A0A096N8F4_PAPAN Loading...

Acrosomal vesicle protein 1

AlphaFold DB , UniProt , Accession A0A096N8F4, Species PAPAN (Papio anubis, Olive baboon), Gene ACRV1, Length 285 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
1M57.2Low60.8Low196 Ų196127.8 Ų127.897%0.96664%0.635SS**  0-67.50-122.277.692.700112.8M3 F4M1-M3 PolarHBondContact O-N 3Å; M1-M3 VanDerWaalsContact O-N 3.11Å; M1-F4 PolarHBondContact O-N 3.33Å
2N57.1Low60.1Low122 Ų122129.5 Ų129.565%0.65265%0.647SS**Hα-helixtrans-59-34.4-154.4-5727.3000116.3F4 L5 L6N2-F4 VanDerWaalsContact C-N 3.26Å; N2-F4 PolarHBondContact O-N 2.74Å; N2-L5 PolarHBondContact O-N 3.12Å; N2-L6 PolarHBondContact O-N 2.82Å; N2-L6 VanDerWaalsContact O-N 3.09Å
3M59.3Low59.6Low149 Ų149130.2 Ų130.273%0.73465%0.653SS**Hα-helixtrans-61.8-32.8-177.9-163.7177.483.500113.1M1 L7M1-M3 PolarHBondContact O-N 3Å; M1-M3 VanDerWaalsContact O-N 3.11Å; M3-L7 WeakPolarHBondContact O-CG 3.44Å; M3-L7 PolarHBondContact O-N 3.31Å
4F67.3Low58.8Low151 Ų151125.6 Ų125.666%0.66265%0.654SS**Hα-helixtrans-74.5-35.3179.2-149.7-89.4000111.9M1 N2 L7 M8M1-F4 PolarHBondContact O-N 3.33Å; N2-F4 VanDerWaalsContact C-N 3.26Å; N2-F4 PolarHBondContact O-N 2.74Å; F4-L7 PolarHBondContact O-N 2.93Å; F4-M8 HydrophobicContact CD1-CG 4.37Å; F4-M8 HydrophobicContact CE1-CE 4.3Å; F4-M8 WeakPolarHBondContact O-CG 3.44Å; F4-M8 PolarHBondContact O-N 3.27Å; F4-M8 VanDerWaalsContact O-N 3.15Å
5L67.5Low58.4Low112 Ų112125.3 Ų125.359%0.58667%0.668SS**Hα-helixtrans-65.5-41.7173.9-69.1169.5000111.5N2 L7 M8 S9N2-L5 PolarHBondContact O-N 3.12Å; L5-L7 VanDerWaalsContact C-N 3.34Å; L5-L7 PolarHBondContact O-N 2.98Å; L5-M8 PolarHBondContact O-N 3Å; L5-S9 PolarHBondContact O-N 3.43Å; L5-S9 PolarHBondContact O-OG 3.2Å
6L66Low57.7Low111 Ų111123.4 Ų123.458%0.58167%0.674SS**Hα-helixtrans-59.8-41.9175.3-74.7166.6000112.4N2 S9 L10N2-L6 PolarHBondContact O-N 2.82Å; N2-L6 VanDerWaalsContact O-N 3.09Å; L6-S9 PolarHBondContact O-N 2.87Å; L6-L10 WeakPolarHBondContact O-CG 3.31Å; L6-L10 PolarHBondContact O-N 3.19Å
7L59.2Low57.4Low95 Ų95131.4 Ų131.450%0.49769%0.692SS.*Hα-helixtrans-65.1-38.1176.7-72.4167000112.6M3 F4 L5 Y11M3-L7 WeakPolarHBondContact O-CG 3.44Å; M3-L7 PolarHBondContact O-N 3.31Å; F4-L7 PolarHBondContact O-N 2.93Å; L5-L7 VanDerWaalsContact C-N 3.34Å; L5-L7 PolarHBondContact O-N 2.98Å; L7-Y11 PolarHBondContact O-N 3.4Å
8M63.4Low56.2Low98 Ų98128 Ų12848%0.48369%0.694SS.*Hα-helixtrans-67.7-42.3174.6-65.3-63.798.100112.1F4 L5 L10 Y11 L12F4-M8 HydrophobicContact CD1-CG 4.37Å; F4-M8 HydrophobicContact CE1-CE 4.3Å; F4-M8 WeakPolarHBondContact O-CG 3.44Å; F4-M8 PolarHBondContact O-N 3.27Å; F4-M8 VanDerWaalsContact O-N 3.15Å; L5-M8 PolarHBondContact O-N 3Å; M8-L10 PolarHBondContact O-N 3.13Å; M8-Y11 PolarHBondContact O-N 2.74Å; M8-L12 PolarHBondContact O-N 2.88Å
9S54.7Low55.1Low68 Ų68128.7 Ų128.748%0.47670%0.703SS.*Hα-helixtrans-63.4-39.8177.7-63.70000112.9L5 L6 Y11 L12L5-S9 PolarHBondContact O-N 3.43Å; L5-S9 PolarHBondContact O-OG 3.2Å; L6-S9 PolarHBondContact O-N 2.87Å; S9-Y11 VanDerWaalsContact C-N 3.33Å; S9-Y11 PolarHBondContact O-N 3.01Å; S9-L12 PolarHBondContact O-N 3.32Å
10L55.8Low54.4Low121 Ų121128.8 Ų128.863%0.63471%0.713SS**Hα-helixtrans-65.4-35.6176.5-74.7166.5000112.3L6 M8 L12 L13L6-L10 WeakPolarHBondContact O-CG 3.31Å; L6-L10 PolarHBondContact O-N 3.19Å; M8-L10 PolarHBondContact O-N 3.13Å; L10-L12 VanDerWaalsContact C-N 3.29Å; L10-L12 PolarHBondContact O-N 3.29Å; L10-L13 PolarHBondContact O-N 3.08Å
11Y60.8Low53.5Low183 Ų183125.9 Ų125.972%0.71871%0.713SS**Hα-helixtrans-67.5-29178.1-159.2-96.5000112.8L7 M8 S9L7-Y11 PolarHBondContact O-N 3.4Å; M8-Y11 PolarHBondContact O-N 2.74Å; S9-Y11 VanDerWaalsContact C-N 3.33Å; S9-Y11 PolarHBondContact O-N 3.01Å
12L53.5Low52.4Low148 Ų148124.4 Ų124.478%0.77570%0.704SS**Hα-helixtrans-81.2-15.9179.5-67.6172.3000114.3M8 S9 L10M8-L12 PolarHBondContact O-N 2.88Å; S9-L12 PolarHBondContact O-N 3.32Å; L10-L12 VanDerWaalsContact C-N 3.29Å; L10-L12 PolarHBondContact O-N 3.29Å
13L53.2Low51.2Low139 Ų139124 Ų12473%0.72871%0.711SS**THydrogen-bonded Turntrans-89.6-1.5179.9-73.5163.7000113.7L10 S15L10-L13 PolarHBondContact O-N 3.08Å; L13-S15 PolarHBondContact O-N 3.11Å
14G47.6Very low50.1Low65 Ų65123.4 Ų123.467%0.6771%0.71SS**SBendtrans-79.51.3-168.700000117.6
15S53.8Low48.5Very low122 Ų122125.9 Ų125.985%0.85372%0.724SS**  trans-133.354.3-166.4-57.70000114.7L13L13-S15 PolarHBondContact O-N 3.11Å
16A47.5Very low46.9Very low94 Ų94125.3 Ų125.378%0.77773%0.729SS**  trans-142.459.3177.100000113.7
17R51.7Low45.3Very low260 Ų260125.8 Ų125.898%0.98174%0.742SS**  trans-137.984.7164.1-85-167.9163.7136.4-1.5111.3
18G35.7Very low43.9Very low70 Ų70125.3 Ų125.372%0.72276%0.76SS**  trans-119.9113.517000000110.3
19T36.6Very low42.6Very low141 Ų141125.7 Ų125.787%0.86577%0.773SS**  trans8.9109.3160.653.30000118.4G21T19-G21 PolarHBondContact O-N 3.34Å
20S40.8Very low42Very low130 Ų130130.2 Ų130.291%0.90979%0.79SS**  trans-77.1101.4149-174.20000108
21G34.2Very low41.1Very low69 Ų69131.2 Ų131.271%0.71180%0.796SS**  trans-116.7101.9172.600000108.6T19T19-G21 PolarHBondContact O-N 3.34Å
22Q35.3Very low40Very low164 Ų164131.6 Ų131.677%0.76680%0.804SS**  trans-85132.2-178.2-176172.1-4.200110.2D24Q22-D24 WeakPolarHBondContact CG-OD2 3.43Å; Q22-D24 PolarHBondContact NE2-OD2 2.87Å
23S31.7Very low39.2Very low115 Ų115132.5 Ų132.580%0.80480%0.804SS**  trans-144.783.5172.5600000109.6
24D36.8Very low38.1Very low135 Ų135131.6 Ų131.672%0.72280%0.804SS**  trans-77.4111.5165.1-69.7-82.9000109.2Q22Q22-D24 WeakPolarHBondContact CG-OD2 3.43Å; Q22-D24 PolarHBondContact NE2-OD2 2.87Å
25E32.3Very low37.3Very low203 Ų203133 Ų13395%0.94980%0.804SS**  trans-143.4159.5154.6-148.3171.393.600109.9
26S34Very low36.3Very low100 Ų100132.6 Ų132.670%0.69980%0.796SS**  trans-138.4151.6-145.7-179.40000114.7
27S33.6Very low35.6Very low122 Ų122136.1 Ų136.185%0.85380%0.796SS**  trans73.4130.5159.2-58.10000117.6
28G29.1Very low34.8Very low84 Ų84131.2 Ų131.287%0.86678%0.784SS**  trans171.351-18000000114.2
29S36.7Very low34.6Very low107 Ų107135 Ų13575%0.74879%0.788SS**  trans-91.9134.6172.5-179.10000110.9
30I40.6Very low34.6Very low163 Ų163134.6 Ų134.684%0.83679%0.79SS**  trans-177.7138.1146.2-99.4153.7000110.1
31D38.2Very low34.1Very low142 Ų142131.7 Ų131.776%0.75978%0.781SS**  trans-74.8144.6174.9-51.1-102.3000113.3
32H37.4Very low34.1Very low191 Ų191137 Ų13788%0.88479%0.787SS**  trans-150.6149.7138.8-123.263000114.7
33Q37.1Very low34Very low166 Ų166138.1 Ų138.178%0.77679%0.79SS**  trans-131.2139.9-174.5-172.7-172.9-3.500109.2
34T29.9Very low34.1Very low121 Ų121140.9 Ų140.974%0.74279%0.788SS**  trans71.2132175.7-11.80000113.2
35S30.7Very low33.9Very low95 Ų95139.6 Ų139.666%0.66479%0.789SS**  -177130.752.6-167.10000113.8
36V33.3Very low33.9Very low112 Ų112137 Ų13768%0.67978%0.781SS**  trans65.8141.6138.9174.40000122
37Q32.9Very low33.7Very low168 Ų168140.1 Ų140.179%0.78579%0.785SS**  trans74.6140.2164.5-84.5155.1000118
38Q33.5Very low34.1Very low157 Ų157141.8 Ų141.873%0.73478%0.784SS**  cis-149.3140.83.4-166.1155.8-73.400115.2
39L32.9Very low35.2Very low150 Ų150142.7 Ų142.779%0.78578%0.775SS**  trans6.1125.3158.4-57.4168.3000121.6
40S35.5Very low35.2Very low132 Ų132142.2 Ų142.292%0.92377%0.771SS**  177.8136.7118.8-74.60000109.9
41G30.9Very low35.1Very low69 Ų69141.5 Ų141.571%0.71177%0.769SS**  cis-177.5159.3-8.300000110.5
42E33.5Very low35.2Very low182 Ų182139.4 Ų139.485%0.8577%0.772SS**  trans49.5128.8165.3-48.2-164.9139.200118.7
43F34Very low35.2Very low187 Ų187139.8 Ų139.882%0.8277%0.774SS**  -155.6179.857.8-160-106.9000113.1
44F32.8Very low35.1Very low173 Ų173136 Ų13676%0.75977%0.771SS**  trans-78.7167.8-166.4-81.4-101.4000117
45S32.3Very low35.3Very low108 Ų108138.2 Ų138.276%0.75578%0.777SS**  trans-145.6155.7167.1-76.60000111.8
46L33.5Very low35.6Very low149 Ų149143.5 Ų143.578%0.7878%0.784SS**  trans74114.8168.7-9372.6000120.7
47E29.7Very low35.6Very low165 Ų165145.6 Ų145.677%0.77179%0.786SS**  92.291.9112.4-151.1150.6107.500122.7
48N41.9Very low35.7Very low157 Ų157143 Ų14384%0.8478%0.782SS**  trans63.8-179.9137.3-113.97.4000119.2
49P51.1Low36.2Very low102 Ų102140.3 Ų140.366%0.66279%0.787SS**  cis-131.4-165.8-9.941.2-23.5000115.2
50S36.9Very low36.6Very low97 Ų97139.3 Ų139.368%0.67879%0.792SS**  trans73.2151.9155.7-85.50000119.5
51D40.3Very low36.6Very low149 Ų149136.4 Ų136.480%0.79778%0.784SS**  cis-155.3163.210.8-118.1-11.1000115.5
52A38.4Very low37.2Very low98 Ų98140.7 Ų140.781%0.8179%0.789SS**  trans69133.5152.200000123.8
53E37.8Very low37.5Very low199 Ų199138.5 Ų138.593%0.9378%0.784SS**  trans-92.1159.9172.6-79.6163.571.200114.4
54A34.8Very low37.6Very low86 Ų86135.4 Ų135.471%0.71178%0.78SS**  trans-162.8108.314900000114.6
55L35Very low37.8Very low168 Ų168134.9 Ų134.988%0.8878%0.784SS**  trans68.8146.6151.1-50.6174.7000117.3
56Y37Very low38Very low206 Ų206134 Ų13481%0.80878%0.778SS**  cis-155158.28.147.3-89.7000113.2
57E33Very low38.2Very low155 Ų155134.3 Ų134.372%0.72478%0.776SS**  trans39107.3153.2-69.8-62.8135.600122.5
58T34Very low38.6Very low114 Ų114134 Ų13470%0.69977%0.774SS**  51.2126.2115.7-46.60000121.5
59A45.8Very low38.2Very low101 Ų101129.7 Ų129.784%0.83577%0.767SS**  trans-105.2128.5162.600000112.1
60S40.3Very low37.9Very low128 Ų128130 Ų13090%0.89577%0.772SS**  trans-168.4159.8162.7-165.90000111.3
61G35.2Very low38.1Very low72 Ų72131 Ų13174%0.74278%0.778SS**  trans131.7122.5164.400000116
62L44.4Very low38Very low159 Ų159130.3 Ų130.383%0.83277%0.77SS**  trans-118.1156.5168-82.9169.4000110.3
63N38.5Very low37.9Very low136 Ų136133.8 Ų133.873%0.72777%0.77SS**  trans82.4136.5148.5-75.4-3.5000123.8
64T36.5Very low37.6Very low122 Ų122126.8 Ų126.875%0.74875%0.751SS**  trans76.4122.8138.848.90000123.4
65L37.1Very low38Very low161 Ų161127.3 Ų127.384%0.84375%0.749SS**  171.4127.8118.9-84.7161.5000107.5
66S36.8Very low38.5Very low90 Ų90129 Ų12963%0.62974%0.744SS**  52.6131.375.7-780000114.5
67E37.7Very low38.4Very low155 Ų155127.2 Ų127.272%0.72474%0.743SS**  cis-165.3-158.3-1.6-126167.485.900109.4
68H37.2Very low38.5Very low158 Ų158127 Ų12773%0.73174%0.741SS**  cis-161.8171.913.7-164.768.8000110.5
69G33.8Very low38.4Very low67 Ų67127 Ų12769%0.69174%0.742SS**  trans157.7127.6161.900000118.1
70S44.5Very low38Very low110 Ų110128.9 Ų128.977%0.76974%0.742SS**  trans-90.6177.3-172.5-43.30000114.8
71S42.7Very low37.8Very low117 Ų117127 Ų12782%0.81873%0.734SS**  cis-158169.320.4580000115.6
72E38.3Very low37.5Very low135 Ų135131.2 Ų131.263%0.63174%0.735SS**  trans-67.1178.8176.1-126.5-149.9106.900114.2G74E72-G74 WeakPolarHBondContact OE1-CA 3.2Å
73H34.6Very low36.9Very low171 Ų171131.4 Ų131.479%0.79273%0.731SS**  cis-141.517430.4-73.8-69.8000113
74G32.5Very low36.7Very low52 Ų52131.1 Ų131.154%0.53673%0.734SS.*  cis152.2162.2-8.600000114.3E72E72-G74 WeakPolarHBondContact OE1-CA 3.2Å
75S43.9Very low37.8Very low96 Ų96131.5 Ų131.567%0.67174%0.739SS**  trans55.6156.1165.1-630000121
76R44.5Very low37.5Very low204 Ų204127.5 Ų127.577%0.7774%0.737SS**  cis-163173.6-18.8-98.2172.1169.8100.3-9.7105.1
77E35.9Very low37.3Very low168 Ų168132 Ų13279%0.78575%0.748SS**  cis-160.2142.146.2-72.4-171.1125.700109.8
78H33.2Very low37Very low150 Ų150133.3 Ų133.369%0.69475%0.753SS**  57.2139.6109.6-61.6-75.7000117.8
79T33.6Very low36.8Very low116 Ų116129.5 Ų129.571%0.71275%0.749SS**  cis-162.7149.217.3230000113.7
80V37.1Very low36.6Very low139 Ų139135.4 Ų135.484%0.84276%0.759SS**  trans61.1145.7133.8172.80000120.6
81A34.7Very low36Very low88 Ų88135.3 Ų135.373%0.72776%0.758SS**  cis-168-162.5-23.800000110.6
82E30.8Very low35.6Very low161 Ų161137 Ų13775%0.75275%0.753SS**  trans-83.7177.8-158-53.9174.964.600118.9
83H30Very low35.2Very low163 Ų163138.5 Ų138.576%0.75576%0.76SS**  trans115.9145141.9-59.4-40.3000119.5
84T34.3Very low35.2Very low130 Ų130134.8 Ų134.880%0.79876%0.759SS**  trans-118-175.7174.554.10000108.7
85P60Low35.4Very low131 Ų131138.6 Ų138.685%0.85178%0.777SS**  cis-112.3-172.3-46.836.1-22.1000110.9
86G32Very low35Very low77 Ų77137.7 Ų137.779%0.79478%0.783SS**  trans-157.8160.7176.100000113.9
87E31.4Very low34.6Very low185 Ų185135.8 Ų135.886%0.86478%0.783SS**  trans-115.7152-162-64.4178.3107.200115.2
88H32Very low35.2Very low181 Ų181133.6 Ų133.684%0.83878%0.783SS**  trans42.8137.8144.8-80.4-85.4000124.7
89A32.1Very low35.4Very low78 Ų78129.7 Ų129.765%0.64578%0.777SS**  trans102.7131.5136.100000121.8
90E30.9Very low35.7Very low191 Ų191128.3 Ų128.389%0.89378%0.777SS**  trans63.2147.4147.2-68.1163.5-151.600120.3
91S32.2Very low35.6Very low108 Ų108128 Ų12876%0.75578%0.776SS**  cis-124.5-128.94.443.80000111.2
92E32.7Very low35.5Very low152 Ų152126.8 Ų126.871%0.7177%0.772SS**  cis-158.1-177.74.1-138.7-91.184.300108.9
93H31.2Very low35.6Very low168 Ų168127.9 Ų127.978%0.77878%0.777SS**  trans-90.8-179.1-178-59.9-94.1000112.4
94A34.3Very low35.8Very low93 Ų93124.9 Ų124.977%0.76978%0.78SS**  cis-166.21682400000115.9
95S37.4Very low35.8Very low132 Ų132128.1 Ų128.192%0.92379%0.786SS**  trans80.8128.2149.4-151.40000120.4
96G33.9Very low34.4Very low77 Ų77125.4 Ų125.479%0.79478%0.782SS**  trans15130.9165.300000121.1
97E38Very low34.4Very low164 Ų164129.3 Ų129.377%0.76678%0.779SS**  trans-73.9161.4171.7-121.3-160.5143.900112.4A99E97-A99 WeakPolarHBondContact OE1-CA 3.37Å; E97-A99 VanDerWaalsContact OE1-CB 3.25Å; E97-A99 WeakPolarHBondContact OE1-CB 3.35Å; E97-A99 PolarHBondContact OE1-N 2.03Å
98P48.1Very low34.3Very low122 Ų122128 Ų12879%0.79277%0.773SS**  -115.415151.1519.2000114.5
99A36.9Very low34.4Very low68 Ų68125.8 Ų125.856%0.56277%0.772SS**  72.313860.700000112.5E97E97-A99 WeakPolarHBondContact OE1-CA 3.37Å; E97-A99 VanDerWaalsContact OE1-CB 3.25Å; E97-A99 WeakPolarHBondContact OE1-CB 3.35Å; E97-A99 PolarHBondContact OE1-N 2.03Å
100A39.2Very low34.8Very low86 Ų86129.2 Ų129.271%0.71179%0.785SS**  cis-166.6166.310.600000108.7
101T36.1Very low34.8Very low133 Ų133123.7 Ų123.782%0.81678%0.779SS**  cis-169.9159.8-9.326.40000109
102G32.2Very low34.7Very low62 Ų62126.6 Ų126.664%0.63978%0.78SS**  trans130.199.9168.900000111.6
103H32.5Very low34.8Very low185 Ų185126.5 Ų126.586%0.85678%0.78SS**  60.2129.955.8-55.8-70.4000113
104A34.1Very low35.7Very low99 Ų99124 Ų12482%0.81878%0.779SS**  cis-144.8-174.16.800000112.9
105E33.7Very low35.8Very low199 Ų199125.7 Ų125.793%0.9379%0.785SS**  trans-96.3168.3-169.7-55.3178105.500115.1
106G31.8Very low35.6Very low74 Ų74122.2 Ų122.276%0.76377%0.769SS**  trans89.6156.4155.500000117.6
107E32Very low35.4Very low159 Ų159126.9 Ų126.974%0.74377%0.771SS**  cis-163.1154.1-19.2-148.6-177.3152.300110.2
108H30.2Very low35.3Very low158 Ų158126 Ų12673%0.73177%0.767SS**  trans63.4169.2175.7-38.1-57.4000115.7
109T34.2Very low35.1Very low133 Ų133125.5 Ų125.582%0.81676%0.763SS**  cis-133.4170.56.146.80000111.6
110V40.3Very low35.1Very low151 Ų151128.4 Ų128.492%0.91578%0.779SS**  trans-96.2138.6167.4174.90000109.4
111G29.6Very low34.8Very low74 Ų74127.7 Ų127.776%0.76378%0.78SS**  trans-168.8140.5176.200000113.6
112E31.4Very low34.7Very low169 Ų169130.8 Ų130.879%0.7979%0.785SS**  trans-84.7149.4-169.1-56.5165.651.200115.4
113Q34.5Very low34.8Very low151 Ų151136.4 Ų136.471%0.70680%0.795SS**  146.3137.5119.9-80.5-62.7-49.500111.9
114P48.7Very low34.9Very low115 Ų115135.3 Ų135.375%0.74780%0.795SS**  trans-81.6151.7166.135-33.1000111.2
115S37.5Very low34.9Very low129 Ų129135.5 Ų135.590%0.90279%0.79SS**  trans-137.7140164.8-1650000108.9
116G31.8Very low34.7Very low58 Ų58129.1 Ų129.160%0.59878%0.778SS**  trans-128-171.3-171.600000113.2
117E31Very low34.7Very low175 Ų175133.9 Ų133.982%0.81878%0.78SS**  trans67144.2177.8-48.4-177.656.900113.7
118Q35.3Very low34.8Very low147 Ų147134.5 Ų134.569%0.68778%0.783SS**  cis-140.8154.630-80.4-91.3-65.400112.4
119P44.3Very low34.8Very low110 Ų110132.3 Ų132.371%0.71479%0.785SS**  trans-88.2115.2157.533.4-26.4000110.4G121P119-G121 PolarHBondContact O-N 3.46Å
120S37.4Very low34.9Very low129 Ų129133.9 Ų133.990%0.90279%0.788SS**  trans-70.9103.1173.4-62.70000111.1
121G31.3Very low34.8Very low71 Ų71130 Ų13073%0.73278%0.779SS**  trans-90.1148.4163.700000111.5P119P119-G121 PolarHBondContact O-N 3.46Å
122E34Very low34.9Very low198 Ų198134.7 Ų134.793%0.92578%0.781SS**  trans-96.1138.8162.4-67.2-174.8117.100109.2
123H35.2Very low35Very low181 Ų181134.3 Ų134.384%0.83878%0.779SS**  trans-153.9178.3-176.1-130.9-99.5000109.4
124L34.8Very low35.4Very low162 Ų162132 Ų13285%0.84879%0.786SS**  trans79.1130.7-172.3-48175000112.6
125S33.8Very low34.9Very low103 Ų103132 Ų13272%0.7279%0.788SS**  cis-144.6166.6-8.9-78.40000107.5
126G30.6Very low34.9Very low65 Ų65129 Ų12967%0.6778%0.778SS**  65.7125.662.600000111.2
127E30.1Very low34.9Very low174 Ų174135.2 Ų135.281%0.81379%0.791SS**  cis-154.5169.311.3-94.6153.782.600112.7
128Q34Very low35.2Very low172 Ų172135 Ų13580%0.80479%0.79SS**  trans5.7138.1160.5-52.7-177.7-59.200121.6
129S30.9Very low35.6Very low112 Ų112132.8 Ų132.878%0.78379%0.789SS**  -172.3154.1116.8-850000113.9
130L35.3Very low35.2Very low165 Ų165133.5 Ų133.586%0.86480%0.796SS**  trans17.6136.7150.8-55.5165.8000119.3
131G38.2Very low35.1Very low71 Ų71133.8 Ų133.873%0.73279%0.787SS**  cis108.864.49.100000112.8
132E32.7Very low35.2Very low172 Ų172140.1 Ų140.180%0.80480%0.798SS**  trans-121.1119179.7-73.8-167.174.700113.6
133H34.4Very low35.2Very low161 Ų161137.8 Ų137.875%0.74579%0.787SS**  trans48.5108.3144.5-61.9-70.2000121.1
134A41.9Very low35Very low103 Ų103136.6 Ų136.685%0.85179%0.786SS**  trans-69135.6140.600000110.1
135S38.9Very low35.1Very low114 Ų114133.9 Ų133.980%0.79778%0.781SS**  trans-128.5130.5158.8-74.20000108
136G36.8Very low35.1Very low67 Ų67131.9 Ų131.969%0.69178%0.777SS**  trans-128119.4176.200000110.4
137E31.9Very low35.2Very low188 Ų188137.3 Ų137.388%0.87979%0.785SS**  trans-119.297.4166.2-66.2173.696.600104.1
138Q36.5Very low35.3Very low170 Ų170138 Ų13879%0.79479%0.787SS**  63.4135.682.5-70.7-60.2-67.400113.3
139P44Very low35.6Very low101 Ų101134.4 Ų134.466%0.65679%0.787SS**PPolyproline II helixtrans-77.7153.1-174.933.9-35.4000111.5
140S35.6Very low35.9Very low125 Ų125135.2 Ų135.287%0.87479%0.793SS**PPolyproline II helixtrans-95.2120158.6-63.10000108.9
141D35.2Very low35.9Very low134 Ų134130.2 Ų130.272%0.71778%0.781SS**PPolyproline II helixtrans-65.8137.3166.4-63-85.5000111
142E35Very low35.6Very low204 Ų204135.9 Ų135.995%0.95379%0.789SS**  trans-121.5137.3140.8-79.1-161.3114.900107.9
143Q32.6Very low35.7Very low150 Ų150135.8 Ų135.870%0.70179%0.788SS**  trans-135.3141.2-155.8-155.3-162-30.800111
144L32.5Very low36.4Very low155 Ų155133.3 Ų133.381%0.81279%0.787SS**  trans69.9149.9175.6-43.3170.6000113.7
145S36Very low36.1Very low105 Ų105134.6 Ų134.673%0.73479%0.789SS**  cis-136.6160.6-1.7-145.20000107.8
146G33.3Very low35.8Very low62 Ų62132 Ų13264%0.63978%0.781SS**  cis98.773.71200000111.9
147E32.4Very low35.6Very low179 Ų179136.4 Ų136.484%0.83678%0.783SS**  trans-155.1115.8168.5-120165.2129.200113.8
148H33.5Very low35.7Very low188 Ų188135.6 Ų135.687%0.8778%0.779SS**  trans28.1141.7155.5-66.7-76.5000124.9
149A40.6Very low35.5Very low97 Ų97130.2 Ų130.280%0.80276%0.764SS**  trans-100.8143.8161.500000111.9
150S37.5Very low35.1Very low129 Ų129131.5 Ų131.590%0.90278%0.775SS**  trans-156155.5158.4-800000107.2
151G34.5Very low34.9Very low60 Ų60128.6 Ų128.662%0.61977%0.765SS**  cis126.4115.84.200000110.5
152E31.1Very low34.7Very low190 Ų190131.2 Ų131.289%0.88877%0.773SS**  trans64.7164.4172.7-58.1173.985.200116.4
153Q34.9Very low34.7Very low169 Ų169129.8 Ų129.879%0.7977%0.766SS**  cis-156.5168.5-41.1-103.5-61.4-82.400106.4
154P50Low35.5Very low110 Ų110127.4 Ų127.471%0.71476%0.763SS**  trans-88.3158.4-17136-35.3000115
155S35.9Very low35.6Very low129 Ų129126.3 Ų126.390%0.90277%0.769SS**  trans-159.5148.9166-1650000107.8
156G31.5Very low35.3Very low60 Ų60124.4 Ų124.462%0.61977%0.766SS**  cis158.1141.90.300000109.7
157E32.9Very low35.3Very low159 Ų159130.7 Ų130.774%0.74378%0.779SS**  trans61.2163.3-168.7-66.1-80.135.500113.5
158H33.7Very low35.4Very low172 Ų172130.4 Ų130.480%0.79678%0.777SS**  cis-152.8-173.51.7-15050.8000109.1
159A32.3Very low35.9Very low57 Ų57127.2 Ų127.247%0.47177%0.773SS.*  -157.6173-83.500000109.1
160S36.2Very low35.8Very low127 Ų127128.2 Ų128.289%0.88878%0.775SS**  trans65.5137.1172.2-54.40000117
161G31Very low35.5Very low64 Ų64125.8 Ų125.866%0.6677%0.77SS**  cis179.6165.9-5.300000113.7
162E32.1Very low35.5Very low190 Ų190131.6 Ų131.689%0.88878%0.781SS**  trans63.1148.1159.7-62.5167.485.400120.4
163Q34.3Very low35.6Very low173 Ų173132.2 Ų132.281%0.80878%0.783SS**  cis-162.4166.3-32.9-107.2-56.2-87.700106.6
164P49.7Very low35.4Very low100 Ų100128.2 Ų128.265%0.64978%0.779SS**  trans-102.9163.2-163.539.6-36.6000116.7
165S34.1Very low34.7Very low132 Ų132128.9 Ų128.992%0.92379%0.786SS**  trans-166.8145.2153.9-74.70000108.8
166G30.6Very low34.3Very low66 Ų66126 Ų12668%0.6878%0.777SS**  cis-174.3176.8-4.500000112.5
167E32.7Very low34.3Very low194 Ų194130.7 Ų130.791%0.90778%0.783SS**  trans58.1107.9153.9-65.8169.511300121.4
168Q34.8Very low34.2Very low172 Ų172130.8 Ų130.880%0.80478%0.784SS**  trans-76.9162.4143.8-77-73.8-7200109
169P43Very low34.1Very low121 Ų121127 Ų12779%0.78678%0.776SS**  cis-151.2-164.746.543.8-21.5000117.4
170S39.8Very low34.2Very low119 Ų119132.3 Ų132.383%0.83280%0.796SS**  trans-54.2155.2-178.4-460000117
171G31Very low33.9Very low78 Ų78129.1 Ų129.180%0.80478%0.783SS**  trans-147.8130.6157.800000110.8
172E33.7Very low33.9Very low182 Ų182134.2 Ų134.285%0.8579%0.79SS**  trans-78.4158.6172.4-63.8156.289.400111
173H33.8Very low33.9Very low202 Ų202134.6 Ų134.694%0.93579%0.791SS**  trans-173.8166.6131.4-93.4-50.1000110.5
174A31.2Very low33.8Very low85 Ų85130.3 Ų130.370%0.70279%0.785SS**  trans-144.6168.2-163.600000113.9
175S33.6Very low33.2Very low124 Ų124133.4 Ų133.487%0.86780%0.796SS**  trans77.1131.8156.6-570000120.3
176G28Very low32.9Very low69 Ų69131.7 Ų131.771%0.71178%0.784SS**  trans85.4161.615200000117.9
177E31Very low32.9Very low158 Ų158137.1 Ų137.174%0.73879%0.791SS**  cis-167.8143.9-18.5-130-169.7110.500111.1
178Q31.1Very low33Very low161 Ų161136.4 Ų136.475%0.75279%0.785SS**  trans60.9176.9164.5-49.1-176.712.400114.9
179S32.8Very low33.4Very low92 Ų92134.1 Ų134.164%0.64379%0.785SS**  cis-147.5130.41.7-1520000107.6
180L34.6Very low33.1Very low169 Ų169133.5 Ų133.589%0.88578%0.784SS**  62.3128.589-154.682000116.2
181G29.2Very low32.7Very low60 Ų60131.2 Ų131.262%0.61978%0.779SS**  trans76.1161.7167.600000115.3
182E29.9Very low33Very low172 Ų172136.4 Ų136.480%0.80478%0.782SS**  cis-161.4146.4-12-157.493116.100107
183H32.4Very low33.1Very low197 Ų197136.4 Ų136.491%0.91278%0.782SS**  trans-178.1127145.3-104.1-65.4000110.8
184A32.8Very low33.7Very low83 Ų83132.3 Ų132.369%0.68677%0.774SS**  trans-139.3168.8-178.400000112
185L36.3Very low34.1Very low166 Ų166134.4 Ų134.487%0.86978%0.783SS**  trans81.5149.2161.9-64.8165.1000120.3
186S28.8Very low34Very low96 Ų96131.6 Ų131.667%0.67177%0.774SS**  trans65.6141.5164.8-74.80000118.6
187E31.3Very low34.9Very low180 Ų180132.6 Ų132.684%0.84178%0.775SS**  cis-160.3177.5-14-129.6168.4118.500110.7
188K34.6Very low35.5Very low179 Ų179130.9 Ų130.978%0.77878%0.778SS**  trans-125.1136.8175.9-176.8-172178.1-171.30111.5
189P42.2Very low36.3Very low123 Ų123131 Ų13180%0.79978%0.782SS**  trans-125-175.713811.210.5000113.2
190S37.6Very low37.4Very low108 Ų108132 Ų13276%0.75579%0.789SS**  trans-93.7165.3-170.8-155.10000114.4
191G30.2Very low37.9Very low71 Ų71127.9 Ų127.973%0.73277%0.774SS**  trans-171.7135169.200000110.9
192E37.4Very low39Very low187 Ų187133.3 Ų133.387%0.87479%0.787SS**  trans-101.5164.5-172.1-92.6151.179.500114.6
193Q36.7Very low40.2Very low183 Ų183127.9 Ų127.986%0.85577%0.768SS**  trans-51.6156.1178.6-142159.7-124.300111.9
194P47Very low41.4Very low116 Ų116124.7 Ų124.775%0.75376%0.763SS**  cis-153.9175.835.944.7-23.7000121.7
195S39.1Very low42.9Very low128 Ų128122.7 Ų122.790%0.89575%0.75SS**  trans81.5150.8159-151.30000117.3
196G31.2Very low45Very low65 Ų65118.8 Ų118.867%0.6773%0.734SS**  trans108.985.5-167.700000111.7
197A47Very low48Very low90 Ų90120.3 Ų120.374%0.74473%0.733SS**  trans-62.6129.9164.200000108.2I199A197-I199 PolarHBondContact O-N 3.23Å
198P44.3Very low51.1Low122 Ų122112.2 Ų112.279%0.79270%0.695SS**  trans-65104.2177.925.3-32.4000109S200P198-S200 PolarHBondContact O-N 3.36Å
199I47.5Very low54.1Low164 Ų164106.5 Ų106.584%0.84167%0.673SS**  trans-49.4126.8174.2-57.8169.2000107.2A197 S201A197-I199 PolarHBondContact O-N 3.23Å; I199-S201 PolarHBondContact O-N 2.91Å
200S54.4Low56.8Low113 Ų113100.6 Ų100.679%0.7964%0.635SS**  trans-2193.6-172.9-62.20000113.3P198 I202P198-S200 PolarHBondContact O-N 3.36Å; S200-I202 PolarHBondContact O-N 3.2Å
201S45.1Very low59.7Low83 Ų8399.4 Ų99.458%0.5862%0.615SS**  trans-55.8131.3171.948.60000107.4I199 S203I199-S201 PolarHBondContact O-N 2.91Å; S201-S203 PolarHBondContact O-N 3.26Å
202I54Low62.9Low174 Ų17497.7 Ų97.789%0.89259%0.59SS**  trans-7077.9164.3-58.1176000104.9S200 T204S200-I202 PolarHBondContact O-N 3.2Å; I202-T204 PolarHBondContact O-N 3.46Å; I202-T204 VanDerWaalsContact O-N 3.1Å
203S54.3Low65.8Low58 Ų5888.9 Ų88.941%0.40655%0.549SS..  trans-60.5118.1176.8-165.60000105.9S201 G205S201-S203 PolarHBondContact O-N 3.26Å; S203-G205 PolarHBondContact O-N 2.91Å
204T57.4Low68.8Low130 Ų13083 Ų8380%0.79853%0.531SS*.  trans-44.9117.214738.90000105.9I202 T206I202-T204 PolarHBondContact O-N 3.46Å; I202-T204 VanDerWaalsContact O-N 3.1Å; T204-T206 PolarHBondContact O-N 3.2Å
205G65.4Low71.2Confident41 Ų4182.4 Ų82.442%0.42352%0.515SS..  trans-63.1114.3-163.700000109.6S203 I207S203-G205 PolarHBondContact O-N 2.91Å; G205-I207 PolarHBondContact O-N 3.01Å
206T79.3Confident74Confident84 Ų8476.4 Ų76.452%0.51547%0.473SS..  trans-60115.5176.9-48.40000107.8T204 L208 T231T204-T206 PolarHBondContact O-N 3.2Å; T206-L208 HydrophobicContact CG2-CD2 3.68Å; T206-L208 HydrophobicContact CG2-CG 4.14Å; T206-L208 PolarHBondContact O-N 3.27Å; T206-T231 PolarHBondContact O-OG1 2.93Å
207I91.5Very high77.2Confident127 Ų12774.3 Ų74.365%0.65145%0.446SS*.  trans-73.5111.2178.2-59.2-179.3000106.9G205 I230G205-I207 PolarHBondContact O-N 3.01Å; I207-I230 HydrophobicContact CG2-CG2 3.36Å
208L96.1Very high79.6Confident11 Ų1173.2 Ų73.26%0.05843%0.428CS..  trans-119.9138.7-177.5-61.1179.2000109T206 I230 T231 R277T206-L208 HydrophobicContact CG2-CD2 3.68Å; T206-L208 HydrophobicContact CG2-CG 4.14Å; T206-L208 PolarHBondContact O-N 3.27Å; L208-I230 CarbonylContact O-C 3.5Å; L208-I230 WeakPolarHBondContact O-CA 3.28Å; L208-T231 HydrophobicContact CB-CG2 4.15Å; L208-T231 PolarHBondContact N-OG1 3Å; L208-T231 PolarHBondContact O-N 3.39Å; L208-T231 PolarHBondContact O-OG1 2.92Å; L208-R277 HydrophobicContact CD1-CB 4.34Å
209N98Very high82.1Confident58 Ų5874.8 Ų74.831%0.3142%0.424SS..EExtended strand (participates in β ladder)trans-79.9139.3161.8-61.6-92000108C229 S280 F281N209-C229 CarbonylContact C-O 3.58Å; N209-C229 WeakPolarHBondContact CA-O 3.02Å; N209-S280 PolarHBondContact N-OG 2.91Å; N209-S280 CarbonylContact O-C 3.51Å; N209-S280 VanDerWaalsContact O-CA 3.24Å; N209-S280 WeakPolarHBondContact O-CA 3.24Å; N209-S280 WeakPolarHBondContact O-CB 3.47Å; N209-F281 HydrophobicContact CB-CD1 4.4Å; N209-F281 HydrophobicContact CB-CE1 3.67Å; N209-F281 HydrophobicContact CB-CE2 3.87Å; N209-F281 HydrophobicContact CB-CZ 3.36Å; N209-F281 PolarHBondContact O-N 3.13Å
210C98.4Very high84.4Confident0 Ų068 Ų680%040%0.395CS..EExtended strand (participates in β ladder)trans-128154.7174.4-46.80000109.1T228 C229 C237C210-T228 CarbonylContact O-C 3.53Å; C210-T228 WeakPolarHBondContact O-CA 3.48Å; C210-T228 WeakPolarHBondContact O-CB 3.07Å; C210-C229 PolarHBondContact N-O 3.41Å; C210-C229 PolarHBondContact O-N 2.84Å; C210-C237 HydrophobicContact CB-CB 3.66Å; C210-C237 WeakPolarHBondContact CB-SG 3.26Å; C210-C237 WeakPolarHBondContact SG-CA 3.41Å; C210-C237 WeakPolarHBondContact SG-CB 3.25Å; C210-C237 CovalentContact SG-SG 2.03Å; C210-C237 PolarHBondContact SG-SG 2.97Å
211Y98.6Very high86.5Confident83 Ų8370.3 Ų70.333%0.32539%0.386SS..EExtended strand (participates in β ladder)trans-69.7145.9166.3-68.4-66.3000110.1G254 F281 N283 K284Y211-G254 WeakPolarHBondContact O-CA 3.46Å; Y211-G254 PolarHBondContact O-N 3.16Å; Y211-F281 HydrophobicContact CD1-CD1 4.09Å; Y211-F281 HydrophobicContact CD2-CB 4.12Å; Y211-F281 HydrophobicContact CD2-CD1 4.08Å; Y211-F281 AromaticContact CE1-CD1 3.95Å; Y211-F281 HydrophobicContact CE1-CD1 3.95Å; Y211-F281 HydrophobicContact CE1-CE1 4.4Å; Y211-F281 HydrophobicContact CE2-CB 3.61Å; Y211-F281 AromaticContact CE2-CD1 3.95Å; Y211-F281 HydrophobicContact CE2-CD1 3.95Å; Y211-F281 HydrophobicContact CE2-CG 4.1Å; Y211-F281 HydrophobicContact CG-CD1 4.15Å; Y211-F281 AromaticContact CZ-CD1 3.87Å; Y211-N283 PolarHBondContact N-OD1 2.04Å; Y211-N283 PolarHBondContact O-ND2 3.48Å; Y211-K284 HydrophobicContact CD2-CB 4.14Å; Y211-K284 HydrophobicContact CD2-CG 4.39Å; Y211-K284 HydrophobicContact CE2-CB 3.87Å; Y211-K284 HydrophobicContact CE2-CD 4.25Å; Y211-K284 HydrophobicContact CE2-CG 3.87Å
212T98.6Very high89Confident35 Ų3567.5 Ų67.522%0.21537%0.366CS..EExtended strand (participates in β ladder)trans-114.8136.3165.158.70000110.1G225 E226 G227 T228 C229 Q253T212-G225 CarbonylContact C-O 3.46Å; T212-E226 WeakPolarHBondContact O-CA 3.08Å; T212-G227 PolarHBondContact N-O 3.49Å; T212-G227 PolarHBondContact O-N 3.27Å; T212-G227 VanDerWaalsContact O-N 3.12Å; T212-G227 VanDerWaalsContact OG1-CA 3.31Å; T212-G227 WeakPolarHBondContact OG1-CA 3.07Å; T212-G227 PolarHBondContact OG1-N 3.34Å; T212-G227 PolarHBondContact OG1-O 3.48Å; T212-T228 PolarHBondContact OG1-N 2.83Å; T212-C229 HydrophobicContact CG2-CB 3.59Å; T212-C229 VanDerWaalsContact CG2-SG 3.52Å; T212-Q253 WeakPolarHBondContact CA-O 3.05Å
213C98.7Very high91.2Very high1 Ų163.1 Ų63.11%0.00734%0.344CS..EExtended strand (participates in β ladder)trans-152.9122.2160.5-175.40000108.8Y215 M216 C222 R224 G225 V252 Q253C213-Y215 VanDerWaalsContact C-N 3.31Å; C213-Y215 PolarHBondContact SG-O 2.92Å; C213-M216 HydrophobicContact CB-CE 4.19Å; C213-M216 HydrophobicContact CB-CG 3.72Å; C213-M216 HydrophobicContact CB-SD 4.27Å; C213-M216 WeakPolarHBondContact SG-CG 3.33Å; C213-C222 HydrophobicContact CB-CB 3.89Å; C213-C222 WeakPolarHBondContact CB-SG 3.47Å; C213-C222 WeakPolarHBondContact SG-CA 3.35Å; C213-C222 WeakPolarHBondContact SG-CB 3.47Å; C213-C222 CovalentContact SG-SG 2.03Å; C213-C222 PolarHBondContact SG-SG 2.67Å; C213-R224 PolarHBondContact SG-O 2.82Å; C213-R224 VanDerWaalsContact SG-O 3.36Å; C213-G225 WeakPolarHBondContact CA-O 3.47Å; C213-V252 WeakPolarHBondContact O-CA 3.26Å; C213-V252 WeakPolarHBondContact O-CG1 3.29Å; C213-Q253 HydrophobicContact CB-CB 4.37Å; C213-Q253 PolarHBondContact N-O 2.79Å; C213-Q253 PolarHBondContact O-N 3.42Å
214A98.4Very high93.3Very high59 Ų5969.6 Ų69.649%0.48836%0.36SS..EExtended strand (participates in β ladder)trans-72.3-25.9179.900000112.5R224A214-R224 WeakPolarHBondContact CB-O 3.41Å; A214-R224 PolarHBondContact N-O 2.86Å
215Y98.3Very high95.2Very high104 Ų10465.5 Ų65.541%0.40834%0.344SS..EExtended strand (participates in β ladder)trans-155.3109.8176.9-175.9-110.7000111.5C213 L223 R224 F250C213-Y215 VanDerWaalsContact C-N 3.31Å; C213-Y215 PolarHBondContact SG-O 2.92Å; Y215-L223 HydrophobicContact CD1-CB 3.98Å; Y215-L223 HydrophobicContact CD1-CD1 4.11Å; Y215-L223 HydrophobicContact CE1-CB 4.5Å; Y215-L223 HydrophobicContact CE1-CD1 3.81Å; Y215-L223 PolarHBondContact O-N 2.85Å; Y215-R224 PolarHBondContact N-O 3.17Å; Y215-R224 PolarHBondContact O-N 2.9Å; Y215-F250 HydrophobicContact CD2-CB 3.8Å; Y215-F250 AromaticContact CD2-CD2 3.73Å; Y215-F250 HydrophobicContact CD2-CD2 3.73Å; Y215-F250 HydrophobicContact CD2-CE2 4.47Å; Y215-F250 AromaticContact CD2-CG 3.9Å; Y215-F250 HydrophobicContact CD2-CG 3.9Å; Y215-F250 HydrophobicContact CE2-CB 3.34Å; Y215-F250 HydrophobicContact CE2-CD1 4.14Å; Y215-F250 AromaticContact CE2-CD2 3.9Å; Y215-F250 HydrophobicContact CE2-CD2 3.9Å; Y215-F250 AromaticContact CE2-CG 3.57Å; Y215-F250 HydrophobicContact CE2-CG 3.57Å
216M98.3Very high96.8Very high2 Ų271.3 Ų71.31%0.0136%0.36CS..EExtended strand (participates in β ladder)trans-104.8147.9168.4-64.9170.8-87.600110.7C213 R221 C222 L239 F250 M251 Q253 I285C213-M216 HydrophobicContact CB-CE 4.19Å; C213-M216 HydrophobicContact CB-CG 3.72Å; C213-M216 HydrophobicContact CB-SD 4.27Å; C213-M216 WeakPolarHBondContact SG-CG 3.33Å; M216-R221 VanDerWaalsContact CA-O 3.28Å; M216-R221 WeakPolarHBondContact CA-O 3.39Å; M216-C222 HydrophobicContact CG-CB 4.29Å; M216-L239 HydrophobicContact CE-CD1 4.23Å; M216-F250 VanDerWaalsContact O-CA 3.26Å; M216-F250 WeakPolarHBondContact O-CA 3.28Å; M216-F250 VanDerWaalsContact O-CB 3.25Å; M216-F250 WeakPolarHBondContact O-CB 3.06Å; M216-M251 HydrophobicContact CB-CB 4.16Å; M216-M251 HydrophobicContact CE-CB 3.61Å; M216-M251 PolarHBondContact N-O 2.03Å; M216-M251 PolarHBondContact O-N 3.04Å; M216-M251 HydrophobicContact SD-CB 4.37Å; M216-Q253 HydrophobicContact CE-CB 3.84Å; M216-Q253 HydrophobicContact CE-CG 3.5Å; M216-Q253 HydrophobicContact SD-CG 4.39Å; M216-I285 HydrophobicContact CE-CD1 4.06Å; M216-I285 HydrophobicContact SD-CD1 3.8Å; M216-I285 HydrophobicContact SD-CG1 3.77Å
217N97.9Very high97.7Very high21 Ų2168.8 Ų68.811%0.11235%0.35CS..  trans-74.4177.6170.272.4-12.7000112.8Q219 G220 R221 L223 M251N217-Q219 PolarHBondContact ND2-OE1 3.03Å; N217-Q219 VanDerWaalsContact ND2-OE1 3.08Å; N217-Q219 PolarHBondContact O-N 3.49Å; N217-Q219 WeakPolarHBondContact OD1-CB 3.38Å; N217-Q219 PolarHBondContact OD1-N 3.4Å; N217-G220 PolarHBondContact O-N 3.03Å; N217-G220 PolarHBondContact OD1-N 3.03Å; N217-R221 PolarHBondContact N-O 2.9Å; N217-R221 VanDerWaalsContact N-O 3.11Å; N217-R221 PolarHBondContact OD1-N 3.1Å; N217-R221 PolarHBondContact OD1-O 3.26Å; N217-L223 HydrophobicContact CB-CD1 3.98Å; N217-M251 WeakPolarHBondContact O-CE 3.03Å
218D97.2Very high98Very high67 Ų6766.9 Ų66.936%0.35835%0.345SS..THydrogen-bonded Turntrans-61.8-20.8174.656.1-6.1000114.1G220 K247 L248D218-G220 VanDerWaalsContact C-N 3.34Å; D218-K247 WeakPolarHBondContact OD2-CE 3.41Å; D218-K247 IonicContact OD2-NZ 2.67Å; D218-K247 PolarHBondContact OD2-NZ 2.04Å; D218-L248 HydrophobicContact CB-CB 4.4Å; D218-L248 HydrophobicContact CB-CD2 4.24Å; D218-L248 HydrophobicContact CB-CG 4.23Å
219Q96.9Very high98.1Very high155 Ų15567.8 Ų67.872%0.72435%0.351SS*.THydrogen-bonded Turntrans-83.1-2.6171.9-54.6175.1-41.200114.1N217 R221N217-Q219 PolarHBondContact ND2-OE1 3.03Å; N217-Q219 VanDerWaalsContact ND2-OE1 3.08Å; N217-Q219 PolarHBondContact O-N 3.49Å; N217-Q219 WeakPolarHBondContact OD1-CB 3.38Å; N217-Q219 PolarHBondContact OD1-N 3.4Å; Q219-R221 VanDerWaalsContact C-N 3.33Å; Q219-R221 PolarHBondContact O-N 2.73Å
220G96.5Very high98.1Very high21 Ų2169.4 Ų69.422%0.21636%0.359CS..  trans78.47.4-178.700000115.6N217 D218N217-G220 PolarHBondContact O-N 3.03Å; N217-G220 PolarHBondContact OD1-N 3.03Å; D218-G220 VanDerWaalsContact C-N 3.34Å
221R98Very high98Very high163 Ų16369.9 Ų69.962%0.61536%0.362SS*.  trans-77.6128.1172.5-167179.675.3-164.63.9109.3M216 N217 Q219M216-R221 VanDerWaalsContact CA-O 3.28Å; M216-R221 WeakPolarHBondContact CA-O 3.39Å; N217-R221 PolarHBondContact N-O 2.9Å; N217-R221 VanDerWaalsContact N-O 3.11Å; N217-R221 PolarHBondContact OD1-N 3.1Å; N217-R221 PolarHBondContact OD1-O 3.26Å; Q219-R221 VanDerWaalsContact C-N 3.33Å; Q219-R221 PolarHBondContact O-N 2.73Å
222C98.4Very high97.7Very high23 Ų2372.2 Ų72.216%0.15538%0.376CS..EExtended strand (participates in β ladder)trans-65.4135.9170.6-167.60000110.5C213 M216 E226C213-C222 HydrophobicContact CB-CB 3.89Å; C213-C222 WeakPolarHBondContact CB-SG 3.47Å; C213-C222 WeakPolarHBondContact SG-CA 3.35Å; C213-C222 WeakPolarHBondContact SG-CB 3.47Å; C213-C222 CovalentContact SG-SG 2.03Å; C213-C222 PolarHBondContact SG-SG 2.67Å; M216-C222 HydrophobicContact CG-CB 4.29Å; C222-E226 HydrophobicContact CB-CB 4.12Å; C222-E226 HydrophobicContact CB-CG 4.27Å; C222-E226 VanDerWaalsContact SG-CA 3.58Å; C222-E226 VanDerWaalsContact SG-CB 3.59Å; C222-E226 PolarHBondContact SG-N 3.04Å
223L98.3Very high97.1Very high82 Ų8277.2 Ų77.243%0.42940%0.402SS..EExtended strand (participates in β ladder)trans-117.8-18177.2-59.5-178.3000112.2Y215 N217Y215-L223 HydrophobicContact CD1-CB 3.98Å; Y215-L223 HydrophobicContact CD1-CD1 4.11Å; Y215-L223 HydrophobicContact CE1-CB 4.5Å; Y215-L223 HydrophobicContact CE1-CD1 3.81Å; Y215-L223 PolarHBondContact O-N 2.85Å; N217-L223 HydrophobicContact CB-CD1 3.98Å
224R98.4Very high96.6Very high194 Ų19480.2 Ų80.273%0.73242%0.422SS*.EExtended strand (participates in β ladder)trans-155.9135.3175.3-175.6175.7176.11660112C213 A214 Y215C213-R224 PolarHBondContact SG-O 2.82Å; C213-R224 VanDerWaalsContact SG-O 3.36Å; A214-R224 WeakPolarHBondContact CB-O 3.41Å; A214-R224 PolarHBondContact N-O 2.86Å; Y215-R224 PolarHBondContact N-O 3.17Å; Y215-R224 PolarHBondContact O-N 2.9Å
225G97.8Very high96.5Very high45 Ų4579.4 Ų79.446%0.46441%0.408SS..  trans7632.5172.600000114.1T212 C213T212-G225 CarbonylContact C-O 3.46Å; C213-G225 WeakPolarHBondContact CA-O 3.47Å
226E98.6Very high96.4Very high163 Ų16376.3 Ų76.376%0.76240%0.398SS*.  trans-61142.5172.7-170.7162.1-142.300111T212 C222T212-E226 WeakPolarHBondContact O-CA 3.08Å; C222-E226 HydrophobicContact CB-CB 4.12Å; C222-E226 HydrophobicContact CB-CG 4.27Å; C222-E226 VanDerWaalsContact SG-CA 3.58Å; C222-E226 VanDerWaalsContact SG-CB 3.59Å; C222-E226 PolarHBondContact SG-N 3.04Å
227G98.3Very high96.4Very high31 Ų3176.2 Ų76.232%0.3240%0.397SS..EExtended strand (participates in β ladder)trans159.2-154177.500000112.4T212T212-G227 PolarHBondContact N-O 3.49Å; T212-G227 PolarHBondContact O-N 3.27Å; T212-G227 VanDerWaalsContact O-N 3.12Å; T212-G227 VanDerWaalsContact OG1-CA 3.31Å; T212-G227 WeakPolarHBondContact OG1-CA 3.07Å; T212-G227 PolarHBondContact OG1-N 3.34Å; T212-G227 PolarHBondContact OG1-O 3.48Å
228T98.5Very high96.4Very high87 Ų8775.9 Ų75.953%0.53440%0.395SS..EExtended strand (participates in β ladder)trans-135.8156.7176.361.50000111.1C210 T212 F281C210-T228 CarbonylContact O-C 3.53Å; C210-T228 WeakPolarHBondContact O-CA 3.48Å; C210-T228 WeakPolarHBondContact O-CB 3.07Å; T212-T228 PolarHBondContact OG1-N 2.83Å; T228-F281 HydrophobicContact CG2-CE1 3.71Å; T228-F281 HydrophobicContact CG2-CZ 4.35Å
229C97.8Very high96.4Very high29 Ų2973.1 Ų73.120%0.19638%0.381CS..EExtended strand (participates in β ladder)trans-132157.1169.660.80000110N209 C210 T212 C255N209-C229 CarbonylContact C-O 3.58Å; N209-C229 WeakPolarHBondContact CA-O 3.02Å; C210-C229 PolarHBondContact N-O 3.41Å; C210-C229 PolarHBondContact O-N 2.84Å; T212-C229 HydrophobicContact CG2-CB 3.59Å; T212-C229 VanDerWaalsContact CG2-SG 3.52Å; C229-C255 VanDerWaalsContact C-SG 3.52Å; C229-C255 HydrophobicContact CB-CB 4.05Å; C229-C255 WeakPolarHBondContact CB-SG 3.31Å; C229-C255 WeakPolarHBondContact SG-CB 3.06Å; C229-C255 PolarHBondContact SG-N 3.06Å; C229-C255 CovalentContact SG-SG 2.04Å; C229-C255 PolarHBondContact SG-SG 3.38Å
230I97.4Very high96.5Very high93 Ų9368.9 Ų68.948%0.47736%0.359SS..EExtended strand (participates in β ladder)trans-107.6129.9174.8-61.3176.1000107.6I207 L208 Q232I207-I230 HydrophobicContact CG2-CG2 3.36Å; L208-I230 CarbonylContact O-C 3.5Å; L208-I230 WeakPolarHBondContact O-CA 3.28Å; I230-Q232 PolarHBondContact O-N 2.95Å
231T96.5Very high96.6Very high9 Ų970 Ų706%0.05536%0.358CS..  trans-65132.5178.852.20000111.6T206 L208 Q235 C255T206-T231 PolarHBondContact O-OG1 2.93Å; L208-T231 HydrophobicContact CB-CG2 4.15Å; L208-T231 PolarHBondContact N-OG1 3Å; L208-T231 PolarHBondContact O-N 3.39Å; L208-T231 PolarHBondContact O-OG1 2.92Å; T231-Q235 HydrophobicContact CG2-CB 4.1Å; T231-C255 HydrophobicContact CG2-CB 4.45Å
232Q92.1Very high96.6Very high132 Ų13263 Ų6362%0.61733%0.333SS*.  trans-114.1146.8174.1-58.4-178.26.700110.4I230 S234 Q235I230-Q232 PolarHBondContact O-N 2.95Å; Q232-S234 PolarHBondContact O-N 3Å; Q232-Q235 VanDerWaalsContact O-CB 3.27Å; Q232-Q235 WeakPolarHBondContact O-CB 3.03Å; Q232-Q235 VanDerWaalsContact O-CG 3.29Å; Q232-Q235 WeakPolarHBondContact O-CG 3.38Å; Q232-Q235 PolarHBondContact O-N 2.89Å
233N87.9Confident96.6Very high141 Ų14163.7 Ų63.775%0.75433%0.334SS*.THydrogen-bonded Turntrans54.8-105.5174.6-54.4-44.2000113.5
234S88.1Confident96.6Very high63 Ų6365.2 Ų65.244%0.44134%0.338SS..THydrogen-bonded Turntrans-110.413.4179.660.90000113.4Q232Q232-S234 PolarHBondContact O-N 3Å
235Q95.1Very high96.4Very high42 Ų4259.7 Ų59.720%0.19634%0.342CS..  trans-63.7148.7177-73.2-178.7-35.500112.3T231 Q232 C255 E256 N257T231-Q235 HydrophobicContact CG2-CB 4.1Å; Q232-Q235 VanDerWaalsContact O-CB 3.27Å; Q232-Q235 WeakPolarHBondContact O-CB 3.03Å; Q232-Q235 VanDerWaalsContact O-CG 3.29Å; Q232-Q235 WeakPolarHBondContact O-CG 3.38Å; Q232-Q235 PolarHBondContact O-N 2.89Å; Q235-C255 HydrophobicContact CB-CB 4.46Å; Q235-C255 PolarHBondContact NE2-O 3.26Å; Q235-E256 VanDerWaalsContact CA-O 3.26Å; Q235-E256 WeakPolarHBondContact CA-O 3.45Å; Q235-N257 VanDerWaalsContact CG-OD1 3.31Å; Q235-N257 WeakPolarHBondContact CG-OD1 3.43Å; Q235-N257 PolarHBondContact NE2-ND2 3.32Å
236Q96.3Very high96.1Very high40 Ų4060.7 Ų60.719%0.18735%0.352CS..EExtended strand (participates in β ladder)trans-127.1158.2172.6-64.7178.988.400109.7M238 E256 C259 R277Q236-M238 PolarHBondContact O-N 3.23Å; Q236-E256 PolarHBondContact N-O 3.09Å; Q236-E256 PolarHBondContact O-N 3.37Å; Q236-C259 HydrophobicContact CB-CB 4.41Å; Q236-C259 PolarHBondContact NE2-O 2.93Å; Q236-R277 HydrophobicContact CG-CB 4.12Å
237C98Very high96Very high0 Ų058.2 Ų58.20%034%0.339CS..EExtended strand (participates in β ladder)trans-68.1129.8170.4-58.70000109.1C210 C275 C276 N283C210-C237 HydrophobicContact CB-CB 3.66Å; C210-C237 WeakPolarHBondContact CB-SG 3.26Å; C210-C237 WeakPolarHBondContact SG-CA 3.41Å; C210-C237 WeakPolarHBondContact SG-CB 3.25Å; C210-C237 CovalentContact SG-SG 2.03Å; C210-C237 PolarHBondContact SG-SG 2.97Å; C237-C275 WeakPolarHBondContact O-CA 3.3Å; C237-C276 PolarHBondContact N-O 2.03Å; C237-C276 PolarHBondContact O-N 3.2Å; C237-N283 HydrophobicContact CB-CB 3.87Å
238M98.1Very high96Very high13 Ų1358.3 Ų58.36%0.06433%0.332CS..EExtended strand (participates in β ladder)trans-121.8140.7-171.6178.8-85.3-72.600111.1Q236 K240 Q253 G254 E256 I273 I274 N283Q236-M238 PolarHBondContact O-N 3.23Å; M238-K240 HydrophobicContact SD-CB 3.56Å; M238-K240 VanDerWaalsContact SD-CB 3.56Å; M238-K240 PolarHBondContact SD-N 2.89Å; M238-Q253 WeakPolarHBondContact O-CA 3.27Å; M238-G254 PolarHBondContact N-O 3.49Å; M238-G254 PolarHBondContact O-N 3.34Å; M238-E256 HydrophobicContact CB-CB 3.53Å; M238-E256 HydrophobicContact CB-CG 4.48Å; M238-E256 HydrophobicContact CE-CB 4.18Å; M238-E256 HydrophobicContact CE-CG 4.45Å; M238-E256 HydrophobicContact CG-CB 3.79Å; M238-E256 HydrophobicContact CG-CG 4.22Å; M238-I273 HydrophobicContact CG-CG2 4.3Å; M238-I274 WeakPolarHBondContact CA-O 3.22Å; M238-N283 WeakPolarHBondContact O-CB 3.37Å; M238-N283 PolarHBondContact O-ND2 3.07Å
239L98.4Very high95.9Very high10 Ų1057.4 Ų57.45%0.05232%0.322CS..EExtended strand (participates in β ladder)trans-131.1116.7168.2169.256.3000108.8M216 K241 M251 V252 Q253 I274 N283 I285M216-L239 HydrophobicContact CE-CD1 4.23Å; L239-K241 HydrophobicContact CD1-CG 4.33Å; L239-K241 HydrophobicContact CG-CG 4.33Å; L239-M251 HydrophobicContact CD1-CB 4.22Å; L239-M251 HydrophobicContact CD1-SD 4.46Å; L239-V252 WeakPolarHBondContact CA-O 3.31Å; L239-Q253 HydrophobicContact CD1-CG 4.17Å; L239-I274 HydrophobicContact CB-CB 4.35Å; L239-I274 HydrophobicContact CD2-CD1 4.41Å; L239-I274 PolarHBondContact N-O 2.87Å; L239-I274 WeakPolarHBondContact O-CB 3.38Å; L239-I274 PolarHBondContact O-N 3.26Å; L239-N283 HydrophobicContact CB-CB 4.3Å; L239-I285 HydrophobicContact CD1-CD1 3.36Å; L239-I285 HydrophobicContact CD2-CD1 3.72Å; L239-I285 HydrophobicContact CG-CD1 4.19Å
240K98.3Very high96Very high65 Ų6559.1 Ų59.128%0.28333%0.326SS..EExtended strand (participates in β ladder)trans-110.7125.2178.9176.5-176.5-179.4170.10109.2M238 I242 M251 V252 M271 Q272 I273M238-K240 HydrophobicContact SD-CB 3.56Å; M238-K240 VanDerWaalsContact SD-CB 3.56Å; M238-K240 PolarHBondContact SD-N 2.89Å; K240-I242 HydrophobicContact CD-CD1 4.33Å; K240-I242 HydrophobicContact CG-CD1 3.87Å; K240-M251 CarbonylContact O-C 3.47Å; K240-M251 WeakPolarHBondContact O-CA 3.44Å; K240-V252 HydrophobicContact CB-CB 4.31Å; K240-V252 PolarHBondContact N-O 3.41Å; K240-V252 PolarHBondContact O-N 3.28Å; K240-M271 WeakPolarHBondContact CE-SD 3.43Å; K240-M271 HydrophobicContact CG-CG 4.23Å; K240-Q272 CarbonylContact C-O 3.53Å; K240-Q272 WeakPolarHBondContact CA-O 3.43Å; K240-I273 HydrophobicContact CG-CG1 4.46Å
241K98.4Very high96Very high45 Ų4554.8 Ų54.820%0.19630%0.304CS..EExtended strand (participates in β ladder)trans-113.2128.4178.3-52.6-162.5176.9-165.40109.8L239 F243 L248 M251 Q272L239-K241 HydrophobicContact CD1-CG 4.33Å; L239-K241 HydrophobicContact CG-CG 4.33Å; K241-F243 HydrophobicContact CB-CD2 4.42Å; K241-F243 HydrophobicContact CB-CE2 3.62Å; K241-F243 HydrophobicContact CB-CZ 4Å; K241-F243 HydrophobicContact CD-CZ 4.42Å; K241-L248 HydrophobicContact CB-CD1 3.97Å; K241-M251 HydrophobicContact CB-CG 4.17Å; K241-M251 HydrophobicContact CD-CG 4.32Å; K241-M251 HydrophobicContact CD-SD 3.7Å; K241-M251 VanDerWaalsContact CE-SD 3.58Å; K241-M251 HydrophobicContact CG-CG 3.86Å; K241-M251 HydrophobicContact CG-SD 3.85Å; K241-Q272 HydrophobicContact CB-CB 4.42Å; K241-Q272 PolarHBondContact N-O 3.45Å; K241-Q272 PolarHBondContact O-N 3.42Å
242I98.1Very high96.1Very high16 Ų1655.8 Ų55.88%0.08231%0.31CS..EExtended strand (participates in β ladder)trans-112.8119.4-177.9-57.978.6000108.1K240 Q249 F250 V252 T269K240-I242 HydrophobicContact CD-CD1 4.33Å; K240-I242 HydrophobicContact CG-CD1 3.87Å; I242-Q249 PolarHBondContact O-N 3.22Å; I242-F250 HydrophobicContact CB-CD1 4.01Å; I242-F250 HydrophobicContact CB-CE1 3.77Å; I242-F250 HydrophobicContact CB-CE2 4.37Å; I242-F250 HydrophobicContact CB-CG 4.41Å; I242-F250 HydrophobicContact CB-CZ 3.96Å; I242-F250 HydrophobicContact CD1-CD2 3.7Å; I242-F250 HydrophobicContact CD1-CE1 4.4Å; I242-F250 HydrophobicContact CD1-CE2 3.43Å; I242-F250 VanDerWaalsContact CD1-CE2 3.43Å; I242-F250 HydrophobicContact CD1-CG 4.31Å; I242-F250 HydrophobicContact CD1-CZ 3.82Å; I242-F250 HydrophobicContact CG1-CD2 4.36Å; I242-F250 HydrophobicContact CG1-CE1 4.02Å; I242-F250 HydrophobicContact CG1-CE2 3.84Å; I242-F250 HydrophobicContact CG1-CZ 3.65Å; I242-F250 HydrophobicContact CG2-CD1 4.31Å; I242-F250 HydrophobicContact CG2-CE1 3.74Å; I242-F250 HydrophobicContact CG2-CZ 4.13Å; I242-F250 PolarHBondContact N-O 3.33Å; I242-F250 PolarHBondContact O-N 3.48Å; I242-V252 HydrophobicContact CD1-CG2 4.27Å; I242-T269 HydrophobicContact CG2-CG2 4.08Å
243F98.2Very high96.4Very high38 Ų3850.6 Ų50.617%0.16729%0.285CS..EExtended strand (participates in β ladder)trans-115.9144.1178.3-50.2-106.1000109.9K241 K247 L248 T269 R270 Q272K241-F243 HydrophobicContact CB-CD2 4.42Å; K241-F243 HydrophobicContact CB-CE2 3.62Å; K241-F243 HydrophobicContact CB-CZ 4Å; K241-F243 HydrophobicContact CD-CZ 4.42Å; F243-K247 CarbonylContact C-O 3.58Å; F243-K247 WeakPolarHBondContact CA-O 3.41Å; F243-K247 WeakPolarHBondContact CB-O 3.43Å; F243-L248 HydrophobicContact CD1-CB 3.87Å; F243-L248 HydrophobicContact CD1-CD1 4.08Å; F243-L248 HydrophobicContact CE1-CB 3.94Å; F243-L248 HydrophobicContact CE1-CD1 3.89Å; F243-L248 HydrophobicContact CE1-CG 4.46Å; F243-L248 HydrophobicContact CE2-CD1 4.4Å; F243-L248 HydrophobicContact CG-CD1 4.4Å; F243-L248 HydrophobicContact CZ-CD1 4.06Å; F243-T269 CarbonylContact O-C 3.5Å; F243-T269 VanDerWaalsContact O-CA 3.3Å; F243-T269 WeakPolarHBondContact O-CA 3.48Å; F243-R270 HydrophobicContact CB-CB 4.25Å; F243-R270 HydrophobicContact CD2-CB 4.44Å; F243-R270 HydrophobicContact CD2-CG 4.27Å; F243-R270 PolarHBondContact N-O 2.88Å; F243-R270 PolarHBondContact O-N 2.95Å; F243-Q272 HydrophobicContact CE2-CB 4.12Å
244E97.3Very high96.9Very high113 Ų11344.3 Ų44.353%0.52825%0.254SS..EExtended strand (participates in β ladder)trans-139.7131.3177.1-175.3179.1-168.200108.3G246 K247 Q249E244-G246 PolarHBondContact O-N 2.82Å; E244-G246 VanDerWaalsContact O-N 3.16Å; E244-K247 PolarHBondContact N-O 2.87Å; E244-K247 PolarHBondContact O-N 3.39Å; E244-K247 VanDerWaalsContact O-N 3.09Å; E244-Q249 HydrophobicContact CB-CG 3.65Å; E244-Q249 PolarHBondContact O-NE2 3.32Å
245G94.4Very high97.4Very high79 Ų7942.3 Ų42.381%0.81424%0.24SC*.THydrogen-bonded Turntrans6120.2-170.100000113.5K247 G268G245-K247 VanDerWaalsContact C-N 3.26Å; G245-K247 PolarHBondContact O-N 2.93Å; G245-G268 PolarHBondContact N-O 2.89Å
246G92.6Very high97.5Very high65 Ų6543.5 Ų43.567%0.6725%0.245SC*.THydrogen-bonded Turntrans83-17.5-172.900000115.2E244E244-G246 PolarHBondContact O-N 2.82Å; E244-G246 VanDerWaalsContact O-N 3.16Å
247K96.6Very high97.4Very high112 Ų11245.1 Ų45.149%0.48726%0.255SS..EExtended strand (participates in β ladder)trans-77.3138.1175-161-146.9171.6-150.40110.3D218 F243 E244 G245 Q249D218-K247 WeakPolarHBondContact OD2-CE 3.41Å; D218-K247 IonicContact OD2-NZ 2.67Å; D218-K247 PolarHBondContact OD2-NZ 2.04Å; F243-K247 CarbonylContact C-O 3.58Å; F243-K247 WeakPolarHBondContact CA-O 3.41Å; F243-K247 WeakPolarHBondContact CB-O 3.43Å; E244-K247 PolarHBondContact N-O 2.87Å; E244-K247 PolarHBondContact O-N 3.39Å; E244-K247 VanDerWaalsContact O-N 3.09Å; G245-K247 VanDerWaalsContact C-N 3.26Å; G245-K247 PolarHBondContact O-N 2.93Å; K247-Q249 PolarHBondContact O-N 3.18Å
248L97.5Very high97Very high33 Ų3352.6 Ų52.617%0.17329%0.292CS..EExtended strand (participates in β ladder)trans-63.4128166.1-177.464.8000109.1D218 K241 F243 M251D218-L248 HydrophobicContact CB-CB 4.4Å; D218-L248 HydrophobicContact CB-CD2 4.24Å; D218-L248 HydrophobicContact CB-CG 4.23Å; K241-L248 HydrophobicContact CB-CD1 3.97Å; F243-L248 HydrophobicContact CD1-CB 3.87Å; F243-L248 HydrophobicContact CD1-CD1 4.08Å; F243-L248 HydrophobicContact CE1-CB 3.94Å; F243-L248 HydrophobicContact CE1-CD1 3.89Å; F243-L248 HydrophobicContact CE1-CG 4.46Å; F243-L248 HydrophobicContact CE2-CD1 4.4Å; F243-L248 HydrophobicContact CG-CD1 4.4Å; F243-L248 HydrophobicContact CZ-CD1 4.06Å; L248-M251 HydrophobicContact CD1-CG 3.92Å; L248-M251 HydrophobicContact CD1-SD 4.49Å; L248-M251 HydrophobicContact CD2-CE 4.11Å; L248-M251 HydrophobicContact CD2-CG 4.24Å; L248-M251 HydrophobicContact CD2-SD 3.98Å
249Q97.8Very high96.8Very high68 Ų6852.4 Ų52.432%0.31829%0.292SS..EExtended strand (participates in β ladder)trans-102.2-51.3178.7-60-60.1-12.500111I242 E244 K247I242-Q249 PolarHBondContact O-N 3.22Å; E244-Q249 HydrophobicContact CB-CG 3.65Å; E244-Q249 PolarHBondContact O-NE2 3.32Å; K247-Q249 PolarHBondContact O-N 3.18Å
250F98.2Very high96.6Very high65 Ų6555.5 Ų55.529%0.28531%0.313SS..EExtended strand (participates in β ladder)trans-157.3167.5178.167-82.6000112.1Y215 M216 I242 V252Y215-F250 HydrophobicContact CD2-CB 3.8Å; Y215-F250 AromaticContact CD2-CD2 3.73Å; Y215-F250 HydrophobicContact CD2-CD2 3.73Å; Y215-F250 HydrophobicContact CD2-CE2 4.47Å; Y215-F250 AromaticContact CD2-CG 3.9Å; Y215-F250 HydrophobicContact CD2-CG 3.9Å; Y215-F250 HydrophobicContact CE2-CB 3.34Å; Y215-F250 HydrophobicContact CE2-CD1 4.14Å; Y215-F250 AromaticContact CE2-CD2 3.9Å; Y215-F250 HydrophobicContact CE2-CD2 3.9Å; Y215-F250 AromaticContact CE2-CG 3.57Å; Y215-F250 HydrophobicContact CE2-CG 3.57Å; M216-F250 VanDerWaalsContact O-CA 3.26Å; M216-F250 WeakPolarHBondContact O-CA 3.28Å; M216-F250 VanDerWaalsContact O-CB 3.25Å; M216-F250 WeakPolarHBondContact O-CB 3.06Å; I242-F250 HydrophobicContact CB-CD1 4.01Å; I242-F250 HydrophobicContact CB-CE1 3.77Å; I242-F250 HydrophobicContact CB-CE2 4.37Å; I242-F250 HydrophobicContact CB-CG 4.41Å; I242-F250 HydrophobicContact CB-CZ 3.96Å; I242-F250 HydrophobicContact CD1-CD2 3.7Å; I242-F250 HydrophobicContact CD1-CE1 4.4Å; I242-F250 HydrophobicContact CD1-CE2 3.43Å; I242-F250 VanDerWaalsContact CD1-CE2 3.43Å; I242-F250 HydrophobicContact CD1-CG 4.31Å; I242-F250 HydrophobicContact CD1-CZ 3.82Å; I242-F250 HydrophobicContact CG1-CD2 4.36Å; I242-F250 HydrophobicContact CG1-CE1 4.02Å; I242-F250 HydrophobicContact CG1-CE2 3.84Å; I242-F250 HydrophobicContact CG1-CZ 3.65Å; I242-F250 HydrophobicContact CG2-CD1 4.31Å; I242-F250 HydrophobicContact CG2-CE1 3.74Å; I242-F250 HydrophobicContact CG2-CZ 4.13Å; I242-F250 PolarHBondContact N-O 3.33Å; I242-F250 PolarHBondContact O-N 3.48Å; F250-V252 HydrophobicContact CD2-CG2 4.06Å; F250-V252 HydrophobicContact CE2-CG2 3.98Å
251M98.6Very high96.5Very high2 Ų256.1 Ų56.11%0.0133%0.325CS..EExtended strand (participates in β ladder)trans-129.8158.8174.3-57.9179.9-77.200111.1M216 N217 L239 K240 K241 L248 I285M216-M251 HydrophobicContact CB-CB 4.16Å; M216-M251 HydrophobicContact CE-CB 3.61Å; M216-M251 PolarHBondContact N-O 2.03Å; M216-M251 PolarHBondContact O-N 3.04Å; M216-M251 HydrophobicContact SD-CB 4.37Å; N217-M251 WeakPolarHBondContact O-CE 3.03Å; L239-M251 HydrophobicContact CD1-CB 4.22Å; L239-M251 HydrophobicContact CD1-SD 4.46Å; K240-M251 CarbonylContact O-C 3.47Å; K240-M251 WeakPolarHBondContact O-CA 3.44Å; K241-M251 HydrophobicContact CB-CG 4.17Å; K241-M251 HydrophobicContact CD-CG 4.32Å; K241-M251 HydrophobicContact CD-SD 3.7Å; K241-M251 VanDerWaalsContact CE-SD 3.58Å; K241-M251 HydrophobicContact CG-CG 3.86Å; K241-M251 HydrophobicContact CG-SD 3.85Å; L248-M251 HydrophobicContact CD1-CG 3.92Å; L248-M251 HydrophobicContact CD1-SD 4.49Å; L248-M251 HydrophobicContact CD2-CE 4.11Å; L248-M251 HydrophobicContact CD2-CG 4.24Å; L248-M251 HydrophobicContact CD2-SD 3.98Å; M251-I285 HydrophobicContact CE-CD1 4.24Å; M251-I285 HydrophobicContact CE-CG1 4.39Å; M251-I285 HydrophobicContact CE-CG2 3.99Å; M251-I285 HydrophobicContact SD-CD1 4.08Å; M251-I285 HydrophobicContact SD-CG2 4.42Å
252V98.6Very high96.4Very high30 Ų3057.4 Ų57.418%0.18233%0.333CS..EExtended strand (participates in β ladder)trans-134.3141.9176.8-173.90000109C213 L239 K240 I242 F250C213-V252 WeakPolarHBondContact O-CA 3.26Å; C213-V252 WeakPolarHBondContact O-CG1 3.29Å; L239-V252 WeakPolarHBondContact CA-O 3.31Å; K240-V252 HydrophobicContact CB-CB 4.31Å; K240-V252 PolarHBondContact N-O 3.41Å; K240-V252 PolarHBondContact O-N 3.28Å; I242-V252 HydrophobicContact CD1-CG2 4.27Å; F250-V252 HydrophobicContact CD2-CG2 4.06Å; F250-V252 HydrophobicContact CE2-CG2 3.98Å
253Q98.6Very high96.3Very high22 Ų2259.9 Ų59.910%0.10335%0.346CS..EExtended strand (participates in β ladder)trans-128.3143.4178.8-93.7168.6-14.100110.4T212 C213 M216 M238 L239 N283T212-Q253 WeakPolarHBondContact CA-O 3.05Å; C213-Q253 HydrophobicContact CB-CB 4.37Å; C213-Q253 PolarHBondContact N-O 2.79Å; C213-Q253 PolarHBondContact O-N 3.42Å; M216-Q253 HydrophobicContact CE-CB 3.84Å; M216-Q253 HydrophobicContact CE-CG 3.5Å; M216-Q253 HydrophobicContact SD-CG 4.39Å; M238-Q253 WeakPolarHBondContact O-CA 3.27Å; L239-Q253 HydrophobicContact CD1-CG 4.17Å; Q253-N283 PolarHBondContact NE2-O 3.11Å
254G98Very high96.2Very high9 Ų961.7 Ų61.79%0.09336%0.357CS..EExtended strand (participates in β ladder)trans176.1-162169.500000114.3Y211 M238Y211-G254 WeakPolarHBondContact O-CA 3.46Å; Y211-G254 PolarHBondContact O-N 3.16Å; M238-G254 PolarHBondContact N-O 3.49Å; M238-G254 PolarHBondContact O-N 3.34Å
255C97.9Very high96.1Very high22 Ų2263.2 Ų63.215%0.14936%0.362CS..EExtended strand (participates in β ladder)trans-103.5113.5175.6-64.30000108.3C229 T231 Q235C229-C255 VanDerWaalsContact C-SG 3.52Å; C229-C255 HydrophobicContact CB-CB 4.05Å; C229-C255 WeakPolarHBondContact CB-SG 3.31Å; C229-C255 WeakPolarHBondContact SG-CB 3.06Å; C229-C255 PolarHBondContact SG-N 3.06Å; C229-C255 CovalentContact SG-SG 2.04Å; C229-C255 PolarHBondContact SG-SG 3.38Å; T231-C255 HydrophobicContact CG2-CB 4.45Å; Q235-C255 HydrophobicContact CB-CB 4.46Å; Q235-C255 PolarHBondContact NE2-O 3.26Å
256E96.8Very high96.1Very high66 Ų6663 Ų6331%0.30835%0.348SS..EExtended strand (participates in β ladder)trans-116.8136.3-168.7-173.259.3-83.200112.4Q235 Q236 M238 C259Q235-E256 VanDerWaalsContact CA-O 3.26Å; Q235-E256 WeakPolarHBondContact CA-O 3.45Å; Q236-E256 PolarHBondContact N-O 3.09Å; Q236-E256 PolarHBondContact O-N 3.37Å; M238-E256 HydrophobicContact CB-CB 3.53Å; M238-E256 HydrophobicContact CB-CG 4.48Å; M238-E256 HydrophobicContact CE-CB 4.18Å; M238-E256 HydrophobicContact CE-CG 4.45Å; M238-E256 HydrophobicContact CG-CB 3.79Å; M238-E256 HydrophobicContact CG-CG 4.22Å; E256-C259 HydrophobicContact CB-CB 4.06Å; E256-C259 HydrophobicContact CG-CB 4.07Å
257N94.1Very high96.1Very high75 Ų7569 Ų6940%0.40136%0.358SS..SBendtrans-84.2143.6175.3-74.2-75.2000110Q235 C259Q235-N257 VanDerWaalsContact CG-OD1 3.31Å; Q235-N257 WeakPolarHBondContact CG-OD1 3.43Å; Q235-N257 PolarHBondContact NE2-ND2 3.32Å; N257-C259 PolarHBondContact O-N 3.16Å
258M90.4Very high95.8Very high156 Ų15666.6 Ų66.677%0.76837%0.366SS*.SBendtrans49.855.4179.8-60.1-6115900112.1P260M258-P260 VanDerWaalsContact C-CD 3.49Å; M258-P260 WeakPolarHBondContact O-CD 3.33Å
259C93.9Very high95.8Very high9 Ų967.4 Ų67.46%0.06137%0.372CS..  trans-96.494.8-176.3-1630000111.4Q236 E256 N257 C275Q236-C259 HydrophobicContact CB-CB 4.41Å; Q236-C259 PolarHBondContact NE2-O 2.93Å; E256-C259 HydrophobicContact CB-CB 4.06Å; E256-C259 HydrophobicContact CG-CB 4.07Å; N257-C259 PolarHBondContact O-N 3.16Å; C259-C275 WeakPolarHBondContact CA-SG 3.41Å; C259-C275 HydrophobicContact CB-CB 3.76Å; C259-C275 WeakPolarHBondContact CB-SG 3.42Å; C259-C275 VanDerWaalsContact O-CB 3.31Å; C259-C275 WeakPolarHBondContact O-CB 3.39Å; C259-C275 PolarHBondContact O-SG 3.28Å; C259-C275 WeakPolarHBondContact SG-CB 3.39Å; C259-C275 CovalentContact SG-SG 2.03Å; C259-C275 PolarHBondContact SG-SG 2.9Å
260P94.3Very high95.8Very high75 Ų7568.6 Ų68.649%0.48737%0.374SS..  trans-87.1136.5162.734.4-34.3000110.8M258 M262M258-P260 VanDerWaalsContact C-CD 3.49Å; M258-P260 WeakPolarHBondContact O-CD 3.33Å; P260-M262 HydrophobicContact CG-SD 4.05Å; P260-M262 PolarHBondContact O-N 2.82Å
261S96.1Very high95.7Very high78 Ų7868.1 Ų68.155%0.54537%0.373SS..  trans-68115169.4-65.80000109.7I273 C275S261-I273 CarbonylContact C-O 3.49Å; S261-I273 VanDerWaalsContact CA-O 3.28Å; S261-I273 WeakPolarHBondContact CA-O 3.11Å; S261-C275 PolarHBondContact OG-N 3.05Å; S261-C275 PolarHBondContact OG-O 3.15Å
262M96.4Very high95.7Very high72 Ų7270.4 Ų70.436%0.35538%0.384SS..EExtended strand (participates in β ladder)trans-151.2167.5-17271.5-177.1-52.700113.3P260 L264 I273P260-M262 HydrophobicContact CG-SD 4.05Å; P260-M262 PolarHBondContact O-N 2.82Å; M262-L264 HydrophobicContact CE-CD1 4.36Å; M262-L264 HydrophobicContact CE-CD2 3.67Å; M262-L264 HydrophobicContact CE-CG 3.92Å; M262-L264 HydrophobicContact CG-CG 4.5Å; M262-L264 HydrophobicContact SD-CD1 4.19Å; M262-L264 HydrophobicContact SD-CG 4.3Å; M262-I273 HydrophobicContact CG-CB 4.26Å; M262-I273 HydrophobicContact CG-CD1 4.29Å; M262-I273 PolarHBondContact N-O 3.43Å; M262-I273 PolarHBondContact O-N 3.24Å
263N96.6Very high95.7Very high69 Ų6970.5 Ų70.537%0.36938%0.383SS..EExtended strand (participates in β ladder)trans-123.1128.5171-69.6-101.4000109.4F265 R270N263-F265 HydrophobicContact CB-CE2 3.74Å; N263-F265 HydrophobicContact CB-CZ 4.37Å; N263-R270 PolarHBondContact OD1-NE 3.23Å; N263-R270 VanDerWaalsContact OD1-NE 3.11Å; N263-R270 PolarHBondContact OD1-NH2 2.83Å
264L95.4Very high95.7Very high76 Ų7672.1 Ų72.140%0.39839%0.392SS..EExtended strand (participates in β ladder)trans-115141177.1-68.5159.3000108.5M262 R270 M271 I273M262-L264 HydrophobicContact CE-CD1 4.36Å; M262-L264 HydrophobicContact CE-CD2 3.67Å; M262-L264 HydrophobicContact CE-CG 3.92Å; M262-L264 HydrophobicContact CG-CG 4.5Å; M262-L264 HydrophobicContact SD-CD1 4.19Å; M262-L264 HydrophobicContact SD-CG 4.3Å; L264-R270 CarbonylContact O-C 3.57Å; L264-R270 WeakPolarHBondContact O-CA 2.9Å; L264-M271 HydrophobicContact CB-CB 4.24Å; L264-M271 HydrophobicContact CD1-SD 4.05Å; L264-M271 PolarHBondContact N-O 3.39Å; L264-M271 PolarHBondContact O-N 2.97Å; L264-I273 HydrophobicContact CD1-CD1 4.25Å
265F95.8Very high95.6Very high145 Ų14572.5 Ų72.564%0.63639%0.393SS*.EExtended strand (participates in β ladder)trans-132.7130.9-179-64.3-99.8000109.5N263 T269 R270N263-F265 HydrophobicContact CB-CE2 3.74Å; N263-F265 HydrophobicContact CB-CZ 4.37Å; F265-T269 WeakPolarHBondContact CA-O 3.49Å; F265-R270 HydrophobicContact CD1-CB 3.83Å; F265-R270 HydrophobicContact CD1-CG 3.89Å; F265-R270 HydrophobicContact CE1-CB 3.87Å; F265-R270 HydrophobicContact CE1-CG 3.54Å; F265-R270 HydrophobicContact CZ-CG 3.88Å
266S93.6Very high95.6Very high74 Ų7472.6 Ų72.652%0.51739%0.393SS..EExtended strand (participates in β ladder)trans-158.9129.7179.7-167.90000110.4G268 T269S266-G268 VanDerWaalsContact C-N 3.33Å; S266-G268 PolarHBondContact O-N 2.82Å; S266-G268 VanDerWaalsContact O-N 3.13Å; S266-T269 PolarHBondContact N-O 2.83Å; S266-T269 WeakPolarHBondContact O-CA 3.28Å; S266-T269 WeakPolarHBondContact O-CB 3.07Å; S266-T269 PolarHBondContact O-N 3.11Å; S266-T269 VanDerWaalsContact O-O 3.13Å
267H92.3Very high95.4Very high190 Ų19076.6 Ų76.688%0.8841%0.406SS*.THydrogen-bonded Turntrans43.748174.1-57.4-74000115.4T269H267-T269 PolarHBondContact O-N 2.78Å
268G91.9Very high95.3Very high63 Ų6379.9 Ų79.965%0.64942%0.423SS*.THydrogen-bonded Turntrans77.9-8.2-179.700000115.6G245 S266G245-G268 PolarHBondContact N-O 2.89Å; S266-G268 VanDerWaalsContact C-N 3.33Å; S266-G268 PolarHBondContact O-N 2.82Å; S266-G268 VanDerWaalsContact O-N 3.13Å
269T96.7Very high95.5Very high49 Ų4978.7 Ų78.730%0.30142%0.416SS..EExtended strand (participates in β ladder)trans-88.6135169.6-60.70000110.6I242 F243 F265 S266 H267I242-T269 HydrophobicContact CG2-CG2 4.08Å; F243-T269 CarbonylContact O-C 3.5Å; F243-T269 VanDerWaalsContact O-CA 3.3Å; F243-T269 WeakPolarHBondContact O-CA 3.48Å; F265-T269 WeakPolarHBondContact CA-O 3.49Å; S266-T269 PolarHBondContact N-O 2.83Å; S266-T269 WeakPolarHBondContact O-CA 3.28Å; S266-T269 WeakPolarHBondContact O-CB 3.07Å; S266-T269 PolarHBondContact O-N 3.11Å; S266-T269 VanDerWaalsContact O-O 3.13Å; H267-T269 PolarHBondContact O-N 2.78Å
270R97.2Very high95.6Very high93 Ų9380.1 Ų80.135%0.35143%0.426SS..EExtended strand (participates in β ladder)trans-113.6129.4166.3173.5-170.6-177.2170.9-0.9108.9F243 N263 L264 F265F243-R270 HydrophobicContact CB-CB 4.25Å; F243-R270 HydrophobicContact CD2-CB 4.44Å; F243-R270 HydrophobicContact CD2-CG 4.27Å; F243-R270 PolarHBondContact N-O 2.88Å; F243-R270 PolarHBondContact O-N 2.95Å; N263-R270 PolarHBondContact OD1-NE 3.23Å; N263-R270 VanDerWaalsContact OD1-NE 3.11Å; N263-R270 PolarHBondContact OD1-NH2 2.83Å; L264-R270 CarbonylContact O-C 3.57Å; L264-R270 WeakPolarHBondContact O-CA 2.9Å; F265-R270 HydrophobicContact CD1-CB 3.83Å; F265-R270 HydrophobicContact CD1-CG 3.89Å; F265-R270 HydrophobicContact CE1-CB 3.87Å; F265-R270 HydrophobicContact CE1-CG 3.54Å; F265-R270 HydrophobicContact CZ-CG 3.88Å
271M97.4Very high95.8Very high56 Ų5680.1 Ų80.128%0.27642%0.418SS..EExtended strand (participates in β ladder)trans-114.2114.3173.4178.5-171.8-55.600108.5K240 L264 I273K240-M271 WeakPolarHBondContact CE-SD 3.43Å; K240-M271 HydrophobicContact CG-CG 4.23Å; L264-M271 HydrophobicContact CB-CB 4.24Å; L264-M271 HydrophobicContact CD1-SD 4.05Å; L264-M271 PolarHBondContact N-O 3.39Å; L264-M271 PolarHBondContact O-N 2.97Å; M271-I273 HydrophobicContact CG-CG1 4.33Å; M271-I273 HydrophobicContact SD-CD1 4.4Å
272Q98Very high95.9Very high50 Ų5078.1 Ų78.123%0.23440%0.404CS..EExtended strand (participates in β ladder)trans-100.7125173.4-176.1179.813.500108.6K240 K241 F243 I274K240-Q272 CarbonylContact C-O 3.53Å; K240-Q272 WeakPolarHBondContact CA-O 3.43Å; K241-Q272 HydrophobicContact CB-CB 4.42Å; K241-Q272 PolarHBondContact N-O 3.45Å; K241-Q272 PolarHBondContact O-N 3.42Å; F243-Q272 HydrophobicContact CE2-CB 4.12Å; Q272-I274 HydrophobicContact CG-CD1 4.38Å; Q272-I274 HydrophobicContact CG-CG1 4.03Å
273I98.1Very high95.9Very high32 Ų3274.9 Ų74.916%0.16439%0.388CS..EExtended strand (participates in β ladder)trans-107.9130.3173.5-54.9177.5000107.2M238 K240 S261 M262 L264 M271M238-I273 HydrophobicContact CG-CG2 4.3Å; K240-I273 HydrophobicContact CG-CG1 4.46Å; S261-I273 CarbonylContact C-O 3.49Å; S261-I273 VanDerWaalsContact CA-O 3.28Å; S261-I273 WeakPolarHBondContact CA-O 3.11Å; M262-I273 HydrophobicContact CG-CB 4.26Å; M262-I273 HydrophobicContact CG-CD1 4.29Å; M262-I273 PolarHBondContact N-O 3.43Å; M262-I273 PolarHBondContact O-N 3.24Å; L264-I273 HydrophobicContact CD1-CD1 4.25Å; M271-I273 HydrophobicContact CG-CG1 4.33Å; M271-I273 HydrophobicContact SD-CD1 4.4Å
274I97.9Very high95.9Very high56 Ų5678.4 Ų78.429%0.28740%0.4SS..EExtended strand (participates in β ladder)trans-125.5123.5179.7-53.4173000106.8M238 L239 Q272M238-I274 WeakPolarHBondContact CA-O 3.22Å; L239-I274 HydrophobicContact CB-CB 4.35Å; L239-I274 HydrophobicContact CD2-CD1 4.41Å; L239-I274 PolarHBondContact N-O 2.87Å; L239-I274 WeakPolarHBondContact O-CB 3.38Å; L239-I274 PolarHBondContact O-N 3.26Å; Q272-I274 HydrophobicContact CG-CD1 4.38Å; Q272-I274 HydrophobicContact CG-CG1 4.03Å
275C97.5Very high95.8Very high17 Ų1779.8 Ų79.812%0.11541%0.407CS..EExtended strand (participates in β ladder)trans-122.8136.3-175.8-50.90000109.4C237 C259 S261C237-C275 WeakPolarHBondContact O-CA 3.3Å; C259-C275 WeakPolarHBondContact CA-SG 3.41Å; C259-C275 HydrophobicContact CB-CB 3.76Å; C259-C275 WeakPolarHBondContact CB-SG 3.42Å; C259-C275 VanDerWaalsContact O-CB 3.31Å; C259-C275 WeakPolarHBondContact O-CB 3.39Å; C259-C275 PolarHBondContact O-SG 3.28Å; C259-C275 WeakPolarHBondContact SG-CB 3.39Å; C259-C275 CovalentContact SG-SG 2.03Å; C259-C275 PolarHBondContact SG-SG 2.9Å; S261-C275 PolarHBondContact OG-N 3.05Å; S261-C275 PolarHBondContact OG-O 3.15Å
276C96.1Very high95.8Very high23 Ų2376.5 Ų76.516%0.15540%0.395CS..EExtended strand (participates in β ladder)trans-142.4147.1-179.164.20000111.9C237 C282C237-C276 PolarHBondContact N-O 2.03Å; C237-C276 PolarHBondContact O-N 3.2Å; C276-C282 VanDerWaalsContact C-SG 3.51Å; C276-C282 HydrophobicContact CB-CB 3.91Å; C276-C282 WeakPolarHBondContact CB-SG 3.25Å; C276-C282 PolarHBondContact O-SG 3.19Å; C276-C282 WeakPolarHBondContact SG-CB 3.34Å; C276-C282 PolarHBondContact SG-O 3.41Å; C276-C282 VanDerWaalsContact SG-O 3.4Å; C276-C282 CovalentContact SG-SG 2.04Å; C276-C282 PolarHBondContact SG-SG 3.25Å
277R93.9Very high95.9Very high151 Ų15176.6 Ų76.657%0.5739%0.389SS*.  trans-14017.8-176.164.3176.7-177.9172.92.1113.7L208 Q236L208-R277 HydrophobicContact CD1-CB 4.34Å; Q236-R277 HydrophobicContact CG-CB 4.12Å
278N90.8Very high96.1Very high143 Ų14370.3 Ų70.377%0.76536%0.361SS*.SBendtrans-91.6-26.3-165.9-5819000112.5
279Q95.1Very high96.3Very high131 Ų13170.8 Ų70.861%0.61235%0.345SS*.SBendtrans-162.5162.9-17959.6178.486.500109.5C282Q279-C282 HydrophobicContact CG-CB 3.78Å; Q279-C282 WeakPolarHBondContact O-CB 3.44Å; Q279-C282 PolarHBondContact O-SG 2.84Å; Q279-C282 VanDerWaalsContact O-SG 3.4Å
280S97.4Very high96.3Very high39 Ų3972.1 Ų72.127%0.27335%0.347SS..THydrogen-bonded Turntrans-63.3149.7168.6-71.80000110.7N209 C282N209-S280 PolarHBondContact N-OG 2.91Å; N209-S280 CarbonylContact O-C 3.51Å; N209-S280 VanDerWaalsContact O-CA 3.24Å; N209-S280 WeakPolarHBondContact O-CA 3.24Å; N209-S280 WeakPolarHBondContact O-CB 3.47Å; S280-C282 PolarHBondContact O-N 3.27Å
281F97.9Very high96.2Very high75 Ų7570.7 Ų70.733%0.32935%0.347SS..THydrogen-bonded Turntrans60.919.4178.3-54.2-64.1000115N209 Y211 T228 N283 K284N209-F281 HydrophobicContact CB-CD1 4.4Å; N209-F281 HydrophobicContact CB-CE1 3.67Å; N209-F281 HydrophobicContact CB-CE2 3.87Å; N209-F281 HydrophobicContact CB-CZ 3.36Å; N209-F281 PolarHBondContact O-N 3.13Å; Y211-F281 HydrophobicContact CD1-CD1 4.09Å; Y211-F281 HydrophobicContact CD2-CB 4.12Å; Y211-F281 HydrophobicContact CD2-CD1 4.08Å; Y211-F281 AromaticContact CE1-CD1 3.95Å; Y211-F281 HydrophobicContact CE1-CD1 3.95Å; Y211-F281 HydrophobicContact CE1-CE1 4.4Å; Y211-F281 HydrophobicContact CE2-CB 3.61Å; Y211-F281 AromaticContact CE2-CD1 3.95Å; Y211-F281 HydrophobicContact CE2-CD1 3.95Å; Y211-F281 HydrophobicContact CE2-CG 4.1Å; Y211-F281 HydrophobicContact CG-CD1 4.15Å; Y211-F281 AromaticContact CZ-CD1 3.87Å; T228-F281 HydrophobicContact CG2-CE1 3.71Å; T228-F281 HydrophobicContact CG2-CZ 4.35Å; F281-N283 PolarHBondContact O-N 3.09Å; F281-N283 VanDerWaalsContact O-N 3.13Å; F281-K284 PolarHBondContact O-N 3.21Å
282C97.6Very high96.1Very high37 Ų3771.8 Ų71.825%0.2535%0.352CS..THydrogen-bonded Turntrans-65.6-13.5-17965.80000114.6C276 Q279 S280 K284C276-C282 VanDerWaalsContact C-SG 3.51Å; C276-C282 HydrophobicContact CB-CB 3.91Å; C276-C282 WeakPolarHBondContact CB-SG 3.25Å; C276-C282 PolarHBondContact O-SG 3.19Å; C276-C282 WeakPolarHBondContact SG-CB 3.34Å; C276-C282 PolarHBondContact SG-O 3.41Å; C276-C282 VanDerWaalsContact SG-O 3.4Å; C276-C282 CovalentContact SG-SG 2.04Å; C276-C282 PolarHBondContact SG-SG 3.25Å; Q279-C282 HydrophobicContact CG-CB 3.78Å; Q279-C282 WeakPolarHBondContact O-CB 3.44Å; Q279-C282 PolarHBondContact O-SG 2.84Å; Q279-C282 VanDerWaalsContact O-SG 3.4Å; S280-C282 PolarHBondContact O-N 3.27Å; C282-K284 VanDerWaalsContact C-N 3.29Å; C282-K284 PolarHBondContact O-N 3.26Å
283N97.3Very high96Very high4 Ų473.5 Ų73.52%0.02136%0.361CS..THydrogen-bonded Turntrans-87.712.7177.667.6-29000114.1Y211 C237 M238 L239 Q253 F281Y211-N283 PolarHBondContact N-OD1 2.04Å; Y211-N283 PolarHBondContact O-ND2 3.48Å; C237-N283 HydrophobicContact CB-CB 3.87Å; M238-N283 WeakPolarHBondContact O-CB 3.37Å; M238-N283 PolarHBondContact O-ND2 3.07Å; L239-N283 HydrophobicContact CB-CB 4.3Å; Q253-N283 PolarHBondContact NE2-O 3.11Å; F281-N283 PolarHBondContact O-N 3.09Å; F281-N283 VanDerWaalsContact O-N 3.13Å
284K96.3Very high95.8Very high143 Ų14376.9 Ų76.962%0.62238%0.378SS*.  trans-55.1150.5173.6-161.4179.7173.8-179.90111.7Y211 F281 C282Y211-K284 HydrophobicContact CD2-CB 4.14Å; Y211-K284 HydrophobicContact CD2-CG 4.39Å; Y211-K284 HydrophobicContact CE2-CB 3.87Å; Y211-K284 HydrophobicContact CE2-CD 4.25Å; Y211-K284 HydrophobicContact CE2-CG 3.87Å; F281-K284 PolarHBondContact O-N 3.21Å; C282-K284 VanDerWaalsContact C-N 3.29Å; C282-K284 PolarHBondContact O-N 3.26Å
285I92.3Very high95.6Very high104 Ų10478.8 Ų78.853%0.53339%0.386SS..  trans-82.40171.4-42.3-55.7000110M216 L239 M251M216-I285 HydrophobicContact CE-CD1 4.06Å; M216-I285 HydrophobicContact SD-CD1 3.8Å; M216-I285 HydrophobicContact SD-CG1 3.77Å; L239-I285 HydrophobicContact CD1-CD1 3.36Å; L239-I285 HydrophobicContact CD2-CD1 3.72Å; L239-I285 HydrophobicContact CG-CD1 4.19Å; M251-I285 HydrophobicContact CE-CD1 4.24Å; M251-I285 HydrophobicContact CE-CG1 4.39Å; M251-I285 HydrophobicContact CE-CG2 3.99Å; M251-I285 HydrophobicContact SD-CD1 4.08Å; M251-I285 HydrophobicContact SD-CG2 4.42Å

Retrieved 285 of 285 residues in 61.4 ms (Link to these results)