A0A5K4FCT6_SCHMA Loading...

SIR2_2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FCT6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 282 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M31.4Very low31.5Very low225 Ų225166.3 Ų166.3100%1.10878%0.779SS**  01110-80.9-75.1-165.600107.4
2D31.4Very low31.6Very low132 Ų132157.8 Ų157.871%0.70675%0.749SS**  trans73.738.6160.5-48.3-20.1000122.2
3F30.8Very low31.6Very low198 Ų198153.5 Ų153.587%0.86873%0.728SS**  trans-91.8-8.3168.8-104.1-89.1000115.4
4L30.3Very low31.6Very low167 Ų167148.4 Ų148.487%0.87471%0.707SS**THydrogen-bonded Turntrans-86.8-10-173.9-93.8151.3000114.9
5L31.4Very low31.4Very low139 Ų139145.7 Ų145.773%0.72869%0.688SS**THydrogen-bonded Turntrans-97.21.7-175.2-96.3143.9000115.1
6Y31.2Very low31.3Very low161 Ų161139.7 Ų139.763%0.63166%0.664SS**SBendtrans-102.5-6.9-175.5-121.5-90.9000115.4
7L32.4Very low31.2Very low147 Ų147134.4 Ų134.477%0.7764%0.642SS**G310 helixtrans-84-17.7-177.2-88.4153.8000114.2K9L7-K9 VanDerWaalsContact C-N 3.3Å; L7-K9 PolarHBondContact O-N 3.26Å
8E30.5Very low30.9Very low169 Ų169129.1 Ų129.179%0.7962%0.622SS**G310 helixtrans-75.5-13.1177.5-74.2-170.4147.600114.3Y10E8-Y10 VanDerWaalsContact C-N 3.29Å; E8-Y10 PolarHBondContact O-N 2.98Å
9K33.8Very low30.7Very low157 Ų157129.2 Ų129.268%0.68363%0.625SS**G310 helixtrans-78.9-0.5-176.4-91.6-177.7178.3174.40115.7L7L7-K9 VanDerWaalsContact C-N 3.3Å; L7-K9 PolarHBondContact O-N 3.26Å
10Y33.4Very low30.6Very low200 Ų200128.4 Ų128.478%0.78462%0.622SS**G310 helixtrans-114.928.9-178.3-75.4-80.3000114.1E8 P12E8-Y10 VanDerWaalsContact C-N 3.29Å; E8-Y10 PolarHBondContact O-N 2.98Å; Y10-P12 WeakPolarHBondContact O-CD 3.49Å
11Q29.9Very low30.6Very low134 Ų134129.1 Ų129.163%0.62663%0.629SS**PPolyproline II helixtrans-73.5119.1164.7-73.8-157.3-6.100110.5Q13Q11-Q13 PolarHBondContact O-N 3.09Å
12P33.4Very low30.8Very low64 Ų64127.3 Ų127.342%0.41662%0.618SS.*PPolyproline II helixtrans-69.5124.6172.18.22.9000109.2Y10 D204Y10-P12 WeakPolarHBondContact O-CD 3.49Å; P12-D204 VanDerWaalsContact CB-OD2 3.26Å; P12-D204 WeakPolarHBondContact CB-OD2 3.41Å
13Q31.6Very low30.6Very low102 Ų102126.6 Ų126.648%0.47761%0.614SS.*PPolyproline II helixtrans-77.7121.7176.1-64.91807.400109Q11 Y15Q11-Q13 PolarHBondContact O-N 3.09Å; Q13-Y15 HydrophobicContact CB-CE2 4.16Å; Q13-Y15 WeakPolarHBondContact O-CD2 3.11Å; Q13-Y15 PolarHBondContact O-N 3.37Å
14L31Very low30.6Very low83 Ų83122.2 Ų122.244%0.43560%0.603SS.*  trans-63.9115.7175.1-84.9155.8000110.7I29L14-I29 HydrophobicContact CB-CB 4.15Å; L14-I29 HydrophobicContact CB-CD1 4.16Å; L14-I29 PolarHBondContact O-N 2.98Å
15Y29.2Very low30.5Very low107 Ų107119 Ų11942%0.4259%0.586SS.*EExtended strand (participates in β ladder)trans-105.2123.9165.4-64.4-83.8000108.8Q13 K26Q13-Y15 HydrophobicContact CB-CE2 4.16Å; Q13-Y15 WeakPolarHBondContact O-CD2 3.11Å; Q13-Y15 PolarHBondContact O-N 3.37Å; Y15-K26 HydrophobicContact CD1-CB 4.22Å; Y15-K26 HydrophobicContact CD1-CD 4.49Å
16V29.5Very low30.4Very low50 Ų50119.6 Ų119.630%0.30358%0.583SS.*EExtended strand (participates in β ladder)trans-85.7120.3161.8-178.70000106.7K27 I29V16-K27 PolarHBondContact N-O 3.3Å; V16-I29 HydrophobicContact CG2-CD1 3.33Å; V16-I29 HydrophobicContact CG2-CG1 3.85Å
17T28.7Very low30.5Very low49 Ų49119.6 Ų119.630%0.30159%0.586SS.*EExtended strand (participates in β ladder)trans-10497.3168.848.40000108.5V24T17-V24 HydrophobicContact CG2-CG1 4.47Å
18S26.6Very low30.3Very low40 Ų40121.2 Ų121.228%0.2858%0.582SS.*EExtended strand (participates in β ladder)trans-80.5123162.757.40000108.1
19I26.9Very low30.5Very low131 Ų131116.9 Ų116.967%0.67256%0.563SS**EExtended strand (participates in β ladder)trans-88.6108.1168.3-59.1173.9000107
20I28.9Very low30.2Very low113 Ų113114.7 Ų114.758%0.57957%0.565SS**EExtended strand (participates in β ladder)trans-121.7117.6165.9-55.7174.6000105.3H22 N23I20-H22 PolarHBondContact O-N 2.82Å; I20-N23 PolarHBondContact O-N 3.21Å
21D30.2Very low30.2Very low143 Ų143109.2 Ų109.277%0.76556%0.556SS**THydrogen-bonded Turntrans44.365.5173.1-62.5-28.2000115.5N23D21-N23 PolarHBondContact O-N 3.28Å
22H35.6Very low30.1Very low187 Ų187108.6 Ų108.687%0.86657%0.566SS**THydrogen-bonded Turntrans56.85172.3-64.6-45.3000117.6I20I20-H22 PolarHBondContact O-N 2.82Å
23N27.5Very low30Very low118 Ų118110.2 Ų110.263%0.63158%0.575SS**EExtended strand (participates in β ladder)trans-103.7119.1174.4-79.9-28.1000111.2I20 D21 I25I20-N23 PolarHBondContact O-N 3.21Å; D21-N23 PolarHBondContact O-N 3.28Å; N23-I25 PolarHBondContact O-N 2.74Å
24V31.3Very low29.9Very low105 Ų105110.4 Ų110.464%0.63659%0.586SS**EExtended strand (participates in β ladder)trans-80.4100.2175.8-179.80000109.1T17 K26T17-V24 HydrophobicContact CG2-CG1 4.47Å; V24-K26 HydrophobicContact CG1-CG 4.3Å
25I28.2Very low29.7Very low100 Ų100114.1 Ų114.151%0.51361%0.605SS.*EExtended strand (participates in β ladder)trans-90.6116.7170.1-59175000108.2N23N23-I25 PolarHBondContact O-N 2.74Å
26K29.4Very low29.6Very low152 Ų152116.3 Ų116.366%0.66162%0.622SS**EExtended strand (participates in β ladder)trans-92.1111.1172.8-66.2-178.6-176.8178.70108.9Y15 V24Y15-K26 HydrophobicContact CD1-CB 4.22Å; Y15-K26 HydrophobicContact CD1-CD 4.49Å; V24-K26 HydrophobicContact CG1-CG 4.3Å
27K33Very low29.5Very low161 Ų161121.8 Ų121.870%0.765%0.645SS**EExtended strand (participates in β ladder)trans-104.7127.2169.4-123.1178.6-179.4178.50109.9V16V16-K27 PolarHBondContact N-O 3.3Å
28R28.6Very low29.4Very low180 Ų180124.6 Ų124.668%0.67967%0.666SS**EExtended strand (participates in β ladder)trans-75121.5176.4-159.1179.7-167.2-168.70.7108.1
29I34.1Very low29.6Very low78 Ų78128.2 Ų128.240%0.469%0.687SS.*PPolyproline II helixtrans-80.6124.3164-63171.9000106.6L14 V16 S31L14-I29 HydrophobicContact CB-CB 4.15Å; L14-I29 HydrophobicContact CB-CD1 4.16Å; L14-I29 PolarHBondContact O-N 2.98Å; V16-I29 HydrophobicContact CG2-CD1 3.33Å; V16-I29 HydrophobicContact CG2-CG1 3.85Å; I29-S31 PolarHBondContact O-N 2.67Å
30P28Very low29.8Very low112 Ų112129.2 Ų129.273%0.72769%0.693SS**PPolyproline II helixtrans-64.8120.8171.824.5-28.8000109.3S32P30-S32 PolarHBondContact O-N 3.1Å
31S32.4Very low29.8Very low85 Ų85131.5 Ų131.559%0.59471%0.707SS**  trans-63.7114.9166.251.10000108.3I29 T33I29-S31 PolarHBondContact O-N 2.67Å; S31-T33 VanDerWaalsContact C-N 3.27Å; S31-T33 PolarHBondContact O-N 3.25Å
32S29.3Very low30.1Very low120 Ų120132.4 Ų132.484%0.83971%0.711SS**  trans-7482.1172.457.10000109.7P30P30-S32 PolarHBondContact O-N 3.1Å
33T30.3Very low29.9Very low98 Ų98130.6 Ų130.660%0.60171%0.708SS**  trans-87.5119.8154.615.60000107.3S31 L35S31-T33 VanDerWaalsContact C-N 3.27Å; S31-T33 PolarHBondContact O-N 3.25Å; T33-L35 PolarHBondContact O-N 3.04Å
34P29.2Very low30.3Very low107 Ų107132.7 Ų132.770%0.69572%0.719SS**  trans-65124.2164.928-29.3000107.4I36P34-I36 PolarHBondContact O-N 2.97Å
35L26.4Very low30.3Very low161 Ų161132.2 Ų132.284%0.84372%0.721SS**  trans-58.6107.9165.7-10094.6000107.6T33 Q37T33-L35 PolarHBondContact O-N 3.04Å; L35-Q37 PolarHBondContact O-N 3.11Å
36I28.1Very low30.6Very low152 Ų152134.2 Ų134.278%0.77973%0.732SS**  trans-86.299.2161.1-60.9177.4000105.8P34 S38P34-I36 PolarHBondContact O-N 2.97Å; I36-S38 PolarHBondContact O-N 3.4Å
37Q28Very low30.8Very low166 Ų166133.4 Ų133.478%0.77674%0.735SS**  trans-66.6106.9165.6-82.2177.6-24.200108.5L35L35-Q37 PolarHBondContact O-N 3.11Å
38S26.4Very low30.9Very low107 Ų107132.2 Ų132.275%0.74874%0.737SS**  trans-86.6102.7162.958.20000108.7I36I36-S38 PolarHBondContact O-N 3.4Å
39T30.1Very low31.2Very low116 Ų116129.9 Ų129.971%0.71274%0.738SS**  trans-143.4107.2161.640.50000111.7
40N31.3Very low31.2Very low153 Ų153132.5 Ų132.582%0.81875%0.753SS**  trans59.5104.8142-64.8-7.5000119.3N42N40-N42 PolarHBondContact O-N 3.11Å
41N28.9Very low31.6Very low160 Ų160133.2 Ų133.286%0.85675%0.75SS**  trans-39.1120.8143.8-81.8-16.9000110.8
42N35.2Very low31.7Very low162 Ų162135.1 Ų135.187%0.86675%0.754SS**  trans-143.3123.6142.7-102.8-15.7000108.9N40N40-N42 PolarHBondContact O-N 3.11Å
43N32.4Very low32.1Very low149 Ų149136.9 Ų136.980%0.79775%0.754SS**  trans-46.7134.9171.5-69.2-32.7000111.4
44N34.7Very low32.2Very low162 Ų162140.4 Ų140.487%0.86677%0.769SS**  -166132.5122-101.5-18.3000112.9
45S32.4Very low32.5Very low95 Ų95139.1 Ų139.166%0.66478%0.776SS**  trans-50.8138.7168.7175.50000112.9
46N33.4Very low32.8Very low142 Ų142138.6 Ų138.676%0.75977%0.773SS**  -179.7121.8115.1-91.3-12.6000113.1
47N33.7Very low33Very low135 Ų135137.6 Ų137.672%0.72277%0.77SS**  trans19.7122.7133.3-79.9-9.7000118.4
48N35.5Very low33.2Very low136 Ų136138.4 Ų138.473%0.72777%0.773SS**  169.7125.894.5-102.8-21.4000113
49N35.4Very low33.2Very low131 Ų131144.1 Ų144.170%0.70178%0.78SS**  59.9136.2128.5-87.6-7.9000123.9
50N35.1Very low33.2Very low133 Ų133144.4 Ų144.471%0.71179%0.787SS**  trans82148.8146.1-64.1-13.1000118.1
51N35Very low32.9Very low128 Ų128143 Ų14368%0.68478%0.784SS**  cis-179145.1-30.8-132-8.9000103.2
52N35.6Very low32.7Very low124 Ų124145.8 Ų145.866%0.66378%0.782SS**  trans59.1117.6146.6-68.7-8.3000120.8
53N37.8Very low32.4Very low157 Ų157143.9 Ų143.984%0.8478%0.782SS**  166146.385.3-98.9-22.6000114.3
54N31.9Very low32.1Very low172 Ų172143.3 Ų143.392%0.9278%0.779SS**  trans-61152.3173.9-83.4-29.5000115.2
55G35.3Very low31.8Very low81 Ų81143.4 Ų143.484%0.83578%0.778SS**  trans-158.1110.6163.400000112
56N33.2Very low31.6Very low149 Ų149146.6 Ų146.680%0.79778%0.782SS**  trans-87.3165.9-172.4-116.2-10.5000113.6
57N31.6Very low31.2Very low131 Ų131146.1 Ų146.170%0.70178%0.779SS**  trans80.5140.7156-59.4-20000116.6
58Q33Very low30.9Very low183 Ų183147.7 Ų147.786%0.85579%0.787SS**  cis-168.3140.536.9-135.6159.219.400110.5
59Y26Very low30.3Very low228 Ų228146.2 Ų146.289%0.89479%0.787SS**  trans-77.7145.1171.4-87.3-93.2000112.1
60S30.1Very low30Very low121 Ų121150.1 Ų150.185%0.84679%0.794SS**  trans-129109.2155.963.20000110.4
61T24.4Very low29.5Very low124 Ų124151 Ų15176%0.76180%0.799SS**  trans-80.5148.4171.543.90000112.2
62R25.4Very low29Very low218 Ų218151.7 Ų151.782%0.82380%0.802SS**  137.3112.2113.7-158.1178.4-158.2-176.44.1113.9
63S29.4Very low28.5Very low122 Ų122153 Ų15385%0.85381%0.809SS**  trans-164.3114.4133.157.10000110.7
64N24.8Very low28Very low138 Ų138155.3 Ų155.374%0.73881%0.812SS**  trans-69143.1179.7-60.6-26.8000112.5
65I29.2Very low27.9Very low164 Ų164155.4 Ų155.484%0.84181%0.81SS**  trans-150112.4135.8-61.8-169.1000109.4
66H28.4Very low27.4Very low161 Ų161159.9 Ų159.975%0.74581%0.81SS**  trans49.9101.2152.6-83.8-74.4000123.3
67D25.5Very low27Very low133 Ų133159.9 Ų159.971%0.71181%0.81SS**  35.5103.2119.6-66.8-33.1000120.3
68L27Very low26.8Very low168 Ų168160.6 Ų160.688%0.8881%0.813SS**  trans-140.986.5136.1-107.3144.1000107.3Y70L68-Y70 PolarHBondContact O-N 3.02Å
69S23.3Very low26.4Very low105 Ų105159.8 Ų159.873%0.73481%0.814SS**  trans-70105.716854.60000109.9
70Y27.6Very low26.4Very low213 Ų213155 Ų15584%0.83580%0.803SS**  trans-131.9103.3151.4-100.4-82.9000108.7L68L68-Y70 PolarHBondContact O-N 3.02Å
71N25.4Very low26.1Very low152 Ų152160.1 Ų160.181%0.81380%0.803SS**  trans22.2110.5155.7-85.7-16.9000119.1
72N24.4Very low26.2Very low141 Ų141157.9 Ų157.975%0.75479%0.79SS**SBendtrans-27.9144.5137.2-65.5-33.4000114
73N26Very low26.3Very low152 Ų152155.2 Ų155.281%0.81379%0.791SS**  trans108.915.3156-55.8-19000120.9
74F27.3Very low26.1Very low205 Ų205157.3 Ų157.390%0.89979%0.793SS**  trans-118.9106.6168.8-84.7-91.9000111.6
75I28.4Very low26.1Very low174 Ų174154 Ų15489%0.89278%0.78SS**SBendtrans134.346.8168.3-60.5152.9000109.8
76Q25.1Very low26.1Very low175 Ų175154.5 Ų154.582%0.81878%0.779SS**SBendtrans-128.9136.5145.7-85.9-174.9-16.400105.2
77N25.5Very low26.4Very low150 Ų150153 Ų15380%0.80277%0.771SS**  trans82.587.2-179.8-51.8-25.1000116.4
78N26.3Very low26.7Very low145 Ų145152.6 Ų152.678%0.77577%0.767SS**  -166.876.5119.4-90.7-18000109L80N78-L80 PolarHBondContact O-N 3.39Å; N78-L80 VanDerWaalsContact O-N 3.09Å
79I25.7Very low27.7Very low167 Ų167146.4 Ų146.486%0.85674%0.735SS**  trans-70.783.3146.5-63.1170.1000104.4
80L26.2Very low28.9Very low127 Ų127145.4 Ų145.467%0.66573%0.728SS**  trans-97.799.1162.3-146.584.3000106.4N78 T82N78-L80 PolarHBondContact O-N 3.39Å; N78-L80 VanDerWaalsContact O-N 3.09Å; L80-T82 VanDerWaalsContact C-N 3.32Å; L80-T82 HydrophobicContact CD2-CG2 3.81Å; L80-T82 HydrophobicContact CG-CG2 4.35Å; L80-T82 PolarHBondContact O-N 3.27Å
81R23.9Very low30.5Very low228 Ų228143.4 Ų143.486%0.8672%0.72SS**  trans-5399.6155.9-82.1173.8157.9179.4-6.3107.7
82T26.1Very low33.1Very low77 Ų77141.8 Ų141.847%0.47271%0.711SS.*  trans-124.587.2158.842.60000108.2L80 N84 S85L80-T82 VanDerWaalsContact C-N 3.32Å; L80-T82 HydrophobicContact CD2-CG2 3.81Å; L80-T82 HydrophobicContact CG-CG2 4.35Å; L80-T82 PolarHBondContact O-N 3.27Å; T82-N84 PolarHBondContact O-N 3.41Å; T82-S85 WeakPolarHBondContact CB-OG 3.47Å; T82-S85 PolarHBondContact OG1-OG 3.49Å
83L26.3Very low36Very low163 Ų163137 Ų13785%0.85368%0.682SS**THydrogen-bonded Turntrans-47126148.7-74.8134.1000107.1
84N25.3Very low39Very low166 Ų166130.6 Ų130.689%0.88865%0.65SS**THydrogen-bonded Turntrans71.548.5178.5-64.1-12.3000118.9T82T82-N84 PolarHBondContact O-N 3.41Å
85S25.3Very low41.7Very low68 Ų68126.5 Ų126.548%0.47664%0.637SS.*  trans-132.6123.9162.261.20000110.9T82 F87T82-S85 WeakPolarHBondContact CB-OG 3.47Å; T82-S85 PolarHBondContact OG1-OG 3.49Å; S85-F87 PolarHBondContact O-N 3.26Å
86Q29.1Very low44.6Very low175 Ų175119.8 Ų119.882%0.81860%0.601SS**  trans-21.1123.6162.7-74.7160-32.100111.1I88Q86-I88 HydrophobicContact CB-CG1 4.48Å; Q86-I88 PolarHBondContact O-N 2.91Å
87F34.1Very low47.7Very low130 Ų130111.4 Ų111.457%0.5756%0.563SS**  trans-59.687.8167.1-93.8-90000107.8S85 L89 L277S85-F87 PolarHBondContact O-N 3.26Å; F87-L89 VanDerWaalsContact C-N 3.29Å; F87-L89 PolarHBondContact O-N 3.41Å; F87-L277 WeakPolarHBondContact CZ-O 2.9Å
88I33.3Very low50.7Low124 Ų124109 Ų10964%0.63655%0.545SS*.  trans-69.898.3171.5-58.2176.2000104.5Q86 S90Q86-I88 HydrophobicContact CB-CG1 4.48Å; Q86-I88 PolarHBondContact O-N 2.91Å; I88-S90 PolarHBondContact O-N 2.67Å; I88-S90 PolarHBondContact O-OG 2.95Å
89L47.5Very low53.7Low38 Ų38108.7 Ų108.720%0.19954%0.542CS..  trans-65.857.6166.7-74.7157.6000109.9F87 Y91 H112 I147 I232 L277F87-L89 VanDerWaalsContact C-N 3.29Å; F87-L89 PolarHBondContact O-N 3.41Å; L89-Y91 VanDerWaalsContact C-N 3.25Å; L89-Y91 PolarHBondContact O-N 3.47Å; L89-H112 HydrophobicContact CD1-CB 3.79Å; L89-H112 WeakPolarHBondContact CD1-CD2 3.13Å; L89-I147 HydrophobicContact CB-CG2 4.18Å; L89-I147 HydrophobicContact CD1-CD1 4.42Å; L89-I147 HydrophobicContact CD2-CD1 3.95Å; L89-I232 HydrophobicContact CD1-CD1 4.38Å; L89-L277 HydrophobicContact CD2-CD2 4.35Å
90S47.7Very low56.7Low84 Ų84103.4 Ų103.459%0.58752%0.515SS*.  trans-82.90.5179.446.50000113I88I88-S90 PolarHBondContact O-N 2.67Å; I88-S90 PolarHBondContact O-OG 2.95Å
91Y60.9Low59.9Low171 Ų17197.4 Ų97.467%0.67148%0.484SS*.SBendtrans-100124.2-178.1-67.6-77.3000110.8L89 W93L89-Y91 VanDerWaalsContact C-N 3.25Å; L89-Y91 PolarHBondContact O-N 3.47Å; Y91-W93 PolarHBondContact O-N 2.87Å; Y91-W93 PolarHBondContact O-NE1 3.13Å
92D79.9Confident62.9Low117 Ų11789.1 Ų89.163%0.62646%0.456SS*.  trans-69110.3166.4-179.710.1000109.8S94D92-S94 VanDerWaalsContact CG-OG 3.28Å; D92-S94 PolarHBondContact O-N 3.29Å; D92-S94 WeakPolarHBondContact OD1-CB 3.47Å; D92-S94 PolarHBondContact OD1-N 3.2Å; D92-S94 PolarHBondContact OD1-OG 3.12Å; D92-S94 PolarHBondContact OD2-OG 3.45Å
93W86.9Confident65.9Low40 Ų4089.5 Ų89.515%0.15246%0.455CS..  trans-802.4179.6-6885.8000113.3Y91 N95 F96 L97 L110 I147 L273 K276Y91-W93 PolarHBondContact O-N 2.87Å; Y91-W93 PolarHBondContact O-NE1 3.13Å; W93-N95 VanDerWaalsContact C-N 3.33Å; W93-N95 PolarHBondContact O-N 3.41Å; W93-F96 HydrophobicContact CE3-CB 3.98Å; W93-F96 AromaticContact CE3-CD1 3.63Å; W93-F96 HydrophobicContact CE3-CD1 3.63Å; W93-F96 HydrophobicContact CE3-CD2 4.44Å; W93-F96 HydrophobicContact CE3-CE1 4.2Å; W93-F96 AromaticContact CE3-CG 3.76Å; W93-F96 HydrophobicContact CE3-CG 3.76Å; W93-F96 HydrophobicContact CZ3-CD1 4.21Å; W93-F96 HydrophobicContact CZ3-CD2 4.42Å; W93-F96 HydrophobicContact CZ3-CE1 4.45Å; W93-F96 HydrophobicContact CZ3-CG 4.18Å; W93-F96 WeakPolarHBondContact O-CB 3.14Å; W93-F96 PolarHBondContact O-N 2.87Å; W93-L97 WeakPolarHBondContact O-CG 3.23Å; W93-L97 PolarHBondContact O-N 3.29Å; W93-L110 HydrophobicContact CB-CD2 3.75Å; W93-L110 HydrophobicContact CG-CD2 3.85Å; W93-I147 VanDerWaalsContact CD1-O 3.32Å; W93-I147 PolarHBondContact N-O 3.12Å; W93-L273 HydrophobicContact CD2-CD2 4.04Å; W93-L273 HydrophobicContact CE3-CD2 3.58Å; W93-L273 HydrophobicContact CH2-CD2 4.13Å; W93-L273 HydrophobicContact CZ3-CD2 3.63Å; W93-K276 HydrophobicContact CH2-CB 4.09Å; W93-K276 HydrophobicContact CH2-CD 3.85Å; W93-K276 HydrophobicContact CZ3-CD 3.62Å
94S87.8Confident69Low18 Ų1885.8 Ų85.813%0.12643%0.431CS..Hα-helixtrans-51.9-45.6-176.5-64.30000113.5D92 L97 K98 Q149D92-S94 VanDerWaalsContact CG-OG 3.28Å; D92-S94 PolarHBondContact O-N 3.29Å; D92-S94 WeakPolarHBondContact OD1-CB 3.47Å; D92-S94 PolarHBondContact OD1-N 3.2Å; D92-S94 PolarHBondContact OD1-OG 3.12Å; D92-S94 PolarHBondContact OD2-OG 3.45Å; S94-L97 PolarHBondContact O-N 2.94Å; S94-K98 WeakPolarHBondContact O-CB 3.38Å; S94-K98 PolarHBondContact O-N 3.06Å; S94-Q149 WeakPolarHBondContact CA-O 3.29Å; S94-Q149 WeakPolarHBondContact CB-O 3.3Å; S94-Q149 PolarHBondContact OG-N 2.77Å; S94-Q149 PolarHBondContact OG-O 2.87Å
95N84.6Confident72.1Confident119 Ų11977.9 Ų77.964%0.63639%0.388SS*.Hα-helixtrans-66.8-39.5178.2-79.8-23.3000112.6W93 K98 I99W93-N95 VanDerWaalsContact C-N 3.33Å; W93-N95 PolarHBondContact O-N 3.41Å; N95-K98 PolarHBondContact O-N 3.01Å; N95-I99 WeakPolarHBondContact O-CG1 3.05Å; N95-I99 PolarHBondContact O-N 2.89Å
96F88.4Confident75.1Confident33 Ų3376.4 Ų76.415%0.14538%0.375CS..Hα-helixtrans-62.5-44.4174.9167.8-93.2000111W93 N100 V269 L272 L273 K276W93-F96 HydrophobicContact CE3-CB 3.98Å; W93-F96 AromaticContact CE3-CD1 3.63Å; W93-F96 HydrophobicContact CE3-CD1 3.63Å; W93-F96 HydrophobicContact CE3-CD2 4.44Å; W93-F96 HydrophobicContact CE3-CE1 4.2Å; W93-F96 AromaticContact CE3-CG 3.76Å; W93-F96 HydrophobicContact CE3-CG 3.76Å; W93-F96 HydrophobicContact CZ3-CD1 4.21Å; W93-F96 HydrophobicContact CZ3-CD2 4.42Å; W93-F96 HydrophobicContact CZ3-CE1 4.45Å; W93-F96 HydrophobicContact CZ3-CG 4.18Å; W93-F96 WeakPolarHBondContact O-CB 3.14Å; W93-F96 PolarHBondContact O-N 2.87Å; F96-N100 PolarHBondContact O-N 3.39Å; F96-N100 PolarHBondContact O-ND2 2.5Å; F96-V269 HydrophobicContact CE1-CG1 3.75Å; F96-V269 HydrophobicContact CZ-CG1 4.34Å; F96-L272 HydrophobicContact CE2-CB 4.25Å; F96-L272 HydrophobicContact CE2-CD1 4.47Å; F96-L272 HydrophobicContact CZ-CB 3.77Å; F96-L272 HydrophobicContact CZ-CD1 4.4Å; F96-L273 HydrophobicContact CD1-CD2 4.16Å; F96-L273 HydrophobicContact CE1-CD1 4.42Å; F96-L273 HydrophobicContact CE1-CD2 3.58Å; F96-L273 HydrophobicContact CE1-CG 3.7Å; F96-L273 HydrophobicContact CZ-CD2 4.19Å; F96-L273 HydrophobicContact CZ-CG 4.18Å; F96-K276 HydrophobicContact CE2-CD 4.2Å
97L90.5Very high78Confident0 Ų071 Ų710%035%0.349CS..Hα-helixtrans-62.2-46.5175.7-64.9171.8000111.2W93 S94 I99 N100 L101 V108 L110 L249 V269W93-L97 WeakPolarHBondContact O-CG 3.23Å; W93-L97 PolarHBondContact O-N 3.29Å; S94-L97 PolarHBondContact O-N 2.94Å; L97-I99 PolarHBondContact O-N 3.36Å; L97-N100 PolarHBondContact O-N 2.85Å; L97-L101 HydrophobicContact CD2-CD1 4.28Å; L97-L101 VanDerWaalsContact O-CB 3.28Å; L97-L101 WeakPolarHBondContact O-CB 3.46Å; L97-L101 PolarHBondContact O-N 3.33Å; L97-V108 HydrophobicContact CB-CG1 3.93Å; L97-V108 HydrophobicContact CD1-CG1 4.11Å; L97-V108 HydrophobicContact CD1-CG2 4.5Å; L97-V108 HydrophobicContact CD2-CG2 4.36Å; L97-V108 HydrophobicContact CG-CG1 4.46Å; L97-L110 HydrophobicContact CD1-CB 3.89Å; L97-L249 HydrophobicContact CD2-CD1 4.07Å; L97-V269 HydrophobicContact CD2-CG1 3.99Å
98K89Confident80.8Confident100 Ų10064.8 Ų64.844%0.43532%0.322SS..Hα-helixtrans-54.1-55.3178177.3172.2179.5-176.70111.4S94 N95 N100 L101 L102 Y150S94-K98 WeakPolarHBondContact O-CB 3.38Å; S94-K98 PolarHBondContact O-N 3.06Å; N95-K98 PolarHBondContact O-N 3.01Å; K98-N100 PolarHBondContact O-N 3.31Å; K98-L101 PolarHBondContact O-N 2.83Å; K98-L102 VanDerWaalsContact O-CB 3.24Å; K98-L102 WeakPolarHBondContact O-CB 3.31Å; K98-L102 PolarHBondContact O-N 2.8Å; K98-Y150 HydrophobicContact CB-CD2 3.47Å; K98-Y150 VanDerWaalsContact CB-CD2 3.47Å; K98-Y150 HydrophobicContact CB-CE2 3.95Å; K98-Y150 HydrophobicContact CB-CG 3.94Å; K98-Y150 HydrophobicContact CD-CD2 4.04Å; K98-Y150 HydrophobicContact CD-CE2 4.04Å; K98-Y150 HydrophobicContact CG-CD2 3.6Å; K98-Y150 HydrophobicContact CG-CE2 3.56Å; K98-Y150 HydrophobicContact CG-CG 4.47Å
99I88.6Confident83.6Confident137 Ų13759 Ų5970%0.70329%0.292SS*.Hα-helixtrans-57.1-40.4-176.3-69.8166000111.4N95 L97N95-I99 WeakPolarHBondContact O-CG1 3.05Å; N95-I99 PolarHBondContact O-N 2.89Å; L97-I99 PolarHBondContact O-N 3.36Å
100N89.9Confident85.7Confident57 Ų5757.2 Ų57.231%0.30528%0.283SS..Hα-helixtrans-89.5-18-173.4-67-80.6000114.3F96 L97 K98 V269F96-N100 PolarHBondContact O-N 3.39Å; F96-N100 PolarHBondContact O-ND2 2.5Å; L97-N100 PolarHBondContact O-N 2.85Å; K98-N100 PolarHBondContact O-N 3.31Å; N100-V269 HydrophobicContact CB-CG2 3.36Å
101L92.3Very high87.8Confident0 Ų053.2 Ų53.20%026%0.255CS..Hα-helixtrans-121.7-7.5-171.6-60.8175.9000115.3L97 K98 N103 Y104 I105 V108 A265 I266 V269L97-L101 HydrophobicContact CD2-CD1 4.28Å; L97-L101 VanDerWaalsContact O-CB 3.28Å; L97-L101 WeakPolarHBondContact O-CB 3.46Å; L97-L101 PolarHBondContact O-N 3.33Å; K98-L101 PolarHBondContact O-N 2.83Å; L101-N103 PolarHBondContact O-N 3.34Å; L101-Y104 PolarHBondContact O-N 3.05Å; L101-I105 HydrophobicContact CB-CB 4.01Å; L101-I105 HydrophobicContact CB-CG1 3.97Å; L101-I105 HydrophobicContact CD1-CG1 4.37Å; L101-I105 HydrophobicContact CD2-CG1 3.98Å; L101-I105 HydrophobicContact CG-CG1 4.33Å; L101-I105 PolarHBondContact O-N 3.02Å; L101-V108 HydrophobicContact CD1-CB 4.09Å; L101-V108 HydrophobicContact CD1-CG1 4.03Å; L101-V108 HydrophobicContact CD1-CG2 3.76Å; L101-A265 HydrophobicContact CD2-CB 3.97Å; L101-I266 HydrophobicContact CD2-CG1 4.45Å; L101-V269 HydrophobicContact CD1-CG2 4.28Å; L101-V269 HydrophobicContact CD2-CB 4.37Å; L101-V269 HydrophobicContact CD2-CG2 3.56Å; L101-V269 HydrophobicContact CG-CG2 3.78Å
102L87.5Confident89.1Confident54 Ų5446.1 Ų46.128%0.28323%0.227SC..THydrogen-bonded Turntrans-43.5-40.8-176.2178.464.9000114.5K98 Y150 F154K98-L102 VanDerWaalsContact O-CB 3.24Å; K98-L102 WeakPolarHBondContact O-CB 3.31Å; K98-L102 PolarHBondContact O-N 2.8Å; L102-Y150 HydrophobicContact CD1-CE2 4.26Å; L102-Y150 WeakPolarHBondContact CD1-OH 3.47Å; L102-F154 HydrophobicContact CD1-CE2 3.77Å; L102-F154 HydrophobicContact CG-CE2 4.43Å
103N88.5Confident89.3Confident85 Ų8540.5 Ų40.546%0.45520%0.198SC..THydrogen-bonded Turntrans-88.6-6.6-172.9-69.6-29.3000115L101 R257L101-N103 PolarHBondContact O-N 3.34Å; N103-R257 PolarHBondContact O-NE 2.89Å
104Y92Very high89.1Confident85 Ų8538.8 Ų38.833%0.33319%0.192SC..THydrogen-bonded Turntrans-127.6-27.9-168.6-61.7-74.7000113.5L101 R254 K261 C262 A265L101-Y104 PolarHBondContact O-N 3.05Å; Y104-R254 VanDerWaalsContact O-CB 3.28Å; Y104-R254 WeakPolarHBondContact O-CB 3.5Å; Y104-R254 WeakPolarHBondContact O-CG 3.44Å; Y104-R254 PolarHBondContact O-N 2.87Å; Y104-K261 HydrophobicContact CD1-CB 4.12Å; Y104-K261 HydrophobicContact CE1-CB 3.96Å; Y104-C262 PolarHBondContact O-SG 3.38Å; Y104-A265 HydrophobicContact CD1-CB 4.45Å; Y104-A265 HydrophobicContact CD2-CB 3.6Å; Y104-A265 HydrophobicContact CE2-CB 4.24Å; Y104-A265 HydrophobicContact CG-CB 3.72Å
105I90.3Very high88.6Confident0 Ų038 Ų380%019%0.186CC..EExtended strand (participates in β ladder)trans-123.8130.9-169-59.1-57.8000110.1L101 K107 V108 F252 C262 I266L101-I105 HydrophobicContact CB-CB 4.01Å; L101-I105 HydrophobicContact CB-CG1 3.97Å; L101-I105 HydrophobicContact CD1-CG1 4.37Å; L101-I105 HydrophobicContact CD2-CG1 3.98Å; L101-I105 HydrophobicContact CG-CG1 4.33Å; L101-I105 PolarHBondContact O-N 3.02Å; I105-K107 WeakPolarHBondContact CG2-O 3.37Å; I105-V108 HydrophobicContact CG2-CB 3.89Å; I105-F252 WeakPolarHBondContact CA-O 3.39Å; I105-F252 VanDerWaalsContact CG2-O 3.31Å; I105-F252 WeakPolarHBondContact CG2-O 3.32Å; I105-C262 HydrophobicContact CD1-CB 4.2Å; I105-I266 HydrophobicContact CD1-CD1 3.6Å; I105-I266 HydrophobicContact CD1-CG1 3.8Å; I105-I266 HydrophobicContact CG1-CD1 4.43Å; I105-I266 HydrophobicContact CG1-CG1 4.17Å
106D87.8Confident88.2Confident38 Ų3835.9 Ų35.920%0.20317%0.174CC..EExtended strand (participates in β ladder)trans-77.7-41.9176.7-83-32.6000111.2Y151 S152 F252 R254D106-Y151 CarbonylContact O-C 3.58Å; D106-Y151 WeakPolarHBondContact O-CA 3.49Å; D106-S152 PolarHBondContact O-N 2.83Å; D106-F252 PolarHBondContact N-O 3.25Å; D106-R254 VanDerWaalsContact OD1-CG 3.28Å; D106-R254 WeakPolarHBondContact OD1-CG 3.39Å; D106-R254 WeakPolarHBondContact OD2-CA 3.4Å
107K90.4Very high87.1Confident60 Ų6035.2 Ų35.226%0.26117%0.173SC..EExtended strand (participates in β ladder)trans-143.7133.9-178.1-45.5-169.8176.9179.60109.5I105 F109 Y150 Y151 Y156 F252I105-K107 WeakPolarHBondContact CG2-O 3.37Å; K107-F109 HydrophobicContact CB-CE2 4.24Å; K107-Y150 CarbonylContact C-O 3.56Å; K107-Y150 WeakPolarHBondContact CA-O 3.13Å; K107-Y151 HydrophobicContact CB-CD1 3.8Å; K107-Y151 HydrophobicContact CB-CE1 3.95Å; K107-Y151 HydrophobicContact CD-CD1 3.88Å; K107-Y151 HydrophobicContact CD-CE1 4.08Å; K107-Y151 HydrophobicContact CG-CD1 3.71Å; K107-Y151 HydrophobicContact CG-CE1 4.18Å; K107-Y156 WeakPolarHBondContact CE-OH 3.24Å; K107-Y156 PolarHBondContact NZ-OH 2.86Å; K107-F252 HydrophobicContact CB-CB 4.19Å; K107-F252 HydrophobicContact CB-CD2 4.01Å; K107-F252 HydrophobicContact CB-CG 4.4Å; K107-F252 PolarHBondContact O-N 2.87Å
108V92Very high85.8Confident0 Ų039.8 Ų39.80%019%0.193CC..EExtended strand (participates in β ladder)trans-136.2143.717562.80000110.8L97 L101 I105 Q149 Y150 L249 I250L97-V108 HydrophobicContact CB-CG1 3.93Å; L97-V108 HydrophobicContact CD1-CG1 4.11Å; L97-V108 HydrophobicContact CD1-CG2 4.5Å; L97-V108 HydrophobicContact CD2-CG2 4.36Å; L97-V108 HydrophobicContact CG-CG1 4.46Å; L101-V108 HydrophobicContact CD1-CB 4.09Å; L101-V108 HydrophobicContact CD1-CG1 4.03Å; L101-V108 HydrophobicContact CD1-CG2 3.76Å; I105-V108 HydrophobicContact CG2-CB 3.89Å; V108-Q149 CarbonylContact O-C 3.53Å; V108-Q149 VanDerWaalsContact O-CA 3.28Å; V108-Q149 WeakPolarHBondContact O-CA 3.02Å; V108-Y150 HydrophobicContact CG1-CD1 3.82Å; V108-Y150 HydrophobicContact CG1-CG 4.2Å; V108-Y150 PolarHBondContact N-O 2.85Å; V108-Y150 PolarHBondContact O-N 2.83Å; V108-L249 HydrophobicContact CG2-CD1 4.36Å; V108-L249 HydrophobicContact CG2-CD2 3.74Å; V108-L249 HydrophobicContact CG2-CG 3.87Å; V108-I250 CarbonylContact C-O 3.56Å; V108-I250 VanDerWaalsContact CA-O 3.28Å; V108-I250 WeakPolarHBondContact CA-O 3.27Å
109F92.3Very high84.3Confident2 Ų240.2 Ų40.21%0.00920%0.195CC..EExtended strand (participates in β ladder)trans-130.9135.6177.6-58-92.7000109.4K107 F111 I146 Q149 Y151 I167 P168 L249 I250 F252K107-F109 HydrophobicContact CB-CE2 4.24Å; F109-F111 HydrophobicContact CB-CD2 4.16Å; F109-F111 HydrophobicContact CB-CE2 3.33Å; F109-F111 HydrophobicContact CB-CZ 3.6Å; F109-F111 HydrophobicContact CD1-CZ 4.16Å; F109-F111 HydrophobicContact CG-CE2 4.2Å; F109-F111 HydrophobicContact CG-CZ 4.11Å; F109-I146 HydrophobicContact CD1-CD1 4.04Å; F109-Q149 HydrophobicContact CD1-CB 4.45Å; F109-Y151 HydrophobicContact CE1-CE1 4.2Å; F109-Y151 AromaticContact CE1-CZ 3.83Å; F109-Y151 WeakPolarHBondContact CE1-OH 3.3Å; F109-Y151 HydrophobicContact CE2-CE1 4.33Å; F109-Y151 AromaticContact CZ-CE1 3.7Å; F109-Y151 HydrophobicContact CZ-CE1 3.7Å; F109-Y151 AromaticContact CZ-CZ 3.82Å; F109-Y151 WeakPolarHBondContact CZ-OH 3.47Å; F109-I167 HydrophobicContact CD1-CG2 4.14Å; F109-I167 HydrophobicContact CE1-CB 4.04Å; F109-I167 HydrophobicContact CE1-CG1 4.02Å; F109-I167 HydrophobicContact CE1-CG2 3.95Å; F109-P168 HydrophobicContact CD1-CG 4.49Å; F109-P168 HydrophobicContact CD2-CG 3.89Å; F109-P168 VanDerWaalsContact CE1-CD 3.42Å; F109-P168 HydrophobicContact CE2-CG 4.05Å; F109-P168 HydrophobicContact CG-CG 4.12Å; F109-P168 VanDerWaalsContact CZ-CD 3.41Å; F109-P168 HydrophobicContact CZ-CG 4.38Å; F109-L249 CarbonylContact O-C 3.6Å; F109-L249 WeakPolarHBondContact O-CA 3.41Å; F109-I250 PolarHBondContact N-O 2.93Å; F109-I250 PolarHBondContact O-N 2.97Å; F109-F252 HydrophobicContact CD2-CD2 4.45Å; F109-F252 HydrophobicContact CD2-CE2 4.1Å; F109-F252 HydrophobicContact CE2-CD2 4.2Å; F109-F252 AromaticContact CE2-CE2 3.83Å; F109-F252 HydrophobicContact CE2-CE2 3.83Å
110L92.5Very high82.6Confident1 Ų137.9 Ų37.91%0.00518%0.18CC..EExtended strand (participates in β ladder)trans-118.7120.8174.1-166.270.1000108.6W93 L97 I147 G148 V247 M248 L249 L273W93-L110 HydrophobicContact CB-CD2 3.75Å; W93-L110 HydrophobicContact CG-CD2 3.85Å; L97-L110 HydrophobicContact CD1-CB 3.89Å; L110-I147 HydrophobicContact CB-CG1 4.12Å; L110-I147 HydrophobicContact CD2-CD1 3.82Å; L110-I147 HydrophobicContact CD2-CG1 3.93Å; L110-I147 HydrophobicContact CG-CD1 3.89Å; L110-I147 HydrophobicContact CG-CG1 3.78Å; L110-I147 VanDerWaalsContact O-CG1 3.31Å; L110-I147 WeakPolarHBondContact O-CG1 3.35Å; L110-I147 PolarHBondContact O-N 3.01Å; L110-G148 PolarHBondContact N-O 3.22Å; L110-G148 PolarHBondContact O-N 3.48Å; L110-V247 HydrophobicContact CD1-CG1 3.3Å; L110-V247 HydrophobicContact CD2-CG1 4.24Å; L110-V247 HydrophobicContact CG-CG1 3.67Å; L110-M248 WeakPolarHBondContact CA-O 2.85Å; L110-L249 HydrophobicContact CD1-CB 3.73Å; L110-L249 HydrophobicContact CD1-CD1 4.22Å; L110-L249 HydrophobicContact CD1-CG 4.15Å; L110-L273 HydrophobicContact CD1-CD1 3.79Å; L110-L273 HydrophobicContact CD2-CD1 4.14Å; L110-L273 HydrophobicContact CD2-CD2 4.31Å
111F90.9Very high80.3Confident0 Ų043 Ų430%021%0.206CC..EExtended strand (participates in β ladder)trans-116.3140.6-177.5-59.9-79.7000111.1F109 I113 F144 N145 I146 I167 P168 V247 M248 I250F109-F111 HydrophobicContact CB-CD2 4.16Å; F109-F111 HydrophobicContact CB-CE2 3.33Å; F109-F111 HydrophobicContact CB-CZ 3.6Å; F109-F111 HydrophobicContact CD1-CZ 4.16Å; F109-F111 HydrophobicContact CG-CE2 4.2Å; F109-F111 HydrophobicContact CG-CZ 4.11Å; F111-I113 HydrophobicContact CB-CD1 3.88Å; F111-I113 HydrophobicContact CB-CG1 3.73Å; F111-F144 HydrophobicContact CB-CE2 4.25Å; F111-F144 HydrophobicContact CD1-CD2 4.37Å; F111-F144 HydrophobicContact CD1-CE1 4.11Å; F111-F144 AromaticContact CD1-CE2 3.54Å; F111-F144 HydrophobicContact CD1-CE2 3.54Å; F111-F144 AromaticContact CD1-CZ 3.39Å; F111-F144 HydrophobicContact CD1-CZ 3.39Å; F111-F144 HydrophobicContact CD2-CE2 4.47Å; F111-F144 AromaticContact CE1-CE1 3.93Å; F111-F144 HydrophobicContact CE1-CE1 3.93Å; F111-F144 AromaticContact CE1-CE2 3.94Å; F111-F144 HydrophobicContact CE1-CE2 3.94Å; F111-F144 AromaticContact CE1-CZ 3.3Å; F111-F144 HydrophobicContact CE1-CZ 3.3Å; F111-F144 AromaticContact CG-CE2 3.84Å; F111-F144 HydrophobicContact CG-CE2 3.84Å; F111-F144 HydrophobicContact CG-CZ 4.08Å; F111-F144 AromaticContact CZ-CZ 3.91Å; F111-F144 HydrophobicContact CZ-CZ 3.91Å; F111-N145 CarbonylContact C-O 3.57Å; F111-N145 VanDerWaalsContact CA-O 3.25Å; F111-N145 WeakPolarHBondContact CA-O 3.28Å; F111-I146 HydrophobicContact CD1-CB 4.23Å; F111-I146 HydrophobicContact CD1-CG1 4.41Å; F111-I146 HydrophobicContact CE1-CB 4.18Å; F111-I146 HydrophobicContact CE1-CD1 4.32Å; F111-I146 HydrophobicContact CE1-CG1 4.18Å; F111-I167 HydrophobicContact CE1-CG2 4.34Å; F111-I167 HydrophobicContact CZ-CG2 4.32Å; F111-P168 HydrophobicContact CE2-CB 4.23Å; F111-P168 HydrophobicContact CE2-CG 4.28Å; F111-P168 HydrophobicContact CZ-CB 3.95Å; F111-P168 HydrophobicContact CZ-CG 4.11Å; F111-V247 CarbonylContact O-C 3.45Å; F111-V247 VanDerWaalsContact O-CA 3.24Å; F111-V247 WeakPolarHBondContact O-CA 3.27Å; F111-M248 HydrophobicContact CD2-CE 4.33Å; F111-M248 PolarHBondContact N-O 3.23Å; F111-M248 PolarHBondContact O-N 2.85Å; F111-I250 HydrophobicContact CD2-CD1 4.32Å; F111-I250 HydrophobicContact CD2-CG1 4.5Å; F111-I250 HydrophobicContact CE2-CD1 3.85Å; F111-I250 HydrophobicContact CE2-CG1 4.27Å
112H88.1Confident78Confident22 Ų2248.1 Ų48.110%0.10223%0.23CC..EExtended strand (participates in β ladder)trans-91.7120.8158.9-177.9-114.9000109L89 N145 I147L89-H112 HydrophobicContact CD1-CB 3.79Å; L89-H112 WeakPolarHBondContact CD1-CD2 3.13Å; H112-N145 HydrophobicContact CB-CB 4.37Å; H112-N145 PolarHBondContact N-O 2.81Å; H112-N145 PolarHBondContact O-N 2.99Å; H112-I147 HydrophobicContact CB-CD1 4.39Å; H112-I147 HydrophobicContact CB-CG2 3.95Å
113I86Confident75.9Confident0 Ų052.8 Ų52.80%026%0.255CS..EExtended strand (participates in β ladder)trans-127.8132.9-173.2-56.6-172.9000110.2F111 L115 I141 Q143 F144 Q245 F246 M248F111-I113 HydrophobicContact CB-CD1 3.88Å; F111-I113 HydrophobicContact CB-CG1 3.73Å; I113-L115 HydrophobicContact CG2-CD2 4.07Å; I113-L115 HydrophobicContact CG2-CG 4.19Å; I113-I141 HydrophobicContact CG2-CD1 4.29Å; I113-I141 HydrophobicContact CG2-CG1 3.99Å; I113-I141 HydrophobicContact CG2-CG2 4.02Å; I113-Q143 WeakPolarHBondContact CA-O 3.38Å; I113-F144 HydrophobicContact CD1-CD2 4.03Å; I113-F144 HydrophobicContact CD1-CE2 3.96Å; I113-F144 HydrophobicContact CG1-CD2 4.01Å; I113-F144 HydrophobicContact CG1-CE2 4.34Å; I113-Q245 WeakPolarHBondContact O-CA 3.39Å; I113-F246 HydrophobicContact CB-CD2 4.25Å; I113-F246 HydrophobicContact CB-CE2 3.77Å; I113-F246 HydrophobicContact CB-CZ 3.94Å; I113-F246 HydrophobicContact CD1-CE2 4.09Å; I113-F246 HydrophobicContact CG1-CE2 4.36Å; I113-F246 HydrophobicContact CG2-CE1 4.29Å; I113-F246 HydrophobicContact CG2-CE2 3.99Å; I113-F246 HydrophobicContact CG2-CZ 3.66Å; I113-F246 PolarHBondContact N-O 2.92Å; I113-F246 PolarHBondContact O-N 2.79Å; I113-M248 HydrophobicContact CD1-CB 3.86Å; I113-M248 HydrophobicContact CD1-CE 3.32Å; I113-M248 HydrophobicContact CD1-SD 4.14Å
114S82.2Confident73.5Confident4 Ų456.7 Ų56.73%0.02828%0.275CS..EExtended strand (participates in β ladder)trans-113.5127.3164.4176.80000109.5I141 N142 Q143 L244S114-I141 CarbonylContact O-C 3.49Å; S114-I141 WeakPolarHBondContact O-CA 3.47Å; S114-N142 PolarHBondContact O-N 2.96Å; S114-Q143 PolarHBondContact N-O 2.8Å; S114-Q143 PolarHBondContact O-N 2.91Å; S114-L244 CarbonylContact C-O 3.55Å; S114-L244 WeakPolarHBondContact CA-O 3.21Å
115L77.6Confident71.2Confident2 Ų256 Ų561%0.0128%0.277CS..EExtended strand (participates in β ladder)trans-109.4122.3178.2-71.6-175.9000111.1I113 Y139 F140 I141 C177 G243 L244 F246I113-L115 HydrophobicContact CG2-CD2 4.07Å; I113-L115 HydrophobicContact CG2-CG 4.19Å; L115-Y139 HydrophobicContact CB-CD1 3.97Å; L115-Y139 HydrophobicContact CB-CG 4.12Å; L115-Y139 HydrophobicContact CD1-CD1 4.35Å; L115-Y139 HydrophobicContact CD1-CD2 4.21Å; L115-Y139 HydrophobicContact CD1-CG 3.88Å; L115-Y139 HydrophobicContact CG-CG 4.47Å; L115-F140 CarbonylContact C-O 3.27Å; L115-F140 WeakPolarHBondContact CA-O 3.34Å; L115-I141 HydrophobicContact CD2-CB 4.29Å; L115-I141 HydrophobicContact CD2-CG1 3.46Å; L115-I141 VanDerWaalsContact CD2-CG1 3.46Å; L115-C177 HydrophobicContact CD1-CB 4.03Å; L115-C177 HydrophobicContact CD2-CB 4.43Å; L115-G243 CarbonylContact O-C 3.57Å; L115-G243 VanDerWaalsContact O-C 3.27Å; L115-G243 WeakPolarHBondContact O-CA 3.33Å; L115-L244 HydrophobicContact CB-CB 4.16Å; L115-L244 PolarHBondContact N-O 2.86Å; L115-L244 PolarHBondContact O-N 3.18Å; L115-F246 HydrophobicContact CB-CE1 4.39Å; L115-F246 HydrophobicContact CD1-CE1 3.46Å; L115-F246 VanDerWaalsContact CD1-CE1 3.46Å; L115-F246 HydrophobicContact CD1-CZ 3.6Å; L115-F246 HydrophobicContact CG-CE1 3.6Å; L115-F246 HydrophobicContact CG-CZ 3.76Å
116I74.6Confident68.7Low73 Ų7365.3 Ų65.337%0.37432%0.317SS..EExtended strand (participates in β ladder)trans-93.6128.4169.8-66.8171000108.8Y139 F140 N142I116-Y139 WeakPolarHBondContact O-CA 2.99Å; I116-F140 PolarHBondContact N-O 3.41Å; I116-F140 PolarHBondContact O-N 2.88Å; I116-N142 HydrophobicContact CD1-CB 3.57Å; I116-N142 VanDerWaalsContact CD1-CG 3.46Å; I116-N142 HydrophobicContact CG1-CB 3.79Å
117P65.5Low66.4Low20 Ų2074 Ų7413%0.1335%0.353CS..EExtended strand (participates in β ladder)trans-66.1134.817524.4-30.8000111.7F119 Y136 Y139P117-F119 HydrophobicContact CB-CE2 4.46Å; P117-F119 HydrophobicContact CB-CZ 4.43Å; P117-F119 HydrophobicContact CG-CE2 4Å; P117-F119 HydrophobicContact CG-CZ 4.02Å; P117-Y136 HydrophobicContact CB-CD1 3.3Å; P117-Y136 HydrophobicContact CB-CE1 3.18Å; P117-Y136 HydrophobicContact CB-CG 4.38Å; P117-Y136 HydrophobicContact CG-CD1 4.4Å; P117-Y136 HydrophobicContact CG-CE1 3.83Å; P117-Y139 HydrophobicContact CB-CD1 4.11Å; P117-Y139 HydrophobicContact CB-CE1 3.91Å
118K64.6Low64.2Low95 Ų9573.9 Ų73.941%0.41336%0.36SS..EExtended strand (participates in β ladder)trans-87113.9162.7-161.2-169.4-162.11770108.7E137 S138 F140K118-E137 PolarHBondContact O-N 3.3Å; K118-S138 WeakPolarHBondContact CB-O 3.37Å; K118-S138 PolarHBondContact N-O 2.94Å; K118-F140 HydrophobicContact CB-CD2 4.15Å; K118-F140 HydrophobicContact CB-CE2 3.83Å; K118-F140 HydrophobicContact CD-CE2 3.51Å; K118-F140 HydrophobicContact CD-CZ 3.97Å; K118-F140 HydrophobicContact CG-CD2 4.46Å; K118-F140 HydrophobicContact CG-CE2 3.76Å
119F57.3Low61.9Low109 Ų10981.4 Ų81.448%0.47840%0.399SS..EExtended strand (participates in β ladder)trans-76.7133.1173-66.7-77.8000110.1P117 L121 L132 Y136P117-F119 HydrophobicContact CB-CE2 4.46Å; P117-F119 HydrophobicContact CB-CZ 4.43Å; P117-F119 HydrophobicContact CG-CE2 4Å; P117-F119 HydrophobicContact CG-CZ 4.02Å; F119-L121 PolarHBondContact O-N 3.33Å; F119-L132 HydrophobicContact CE1-CD2 3.77Å; F119-Y136 HydrophobicContact CD1-CD1 4.45Å; F119-Y136 HydrophobicContact CD1-CE1 4.07Å; F119-Y136 HydrophobicContact CE1-CD1 4.25Å; F119-Y136 AromaticContact CE1-CE1 3.45Å; F119-Y136 HydrophobicContact CE1-CE1 3.45Å; F119-Y136 VanDerWaalsContact CE1-CE1 3.45Å; F119-Y136 AromaticContact CZ-CE1 3.88Å; F119-Y136 HydrophobicContact CZ-CE1 3.88Å
120K51.5Low59.5Low89 Ų8990 Ų9039%0.38744%0.436SS..  trans-58.7122.7158.6-84.3-176.8167.4179.70107.7H122 E137K120-H122 VanDerWaalsContact CD-NE2 3.35Å; K120-H122 WeakPolarHBondContact CD-NE2 3.35Å; K120-H122 PolarHBondContact O-N 2.79Å; K120-E137 HydrophobicContact CD-CG 3.82Å; K120-E137 WeakPolarHBondContact CD-OE1 3.37Å; K120-E137 WeakPolarHBondContact CE-OE1 3.47Å; K120-E137 HydrophobicContact CG-CB 4.14Å; K120-E137 HydrophobicContact CG-CG 3.41Å; K120-E137 VanDerWaalsContact CG-CG 3.41Å; K120-E137 WeakPolarHBondContact CG-OE1 3.11Å
121L43.5Very low57Low165 Ų16594.5 Ų94.586%0.86446%0.457SS*.  trans-65.979.4164.4-115.1144.2000107.5F119F119-L121 PolarHBondContact O-N 3.33Å
122H44Very low54.6Low106 Ų10698 Ų9849%0.49148%0.475SS..  trans-98.8113.6168.8-83.8-50.4000107.1K120 L124 I125K120-H122 VanDerWaalsContact CD-NE2 3.35Å; K120-H122 WeakPolarHBondContact CD-NE2 3.35Å; K120-H122 PolarHBondContact O-N 2.79Å; H122-L124 PolarHBondContact O-N 3.3Å; H122-I125 HydrophobicContact CB-CD1 3.55Å; H122-I125 HydrophobicContact CB-CG1 3.78Å
123N41.9Very low52.4Low153 Ų153102.8 Ų102.882%0.81849%0.493SS*.SBendtrans-58.2-2.9-176.7-80.5-13.2000115.5
124L38.7Very low50.4Low166 Ų166112.1 Ų112.187%0.86953%0.529SS*.  trans-154.384.5-174.7-74.7165000110.5H122H122-L124 PolarHBondContact O-N 3.3Å
125I44.1Very low48.3Very low71 Ų71112.8 Ų112.836%0.36453%0.534SS..  trans-129112.4167.1-56.1-173.7000110H122 K127 H131 C135H122-I125 HydrophobicContact CB-CD1 3.55Å; H122-I125 HydrophobicContact CB-CG1 3.78Å; I125-K127 PolarHBondContact O-N 3.4Å; I125-H131 HydrophobicContact CG2-CB 4.43Å; I125-C135 HydrophobicContact CD1-CB 4.48Å; I125-C135 VanDerWaalsContact CD1-SG 3.51Å
126K37.8Very low47.1Very low196 Ų196115.1 Ų115.185%0.85254%0.543SS*.  trans-60.1121170.9-76-179.7175.9178.90109S128K126-S128 PolarHBondContact O-N 3.01Å
127K38.8Very low46Very low219 Ų219116 Ų11695%0.95255%0.546SS*.  trans-54.596.4176.5-68178.2175.7-1770110.9I125I125-K127 PolarHBondContact O-N 3.4Å
128S43.7Very low46Very low59 Ų59116.6 Ų116.641%0.41355%0.55SS.*  trans-129139.1154.977.70000108.8K126 K130 H131 L132K126-S128 PolarHBondContact O-N 3.01Å; S128-K130 PolarHBondContact O-N 3.37Å; S128-K130 VanDerWaalsContact O-N 3.17Å; S128-H131 WeakPolarHBondContact O-CA 3.3Å; S128-H131 VanDerWaalsContact O-CB 3.3Å; S128-H131 WeakPolarHBondContact O-CB 3.43Å; S128-H131 PolarHBondContact O-N 3.37Å; S128-L132 PolarHBondContact O-N 2.85Å
129I45Very low46.3Very low158 Ų158112.8 Ų112.881%0.8153%0.533SS*.Hα-helixtrans-59.3-30.5-174.2-65.1166.2000111.4H131I129-H131 VanDerWaalsContact C-N 3.35Å
130K41.5Very low47.3Very low183 Ų183112 Ų11280%0.79653%0.53SS*.Hα-helixtrans-68.3-30172.3-86-177.4174.5177.60113.5S128S128-K130 PolarHBondContact O-N 3.37Å; S128-K130 VanDerWaalsContact O-N 3.17Å
131H39.5Very low48.8Very low94 Ų94108 Ų10844%0.43551%0.513SS..Hα-helixtrans-71.7-34.8-179.6-130.9-54.4000112.1I125 S128 I129 Y133 Y134 C135I125-H131 HydrophobicContact CG2-CB 4.43Å; S128-H131 WeakPolarHBondContact O-CA 3.3Å; S128-H131 VanDerWaalsContact O-CB 3.3Å; S128-H131 WeakPolarHBondContact O-CB 3.43Å; S128-H131 PolarHBondContact O-N 3.37Å; I129-H131 VanDerWaalsContact C-N 3.35Å; H131-Y133 VanDerWaalsContact C-N 3.26Å; H131-Y133 PolarHBondContact O-N 3.27Å; H131-Y134 PolarHBondContact O-N 3.48Å; H131-C135 PolarHBondContact O-N 2.95Å; H131-C135 PolarHBondContact O-SG 2.77Å
132L39.7Very low50.5Low74 Ų74104.5 Ų104.539%0.38750%0.495SS..Hα-helixtrans-58.4-37.5-179.9-73.9162.7000112.4F119 S128 Y134 C135 Y136F119-L132 HydrophobicContact CE1-CD2 3.77Å; S128-L132 PolarHBondContact O-N 2.85Å; L132-Y134 PolarHBondContact O-N 3.39Å; L132-Y134 VanDerWaalsContact O-N 3.15Å; L132-C135 PolarHBondContact O-N 2.84Å; L132-C135 VanDerWaalsContact O-N 3.07Å; L132-Y136 WeakPolarHBondContact O-CD2 3.34Å; L132-Y136 WeakPolarHBondContact O-CE2 2.94Å
133Y42.9Very low52.4Low122 Ų122103.6 Ų103.648%0.47849%0.491SS..THydrogen-bonded Turntrans-59.7-29.7-178-165-95.4000113.7H131 R181 N206H131-Y133 VanDerWaalsContact C-N 3.26Å; H131-Y133 PolarHBondContact O-N 3.27Å; Y133-R181 PolarHBondContact O-NH2 2.76Å; Y133-R181 VanDerWaalsContact O-NH2 3.13Å; Y133-N206 PolarHBondContact OH-ND2 3.04Å
134Y44.7Very low54.4Low196 Ų19698.7 Ų98.777%0.76946%0.462SS*.THydrogen-bonded Turntrans-94.5-9.8179.3-69.1-76.2000114.1H131 L132H131-Y134 PolarHBondContact O-N 3.48Å; L132-Y134 PolarHBondContact O-N 3.39Å; L132-Y134 VanDerWaalsContact O-N 3.15Å
135C37.8Very low56.8Low18 Ų1895 Ų9512%0.12244%0.443CS..  trans-94.1-0.1-174.5-65.90000114.3I125 H131 L132I125-C135 HydrophobicContact CD1-CB 4.48Å; I125-C135 VanDerWaalsContact CD1-SG 3.51Å; H131-C135 PolarHBondContact O-N 2.95Å; H131-C135 PolarHBondContact O-SG 2.77Å; L132-C135 PolarHBondContact O-N 2.84Å; L132-C135 VanDerWaalsContact O-N 3.07Å
136Y52Low58.8Low52 Ų5295.1 Ų95.120%0.20444%0.444CS..EExtended strand (participates in β ladder)trans-80.4123.2178.5-61.1-59000111.3P117 F119 L132P117-Y136 HydrophobicContact CB-CD1 3.3Å; P117-Y136 HydrophobicContact CB-CE1 3.18Å; P117-Y136 HydrophobicContact CB-CG 4.38Å; P117-Y136 HydrophobicContact CG-CD1 4.4Å; P117-Y136 HydrophobicContact CG-CE1 3.83Å; F119-Y136 HydrophobicContact CD1-CD1 4.45Å; F119-Y136 HydrophobicContact CD1-CE1 4.07Å; F119-Y136 HydrophobicContact CE1-CD1 4.25Å; F119-Y136 AromaticContact CE1-CE1 3.45Å; F119-Y136 HydrophobicContact CE1-CE1 3.45Å; F119-Y136 VanDerWaalsContact CE1-CE1 3.45Å; F119-Y136 AromaticContact CZ-CE1 3.88Å; F119-Y136 HydrophobicContact CZ-CE1 3.88Å; L132-Y136 WeakPolarHBondContact O-CD2 3.34Å; L132-Y136 WeakPolarHBondContact O-CE2 2.94Å
137E52.2Low61.2Low91 Ų9186.4 Ų86.443%0.42541%0.407SS..EExtended strand (participates in β ladder)trans-85.9-38.7177.4-115.3176.7-175.100113.2K118 K120 W178K118-E137 PolarHBondContact O-N 3.3Å; K120-E137 HydrophobicContact CD-CG 3.82Å; K120-E137 WeakPolarHBondContact CD-OE1 3.37Å; K120-E137 WeakPolarHBondContact CE-OE1 3.47Å; K120-E137 HydrophobicContact CG-CB 4.14Å; K120-E137 HydrophobicContact CG-CG 3.41Å; K120-E137 VanDerWaalsContact CG-CG 3.41Å; K120-E137 WeakPolarHBondContact CG-OE1 3.11Å; E137-W178 VanDerWaalsContact C-CH2 3.41Å; E137-W178 WeakPolarHBondContact O-CH2 3.28Å; E137-W178 WeakPolarHBondContact O-CZ2 3.25Å
138S65.1Low63.5Low33 Ų3376.1 Ų76.123%0.23136%0.362CS..EExtended strand (participates in β ladder)trans-168.2162.6-174.943.80000108K118K118-S138 WeakPolarHBondContact CB-O 3.37Å; K118-S138 PolarHBondContact N-O 2.94Å
139Y70.2Confident65.7Low14 Ų1476.6 Ų76.66%0.05536%0.358CS..EExtended strand (participates in β ladder)trans-110.1148.2165-64-84.2000108.5L115 I116 P117 E174 W178 R181 L244L115-Y139 HydrophobicContact CB-CD1 3.97Å; L115-Y139 HydrophobicContact CB-CG 4.12Å; L115-Y139 HydrophobicContact CD1-CD1 4.35Å; L115-Y139 HydrophobicContact CD1-CD2 4.21Å; L115-Y139 HydrophobicContact CD1-CG 3.88Å; L115-Y139 HydrophobicContact CG-CG 4.47Å; I116-Y139 WeakPolarHBondContact O-CA 2.99Å; P117-Y139 HydrophobicContact CB-CD1 4.11Å; P117-Y139 HydrophobicContact CB-CE1 3.91Å; Y139-E174 VanDerWaalsContact O-CD 3.27Å; Y139-E174 VanDerWaalsContact O-CG 3.27Å; Y139-E174 WeakPolarHBondContact O-CG 3.27Å; Y139-W178 AromaticContact CD2-CE3 3.81Å; Y139-W178 HydrophobicContact CD2-CE3 3.81Å; Y139-W178 AromaticContact CD2-CZ3 3.75Å; Y139-W178 HydrophobicContact CD2-CZ3 3.75Å; Y139-W178 HydrophobicContact CE2-CE3 4.15Å; Y139-W178 AromaticContact CE2-CZ3 3.73Å; Y139-W178 HydrophobicContact CE2-CZ3 3.73Å; Y139-R181 VanDerWaalsContact CE2-CD 3.46Å; Y139-R181 PolarHBondContact OH-NH1 3.25Å; Y139-R181 VanDerWaalsContact OH-NH1 3.1Å; Y139-L244 HydrophobicContact CD1-CD1 4.34Å; Y139-L244 HydrophobicContact CE1-CD1 3.61Å
140F78.8Confident67.6Low94 Ų9469.8 Ų69.841%0.41232%0.323SS..EExtended strand (participates in β ladder)trans-104.7138.9164.1-67.4-69.3000109.9L115 I116 K118 N142 E174L115-F140 CarbonylContact C-O 3.27Å; L115-F140 WeakPolarHBondContact CA-O 3.34Å; I116-F140 PolarHBondContact N-O 3.41Å; I116-F140 PolarHBondContact O-N 2.88Å; K118-F140 HydrophobicContact CB-CD2 4.15Å; K118-F140 HydrophobicContact CB-CE2 3.83Å; K118-F140 HydrophobicContact CD-CE2 3.51Å; K118-F140 HydrophobicContact CD-CZ 3.97Å; K118-F140 HydrophobicContact CG-CD2 4.46Å; K118-F140 HydrophobicContact CG-CE2 3.76Å; F140-N142 PolarHBondContact O-N 2.88Å; F140-E174 WeakPolarHBondContact CA-OE2 3.24Å; F140-E174 VanDerWaalsContact CD1-OE1 3.24Å; F140-E174 WeakPolarHBondContact CD1-OE1 3.42Å
141I81.8Confident69.6Low5 Ų562.7 Ų62.73%0.02629%0.291CS..EExtended strand (participates in β ladder)trans-71.5115.6169.5-63.7173.1000108.7I113 S114 L115 Q143 F144 K170 C173 E174I113-I141 HydrophobicContact CG2-CD1 4.29Å; I113-I141 HydrophobicContact CG2-CG1 3.99Å; I113-I141 HydrophobicContact CG2-CG2 4.02Å; S114-I141 CarbonylContact O-C 3.49Å; S114-I141 WeakPolarHBondContact O-CA 3.47Å; L115-I141 HydrophobicContact CD2-CB 4.29Å; L115-I141 HydrophobicContact CD2-CG1 3.46Å; L115-I141 VanDerWaalsContact CD2-CG1 3.46Å; I141-Q143 WeakPolarHBondContact CG2-O 3.24Å; I141-F144 HydrophobicContact CD1-CD2 4.11Å; I141-F144 HydrophobicContact CG2-CB 3.67Å; I141-F144 HydrophobicContact CG2-CD2 4.29Å; I141-F144 HydrophobicContact CG2-CG 4.38Å; I141-K170 HydrophobicContact CB-CG 4.19Å; I141-K170 HydrophobicContact CD1-CG 4.23Å; I141-K170 HydrophobicContact CG2-CG 4.4Å; I141-K170 WeakPolarHBondContact O-CE 3.33Å; I141-K170 PolarHBondContact O-NZ 2.78Å; I141-C173 HydrophobicContact CD1-CB 3.88Å; I141-E174 HydrophobicContact CD1-CB 3.88Å; I141-E174 HydrophobicContact CG1-CB 4.07Å; I141-E174 HydrophobicContact CG1-CG 4.31Å; I141-E174 PolarHBondContact N-OE2 3.37Å
142N80.5Confident71.2Confident90 Ų9058.5 Ų58.548%0.48127%0.272SS..EExtended strand (participates in β ladder)trans-78.8-58.9172.4-176.234.9000110.5S114 I116 F140S114-N142 PolarHBondContact O-N 2.96Å; I116-N142 HydrophobicContact CD1-CB 3.57Å; I116-N142 VanDerWaalsContact CD1-CG 3.46Å; I116-N142 HydrophobicContact CG1-CB 3.79Å; F140-N142 PolarHBondContact O-N 2.88Å
143Q83Confident72.5Confident88 Ų8862.6 Ų62.641%0.41128%0.284SS..EExtended strand (participates in β ladder)trans-113.4135.4177.2-63.6-179.7-16.100110.2I113 S114 I141I113-Q143 WeakPolarHBondContact CA-O 3.38Å; S114-Q143 PolarHBondContact N-O 2.8Å; S114-Q143 PolarHBondContact O-N 2.91Å; I141-Q143 WeakPolarHBondContact CG2-O 3.24Å
144F85.3Confident73Confident49 Ų4963 Ų6322%0.21529%0.288CS..EExtended strand (participates in β ladder)trans-141.495-178.2-173.3-111.5000109.7F111 I113 I141 K170 C173F111-F144 HydrophobicContact CB-CE2 4.25Å; F111-F144 HydrophobicContact CD1-CD2 4.37Å; F111-F144 HydrophobicContact CD1-CE1 4.11Å; F111-F144 AromaticContact CD1-CE2 3.54Å; F111-F144 HydrophobicContact CD1-CE2 3.54Å; F111-F144 AromaticContact CD1-CZ 3.39Å; F111-F144 HydrophobicContact CD1-CZ 3.39Å; F111-F144 HydrophobicContact CD2-CE2 4.47Å; F111-F144 AromaticContact CE1-CE1 3.93Å; F111-F144 HydrophobicContact CE1-CE1 3.93Å; F111-F144 AromaticContact CE1-CE2 3.94Å; F111-F144 HydrophobicContact CE1-CE2 3.94Å; F111-F144 AromaticContact CE1-CZ 3.3Å; F111-F144 HydrophobicContact CE1-CZ 3.3Å; F111-F144 AromaticContact CG-CE2 3.84Å; F111-F144 HydrophobicContact CG-CE2 3.84Å; F111-F144 HydrophobicContact CG-CZ 4.08Å; F111-F144 AromaticContact CZ-CZ 3.91Å; F111-F144 HydrophobicContact CZ-CZ 3.91Å; I113-F144 HydrophobicContact CD1-CD2 4.03Å; I113-F144 HydrophobicContact CD1-CE2 3.96Å; I113-F144 HydrophobicContact CG1-CD2 4.01Å; I113-F144 HydrophobicContact CG1-CE2 4.34Å; I141-F144 HydrophobicContact CD1-CD2 4.11Å; I141-F144 HydrophobicContact CG2-CB 3.67Å; I141-F144 HydrophobicContact CG2-CD2 4.29Å; I141-F144 HydrophobicContact CG2-CG 4.38Å; F144-K170 HydrophobicContact CB-CD 4.48Å; F144-K170 HydrophobicContact CB-CG 4.36Å; F144-K170 HydrophobicContact CD1-CB 4.09Å; F144-K170 HydrophobicContact CD1-CG 4.46Å; F144-K170 HydrophobicContact CE1-CB 4.41Å; F144-K170 HydrophobicContact CG-CB 4.41Å; F144-K170 HydrophobicContact CG-CG 4.31Å; F144-C173 HydrophobicContact CD2-CB 4.47Å; F144-C173 HydrophobicContact CE2-CB 3.63Å; F144-C173 HydrophobicContact CZ-CB 4.04Å; F144-C173 VanDerWaalsContact CZ-SG 3.57Å
145N87.5Confident73.1Confident88 Ų8859.9 Ų59.947%0.47129%0.285SS..EExtended strand (participates in β ladder)trans-119.1133.3-178.3-62.4-19.9000109.9F111 H112F111-N145 CarbonylContact C-O 3.57Å; F111-N145 VanDerWaalsContact CA-O 3.25Å; F111-N145 WeakPolarHBondContact CA-O 3.28Å; H112-N145 HydrophobicContact CB-CB 4.37Å; H112-N145 PolarHBondContact N-O 2.81Å; H112-N145 PolarHBondContact O-N 2.99Å
146I87Confident73.4Confident74 Ų7463.1 Ų63.138%0.37930%0.295SS..EExtended strand (participates in β ladder)trans-78.8127.2167.4-165.1166.8000108.6F109 F111 Q149 I167F109-I146 HydrophobicContact CD1-CD1 4.04Å; F111-I146 HydrophobicContact CD1-CB 4.23Å; F111-I146 HydrophobicContact CD1-CG1 4.41Å; F111-I146 HydrophobicContact CE1-CB 4.18Å; F111-I146 HydrophobicContact CE1-CD1 4.32Å; F111-I146 HydrophobicContact CE1-CG1 4.18Å; I146-Q149 HydrophobicContact CD1-CB 4.08Å; I146-Q149 HydrophobicContact CD1-CG 4.48Å; I146-I167 HydrophobicContact CD1-CG2 4.11Å
147I88.8Confident73.1Confident14 Ų1467.2 Ų67.27%0.07232%0.32CS..EExtended strand (participates in β ladder)trans-119.8-0.3-178.258.8165.4000112.2L89 W93 L110 H112 V247L89-I147 HydrophobicContact CB-CG2 4.18Å; L89-I147 HydrophobicContact CD1-CD1 4.42Å; L89-I147 HydrophobicContact CD2-CD1 3.95Å; W93-I147 VanDerWaalsContact CD1-O 3.32Å; W93-I147 PolarHBondContact N-O 3.12Å; L110-I147 HydrophobicContact CB-CG1 4.12Å; L110-I147 HydrophobicContact CD2-CD1 3.82Å; L110-I147 HydrophobicContact CD2-CG1 3.93Å; L110-I147 HydrophobicContact CG-CD1 3.89Å; L110-I147 HydrophobicContact CG-CG1 3.78Å; L110-I147 VanDerWaalsContact O-CG1 3.31Å; L110-I147 WeakPolarHBondContact O-CG1 3.35Å; L110-I147 PolarHBondContact O-N 3.01Å; H112-I147 HydrophobicContact CB-CD1 4.39Å; H112-I147 HydrophobicContact CB-CG2 3.95Å; I147-V247 HydrophobicContact CD1-CG1 4.16Å; I147-V247 HydrophobicContact CD1-CG2 4.28Å
148G86.9Confident72.7Confident2 Ų269.2 Ų69.22%0.02133%0.334CS..EExtended strand (participates in β ladder)trans-177146.5171.500000111.3L110L110-G148 PolarHBondContact N-O 3.22Å; L110-G148 PolarHBondContact O-N 3.48Å
149Q89.9Confident71.6Confident69 Ų6975.4 Ų75.432%0.32236%0.364SS..EExtended strand (participates in β ladder)trans-148.8146.7175.960.5-176.46.800111.1S94 V108 F109 I146 Y151S94-Q149 WeakPolarHBondContact CA-O 3.29Å; S94-Q149 WeakPolarHBondContact CB-O 3.3Å; S94-Q149 PolarHBondContact OG-N 2.77Å; S94-Q149 PolarHBondContact OG-O 2.87Å; V108-Q149 CarbonylContact O-C 3.53Å; V108-Q149 VanDerWaalsContact O-CA 3.28Å; V108-Q149 WeakPolarHBondContact O-CA 3.02Å; F109-Q149 HydrophobicContact CD1-CB 4.45Å; I146-Q149 HydrophobicContact CD1-CB 4.08Å; I146-Q149 HydrophobicContact CD1-CG 4.48Å; Q149-Y151 HydrophobicContact CB-CE2 4.17Å; Q149-Y151 HydrophobicContact CG-CE2 4.19Å; Q149-Y151 PolarHBondContact OE1-OH 2.95Å
150Y84.8Confident70.2Confident16 Ų1679.1 Ų79.16%0.06338%0.382CS..EExtended strand (participates in β ladder)trans-146.1141.6174.2158.1-97.4000110.6K98 L102 K107 V108 S152K98-Y150 HydrophobicContact CB-CD2 3.47Å; K98-Y150 VanDerWaalsContact CB-CD2 3.47Å; K98-Y150 HydrophobicContact CB-CE2 3.95Å; K98-Y150 HydrophobicContact CB-CG 3.94Å; K98-Y150 HydrophobicContact CD-CD2 4.04Å; K98-Y150 HydrophobicContact CD-CE2 4.04Å; K98-Y150 HydrophobicContact CG-CD2 3.6Å; K98-Y150 HydrophobicContact CG-CE2 3.56Å; K98-Y150 HydrophobicContact CG-CG 4.47Å; L102-Y150 HydrophobicContact CD1-CE2 4.26Å; L102-Y150 WeakPolarHBondContact CD1-OH 3.47Å; K107-Y150 CarbonylContact C-O 3.56Å; K107-Y150 WeakPolarHBondContact CA-O 3.13Å; V108-Y150 HydrophobicContact CG1-CD1 3.82Å; V108-Y150 HydrophobicContact CG1-CG 4.2Å; V108-Y150 PolarHBondContact N-O 2.85Å; V108-Y150 PolarHBondContact O-N 2.83Å; Y150-S152 VanDerWaalsContact OH-CA 3.26Å; Y150-S152 WeakPolarHBondContact OH-CA 3.26Å; Y150-S152 WeakPolarHBondContact OH-CB 3.49Å
151Y83.8Confident68.4Low34 Ų3479.5 Ų79.513%0.13339%0.388CS..EExtended strand (participates in β ladder)trans-129.8130.2177.5-54.3-82.2000109.9D106 K107 F109 Q149 I165D106-Y151 CarbonylContact O-C 3.58Å; D106-Y151 WeakPolarHBondContact O-CA 3.49Å; K107-Y151 HydrophobicContact CB-CD1 3.8Å; K107-Y151 HydrophobicContact CB-CE1 3.95Å; K107-Y151 HydrophobicContact CD-CD1 3.88Å; K107-Y151 HydrophobicContact CD-CE1 4.08Å; K107-Y151 HydrophobicContact CG-CD1 3.71Å; K107-Y151 HydrophobicContact CG-CE1 4.18Å; F109-Y151 HydrophobicContact CE1-CE1 4.2Å; F109-Y151 AromaticContact CE1-CZ 3.83Å; F109-Y151 WeakPolarHBondContact CE1-OH 3.3Å; F109-Y151 HydrophobicContact CE2-CE1 4.33Å; F109-Y151 AromaticContact CZ-CE1 3.7Å; F109-Y151 HydrophobicContact CZ-CE1 3.7Å; F109-Y151 AromaticContact CZ-CZ 3.82Å; F109-Y151 WeakPolarHBondContact CZ-OH 3.47Å; Q149-Y151 HydrophobicContact CB-CE2 4.17Å; Q149-Y151 HydrophobicContact CG-CE2 4.19Å; Q149-Y151 PolarHBondContact OE1-OH 2.95Å; Y151-I165 HydrophobicContact CE1-CG2 3.83Å; Y151-I165 HydrophobicContact CE2-CD1 4.39Å; Y151-I165 HydrophobicContact CE2-CG2 3.81Å; Y151-I165 WeakPolarHBondContact OH-CG2 3.41Å
152S73.7Confident66.1Low5 Ų586.6 Ų86.64%0.03543%0.426CS..  trans-78.4119.7169176.70000109.3D106 Y150 F154D106-S152 PolarHBondContact O-N 2.83Å; Y150-S152 VanDerWaalsContact OH-CA 3.26Å; Y150-S152 WeakPolarHBondContact OH-CA 3.26Å; Y150-S152 WeakPolarHBondContact OH-CB 3.49Å; S152-F154 PolarHBondContact O-N 2.93Å; S152-F154 WeakPolarHBondContact OG-CD2 2.98Å
153Y65.6Low64Low161 Ų16189.2 Ų89.263%0.63143%0.433SS*.  trans-81.84.2174.7-72.9-81.7000113.2N155 Y156 L161Y153-N155 PolarHBondContact O-N 3Å; Y153-Y156 PolarHBondContact O-N 3.34Å; Y153-L161 HydrophobicContact CD1-CD2 4.48Å; Y153-L161 HydrophobicContact CE1-CD2 3.93Å
154F54.6Low62.1Low131 Ų13191.7 Ų91.758%0.57545%0.449SS*.THydrogen-bonded Turntrans-66.6-3.3-165.1-81.8-71.4000116.3L102 S152L102-F154 HydrophobicContact CD1-CE2 3.77Å; L102-F154 HydrophobicContact CG-CE2 4.43Å; S152-F154 PolarHBondContact O-N 2.93Å; S152-F154 WeakPolarHBondContact OG-CD2 2.98Å
155N45.7Very low60.7Low130 Ų13093.7 Ų93.770%0.69546%0.461SS*.THydrogen-bonded Turntrans-139.212.5-178.6-85.3-29.3000115.6Y153Y153-N155 PolarHBondContact O-N 3Å
156Y45Very low59.7Low86 Ų8695.5 Ų95.534%0.33747%0.47SS..  trans-97.1108.5177.5-71.5-74.2000110.5K107 Y153 N158 Q160K107-Y156 WeakPolarHBondContact CE-OH 3.24Å; K107-Y156 PolarHBondContact NZ-OH 2.86Å; Y153-Y156 PolarHBondContact O-N 3.34Å; Y156-N158 PolarHBondContact O-N 3.31Å; Y156-Q160 HydrophobicContact CD1-CB 4Å
157N44.2Very low59.3Low138 Ų13895.6 Ų95.674%0.73847%0.471SS*.  trans-51.2128.3158.2-81.7-16.8000107.3N159 Q160N157-N159 PolarHBondContact O-N 3.48Å; N157-Q160 PolarHBondContact O-N 3.23Å
158N44.1Very low59Low133 Ų13395 Ų9571%0.71147%0.468SS*.G310 helixtrans-49.5-15.3-173.2-79.2-22.3000115.2Y156 L161Y156-N158 PolarHBondContact O-N 3.31Å; N158-L161 HydrophobicContact CB-CD1 4.47Å
159N42.2Very low59.1Low162 Ų16298.3 Ų98.387%0.86649%0.485SS*.G310 helixtrans-83.4-2.2175.1-68.1-8.3000115N157N157-N159 PolarHBondContact O-N 3.48Å
160Q41.2Very low59Low92 Ų9299.2 Ų99.243%0.4349%0.488SS..G310 helixtrans-105.78.2175-77.5-168.7-4.900113.9Y156 N157 N162 F163Y156-Q160 HydrophobicContact CD1-CB 4Å; N157-Q160 PolarHBondContact O-N 3.23Å; Q160-N162 PolarHBondContact O-N 2.82Å; Q160-F163 HydrophobicContact CB-CD2 3.97Å; Q160-F163 HydrophobicContact CB-CE2 4.47Å; Q160-F163 HydrophobicContact CG-CD2 4.03Å; Q160-F163 HydrophobicContact CG-CE2 4.02Å; Q160-F163 PolarHBondContact O-N 2.86Å
161L40.7Very low59.2Low102 Ų102103.7 Ų103.753%0.53451%0.513SS..THydrogen-bonded Turntrans-59.1-11.1178.3-90.2156.4000114.2Y153 N158Y153-L161 HydrophobicContact CD1-CD2 4.48Å; Y153-L161 HydrophobicContact CE1-CD2 3.93Å; N158-L161 HydrophobicContact CB-CD1 4.47Å
162N33.4Very low59.5Low155 Ų155102.5 Ų102.583%0.82951%0.509SS*.THydrogen-bonded Turntrans-92.35.6172.5-76.4-11.2000115Q160 L164Q160-N162 PolarHBondContact O-N 2.82Å; N162-L164 PolarHBondContact O-N 2.84Å
163F36.2Very low60.3Low144 Ų144102.3 Ų102.363%0.63251%0.508SS*.SBendtrans-69.491.7165.3-90.6-81.3000108.3Q160 I165Q160-F163 HydrophobicContact CB-CD2 3.97Å; Q160-F163 HydrophobicContact CB-CE2 4.47Å; Q160-F163 HydrophobicContact CG-CD2 4.03Å; Q160-F163 HydrophobicContact CG-CE2 4.02Å; Q160-F163 PolarHBondContact O-N 2.86Å; F163-I165 PolarHBondContact O-N 3.1Å
164L44.3Very low61.4Low140 Ų14096.6 Ų96.673%0.73349%0.487SS*.  trans-18.4116.4168-125.286.6000109.8N162 N166N162-L164 PolarHBondContact O-N 2.84Å; L164-N166 PolarHBondContact O-N 3.29Å; L164-N166 PolarHBondContact O-OD1 3.07Å
165I54.7Low63.1Low92 Ų9294.2 Ų94.247%0.47248%0.476SS..  trans-57.696.4170.1-63.1175.1000106.2Y151 F163 I167Y151-I165 HydrophobicContact CE1-CG2 3.83Å; Y151-I165 HydrophobicContact CE2-CD1 4.39Å; Y151-I165 HydrophobicContact CE2-CG2 3.81Å; Y151-I165 WeakPolarHBondContact OH-CG2 3.41Å; F163-I165 PolarHBondContact O-N 3.1Å; I165-I167 HydrophobicContact CG2-CG1 3.88Å; I165-I167 PolarHBondContact O-N 3.15Å
166N67Low65.2Low125 Ų12588 Ų8867%0.66844%0.443SS*.  trans-77.381.1-179.1-78-13.2000107.9L164L164-N166 PolarHBondContact O-N 3.29Å; L164-N166 PolarHBondContact O-OD1 3.07Å
167I77.6Confident67.3Low77 Ų7784 Ų8440%0.39543%0.427SS..PPolyproline II helixtrans-61.6129170.6-52.9-177.4000107.6F109 F111 I146 I165 N169F109-I167 HydrophobicContact CD1-CG2 4.14Å; F109-I167 HydrophobicContact CE1-CB 4.04Å; F109-I167 HydrophobicContact CE1-CG1 4.02Å; F109-I167 HydrophobicContact CE1-CG2 3.95Å; F111-I167 HydrophobicContact CE1-CG2 4.34Å; F111-I167 HydrophobicContact CZ-CG2 4.32Å; I146-I167 HydrophobicContact CD1-CG2 4.11Å; I165-I167 HydrophobicContact CG2-CG1 3.88Å; I165-I167 PolarHBondContact O-N 3.15Å; I167-N169 PolarHBondContact O-N 3.03Å; I167-N169 VanDerWaalsContact O-N 3.07Å
168P84.2Confident69.2Low1 Ų179.2 Ų79.21%0.00640%0.399CS..PPolyproline II helixtrans-49.1118171.9-31.436.6000111.4F109 F111 W194 I250F109-P168 HydrophobicContact CD1-CG 4.49Å; F109-P168 HydrophobicContact CD2-CG 3.89Å; F109-P168 VanDerWaalsContact CE1-CD 3.42Å; F109-P168 HydrophobicContact CE2-CG 4.05Å; F109-P168 HydrophobicContact CG-CG 4.12Å; F109-P168 VanDerWaalsContact CZ-CD 3.41Å; F109-P168 HydrophobicContact CZ-CG 4.38Å; F111-P168 HydrophobicContact CE2-CB 4.23Å; F111-P168 HydrophobicContact CE2-CG 4.28Å; F111-P168 HydrophobicContact CZ-CB 3.95Å; F111-P168 HydrophobicContact CZ-CG 4.11Å; P168-W194 HydrophobicContact CB-CZ2 4Å; P168-W194 HydrophobicContact CG-CZ2 3.84Å; P168-I250 HydrophobicContact CB-CD1 4.2Å; P168-I250 HydrophobicContact CG-CD1 4.17Å
169N87.2Confident71.3Confident72 Ų7272.9 Ų72.939%0.38537%0.365SS..PPolyproline II helixtrans-72.8159.5179.167.460.4000110.9I167 N171 D172 C173I167-N169 PolarHBondContact O-N 3.03Å; I167-N169 VanDerWaalsContact O-N 3.07Å; N169-N171 VanDerWaalsContact C-N 3.31Å; N169-N171 PolarHBondContact O-N 3.41Å; N169-N171 PolarHBondContact OD1-N 2.9Å; N169-N171 VanDerWaalsContact OD1-N 3.16Å; N169-D172 PolarHBondContact ND2-OD2 3.35Å; N169-D172 PolarHBondContact O-N 3.38Å; N169-D172 WeakPolarHBondContact OD1-CB 3.11Å; N169-D172 PolarHBondContact OD1-N 3.48Å; N169-D172 PolarHBondContact OD1-OD2 3.12Å; N169-C173 PolarHBondContact O-N 3.26Å; N169-C173 PolarHBondContact O-SG 3.46Å
170K89.6Confident73.5Confident87 Ų8765.1 Ų65.138%0.37832%0.324SS..Hα-helixtrans-54.3-43.9-179-175.9179.7176.3177.30112.7I141 F144 D172 C173 E174I141-K170 HydrophobicContact CB-CG 4.19Å; I141-K170 HydrophobicContact CD1-CG 4.23Å; I141-K170 HydrophobicContact CG2-CG 4.4Å; I141-K170 WeakPolarHBondContact O-CE 3.33Å; I141-K170 PolarHBondContact O-NZ 2.78Å; F144-K170 HydrophobicContact CB-CD 4.48Å; F144-K170 HydrophobicContact CB-CG 4.36Å; F144-K170 HydrophobicContact CD1-CB 4.09Å; F144-K170 HydrophobicContact CD1-CG 4.46Å; F144-K170 HydrophobicContact CE1-CB 4.41Å; F144-K170 HydrophobicContact CG-CB 4.41Å; F144-K170 HydrophobicContact CG-CG 4.31Å; K170-D172 PolarHBondContact O-N 3.04Å; K170-C173 PolarHBondContact O-N 2.94Å; K170-E174 PolarHBondContact O-N 2.84Å
171N88.8Confident75.4Confident110 Ų11061.8 Ų61.859%0.58831%0.307SS*.Hα-helixtrans-64.9-41.9-176.4-68.5-0.5000112.2N169 E174 K175N169-N171 VanDerWaalsContact C-N 3.31Å; N169-N171 PolarHBondContact O-N 3.41Å; N169-N171 PolarHBondContact OD1-N 2.9Å; N169-N171 VanDerWaalsContact OD1-N 3.16Å; N171-E174 PolarHBondContact O-N 3.17Å; N171-K175 WeakPolarHBondContact O-CG 2.76Å; N171-K175 PolarHBondContact O-N 2.95Å; N171-K175 VanDerWaalsContact O-N 3.08Å
172D90.3Very high77.4Confident10 Ų1058.6 Ų58.65%0.05329%0.289CS..Hα-helixtrans-71.9-36.7177.3-71-26.7000111.2N169 K170 E174 K175 L176 L193 W194N169-D172 PolarHBondContact ND2-OD2 3.35Å; N169-D172 PolarHBondContact O-N 3.38Å; N169-D172 WeakPolarHBondContact OD1-CB 3.11Å; N169-D172 PolarHBondContact OD1-N 3.48Å; N169-D172 PolarHBondContact OD1-OD2 3.12Å; K170-D172 PolarHBondContact O-N 3.04Å; D172-E174 VanDerWaalsContact C-N 3.29Å; D172-E174 PolarHBondContact O-N 2.93Å; D172-K175 PolarHBondContact O-N 3.24Å; D172-K175 IonicContact OD1-NZ 2.77Å; D172-K175 PolarHBondContact OD1-NZ 3.36Å; D172-L176 VanDerWaalsContact O-CB 3.27Å; D172-L176 WeakPolarHBondContact O-CB 3.26Å; D172-L176 PolarHBondContact O-N 3.42Å; D172-L193 HydrophobicContact CB-CD2 3.75Å; D172-L193 WeakPolarHBondContact O-CD2 3.37Å; D172-W194 WeakPolarHBondContact OD2-CA 3.31Å; D172-W194 VanDerWaalsContact OD2-CD1 3.29Å; D172-W194 PolarHBondContact OD2-N 3.06Å
173C90.8Very high79.9Confident0 Ų051.7 Ų51.70%025%0.253CS..Hα-helixtrans-62.2-35.6171.2-74.90000112.5I141 F144 N169 K170 L176 C177 M248I141-C173 HydrophobicContact CD1-CB 3.88Å; F144-C173 HydrophobicContact CD2-CB 4.47Å; F144-C173 HydrophobicContact CE2-CB 3.63Å; F144-C173 HydrophobicContact CZ-CB 4.04Å; F144-C173 VanDerWaalsContact CZ-SG 3.57Å; N169-C173 PolarHBondContact O-N 3.26Å; N169-C173 PolarHBondContact O-SG 3.46Å; K170-C173 PolarHBondContact O-N 2.94Å; C173-L176 PolarHBondContact O-N 3.28Å; C173-C177 WeakPolarHBondContact O-CB 2.94Å; C173-C177 PolarHBondContact O-N 2.94Å; C173-C177 PolarHBondContact O-SG 2.8Å; C173-M248 HydrophobicContact CB-CE 3.88Å
174E88.6Confident82.1Confident42 Ų4250.1 Ų50.120%0.19624%0.244CC..Hα-helixtrans-67-47.6175.6-170.6172.7115.400111.4Y139 F140 I141 K170 N171 D172 L176 C177 W178Y139-E174 VanDerWaalsContact O-CD 3.27Å; Y139-E174 VanDerWaalsContact O-CG 3.27Å; Y139-E174 WeakPolarHBondContact O-CG 3.27Å; F140-E174 WeakPolarHBondContact CA-OE2 3.24Å; F140-E174 VanDerWaalsContact CD1-OE1 3.24Å; F140-E174 WeakPolarHBondContact CD1-OE1 3.42Å; I141-E174 HydrophobicContact CD1-CB 3.88Å; I141-E174 HydrophobicContact CG1-CB 4.07Å; I141-E174 HydrophobicContact CG1-CG 4.31Å; I141-E174 PolarHBondContact N-OE2 3.37Å; K170-E174 PolarHBondContact O-N 2.84Å; N171-E174 PolarHBondContact O-N 3.17Å; D172-E174 VanDerWaalsContact C-N 3.29Å; D172-E174 PolarHBondContact O-N 2.93Å; E174-L176 VanDerWaalsContact C-N 3.27Å; E174-L176 PolarHBondContact O-N 3.3Å; E174-C177 WeakPolarHBondContact O-CB 3.42Å; E174-C177 PolarHBondContact O-N 3.22Å; E174-W178 PolarHBondContact O-N 2.85Å
175K88.6Confident84Confident81 Ų8147.9 Ų47.935%0.35223%0.232SC..Hα-helixtrans-57-42172.1-67.8173.2-164.4158.40111.6N171 D172 W178 A179 L193N171-K175 WeakPolarHBondContact O-CG 2.76Å; N171-K175 PolarHBondContact O-N 2.95Å; N171-K175 VanDerWaalsContact O-N 3.08Å; D172-K175 PolarHBondContact O-N 3.24Å; D172-K175 IonicContact OD1-NZ 2.77Å; D172-K175 PolarHBondContact OD1-NZ 3.36Å; K175-W178 WeakPolarHBondContact O-CB 3.42Å; K175-W178 PolarHBondContact O-N 3.49Å; K175-A179 WeakPolarHBondContact O-CB 3.33Å; K175-A179 PolarHBondContact O-N 2.9Å; K175-L193 HydrophobicContact CB-CD2 3.98Å; K175-L193 HydrophobicContact CD-CD2 4.4Å
176L90.7Very high85.4Confident0 Ų045.7 Ų45.70%022%0.218CC..Hα-helixtrans-65.3-41.9178.2179.960000111.4D172 C173 E174 W178 A179 I180 L191 L193 L209 F225 A227 M248 I250D172-L176 VanDerWaalsContact O-CB 3.27Å; D172-L176 WeakPolarHBondContact O-CB 3.26Å; D172-L176 PolarHBondContact O-N 3.42Å; C173-L176 PolarHBondContact O-N 3.28Å; E174-L176 VanDerWaalsContact C-N 3.27Å; E174-L176 PolarHBondContact O-N 3.3Å; L176-W178 VanDerWaalsContact C-N 3.26Å; L176-W178 PolarHBondContact O-N 2.89Å; L176-A179 PolarHBondContact O-N 3.48Å; L176-I180 HydrophobicContact CD1-CD1 4.39Å; L176-I180 HydrophobicContact CD1-CG1 4.37Å; L176-I180 HydrophobicContact CG-CD1 4.19Å; L176-I180 VanDerWaalsContact O-CG1 3.29Å; L176-I180 WeakPolarHBondContact O-CG1 3.48Å; L176-I180 PolarHBondContact O-N 3.14Å; L176-L191 HydrophobicContact CD1-CD2 4.34Å; L176-L193 HydrophobicContact CB-CD1 4.43Å; L176-L193 HydrophobicContact CB-CD2 4.33Å; L176-L193 HydrophobicContact CD1-CD1 4.15Å; L176-L209 HydrophobicContact CD1-CD2 4.11Å; L176-F225 HydrophobicContact CD1-CE2 3.9Å; L176-F225 HydrophobicContact CD1-CZ 4.13Å; L176-F225 HydrophobicContact CD2-CE2 4.43Å; L176-A227 HydrophobicContact CD1-CB 3.96Å; L176-A227 HydrophobicContact CD2-CB 3.68Å; L176-A227 HydrophobicContact CG-CB 4.09Å; L176-M248 HydrophobicContact CD2-CE 4.31Å; L176-M248 HydrophobicContact CD2-SD 4.27Å; L176-I250 HydrophobicContact CD2-CD1 3.56Å; L176-I250 HydrophobicContact CD2-CG1 4.08Å
177C88.1Confident85.7Confident1 Ų147.5 Ų47.51%0.00722%0.22CC..Hα-helixtrans-58.9-40173.5-72.70000111.8L115 C173 E174 R181 R229L115-C177 HydrophobicContact CD1-CB 4.03Å; L115-C177 HydrophobicContact CD2-CB 4.43Å; C173-C177 WeakPolarHBondContact O-CB 2.94Å; C173-C177 PolarHBondContact O-N 2.94Å; C173-C177 PolarHBondContact O-SG 2.8Å; E174-C177 WeakPolarHBondContact O-CB 3.42Å; E174-C177 PolarHBondContact O-N 3.22Å; C177-R181 PolarHBondContact O-N 3.4Å; C177-R229 PolarHBondContact O-NH1 3.3Å
178W85.2Confident85.4Confident37 Ų3751.6 Ų51.614%0.1424%0.243CC..Hα-helixtrans-66.9-44.9174.2-165.9-115.3000112E137 Y139 E174 K175 L176 I180 R181 Q182E137-W178 VanDerWaalsContact C-CH2 3.41Å; E137-W178 WeakPolarHBondContact O-CH2 3.28Å; E137-W178 WeakPolarHBondContact O-CZ2 3.25Å; Y139-W178 AromaticContact CD2-CE3 3.81Å; Y139-W178 HydrophobicContact CD2-CE3 3.81Å; Y139-W178 AromaticContact CD2-CZ3 3.75Å; Y139-W178 HydrophobicContact CD2-CZ3 3.75Å; Y139-W178 HydrophobicContact CE2-CE3 4.15Å; Y139-W178 AromaticContact CE2-CZ3 3.73Å; Y139-W178 HydrophobicContact CE2-CZ3 3.73Å; E174-W178 PolarHBondContact O-N 2.85Å; K175-W178 WeakPolarHBondContact O-CB 3.42Å; K175-W178 PolarHBondContact O-N 3.49Å; L176-W178 VanDerWaalsContact C-N 3.26Å; L176-W178 PolarHBondContact O-N 2.89Å; W178-I180 VanDerWaalsContact C-N 3.34Å; W178-I180 PolarHBondContact O-N 2.87Å; W178-R181 PolarHBondContact O-N 2.9Å; W178-Q182 VanDerWaalsContact CZ2-CD 3.41Å; W178-Q182 HydrophobicContact CZ2-CG 4.34Å; W178-Q182 PolarHBondContact O-N 2.78Å
179A88.3Confident84.7Confident0 Ų054 Ų540%027%0.268CS..Hα-helixtrans-60.9-38.4178.200000113.1K175 L176 R181 Q182 P183 Y186 L191 L209K175-A179 WeakPolarHBondContact O-CB 3.33Å; K175-A179 PolarHBondContact O-N 2.9Å; L176-A179 PolarHBondContact O-N 3.48Å; A179-R181 VanDerWaalsContact C-N 3.32Å; A179-R181 PolarHBondContact O-N 3.36Å; A179-Q182 CarbonylContact O-C 3.59Å; A179-P183 WeakPolarHBondContact O-CA 3.36Å; A179-P183 WeakPolarHBondContact O-CB 3.28Å; A179-P183 WeakPolarHBondContact O-CD 3.12Å; A179-Y186 VanDerWaalsContact CA-CE2 3.49Å; A179-Y186 HydrophobicContact CB-CD2 3.91Å; A179-Y186 HydrophobicContact CB-CE2 3.65Å; A179-L191 HydrophobicContact CB-CD1 3.87Å; A179-L191 HydrophobicContact CB-CD2 3.79Å; A179-L191 HydrophobicContact CB-CG 4.48Å; A179-L209 HydrophobicContact CB-CD1 3.8Å
180I87.9Confident84.5Confident0 Ų051.3 Ų51.30%026%0.257CS..Hα-helixtrans-67.3-33.8175-60.3160.9000111.1L176 W178 N206 L209 A227 R229 M248L176-I180 HydrophobicContact CD1-CD1 4.39Å; L176-I180 HydrophobicContact CD1-CG1 4.37Å; L176-I180 HydrophobicContact CG-CD1 4.19Å; L176-I180 VanDerWaalsContact O-CG1 3.29Å; L176-I180 WeakPolarHBondContact O-CG1 3.48Å; L176-I180 PolarHBondContact O-N 3.14Å; W178-I180 VanDerWaalsContact C-N 3.34Å; W178-I180 PolarHBondContact O-N 2.87Å; I180-N206 PolarHBondContact O-N 3.18Å; I180-L209 HydrophobicContact CB-CB 4.46Å; I180-L209 HydrophobicContact CG1-CB 3.58Å; I180-L209 HydrophobicContact CG1-CD1 4.24Å; I180-A227 HydrophobicContact CD1-CB 4.2Å; I180-R229 HydrophobicContact CD1-CG 4.04Å; I180-R229 VanDerWaalsContact CG2-CZ 3.49Å; I180-M248 HydrophobicContact CD1-SD 4.43Å
181R82Confident84.5Confident22 Ų2247.2 Ų47.28%0.08324%0.239CC..Hα-helixtrans-74-43.2176.6-178.9178.4177.886.8-0112.1Y133 Y139 C177 W178 A179 P183 N206Y133-R181 PolarHBondContact O-NH2 2.76Å; Y133-R181 VanDerWaalsContact O-NH2 3.13Å; Y139-R181 VanDerWaalsContact CE2-CD 3.46Å; Y139-R181 PolarHBondContact OH-NH1 3.25Å; Y139-R181 VanDerWaalsContact OH-NH1 3.1Å; C177-R181 PolarHBondContact O-N 3.4Å; W178-R181 PolarHBondContact O-N 2.9Å; A179-R181 VanDerWaalsContact C-N 3.32Å; A179-R181 PolarHBondContact O-N 3.36Å; R181-P183 VanDerWaalsContact C-CD 3.46Å; R181-N206 WeakPolarHBondContact CG-OD1 3.47Å
182Q83.1Confident84.5Confident34 Ų3446.8 Ų46.816%0.15924%0.237CC..  trans-129.663.4-172.8-59.2-169.8-10.900111.7W178 A179 Y184 L185W178-Q182 VanDerWaalsContact CZ2-CD 3.41Å; W178-Q182 HydrophobicContact CZ2-CG 4.34Å; W178-Q182 PolarHBondContact O-N 2.78Å; A179-Q182 CarbonylContact O-C 3.59Å; Q182-Y184 HydrophobicContact CB-CD1 4.34Å; Q182-Y184 HydrophobicContact CB-CE1 3.71Å; Q182-Y184 HydrophobicContact CG-CE1 4.01Å; Q182-Y184 PolarHBondContact O-N 2.99Å; Q182-Y184 VanDerWaalsContact O-N 3.11Å; Q182-Y184 PolarHBondContact OE1-OH 2.84Å; Q182-L185 HydrophobicContact CB-CD1 3.91Å; Q182-L185 HydrophobicContact CB-CG 4.11Å; Q182-L185 PolarHBondContact O-N 2.99Å; Q182-L185 VanDerWaalsContact O-N 3.17Å
183P84.7Confident84.5Confident10 Ų1046.3 Ų46.37%0.06523%0.234CC..G310 helixtrans-61.9-26.4-175.124.3-35.3000112.9A179 R181 L185 Y186 I200 A203 Y205A179-P183 WeakPolarHBondContact O-CA 3.36Å; A179-P183 WeakPolarHBondContact O-CB 3.28Å; A179-P183 WeakPolarHBondContact O-CD 3.12Å; R181-P183 VanDerWaalsContact C-CD 3.46Å; P183-L185 PolarHBondContact O-N 2.98Å; P183-Y186 PolarHBondContact O-N 2.86Å; P183-Y186 VanDerWaalsContact O-N 3.14Å; P183-I200 HydrophobicContact CB-CD1 4.22Å; P183-A203 HydrophobicContact CB-CB 3.53Å; P183-A203 HydrophobicContact CG-CB 3.69Å; P183-Y205 HydrophobicContact CG-CD1 3.85Å; P183-Y205 HydrophobicContact CG-CE1 3.54Å
184Y83.5Confident84.3Confident111 Ų11148.9 Ų48.944%0.43524%0.244SC..G310 helixtrans-61.6-26.4179.662.2-92.4000113.7Q182 Y186 Y205Q182-Y184 HydrophobicContact CB-CD1 4.34Å; Q182-Y184 HydrophobicContact CB-CE1 3.71Å; Q182-Y184 HydrophobicContact CG-CE1 4.01Å; Q182-Y184 PolarHBondContact O-N 2.99Å; Q182-Y184 VanDerWaalsContact O-N 3.11Å; Q182-Y184 PolarHBondContact OE1-OH 2.84Å; Y184-Y186 PolarHBondContact O-N 2.87Å; Y184-Y205 HydrophobicContact CD1-CE1 4.24Å
185L83.1Confident84.1Confident93 Ų9350.5 Ų50.549%0.48727%0.272SS..G310 helixtrans-67.2-20.7178.1-68-177.8000113.1Q182 P183Q182-L185 HydrophobicContact CB-CD1 3.91Å; Q182-L185 HydrophobicContact CB-CG 4.11Å; Q182-L185 PolarHBondContact O-N 2.99Å; Q182-L185 VanDerWaalsContact O-N 3.17Å; P183-L185 PolarHBondContact O-N 2.98Å
186Y84.8Confident84.1Confident46 Ų4650.9 Ų50.918%0.1827%0.274CS..G310 helixtrans-104.61.8-173.2-62.3-86.7000113.3A179 P183 Y184 N188 G190 L191 I200A179-Y186 VanDerWaalsContact CA-CE2 3.49Å; A179-Y186 HydrophobicContact CB-CD2 3.91Å; A179-Y186 HydrophobicContact CB-CE2 3.65Å; P183-Y186 PolarHBondContact O-N 2.86Å; P183-Y186 VanDerWaalsContact O-N 3.14Å; Y184-Y186 PolarHBondContact O-N 2.87Å; Y186-N188 VanDerWaalsContact C-N 3.28Å; Y186-N188 PolarHBondContact O-N 2.81Å; Y186-G190 PolarHBondContact O-N 2.8Å; Y186-G190 VanDerWaalsContact O-N 3.07Å; Y186-L191 HydrophobicContact CD1-CB 4.19Å; Y186-L191 HydrophobicContact CD1-CD1 3.77Å; Y186-L191 HydrophobicContact CE1-CD1 3.57Å; Y186-L191 HydrophobicContact CG-CD1 4.42Å; Y186-I200 HydrophobicContact CG-CD1 4.38Å
187K73.6Confident84Confident163 Ų16355 Ų5571%0.70929%0.292SS*.THydrogen-bonded Turntrans-55.8-39.8-176.4-78.2-177.7176.3-174.70113.5
188N70.8Confident84.2Confident163 Ų16355.1 Ų55.187%0.87229%0.292SS*.THydrogen-bonded Turntrans-103.9-26.8-173.4-62.3-10.6000113.1Y186Y186-N188 VanDerWaalsContact C-N 3.28Å; Y186-N188 PolarHBondContact O-N 2.81Å
189G69.7Low84.5Confident53 Ų5359.8 Ų59.855%0.54631%0.31SS..THydrogen-bonded Turntrans-92-17.8-177.100000114.4K197G189-K197 WeakPolarHBondContact O-CE 3.35Å
190G82.9Confident84.6Confident15 Ų1561.7 Ų61.716%0.15532%0.32CS..  trans66170.7-163.900000112.1Y186 Y198Y186-G190 PolarHBondContact O-N 2.8Å; Y186-G190 VanDerWaalsContact O-N 3.07Å; G190-Y198 CarbonylContact C-O 3.59Å; G190-Y198 WeakPolarHBondContact CA-O 3.33Å
191L88.8Confident84.7Confident0 Ų064.2 Ų64.20%033%0.333CS..EExtended strand (participates in β ladder)trans-108.3110.9-176.2177.157.9000108.7L176 A179 Y186 L193 Y198 L209L176-L191 HydrophobicContact CD1-CD2 4.34Å; A179-L191 HydrophobicContact CB-CD1 3.87Å; A179-L191 HydrophobicContact CB-CD2 3.79Å; A179-L191 HydrophobicContact CB-CG 4.48Å; Y186-L191 HydrophobicContact CD1-CB 4.19Å; Y186-L191 HydrophobicContact CD1-CD1 3.77Å; Y186-L191 HydrophobicContact CE1-CD1 3.57Å; Y186-L191 HydrophobicContact CG-CD1 4.42Å; L191-L193 HydrophobicContact CD1-CD1 4.3Å; L191-L193 HydrophobicContact CD1-CD2 4.32Å; L191-L193 HydrophobicContact CD1-CG 4.13Å; L191-L193 HydrophobicContact CD2-CD1 3.55Å; L191-L193 HydrophobicContact CD2-CG 4.26Å; L191-L193 HydrophobicContact CG-CD1 3.64Å; L191-L193 HydrophobicContact CG-CD2 4.46Å; L191-L193 HydrophobicContact CG-CG 3.77Å; L191-L193 PolarHBondContact O-N 2.83Å; L191-Y198 PolarHBondContact N-O 3.11Å; L191-Y198 WeakPolarHBondContact O-CB 3.42Å; L191-Y198 PolarHBondContact O-N 3.25Å; L191-L209 HydrophobicContact CD2-CD1 4.5Å; L191-L209 HydrophobicContact CD2-CD2 4.3Å
192L89.3Confident85Confident102 Ų10265.6 Ų65.653%0.53434%0.338SS..EExtended strand (participates in β ladder)trans-85.6106.7179.1-17274.6000110.3K196L192-K196 WeakPolarHBondContact CA-O 3.27Å
193L90Very high85.2Confident0 Ų065.2 Ų65.20%034%0.341CS..EExtended strand (participates in β ladder)trans-132.8140.8179.1-64170.8000109.6D172 K175 L176 L191 G195 K196 Y198 F225D172-L193 HydrophobicContact CB-CD2 3.75Å; D172-L193 WeakPolarHBondContact O-CD2 3.37Å; K175-L193 HydrophobicContact CB-CD2 3.98Å; K175-L193 HydrophobicContact CD-CD2 4.4Å; L176-L193 HydrophobicContact CB-CD1 4.43Å; L176-L193 HydrophobicContact CB-CD2 4.33Å; L176-L193 HydrophobicContact CD1-CD1 4.15Å; L191-L193 HydrophobicContact CD1-CD1 4.3Å; L191-L193 HydrophobicContact CD1-CD2 4.32Å; L191-L193 HydrophobicContact CD1-CG 4.13Å; L191-L193 HydrophobicContact CD2-CD1 3.55Å; L191-L193 HydrophobicContact CD2-CG 4.26Å; L191-L193 HydrophobicContact CG-CD1 3.64Å; L191-L193 HydrophobicContact CG-CD2 4.46Å; L191-L193 HydrophobicContact CG-CG 3.77Å; L191-L193 PolarHBondContact O-N 2.83Å; L193-G195 PolarHBondContact O-N 3.13Å; L193-G195 VanDerWaalsContact O-N 3.1Å; L193-K196 PolarHBondContact N-O 3.05Å; L193-K196 CarbonylContact O-C 3.56Å; L193-K196 PolarHBondContact O-N 3.34Å; L193-Y198 HydrophobicContact CB-CD2 4.06Å; L193-Y198 HydrophobicContact CB-CE2 4.12Å; L193-Y198 WeakPolarHBondContact O-CE2 3.45Å; L193-F225 HydrophobicContact CD1-CE1 4.22Å; L193-F225 HydrophobicContact CD1-CZ 3.74Å
194W87.5Confident85.3Confident53 Ų5366.5 Ų66.520%0.20135%0.347CS..THydrogen-bonded Turntrans54.235.7173.2-43.3-47.4000113.3P168 D172 K196 Y198 F225 I250 F252P168-W194 HydrophobicContact CB-CZ2 4Å; P168-W194 HydrophobicContact CG-CZ2 3.84Å; D172-W194 WeakPolarHBondContact OD2-CA 3.31Å; D172-W194 VanDerWaalsContact OD2-CD1 3.29Å; D172-W194 PolarHBondContact OD2-N 3.06Å; W194-K196 PolarHBondContact O-N 3.48Å; W194-Y198 AromaticContact CE3-CE2 3.89Å; W194-Y198 HydrophobicContact CE3-CE2 3.89Å; W194-Y198 AromaticContact CE3-CZ 3.87Å; W194-Y198 HydrophobicContact CZ3-CE2 4.26Å; W194-F225 HydrophobicContact CH2-CD1 4.13Å; W194-F225 HydrophobicContact CH2-CD2 4.25Å; W194-F225 HydrophobicContact CH2-CE1 4.15Å; W194-F225 HydrophobicContact CH2-CE2 4.32Å; W194-F225 HydrophobicContact CH2-CG 4.17Å; W194-F225 HydrophobicContact CH2-CZ 4.26Å; W194-F225 AromaticContact CZ3-CD1 3.74Å; W194-F225 HydrophobicContact CZ3-CD1 3.74Å; W194-F225 AromaticContact CZ3-CE1 3.82Å; W194-F225 HydrophobicContact CZ3-CE1 3.82Å; W194-F225 HydrophobicContact CZ3-CG 4.18Å; W194-F225 HydrophobicContact CZ3-CZ 4.37Å; W194-I250 HydrophobicContact CH2-CG2 3.9Å; W194-I250 HydrophobicContact CZ2-CD1 4.23Å; W194-I250 HydrophobicContact CZ2-CG2 4.22Å; W194-F252 HydrophobicContact CD2-CZ 4.31Å; W194-F252 AromaticContact CE3-CE1 3.91Å; W194-F252 HydrophobicContact CE3-CE1 3.91Å; W194-F252 AromaticContact CE3-CZ 3.7Å; W194-F252 HydrophobicContact CE3-CZ 3.7Å; W194-F252 AromaticContact CH2-CE1 3.94Å; W194-F252 HydrophobicContact CH2-CE1 3.94Å; W194-F252 HydrophobicContact CH2-CE2 4.1Å; W194-F252 AromaticContact CH2-CZ 3.32Å; W194-F252 HydrophobicContact CH2-CZ 3.32Å; W194-F252 AromaticContact CZ2-CZ 3.98Å; W194-F252 HydrophobicContact CZ2-CZ 3.98Å; W194-F252 AromaticContact CZ3-CE1 3.37Å; W194-F252 HydrophobicContact CZ3-CE1 3.37Å; W194-F252 HydrophobicContact CZ3-CE2 4.33Å; W194-F252 AromaticContact CZ3-CZ 3.18Å; W194-F252 HydrophobicContact CZ3-CZ 3.18Å
195G84.5Confident84.9Confident77 Ų7767.7 Ų67.779%0.79435%0.352SS*.THydrogen-bonded Turntrans72.55.9-177.300000115.1L193L193-G195 PolarHBondContact O-N 3.13Å; L193-G195 VanDerWaalsContact O-N 3.1Å
196K87.3Confident84.5Confident88 Ų8866.1 Ų66.138%0.38334%0.344SS..EExtended strand (participates in β ladder)trans-122.4147.7-177.1-68.9174.1165.9-146.20111.2L192 L193 W194 Y198 E213L192-K196 WeakPolarHBondContact CA-O 3.27Å; L193-K196 PolarHBondContact N-O 3.05Å; L193-K196 CarbonylContact O-C 3.56Å; L193-K196 PolarHBondContact O-N 3.34Å; W194-K196 PolarHBondContact O-N 3.48Å; K196-Y198 HydrophobicContact CB-CD2 4.34Å; K196-Y198 HydrophobicContact CB-CE2 3.66Å; K196-Y198 WeakPolarHBondContact O-CD2 3.38Å; K196-E213 HydrophobicContact CD-CG 4.34Å; K196-E213 VanDerWaalsContact CD-OE1 3.28Å; K196-E213 WeakPolarHBondContact CD-OE1 3.35Å; K196-E213 WeakPolarHBondContact CE-OE1 3.28Å; K196-E213 IonicContact NZ-OE1 2.88Å; K196-E213 PolarHBondContact NZ-OE1 3.45Å; K196-E213 IonicContact NZ-OE2 3.01Å; K196-E213 PolarHBondContact NZ-OE2 3.13Å
197K89.4Confident84.6Confident86 Ų8666 Ų6637%0.37435%0.345SS..EExtended strand (participates in β ladder)trans-87.5134.3174.8-167.7-177.9-176.8-1390108.8G189 E214G189-K197 WeakPolarHBondContact O-CE 3.35Å; K197-E214 HydrophobicContact CB-CB 4.46Å; K197-E214 VanDerWaalsContact CD-OE2 3.25Å; K197-E214 WeakPolarHBondContact CD-OE2 3.29Å; K197-E214 WeakPolarHBondContact CE-OE2 3.46Å; K197-E214 IonicContact NZ-OE2 2.72Å; K197-E214 PolarHBondContact NZ-OE2 3.38Å; K197-E214 PolarHBondContact O-N 3.02Å
198Y91.7Very high85.4Confident5 Ų558.2 Ų58.22%0.0231%0.311CS..EExtended strand (participates in β ladder)trans-122.3139.4178.8-71.6-93.7000111.1G190 L191 L193 W194 K196 A211 I212 E213 F225G190-Y198 CarbonylContact C-O 3.59Å; G190-Y198 WeakPolarHBondContact CA-O 3.33Å; L191-Y198 PolarHBondContact N-O 3.11Å; L191-Y198 WeakPolarHBondContact O-CB 3.42Å; L191-Y198 PolarHBondContact O-N 3.25Å; L193-Y198 HydrophobicContact CB-CD2 4.06Å; L193-Y198 HydrophobicContact CB-CE2 4.12Å; L193-Y198 WeakPolarHBondContact O-CE2 3.45Å; W194-Y198 AromaticContact CE3-CE2 3.89Å; W194-Y198 HydrophobicContact CE3-CE2 3.89Å; W194-Y198 AromaticContact CE3-CZ 3.87Å; W194-Y198 HydrophobicContact CZ3-CE2 4.26Å; K196-Y198 HydrophobicContact CB-CD2 4.34Å; K196-Y198 HydrophobicContact CB-CE2 3.66Å; K196-Y198 WeakPolarHBondContact O-CD2 3.38Å; Y198-A211 HydrophobicContact CD1-CB 4.46Å; Y198-I212 CarbonylContact C-O 3.55Å; Y198-I212 VanDerWaalsContact CA-O 3.3Å; Y198-I212 WeakPolarHBondContact CA-O 3.42Å; Y198-I212 VanDerWaalsContact CD1-C 3.48Å; Y198-E213 HydrophobicContact CD1-CB 4.17Å; Y198-E213 VanDerWaalsContact CD1-N 3.3Å; Y198-E213 HydrophobicContact CE1-CB 3.83Å; Y198-F225 AromaticContact CD1-CD1 3.8Å; Y198-F225 HydrophobicContact CD1-CD1 3.8Å; Y198-F225 AromaticContact CD1-CE1 3.5Å; Y198-F225 HydrophobicContact CD1-CE1 3.5Å; Y198-F225 HydrophobicContact CD2-CE1 4.34Å; Y198-F225 AromaticContact CE1-CD1 3.69Å; Y198-F225 HydrophobicContact CE1-CD1 3.69Å; Y198-F225 AromaticContact CE1-CE1 3.78Å; Y198-F225 HydrophobicContact CE1-CE1 3.78Å; Y198-F225 AromaticContact CG-CE1 3.84Å; Y198-F225 HydrophobicContact CG-CE1 3.84Å
199R90.8Very high86.5Confident134 Ų13450.4 Ų50.451%0.50627%0.269SS..EExtended strand (participates in β ladder)trans-94.1124.9168.9-167.7174.263.5176.7-0109.5L201 A211 I212 E214R199-L201 PolarHBondContact O-N 3.41Å; R199-A211 CarbonylContact O-C 3.58Å; R199-A211 WeakPolarHBondContact O-CA 3.44Å; R199-A211 WeakPolarHBondContact O-CB 3.44Å; R199-I212 HydrophobicContact CB-CG2 4.17Å; R199-I212 PolarHBondContact N-O 3.47Å; R199-I212 PolarHBondContact O-N 3.22Å; R199-E214 HydrophobicContact CB-CG 3.7Å; R199-E214 WeakPolarHBondContact CB-OE1 3.4Å
200I91Very high87.7Confident41 Ų4148.7 Ų48.721%0.2125%0.247CC..EExtended strand (participates in β ladder)trans-68.3121.8172.4-59.7174.4000108.4P183 Y186 A203 L209P183-I200 HydrophobicContact CB-CD1 4.22Å; Y186-I200 HydrophobicContact CG-CD1 4.38Å; I200-A203 HydrophobicContact CG2-CB 4.27Å; I200-L209 HydrophobicContact CD1-CD1 3.75Å; I200-L209 HydrophobicContact CG1-CD1 4.08Å; I200-L209 HydrophobicContact CG1-CD2 4.41Å; I200-L209 HydrophobicContact CG1-CG 4.39Å; I200-L209 HydrophobicContact CG2-CD1 4.41Å; I200-L209 HydrophobicContact CG2-CG 4.2Å
201L90Very high88.1Confident53 Ų5348 Ų4828%0.27724%0.24SC..EExtended strand (participates in β ladder)trans-88.1-42174.5-65.7-179.3000111R199 M210 I212 T224R199-L201 PolarHBondContact O-N 3.41Å; L201-M210 HydrophobicContact CB-CE 3.82Å; L201-M210 HydrophobicContact CD1-CE 3.94Å; L201-M210 HydrophobicContact CD1-CG 4.49Å; L201-M210 PolarHBondContact N-O 3.07Å; L201-I212 HydrophobicContact CD1-CB 3.92Å; L201-I212 HydrophobicContact CD1-CG2 3.99Å; L201-I212 HydrophobicContact CD2-CG2 3.68Å; L201-I212 HydrophobicContact CG-CB 4.22Å; L201-I212 HydrophobicContact CG-CG2 3.83Å; L201-T224 HydrophobicContact CD1-CG2 4.48Å
202Y89.3Confident88.3Confident51 Ų5149 Ų4920%0.225%0.245CC..EExtended strand (participates in β ladder)trans-150.2147.5-177.5169.4-99.8000110D204 L209 M210Y202-D204 HydrophobicContact CE1-CB 4.11Å; Y202-D204 WeakPolarHBondContact OH-CB 3.3Å; Y202-L209 WeakPolarHBondContact O-CA 3.22Å; Y202-M210 PolarHBondContact N-O 2.97Å; Y202-M210 PolarHBondContact O-N 3.2Å
203A87.4Confident88.3Confident25 Ų2545.5 Ų45.521%0.20723%0.226CC..EExtended strand (participates in β ladder)trans-146.5132.1168.500000110P183 I200 T208P183-A203 HydrophobicContact CB-CB 3.53Å; P183-A203 HydrophobicContact CG-CB 3.69Å; I200-A203 HydrophobicContact CG2-CB 4.27Å; A203-T208 CarbonylContact C-O 3.49Å; A203-T208 VanDerWaalsContact CA-O 3.27Å; A203-T208 WeakPolarHBondContact CA-O 3.47Å
204D85.4Confident88.1Confident37 Ų3748.9 Ų48.920%0.19824%0.242CC..EExtended strand (participates in β ladder)trans-98.2114.1164.2-165.30.9000107.9P12 Y202 N206 Q207 T208P12-D204 VanDerWaalsContact CB-OD2 3.26Å; P12-D204 WeakPolarHBondContact CB-OD2 3.41Å; Y202-D204 HydrophobicContact CE1-CB 4.11Å; Y202-D204 WeakPolarHBondContact OH-CB 3.3Å; D204-N206 PolarHBondContact O-N 3.37Å; D204-Q207 HydrophobicContact CB-CB 4.44Å; D204-Q207 PolarHBondContact O-N 3.15Å; D204-T208 PolarHBondContact N-O 3.23Å; D204-T208 PolarHBondContact O-N 2.9Å; D204-T208 VanDerWaalsContact O-N 3.11Å
205Y74.8Confident87.4Confident136 Ų13648.2 Ų48.253%0.53325%0.245SC..THydrogen-bonded Turntrans-51.6126.9-170.9-72.6-81.8000110.8P183 Y184 Q207P183-Y205 HydrophobicContact CG-CD1 3.85Å; P183-Y205 HydrophobicContact CG-CE1 3.54Å; Y184-Y205 HydrophobicContact CD1-CE1 4.24Å; Y205-Q207 PolarHBondContact O-N 3.11Å
206N75.7Confident86.4Confident60 Ų6048.7 Ų48.732%0.32125%0.251SS..THydrogen-bonded Turntrans71.5-12.1-176.7-64.9-37.7000117.4Y133 I180 R181 D204 R229Y133-N206 PolarHBondContact OH-ND2 3.04Å; I180-N206 PolarHBondContact O-N 3.18Å; R181-N206 WeakPolarHBondContact CG-OD1 3.47Å; D204-N206 PolarHBondContact O-N 3.37Å; N206-R229 VanDerWaalsContact O-CZ 3.31Å; N206-R229 PolarHBondContact O-NE 3Å; N206-R229 PolarHBondContact O-NH2 3.08Å
207Q86.3Confident85.1Confident43 Ų4351 Ų5120%0.20127%0.271CS..THydrogen-bonded Turntrans-113.5-59.1-173.9-169.8175.7-15.400113.8D204 Y205 T228 R229D204-Q207 HydrophobicContact CB-CB 4.44Å; D204-Q207 PolarHBondContact O-N 3.15Å; Y205-Q207 PolarHBondContact O-N 3.11Å; Q207-T228 CarbonylContact O-C 3.5Å; Q207-T228 WeakPolarHBondContact O-CA 3.37Å; Q207-R229 PolarHBondContact O-N 3Å
208T91.3Very high83.6Confident0 Ų052 Ų520%028%0.281CS..EExtended strand (participates in β ladder)trans-134.6145.2-167.4-58.30000111A203 D204 T226 A227 T228 M267A203-T208 CarbonylContact C-O 3.49Å; A203-T208 VanDerWaalsContact CA-O 3.27Å; A203-T208 WeakPolarHBondContact CA-O 3.47Å; D204-T208 PolarHBondContact N-O 3.23Å; D204-T208 PolarHBondContact O-N 2.9Å; D204-T208 VanDerWaalsContact O-N 3.11Å; T208-T226 HydrophobicContact CG2-CG2 3.62Å; T208-A227 CarbonylContact C-O 3.55Å; T208-A227 VanDerWaalsContact CA-O 3.28Å; T208-A227 WeakPolarHBondContact CA-O 3.28Å; T208-T228 PolarHBondContact OG1-OG1 2.91Å; T208-M267 HydrophobicContact CG2-CE 3.81Å
209L93.5Very high82.2Confident0 Ų060.7 Ų60.70%032%0.319CS..EExtended strand (participates in β ladder)trans-138.8134.4171.7-179.6151.9000109.1L176 A179 I180 L191 I200 Y202 A211 F225 T226 A227L176-L209 HydrophobicContact CD1-CD2 4.11Å; A179-L209 HydrophobicContact CB-CD1 3.8Å; I180-L209 HydrophobicContact CB-CB 4.46Å; I180-L209 HydrophobicContact CG1-CB 3.58Å; I180-L209 HydrophobicContact CG1-CD1 4.24Å; L191-L209 HydrophobicContact CD2-CD1 4.5Å; L191-L209 HydrophobicContact CD2-CD2 4.3Å; I200-L209 HydrophobicContact CD1-CD1 3.75Å; I200-L209 HydrophobicContact CG1-CD1 4.08Å; I200-L209 HydrophobicContact CG1-CD2 4.41Å; I200-L209 HydrophobicContact CG1-CG 4.39Å; I200-L209 HydrophobicContact CG2-CD1 4.41Å; I200-L209 HydrophobicContact CG2-CG 4.2Å; Y202-L209 WeakPolarHBondContact O-CA 3.22Å; L209-A211 HydrophobicContact CD2-CB 3.88Å; L209-F225 HydrophobicContact CD2-CE2 4.12Å; L209-F225 HydrophobicContact CD2-CZ 4.14Å; L209-T226 CarbonylContact O-C 3.5Å; L209-T226 WeakPolarHBondContact O-CA 3.49Å; L209-A227 PolarHBondContact N-O 3.47Å; L209-A227 PolarHBondContact O-N 3.3Å
210M94.1Very high80.8Confident16 Ų1660.6 Ų60.68%0.07933%0.327CS..EExtended strand (participates in β ladder)trans-117.3132.2172-174.3174.269.700108.8L201 Y202 T224 F225L201-M210 HydrophobicContact CB-CE 3.82Å; L201-M210 HydrophobicContact CD1-CE 3.94Å; L201-M210 HydrophobicContact CD1-CG 4.49Å; L201-M210 PolarHBondContact N-O 3.07Å; Y202-M210 PolarHBondContact N-O 2.97Å; Y202-M210 PolarHBondContact O-N 3.2Å; M210-T224 HydrophobicContact CG-CG2 4.11Å; M210-T224 HydrophobicContact SD-CG2 4.42Å; M210-F225 WeakPolarHBondContact CA-O 3.13Å; M210-F225 WeakPolarHBondContact CG-O 3.35Å
211A93.1Very high79.6Confident0 Ų064.1 Ų64.10%035%0.346CS..EExtended strand (participates in β ladder)trans-142.1151.8179.900000112Y198 R199 L209 T224 F225Y198-A211 HydrophobicContact CD1-CB 4.46Å; R199-A211 CarbonylContact O-C 3.58Å; R199-A211 WeakPolarHBondContact O-CA 3.44Å; R199-A211 WeakPolarHBondContact O-CB 3.44Å; L209-A211 HydrophobicContact CD2-CB 3.88Å; A211-T224 WeakPolarHBondContact O-CA 3.43Å; A211-F225 HydrophobicContact CB-CD1 4.41Å; A211-F225 HydrophobicContact CB-CE1 3.75Å; A211-F225 HydrophobicContact CB-CZ 3.86Å; A211-F225 PolarHBondContact N-O 2.84Å; A211-F225 PolarHBondContact O-N 3.16Å
212I91.4Very high78.9Confident23 Ų2363.6 Ų63.612%0.11834%0.344CS..EExtended strand (participates in β ladder)trans-118.2139.1178.4-170.7166.4000109.6Y198 R199 L201 E214 L222 T224Y198-I212 CarbonylContact C-O 3.55Å; Y198-I212 VanDerWaalsContact CA-O 3.3Å; Y198-I212 WeakPolarHBondContact CA-O 3.42Å; Y198-I212 VanDerWaalsContact CD1-C 3.48Å; R199-I212 HydrophobicContact CB-CG2 4.17Å; R199-I212 PolarHBondContact N-O 3.47Å; R199-I212 PolarHBondContact O-N 3.22Å; L201-I212 HydrophobicContact CD1-CB 3.92Å; L201-I212 HydrophobicContact CD1-CG2 3.99Å; L201-I212 HydrophobicContact CD2-CG2 3.68Å; L201-I212 HydrophobicContact CG-CB 4.22Å; L201-I212 HydrophobicContact CG-CG2 3.83Å; I212-E214 PolarHBondContact O-N 3.24Å; I212-L222 HydrophobicContact CD1-CB 3.98Å; I212-L222 HydrophobicContact CD1-CD1 4.14Å; I212-L222 HydrophobicContact CG1-CB 3.77Å; I212-L222 HydrophobicContact CG1-CD1 4.3Å; I212-T224 WeakPolarHBondContact CG1-OG1 3.28Å
213E90Very high78.8Confident28 Ų2862.4 Ų62.413%0.13134%0.343CS..EExtended strand (participates in β ladder)trans-55.6132.4174.4-176.4174.4175.100110.4K196 Y198 L222 S223K196-E213 HydrophobicContact CD-CG 4.34Å; K196-E213 VanDerWaalsContact CD-OE1 3.28Å; K196-E213 WeakPolarHBondContact CD-OE1 3.35Å; K196-E213 WeakPolarHBondContact CE-OE1 3.28Å; K196-E213 IonicContact NZ-OE1 2.88Å; K196-E213 PolarHBondContact NZ-OE1 3.45Å; K196-E213 IonicContact NZ-OE2 3.01Å; K196-E213 PolarHBondContact NZ-OE2 3.13Å; Y198-E213 HydrophobicContact CD1-CB 4.17Å; Y198-E213 VanDerWaalsContact CD1-N 3.3Å; Y198-E213 HydrophobicContact CE1-CB 3.83Å; E213-L222 HydrophobicContact CB-CB 4.36Å; E213-L222 HydrophobicContact CB-CD2 4.41Å; E213-L222 HydrophobicContact CG-CD2 4.48Å; E213-L222 WeakPolarHBondContact O-CD1 3.43Å; E213-L222 WeakPolarHBondContact O-CD2 3.27Å; E213-S223 PolarHBondContact N-O 3.47Å; E213-S223 WeakPolarHBondContact OE2-CB 2.76Å; E213-S223 PolarHBondContact OE2-N 2.9Å
214E85.1Confident79Confident70 Ų7061.6 Ų61.633%0.32734%0.335SS..  trans-93.9116.7166.9-67.8-169.415400108K197 R199 I212K197-E214 HydrophobicContact CB-CB 4.46Å; K197-E214 VanDerWaalsContact CD-OE2 3.25Å; K197-E214 WeakPolarHBondContact CD-OE2 3.29Å; K197-E214 WeakPolarHBondContact CE-OE2 3.46Å; K197-E214 IonicContact NZ-OE2 2.72Å; K197-E214 PolarHBondContact NZ-OE2 3.38Å; K197-E214 PolarHBondContact O-N 3.02Å; R199-E214 HydrophobicContact CB-CG 3.7Å; R199-E214 WeakPolarHBondContact CB-OE1 3.4Å; I212-E214 PolarHBondContact O-N 3.24Å
215S73.2Confident79.5Confident39 Ų3959.8 Ų59.827%0.27333%0.326SS..  trans-113.7133168139.30000109.5V217 N218S215-V217 VanDerWaalsContact C-N 3.27Å; S215-V217 PolarHBondContact OG-N 3.21Å; S215-N218 WeakPolarHBondContact CB-O 3.15Å; S215-N218 VanDerWaalsContact OG-C 3.23Å; S215-N218 WeakPolarHBondContact OG-CA 3.06Å; S215-N218 PolarHBondContact OG-N 2.73Å; S215-N218 PolarHBondContact OG-O 2.85Å
216G62.9Low80.5Confident88 Ų8853.3 Ų53.391%0.90730%0.3SS*.SBendtrans-76.9-13.3175.200000113.6
217V61.1Low81.4Confident135 Ų13550.5 Ų50.582%0.81829%0.285SS*.SBendtrans-118.4-46.2-167.5-171.30000111.8S215S215-V217 VanDerWaalsContact C-N 3.27Å; S215-V217 PolarHBondContact OG-N 3.21Å
218N57.4Low81.7Confident107 Ų10748.4 Ų48.457%0.57228%0.275SS*.  trans-120.9111.8179.6-77-17.9000111S215 L222S215-N218 WeakPolarHBondContact CB-O 3.15Å; S215-N218 VanDerWaalsContact OG-C 3.23Å; S215-N218 WeakPolarHBondContact OG-CA 3.06Å; S215-N218 PolarHBondContact OG-N 2.73Å; S215-N218 PolarHBondContact OG-O 2.85Å; N218-L222 WeakPolarHBondContact O-CD2 3.19Å
219K63.5Low81.7Confident188 Ų18849.8 Ų49.882%0.81728%0.281SS*.  trans-80.7-6.7170.6-67.1-177.3179.6176.80113
220I60.9Low81.4Confident133 Ų13350.4 Ų50.468%0.68228%0.284SS*.THydrogen-bonded Turntrans-89.9135.1-179.3-56.5173000107.7
221N65.8Low80.7Confident114 Ų11454.9 Ų54.961%0.6131%0.305SS*.THydrogen-bonded Turntrans66.338.2178.1-55.7-16.6000115.5S223 Q255N221-S223 PolarHBondContact O-N 3.35Å; N221-Q255 PolarHBondContact O-NE2 3.07Å; N221-Q255 PolarHBondContact OD1-OE1 3.01Å
222L76Confident79.6Confident42 Ų4255.9 Ų55.922%0.2231%0.31CS..PPolyproline II helixtrans-66.3131.4172.1-59.9175.1000110.4I212 E213 N218 T224I212-L222 HydrophobicContact CD1-CB 3.98Å; I212-L222 HydrophobicContact CD1-CD1 4.14Å; I212-L222 HydrophobicContact CG1-CB 3.77Å; I212-L222 HydrophobicContact CG1-CD1 4.3Å; E213-L222 HydrophobicContact CB-CB 4.36Å; E213-L222 HydrophobicContact CB-CD2 4.41Å; E213-L222 HydrophobicContact CG-CD2 4.48Å; E213-L222 WeakPolarHBondContact O-CD1 3.43Å; E213-L222 WeakPolarHBondContact O-CD2 3.27Å; N218-L222 WeakPolarHBondContact O-CD2 3.19Å; L222-T224 PolarHBondContact O-N 2.82Å
223S86.8Confident78.2Confident26 Ų2658.5 Ų58.518%0.18233%0.328CS..PPolyproline II helixtrans-74.6118.6176.3-176.50000110.4E213 N221 F252E213-S223 PolarHBondContact N-O 3.47Å; E213-S223 WeakPolarHBondContact OE2-CB 2.76Å; E213-S223 PolarHBondContact OE2-N 2.9Å; N221-S223 PolarHBondContact O-N 3.35Å; S223-F252 WeakPolarHBondContact OG-CD1 3.44Å
224T91.7Very high76.6Confident8 Ų859.7 Ų59.75%0.04934%0.335CS..EExtended strand (participates in β ladder)trans-97.2140167.8-58.40000109.8L201 M210 A211 I212 L222 H253 Q259L201-T224 HydrophobicContact CD1-CG2 4.48Å; M210-T224 HydrophobicContact CG-CG2 4.11Å; M210-T224 HydrophobicContact SD-CG2 4.42Å; A211-T224 WeakPolarHBondContact O-CA 3.43Å; I212-T224 WeakPolarHBondContact CG1-OG1 3.28Å; L222-T224 PolarHBondContact O-N 2.82Å; T224-H253 PolarHBondContact O-N 3.3Å; T224-Q259 PolarHBondContact OG1-NE2 2.8Å
225F94.7Very high74.6Confident0 Ų064.9 Ų64.90%036%0.36CS..EExtended strand (participates in β ladder)trans-134.3152.9170.577-92.4000111.5L176 L193 W194 Y198 L209 M210 A211 A227 I250 G251 F252L176-F225 HydrophobicContact CD1-CE2 3.9Å; L176-F225 HydrophobicContact CD1-CZ 4.13Å; L176-F225 HydrophobicContact CD2-CE2 4.43Å; L193-F225 HydrophobicContact CD1-CE1 4.22Å; L193-F225 HydrophobicContact CD1-CZ 3.74Å; W194-F225 HydrophobicContact CH2-CD1 4.13Å; W194-F225 HydrophobicContact CH2-CD2 4.25Å; W194-F225 HydrophobicContact CH2-CE1 4.15Å; W194-F225 HydrophobicContact CH2-CE2 4.32Å; W194-F225 HydrophobicContact CH2-CG 4.17Å; W194-F225 HydrophobicContact CH2-CZ 4.26Å; W194-F225 AromaticContact CZ3-CD1 3.74Å; W194-F225 HydrophobicContact CZ3-CD1 3.74Å; W194-F225 AromaticContact CZ3-CE1 3.82Å; W194-F225 HydrophobicContact CZ3-CE1 3.82Å; W194-F225 HydrophobicContact CZ3-CG 4.18Å; W194-F225 HydrophobicContact CZ3-CZ 4.37Å; Y198-F225 AromaticContact CD1-CD1 3.8Å; Y198-F225 HydrophobicContact CD1-CD1 3.8Å; Y198-F225 AromaticContact CD1-CE1 3.5Å; Y198-F225 HydrophobicContact CD1-CE1 3.5Å; Y198-F225 HydrophobicContact CD2-CE1 4.34Å; Y198-F225 AromaticContact CE1-CD1 3.69Å; Y198-F225 HydrophobicContact CE1-CD1 3.69Å; Y198-F225 AromaticContact CE1-CE1 3.78Å; Y198-F225 HydrophobicContact CE1-CE1 3.78Å; Y198-F225 AromaticContact CG-CE1 3.84Å; Y198-F225 HydrophobicContact CG-CE1 3.84Å; L209-F225 HydrophobicContact CD2-CE2 4.12Å; L209-F225 HydrophobicContact CD2-CZ 4.14Å; M210-F225 WeakPolarHBondContact CA-O 3.13Å; M210-F225 WeakPolarHBondContact CG-O 3.35Å; A211-F225 HydrophobicContact CB-CD1 4.41Å; A211-F225 HydrophobicContact CB-CE1 3.75Å; A211-F225 HydrophobicContact CB-CZ 3.86Å; A211-F225 PolarHBondContact N-O 2.84Å; A211-F225 PolarHBondContact O-N 3.16Å; F225-A227 HydrophobicContact CD2-CB 4.23Å; F225-A227 HydrophobicContact CE2-CB 3.98Å; F225-I250 HydrophobicContact CD2-CG2 4.15Å; F225-G251 CarbonylContact C-O 3.56Å; F225-G251 VanDerWaalsContact CA-O 3.23Å; F225-G251 WeakPolarHBondContact CA-O 3.36Å; F225-F252 HydrophobicContact CB-CD1 3.9Å; F225-F252 HydrophobicContact CB-CE1 4.13Å; F225-F252 HydrophobicContact CB-CG 4.24Å
226T95.3Very high73.3Confident0 Ų069.1 Ų69.10%038%0.375CS..EExtended strand (participates in β ladder)trans-115.1131.9164.5-58.60000108.8T208 L209 I250 G251 H253 N263 I266T208-T226 HydrophobicContact CG2-CG2 3.62Å; L209-T226 CarbonylContact O-C 3.5Å; L209-T226 WeakPolarHBondContact O-CA 3.49Å; T226-I250 WeakPolarHBondContact O-CA 3.38Å; T226-G251 PolarHBondContact N-O 2.88Å; T226-G251 PolarHBondContact O-N 3.49Å; T226-H253 PolarHBondContact OG1-NE2 3.13Å; T226-N263 WeakPolarHBondContact CG2-OD1 3.47Å; T226-N263 PolarHBondContact OG1-OD1 2.92Å; T226-I266 HydrophobicContact CG2-CD1 4.45Å; T226-I266 HydrophobicContact CG2-CG2 4.17Å
227A95Very high72.5Confident0 Ų069 Ų690%035%0.348CS..EExtended strand (participates in β ladder)trans-114.9131170.600000109.6L176 I180 T208 L209 F225 L249 I250L176-A227 HydrophobicContact CD1-CB 3.96Å; L176-A227 HydrophobicContact CD2-CB 3.68Å; L176-A227 HydrophobicContact CG-CB 4.09Å; I180-A227 HydrophobicContact CD1-CB 4.2Å; T208-A227 CarbonylContact C-O 3.55Å; T208-A227 VanDerWaalsContact CA-O 3.28Å; T208-A227 WeakPolarHBondContact CA-O 3.28Å; L209-A227 PolarHBondContact N-O 3.47Å; L209-A227 PolarHBondContact O-N 3.3Å; F225-A227 HydrophobicContact CD2-CB 4.23Å; F225-A227 HydrophobicContact CE2-CB 3.98Å; A227-L249 CarbonylContact C-O 3.56Å; A227-L249 VanDerWaalsContact CA-O 3.27Å; A227-L249 WeakPolarHBondContact CA-O 3.46Å; A227-I250 HydrophobicContact CB-CG1 4.26Å
228T93.6Very high71.5Confident0 Ų070.3 Ų70.30%035%0.349CS..EExtended strand (participates in β ladder)trans-142.2142.7-175.2-176.80000110.9Q207 T208 M248 L249 I266 M270Q207-T228 CarbonylContact O-C 3.5Å; Q207-T228 WeakPolarHBondContact O-CA 3.37Å; T208-T228 PolarHBondContact OG1-OG1 2.91Å; T228-M248 CarbonylContact O-C 3.58Å; T228-M248 WeakPolarHBondContact O-CA 3.48Å; T228-L249 HydrophobicContact CG2-CB 3.95Å; T228-L249 HydrophobicContact CG2-CD2 4.39Å; T228-L249 PolarHBondContact N-O 3.49Å; T228-L249 PolarHBondContact O-N 3.45Å; T228-I266 HydrophobicContact CG2-CG2 3.74Å; T228-M270 HydrophobicContact CG2-CE 3.92Å; T228-M270 HydrophobicContact CG2-CG 3.29Å; T228-M270 HydrophobicContact CG2-SD 3.73Å
229R90.2Very high70.6Confident28 Ų2876.5 Ų76.511%0.10637%0.365CS..EExtended strand (participates in β ladder)trans-116.4135.8-173.7-59.4-174-68-161.1-1110.5C177 I180 N206 Q207 F246 V247 M248C177-R229 PolarHBondContact O-NH1 3.3Å; I180-R229 HydrophobicContact CD1-CG 4.04Å; I180-R229 VanDerWaalsContact CG2-CZ 3.49Å; N206-R229 VanDerWaalsContact O-CZ 3.31Å; N206-R229 PolarHBondContact O-NE 3Å; N206-R229 PolarHBondContact O-NH2 3.08Å; Q207-R229 PolarHBondContact O-N 3Å; R229-F246 HydrophobicContact CB-CD2 4.02Å; R229-F246 HydrophobicContact CB-CG 4.48Å; R229-F246 VanDerWaalsContact CD-CE2 3.48Å; R229-F246 HydrophobicContact CG-CD2 3.88Å; R229-F246 HydrophobicContact CG-CE2 3.95Å; R229-V247 CarbonylContact C-O 3.5Å; R229-V247 WeakPolarHBondContact CA-O 3.04Å; R229-M248 HydrophobicContact CG-CB 4.42Å; R229-M248 HydrophobicContact CG-CG 4.18Å; R229-M248 HydrophobicContact CG-SD 4.4Å
230L87.1Confident69.4Low13 Ų1369.5 Ų69.57%0.06834%0.339CS..EExtended strand (participates in β ladder)trans-118.6111.5170.8177.567.5000108.5I232 F246 V247 M270 L273 R274 L277L230-I232 PolarHBondContact O-N 3.4Å; L230-F246 CarbonylContact O-C 3.54Å; L230-F246 VanDerWaalsContact O-CA 3.27Å; L230-F246 WeakPolarHBondContact O-CA 3.34Å; L230-F246 WeakPolarHBondContact O-CB 3.46Å; L230-V247 PolarHBondContact N-O 3.18Å; L230-V247 PolarHBondContact O-N 3.39Å; L230-M270 HydrophobicContact CB-CE 3.44Å; L230-M270 VanDerWaalsContact CB-CE 3.44Å; L230-L273 HydrophobicContact CD2-CB 4.23Å; L230-R274 HydrophobicContact CD1-CB 3.85Å; L230-R274 HydrophobicContact CD1-CG 3.87Å; L230-R274 HydrophobicContact CD2-CB 3.93Å; L230-L277 HydrophobicContact CD2-CD1 3.79Å
231Q80.3Confident68.9Low111 Ų11172.5 Ų72.552%0.51935%0.351SS..EExtended strand (participates in β ladder)trans-60132.5172.7-173.3173.32.500109.5
232I70.4Confident68.1Low20 Ų2072.2 Ų72.210%0.10335%0.346CS..  trans-83124.3172-62.1169.8000106.3L89 L230 N234 Q245 V247L89-I232 HydrophobicContact CD1-CD1 4.38Å; L230-I232 PolarHBondContact O-N 3.4Å; I232-N234 PolarHBondContact O-N 2.85Å; I232-N234 VanDerWaalsContact O-N 3.12Å; I232-Q245 PolarHBondContact N-O 2.98Å; I232-V247 HydrophobicContact CD1-CG2 3.93Å; I232-V247 HydrophobicContact CG1-CG2 4.1Å
233P60.2Low67.4Low78 Ų7870.6 Ų70.651%0.50634%0.339SS..  trans-63.9115.9170.127.2-32.1000107.9T278P233-T278 HydrophobicContact CG-CG2 4.16Å
234N56.9Low66.7Low53 Ų5371.5 Ų71.528%0.28334%0.341SS..  trans-119.5121.3166.5-175.2-3.2000106.9I232 E236 Y237I232-N234 PolarHBondContact O-N 2.85Å; I232-N234 VanDerWaalsContact O-N 3.12Å; N234-E236 PolarHBondContact O-N 3.38Å; N234-E236 PolarHBondContact OD1-N 2.83Å; N234-E236 VanDerWaalsContact OD1-N 3.1Å; N234-Y237 WeakPolarHBondContact O-CB 3.23Å; N234-Y237 PolarHBondContact O-N 3.35Å
235E44.7Very low66Low180 Ų18073.6 Ų73.684%0.84135%0.35SS*.G310 helixtrans-60.6-27.6178.8-66.5-170.215900111.8Y237E235-Y237 VanDerWaalsContact C-N 3.26Å; E235-Y237 PolarHBondContact O-N 3.26Å
236E44.8Very low65.6Low128 Ų12874.1 Ų74.160%0.59835%0.353SS*.G310 helixtrans-73-18.5177-64.4-179.7154.200113N234 L238 R239 S240N234-E236 PolarHBondContact O-N 3.38Å; N234-E236 PolarHBondContact OD1-N 2.83Å; N234-E236 VanDerWaalsContact OD1-N 3.1Å; E236-L238 PolarHBondContact O-N 3Å; E236-L238 VanDerWaalsContact O-N 3.11Å; E236-R239 PolarHBondContact O-N 3.36Å; E236-S240 PolarHBondContact O-N 3.35Å; E236-S240 PolarHBondContact O-OG 2.96Å
237Y46.6Very low65.3Low85 Ų8574.2 Ų74.233%0.33335%0.354SS..G310 helixtrans-62.9-23.8-175.3-169.3-97.5000113.6N234 E235 R239 L244N234-Y237 WeakPolarHBondContact O-CB 3.23Å; N234-Y237 PolarHBondContact O-N 3.35Å; E235-Y237 VanDerWaalsContact C-N 3.26Å; E235-Y237 PolarHBondContact O-N 3.26Å; Y237-R239 PolarHBondContact O-N 2.73Å; Y237-L244 HydrophobicContact CE2-CD2 4.38Å; Y237-L244 WeakPolarHBondContact OH-CD2 3.5Å; Y237-L244 WeakPolarHBondContact OH-CG 3.42Å
238L39.6Very low65.1Low162 Ų16274.2 Ų74.285%0.84835%0.354SS*.G310 helixtrans-72-11.2176.9-75167.2000113E236E236-L238 PolarHBondContact O-N 3Å; E236-L238 VanDerWaalsContact O-N 3.11Å
239R38.3Very low65.2Low238 Ų23874.2 Ų74.290%0.89835%0.354SS*.THydrogen-bonded Turntrans-124.4-16.3-168.8-68.9-172.7176.8-179.51.1115.9E236 Y237E236-R239 PolarHBondContact O-N 3.36Å; Y237-R239 PolarHBondContact O-N 2.73Å
240S38.8Very low65.4Low40 Ų4072.9 Ų72.928%0.2835%0.349SS..  trans-111.1148.2-170.858.20000113.1E236 E242E236-S240 PolarHBondContact O-N 3.35Å; E236-S240 PolarHBondContact O-OG 2.96Å; S240-E242 VanDerWaalsContact CB-OE2 3.23Å; S240-E242 WeakPolarHBondContact CB-OE2 3.16Å; S240-E242 PolarHBondContact O-N 2.85Å; S240-E242 VanDerWaalsContact OG-CB 3.29Å; S240-E242 WeakPolarHBondContact OG-CB 3.35Å; S240-E242 VanDerWaalsContact OG-CD 3.26Å; S240-E242 WeakPolarHBondContact OG-CG 3.47Å; S240-E242 PolarHBondContact OG-OE2 2.89Å
241E49.3Very low65.8Low197 Ų19772.3 Ų72.392%0.92135%0.345SS*.SBendtrans-64.811.7164.3-62.3-177157.300112
242E50.6Low66.4Low108 Ų10868.1 Ų68.151%0.50533%0.326SS..PPolyproline II helixtrans-79142.1-173-66.9163.7169.200110.4S240S240-E242 VanDerWaalsContact CB-OE2 3.23Å; S240-E242 WeakPolarHBondContact CB-OE2 3.16Å; S240-E242 PolarHBondContact O-N 2.85Å; S240-E242 VanDerWaalsContact OG-CB 3.29Å; S240-E242 WeakPolarHBondContact OG-CB 3.35Å; S240-E242 VanDerWaalsContact OG-CD 3.26Å; S240-E242 WeakPolarHBondContact OG-CG 3.47Å; S240-E242 PolarHBondContact OG-OE2 2.89Å
243G60.5Low67.5Low7 Ų767.6 Ų67.67%0.07232%0.322CS..PPolyproline II helixtrans-56.5158.7-170.500000115.5L115 Q245L115-G243 CarbonylContact O-C 3.57Å; L115-G243 VanDerWaalsContact O-C 3.27Å; L115-G243 WeakPolarHBondContact O-CA 3.33Å; G243-Q245 PolarHBondContact O-N 2.89Å
244L71.9Confident68.8Low45 Ų4565.1 Ų65.124%0.23630%0.303CS..EExtended strand (participates in β ladder)trans-60.4118.6170.5-79.7156.2000109.9S114 L115 Y139 Y237 F246S114-L244 CarbonylContact C-O 3.55Å; S114-L244 WeakPolarHBondContact CA-O 3.21Å; L115-L244 HydrophobicContact CB-CB 4.16Å; L115-L244 PolarHBondContact N-O 2.86Å; L115-L244 PolarHBondContact O-N 3.18Å; Y139-L244 HydrophobicContact CD1-CD1 4.34Å; Y139-L244 HydrophobicContact CE1-CD1 3.61Å; Y237-L244 HydrophobicContact CE2-CD2 4.38Å; Y237-L244 WeakPolarHBondContact OH-CD2 3.5Å; Y237-L244 WeakPolarHBondContact OH-CG 3.42Å; L244-F246 HydrophobicContact CB-CD1 4.46Å; L244-F246 HydrophobicContact CB-CE1 4.44Å
245Q78Confident70.2Confident52 Ų5267.5 Ų67.524%0.24331%0.313CS..EExtended strand (participates in β ladder)trans-105.1130.8175-64.1-176.63.500111.1I113 I232 G243I113-Q245 WeakPolarHBondContact O-CA 3.39Å; I232-Q245 PolarHBondContact N-O 2.98Å; G243-Q245 PolarHBondContact O-N 2.89Å
246F85Confident72.1Confident12 Ų1263.3 Ų63.35%0.05330%0.296CS..EExtended strand (participates in β ladder)trans-155.1160.9178.253.2-88.2000112I113 L115 R229 L230 L244 M248I113-F246 HydrophobicContact CB-CD2 4.25Å; I113-F246 HydrophobicContact CB-CE2 3.77Å; I113-F246 HydrophobicContact CB-CZ 3.94Å; I113-F246 HydrophobicContact CD1-CE2 4.09Å; I113-F246 HydrophobicContact CG1-CE2 4.36Å; I113-F246 HydrophobicContact CG2-CE1 4.29Å; I113-F246 HydrophobicContact CG2-CE2 3.99Å; I113-F246 HydrophobicContact CG2-CZ 3.66Å; I113-F246 PolarHBondContact N-O 2.92Å; I113-F246 PolarHBondContact O-N 2.79Å; L115-F246 HydrophobicContact CB-CE1 4.39Å; L115-F246 HydrophobicContact CD1-CE1 3.46Å; L115-F246 VanDerWaalsContact CD1-CE1 3.46Å; L115-F246 HydrophobicContact CD1-CZ 3.6Å; L115-F246 HydrophobicContact CG-CE1 3.6Å; L115-F246 HydrophobicContact CG-CZ 3.76Å; R229-F246 HydrophobicContact CB-CD2 4.02Å; R229-F246 HydrophobicContact CB-CG 4.48Å; R229-F246 VanDerWaalsContact CD-CE2 3.48Å; R229-F246 HydrophobicContact CG-CD2 3.88Å; R229-F246 HydrophobicContact CG-CE2 3.95Å; L230-F246 CarbonylContact O-C 3.54Å; L230-F246 VanDerWaalsContact O-CA 3.27Å; L230-F246 WeakPolarHBondContact O-CA 3.34Å; L230-F246 WeakPolarHBondContact O-CB 3.46Å; L244-F246 HydrophobicContact CB-CD1 4.46Å; L244-F246 HydrophobicContact CB-CE1 4.44Å; F246-M248 HydrophobicContact CD2-CB 4.12Å; F246-M248 HydrophobicContact CE2-CB 4.05Å
247V89Confident74Confident2 Ų262.3 Ų62.31%0.01229%0.287CS..EExtended strand (participates in β ladder)trans-90.1131.6163.1178.70000108.7L110 F111 I147 R229 L230 I232 L277L110-V247 HydrophobicContact CD1-CG1 3.3Å; L110-V247 HydrophobicContact CD2-CG1 4.24Å; L110-V247 HydrophobicContact CG-CG1 3.67Å; F111-V247 CarbonylContact O-C 3.45Å; F111-V247 VanDerWaalsContact O-CA 3.24Å; F111-V247 WeakPolarHBondContact O-CA 3.27Å; I147-V247 HydrophobicContact CD1-CG1 4.16Å; I147-V247 HydrophobicContact CD1-CG2 4.28Å; R229-V247 CarbonylContact C-O 3.5Å; R229-V247 WeakPolarHBondContact CA-O 3.04Å; L230-V247 PolarHBondContact N-O 3.18Å; L230-V247 PolarHBondContact O-N 3.39Å; I232-V247 HydrophobicContact CD1-CG2 3.93Å; I232-V247 HydrophobicContact CG1-CG2 4.1Å; V247-L277 HydrophobicContact CG2-CD1 4.03Å
248M92.3Very high76Confident0 Ų063.6 Ų63.60%030%0.296CS..EExtended strand (participates in β ladder)trans-115.4123174.2-175.3167.272.200110.4L110 F111 I113 C173 L176 I180 T228 R229 F246 I250L110-M248 WeakPolarHBondContact CA-O 2.85Å; F111-M248 HydrophobicContact CD2-CE 4.33Å; F111-M248 PolarHBondContact N-O 3.23Å; F111-M248 PolarHBondContact O-N 2.85Å; I113-M248 HydrophobicContact CD1-CB 3.86Å; I113-M248 HydrophobicContact CD1-CE 3.32Å; I113-M248 HydrophobicContact CD1-SD 4.14Å; C173-M248 HydrophobicContact CB-CE 3.88Å; L176-M248 HydrophobicContact CD2-CE 4.31Å; L176-M248 HydrophobicContact CD2-SD 4.27Å; I180-M248 HydrophobicContact CD1-SD 4.43Å; T228-M248 CarbonylContact O-C 3.58Å; T228-M248 WeakPolarHBondContact O-CA 3.48Å; R229-M248 HydrophobicContact CG-CB 4.42Å; R229-M248 HydrophobicContact CG-CG 4.18Å; R229-M248 HydrophobicContact CG-SD 4.4Å; F246-M248 HydrophobicContact CD2-CB 4.12Å; F246-M248 HydrophobicContact CE2-CB 4.05Å; M248-I250 HydrophobicContact CE-CD1 3.85Å; M248-I250 HydrophobicContact CE-CG1 4.25Å; M248-I250 HydrophobicContact CG-CG1 4.25Å
249L94.6Very high78.4Confident0 Ų059.6 Ų59.60%027%0.273CS..EExtended strand (participates in β ladder)trans-102.3125.9172.4-172.4160.1000109L97 V108 F109 L110 A227 T228 I266 V269 M270 L273L97-L249 HydrophobicContact CD2-CD1 4.07Å; V108-L249 HydrophobicContact CG2-CD1 4.36Å; V108-L249 HydrophobicContact CG2-CD2 3.74Å; V108-L249 HydrophobicContact CG2-CG 3.87Å; F109-L249 CarbonylContact O-C 3.6Å; F109-L249 WeakPolarHBondContact O-CA 3.41Å; L110-L249 HydrophobicContact CD1-CB 3.73Å; L110-L249 HydrophobicContact CD1-CD1 4.22Å; L110-L249 HydrophobicContact CD1-CG 4.15Å; A227-L249 CarbonylContact C-O 3.56Å; A227-L249 VanDerWaalsContact CA-O 3.27Å; A227-L249 WeakPolarHBondContact CA-O 3.46Å; T228-L249 HydrophobicContact CG2-CB 3.95Å; T228-L249 HydrophobicContact CG2-CD2 4.39Å; T228-L249 PolarHBondContact N-O 3.49Å; T228-L249 PolarHBondContact O-N 3.45Å; L249-I266 HydrophobicContact CD2-CG1 4.31Å; L249-I266 HydrophobicContact CD2-CG2 3.74Å; L249-V269 HydrophobicContact CD1-CB 4.42Å; L249-V269 HydrophobicContact CD1-CG1 3.71Å; L249-M270 HydrophobicContact CB-CE 4.5Å; L249-M270 HydrophobicContact CB-SD 3.51Å; L249-M270 VanDerWaalsContact CB-SD 3.51Å; L249-M270 HydrophobicContact CD1-CG 4.38Å; L249-M270 HydrophobicContact CD1-SD 3.77Å; L249-M270 HydrophobicContact CG-SD 4.27Å; L249-L273 HydrophobicContact CD1-CD1 4.41Å
250I95.2Very high80.9Confident0 Ų051.6 Ų51.60%025%0.248CC..EExtended strand (participates in β ladder)trans-115.8113.6171.6-52.3-179.8000107.9V108 F109 F111 P168 L176 W194 F225 T226 A227 M248 F252V108-I250 CarbonylContact C-O 3.56Å; V108-I250 VanDerWaalsContact CA-O 3.28Å; V108-I250 WeakPolarHBondContact CA-O 3.27Å; F109-I250 PolarHBondContact N-O 2.93Å; F109-I250 PolarHBondContact O-N 2.97Å; F111-I250 HydrophobicContact CD2-CD1 4.32Å; F111-I250 HydrophobicContact CD2-CG1 4.5Å; F111-I250 HydrophobicContact CE2-CD1 3.85Å; F111-I250 HydrophobicContact CE2-CG1 4.27Å; P168-I250 HydrophobicContact CB-CD1 4.2Å; P168-I250 HydrophobicContact CG-CD1 4.17Å; L176-I250 HydrophobicContact CD2-CD1 3.56Å; L176-I250 HydrophobicContact CD2-CG1 4.08Å; W194-I250 HydrophobicContact CH2-CG2 3.9Å; W194-I250 HydrophobicContact CZ2-CD1 4.23Å; W194-I250 HydrophobicContact CZ2-CG2 4.22Å; F225-I250 HydrophobicContact CD2-CG2 4.15Å; T226-I250 WeakPolarHBondContact O-CA 3.38Å; A227-I250 HydrophobicContact CB-CG1 4.26Å; M248-I250 HydrophobicContact CE-CD1 3.85Å; M248-I250 HydrophobicContact CE-CG1 4.25Å; M248-I250 HydrophobicContact CG-CG1 4.25Å; I250-F252 HydrophobicContact CG2-CD2 4.48Å; I250-F252 HydrophobicContact CG2-CE2 3.96Å; I250-F252 HydrophobicContact CG2-CZ 4.5Å
251G94.3Very high83.4Confident0 Ų054.3 Ų54.30%026%0.255CS..EExtended strand (participates in β ladder)trans-117.5123.5179.600000111.9F225 T226F225-G251 CarbonylContact C-O 3.56Å; F225-G251 VanDerWaalsContact CA-O 3.23Å; F225-G251 WeakPolarHBondContact CA-O 3.36Å; T226-G251 PolarHBondContact N-O 2.88Å; T226-G251 PolarHBondContact O-N 3.49Å
252F93.1Very high85.5Confident24 Ų2445 Ų4511%0.10521%0.211CC..EExtended strand (participates in β ladder)trans-89.8118.4175.4-69-95.8000110.2I105 D106 K107 F109 W194 S223 F225 I250I105-F252 WeakPolarHBondContact CA-O 3.39Å; I105-F252 VanDerWaalsContact CG2-O 3.31Å; I105-F252 WeakPolarHBondContact CG2-O 3.32Å; D106-F252 PolarHBondContact N-O 3.25Å; K107-F252 HydrophobicContact CB-CB 4.19Å; K107-F252 HydrophobicContact CB-CD2 4.01Å; K107-F252 HydrophobicContact CB-CG 4.4Å; K107-F252 PolarHBondContact O-N 2.87Å; F109-F252 HydrophobicContact CD2-CD2 4.45Å; F109-F252 HydrophobicContact CD2-CE2 4.1Å; F109-F252 HydrophobicContact CE2-CD2 4.2Å; F109-F252 AromaticContact CE2-CE2 3.83Å; F109-F252 HydrophobicContact CE2-CE2 3.83Å; W194-F252 HydrophobicContact CD2-CZ 4.31Å; W194-F252 AromaticContact CE3-CE1 3.91Å; W194-F252 HydrophobicContact CE3-CE1 3.91Å; W194-F252 AromaticContact CE3-CZ 3.7Å; W194-F252 HydrophobicContact CE3-CZ 3.7Å; W194-F252 AromaticContact CH2-CE1 3.94Å; W194-F252 HydrophobicContact CH2-CE1 3.94Å; W194-F252 HydrophobicContact CH2-CE2 4.1Å; W194-F252 AromaticContact CH2-CZ 3.32Å; W194-F252 HydrophobicContact CH2-CZ 3.32Å; W194-F252 AromaticContact CZ2-CZ 3.98Å; W194-F252 HydrophobicContact CZ2-CZ 3.98Å; W194-F252 AromaticContact CZ3-CE1 3.37Å; W194-F252 HydrophobicContact CZ3-CE1 3.37Å; W194-F252 HydrophobicContact CZ3-CE2 4.33Å; W194-F252 AromaticContact CZ3-CZ 3.18Å; W194-F252 HydrophobicContact CZ3-CZ 3.18Å; S223-F252 WeakPolarHBondContact OG-CD1 3.44Å; F225-F252 HydrophobicContact CB-CD1 3.9Å; F225-F252 HydrophobicContact CB-CE1 4.13Å; F225-F252 HydrophobicContact CB-CG 4.24Å; I250-F252 HydrophobicContact CG2-CD2 4.48Å; I250-F252 HydrophobicContact CG2-CE2 3.96Å; I250-F252 HydrophobicContact CG2-CZ 4.5Å
253H92.8Very high87.5Confident8 Ų841.2 Ų41.24%0.03719%0.194CC..EExtended strand (participates in β ladder)trans-67.4141.8-172.6-66.1-161.1000110.6T224 T226 C262T224-H253 PolarHBondContact O-N 3.3Å; T226-H253 PolarHBondContact OG1-NE2 3.13Å; H253-C262 HydrophobicContact CB-CB 3.92Å; H253-C262 VanDerWaalsContact CG-CB 3.44Å; H253-C262 VanDerWaalsContact ND1-CB 3.34Å; H253-C262 WeakPolarHBondContact ND1-CB 3.19Å
254R89.1Confident89Confident26 Ų2643.8 Ų43.810%0.09822%0.215CC..PPolyproline II helixtrans-62.5134.7164.3-84.3-179.770.9145.63.7110.6Y104 D106 D256 R257Y104-R254 VanDerWaalsContact O-CB 3.28Å; Y104-R254 WeakPolarHBondContact O-CB 3.5Å; Y104-R254 WeakPolarHBondContact O-CG 3.44Å; Y104-R254 PolarHBondContact O-N 2.87Å; D106-R254 VanDerWaalsContact OD1-CG 3.28Å; D106-R254 WeakPolarHBondContact OD1-CG 3.39Å; D106-R254 WeakPolarHBondContact OD2-CA 3.4Å; R254-D256 VanDerWaalsContact C-N 3.33Å; R254-D256 WeakPolarHBondContact CB-OD1 3.42Å; R254-D256 IonicContact CZ-OD1 2.77Å; R254-D256 IonicContact CZ-OD2 3.66Å; R254-D256 IonicContact NE-OD1 3.35Å; R254-D256 PolarHBondContact NE-OD1 2.81Å; R254-D256 IonicContact NE-OD2 2.73Å; R254-D256 IonicContact NH2-OD1 3.53Å; R254-D256 PolarHBondContact NH2-OD1 2.78Å; R254-D256 IonicContact NH2-OD2 3.59Å; R254-D256 PolarHBondContact NH2-OD2 2.77Å; R254-R257 HydrophobicContact CB-CB 4.09Å; R254-R257 HydrophobicContact CB-CG 3.79Å; R254-R257 PolarHBondContact O-N 3Å
255Q85.2Confident90Very high104 Ų10442.5 Ų42.549%0.48621%0.211SC..THydrogen-bonded Turntrans-73.2-25.3-179.6-63.8-174.1-15.400113.2N221 R257N221-Q255 PolarHBondContact O-NE2 3.07Å; N221-Q255 PolarHBondContact OD1-OE1 3.01Å; Q255-R257 PolarHBondContact O-N 3.2Å
256D84.5Confident90.8Very high92 Ų9240 Ų4049%0.49220%0.199SC..THydrogen-bonded Turntrans-85.610.2177.868.5-40000113.4R254R254-D256 VanDerWaalsContact C-N 3.33Å; R254-D256 WeakPolarHBondContact CB-OD1 3.42Å; R254-D256 IonicContact CZ-OD1 2.77Å; R254-D256 IonicContact CZ-OD2 3.66Å; R254-D256 IonicContact NE-OD1 3.35Å; R254-D256 PolarHBondContact NE-OD1 2.81Å; R254-D256 IonicContact NE-OD2 2.73Å; R254-D256 IonicContact NH2-OD1 3.53Å; R254-D256 PolarHBondContact NH2-OD1 2.78Å; R254-D256 IonicContact NH2-OD2 3.59Å; R254-D256 PolarHBondContact NH2-OD2 2.77Å
257R86.2Confident91.1Very high107 Ų10740.7 Ų40.740%0.40420%0.203SC..SBendtrans-124.5149.1-178.6-64.4-60.1-166.6-163.5-2.4111.1N103 R254 Q255 Q259 C262N103-R257 PolarHBondContact O-NE 2.89Å; R254-R257 HydrophobicContact CB-CB 4.09Å; R254-R257 HydrophobicContact CB-CG 3.79Å; R254-R257 PolarHBondContact O-N 3Å; Q255-R257 PolarHBondContact O-N 3.2Å; R257-Q259 PolarHBondContact O-N 3.43Å; R257-C262 VanDerWaalsContact CB-SG 3.55Å
258E88.7Confident91.3Very high112 Ų11242.1 Ų42.152%0.52322%0.218SC..  trans-63132.9172.2-69.6160.8-142.200110.5D260 K261 C262E258-D260 PolarHBondContact O-N 3.44Å; E258-K261 HydrophobicContact CB-CB 4.4Å; E258-K261 HydrophobicContact CB-CD 4.14Å; E258-K261 HydrophobicContact CB-CG 4.18Å; E258-K261 WeakPolarHBondContact O-CB 3.4Å; E258-K261 PolarHBondContact O-N 2.94Å; E258-K261 IonicContact OE1-NZ 3.67Å; E258-K261 PolarHBondContact OE1-NZ 2.84Å; E258-K261 WeakPolarHBondContact OE2-CD 3.34Å; E258-K261 WeakPolarHBondContact OE2-CE 3.19Å; E258-K261 IonicContact OE2-NZ 2.85Å; E258-K261 PolarHBondContact OE2-NZ 2.91Å; E258-C262 PolarHBondContact O-N 3.29Å; E258-C262 VanDerWaalsContact O-N 3.13Å; E258-C262 PolarHBondContact O-SG 2.82Å
259Q89.6Confident91.3Very high77 Ų7742.2 Ų42.236%0.3622%0.219SC..Hα-helixtrans-55.7-38-178.6-66.6180-12.100112.3T224 R257 K261 C262 N263T224-Q259 PolarHBondContact OG1-NE2 2.8Å; R257-Q259 PolarHBondContact O-N 3.43Å; Q259-K261 VanDerWaalsContact C-N 3.33Å; Q259-K261 PolarHBondContact O-N 2.74Å; Q259-C262 PolarHBondContact O-N 3.1Å; Q259-N263 WeakPolarHBondContact O-CB 3.28Å; Q259-N263 PolarHBondContact O-N 2.85Å
260D89.4Confident91.1Very high70 Ų7042.5 Ų42.537%0.37422%0.22SC..Hα-helixtrans-63.2-38.4178-70.2-23.4000112.2E258 N263 A264E258-D260 PolarHBondContact O-N 3.44Å; D260-N263 PolarHBondContact O-N 2.88Å; D260-A264 VanDerWaalsContact O-CB 3.3Å; D260-A264 WeakPolarHBondContact O-CB 3.4Å; D260-A264 PolarHBondContact O-N 3.42Å
261K92.9Very high90.7Very high98 Ų9845.6 Ų45.643%0.42624%0.237SC..Hα-helixtrans-69.5-40.9176.9-69.3177.3177.7152.80111.3Y104 E258 Q259 A264 A265Y104-K261 HydrophobicContact CD1-CB 4.12Å; Y104-K261 HydrophobicContact CE1-CB 3.96Å; E258-K261 HydrophobicContact CB-CB 4.4Å; E258-K261 HydrophobicContact CB-CD 4.14Å; E258-K261 HydrophobicContact CB-CG 4.18Å; E258-K261 WeakPolarHBondContact O-CB 3.4Å; E258-K261 PolarHBondContact O-N 2.94Å; E258-K261 IonicContact OE1-NZ 3.67Å; E258-K261 PolarHBondContact OE1-NZ 2.84Å; E258-K261 WeakPolarHBondContact OE2-CD 3.34Å; E258-K261 WeakPolarHBondContact OE2-CE 3.19Å; E258-K261 IonicContact OE2-NZ 2.85Å; E258-K261 PolarHBondContact OE2-NZ 2.91Å; Q259-K261 VanDerWaalsContact C-N 3.33Å; Q259-K261 PolarHBondContact O-N 2.74Å; K261-A264 PolarHBondContact O-N 3.24Å; K261-A265 PolarHBondContact O-N 3.37Å
262C92.9Very high90.5Very high0 Ų048.7 Ų48.70%025%0.253CS..Hα-helixtrans-62-45.6174.5-62.70000111.7Y104 I105 H253 R257 E258 Q259 A265 I266Y104-C262 PolarHBondContact O-SG 3.38Å; I105-C262 HydrophobicContact CD1-CB 4.2Å; H253-C262 HydrophobicContact CB-CB 3.92Å; H253-C262 VanDerWaalsContact CG-CB 3.44Å; H253-C262 VanDerWaalsContact ND1-CB 3.34Å; H253-C262 WeakPolarHBondContact ND1-CB 3.19Å; R257-C262 VanDerWaalsContact CB-SG 3.55Å; E258-C262 PolarHBondContact O-N 3.29Å; E258-C262 VanDerWaalsContact O-N 3.13Å; E258-C262 PolarHBondContact O-SG 2.82Å; Q259-C262 PolarHBondContact O-N 3.1Å; C262-A265 PolarHBondContact O-N 2.91Å; C262-I266 PolarHBondContact O-N 2.93Å; C262-I266 VanDerWaalsContact O-N 3.11Å
263N92.2Very high90.1Very high29 Ų2947.6 Ų47.616%0.15525%0.248CC..Hα-helixtrans-65-43.1178.1-169.761000111.9T226 Q259 D260 A265 I266 M267T226-N263 WeakPolarHBondContact CG2-OD1 3.47Å; T226-N263 PolarHBondContact OG1-OD1 2.92Å; Q259-N263 WeakPolarHBondContact O-CB 3.28Å; Q259-N263 PolarHBondContact O-N 2.85Å; D260-N263 PolarHBondContact O-N 2.88Å; N263-A265 VanDerWaalsContact C-N 3.32Å; N263-A265 PolarHBondContact O-N 2.89Å; N263-I266 PolarHBondContact O-N 3.29Å; N263-M267 WeakPolarHBondContact O-CG 3.43Å; N263-M267 PolarHBondContact O-N 3.14Å
264A92.1Very high89.7Confident62 Ų6251.6 Ų51.651%0.51226%0.263SS..Hα-helixtrans-60-40.7175.900000112.3D260 K261 M267 G268D260-A264 VanDerWaalsContact O-CB 3.3Å; D260-A264 WeakPolarHBondContact O-CB 3.4Å; D260-A264 PolarHBondContact O-N 3.42Å; K261-A264 PolarHBondContact O-N 3.24Å; A264-M267 PolarHBondContact O-N 3.47Å; A264-G268 PolarHBondContact O-N 3.41Å
265A93.6Very high89.3Confident17 Ų1756 Ų5614%0.1428%0.283CS..Hα-helixtrans-62.9-44.8175.800000112L101 Y104 K261 C262 N263 G268 V269L101-A265 HydrophobicContact CD2-CB 3.97Å; Y104-A265 HydrophobicContact CD1-CB 4.45Å; Y104-A265 HydrophobicContact CD2-CB 3.6Å; Y104-A265 HydrophobicContact CE2-CB 4.24Å; Y104-A265 HydrophobicContact CG-CB 3.72Å; K261-A265 PolarHBondContact O-N 3.37Å; C262-A265 PolarHBondContact O-N 2.91Å; N263-A265 VanDerWaalsContact C-N 3.32Å; N263-A265 PolarHBondContact O-N 2.89Å; A265-G268 PolarHBondContact O-N 3.42Å; A265-V269 WeakPolarHBondContact O-CG2 3.41Å; A265-V269 PolarHBondContact O-N 3.3Å
266I93.8Very high89.1Confident0 Ų057.3 Ų57.30%029%0.287CS..Hα-helixtrans-60.1-47.3175.8-72.8172000111.2L101 I105 T226 T228 L249 C262 N263 G268 V269 M270L101-I266 HydrophobicContact CD2-CG1 4.45Å; I105-I266 HydrophobicContact CD1-CD1 3.6Å; I105-I266 HydrophobicContact CD1-CG1 3.8Å; I105-I266 HydrophobicContact CG1-CD1 4.43Å; I105-I266 HydrophobicContact CG1-CG1 4.17Å; T226-I266 HydrophobicContact CG2-CD1 4.45Å; T226-I266 HydrophobicContact CG2-CG2 4.17Å; T228-I266 HydrophobicContact CG2-CG2 3.74Å; L249-I266 HydrophobicContact CD2-CG1 4.31Å; L249-I266 HydrophobicContact CD2-CG2 3.74Å; C262-I266 PolarHBondContact O-N 2.93Å; C262-I266 VanDerWaalsContact O-N 3.11Å; N263-I266 PolarHBondContact O-N 3.29Å; I266-G268 PolarHBondContact O-N 3.26Å; I266-V269 PolarHBondContact O-N 3.23Å; I266-M270 WeakPolarHBondContact O-CG 3.4Å; I266-M270 PolarHBondContact O-N 3.11Å
267M92.6Very high88.6Confident26 Ų2653.7 Ų53.713%0.12827%0.267CS..Hα-helixtrans-62.9-42.2178.8-66.9-58.9-143.600111.7T208 N263 A264 V269 M270 D271T208-M267 HydrophobicContact CG2-CE 3.81Å; N263-M267 WeakPolarHBondContact O-CG 3.43Å; N263-M267 PolarHBondContact O-N 3.14Å; A264-M267 PolarHBondContact O-N 3.47Å; M267-V269 VanDerWaalsContact C-N 3.31Å; M267-V269 PolarHBondContact O-N 3.17Å; M267-M270 WeakPolarHBondContact O-CB 3.46Å; M267-M270 PolarHBondContact O-N 3.24Å; M267-M270 VanDerWaalsContact O-N 3.12Å; M267-D271 PolarHBondContact O-N 2.85Å
268G92.2Very high87.6Confident32 Ų3250.8 Ų50.833%0.3326%0.261SS..Hα-helixtrans-59.3-40.3175.500000112.8A264 A265 I266 D271 L272A264-G268 PolarHBondContact O-N 3.41Å; A265-G268 PolarHBondContact O-N 3.42Å; I266-G268 PolarHBondContact O-N 3.26Å; G268-D271 PolarHBondContact O-N 2.82Å; G268-L272 WeakPolarHBondContact O-CG 3.21Å; G268-L272 PolarHBondContact O-N 3.25Å
269V91.4Very high86Confident3 Ų349.6 Ų49.62%0.01827%0.265CS..Hα-helixtrans-64.9-40.7174.11700000112.2F96 L97 N100 L101 L249 A265 I266 M267 D271 L272 L273F96-V269 HydrophobicContact CE1-CG1 3.75Å; F96-V269 HydrophobicContact CZ-CG1 4.34Å; L97-V269 HydrophobicContact CD2-CG1 3.99Å; N100-V269 HydrophobicContact CB-CG2 3.36Å; L101-V269 HydrophobicContact CD1-CG2 4.28Å; L101-V269 HydrophobicContact CD2-CB 4.37Å; L101-V269 HydrophobicContact CD2-CG2 3.56Å; L101-V269 HydrophobicContact CG-CG2 3.78Å; L249-V269 HydrophobicContact CD1-CB 4.42Å; L249-V269 HydrophobicContact CD1-CG1 3.71Å; A265-V269 WeakPolarHBondContact O-CG2 3.41Å; A265-V269 PolarHBondContact O-N 3.3Å; I266-V269 PolarHBondContact O-N 3.23Å; M267-V269 VanDerWaalsContact C-N 3.31Å; M267-V269 PolarHBondContact O-N 3.17Å; V269-D271 VanDerWaalsContact C-N 3.32Å; V269-D271 PolarHBondContact O-N 2.75Å; V269-L272 PolarHBondContact O-N 2.94Å; V269-L273 HydrophobicContact CG1-CD1 4.16Å; V269-L273 HydrophobicContact CG1-CG 4.44Å; V269-L273 WeakPolarHBondContact O-CG 3.18Å; V269-L273 PolarHBondContact O-N 3.48Å
270M90.5Very high83.7Confident5 Ų554.2 Ų54.23%0.02528%0.281CS..Hα-helixtrans-64.7-37.1176.2-71.1-56.9-76.500112.8T228 L230 L249 I266 M267 L273 R274T228-M270 HydrophobicContact CG2-CE 3.92Å; T228-M270 HydrophobicContact CG2-CG 3.29Å; T228-M270 HydrophobicContact CG2-SD 3.73Å; L230-M270 HydrophobicContact CB-CE 3.44Å; L230-M270 VanDerWaalsContact CB-CE 3.44Å; L249-M270 HydrophobicContact CB-CE 4.5Å; L249-M270 HydrophobicContact CB-SD 3.51Å; L249-M270 VanDerWaalsContact CB-SD 3.51Å; L249-M270 HydrophobicContact CD1-CG 4.38Å; L249-M270 HydrophobicContact CD1-SD 3.77Å; L249-M270 HydrophobicContact CG-SD 4.27Å; I266-M270 WeakPolarHBondContact O-CG 3.4Å; I266-M270 PolarHBondContact O-N 3.11Å; M267-M270 WeakPolarHBondContact O-CB 3.46Å; M267-M270 PolarHBondContact O-N 3.24Å; M267-M270 VanDerWaalsContact O-N 3.12Å; M270-L273 PolarHBondContact O-N 2.79Å; M270-L273 HydrophobicContact SD-CD1 3.9Å; M270-R274 WeakPolarHBondContact O-CB 3.3Å; M270-R274 PolarHBondContact O-N 3.41Å
271D88.2Confident81.1Confident66 Ų6659 Ų5935%0.35330%0.301SS..Hα-helixtrans-67.4-39.4174.4-73.1-26.2000111.5M267 G268 V269 R274 K275M267-D271 PolarHBondContact O-N 2.85Å; G268-D271 PolarHBondContact O-N 2.82Å; V269-D271 VanDerWaalsContact C-N 3.32Å; V269-D271 PolarHBondContact O-N 2.75Å; D271-R274 PolarHBondContact O-N 2.77Å; D271-R274 IonicContact OD1-CZ 2.85Å; D271-R274 IonicContact OD1-NH1 2.75Å; D271-R274 PolarHBondContact OD1-NH1 3.48Å; D271-R274 IonicContact OD1-NH2 3.99Å; D271-K275 VanDerWaalsContact O-CG 3.3Å; D271-K275 WeakPolarHBondContact O-CG 3.44Å; D271-K275 PolarHBondContact O-N 3.25Å
272L89Confident78.1Confident65 Ų6566.5 Ų66.534%0.3434%0.341SS..Hα-helixtrans-63.8-41.9172.5-70.6173.7000112.2F96 G268 V269 K275 K276F96-L272 HydrophobicContact CE2-CB 4.25Å; F96-L272 HydrophobicContact CE2-CD1 4.47Å; F96-L272 HydrophobicContact CZ-CB 3.77Å; F96-L272 HydrophobicContact CZ-CD1 4.4Å; G268-L272 WeakPolarHBondContact O-CG 3.21Å; G268-L272 PolarHBondContact O-N 3.25Å; V269-L272 PolarHBondContact O-N 2.94Å; L272-K275 PolarHBondContact O-N 3.39Å; L272-K276 WeakPolarHBondContact O-CG 3.36Å; L272-K276 PolarHBondContact O-N 2.84Å
273L86.3Confident77.4Confident1 Ų169.9 Ų69.91%0.00536%0.358CS..Hα-helixtrans-61.7-44.7174-76.4171.6000111W93 F96 L110 L230 L249 V269 M270 K275 K276 L277W93-L273 HydrophobicContact CD2-CD2 4.04Å; W93-L273 HydrophobicContact CE3-CD2 3.58Å; W93-L273 HydrophobicContact CH2-CD2 4.13Å; W93-L273 HydrophobicContact CZ3-CD2 3.63Å; F96-L273 HydrophobicContact CD1-CD2 4.16Å; F96-L273 HydrophobicContact CE1-CD1 4.42Å; F96-L273 HydrophobicContact CE1-CD2 3.58Å; F96-L273 HydrophobicContact CE1-CG 3.7Å; F96-L273 HydrophobicContact CZ-CD2 4.19Å; F96-L273 HydrophobicContact CZ-CG 4.18Å; L110-L273 HydrophobicContact CD1-CD1 3.79Å; L110-L273 HydrophobicContact CD2-CD1 4.14Å; L110-L273 HydrophobicContact CD2-CD2 4.31Å; L230-L273 HydrophobicContact CD2-CB 4.23Å; L249-L273 HydrophobicContact CD1-CD1 4.41Å; V269-L273 HydrophobicContact CG1-CD1 4.16Å; V269-L273 HydrophobicContact CG1-CG 4.44Å; V269-L273 WeakPolarHBondContact O-CG 3.18Å; V269-L273 PolarHBondContact O-N 3.48Å; M270-L273 PolarHBondContact O-N 2.79Å; M270-L273 HydrophobicContact SD-CD1 3.9Å; L273-K275 PolarHBondContact O-N 2.77Å; L273-K276 PolarHBondContact O-N 3.36Å; L273-K276 VanDerWaalsContact O-N 3.12Å; L273-L277 WeakPolarHBondContact O-CB 3.25Å; L273-L277 VanDerWaalsContact O-CG 3.3Å; L273-L277 WeakPolarHBondContact O-CG 3.44Å; L273-L277 PolarHBondContact O-N 2.81Å
274R83.6Confident76.6Confident91 Ų9172 Ų7234%0.34337%0.368SS..Hα-helixtrans-54.6-53.4175.4-174.7-178.3-61.9128.73.2110.5L230 M270 D271 K276 L277 T278L230-R274 HydrophobicContact CD1-CB 3.85Å; L230-R274 HydrophobicContact CD1-CG 3.87Å; L230-R274 HydrophobicContact CD2-CB 3.93Å; M270-R274 WeakPolarHBondContact O-CB 3.3Å; M270-R274 PolarHBondContact O-N 3.41Å; D271-R274 PolarHBondContact O-N 2.77Å; D271-R274 IonicContact OD1-CZ 2.85Å; D271-R274 IonicContact OD1-NH1 2.75Å; D271-R274 PolarHBondContact OD1-NH1 3.48Å; D271-R274 IonicContact OD1-NH2 3.99Å; R274-K276 PolarHBondContact O-N 3.25Å; R274-L277 PolarHBondContact O-N 2.62Å; R274-L277 VanDerWaalsContact O-N 3.13Å; R274-T278 HydrophobicContact CG-CG2 4.23Å; R274-T278 PolarHBondContact O-N 2.78Å; R274-T278 PolarHBondContact O-OG1 3.07Å
275K81.6Confident75.8Confident119 Ų11972.6 Ų72.652%0.51736%0.36SS..Hα-helixtrans-59.3-30.1178.9-67.5176.6-179.5179.90113.7D271 L272 L273 Y280D271-K275 VanDerWaalsContact O-CG 3.3Å; D271-K275 WeakPolarHBondContact O-CG 3.44Å; D271-K275 PolarHBondContact O-N 3.25Å; L272-K275 PolarHBondContact O-N 3.39Å; L273-K275 PolarHBondContact O-N 2.77Å; K275-Y280 HydrophobicContact CB-CE2 4.21Å; K275-Y280 HydrophobicContact CG-CE2 4Å
276K80.3Confident74.7Confident132 Ų13275.8 Ų75.857%0.57437%0.373SS*.Hα-helixtrans-83-29.3177.6-77.2179.4172.2-81.10113.5W93 F96 L272 L273 R274W93-K276 HydrophobicContact CH2-CB 4.09Å; W93-K276 HydrophobicContact CH2-CD 3.85Å; W93-K276 HydrophobicContact CZ3-CD 3.62Å; F96-K276 HydrophobicContact CE2-CD 4.2Å; L272-K276 WeakPolarHBondContact O-CG 3.36Å; L272-K276 PolarHBondContact O-N 2.84Å; L273-K276 PolarHBondContact O-N 3.36Å; L273-K276 VanDerWaalsContact O-N 3.12Å; R274-K276 PolarHBondContact O-N 3.25Å
277L73.5Confident73.5Confident15 Ų1580.6 Ų80.68%0.07940%0.397CS..Hα-helixtrans-90.2-30.2-178-69.5171.8000112.8F87 L89 L230 V247 L273 R274F87-L277 WeakPolarHBondContact CZ-O 2.9Å; L89-L277 HydrophobicContact CD2-CD2 4.35Å; L230-L277 HydrophobicContact CD2-CD1 3.79Å; V247-L277 HydrophobicContact CG2-CD1 4.03Å; L273-L277 WeakPolarHBondContact O-CB 3.25Å; L273-L277 VanDerWaalsContact O-CG 3.3Å; L273-L277 WeakPolarHBondContact O-CG 3.44Å; L273-L277 PolarHBondContact O-N 2.81Å; R274-L277 PolarHBondContact O-N 2.62Å; R274-L277 VanDerWaalsContact O-N 3.13Å
278T66.1Low72.2Confident46 Ų4684.2 Ų84.228%0.28241%0.414SS..SBendtrans-88.1115.3170.461.30000108P233 R274 Y280P233-T278 HydrophobicContact CG-CG2 4.16Å; R274-T278 HydrophobicContact CG-CG2 4.23Å; R274-T278 PolarHBondContact O-N 2.78Å; R274-T278 PolarHBondContact O-OG1 3.07Å; T278-Y280 PolarHBondContact O-N 2.72Å; T278-Y280 VanDerWaalsContact O-N 3.11Å
279S53.5Low70.8Confident87 Ų8787.9 Ų87.961%0.60842%0.421SS*.  trans-55.4120.5161.542.20000107.1E281S279-E281 PolarHBondContact O-N 3.41Å
280Y41.4Very low69.2Low174 Ų17494.5 Ų94.568%0.68245%0.451SS*.  trans-69.479162.9-91.1-89.7000106.6K275 T278K275-Y280 HydrophobicContact CB-CE2 4.21Å; K275-Y280 HydrophobicContact CG-CE2 4Å; T278-Y280 PolarHBondContact O-N 2.72Å; T278-Y280 VanDerWaalsContact O-N 3.11Å
281E34.8Very low67.5Low172 Ų172101.9 Ų101.980%0.80449%0.487SS*.  trans-94.187.6155.7-71.3-171.7170.700106.2S279S279-E281 PolarHBondContact O-N 3.41Å
282M31.3Very low65.6Low255 Ų255105.2 Ų105.2100%1.25650%0.499SS*.  trans-121.60151-86.8-164.1-17900107.4

Retrieved 282 of 282 residues in 72.5 ms (Link to these results)