.31Å; E370-K374 WeakPolarHBondContact O-CE 3.43Å; E370-K374 VanDerWaalsContact O-CG 3.24Å; E370-K374 WeakPolarHBondContact O-CG 3.32Å; E370-K374 WeakPolarHBondContact OE1-CE 3.05Å; E370-K374 IonicContact OE1-NZ 3.67Å; E370-K374 PolarHBondContact OE1-NZ 3.35Å; E370-H391 HydrophobicContact CB-CB 3.72Å; E370-H391 HydrophobicContact CG-CB 3.98Å; E370-R392 VanDerWaalsContact OE2-CA 3.27Å; E370-R392 WeakPolarHBondContact OE2-CA 3.45Å; E370-R392 WeakPolarHBondContact OE2-CB 3.35Å; E370-R392 PolarHBondContact OE2-N 2.91Å
371I83.1Confident78.2Confident57 Ų5749 Ų4929%0.29228%0.279SS..Hα-helixtrans-82.7-42.5174-69.2176000110.6Q367 Q368 L369 K374 L375 F426 V430Q367-I371 WeakPolarHBondContact O-CG1 3.38Å; Q367-I371 PolarHBondContact O-N 2.97Å; Q367-I371 VanDerWaalsContact O-N 3.16Å; Q368-I371 WeakPolarHBondContact O-CB 3.42Å; Q368-I371 PolarHBondContact O-N 2.95Å; L369-I371 PolarHBondContact O-N 2.94Å; I371-K374 PolarHBondContact O-N 3.1Å; I371-L375 HydrophobicContact CG2-CD1 3.68Å; I371-L375 HydrophobicContact CG2-CG 4.25Å; I371-L375 WeakPolarHBondContact O-CG 3.17Å; I371-L375 PolarHBondContact O-N 3.46Å; I371-L375 VanDerWaalsContact O-N 3.09Å; I371-F426 HydrophobicContact CD1-CE2 4.46Å; I371-F426 HydrophobicContact CD1-CZ 3.72Å; I371-V430 HydrophobicContact CD1-CG1 4.09Å; I371-V430 HydrophobicContact CD1-CG2 3.66Å
372V80Confident76.1Confident52 Ų5249 Ų4932%0.31528%0.278SS..Hα-helixtrans-56.5-53.5177.3175.50000110.6Q368 L369 K374 L375 T376Q368-V372 WeakPolarHBondContact O-CG2 3.39Å; Q368-V372 PolarHBondContact O-N 3.14Å; L369-V372 PolarHBondContact O-N 3.32Å; V372-K374 PolarHBondContact O-N 3.43Å; V372-K374 VanDerWaalsContact O-N 3.17Å; V372-L375 PolarHBondContact O-N 2.92Å; V372-T376 HydrophobicContact CG1-CG2 3.98Å; V372-T376 PolarHBondContact O-N 3.42Å; V372-T376 PolarHBondContact O-OG1 2.85Å
373D75.4Confident73.5Confident30 Ų3056.3 Ų56.316%0.1631%0.312CS..Hα-helixtrans-56.6-33.7179.2-85.53.6000113.5L369 T376 G377 T380 H391L369-D373 PolarHBondContact O-N 2.99Å; D373-T376 WeakPolarHBondContact CA-OG1 3.47Å; D373-T376 PolarHBondContact O-OG1 2.9Å; D373-G377 PolarHBondContact O-N 3.4Å; D373-T380 WeakPolarHBondContact OD1-CA 3.13Å; D373-T380 WeakPolarHBondContact OD1-CB 3.23Å; D373-T380 PolarHBondContact OD1-N 2.85Å; D373-T380 PolarHBondContact OD1-OG1 2.93Å; D373-H391 IonicContact OD1-NE2 2.73Å; D373-H391 PolarHBondContact OD1-NE2 3Å; D373-H391 IonicContact OD2-CD2 2.74Å; D373-H391 IonicContact OD2-NE2 2.98Å; D373-H391 PolarHBondContact OD2-NE2 2.98Å
374K77.4Confident71.3Confident138 Ų13857.9 Ų57.960%0.632%0.318SS*.Hα-helixtrans-76.5-25.9177.6-72.5171.7-167.7156.70113.3E370 I371 V372E370-K374 VanDerWaalsContact CD-NZ 3.31Å; E370-K374 WeakPolarHBondContact O-CD 3.31Å; E370-K374 WeakPolarHBondContact O-CE 3.43Å; E370-K374 VanDerWaalsContact O-CG 3.24Å; E370-K374 WeakPolarHBondContact O-CG 3.32Å; E370-K374 WeakPolarHBondContact OE1-CE 3.05Å; E370-K374 IonicContact OE1-NZ 3.67Å; E370-K374 PolarHBondContact OE1-NZ 3.35Å; I371-K374 PolarHBondContact O-N 3.1Å; V372-K374 PolarHBondContact O-N 3.43Å; V372-K374 VanDerWaalsContact O-N 3.17Å
375L76.9Confident68.9Low143 Ų14357.8 Ų57.875%0.74932%0.317SS*.Hα-helixtrans-89.2-35.2179.6-68.6174.6000112.1I371 V372I371-L375 HydrophobicContact CG2-CD1 3.68Å; I371-L375 HydrophobicContact CG2-CG 4.25Å; I371-L375 WeakPolarHBondContact O-CG 3.17Å; I371-L375 PolarHBondContact O-N 3.46Å; I371-L375 VanDerWaalsContact O-N 3.09Å; V372-L375 PolarHBondContact O-N 2.92Å
376T71.9Confident66.7Low62 Ų6260.9 Ų60.938%0.3834%0.34SS..Hα-helixtrans-76.6-25.7177.9530000112.8V372 D373 N378 T380V372-T376 HydrophobicContact CG1-CG2 3.98Å; V372-T376 PolarHBondContact O-N 3.42Å; V372-T376 PolarHBondContact O-OG1 2.85Å; D373-T376 WeakPolarHBondContact CA-OG1 3.47Å; D373-T376 PolarHBondContact O-OG1 2.9Å; T376-N378 PolarHBondContact O-N 3.31Å; T376-N378 PolarHBondContact OG1-O 3.45Å; T376-T380 HydrophobicContact CG2-CG2 4.4Å; T376-T380 PolarHBondContact OG1-OG1 3.43Å
377G61.8Low64.6Low65 Ų6562 Ų6267%0.6735%0.347SS*.SBendtrans70.9-19.1179.400000114.8D373D373-G377 PolarHBondContact O-N 3.4Å
378N56.2Low62.8Low121 Ų12161.1 Ų61.165%0.64734%0.342SS*.SBendtrans-94.8132.4163.9-61.8-71.1000107.9T376 T380T376-N378 PolarHBondContact O-N 3.31Å; T376-N378 PolarHBondContact OG1-O 3.45Å; N378-T380 PolarHBondContact O-N 2.86Å
379P54.8Low61.2Low100 Ų10059.9 Ų59.965%0.64934%0.339SS*.  trans-56.2107.2169.9-2535.7000110.1V381P379-V381 HydrophobicContact CB-CG2 3.92Å; P379-V381 PolarHBondContact O-N 3.24Å
380T51.5Low60.3Low49 Ų4963 Ų6330%0.30136%0.362SS..  trans-82.543.7175.516.20000109.8D373 T376 N378 P382D373-T380 WeakPolarHBondContact OD1-CA 3.13Å; D373-T380 WeakPolarHBondContact OD1-CB 3.23Å; D373-T380 PolarHBondContact OD1-N 2.85Å; D373-T380 PolarHBondContact OD1-OG1 2.93Å; T376-T380 HydrophobicContact CG2-CG2 4.4Å; T376-T380 PolarHBondContact OG1-OG1 3.43Å; N378-T380 PolarHBondContact O-N 2.86Å; T380-P382 WeakPolarHBondContact O-CD 3.39Å
381V50.2Low59.7Low53 Ų5362.1 Ų62.132%0.32136%0.357SS..  trans-72119.1171.8-84.50000109.4P379 L385P379-V381 HydrophobicContact CB-CG2 3.92Å; P379-V381 PolarHBondContact O-N 3.24Å; V381-L385 HydrophobicContact CB-CB 4.31Å; V381-L385 HydrophobicContact CG1-CB 4.29Å; V381-L385 HydrophobicContact CG1-CD2 4.16Å; V381-L385 HydrophobicContact CG1-CG 4.1Å
382P51.9Low59.1Low2 Ų268 Ų681%0.01338%0.376CS..  trans-45.6162.9157.3-16.44000114I244 T380 W384 L385 S386I244-P382 HydrophobicContact CG2-CG 4.36Å; I244-P382 WeakPolarHBondContact O-CB 3.48Å; I244-P382 WeakPolarHBondContact O-CG 3.37Å; T380-P382 WeakPolarHBondContact O-CD 3.39Å; P382-W384 VanDerWaalsContact C-N 3.3Å; P382-W384 HydrophobicContact CB-CD2 4.15Å; P382-W384 HydrophobicContact CB-CG 3.93Å; P382-W384 HydrophobicContact CB-CZ2 4.35Å; P382-W384 HydrophobicContact CG-CD2 4.38Å; P382-W384 HydrophobicContact CG-CZ2 3.79Å; P382-W384 PolarHBondContact O-N 3.33Å; P382-L385 HydrophobicContact CB-CB 3.89Å; P382-L385 HydrophobicContact CG-CB 3.59Å; P382-L385 HydrophobicContact CG-CD2 4.07Å; P382-L385 HydrophobicContact CG-CG 4.47Å; P382-L385 CarbonylContact O-C 3.55Å; P382-L385 PolarHBondContact O-N 3.47Å; P382-L385 VanDerWaalsContact O-N 3.11Å; P382-S386 PolarHBondContact O-N 3.31Å; P382-S386 PolarHBondContact O-OG 2.86Å
383E39.8Very low59Low155 Ų15570.4 Ų70.472%0.72439%0.387SS*.THydrogen-bonded Turntrans-65.4-32178.3-168.1162.1-170.800112.7
384W47.6Very low59.3Low32 Ų3269 Ų6912%0.12138%0.379CS..THydrogen-bonded Turntrans-64.3-58.1164.358.5-84.7000110.9N245 A246 M260 H276 W366 P382 S386 T387 H388N245-W384 PolarHBondContact OD1-NE1 2.96Å; A246-W384 PolarHBondContact O-NE1 2.83Å; M260-W384 HydrophobicContact CE-CZ2 3.69Å; H276-W384 AromaticContact CD2-CZ3 3.84Å; H276-W384 AromaticContact NE2-CZ3 3.9Å; W366-W384 AromaticContact CH2-CH2 3.78Å; W366-W384 HydrophobicContact CH2-CH2 3.78Å; W366-W384 AromaticContact CH2-CZ3 3.98Å; W366-W384 HydrophobicContact CH2-CZ3 3.98Å; W366-W384 HydrophobicContact CZ3-CH2 4.32Å; P382-W384 VanDerWaalsContact C-N 3.3Å; P382-W384 HydrophobicContact CB-CD2 4.15Å; P382-W384 HydrophobicContact CB-CG 3.93Å; P382-W384 HydrophobicContact CB-CZ2 4.35Å; P382-W384 HydrophobicContact CG-CD2 4.38Å; P382-W384 HydrophobicContact CG-CZ2 3.79Å; P382-W384 PolarHBondContact O-N 3.33Å; W384-S386 PolarHBondContact O-N 2.71Å; W384-T387 PolarHBondContact O-N 3.27Å; W384-H388 AromaticContact CE3-CE1 3.56Å; W384-H388 AromaticContact CE3-NE2 3.84Å; W384-H388 AromaticContact CZ3-CE1 3.98Å; W384-H388 PolarHBondContact O-CD2 2.96Å; W384-H388 PolarHBondContact O-NE2 3.44Å
385L44.3Very low59.7Low6 Ų662.7 Ų62.73%0.03135%0.353CS..G310 helixtrans-60.8-16.5-171.9-159.770.9000114.6W366 L369 V381 P382 T387 H388 H391 R394W366-L385 HydrophobicContact CH2-CD1 4.17Å; W366-L385 HydrophobicContact CZ3-CD1 3.82Å; W366-L385 HydrophobicContact CZ3-CD2 4.46Å; L369-L385 HydrophobicContact CD1-CD2 4.44Å; V381-L385 HydrophobicContact CB-CB 4.31Å; V381-L385 HydrophobicContact CG1-CB 4.29Å; V381-L385 HydrophobicContact CG1-CD2 4.16Å; V381-L385 HydrophobicContact CG1-CG 4.1Å; P382-L385 HydrophobicContact CB-CB 3.89Å; P382-L385 HydrophobicContact CG-CB 3.59Å; P382-L385 HydrophobicContact CG-CD2 4.07Å; P382-L385 HydrophobicContact CG-CG 4.47Å; P382-L385 CarbonylContact O-C 3.55Å; P382-L385 PolarHBondContact O-N 3.47Å; P382-L385 VanDerWaalsContact O-N 3.11Å; L385-T387 PolarHBondContact O-N 3.41Å; L385-H388 VanDerWaalsContact C-CD2 3.46Å; L385-H388 WeakPolarHBondContact CA-CD2 3.44Å; L385-H388 HydrophobicContact CD1-CB 3.88Å; L385-H388 HydrophobicContact CG-CB 4.38Å; L385-H388 WeakPolarHBondContact O-CB 3.22Å; L385-H388 PolarHBondContact O-CD2 3.16Å; L385-H388 PolarHBondContact O-N 3Å; L385-H388 VanDerWaalsContact O-N 3.09Å; L385-H391 WeakPolarHBondContact CD2-CE1 3.32Å; L385-R394 VanDerWaalsContact CD1-NH1 3.32Å
386S44.1Very low60.2Low67 Ų6757.3 Ų57.347%0.46933%0.332SS..G310 helixtrans-60-6.1178.9-68.10000115.7P382 W384P382-S386 PolarHBondContact O-N 3.31Å; P382-S386 PolarHBondContact O-OG 2.86Å; W384-S386 PolarHBondContact O-N 2.71Å
387T43.5Very low60.9Low27 Ų2757.3 Ų57.317%0.16633%0.327CS..G310 helixtrans-112.80.1177.173.30000114.9F332 S337 W384 L385F332-T387 HydrophobicContact CB-CG2 4.22Å; F332-T387 HydrophobicContact CD1-CG2 3.86Å; F332-T387 WeakPolarHBondContact O-CB 3.32Å; S337-T387 PolarHBondContact OG-O 3.01Å; S337-T387 VanDerWaalsContact OG-O 3.07Å; W384-T387 PolarHBondContact O-N 3.27Å; L385-T387 PolarHBondContact O-N 3.41Å
388H52.4Low62.3Low32 Ų3254.3 Ų54.315%0.14830%0.296CS..SBendtrans-92158.5-160.7-68.3-130.7000113.1H280 E341 W384 L385 R394H280-H388 AromaticContact NE2-CE1 3.48Å; H280-H388 PolarHBondContact NE2-CE1 3.42Å; E341-H388 HydrophobicContact CG-CB 4.34Å; E341-H388 WeakPolarHBondContact CG-ND1 3.48Å; E341-H388 IonicContact OE1-CE1 2.68Å; E341-H388 IonicContact OE1-NE2 3.8Å; E341-H388 IonicContact OE2-CE1 3.37Å; E341-H388 PolarHBondContact OE2-CE1 3.19Å; E341-H388 IonicContact OE2-CG 3.94Å; E341-H388 IonicContact OE2-ND1 2.73Å; E341-H388 PolarHBondContact OE2-ND1 3.3Å; E341-H388 IonicContact OE2-NE2 3.59Å; W384-H388 AromaticContact CE3-CE1 3.56Å; W384-H388 AromaticContact CE3-NE2 3.84Å; W384-H388 AromaticContact CZ3-CE1 3.98Å; W384-H388 PolarHBondContact O-CD2 2.96Å; W384-H388 PolarHBondContact O-NE2 3.44Å; L385-H388 VanDerWaalsContact C-CD2 3.46Å; L385-H388 WeakPolarHBondContact CA-CD2 3.44Å; L385-H388 HydrophobicContact CD1-CB 3.88Å; L385-H388 HydrophobicContact CG-CB 4.38Å; L385-H388 WeakPolarHBondContact O-CB 3.22Å; L385-H388 PolarHBondContact O-CD2 3.16Å; L385-H388 PolarHBondContact O-N 3Å; L385-H388 VanDerWaalsContact O-N 3.09Å; H388-R394 PolarHBondContact ND1-NH1 3.48Å
389P54.9Low64Low25 Ų2550.9 Ų50.916%0.16228%0.277CS..PPolyproline II helixtrans-65.6149.4170.126.7-29.7000110.9R338 H391 R394R338-P389 HydrophobicContact CG-CB 4.09Å; R338-P389 HydrophobicContact CG-CG 4.19Å; P389-H391 PolarHBondContact O-N 2.95Å; P389-R394 HydrophobicContact CG-CG 3.94Å
390S64.3Low65.9Low72 Ų7255.9 Ų55.950%0.50328%0.283SS..PPolyproline II helixtrans-50.6136.2-179.654.30000112.7R392 N393 R394S390-R392 PolarHBondContact O-N 3.48Å; S390-N393 WeakPolarHBondContact O-CB 3.34Å; S390-N393 PolarHBondContact O-N 3.28Å; S390-N393 PolarHBondContact OG-ND2 3.01Å; S390-N393 VanDerWaalsContact OG-ND2 3.14Å; S390-R394 PolarHBondContact O-N 2.92Å
391H70.9Confident68Low17 Ų1754.6 Ų54.68%0.07928%0.275CS..Hα-helixtrans-45.3-40.4-172.8-54.2-90.2000114.2W366 L369 E370 D373 L385 P389 N393 R394 S395W366-H391 AromaticContact CE3-ND1 3.91Å; W366-H391 WeakPolarHBondContact O-CB 3.41Å; L369-H391 WeakPolarHBondContact CB-CE1 3.28Å; E370-H391 HydrophobicContact CB-CB 3.72Å; E370-H391 HydrophobicContact CG-CB 3.98Å; D373-H391 IonicContact OD1-NE2 2.73Å; D373-H391 PolarHBondContact OD1-NE2 3Å; D373-H391 IonicContact OD2-CD2 2.74Å; D373-H391 IonicContact OD2-NE2 2.98Å; D373-H391 PolarHBondContact OD2-NE2 2.98Å; L385-H391 WeakPolarHBondContact CD2-CE1 3.32Å; P389-H391 PolarHBondContact O-N 2.95Å; H391-N393 VanDerWaalsContact C-N 3.28Å; H391-N393 PolarHBondContact O-N 3.37Å; H391-R394 PolarHBondContact O-N 2.91Å; H391-R394 VanDerWaalsContact O-N 3.08Å; H391-S395 PolarHBondContact O-N 3.09Å
392R71.3Confident70.2Confident181 Ų18152.2 Ų52.268%0.68326%0.26SS*.Hα-helixtrans-53.9-40.3176-162.1172.9175.4-178.4-0.3114E370 S390 G396E370-R392 VanDerWaalsContact OE2-CA 3.27Å; E370-R392 WeakPolarHBondContact OE2-CA 3.45Å; E370-R392 WeakPolarHBondContact OE2-CB 3.35Å; E370-R392 PolarHBondContact OE2-N 2.91Å; S390-R392 PolarHBondContact O-N 3.48Å; R392-G396 PolarHBondContact O-N 2.87Å
393N78.7Confident72.3Confident101 Ų10156.2 Ų56.254%0.5429%0.286SS..Hα-helixtrans-72.9-37.6178.7-70.9-33000111.1S390 H391 G396 Q397S390-N393 WeakPolarHBondContact O-CB 3.34Å; S390-N393 PolarHBondContact O-N 3.28Å; S390-N393 PolarHBondContact OG-ND2 3.01Å; S390-N393 VanDerWaalsContact OG-ND2 3.14Å; H391-N393 VanDerWaalsContact C-N 3.28Å; H391-N393 PolarHBondContact O-N 3.37Å; N393-G396 PolarHBondContact O-N 2.68Å; N393-Q397 WeakPolarHBondContact O-CB 3.5Å; N393-Q397 PolarHBondContact O-N 2.87Å
394R80.8Confident75.1Confident1 Ų153.2 Ų53.20%0.00427%0.272CS..Hα-helixtrans-64.3-48.6174.4-62.7-172.371.6172.90.1111.1H276 D345 W366 L385 H388 P389 S390 H391 G396 Q397 M398H276-R394 PolarHBondContact CE1-NH2 2.88Å; H276-R394 PolarHBondContact NE2-NH2 3.44Å; D345-R394 VanDerWaalsContact CG-NH2 3.28Å; D345-R394 IonicContact OD1-CZ 3.21Å; D345-R394 IonicContact OD1-NE 2.78Å; D345-R394 IonicContact OD1-NH2 3.5Å; D345-R394 PolarHBondContact OD1-NH2 2.82Å; D345-R394 IonicContact OD2-CZ 3.99Å; D345-R394 IonicContact OD2-NE 1.88Å; D345-R394 PolarHBondContact OD2-NE 3.22Å; D345-R394 IonicContact OD2-NH2 2.72Å; D345-R394 PolarHBondContact OD2-NH2 2.89Å; W366-R394 HydrophobicContact CD2-CB 4.33Å; W366-R394 HydrophobicContact CG-CB 4.16Å; L385-R394 VanDerWaalsContact CD1-NH1 3.32Å; H388-R394 PolarHBondContact ND1-NH1 3.48Å; P389-R394 HydrophobicContact CG-CG 3.94Å; S390-R394 PolarHBondContact O-N 2.92Å; H391-R394 PolarHBondContact O-N 2.91Å; H391-R394 VanDerWaalsContact O-N 3.08Å; R394-G396 PolarHBondContact O-N 3.36Å; R394-Q397 PolarHBondContact O-N 3.34Å; R394-M398 VanDerWaalsContact O-CB 3.29Å; R394-M398 WeakPolarHBondContact O-CB 3.31Å; R394-M398 PolarHBondContact O-N 2.87Å
395S85.4Confident77.4Confident6 Ų651.7 Ų51.74%0.04227%0.266CS..Hα-helixtrans-54-52.4172.3161.20000111.9Q367 H391 Q397 M398 D399Q367-S395 PolarHBondContact NE2-OG 3.49Å; H391-S395 PolarHBondContact O-N 3.09Å; S395-Q397 PolarHBondContact O-N 3.31Å; S395-M398 PolarHBondContact O-N 3.43Å; S395-D399 PolarHBondContact O-N 3.3Å
396G87.4Confident79.9Confident30 Ų3053.7 Ų53.731%0.30928%0.277SS..Hα-helixtrans-70-12.7-178.900000115.3R392 N393 R394 R400R392-G396 PolarHBondContact O-N 2.87Å; N393-G396 PolarHBondContact O-N 2.68Å; R394-G396 PolarHBondContact O-N 3.36Å; G396-R400 WeakPolarHBondContact O-CG 3.26Å; G396-R400 PolarHBondContact O-NE 2.95Å
397Q87.9Confident82.5Confident62 Ų6256.6 Ų56.629%0.2928%0.283SS..Hα-helixtrans-85.9-49.4166.5172.3169.9-19.100110.7A342 N393 R394 S395 D399 R400 L401A342-Q397 VanDerWaalsContact CA-NE2 3.26Å; A342-Q397 VanDerWaalsContact CB-NE2 3.26Å; A342-Q397 PolarHBondContact O-NE2 2.91Å; N393-Q397 WeakPolarHBondContact O-CB 3.5Å; N393-Q397 PolarHBondContact O-N 2.87Å; R394-Q397 PolarHBondContact O-N 3.34Å; S395-Q397 PolarHBondContact O-N 3.31Å; Q397-D399 VanDerWaalsContact C-N 3.28Å; Q397-D399 PolarHBondContact O-N 2.91Å; Q397-R400 WeakPolarHBondContact O-CB 3.29Å; Q397-R400 PolarHBondContact O-N 2.92Å; Q397-L401 HydrophobicContact CG-CD1 4.44Å; Q397-L401 PolarHBondContact O-N 3.32Å
398M89.7Confident85Confident2 Ų257.3 Ų57.31%0.0129%0.285CS..Hα-helixtrans-55.7-43179.8-162.172.483.400111.2D345 L349 P363 R394 S395 R400 L401 I402D345-M398 HydrophobicContact CB-CE 3.81Å; D345-M398 HydrophobicContact CB-SD 4.42Å; D345-M398 WeakPolarHBondContact OD1-CE 3.41Å; L349-M398 HydrophobicContact CB-SD 3.97Å; L349-M398 HydrophobicContact CD1-CG 4.24Å; L349-M398 HydrophobicContact CD1-SD 3.69Å; L349-M398 HydrophobicContact CD2-CG 4.35Å; L349-M398 HydrophobicContact CD2-SD 3.75Å; L349-M398 HydrophobicContact CG-SD 4Å; P363-M398 HydrophobicContact CG-CB 4Å; P363-M398 HydrophobicContact CG-CG 3.89Å; R394-M398 VanDerWaalsContact O-CB 3.29Å; R394-M398 WeakPolarHBondContact O-CB 3.31Å; R394-M398 PolarHBondContact O-N 2.87Å; S395-M398 PolarHBondContact O-N 3.43Å; M398-R400 PolarHBondContact O-N 3.2Å; M398-R400 VanDerWaalsContact O-N 3.13Å; M398-L401 WeakPolarHBondContact O-CA 3.26Å; M398-L401 WeakPolarHBondContact O-CB 3.29Å; M398-L401 PolarHBondContact O-N 3.4Å; M398-I402 WeakPolarHBondContact O-CG1 3.45Å; M398-I402 PolarHBondContact O-N 3.36Å; M398-I402 VanDerWaalsContact O-N 3.13Å
399D92.6Very high87.2Confident48 Ų4856.4 Ų56.426%0.25728%0.281SS..Hα-helixtrans-56-27.8174.9-86.7-46.9000114.3P363 S395 Q397 R423P363-D399 WeakPolarHBondContact CG-OD1 3.44Å; S395-D399 PolarHBondContact O-N 3.3Å; Q397-D399 VanDerWaalsContact C-N 3.28Å; Q397-D399 PolarHBondContact O-N 2.91Å; D399-R423 WeakPolarHBondContact OD1-CD 3.31Å; D399-R423 IonicContact OD1-CZ 2.81Å; D399-R423 IonicContact OD1-NE 2.42Å; D399-R423 IonicContact OD1-NH1 3.03Å; D399-R423 PolarHBondContact OD1-NH1 2.97Å
400R94.6Very high89.1Confident205 Ų20562.6 Ų62.677%0.77431%0.307SS*.Hα-helixtrans-80.3-22.2176.8-55172.3-168.9-169-3.6112.7G396 Q397 M398 P403G396-R400 WeakPolarHBondContact O-CG 3.26Å; G396-R400 PolarHBondContact O-NE 2.95Å; Q397-R400 WeakPolarHBondContact O-CB 3.29Å; Q397-R400 PolarHBondContact O-N 2.92Å; M398-R400 PolarHBondContact O-N 3.2Å; M398-R400 VanDerWaalsContact O-N 3.13Å; R400-P403 WeakPolarHBondContact O-CD 3.33Å
401L95.8Very high90.7Very high23 Ų2364.3 Ų64.312%0.1232%0.315CS..Hα-helixtrans-89.4-21.5179.4-60.8172.6000111.9Q346 L349 Q397 M398 P403 Q404 A405Q346-L401 HydrophobicContact CB-CD1 3.96Å; Q346-L401 HydrophobicContact CG-CD1 4.34Å; Q346-L401 HydrophobicContact CG-CD2 4.29Å; L349-L401 HydrophobicContact CD2-CB 3.62Å; Q397-L401 HydrophobicContact CG-CD1 4.44Å; Q397-L401 PolarHBondContact O-N 3.32Å; M398-L401 WeakPolarHBondContact O-CA 3.26Å; M398-L401 WeakPolarHBondContact O-CB 3.29Å; M398-L401 PolarHBondContact O-N 3.4Å; L401-P403 VanDerWaalsContact C-CD 3.47Å; L401-Q404 PolarHBondContact O-N 2.82Å; L401-Q404 VanDerWaalsContact O-N 3.16Å; L401-A405 PolarHBondContact O-N 3.05Å
402I96.4Very high91.8Very high3 Ų365.5 Ų65.52%0.01532%0.324CS..Hα-helixtrans-47-47.5177.2-61.8-59.5000113.5L349 V359 R360 P363 M398 Q404 A405 L406L349-I402 HydrophobicContact CD2-CD1 4.3Å; V359-I402 HydrophobicContact CB-CD1 4.16Å; V359-I402 HydrophobicContact CG2-CD1 4.25Å; V359-I402 WeakPolarHBondContact O-CD1 3.19Å; R360-I402 HydrophobicContact CG-CG2 4.14Å; P363-I402 HydrophobicContact CG-CD1 4.01Å; P363-I402 HydrophobicContact CG-CG1 4.16Å; M398-I402 WeakPolarHBondContact O-CG1 3.45Å; M398-I402 PolarHBondContact O-N 3.36Å; M398-I402 VanDerWaalsContact O-N 3.13Å; I402-Q404 PolarHBondContact O-N 3.45Å; I402-A405 PolarHBondContact O-N 2.95Å; I402-L406 HydrophobicContact CG2-CD1 3.72Å; I402-L406 HydrophobicContact CG2-CG 4.04Å; I402-L406 VanDerWaalsContact O-CG 3.28Å; I402-L406 WeakPolarHBondContact O-CG 3.39Å; I402-L406 PolarHBondContact O-N 3.37Å
403P96.9Very high93Very high85 Ų8562 Ų6255%0.55233%0.328SS*.Hα-helixtrans-60.5-43.2-178.2-23.835.5000113.1R400 L401 L406 E407R400-P403 WeakPolarHBondContact O-CD 3.33Å; L401-P403 VanDerWaalsContact C-CD 3.47Å; P403-L406 PolarHBondContact O-N 3.41Å; P403-E407 PolarHBondContact O-N 3.32Å
404Q96.9Very high93.9Very high93 Ų9358.1 Ų58.144%0.43531%0.308SS..Hα-helixtrans-67.2-39.3176.7-175.2-173.943.600111.5H350 L401 I402 L406 E407 L408H350-Q404 PolarHBondContact CE1-OE1 3.23Å; H350-Q404 PolarHBondContact NE2-OE1 2.85Å; L401-Q404 PolarHBondContact O-N 2.82Å; L401-Q404 VanDerWaalsContact O-N 3.16Å; I402-Q404 PolarHBondContact O-N 3.45Å; Q404-L406 VanDerWaalsContact C-N 3.33Å; Q404-E407 PolarHBondContact O-N 3.18Å; Q404-L408 WeakPolarHBondContact O-CB 3.38Å; Q404-L408 PolarHBondContact O-N 2.82Å
405A97.1Very high94.6Very high0 Ų062.4 Ų62.40%034%0.336CS..Hα-helixtrans-69.4-30.3178.400000112.5L349 A353 V359 L401 I402 R409L349-A405 HydrophobicContact CD2-CB 3.7Å; L349-A405 HydrophobicContact CG-CB 3.91Å; A353-A405 HydrophobicContact CB-CB 4.23Å; A353-A405 WeakPolarHBondContact CB-O 3.39Å; V359-A405 HydrophobicContact CB-CB 4.15Å; V359-A405 HydrophobicContact CG1-CB 4.06Å; V359-A405 HydrophobicContact CG2-CB 3.92Å; L401-A405 PolarHBondContact O-N 3.05Å; I402-A405 PolarHBondContact O-N 2.95Å; A405-R409 PolarHBondContact O-N 2.98Å; A405-R409 VanDerWaalsContact O-N 3.08Å
406L97.4Very high95.1Very high48 Ų4867 Ų6725%0.25138%0.375SS..Hα-helixtrans-70.7-44.8170.9-68.7175.2000111.8V359 I402 P403 Q404 L408 R409 E410 L417V359-L406 HydrophobicContact CG2-CD2 3.85Å; V359-L406 HydrophobicContact CG2-CG 4.22Å; I402-L406 HydrophobicContact CG2-CD1 3.72Å; I402-L406 HydrophobicContact CG2-CG 4.04Å; I402-L406 VanDerWaalsContact O-CG 3.28Å; I402-L406 WeakPolarHBondContact O-CG 3.39Å; I402-L406 PolarHBondContact O-N 3.37Å; P403-L406 PolarHBondContact O-N 3.41Å; Q404-L406 VanDerWaalsContact C-N 3.33Å; L406-L408 PolarHBondContact O-N 3.29Å; L406-R409 WeakPolarHBondContact O-CB 3.36Å; L406-R409 PolarHBondContact O-N 3.31Å; L406-R409 VanDerWaalsContact O-N 3.12Å; L406-E410 PolarHBondContact O-N 3.03Å; L406-L417 HydrophobicContact CD2-CD1 3.43Å; L406-L417 VanDerWaalsContact CD2-CD1 3.43Å
407E97.4Very high95.5Very high128 Ų12868 Ų6860%0.59837%0.373SS*.Hα-helixtrans-58.2-36.8173-176.5177.7-162.400111.9P403 Q404 E410 T411P403-E407 PolarHBondContact O-N 3.32Å; Q404-E407 PolarHBondContact O-N 3.18Å; E407-E410 PolarHBondContact O-N 3.13Å; E407-T411 WeakPolarHBondContact O-CB 3.47Å; E407-T411 PolarHBondContact O-N 2.82Å; E407-T411 PolarHBondContact O-OG1 3.37Å
408L96.8Very high95.7Very high42 Ų4268.1 Ų68.122%0.2238%0.381CS..Hα-helixtrans-68.1-40.2174.7-172.557.6000112.6H350 A353 K354 Q404 L406 E410 T411 C412H350-L408 HydrophobicContact CB-CD2 3.79Å; A353-L408 HydrophobicContact CB-CB 4.32Å; A353-L408 HydrophobicContact CB-CD2 4.17Å; A353-L408 HydrophobicContact CB-CG 4.33Å; K354-L408 HydrophobicContact CD-CD1 4.35Å; K354-L408 HydrophobicContact CD-CD2 4.13Å; K354-L408 HydrophobicContact CD-CG 4.44Å; K354-L408 HydrophobicContact CG-CD1 4.04Å; K354-L408 HydrophobicContact CG-CD2 3.79Å; K354-L408 HydrophobicContact CG-CG 3.78Å; Q404-L408 WeakPolarHBondContact O-CB 3.38Å; Q404-L408 PolarHBondContact O-N 2.82Å; L406-L408 PolarHBondContact O-N 3.29Å; L408-E410 PolarHBondContact O-N 3.42Å; L408-T411 PolarHBondContact O-N 2.85Å; L408-C412 WeakPolarHBondContact O-CB 3.35Å; L408-C412 PolarHBondContact O-N 2.94Å; L408-C412 PolarHBondContact O-SG 3.01Å
409R97.5Very high95.9Very high13 Ų1374.4 Ų74.45%0.04942%0.422CS..Hα-helixtrans-58.3-45.7171.4-78.5-179.762.1949.2112A353 C356 A357 A405 L406 C412 S413 C414 P415 L417A353-R409 HydrophobicContact CB-CG 4.06Å; A353-R409 WeakPolarHBondContact O-CG 3.45Å; C356-R409 PolarHBondContact O-NH1 3.41Å; A357-R409 PolarHBondContact O-NH1 3.33Å; A405-R409 PolarHBondContact O-N 2.98Å; A405-R409 VanDerWaalsContact O-N 3.08Å; L406-R409 WeakPolarHBondContact O-CB 3.36Å; L406-R409 PolarHBondContact O-N 3.31Å; L406-R409 VanDerWaalsContact O-N 3.12Å; R409-C412 CarbonylContact O-C 3.57Å; R409-C412 PolarHBondContact O-N 3.34Å; R409-S413 PolarHBondContact O-N 3.14Å; R409-C414 HydrophobicContact CB-CB 4.07Å; R409-C414 HydrophobicContact CG-CB 4.48Å; R409-C414 WeakPolarHBondContact O-CB 3.29Å; R409-C414 PolarHBondContact O-N 2.88Å; R409-P415 PolarHBondContact NH2-O 3.17Å; R409-L417 VanDerWaalsContact CZ-CD2 3.4Å
410E95.8Very high95.9Very high155 Ų15576 Ų7672%0.72443%0.433SS*.Hα-helixtrans-63.6-44.7179.7-70.7179.1-17100110.7L406 E407 L408 C412 S413L406-E410 PolarHBondContact O-N 3.03Å; E407-E410 PolarHBondContact O-N 3.13Å; L408-E410 PolarHBondContact O-N 3.42Å; E410-C412 VanDerWaalsContact C-N 3.29Å; E410-C412 PolarHBondContact O-N 3.15Å; E410-S413 PolarHBondContact O-N 2.86Å
411T96.6Very high95.9Very high107 Ų10768.1 Ų68.166%0.65641%0.406SS*.Hα-helixtrans-58.1-40.4173.6-58.30000112E407 L408 S413E407-T411 WeakPolarHBondContact O-CB 3.47Å; E407-T411 PolarHBondContact O-N 2.82Å; E407-T411 PolarHBondContact O-OG1 3.37Å; L408-T411 PolarHBondContact O-N 2.85Å; T411-S413 PolarHBondContact O-N 2.8Å
412C95.7Very high95.9Very high42 Ų4268.6 Ų68.628%0.28441%0.41SS..THydrogen-bonded Turntrans-77.66.3175.1-720000114.6L408 R409 E410 C414L408-C412 WeakPolarHBondContact O-CB 3.35Å; L408-C412 PolarHBondContact O-N 2.94Å; L408-C412 PolarHBondContact O-SG 3.01Å; R409-C412 CarbonylContact O-C 3.57Å; R409-C412 PolarHBondContact O-N 3.34Å; E410-C412 VanDerWaalsContact C-N 3.29Å; E410-C412 PolarHBondContact O-N 3.15Å; C412-C414 PolarHBondContact O-N 2.73Å
413S95.9Very high95.7Very high107 Ų10771.3 Ų71.375%0.74842%0.421SS*.THydrogen-bonded Turntrans5437.7-179.4-58.10000113.2R409 E410 T411R409-S413 PolarHBondContact O-N 3.14Å; E410-S413 PolarHBondContact O-N 2.86Å; T411-S413 PolarHBondContact O-N 2.8Å
414C97.1Very high95.6Very high20 Ų2070.4 Ų70.414%0.13542%0.42CS..PPolyproline II helixtrans-68.1156.8176.3-70.50000112.1A353 C356 R409 C412A353-C414 PolarHBondContact O-SG 3.49Å; C356-C414 WeakPolarHBondContact CA-SG 3.39Å; C356-C414 HydrophobicContact CB-CB 3.63Å; C356-C414 WeakPolarHBondContact CB-SG 3.24Å; C356-C414 WeakPolarHBondContact SG-CA 3.33Å; C356-C414 WeakPolarHBondContact SG-CB 3.49Å; C356-C414 CovalentContact SG-SG 2.04Å; C356-C414 PolarHBondContact SG-SG 3.12Å; R409-C414 HydrophobicContact CB-CB 4.07Å; R409-C414 HydrophobicContact CG-CB 4.48Å; R409-C414 WeakPolarHBondContact O-CB 3.29Å; R409-C414 PolarHBondContact O-N 2.88Å; C412-C414 PolarHBondContact O-N 2.73Å
415P96.1Very high95.4Very high91 Ų9169.4 Ų69.459%0.59142%0.42SS*.PPolyproline II helixtrans-55.4147.9173.1-25.235.1000112.7R409 L417R409-P415 PolarHBondContact NH2-O 3.17Å; P415-L417 PolarHBondContact O-N 3.48Å
416A95Very high95.2Very high104 Ų10470.9 Ų70.986%0.8643%0.426SS*.PPolyproline II helixtrans-60.2136.2173.100000110.6
417L95.9Very high95Very high51 Ų5171.7 Ų71.727%0.26744%0.436SS..PPolyproline II helixtrans-76.8161.4179.6-72.7177.1000112.2D358 L406 R409 P415D358-L417 HydrophobicContact CB-CD2 3.62Å; D358-L417 WeakPolarHBondContact OD1-CD1 3.47Å; L406-L417 HydrophobicContact CD2-CD1 3.43Å; L406-L417 VanDerWaalsContact CD2-CD1 3.43Å; R409-L417 VanDerWaalsContact CZ-CD2 3.4Å; P415-L417 PolarHBondContact O-N 3.48Å
418S93.5Very high94.8Very high64 Ų6472 Ų7245%0.44844%0.435SS..PPolyproline II helixtrans-57.2134.6170.1179.50000110.6R360 V420R360-S418 PolarHBondContact NH1-O 3.46Å; R360-S418 PolarHBondContact NH2-O 3.41Å; S418-V420 PolarHBondContact O-N 3.26Å; S418-V420 VanDerWaalsContact O-N 3.16Å; S418-V420 PolarHBondContact OG-N 3.33Å
419P92.4Very high94.6Very high134 Ų13473.2 Ų73.287%0.8745%0.445SS*.SBendtrans-65.2-15.9174.629.1-36000112.4
420V93.8Very high94.2Very high82 Ų8274 Ų7450%0.49745%0.451SS..SBendtrans-80.9122.9169.5-177.10000108.8R360 S418 V425R360-V420 PolarHBondContact NH1-O 3.13Å; R360-V420 PolarHBondContact NH2-O 2.96Å; R360-V420 VanDerWaalsContact NH2-O 3.17Å; S418-V420 PolarHBondContact O-N 3.26Å; S418-V420 VanDerWaalsContact O-N 3.16Å; S418-V420 PolarHBondContact OG-N 3.33Å; V420-V425 HydrophobicContact CG1-CG2 3.29Å
421D94.1Very high94Very high38 Ų3870 Ų7020%0.20344%0.44CS..  trans-83.2123.4173.9-168-51.7000110.1R423 A424 V425D421-R423 PolarHBondContact O-N 2.87Å; D421-R423 WeakPolarHBondContact OD1-CB 3.41Å; D421-R423 WeakPolarHBondContact OD1-CG 3.49Å; D421-R423 IonicContact OD1-CZ 2.92Å; D421-R423 PolarHBondContact OD1-N 2.77Å; D421-R423 IonicContact OD1-NE 2.72Å; D421-R423 PolarHBondContact OD1-NE 3.35Å; D421-R423 IonicContact OD1-NH2 3.87Å; D421-R423 IonicContact OD2-CZ 3.47Å; D421-R423 IonicContact OD2-NE 3.38Å; D421-R423 PolarHBondContact OD2-NE 3.11Å; D421-R423 IonicContact OD2-NH2 2.71Å; D421-R423 PolarHBondContact OD2-NH2 3.46Å; D421-A424 HydrophobicContact CB-CB 4.22Å; D421-A424 WeakPolarHBondContact O-CB 3.25Å; D421-A424 PolarHBondContact O-N 3.32Å; D421-A424 VanDerWaalsContact O-N 3.08Å; D421-V425 PolarHBondContact O-N 3.39Å
422P95.2Very high93.8Very high33 Ų3368.9 Ų68.921%0.21443%0.427CS..Hα-helixtrans-61.7-27.6-178.125.4-34.5000112.7R360 V364 V425 F426R360-P422 HydrophobicContact CB-CG 3.63Å; V364-P422 HydrophobicContact CG2-CB 4.33Å; P422-V425 PolarHBondContact O-N 2.98Å; P422-F426 WeakPolarHBondContact O-CB 3.47Å; P422-F426 PolarHBondContact O-N 3.2Å
423R93.4Very high93.6Very high61 Ų6172 Ų7223%0.2344%0.441CS..Hα-helixtrans-67.8-37.3176.4-55.9170.5-67.8175.5-1.7111.7R360 P363 V364 D399 D421 S427R360-R423 VanDerWaalsContact O-CG 3.26Å; R360-R423 WeakPolarHBondContact O-CG 3.23Å; P363-R423 HydrophobicContact CB-CG 4.36Å; V364-R423 HydrophobicContact CG2-CB 4.21Å; V364-R423 HydrophobicContact CG2-CG 3.68Å; D399-R423 WeakPolarHBondContact OD1-CD 3.31Å; D399-R423 IonicContact OD1-CZ 2.81Å; D399-R423 IonicContact OD1-NE 2.42Å; D399-R423 IonicContact OD1-NH1 3.03Å; D399-R423 PolarHBondContact OD1-NH1 2.97Å; D421-R423 PolarHBondContact O-N 2.87Å; D421-R423 WeakPolarHBondContact OD1-CB 3.41Å; D421-R423 WeakPolarHBondContact OD1-CG 3.49Å; D421-R423 IonicContact OD1-CZ 2.92Å; D421-R423 PolarHBondContact OD1-N 2.77Å; D421-R423 IonicContact OD1-NE 2.72Å; D421-R423 PolarHBondContact OD1-NE 3.35Å; D421-R423 IonicContact OD1-NH2 3.87Å; D421-R423 IonicContact OD2-CZ 3.47Å; D421-R423 IonicContact OD2-NE 3.38Å; D421-R423 PolarHBondContact OD2-NE 3.11Å; D421-R423 IonicContact OD2-NH2 2.71Å; D421-R423 PolarHBondContact OD2-NH2 3.46Å; R423-S427 WeakPolarHBondContact O-CB 3.07Å; R423-S427 PolarHBondContact O-N 3.07Å
424A93.5Very high93.2Very high65 Ų6572.4 Ų72.454%0.53743%0.434SS..Hα-helixtrans-69.9-39.7176.300000111.6D421 K428D421-A424 HydrophobicContact CB-CB 4.22Å; D421-A424 WeakPolarHBondContact O-CB 3.25Å; D421-A424 PolarHBondContact O-N 3.32Å; D421-A424 VanDerWaalsContact O-N 3.08Å; A424-K428 WeakPolarHBondContact O-CB 3.39Å; A424-K428 PolarHBondContact O-N 2.83Å; A424-K428 VanDerWaalsContact O-N 3.11Å
425V94.1Very high92.9Very high72 Ų7273.5 Ų73.544%0.43644%0.444SS..Hα-helixtrans-62.1-51.7173.2177.80000110.5V420 D421 P422 K428 T429V420-V425 HydrophobicContact CG1-CG2 3.29Å; D421-V425 PolarHBondContact O-N 3.39Å; P422-V425 PolarHBondContact O-N 2.98Å; V425-K428 PolarHBondContact O-N 3.3Å; V425-T429 PolarHBondContact O-N 2.84Å; V425-T429 PolarHBondContact O-OG1 3.46Å; V425-T429 VanDerWaalsContact O-OG1 3.08Å
426F93.1Very high92.7Very high31 Ų3174.1 Ų74.114%0.13644%0.438CS..Hα-helixtrans-59.8-49.5-179.5176.8-99000112.2V364 Q367 Q368 I371 P422 K428 T429 V430V364-F426 HydrophobicContact CG1-CB 3.75Å; V364-F426 HydrophobicContact CG1-CD1 4.25Å; V364-F426 HydrophobicContact CG1-CD2 3.7Å; V364-F426 HydrophobicContact CG1-CE2 4.36Å; V364-F426 HydrophobicContact CG1-CG 3.62Å; V364-F426 HydrophobicContact CG2-CB 4.24Å; Q367-F426 HydrophobicContact CB-CD1 4.33Å; Q367-F426 HydrophobicContact CB-CE1 3.46Å; Q367-F426 VanDerWaalsContact CB-CE1 3.46Å; Q367-F426 HydrophobicContact CB-CZ 3.86Å; Q367-F426 HydrophobicContact CG-CE1 4.39Å; Q367-F426 VanDerWaalsContact OE1-CE1 3.23Å; Q368-F426 HydrophobicContact CG-CD2 4.14Å; Q368-F426 HydrophobicContact CG-CE2 3.43Å; Q368-F426 VanDerWaalsContact CG-CE2 3.43Å; Q368-F426 HydrophobicContact CG-CZ 3.98Å; I371-F426 HydrophobicContact CD1-CE2 4.46Å; I371-F426 HydrophobicContact CD1-CZ 3.72Å; P422-F426 WeakPolarHBondContact O-CB 3.47Å; P422-F426 PolarHBondContact O-N 3.2Å; F426-K428 VanDerWaalsContact C-N 3.29Å; F426-K428 PolarHBondContact O-N 3.43Å; F426-T429 PolarHBondContact O-N 3.32Å; F426-T429 VanDerWaalsContact O-N 3.15Å; F426-V430 HydrophobicContact CD1-CG2 4.2Å; F426-V430 HydrophobicContact CD2-CG2 4.19Å; F426-V430 HydrophobicContact CE1-CG2 3.76Å; F426-V430 HydrophobicContact CE2-CG2 3.76Å; F426-V430 HydrophobicContact CG-CG2 4.4Å; F426-V430 HydrophobicContact CZ-CG2 3.55Å; F426-V430 WeakPolarHBondContact O-CG2 3.46Å; F426-V430 PolarHBondContact O-N 2.86Å
427S91.3Very high92.3Very high65 Ų6571.8 Ų71.846%0.45542%0.419SS..Hα-helixtrans-57.9-40.4178-178.70000112.4R423 S431R423-S427 WeakPolarHBondContact O-CB 3.07Å; R423-S427 PolarHBondContact O-N 3.07Å; S427-S431 WeakPolarHBondContact O-CB 3.25Å; S427-S431 PolarHBondContact O-N 2.91Å; S427-S431 PolarHBondContact O-OG 3.3Å
428K93.8Very high91.8Very high134 Ų13478 Ų7858%0.58344%0.443SS*.Hα-helixtrans-64.9-49.4173.3179.7174.8170177.80112A424 V425 F426 V430 S431 E432A424-K428 WeakPolarHBondContact O-CB 3.39Å; A424-K428 PolarHBondContact O-N 2.83Å; A424-K428 VanDerWaalsContact O-N 3.11Å; V425-K428 PolarHBondContact O-N 3.3Å; F426-K428 VanDerWaalsContact C-N 3.29Å; F426-K428 PolarHBondContact O-N 3.43Å; K428-V430 PolarHBondContact O-N 3.5Å; K428-S431 WeakPolarHBondContact O-CB 3.26Å; K428-S431 PolarHBondContact O-N 2.91Å; K428-S431 VanDerWaalsContact O-N 3.15Å; K428-E432 WeakPolarHBondContact CE-OE1 3.36Å; K428-E432 IonicContact NZ-OE1 3.74Å; K428-E432 PolarHBondContact O-N 2.89Å
429T92.8Very high91.3Very high68 Ų6882.4 Ų82.442%0.41746%0.457SS..Hα-helixtrans-59.2-44.7179.3-61.70000111.9V425 F426 S431 E432 L433V425-T429 PolarHBondContact O-N 2.84Å; V425-T429 PolarHBondContact O-OG1 3.46Å; V425-T429 VanDerWaalsContact O-OG1 3.08Å; F426-T429 PolarHBondContact O-N 3.32Å; F426-T429 VanDerWaalsContact O-N 3.15Å; T429-S431 VanDerWaalsContact C-N 3.34Å; T429-S431 PolarHBondContact O-N 2.89Å; T429-E432 PolarHBondContact O-N 3.46Å; T429-L433 HydrophobicContact CG2-CD1 4.07Å; T429-L433 WeakPolarHBondContact O-CB 3.33Å; T429-L433 VanDerWaalsContact O-CG 3.3Å; T429-L433 WeakPolarHBondContact O-CG 3.45Å; T429-L433 PolarHBondContact O-N 2.95Å
430V89.8Confident90.4Very high31 Ų3184 Ų8419%0.18845%0.453CS..Hα-helixtrans-62.7-41.8175.5172.90000111I371 F426 K428 L433 L434I371-V430 HydrophobicContact CD1-CG1 4.09Å; I371-V430 HydrophobicContact CD1-CG2 3.66Å; F426-V430 HydrophobicContact CD1-CG2 4.2Å; F426-V430 HydrophobicContact CD2-CG2 4.19Å; F426-V430 HydrophobicContact CE1-CG2 3.76Å; F426-V430 HydrophobicContact CE2-CG2 3.76Å; F426-V430 HydrophobicContact CG-CG2 4.4Å; F426-V430 HydrophobicContact CZ-CG2 3.55Å; F426-V430 WeakPolarHBondContact O-CG2 3.46Å; F426-V430 PolarHBondContact O-N 2.86Å; K428-V430 PolarHBondContact O-N 3.5Å; V430-L433 PolarHBondContact O-N 2.87Å; V430-L434 HydrophobicContact CG1-CD1 3.86Å; V430-L434 HydrophobicContact CG1-CG 4.35Å; V430-L434 WeakPolarHBondContact O-CB 3.38Å; V430-L434 VanDerWaalsContact O-CG 3.29Å; V430-L434 WeakPolarHBondContact O-CG 3.46Å; V430-L434 PolarHBondContact O-N 3.38Å
431S90.7Very high88.3Confident70 Ų7082.6 Ų82.649%0.4946%0.455SS..Hα-helixtrans-62.7-42.3176.7-59.80000112.5S427 K428 T429 L434 A435S427-S431 WeakPolarHBondContact O-CB 3.25Å; S427-S431 PolarHBondContact O-N 2.91Å; S427-S431 PolarHBondContact O-OG 3.3Å; K428-S431 WeakPolarHBondContact O-CB 3.26Å; K428-S431 PolarHBondContact O-N 2.91Å; K428-S431 VanDerWaalsContact O-N 3.15Å; T429-S431 VanDerWaalsContact C-N 3.34Å; T429-S431 PolarHBondContact O-N 2.89Å; S431-L434 PolarHBondContact O-N 3.22Å; S431-A435 WeakPolarHBondContact O-CB 3.18Å; S431-A435 PolarHBondContact O-N 3.24Å
432E93.4Very high86.1Confident83 Ų8388 Ų8839%0.38849%0.489SS..Hα-helixtrans-67.8-36.6176.3-72.7-176.6-166.100112.8K428 T429 K436K428-E432 WeakPolarHBondContact CE-OE1 3.36Å; K428-E432 IonicContact NZ-OE1 3.74Å; K428-E432 PolarHBondContact O-N 2.89Å; T429-E432 PolarHBondContact O-N 3.46Å; E432-K436 WeakPolarHBondContact O-CB 3.47Å; E432-K436 WeakPolarHBondContact O-CD 3.34Å; E432-K436 VanDerWaalsContact O-CG 3.3Å; E432-K436 WeakPolarHBondContact O-CG 3.39Å; E432-K436 PolarHBondContact O-N 3.44Å
433L90.3Very high83.6Confident107 Ų10789.7 Ų89.756%0.5651%0.513SS*.Hα-helixtrans-67.6-43.2174.8-72170.4000111.6T429 V430 K436 A437T429-L433 HydrophobicContact CG2-CD1 4.07Å; T429-L433 WeakPolarHBondContact O-CB 3.33Å; T429-L433 VanDerWaalsContact O-CG 3.3Å; T429-L433 WeakPolarHBondContact O-CG 3.45Å; T429-L433 PolarHBondContact O-N 2.95Å; V430-L433 PolarHBondContact O-N 2.87Å; L433-K436 PolarHBondContact O-N 3.4Å; L433-A437 WeakPolarHBondContact O-CB 3.48Å; L433-A437 PolarHBondContact O-N 2.95Å
434L88.1Confident81.1Confident116 Ų11690.3 Ų90.361%0.60754%0.538SS*.Hα-helixtrans-65.9-36.7175.9-70.7172.1000112.3V430 S431 K438V430-L434 HydrophobicContact CG1-CD1 3.86Å; V430-L434 HydrophobicContact CG1-CG 4.35Å; V430-L434 WeakPolarHBondContact O-CB 3.38Å; V430-L434 VanDerWaalsContact O-CG 3.29Å; V430-L434 WeakPolarHBondContact O-CG 3.46Å; V430-L434 PolarHBondContact O-N 3.38Å; S431-L434 PolarHBondContact O-N 3.22Å; L434-K438 WeakPolarHBondContact O-CB 3.49Å; L434-K438 PolarHBondContact O-N 3.4Å
435A90.8Very high78.3Confident43 Ų4395.6 Ų95.636%0.35556%0.557SS.*Hα-helixtrans-62.1-51.8172.700000111.3S431 A437 K438 E439S431-A435 WeakPolarHBondContact O-CB 3.18Å; S431-A435 PolarHBondContact O-N 3.24Å; A435-A437 PolarHBondContact O-N 3.5Å; A435-K438 WeakPolarHBondContact O-CB 3.49Å; A435-K438 PolarHBondContact O-N 2.91Å; A435-K438 VanDerWaalsContact O-N 3.1Å; A435-E439 WeakPolarHBondContact O-CG 3.45Å; A435-E439 PolarHBondContact O-N 2.84Å
436K91.1Very high75.7Confident104 Ų104101.8 Ų101.845%0.45258%0.581SS.*Hα-helixtrans-59.8-41.7177.6-72.9165.4-175.6163.10112.5E432 L433 K438 E439 Q440E432-K436 WeakPolarHBondContact O-CB 3.47Å; E432-K436 WeakPolarHBondContact O-CD 3.34Å; E432-K436 VanDerWaalsContact O-CG 3.3Å; E432-K436 WeakPolarHBondContact O-CG 3.39Å; E432-K436 PolarHBondContact O-N 3.44Å; L433-K436 PolarHBondContact O-N 3.4Å; K436-K438 VanDerWaalsContact C-N 3.3Å; K436-K438 PolarHBondContact O-N 3.21Å; K436-E439 PolarHBondContact O-N 2.65Å; K436-Q440 WeakPolarHBondContact O-CB 3.36Å; K436-Q440 VanDerWaalsContact O-CG 3.26Å; K436-Q440 WeakPolarHBondContact O-CG 3.35Å; K436-Q440 PolarHBondContact O-N 3.24Å
437A87.4Confident72.8Confident56 Ų56103 Ų10346%0.46360%0.602SS.*Hα-helixtrans-63.8-35.2176.100000112.6L433 A435 G441L433-A437 WeakPolarHBondContact O-CB 3.48Å; L433-A437 PolarHBondContact O-N 2.95Å; A435-A437 PolarHBondContact O-N 3.5Å; A437-G441 PolarHBondContact O-N 2.93Å
438K85.5Confident70.2Confident180 Ų180107 Ų10778%0.78362%0.624SS**Hα-helixtrans-71.2-39.6174.4-171.1-178.9180-175.40112.2L434 A435 K436 G441L434-K438 WeakPolarHBondContact O-CB 3.49Å; L434-K438 PolarHBondContact O-N 3.4Å; A435-K438 WeakPolarHBondContact O-CB 3.49Å; A435-K438 PolarHBondContact O-N 2.91Å; A435-K438 VanDerWaalsContact O-N 3.1Å; K436-K438 VanDerWaalsContact C-N 3.3Å; K436-K438 PolarHBondContact O-N 3.21Å; K438-G441 PolarHBondContact O-N 2.7Å
439E83.1Confident67.2Low158 Ų158112 Ų11274%0.73864%0.639SS**Hα-helixtrans-67.8-33.1175.5-71.5167.9-178.800112.5A435 K436 G441A435-E439 WeakPolarHBondContact O-CG 3.45Å; A435-E439 PolarHBondContact O-N 2.84Å; K436-E439 PolarHBondContact O-N 2.65Å; E439-G441 VanDerWaalsContact C-N 3.28Å; E439-G441 PolarHBondContact O-N 3.13Å
440Q73.8Confident64.2Low168 Ų168116.5 Ų116.579%0.78566%0.655SS**THydrogen-bonded Turntrans-78.5-6.1177.9-73.2175.9-8.400114.4K436K436-Q440 WeakPolarHBondContact O-CB 3.36Å; K436-Q440 VanDerWaalsContact O-CG 3.26Å; K436-Q440 WeakPolarHBondContact O-CG 3.35Å; K436-Q440 PolarHBondContact O-N 3.24Å
441G49.1Very low61.4Low52 Ų52121.1 Ų121.154%0.53669%0.686SS.*THydrogen-bonded Turntrans76.96615700000117.1A437 K438 E439 G443A437-G441 PolarHBondContact O-N 2.93Å; K438-G441 PolarHBondContact O-N 2.7Å; E439-G441 VanDerWaalsContact C-N 3.28Å; E439-G441 PolarHBondContact O-N 3.13Å; G441-G443 VanDerWaalsContact C-N 3.27Å; G441-G443 PolarHBondContact O-N 3.05Å
442V48.1Very low58.4Low150 Ų150125.7 Ų125.791%0.90970%0.699SS**  trans-7389.9149.2-179.50000107.9
443G41.7Very low55.7Low70 Ų70127.6 Ų127.672%0.72272%0.719SS**  trans-76.1128.4-178.700000112.9G441G441-G443 VanDerWaalsContact C-N 3.27Å; G441-G443 PolarHBondContact O-N 3.05Å
444G41.6Very low52.8Low74 Ų74129.5 Ų129.576%0.76374%0.735SS**  trans67.194.9154.700000117.6
445L35.8Very low49.9Very low176 Ų176128.9 Ų128.992%0.92174%0.74SS**  trans-120.848.7148.9-120169.4000110.4G447L445-G447 PolarHBondContact O-N 2.93Å
446E39.3Very low46.9Very low202 Ų202131.4 Ų131.494%0.94476%0.761SS**  trans-73.2100.1167.6-170.4170.4170.500108.1
447G30.6Very low43.7Very low56 Ų56131.6 Ų131.658%0.57778%0.775SS**  trans-169.138.7-162.100000114.3L445 R449L445-G447 PolarHBondContact O-N 2.93Å; G447-R449 PolarHBondContact O-N 3.39Å
448T38.3Very low41Very low149 Ų149136 Ų13691%0.91480%0.796SS**  trans-64.693.717147.40000110.4
449R30.9Very low38.1Very low238 Ų238131.2 Ų131.290%0.89880%0.798SS**  trans-102.7122161.7-88.8-174169.9163.5-0.2110.4G447G447-R449 PolarHBondContact O-N 3.39Å
450E29.6Very low35.3Very low164 Ų164131.6 Ų131.677%0.76680%0.804SS**  trans-58135.1172.4-174.4-177.2164.700111.1Q452E450-Q452 PolarHBondContact O-N 3.13Å
451P30.5Very low33.5Very low127 Ų127128.8 Ų128.883%0.82580%0.8SS**  trans-82.197.7-177.931.9-33.7000111.5
452Q27.4Very low32.4Very low167 Ų167132.3 Ų132.378%0.7881%0.811SS**  trans-83.3144.1160.8-76.6-153.6-9.400111.7E450E450-Q452 PolarHBondContact O-N 3.13Å
453P37.6Very low31.4Very low123 Ų123130.4 Ų130.480%0.79981%0.805SS**  trans-85144.2-170.133.7-35.5000112.8
454V28.8Very low30.7Very low147 Ų147136.1 Ų136.189%0.89181%0.812SS**  trans-128.2133.8166.1-173.30000109.5
455S27Very low30Very low103 Ų103139.2 Ų139.272%0.7282%0.817SS**  trans-99.5158.5-175.756.50000112.9
456A27.4Very low29.4Very low96 Ų96135.3 Ų135.379%0.79381%0.81SS**  trans69.9153.5164.400000115.6
457S24.7Very low28.8Very low107 Ų107133.7 Ų133.775%0.74881%0.807SS**  cis-157.2154.9-5.830.30000112
458V30.6Very low28.5Very low149 Ų149135.8 Ų135.890%0.90382%0.819SS**  trans15.9116.2150.4-173.50000118
459G23.4Very low27.8Very low79 Ų79133.8 Ų133.881%0.81481%0.811SS**  trans-164.991.116800000113.9
460L25.6Very low27.6Very low166 Ų166128.7 Ų128.787%0.86981%0.809SS**  trans-88.5159.6154.8-88.8163.8000107.6
461P35.1Very low27.5Very low109 Ų109126.1 Ų126.171%0.70881%0.809SS**  cis-153.6-167.638.646.6-26.3000117.8
462V25.9Very low27.2Very low126 Ų126129.3 Ų129.376%0.76481%0.813SS**  trans73.4126.3156.81740000119.1
463S28.2Very low27.1Very low111 Ų111128.2 Ų128.278%0.77682%0.817SS**  trans-77.7148.8168.6-35.40000112.4
464Q26.5Very low26.5Very low189 Ų189126.3 Ų126.388%0.88381%0.812SS**  trans-133135.1152.7-73.3-164-600111.1
465T26.5Very low26.2Very low140 Ų140131.3 Ų131.386%0.85981%0.814SS**  trans-84.8128.7175.9-45.40000109.4
466A24.5Very low26.4Very low94 Ų94136.2 Ų136.278%0.77782%0.823SS**  trans-138127.6171.800000110.5
467L25.4Very low26.3Very low167 Ų167138 Ų13887%0.87482%0.819SS**  trans-71.4141169.1-98.163000109.8
468A24.8Very low26.3Very low100 Ų100142.1 Ų142.183%0.82682%0.824SS**  trans-126.2118.9164.100000108.9
469S23.6Very low26.2Very low108 Ų108141.5 Ų141.576%0.75582%0.816SS**  trans-76.1147.1179.4-58.80000111.6
470P27Very low26.4Very low131 Ų131149.2 Ų149.285%0.85182%0.82SS**  trans-72.7144.1-17930.7-35.5000111.7
471S25.9Very low26.8Very low109 Ų109147.7 Ų147.776%0.76282%0.817SS**  trans-139137.5171.458.10000112.2
472Q24.3Very low26.6Very low195 Ų195147.9 Ų147.991%0.91182%0.819SS**  trans64.762.5166.8-56.6-174.5200117.7A474Q472-A474 PolarHBondContact O-N 3.38Å
473V26.5Very low26.6Very low144 Ų144146 Ų14687%0.87382%0.817SS**  trans-64.1124.5150.2175.30000109.1
474A25.2Very low26.7Very low83 Ų83147.3 Ų147.369%0.68682%0.819SS**  trans-72.6126.1171.300000110.3Q472 F476Q472-A474 PolarHBondContact O-N 3.38Å; A474-F476 PolarHBondContact O-N 3.25Å; A474-F476 VanDerWaalsContact O-N 3.14Å
475R22.9Very low26.7Very low251 Ų251144.6 Ų144.695%0.94782%0.816SS**  trans-64.4113.3173.1-80.2-177.8174.4166.8-1.7109.9
476F30Very low26.8Very low206 Ų206143 Ų14390%0.90481%0.81SS**  trans-72.3141165-111.7-97000110.7A474A474-F476 PolarHBondContact O-N 3.25Å; A474-F476 VanDerWaalsContact O-N 3.14Å
477N24.9Very low27.2Very low133 Ų133144.8 Ų144.871%0.71181%0.814SS**  trans-87.1133.4-175.2-162.220.2000110.5D479N477-D479 VanDerWaalsContact C-N 3.33Å; N477-D479 PolarHBondContact O-N 2.78Å
478K26.2Very low27.2Very low194 Ų194144.7 Ų144.784%0.84381%0.813SS**SBendtrans-80.6-11.1-165.8-157.7165.6-177.1171.20114.3R480K478-R480 PolarHBondContact O-N 2.7Å
479D27.5Very low27.6Very low137 Ų137145.7 Ų145.773%0.73381%0.812SS**  trans-98.573.8-168.1-59-44.3000113.6N477N477-D479 VanDerWaalsContact C-N 3.33Å; N477-D479 PolarHBondContact O-N 2.78Å
480R28.5Very low27.8Very low241 Ų241147.3 Ų147.391%0.90982%0.817SS**  trans-156.255.4163.5-124.3175.2-161.8-164.74.3116.1K478 P482K478-R480 PolarHBondContact O-N 2.7Å; R480-P482 WeakPolarHBondContact O-CD 3.34Å
481V33.6Very low27.8Very low133 Ų133145.9 Ų145.981%0.80682%0.816SS**PPolyproline II helixtrans-87116.5161.7-178.50000109A483V481-A483 PolarHBondContact O-N 3.41Å
482P30.8Very low28Very low114 Ų114145.8 Ų145.874%0.7482%0.822SS**PPolyproline II helixtrans-72.1123.2171.129.3-32000109.8R480 V484R480-P482 WeakPolarHBondContact O-CD 3.34Å; P482-V484 PolarHBondContact O-N 3.08Å
483A26.3Very low28Very low87 Ų87140 Ų14072%0.71981%0.814SS**PPolyproline II helixtrans-70.4127.4179.600000111.3V481 T485V481-A483 PolarHBondContact O-N 3.41Å; A483-T485 PolarHBondContact O-N 2.89Å
484V29.9Very low28.1Very low138 Ų138142.8 Ų142.884%0.83682%0.818SS**  trans-76.3115.8175.11780000109.7P482P482-V484 PolarHBondContact O-N 3.08Å
485T26.1Very low28.2Very low131 Ų131148.7 Ų148.780%0.80482%0.823SS**  trans-119.5109.2171.344.10000111.1A483A483-T485 PolarHBondContact O-N 2.89Å
486S29.8Very low28.4Very low106 Ų106142.2 Ų142.274%0.74182%0.816SS**  trans-133.1125.6170.7-700000108.6
487P31.4Very low28.4Very low132 Ų132139 Ų13986%0.85780%0.803SS**  trans-81.5139.2-171.931.3-34.5000112.8
488L27Very low28.6Very low165 Ų165141.7 Ų141.786%0.86481%0.812SS**  trans-118.5133.4165-148.273.1000107.9
489P32.5Very low28.8Very low122 Ų122137.9 Ų137.979%0.79280%0.804SS**  trans-74.7139.6-169.528.3-35.3000113.3
490T27.3Very low28.9Very low141 Ų141138.1 Ų138.187%0.86581%0.805SS**  trans-76.3137.6-178.9-21.60000112.5
491A27.8Very low28.9Very low101 Ų101134.7 Ų134.784%0.83580%0.799SS**  trans-119.814815700000108.6
492A28.8Very low28.8Very low107 Ų107135.8 Ų135.888%0.88480%0.8SS**  trans-118156.6-167.800000113.1
493G25.5Very low28.8Very low73 Ų73137.4 Ų137.475%0.75381%0.808SS**  trans112.4131.6-178.800000112
494E27.3Very low29.1Very low203 Ų203140.2 Ų140.295%0.94981%0.811SS**  cis-150.2176.9-6.4-138.4176.9164.700111.7
495R27.5Very low29.4Very low208 Ų208141 Ų14179%0.78581%0.806SS**  trans-108.2129.9-160.1177.4-170.5-173.6177.13.5111.9
496S28.3Very low29.8Very low115 Ų115143.7 Ų143.780%0.80481%0.809SS**  trans-150132.5151.6-158.10000111.6
497Q29.7Very low30.1Very low137 Ų137142.1 Ų142.164%0.6481%0.809SS**  trans-112.7132.7174.7-64.1172-88.500107.7
498H29.5Very low30.4Very low191 Ų191145.5 Ų145.588%0.88484%0.837SS**  trans-139.1161.4156-107.9-85.1000110.3
499V29.3Very low30.6Very low114 Ų114144.6 Ų144.669%0.69184%0.835SS**  trans-147153.5-146.1157.90000110.3
500L29.9Very low30.5Very low141 Ų141145.7 Ų145.774%0.73884%0.837SS**  trans84131.9167.8-80159.1000120.5
501Q29.6Very low30.7Very low170 Ų170146 Ų14679%0.79484%0.836SS**  trans99.3123.1132.5-91.7160.7-10.100122.4
502N29.9Very low30.8Very low156 Ų156148.6 Ų148.683%0.83484%0.836SS**  trans-57.9148.5165.2-58.3-21.4000112.5
503T32.2Very low31Very low147 Ų147151.3 Ų151.390%0.90283%0.833SS**  trans-134163.6135.329.30000109.8
504N32.9Very low31.3Very low147 Ų147156.5 Ų156.579%0.78684%0.838SS**  trans-116.1161.6-168.3-137.8-12.8000110.4
505Q34.3Very low31.6Very low155 Ų155153.1 Ų153.172%0.72483%0.83SS**  trans74.4150.8155.9-70.6-178.2-10.400122.1
506Q36Very low31.9Very low187 Ų187148.9 Ų148.987%0.87483%0.834SS**  trans62.2123158.8-69.3169.15.600118
507G34.4Very low32.2Very low72 Ų72151.8 Ų151.874%0.74284%0.836SS**  cis140.9116.212.100000110.9
508S39.1Very low32.5Very low204 Ų204153.1 Ų153.1100%1.42785%0.854SS**  trans-167.40152.8-75.80000108.6

Retrieved 508 of 508 residues in 264.8 ms (Link to these results)