A0A096NFU8_PAPAN Loading...

Nucleoporin NUP53

Functions as a component of the nuclear pore complex (NPC). NPC components, collectively referred to as nucleoporins (NUPs), can play the role of both NPC structural components and of docking or interaction partners for transiently associated nuclear transport factors. May play a role in the association of MAD1 with the NPC.

AlphaFold DB (A0A0D9RJL0), UniProt , Accession A0A096NFU8, Species PAPAN (Papio anubis, Olive baboon), Gene NUP35, Length 326 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M43Very low45.6Very low237 Ų237133.1 Ų133.1100%1.16779%0.792SS**  0112.50-70.4159.9174.500106.1
2A40.4Very low45.5Very low97 Ų97129.6 Ų129.680%0.80279%0.789SS**  cis61.9137.319.500000114
3A43.9Very low45.7Very low67 Ų67133.5 Ų133.555%0.55480%0.801SS**  cis-170174.8-12.100000110
4F43.8Very low45.5Very low195 Ų195128.4 Ų128.486%0.85579%0.789SS**  trans69.1137.8171.2-45.6-73.2000115.3
5A49.3Very low45.7Very low96 Ų96126.9 Ų126.979%0.79379%0.786SS**  cis89.7114.922.300000115.6
6V51.6Low46.1Very low141 Ų141130.4 Ų130.486%0.85579%0.791SS**  trans-151.8122.4155.861.70000111.2
7E43Very low46.8Very low172 Ų172129.4 Ų129.480%0.80479%0.787SS**  trans-120.8155.7147.9-135.9-152.16900104.1
8P54.9Low47Very low94 Ų94130.9 Ų130.961%0.6179%0.787SS**  -136.8-157.558.938.3-16.1000111
9Q38.7Very low47.1Very low171 Ų171133.5 Ų133.580%0.79979%0.792SS**  cis-158.8162.38-153.7168.3-34.100111.4
10G42.5Very low47.3Very low57 Ų57134.3 Ų134.359%0.58879%0.791SS**  trans-81.5-163.2155.700000112.8
11P50.6Low47.1Very low137 Ų137131.9 Ų131.989%0.8980%0.795SS**  cis-130-155.425.242.4-24.9000113.8
12A44.3Very low47.1Very low91 Ų91124.7 Ų124.775%0.75277%0.768SS**  trans-115.7-167.9-166.700000114.2
13L47.5Very low47.7Very low180 Ų180126.1 Ų126.194%0.94277%0.769SS**  trans85.9148.4167.9-122.872.3000117.7
14G42.7Very low48Very low62 Ų62129.2 Ų129.264%0.63978%0.781SS**  trans129.155.1-168.600000112.3
15S49.3Very low48.2Very low106 Ų106125.4 Ų125.474%0.74178%0.778SS**  45.6108.478.1750000113.9
16E51.4Low48.2Very low184 Ų184126.1 Ų126.186%0.8678%0.775SS**  trans-64136.3179.1-173.6-172.5146.600113.2
17P58.4Low48.1Very low113 Ų113128.9 Ų128.973%0.73478%0.776SS**  trans-115.8133.7159.735.1-24.5000112.1
18M50.3Low48.3Very low157 Ų157126.5 Ų126.577%0.77378%0.775SS**  trans-61.3141.3173.5-60.5-176.7-68.500112
19M49.7Very low47.7Very low180 Ų180124.6 Ų124.689%0.88777%0.773SS**  trans-139.2130.5155.7-90.2-66.2104.700111.2G21M19-G21 PolarHBondContact O-N 3.17Å
20L50.7Low48.5Very low149 Ų149122.8 Ų122.878%0.7877%0.773SS**  trans-72.7118179.5-96.262.3000111.1S22L20-S22 VanDerWaalsContact C-N 3.31Å; L20-S22 PolarHBondContact O-N 3.27Å; L20-S22 VanDerWaalsContact O-N 3.14Å
21G42.4Very low49Very low84 Ų84127.3 Ų127.387%0.86678%0.784SS**  trans-81.868.216600000112.3M19M19-G21 PolarHBondContact O-N 3.17Å
22S44.1Very low49Very low85 Ų85124.4 Ų124.459%0.59477%0.771SS**PPolyproline II helixtrans-75.7128.1175.4-60.30000111.4L20L20-S22 VanDerWaalsContact C-N 3.31Å; L20-S22 PolarHBondContact O-N 3.27Å; L20-S22 VanDerWaalsContact O-N 3.14Å
23P53.6Low49.8Very low128 Ų128129 Ų12983%0.83178%0.777SS**PPolyproline II helixtrans-66.1138171.928.1-33.6000110.4
24T49.2Very low50.2Low132 Ų132129.6 Ų129.681%0.8177%0.772SS**PPolyproline II helixtrans-77138.1-17354.90000111.9P26T24-P26 WeakPolarHBondContact O-CD 3.41Å
25S47Very low51.1Low114 Ų114132.2 Ų132.280%0.79777%0.771SS**PPolyproline II helixtrans-76.4125.9179.3-178.50000111.4K27S25-K27 PolarHBondContact O-N 3.26Å
26P51.3Low51.8Low112 Ų112130.8 Ų130.873%0.72776%0.759SS**PPolyproline II helixtrans-67127.2170.2-20.133.6000111T24T24-P26 WeakPolarHBondContact O-CD 3.41Å
27K49.2Very low52.1Low198 Ų198124 Ų12486%0.86174%0.739SS**PPolyproline II helixtrans-61.8127.1176.8-161.2-176.5-169.274.50109.6S25 G29S25-K27 PolarHBondContact O-N 3.26Å; K27-G29 PolarHBondContact O-N 2.95Å; K27-G29 VanDerWaalsContact O-N 3.09Å
28P46.4Very low52.2Low123 Ų123127.6 Ų127.680%0.79974%0.744SS**  trans-60.1115.9-177.3-27.135.6000112.7
29G42.3Very low52.7Low54 Ų54126.8 Ų126.856%0.55774%0.741SS**  trans-71.3140.5161.600000109.9K27K27-G29 PolarHBondContact O-N 2.95Å; K27-G29 VanDerWaalsContact O-N 3.09Å
30V56.1Low53.1Low133 Ų133125.4 Ų125.481%0.80674%0.735SS**THydrogen-bonded Turntrans-55.9144.8167.7-178.10000108.7
31N53Low53.5Low151 Ų151121.1 Ų121.181%0.80773%0.727SS**THydrogen-bonded Turntrans90.56.9-179.8-45.2-45.8000118.8Q33N31-Q33 PolarHBondContact O-N 3.19Å
32A51Low54.2Low77 Ų77123.6 Ų123.664%0.63672%0.72SS**  trans-7771.1179.200000114.7F34A32-F34 VanDerWaalsContact C-N 3.33Å; A32-F34 PolarHBondContact O-N 3.37Å
33Q60.6Low54.8Low188 Ų188126.6 Ų126.688%0.87973%0.728SS**  trans-75.575.8173.7-71.9-167.2-10.700112.6N31N31-Q33 PolarHBondContact O-N 3.19Å
34F56.5Low54.8Low191 Ų191126.1 Ų126.184%0.83873%0.725SS**  trans-125.315.2178-70.6-77.5000114.6A32A32-F34 VanDerWaalsContact C-N 3.33Å; A32-F34 PolarHBondContact O-N 3.37Å
35L60.4Low54.6Low117 Ų117123.7 Ų123.761%0.61372%0.719SS**SBendtrans-120.5119.6168.9-81.3165.9000109L39L35-L39 HydrophobicContact CD2-CD2 3.81Å
36P64.4Low54.4Low76 Ų76123.9 Ų123.949%0.49472%0.718SS.*  trans-70.3140.4174.930.1-33.9000110.2F38 L39P36-F38 HydrophobicContact CB-CD2 3.71Å; P36-F38 HydrophobicContact CB-CE2 3.67Å; P36-F38 HydrophobicContact CB-CG 4.49Å; P36-F38 HydrophobicContact CB-CZ 4.41Å; P36-F38 HydrophobicContact CG-CD2 4.07Å; P36-F38 HydrophobicContact CG-CE2 4.33Å; P36-F38 PolarHBondContact O-N 2.93Å; P36-L39 PolarHBondContact O-N 3.06Å; P36-L39 VanDerWaalsContact O-N 3.14Å
37G58.6Low53.9Low42 Ų42125.6 Ų125.643%0.43373%0.725SS.*G310 helixtrans-56.4-21.4-169.200000115.7L39 M40G37-L39 PolarHBondContact O-N 3.14Å; G37-M40 PolarHBondContact O-N 2.93Å
38F59.7Low53.8Low189 Ų189122 Ų12283%0.82972%0.72SS**G310 helixtrans-53.8-27.1175.8-30.9-49.6000113.4P36P36-F38 HydrophobicContact CB-CD2 3.71Å; P36-F38 HydrophobicContact CB-CE2 3.67Å; P36-F38 HydrophobicContact CB-CG 4.49Å; P36-F38 HydrophobicContact CB-CZ 4.41Å; P36-F38 HydrophobicContact CG-CD2 4.07Å; P36-F38 HydrophobicContact CG-CE2 4.33Å; P36-F38 PolarHBondContact O-N 2.93Å
39L61.3Low53.9Low139 Ų139121.2 Ų121.273%0.72872%0.715SS**G310 helixtrans-85.4-17.1178.4-152.479.5000113.7L35 P36 G37L35-L39 HydrophobicContact CD2-CD2 3.81Å; P36-L39 PolarHBondContact O-N 3.06Å; P36-L39 VanDerWaalsContact O-N 3.14Å; G37-L39 PolarHBondContact O-N 3.14Å
40M57.9Low53.4Low152 Ų152126.9 Ų126.975%0.74973%0.727SS**THydrogen-bonded Turntrans-95.71.3-176-152.773.380.300113.1G37G37-M40 PolarHBondContact O-N 2.93Å
41G58.9Low53.2Low59 Ų59125.8 Ų125.861%0.60872%0.723SS**THydrogen-bonded Turntrans81.26.6177.100000115.7L43G41-L43 VanDerWaalsContact C-N 3.28Å; G41-L43 PolarHBondContact O-N 3.17Å
42D55.7Low52.7Low135 Ų135129 Ų12972%0.72272%0.724SS**  trans-77.480172.9-169.722.8000110.6
43L58Low52Low148 Ų148130.1 Ų130.178%0.77573%0.727SS**PPolyproline II helixtrans-90.3118.6170.5-76.3164.9000109G41 A45G41-L43 VanDerWaalsContact C-N 3.28Å; G41-L43 PolarHBondContact O-N 3.17Å; L43-A45 PolarHBondContact O-N 3.04Å
44P53.3Low50.9Low118 Ų118128.9 Ų128.977%0.76672%0.724SS**PPolyproline II helixtrans-59.4128.6165.425.4-32.6000109.2
45A45.7Very low49.8Very low82 Ų82125.2 Ų125.268%0.67872%0.723SS**PPolyproline II helixtrans-59.2149.2-168.200000113.6L43 V47L43-A45 PolarHBondContact O-N 3.04Å; A45-V47 PolarHBondContact O-N 3.01Å
46P41.9Very low48.6Very low118 Ų118122.9 Ų122.977%0.76673%0.727SS**PPolyproline II helixtrans-71117.2-168.127.5-35.7000113.5T48P46-T48 PolarHBondContact O-N 3Å; P46-T48 VanDerWaalsContact O-N 3.17Å
47V40.2Very low47.9Very low147 Ų147125.4 Ų125.489%0.89174%0.743SS**  trans-82.788174.1-75.10000112.3A45A45-V47 PolarHBondContact O-N 3.01Å
48T47.6Very low47Very low122 Ų122127.8 Ų127.875%0.74875%0.753SS**  trans-143.1162.9164.560.50000109.1P46P46-T48 PolarHBondContact O-N 3Å; P46-T48 VanDerWaalsContact O-N 3.17Å
49P48.7Very low45.8Very low107 Ų107125.9 Ų125.970%0.69576%0.757SS**  cis-124.7169.5-7.440.4-27.7000113.5
50Q32.4Very low44.6Very low173 Ų173122.2 Ų122.281%0.80875%0.753SS**  trans-152.5113.1150.3-93.4-125.7-4.500112.7
51P51.9Low43.6Very low111 Ų111121.6 Ų121.672%0.72176%0.757SS**  trans-114.1127.8160.934.9-24.5000111.7
52R41.3Very low42.8Very low218 Ų218127.4 Ų127.482%0.82377%0.77SS**  trans-165.9151.7162.4-96178.1-145.6162.66.7108.9
53S36.3Very low41.7Very low100 Ų100128.8 Ų128.870%0.69977%0.773SS**  cis-179.9157.2-28.9-100.30000107.9
54I37.7Very low41Very low162 Ų162128.6 Ų128.683%0.83177%0.77SS**  trans148127.6139.1-76.6157.3000111.3
55S33.7Very low40.1Very low114 Ų114133 Ų13380%0.79777%0.771SS**  trans12.7138161.1-490000121
56G34.7Very low39.8Very low68 Ų68134.4 Ų134.470%0.70178%0.776SS**  cis104172.816.900000112
57P51.1Low40.1Very low129 Ų129134.8 Ų134.884%0.83878%0.779SS**  cis-105.8-136.4-8.536.6-18.7000109.7
58S37.9Very low40Very low92 Ų92135.3 Ų135.364%0.64378%0.775SS**  cis-167.2142.8-4.7390000110.8
59V35.8Very low39.5Very low150 Ų150137.5 Ų137.591%0.90978%0.781SS**  trans63.2138.7166.4-174.50000116.2
60G35.2Very low38.8Very low62 Ų62137.2 Ų137.264%0.63979%0.788SS**  cis163.3168.6-8.600000113.1
61V37.6Very low38.8Very low138 Ų138133.2 Ų133.284%0.83679%0.794SS**  trans52.8111.3158.9-166.60000120.3
62M41.4Very low37.9Very low181 Ų181131.9 Ų131.989%0.89280%0.8SS**  trans7.3153.3135.6-50.1173.9-171.700122.8
63E33Very low37.6Very low165 Ų165127.2 Ų127.277%0.77180%0.801SS**  trans95.8-176.8143.8-127.7-142.3100.100120.9
64M42.8Very low37.9Very low144 Ų144128.3 Ų128.371%0.70981%0.805SS**  trans-99.7176.7-152.2-71.8-174.315800115.1
65R35Very low38.2Very low209 Ų209126.6 Ų126.679%0.78981%0.805SS**  trans79.8122.8153.2-74.3159.1171.7133.9-5.5117.9
66S39.8Very low38.4Very low112 Ų112129.4 Ų129.478%0.78381%0.806SS**  trans-64.6156.3156.1-320000111.5
67P48.6Very low38.8Very low127 Ų127131.2 Ų131.283%0.82581%0.805SS**  -117.8-170.612534.5-30.6000111.9
68L37.7Very low37.9Very low158 Ų158131 Ų13183%0.82780%0.801SS**  trans-110.7169.6-159.4-65.5165.5000114.3
69L36.8Very low38Very low167 Ų167134.2 Ų134.287%0.87481%0.81SS**  trans106.1154.1150.7-55.2-178.5000119.4
70A33.9Very low38.2Very low101 Ų101133 Ų13384%0.83581%0.805SS**  trans8070.9163.500000120.7
71G32Very low38.1Very low90 Ų90135 Ų13593%0.92882%0.816SS**  73.6124.8115.800000121.7
72G33Very low38.4Very low82 Ų82136.9 Ų136.985%0.84582%0.815SS**  trans158.6110.6162.600000113.9
73S35Very low38.4Very low121 Ų121137.9 Ų137.985%0.84681%0.814SS**PPolyproline II helixtrans-85.5149.4175.4-700000112.5
74P43.3Very low38.8Very low122 Ų122136.6 Ų136.679%0.79281%0.812SS**PPolyproline II helixtrans-85.7145.8-17833.9-35.4000113.6
75P43.5Very low39Very low127 Ų127139.7 Ų139.783%0.82582%0.822SS**PPolyproline II helixtrans-93.2119172.533.8-31.2000113.8
76Q37.5Very low39.2Very low173 Ų173135.9 Ų135.981%0.80883%0.827SS**PPolyproline II helixtrans-82.1173.5143.6-82.5-85.5-15.200107.8
77P43.4Very low39.2Very low106 Ų106134.6 Ų134.669%0.68883%0.832SS**  cis-151.1-167.631.431.7-3.8000118.4
78V33.2Very low39.3Very low124 Ų124132.7 Ų132.775%0.75283%0.827SS**  trans101124.5152.3-169.60000118.7
79L38.9Very low39.6Very low160 Ų160130.6 Ų130.684%0.83882%0.823SS**  trans-100.1154.6165.8-63.7167.4000109.4
80P40.8Very low40.6Very low125 Ų125128.6 Ų128.681%0.81282%0.82SS**  -154.8148.191.138-19.9000117.1
81A33.2Very low41.3Very low103 Ų103130.5 Ų130.585%0.85182%0.82SS**  trans170.2149.6134.900000112.8
82H44Very low42.6Very low178 Ų178137 Ų13782%0.82482%0.817SS**  trans-72.4143.6171-80.1-116.3000112.7
83K41.1Very low43.4Very low202 Ų202137.7 Ų137.788%0.87881%0.809SS**  -160.8123.5121.8-150154.5-172165.90113.9
84D40.4Very low44.7Very low137 Ų137139.4 Ų139.473%0.73381%0.807SS**  trans-62130.7171.9-55.8-112.8000112.6
85K47Very low45.1Very low210 Ų210143.3 Ų143.391%0.91381%0.807SS**  trans-143.8131.5144.2-75.2-154.3173.4-172.20110.6
86S39.3Very low45.2Very low128 Ų128144.1 Ų144.190%0.89581%0.805SS**  trans-73148.6-174.345.20000113.7
87G40.5Very low45.6Very low85 Ų85143.3 Ų143.388%0.87681%0.806SS**  trans-161.87.6176.200000116.3
88A50.4Low46Very low87 Ų87146 Ų14672%0.71981%0.813SS**SBendtrans-140.5148-178.700000111.3
89P44.3Very low46.4Very low114 Ų114145 Ų14574%0.7481%0.811SS**  trans-71145.717630.2-34.7000111.4V91P89-V91 PolarHBondContact O-N 3.4Å; P89-V91 VanDerWaalsContact O-N 3.15Å
90P57.8Low46.3Very low125 Ų125142.7 Ų142.781%0.81281%0.809SS**  trans-73.9107.8-175.528.9-34.5000112R92P90-R92 PolarHBondContact O-N 2.68Å
91V49.6Very low46.5Very low141 Ų141142.9 Ų142.986%0.85581%0.81SS**  trans-71.2104.9164.2-179.90000108.1P89 S93P89-V91 PolarHBondContact O-N 3.4Å; P89-V91 VanDerWaalsContact O-N 3.15Å; V91-S93 PolarHBondContact O-N 3.41Å
92R58.3Low46.5Very low226 Ų226141.3 Ų141.385%0.85380%0.804SS**  trans-70.2117.4168.7-81.6-179.1159.2155.1-6108.9P90P90-R92 PolarHBondContact O-N 2.68Å
93S50.7Low46.3Very low97 Ų97141.6 Ų141.668%0.67881%0.81SS**  trans-62.1143.3172-170.90000110.2V91V91-S93 PolarHBondContact O-N 3.41Å
94I61.3Low46.1Very low157 Ų157135.8 Ų135.881%0.80581%0.808SS**SBendtrans-106.220.3-169.6-26.2178.3000111.8
95Y52.3Low46.1Very low204 Ų204135.2 Ų135.280%0.882%0.815SS**SBendtrans-137.322.3-160.7-86.8-74.2000115.3
96D46.3Very low45.9Very low144 Ų144131.1 Ų131.177%0.7781%0.807SS**  trans-138.852-173.8-133.1-40000113
97D45.5Very low46.1Very low156 Ų156130.8 Ų130.883%0.83480%0.802SS**  trans-150.552.3174.6-143-32.8000112.1
98I51.8Low45.9Very low164 Ų164134.3 Ų134.384%0.84180%0.8SS**  trans-131.737.2177.559.2156000113.7
99S41Very low45.3Very low101 Ų101137.1 Ų137.171%0.70681%0.809SS**SBendtrans-148.336.8179.949.70000116.8
100S36.6Very low44.9Very low113 Ų113137.1 Ų137.179%0.7981%0.812SS**  trans65-161.2147.8-46.20000115.4
101P45.9Very low43.7Very low128 Ų128142.1 Ų142.183%0.83181%0.814SS**  -130.5151.6-115.435.8-15.2000116.9
102G33.5Very low43.1Very low70 Ų70146.2 Ų146.272%0.72281%0.814SS**  trans161.9141.115400000117.9
103L38.9Very low42.3Very low184 Ų184143 Ų14396%0.96381%0.809SS**  trans49.9100.1146.1-62.1165.4000117.6
104G36.7Very low42Very low81 Ų81144.8 Ų144.884%0.83582%0.818SS**  trans-86174.917200000114.3
105S40.7Very low40.8Very low125 Ų125143.3 Ų143.387%0.87481%0.812SS**  trans-150.2138.7161.946.80000110.6
106T42.9Very low40.3Very low123 Ų123141.5 Ų141.576%0.75581%0.814SS**  trans-94.3163.3160.657.20000108.5
107P43.3Very low39.6Very low122 Ų122138.5 Ų138.579%0.79281%0.805SS**  -141.3163.498.437-24000114.3
108L37.3Very low39.3Very low159 Ų159137.7 Ų137.783%0.83281%0.805SS**  trans-74.4141.7172.1-70.671.8000110.7
109T37.5Very low39Very low145 Ų145136.5 Ų136.589%0.8980%0.798SS**  trans-127.6160.6142.463.60000108.8
110S34.6Very low38.8Very low115 Ų115139.9 Ų139.980%0.80480%0.802SS**  trans-127.7167.1-161.6-176.70000112.5
111R32.8Very low38.8Very low229 Ų229139.9 Ų139.986%0.86480%0.802SS**  trans74125.7170.8-126.6175.3-166.2-168.95.5112.7
112R37.8Very low38.8Very low228 Ų228139.7 Ų139.786%0.8680%0.801SS**  cis-165.1145.535.9-162.5179.1-165.6174.22.1109.6
113Q40.4Very low39.3Very low159 Ų159144 Ų14474%0.74381%0.806SS**  trans-93.5162.6163.8-75.2-160.70.800111.3
114P44.3Very low39.5Very low134 Ų134141.8 Ų141.887%0.8780%0.8SS**  -123169.6106.937.1-34.2000114
115N37.6Very low39.5Very low126 Ų126140.6 Ų140.667%0.67479%0.788SS**  trans-115.5136-167164.7-7000110.7S117N115-S117 PolarHBondContact OD1-N 3.32Å
116I40.8Very low39.4Very low166 Ų166141.7 Ų141.785%0.85179%0.789SS**  trans-13194.1156.5-59-175.9000110.4
117S31.9Very low39.1Very low81 Ų81141.5 Ų141.557%0.56679%0.788SS**  trans32.6120.9140.5-153.80000120.2N115N115-S117 PolarHBondContact OD1-N 3.32Å
118V40.1Very low38.9Very low139 Ų139140.6 Ų140.684%0.84279%0.785SS**  trans-120.9130.9150.7178.40000107.3Q120V118-Q120 PolarHBondContact O-N 3.36Å
119M45Very low39.2Very low139 Ų139139.5 Ų139.569%0.68579%0.785SS**  trans-65.6115.4177.7-54.9-100.473.700108.4
120Q36.4Very low39.5Very low171 Ų171138.6 Ų138.680%0.79978%0.782SS**  71.1102.371.2-167.5174.912.500112.9V118V118-Q120 PolarHBondContact O-N 3.36Å
121S37.1Very low39.6Very low114 Ų114136.4 Ų136.480%0.79778%0.777SS**  trans-136.5134.9162.2-173.80000107.6
122P44.8Very low39.7Very low123 Ų123132.8 Ų132.880%0.79978%0.781SS**  trans-84.3135.9-162.431.6-35.2000114.1
123L45.6Very low39.7Very low160 Ų160125 Ų12584%0.83877%0.771SS**  trans-93.1130.6163.6174.364.2000109.6
124V42.1Very low39.8Very low138 Ų138126.8 Ų126.884%0.83678%0.779SS**  trans-104.9118.1159.6-178.30000107.1
125G37.5Very low39.5Very low56 Ų56125.3 Ų125.358%0.57777%0.772SS**  trans-113.7174.1178.200000112.4
126V38.2Very low40.1Very low148 Ų148126.9 Ų126.990%0.89778%0.778SS**  trans-146163.6164.91340000109.2
127T37.1Very low40.5Very low119 Ų119128.3 Ų128.373%0.7378%0.778SS**  trans-95.1178.8-155.551.30000116.4
128S39.2Very low40.9Very low104 Ų104130 Ų13073%0.72779%0.79SS**  trans71.2148.1161.927.70000116.8
129T43.1Very low41.3Very low135 Ų135129.2 Ų129.283%0.82879%0.787SS**  cis-150.21667.8-3.70000109.4
130P43.8Very low41.7Very low127 Ų127127.5 Ų127.583%0.82580%0.796SS**  trans-100.6153.3-173.937.7-31.5000114.8
131G35.4Very low41.9Very low69 Ų69125.1 Ų125.171%0.71180%0.798SS**  trans141.8132.2153.700000117.9
132T36.6Very low42.5Very low153 Ų153127.8 Ų127.894%0.93980%0.801SS**  trans69.3109.9145.2-45.80000120.7
133G36.3Very low42.7Very low63 Ų63125.1 Ų125.165%0.64980%0.796SS**  105.196.9116.600000121.7
134Q43.3Very low42.4Very low197 Ų197125.6 Ų125.692%0.92179%0.794SS**  trans66163.7139-57.1-171.80.800121.4
135S38Very low42.5Very low104 Ų104124.7 Ų124.773%0.72779%0.791SS**  trans59.4119.2174.6-142.20000116.5
136M49.8Very low42.6Very low159 Ų159132.5 Ų132.578%0.78380%0.803SS**  62.3123.951.2-59.6-149.8-61.400115
137F49Very low43.1Very low195 Ų195134.6 Ų134.686%0.85580%0.8SS**  trans59.9127.4171.1-81.4-94.3000119
138S39.7Very low43.8Very low117 Ų117133.2 Ų133.282%0.81879%0.792SS**  trans-151.6152.3148.8-83.50000109.6
139P49.3Very low44.4Very low122 Ų122135 Ų13579%0.79280%0.798SS**  trans-111.1-177.4-154.130.3-13.1000113.6
140A53.8Low45.2Very low104 Ų104132.6 Ų132.686%0.8678%0.78SS**  trans-60.4138.8168.400000111.1
141S41.2Very low45.2Very low120 Ų120130 Ų13084%0.83977%0.765SS**  trans-136.8143.3165.3-166.60000111.6
142I49.3Very low46.3Very low170 Ų170132.1 Ų132.187%0.87277%0.766SS**  trans-67.6156.5-179.5-77.9157.4000111.2
143G47.8Very low47.3Very low67 Ų67128.7 Ų128.769%0.69175%0.753SS**  trans110.143.3144.200000119
144Q39.8Very low48.1Very low171 Ų171129.7 Ų129.780%0.79974%0.741SS**  trans-138.1137.2150.3-80.3-155-17.500112.8R146Q144-R146 VanDerWaalsContact C-N 3.32Å; Q144-R146 PolarHBondContact O-N 3.08Å
145P43.9Very low48.5Very low119 Ų119126.2 Ų126.277%0.77373%0.728SS**  trans-70.294.2160.230.9-31.1000107.6K147P145-K147 VanDerWaalsContact C-N 3.27Å; P145-K147 PolarHBondContact O-N 3.1Å
146R41.1Very low49.3Very low219 Ų219125.2 Ų125.283%0.82671%0.714SS**  trans-61.394.6167.9-86.7-174.5171.8161.3-1.6108.3Q144 T148Q144-R146 VanDerWaalsContact C-N 3.32Å; Q144-R146 PolarHBondContact O-N 3.08Å; R146-T148 PolarHBondContact O-N 3.14Å
147K47.7Very low49.9Very low192 Ų192121.7 Ų121.784%0.83570%0.704SS**  trans-61.287.5151-68.9-176.7178.5-177.90106P145 T149P145-K147 VanDerWaalsContact C-N 3.27Å; P145-K147 PolarHBondContact O-N 3.1Å; K147-T149 PolarHBondContact O-N 3.47Å; K147-T149 VanDerWaalsContact O-N 3.14Å
148T51.2Low50.4Low91 Ų91116.1 Ų116.156%0.55868%0.679SS**  trans-55.1119.8170.1350000107R146 L150R146-T148 PolarHBondContact O-N 3.14Å; T148-L150 HydrophobicContact CG2-CD2 4.46Å; T148-L150 PolarHBondContact O-N 2.99Å
149T53.2Low50.9Low140 Ų140117.2 Ų117.286%0.85967%0.666SS**  trans-76.168.7173.651.90000107.8K147K147-T149 PolarHBondContact O-N 3.47Å; K147-T149 VanDerWaalsContact O-N 3.14Å
150L58.2Low51.4Low86 Ų86114.9 Ų114.945%0.4565%0.65SS.*  trans-60.6137.2-179.8-60.4-179.6000108.8T148 Q154T148-L150 HydrophobicContact CG2-CD2 4.46Å; T148-L150 PolarHBondContact O-N 2.99Å; L150-Q154 HydrophobicContact CB-CB 3.97Å; L150-Q154 HydrophobicContact CB-CG 4.5Å
151S44.8Very low51.5Low72 Ų72114.9 Ų114.950%0.50363%0.632SS.*  trans-67154.8179.9-680000110.3A153 Q154S151-A153 PolarHBondContact O-N 3.17Å; S151-Q154 WeakPolarHBondContact O-CB 3.46Å; S151-Q154 PolarHBondContact O-N 3.36Å
152P59.1Low52.2Low113 Ų113110.4 Ų110.473%0.73461%0.605SS**G310 helixtrans-52.8-27.4-178.3-3036.5000115.2Q154 L155P152-Q154 PolarHBondContact O-N 3Å; P152-L155 WeakPolarHBondContact O-CB 3.4Å; P152-L155 PolarHBondContact O-N 2.93Å
153A56Low52.4Low81 Ų81108.3 Ų108.367%0.66960%0.596SS**G310 helixtrans-67.7-14174.600000115S151S151-A153 PolarHBondContact O-N 3.17Å
154Q54.7Low52.8Low85 Ų85109.6 Ų109.640%0.39759%0.594SS.*G310 helixtrans-93.62.4178.8-57.1-173.4-92.100112.8L150 S151 P152 T160L150-Q154 HydrophobicContact CB-CB 3.97Å; L150-Q154 HydrophobicContact CB-CG 4.5Å; S151-Q154 WeakPolarHBondContact O-CB 3.46Å; S151-Q154 PolarHBondContact O-N 3.36Å; P152-Q154 PolarHBondContact O-N 3Å; Q154-T160 PolarHBondContact O-OG1 3.35Å; Q154-T160 VanDerWaalsContact O-OG1 3.12Å
155L51.1Low53.6Low124 Ų124103.9 Ų103.965%0.64957%0.569SS**G310 helixtrans-94.14.4172.4-53.4174.5000111.9P152 P157P152-L155 WeakPolarHBondContact O-CB 3.4Å; P152-L155 PolarHBondContact O-N 2.93Å; L155-P157 WeakPolarHBondContact O-CD 3.27Å
156D54.9Low54Low82 Ų82102.8 Ų102.844%0.43956%0.56SS.*  trans-61.7120.5176.2-176.1-16.2000109.4F158 Y159 T160D156-F158 PolarHBondContact O-N 2.92Å; D156-F158 VanDerWaalsContact O-N 3.08Å; D156-F158 VanDerWaalsContact OD1-CB 3.27Å; D156-F158 WeakPolarHBondContact OD1-CB 3.44Å; D156-F158 PolarHBondContact OD1-N 3.09Å; D156-Y159 WeakPolarHBondContact O-CA 3.42Å; D156-Y159 PolarHBondContact O-N 3.19Å; D156-T160 PolarHBondContact O-N 2.84Å; D156-T160 PolarHBondContact O-OG1 3Å
157P61.8Low54.7Low86 Ų8698.6 Ų98.656%0.55856%0.564SS**Hα-helixtrans-51.7-32.5176-27.335.6000113.1L155 Y159 Q161L155-P157 WeakPolarHBondContact O-CD 3.27Å; P157-Y159 VanDerWaalsContact C-N 3.28Å; P157-Y159 PolarHBondContact O-N 2.98Å; P157-Q161 VanDerWaalsContact O-CB 3.26Å; P157-Q161 WeakPolarHBondContact O-CB 3.4Å; P157-Q161 WeakPolarHBondContact O-CG 3.15Å; P157-Q161 PolarHBondContact O-N 3Å; P157-Q161 VanDerWaalsContact O-N 3.09Å
158F59.8Low54.9Low78 Ų7897.9 Ų97.934%0.34256%0.564SS.*Hα-helixtrans-68.2-27.3178.2-142-82.6000113.1D156 K241 P242 I244D156-F158 PolarHBondContact O-N 2.92Å; D156-F158 VanDerWaalsContact O-N 3.08Å; D156-F158 VanDerWaalsContact OD1-CB 3.27Å; D156-F158 WeakPolarHBondContact OD1-CB 3.44Å; D156-F158 PolarHBondContact OD1-N 3.09Å; F158-K241 HydrophobicContact CE1-CB 4.18Å; F158-K241 HydrophobicContact CE2-CB 3.59Å; F158-K241 HydrophobicContact CE2-CG 4.17Å; F158-K241 HydrophobicContact CZ-CB 3.37Å; F158-K241 HydrophobicContact CZ-CG 4.09Å; F158-P242 WeakPolarHBondContact CZ-O 3.5Å; F158-I244 HydrophobicContact CD2-CD1 3.98Å; F158-I244 HydrophobicContact CE2-CD1 4.14Å; F158-I244 HydrophobicContact CE2-CG1 4.46Å; F158-I244 HydrophobicContact CG-CD1 4.26Å; F158-I244 HydrophobicContact CZ-CG2 4.12Å
159Y51.2Low55.6Low139 Ų13996.5 Ų96.555%0.54555%0.553SS.*Hα-helixtrans-91.4-49.9177.6-146.6-66.1000111.1D156 P157 Q161 G162 D163D156-Y159 WeakPolarHBondContact O-CA 3.42Å; D156-Y159 PolarHBondContact O-N 3.19Å; P157-Y159 VanDerWaalsContact C-N 3.28Å; P157-Y159 PolarHBondContact O-N 2.98Å; Y159-Q161 PolarHBondContact O-N 2.96Å; Y159-G162 WeakPolarHBondContact O-CA 3.04Å; Y159-G162 PolarHBondContact O-N 3.09Å; Y159-G162 VanDerWaalsContact O-N 3.12Å; Y159-D163 WeakPolarHBondContact CD1-OD2 3.18Å; Y159-D163 WeakPolarHBondContact CE1-OD2 3.43Å; Y159-D163 PolarHBondContact O-N 3.34Å
160T58.6Low56.2Low74 Ų7497.9 Ų97.945%0.45455%0.549SS..Hα-helixtrans-71-33.5-174.2-35.20000113.1Q154 D156 S164Q154-T160 PolarHBondContact O-OG1 3.35Å; Q154-T160 VanDerWaalsContact O-OG1 3.12Å; D156-T160 PolarHBondContact O-N 2.84Å; D156-T160 PolarHBondContact O-OG1 3Å; T160-S164 PolarHBondContact O-OG 3.31Å
161Q55Low57.2Low104 Ų10495.6 Ų95.649%0.48654%0.537SS..THydrogen-bonded Turntrans-76.4-33.9168.6-63.2-174.1-1300111.2P157 Y159 S164 I244P157-Q161 VanDerWaalsContact O-CB 3.26Å; P157-Q161 WeakPolarHBondContact O-CB 3.4Å; P157-Q161 WeakPolarHBondContact O-CG 3.15Å; P157-Q161 PolarHBondContact O-N 3Å; P157-Q161 VanDerWaalsContact O-N 3.09Å; Y159-Q161 PolarHBondContact O-N 2.96Å; Q161-S164 WeakPolarHBondContact O-CB 3.32Å; Q161-S164 PolarHBondContact O-N 3.43Å; Q161-S164 VanDerWaalsContact O-N 3.08Å; Q161-I244 HydrophobicContact CB-CD1 4.09Å
162G57.5Low59Low26 Ų2694.3 Ų94.327%0.26853%0.525SS..G310 helixtrans-57.5-48.6176.500000113.5Y159 S164 L165Y159-G162 WeakPolarHBondContact O-CA 3.04Å; Y159-G162 PolarHBondContact O-N 3.09Å; Y159-G162 VanDerWaalsContact O-N 3.12Å; G162-S164 PolarHBondContact O-N 3.05Å; G162-S164 VanDerWaalsContact O-N 3.1Å; G162-L165 WeakPolarHBondContact O-CB 3.23Å; G162-L165 PolarHBondContact O-N 3.16Å
163D53.4Low60.5Low126 Ų12692.7 Ų92.767%0.67451%0.51SS*.G310 helixtrans-64.1-13.1176.3-79-28.2000113.6Y159Y159-D163 WeakPolarHBondContact CD1-OD2 3.18Å; Y159-D163 WeakPolarHBondContact CE1-OD2 3.43Å; Y159-D163 PolarHBondContact O-N 3.34Å
164S56Low62.4Low94 Ų9489.4 Ų89.466%0.65748%0.482SS*.G310 helixtrans-92.7-1.6173.5-56.80000113.5T160 Q161 G162T160-S164 PolarHBondContact O-OG 3.31Å; Q161-S164 WeakPolarHBondContact O-CB 3.32Å; Q161-S164 PolarHBondContact O-N 3.43Å; Q161-S164 VanDerWaalsContact O-N 3.08Å; G162-S164 PolarHBondContact O-N 3.05Å; G162-S164 VanDerWaalsContact O-N 3.1Å
165L56Low64.4Low50 Ų5085.5 Ų85.526%0.26246%0.464SS..  trans-95.7110.4174.5-59.1172.8000109.3G162 L171 I244G162-L165 WeakPolarHBondContact O-CB 3.23Å; G162-L165 PolarHBondContact O-N 3.16Å; L165-L171 HydrophobicContact CD1-CD1 3.74Å; L165-L171 HydrophobicContact CD2-CD1 4.44Å; L165-L171 HydrophobicContact CD2-CD2 4.42Å; L165-I244 HydrophobicContact CD1-CB 4.35Å; L165-I244 HydrophobicContact CD1-CG2 4.09Å
166T53.2Low66.6Low96 Ų9679.6 Ų79.659%0.58943%0.433SS*.  trans-72.1154.4164.355.50000109.7E168 D169T166-E168 PolarHBondContact O-N 3.33Å; T166-D169 WeakPolarHBondContact O-CB 3.42Å; T166-D169 PolarHBondContact O-N 3.07Å
167S54.3Low68.7Low132 Ų13276.4 Ų76.492%0.92342%0.416SS*.THydrogen-bonded Turntrans-60.2-11.5177.6-46.30000114.8
168E53Low70.4Confident176 Ų17672.3 Ų72.382%0.82239%0.39SS*.THydrogen-bonded Turntrans-83.7-15.9176.7-59.9-71.791.900112.6T166 H170T166-E168 PolarHBondContact O-N 3.33Å; E168-H170 PolarHBondContact O-N 3.47Å; E168-H170 VanDerWaalsContact O-N 3.09Å
169D66.4Low72.2Confident62 Ų6272 Ų7233%0.33239%0.389SS..  trans-78.297-176.7-156.2-95.2000110T166 L171 K246T166-D169 WeakPolarHBondContact O-CB 3.42Å; T166-D169 PolarHBondContact O-N 3.07Å; D169-L171 VanDerWaalsContact C-N 3.28Å; D169-L171 PolarHBondContact O-N 3.38Å; D169-L171 VanDerWaalsContact OD1-CD2 3.26Å; D169-L171 WeakPolarHBondContact OD1-CD2 3.43Å; D169-K246 WeakPolarHBondContact OD1-CE 3.23Å; D169-K246 IonicContact OD1-NZ 3.13Å; D169-K246 PolarHBondContact OD1-NZ 3.3Å; D169-K246 IonicContact OD2-NZ 2.65Å; D169-K246 PolarHBondContact OD2-NZ 3.01Å
170H66Low74.4Confident169 Ų16966.8 Ų66.878%0.78238%0.377SS*.  trans-73.376.7-173-168.877.4000112.5E168E168-H170 PolarHBondContact O-N 3.47Å; E168-H170 VanDerWaalsContact O-N 3.09Å
171L78.4Confident76.2Confident38 Ų3863.6 Ų63.620%0.19936%0.356CS..  trans-63.6140.8170-57.8-169.7000110.7L165 D169 D173 I244 K246 M249L165-L171 HydrophobicContact CD1-CD1 3.74Å; L165-L171 HydrophobicContact CD2-CD1 4.44Å; L165-L171 HydrophobicContact CD2-CD2 4.42Å; D169-L171 VanDerWaalsContact C-N 3.28Å; D169-L171 PolarHBondContact O-N 3.38Å; D169-L171 VanDerWaalsContact OD1-CD2 3.26Å; D169-L171 WeakPolarHBondContact OD1-CD2 3.43Å; L171-D173 PolarHBondContact O-N 3.09Å; L171-I244 HydrophobicContact CD1-CG2 4.43Å; L171-K246 HydrophobicContact CD2-CD 4.43Å; L171-K246 HydrophobicContact CD2-CG 4.02Å; L171-M249 HydrophobicContact CB-CE 4.27Å; L171-M249 HydrophobicContact CD1-CE 4.43Å; L171-M249 HydrophobicContact CD2-CE 3.86Å; L171-M249 HydrophobicContact CG-CE 4.41Å
172D82.5Confident78.1Confident45 Ų4561.9 Ų61.924%0.24136%0.355CS..  trans-73.797.8179.5175.31.9000110.3S174 W175 R214 M249D172-S174 PolarHBondContact O-N 3.18Å; D172-S174 WeakPolarHBondContact OD1-CB 3.49Å; D172-S174 PolarHBondContact OD1-N 2.95Å; D172-S174 PolarHBondContact OD1-OG 3.3Å; D172-S174 PolarHBondContact OD2-OG 2.77Å; D172-S174 VanDerWaalsContact OD2-OG 3.1Å; D172-W175 VanDerWaalsContact CG-CD1 3.42Å; D172-W175 PolarHBondContact O-N 2.82Å; D172-W175 VanDerWaalsContact OD2-CD1 3.24Å; D172-W175 PolarHBondContact OD2-NE1 3.09Å; D172-W175 VanDerWaalsContact OD2-NE1 3.15Å; D172-R214 IonicContact OD2-CZ 3.48Å; D172-R214 IonicContact OD2-NE 2.72Å; D172-R214 PolarHBondContact OD2-NE 3.46Å; D172-R214 IonicContact OD2-NH2 3.29Å; D172-R214 PolarHBondContact OD2-NH2 3.11Å; D172-M249 HydrophobicContact CB-SD 4.03Å
173D91.2Very high79.8Confident80 Ų8068.6 Ų68.643%0.42838%0.379SS..THydrogen-bonded Turntrans-52.3-10.2175.9-75-80.5000115.7L171 W175 K218 A221L171-D173 PolarHBondContact O-N 3.09Å; D173-W175 VanDerWaalsContact C-N 3.26Å; D173-K218 HydrophobicContact CB-CB 4.2Å; D173-K218 HydrophobicContact CB-CD 3.49Å; D173-K218 VanDerWaalsContact CB-CD 3.49Å; D173-K218 HydrophobicContact CB-CG 3.76Å; D173-K218 WeakPolarHBondContact OD1-CE 3.45Å; D173-K218 IonicContact OD1-NZ 2.65Å; D173-K218 PolarHBondContact OD1-NZ 2.9Å; D173-K218 WeakPolarHBondContact OD2-CE 3.39Å; D173-K218 IonicContact OD2-NZ 2.81Å; D173-K218 PolarHBondContact OD2-NZ 2.84Å; D173-A221 WeakPolarHBondContact O-CB 3.37Å
174S95.4Very high81.8Confident12 Ų1267.5 Ų67.58%0.08439%0.388CS..THydrogen-bonded Turntrans-77.4-10.6171.475.40000113.4D172 R214 Y215D172-S174 PolarHBondContact O-N 3.18Å; D172-S174 WeakPolarHBondContact OD1-CB 3.49Å; D172-S174 PolarHBondContact OD1-N 2.95Å; D172-S174 PolarHBondContact OD1-OG 3.3Å; D172-S174 PolarHBondContact OD2-OG 2.77Å; D172-S174 VanDerWaalsContact OD2-OG 3.1Å; S174-R214 WeakPolarHBondContact OG-CG 3.3Å; S174-Y215 WeakPolarHBondContact CB-O 3.29Å; S174-Y215 PolarHBondContact O-N 3.14Å
175W96.9Very high83.7Confident3 Ų364.6 Ų64.61%0.01137%0.367CS..EExtended strand (participates in β ladder)trans-94.2139.2178.8-69.383.2000114.5D172 D173 K201 H212 I213 R214 C243 V248 M249 S252D172-W175 VanDerWaalsContact CG-CD1 3.42Å; D172-W175 PolarHBondContact O-N 2.82Å; D172-W175 VanDerWaalsContact OD2-CD1 3.24Å; D172-W175 PolarHBondContact OD2-NE1 3.09Å; D172-W175 VanDerWaalsContact OD2-NE1 3.15Å; D173-W175 VanDerWaalsContact C-N 3.26Å; W175-K201 HydrophobicContact CH2-CB 4.43Å; W175-K201 HydrophobicContact CH2-CD 4.04Å; W175-K201 HydrophobicContact CH2-CG 4.27Å; W175-H212 HydrophobicContact CE3-CB 4.01Å; W175-H212 HydrophobicContact CZ3-CB 3.98Å; W175-I213 VanDerWaalsContact CA-O 3.31Å; W175-I213 WeakPolarHBondContact CA-O 3.18Å; W175-R214 HydrophobicContact CD2-CB 3.68Å; W175-R214 HydrophobicContact CD2-CG 3.99Å; W175-R214 HydrophobicContact CE3-CB 3.94Å; W175-R214 HydrophobicContact CG-CB 4.28Å; W175-R214 HydrophobicContact CG-CG 4.22Å; W175-R214 HydrophobicContact CH2-CB 3.96Å; W175-R214 HydrophobicContact CZ2-CB 3.67Å; W175-R214 HydrophobicContact CZ2-CG 3.94Å; W175-R214 HydrophobicContact CZ3-CB 4.08Å; W175-C243 HydrophobicContact CB-CB 3.4Å; W175-C243 VanDerWaalsContact CB-CB 3.4Å; W175-C243 HydrophobicContact CG-CB 4.37Å; W175-C243 PolarHBondContact O-N 3.3Å; W175-V248 HydrophobicContact CE3-CG1 4.21Å; W175-V248 HydrophobicContact CH2-CG1 3.84Å; W175-V248 HydrophobicContact CZ3-CG1 3.55Å; W175-M249 HydrophobicContact CB-SD 4.36Å; W175-M249 HydrophobicContact CD2-CG 3.97Å; W175-M249 HydrophobicContact CG-CG 3.86Å; W175-M249 HydrophobicContact CG-SD 4.15Å; W175-S252 WeakPolarHBondContact CZ2-OG 3.46Å
176V97.6Very high85.7Confident0 Ų062.6 Ų62.60%036%0.358CS..EExtended strand (participates in β ladder)trans-127.9148.1168.8-58.30000110.8V178 H212 I213 Y215 A221 A224 L225 V240 K241V176-V178 HydrophobicContact CG2-CG2 4.05Å; V176-H212 CarbonylContact O-C 3.51Å; V176-H212 WeakPolarHBondContact O-CA 3.46Å; V176-I213 HydrophobicContact CG2-CB 4.05Å; V176-I213 PolarHBondContact N-O 3.37Å; V176-I213 PolarHBondContact O-N 2.96Å; V176-Y215 HydrophobicContact CG2-CD2 4.4Å; V176-Y215 HydrophobicContact CG2-CE2 3.85Å; V176-A221 HydrophobicContact CG1-CB 4.01Å; V176-A224 HydrophobicContact CG1-CB 4.47Å; V176-A224 HydrophobicContact CG2-CB 4.32Å; V176-L225 HydrophobicContact CG1-CD1 4.27Å; V176-L225 HydrophobicContact CG1-CD2 4.04Å; V176-L225 HydrophobicContact CG1-CG 3.8Å; V176-V240 HydrophobicContact CB-CG1 4.01Å; V176-V240 HydrophobicContact CG1-CG1 4.42Å; V176-V240 HydrophobicContact CG2-CG1 4.27Å; V176-K241 CarbonylContact C-O 3.54Å; V176-K241 WeakPolarHBondContact CA-O 3.46Å
177T97.6Very high87.7Confident14 Ų1462 Ų629%0.08636%0.357CS..EExtended strand (participates in β ladder)trans-99.1120164.4-55.60000108.2W210 M211 H212 V240 K241T177-W210 HydrophobicContact CG2-CB 4.23Å; T177-M211 WeakPolarHBondContact CA-O 3.44Å; T177-H212 PolarHBondContact OG1-CE1 3.11Å; T177-H212 PolarHBondContact OG1-ND1 2.96Å; T177-V240 WeakPolarHBondContact O-CA 3.45Å; T177-K241 PolarHBondContact N-O 3.33Å; T177-K241 PolarHBondContact O-N 2.93Å
178V98.1Very high89.8Confident0 Ų060.2 Ų60.20%033%0.331CS..EExtended strand (participates in β ladder)trans-102.3134.5175-172.30000108.1V176 F181 I189 F193 W210 M211 I213 I238 G239 V240V176-V178 HydrophobicContact CG2-CG2 4.05Å; V178-F181 HydrophobicContact CB-CE1 4.44Å; V178-F181 HydrophobicContact CG1-CD1 4.4Å; V178-F181 HydrophobicContact CG1-CE1 4.17Å; V178-F181 WeakPolarHBondContact O-CE1 3.39Å; V178-I189 HydrophobicContact CG1-CG2 3.93Å; V178-F193 HydrophobicContact CB-CE1 4.45Å; V178-F193 HydrophobicContact CG1-CD2 4.48Å; V178-F193 HydrophobicContact CG1-CE1 4.04Å; V178-F193 HydrophobicContact CG1-CE2 3.98Å; V178-F193 HydrophobicContact CG1-CZ 3.74Å; V178-F193 HydrophobicContact CG2-CD1 3.63Å; V178-F193 HydrophobicContact CG2-CE1 3.51Å; V178-F193 HydrophobicContact CG2-CG 4.32Å; V178-F193 HydrophobicContact CG2-CZ 4.11Å; V178-W210 CarbonylContact O-C 3.52Å; V178-W210 WeakPolarHBondContact O-CA 3.38Å; V178-W210 WeakPolarHBondContact O-CB 3.38Å; V178-M211 HydrophobicContact CB-CE 4.05Å; V178-M211 HydrophobicContact CB-CG 4.07Å; V178-M211 HydrophobicContact CG1-CE 4.02Å; V178-M211 HydrophobicContact CG2-CE 4.49Å; V178-M211 PolarHBondContact N-O 2.82Å; V178-M211 PolarHBondContact O-N 3.14Å; V178-I213 HydrophobicContact CG2-CD1 3.79Å; V178-I213 HydrophobicContact CG2-CG1 4.35Å; V178-I238 HydrophobicContact CG1-CG2 3.53Å; V178-G239 WeakPolarHBondContact CA-O 3.38Å; V178-V240 HydrophobicContact CG2-CG1 4.38Å
179F97.8Very high91.9Very high73 Ų7351.8 Ų51.832%0.3229%0.292SS..EExtended strand (participates in β ladder)trans-148.4175.4-178.863.7-93.8000113.3N209 W210 I238 G239 K241F179-N209 VanDerWaalsContact CA-O 3.29Å; F179-N209 WeakPolarHBondContact CA-O 3.43Å; F179-W210 HydrophobicContact CB-CB 3.63Å; F179-I238 WeakPolarHBondContact O-CA 3.48Å; F179-G239 PolarHBondContact N-O 3.29Å; F179-G239 PolarHBondContact O-N 3.15Å; F179-K241 HydrophobicContact CE1-CG 3.79Å; F179-K241 HydrophobicContact CZ-CG 4.32Å
180G96.9Very high93.4Very high28 Ų2850 Ų5029%0.28928%0.282SS..  trans94.25.2177.100000114.6N209G180-N209 PolarHBondContact N-O 3.48Å; G180-N209 VanDerWaalsContact N-O 3.16Å
181F96.5Very high94.9Very high7 Ų747.7 Ų47.73%0.03128%0.275CS..  trans-99.9144.4179.555-94.7000113.1V178 A186 I189 N209 M211 I236 I238V178-F181 HydrophobicContact CB-CE1 4.44Å; V178-F181 HydrophobicContact CG1-CD1 4.4Å; V178-F181 HydrophobicContact CG1-CE1 4.17Å; V178-F181 WeakPolarHBondContact O-CE1 3.39Å; F181-A186 HydrophobicContact CD2-CB 3.87Å; F181-A186 HydrophobicContact CE2-CB 3.53Å; F181-I189 HydrophobicContact CB-CG1 3.82Å; F181-I189 HydrophobicContact CD1-CB 4.49Å; F181-I189 HydrophobicContact CD1-CG1 4.41Å; F181-I189 HydrophobicContact CD1-CG2 4.25Å; F181-I189 HydrophobicContact CG-CG1 4.17Å; F181-N209 WeakPolarHBondContact O-CB 3.43Å; F181-M211 HydrophobicContact CE1-CE 3.86Å; F181-M211 HydrophobicContact CE1-CG 3.96Å; F181-M211 HydrophobicContact CE1-SD 4.47Å; F181-M211 HydrophobicContact CZ-CB 4.08Å; F181-M211 HydrophobicContact CZ-CE 4.09Å; F181-M211 HydrophobicContact CZ-CG 3.74Å; F181-M211 HydrophobicContact CZ-SD 4.17Å; F181-I236 HydrophobicContact CB-CG2 3.9Å; F181-I238 HydrophobicContact CB-CD1 3.81Å; F181-I238 HydrophobicContact CD1-CD1 4Å; F181-I238 HydrophobicContact CG-CD1 4.41Å
182P95.7Very high95.8Very high69 Ų6947.7 Ų47.745%0.44827%0.274SS..  trans-67.5144167.629.9-33.6000109.9A184 S185 A186 I236P182-A184 PolarHBondContact O-N 2.94Å; P182-A184 VanDerWaalsContact O-N 3.13Å; P182-S185 PolarHBondContact O-N 3.33Å; P182-A186 PolarHBondContact O-N 3.24Å; P182-I236 HydrophobicContact CG-CD1 4.37Å
183Q93.6Very high96.5Very high166 Ų16645.6 Ų45.678%0.77626%0.262SS*.G310 helixtrans-56.4-34-174.9-173.5174.2-40.700113.3S185 A186Q183-S185 PolarHBondContact O-N 3.02Å; Q183-A186 VanDerWaalsContact O-CB 3.29Å; Q183-A186 WeakPolarHBondContact O-CB 3.34Å; Q183-A186 PolarHBondContact O-N 2.96Å; Q183-A186 VanDerWaalsContact O-N 3.16Å
184A94.9Very high96.9Very high104 Ų10444.2 Ų44.286%0.8626%0.263SS*.G310 helixtrans-61.5-24174.900000113.9P182P182-A184 PolarHBondContact O-N 2.94Å; P182-A184 VanDerWaalsContact O-N 3.13Å
185S96.6Very high97Very high32 Ų3249.2 Ų49.222%0.22429%0.285CS..G310 helixtrans-1011.3178.6-54.90000113.6P182 Q183 S187 Y188 I189P182-S185 PolarHBondContact O-N 3.33Å; Q183-S185 PolarHBondContact O-N 3.02Å; S185-S187 VanDerWaalsContact C-N 3.3Å; S185-S187 PolarHBondContact O-N 3.32Å; S185-Y188 WeakPolarHBondContact O-CB 3.34Å; S185-Y188 PolarHBondContact O-N 3.01Å; S185-I189 PolarHBondContact O-N 3.26Å
186A96.4Very high96.9Very high9 Ų950.6 Ų50.67%0.07429%0.29CS..Hα-helixtrans-54-44.9-176.500000112.5F181 P182 Q183 Y188 I189 L190 M204F181-A186 HydrophobicContact CD2-CB 3.87Å; F181-A186 HydrophobicContact CE2-CB 3.53Å; P182-A186 PolarHBondContact O-N 3.24Å; Q183-A186 VanDerWaalsContact O-CB 3.29Å; Q183-A186 WeakPolarHBondContact O-CB 3.34Å; Q183-A186 PolarHBondContact O-N 2.96Å; Q183-A186 VanDerWaalsContact O-N 3.16Å; A186-Y188 PolarHBondContact O-N 3.48Å; A186-I189 PolarHBondContact O-N 3.49Å; A186-L190 PolarHBondContact O-N 3.1Å; A186-M204 HydrophobicContact CB-CE 3.99Å; A186-M204 HydrophobicContact CB-SD 4.05Å
187S96.6Very high96.9Very high82 Ų8251.2 Ų51.257%0.57330%0.296SS*.Hα-helixtrans-62.3-40.9176.1-49.20000112.7S185 L190 L191S185-S187 VanDerWaalsContact C-N 3.3Å; S185-S187 PolarHBondContact O-N 3.32Å; S187-L190 PolarHBondContact O-N 3.4Å; S187-L191 WeakPolarHBondContact O-CD1 3.26Å; S187-L191 PolarHBondContact O-N 3.41Å
188Y97.4Very high96.9Very high95 Ų9554.5 Ų54.537%0.37331%0.314SS..Hα-helixtrans-62.8-45176.4165.3-100.7000111.1S185 A186 L190 L191 Q192 F232 G233S185-Y188 WeakPolarHBondContact O-CB 3.34Å; S185-Y188 PolarHBondContact O-N 3.01Å; A186-Y188 PolarHBondContact O-N 3.48Å; Y188-L190 PolarHBondContact O-N 3.09Å; Y188-L191 PolarHBondContact O-N 3.26Å; Y188-Q192 HydrophobicContact CD1-CG 4.49Å; Y188-Q192 HydrophobicContact CE1-CG 4.05Å; Y188-Q192 HydrophobicContact CE2-CG 4.1Å; Y188-Q192 VanDerWaalsContact CE2-NE2 3.25Å; Y188-Q192 WeakPolarHBondContact O-CG 3.24Å; Y188-Q192 PolarHBondContact O-N 2.91Å; Y188-F232 HydrophobicContact CE1-CB 4.24Å; Y188-G233 PolarHBondContact OH-N 3.1Å
189I97.9Very high96.9Very high0 Ų056.3 Ų56.30%032%0.323CS..Hα-helixtrans-65-39.2177-57.1-58.6000111.1V178 F181 S185 A186 L191 Q192 F193 M211 F232 I236 I238V178-I189 HydrophobicContact CG1-CG2 3.93Å; F181-I189 HydrophobicContact CB-CG1 3.82Å; F181-I189 HydrophobicContact CD1-CB 4.49Å; F181-I189 HydrophobicContact CD1-CG1 4.41Å; F181-I189 HydrophobicContact CD1-CG2 4.25Å; F181-I189 HydrophobicContact CG-CG1 4.17Å; S185-I189 PolarHBondContact O-N 3.26Å; A186-I189 PolarHBondContact O-N 3.49Å; I189-L191 VanDerWaalsContact C-N 3.32Å; I189-L191 PolarHBondContact O-N 3.24Å; I189-Q192 WeakPolarHBondContact O-CB 3.29Å; I189-Q192 PolarHBondContact O-N 3.02Å; I189-Q192 VanDerWaalsContact O-N 3.1Å; I189-F193 HydrophobicContact CG2-CD2 3.76Å; I189-F193 HydrophobicContact CG2-CE2 3.82Å; I189-F193 VanDerWaalsContact O-CD2 3.3Å; I189-F193 WeakPolarHBondContact O-CD2 3.47Å; I189-F193 PolarHBondContact O-N 3.06Å; I189-M211 HydrophobicContact CB-CE 3.96Å; I189-M211 HydrophobicContact CG2-CE 3.56Å; I189-F232 HydrophobicContact CD1-CB 3.96Å; I189-F232 HydrophobicContact CD1-CG 4.38Å; I189-I236 HydrophobicContact CD1-CD1 4.41Å; I189-I236 HydrophobicContact CD1-CG2 4.5Å; I189-I238 HydrophobicContact CD1-CD1 3.76Å; I189-I238 HydrophobicContact CD1-CG1 4.08Å; I189-I238 HydrophobicContact CG1-CD1 3.94Å; I189-I238 HydrophobicContact CG2-CD1 3.97Å; I189-I238 HydrophobicContact CG2-CG1 4.46Å
190L97.6Very high96.8Very high25 Ų2557.6 Ų57.613%0.13133%0.332CS..Hα-helixtrans-59.5-42.4174.4-17665.9000111.7A186 S187 Y188 F193 A194 I199 H202 M204 M211 I213A186-L190 PolarHBondContact O-N 3.1Å; S187-L190 PolarHBondContact O-N 3.4Å; Y188-L190 PolarHBondContact O-N 3.09Å; L190-F193 PolarHBondContact O-N 2.75Å; L190-A194 PolarHBondContact O-N 3.29Å; L190-I199 HydrophobicContact CD1-CD1 3.88Å; L190-H202 HydrophobicContact CD1-CB 3.91Å; L190-M204 HydrophobicContact CB-CE 4.39Å; L190-M204 HydrophobicContact CD2-CE 4.18Å; L190-M211 HydrophobicContact CB-CE 4.35Å; L190-M211 HydrophobicContact CB-SD 4.25Å; L190-M211 HydrophobicContact CD1-SD 4.14Å; L190-I213 HydrophobicContact CD1-CD1 3.95Å; L190-I213 HydrophobicContact CD1-CG1 4.37Å
191L97.3Very high96.7Very high119 Ų11959 Ų5962%0.62333%0.331SS*.Hα-helixtrans-66.1-32.5173.8-90.976.4000113.1S187 Y188 I189S187-L191 WeakPolarHBondContact O-CD1 3.26Å; S187-L191 PolarHBondContact O-N 3.41Å; Y188-L191 PolarHBondContact O-N 3.26Å; I189-L191 VanDerWaalsContact C-N 3.32Å; I189-L191 PolarHBondContact O-N 3.24Å
192Q97.4Very high96.7Very high39 Ų3962.8 Ų62.818%0.18235%0.348CS..Hα-helixtrans-66.8-41.7171.4-65.4-56.1-40.700111.5Y188 I189 A194 Q195 F232Y188-Q192 HydrophobicContact CD1-CG 4.49Å; Y188-Q192 HydrophobicContact CE1-CG 4.05Å; Y188-Q192 HydrophobicContact CE2-CG 4.1Å; Y188-Q192 VanDerWaalsContact CE2-NE2 3.25Å; Y188-Q192 WeakPolarHBondContact O-CG 3.24Å; Y188-Q192 PolarHBondContact O-N 2.91Å; I189-Q192 WeakPolarHBondContact O-CB 3.29Å; I189-Q192 PolarHBondContact O-N 3.02Å; I189-Q192 VanDerWaalsContact O-N 3.1Å; Q192-A194 PolarHBondContact O-N 2.97Å; Q192-Q195 WeakPolarHBondContact O-CB 3.43Å; Q192-Q195 PolarHBondContact O-N 3.35Å; Q192-F232 HydrophobicContact CB-CD1 4.02Å; Q192-F232 HydrophobicContact CB-CE1 3.84Å; Q192-F232 HydrophobicContact CG-CD1 3.86Å; Q192-F232 HydrophobicContact CG-CE1 4.17Å
193F97.8Very high96.7Very high0 Ų061.6 Ų61.60%034%0.34CS..Hα-helixtrans-74.4-24.2-178-85.6-110.7000113.3V178 I189 L190 Q195 Y196 I213 Y215 A224 K227 F232 I238 V240V178-F193 HydrophobicContact CB-CE1 4.45Å; V178-F193 HydrophobicContact CG1-CD2 4.48Å; V178-F193 HydrophobicContact CG1-CE1 4.04Å; V178-F193 HydrophobicContact CG1-CE2 3.98Å; V178-F193 HydrophobicContact CG1-CZ 3.74Å; V178-F193 HydrophobicContact CG2-CD1 3.63Å; V178-F193 HydrophobicContact CG2-CE1 3.51Å; V178-F193 HydrophobicContact CG2-CG 4.32Å; V178-F193 HydrophobicContact CG2-CZ 4.11Å; I189-F193 HydrophobicContact CG2-CD2 3.76Å; I189-F193 HydrophobicContact CG2-CE2 3.82Å; I189-F193 VanDerWaalsContact O-CD2 3.3Å; I189-F193 WeakPolarHBondContact O-CD2 3.47Å; I189-F193 PolarHBondContact O-N 3.06Å; L190-F193 PolarHBondContact O-N 2.75Å; F193-Q195 PolarHBondContact O-N 2.86Å; F193-Y196 HydrophobicContact CB-CD2 4.45Å; F193-Y196 HydrophobicContact CD1-CD2 4.09Å; F193-Y196 HydrophobicContact CD1-CE2 4.39Å; F193-Y196 HydrophobicContact CD2-CE2 4.12Å; F193-Y196 HydrophobicContact CE1-CD2 4.43Å; F193-Y196 HydrophobicContact CE1-CE2 4.48Å; F193-Y196 HydrophobicContact CE2-CE2 4.22Å; F193-Y196 HydrophobicContact CG-CD2 4.13Å; F193-Y196 HydrophobicContact CG-CE2 4.21Å; F193-Y196 HydrophobicContact CZ-CE2 4.39Å; F193-Y196 WeakPolarHBondContact O-CB 3.42Å; F193-Y196 PolarHBondContact O-N 3.04Å; F193-I213 HydrophobicContact CB-CD1 3.88Å; F193-I213 HydrophobicContact CD1-CD1 4.28Å; F193-I213 HydrophobicContact CG-CD1 4.28Å; F193-Y215 WeakPolarHBondContact CB-OH 3.48Å; F193-Y215 PolarHBondContact O-OH 2.92Å; F193-A224 HydrophobicContact CD1-CB 3.96Å; F193-A224 HydrophobicContact CE1-CB 4Å; F193-K227 HydrophobicContact CZ-CB 4.31Å; F193-F232 HydrophobicContact CE2-CE2 4.21Å; F193-F232 AromaticContact CE2-CZ 3.98Å; F193-F232 HydrophobicContact CE2-CZ 3.98Å; F193-I238 HydrophobicContact CE2-CG2 4.03Å; F193-I238 HydrophobicContact CZ-CG2 3.8Å; F193-V240 HydrophobicContact CE1-CG1 4.09Å; F193-V240 HydrophobicContact CE1-CG2 3.69Å; F193-V240 HydrophobicContact CZ-CG2 3.51Å
194A97.9Very high96.7Very high52 Ų5257 Ų5743%0.4332%0.319SS..Hα-helixtrans-63.4-23.817000000113.5L190 Q192 Y196 G197 I199L190-A194 PolarHBondContact O-N 3.29Å; Q192-A194 PolarHBondContact O-N 2.97Å; A194-Y196 PolarHBondContact O-N 2.86Å; A194-G197 VanDerWaalsContact O-O 3.07Å; A194-I199 HydrophobicContact CB-CD1 4.06Å
195Q97.5Very high96.6Very high117 Ų11753.1 Ų53.155%0.54729%0.286SS..THydrogen-bonded Turntrans-72.7-12173.5-59.3167.845.800112.7Q192 F193 K223Q192-Q195 WeakPolarHBondContact O-CB 3.43Å; Q192-Q195 PolarHBondContact O-N 3.35Å; F193-Q195 PolarHBondContact O-N 2.86Å; Q195-K223 PolarHBondContact O-NZ 3.36Å
196Y96.7Very high96.1Very high31 Ų3158.7 Ų58.712%0.12231%0.313CS..THydrogen-bonded Turntrans-90.1-30.2-179-54-29.9000112.6F193 A194 K223 A224 K227 F232F193-Y196 HydrophobicContact CB-CD2 4.45Å; F193-Y196 HydrophobicContact CD1-CD2 4.09Å; F193-Y196 HydrophobicContact CD1-CE2 4.39Å; F193-Y196 HydrophobicContact CD2-CE2 4.12Å; F193-Y196 HydrophobicContact CE1-CD2 4.43Å; F193-Y196 HydrophobicContact CE1-CE2 4.48Å; F193-Y196 HydrophobicContact CE2-CE2 4.22Å; F193-Y196 HydrophobicContact CG-CD2 4.13Å; F193-Y196 HydrophobicContact CG-CE2 4.21Å; F193-Y196 HydrophobicContact CZ-CE2 4.39Å; F193-Y196 WeakPolarHBondContact O-CB 3.42Å; F193-Y196 PolarHBondContact O-N 3.04Å; A194-Y196 PolarHBondContact O-N 2.86Å; Y196-K223 WeakPolarHBondContact O-CD 3.19Å; Y196-K223 PolarHBondContact O-NZ 2.84Å; Y196-K223 VanDerWaalsContact O-NZ 3.09Å; Y196-A224 HydrophobicContact CD2-CB 4.37Å; Y196-K227 HydrophobicContact CD2-CG 4.15Å; Y196-K227 HydrophobicContact CE2-CB 4.47Å; Y196-K227 HydrophobicContact CE2-CD 4.21Å; Y196-K227 HydrophobicContact CE2-CG 3.61Å; Y196-F232 HydrophobicContact CE2-CZ 4.29Å; Y196-F232 VanDerWaalsContact OH-CE1 3.23Å; Y196-F232 WeakPolarHBondContact OH-CE1 3.22Å; Y196-F232 VanDerWaalsContact OH-CZ 3.32Å; Y196-F232 WeakPolarHBondContact OH-CZ 3.24Å
197G96.9Very high95.7Very high13 Ų1363.8 Ų63.813%0.13434%0.343CS..SBendtrans-176.2174.9173.300000112.7A194 I199 Q220A194-G197 VanDerWaalsContact O-O 3.07Å; G197-I199 PolarHBondContact O-N 2.91Å; G197-Q220 VanDerWaalsContact CA-CD 3.49Å
198N97.7Very high95.4Very high84 Ų8461.1 Ų61.145%0.44933%0.328SS..  trans-70.4120.3176.5-175.722.1000109.7Y215 Q216 Q220N198-Y215 CarbonylContact O-C 3.55Å; N198-Y215 WeakPolarHBondContact O-CA 3.41Å; N198-Q216 HydrophobicContact CB-CB 4.02Å; N198-Q216 PolarHBondContact ND2-OE1 3.07Å; N198-Q216 PolarHBondContact O-N 2.94Å; N198-Q220 PolarHBondContact O-OE1 2.62Å
199I97.5Very high95.3Very high38 Ų3860.4 Ų60.420%0.19533%0.331CS..EExtended strand (participates in β ladder)trans-89.1115.1-179.6-64.4177.9000108.6L190 A194 G197 K201 H202 I213 Y215L190-I199 HydrophobicContact CD1-CD1 3.88Å; A194-I199 HydrophobicContact CB-CD1 4.06Å; G197-I199 PolarHBondContact O-N 2.91Å; I199-K201 WeakPolarHBondContact CG2-O 3.27Å; I199-H202 HydrophobicContact CG2-CB 4.43Å; I199-I213 HydrophobicContact CB-CG2 4.35Å; I199-I213 HydrophobicContact CD1-CD1 4.43Å; I199-I213 HydrophobicContact CD1-CG2 3.78Å; I199-I213 HydrophobicContact CG1-CG2 3.71Å; I199-I213 HydrophobicContact CG2-CG2 3.84Å; I199-Y215 HydrophobicContact CD1-CE1 4.49Å; I199-Y215 HydrophobicContact CG1-CD1 4.17Å; I199-Y215 HydrophobicContact CG1-CE1 3.78Å
200L96.1Very high95.2Very high99 Ų9965 Ų6552%0.51835%0.349SS..EExtended strand (participates in β ladder)trans-79.8-35.2176.8-62.2-175.7000112.3R214 Q216L200-R214 HydrophobicContact CB-CB 4.5Å; L200-R214 PolarHBondContact N-O 3.48Å; L200-Q216 HydrophobicContact CD1-CB 4.44Å; L200-Q216 HydrophobicContact CD2-CB 4.16Å; L200-Q216 HydrophobicContact CD2-CG 4.27Å; L200-Q216 HydrophobicContact CG-CB 4.2Å
201K95.4Very high95.2Very high59 Ų5963.9 Ų63.926%0.25734%0.342SS..EExtended strand (participates in β ladder)trans-155.8148178.8-177.2171.5168-174.10109.4W175 I199 V203 R214 S251 S252W175-K201 HydrophobicContact CH2-CB 4.43Å; W175-K201 HydrophobicContact CH2-CD 4.04Å; W175-K201 HydrophobicContact CH2-CG 4.27Å; I199-K201 WeakPolarHBondContact CG2-O 3.27Å; K201-V203 HydrophobicContact CG-CG2 4.44Å; K201-R214 HydrophobicContact CB-CB 4.27Å; K201-R214 PolarHBondContact O-N 3.21Å; K201-S251 PolarHBondContact NZ-O 3.13Å; K201-S251 PolarHBondContact NZ-OG 3.16Å; K201-S252 WeakPolarHBondContact CD-OG 3.26Å; K201-S252 PolarHBondContact NZ-OG 3.5Å
202H95.6Very high95.2Very high85 Ų8559 Ų5939%0.39432%0.316SS..EExtended strand (participates in β ladder)trans-131.5154.1163.273.7-78.7000109.7L190 I199 H212 I213L190-H202 HydrophobicContact CD1-CB 3.91Å; I199-H202 HydrophobicContact CG2-CB 4.43Å; H202-H212 CarbonylContact C-O 3.58Å; H202-H212 WeakPolarHBondContact CA-O 3.2Å; H202-I213 HydrophobicContact CB-CG1 4.32Å
203V95.4Very high95.2Very high45 Ų4557.1 Ų57.127%0.27331%0.308SS..EExtended strand (participates in β ladder)trans-136.3113.9176.1-178.90000107.8K201 M211 H212 V248K201-V203 HydrophobicContact CG-CG2 4.44Å; V203-M211 CarbonylContact O-C 3.48Å; V203-M211 VanDerWaalsContact O-CA 3.26Å; V203-M211 WeakPolarHBondContact O-CA 3.44Å; V203-M211 WeakPolarHBondContact O-CB 3.38Å; V203-H212 PolarHBondContact N-O 3.44Å; V203-H212 PolarHBondContact O-N 3.1Å; V203-V248 HydrophobicContact CB-CG1 4.27Å; V203-V248 HydrophobicContact CG2-CG1 4.08Å
204M94.4Very high95.2Very high69 Ų6959 Ų5934%0.3432%0.315SS..EExtended strand (participates in β ladder)trans-76.4138.9172.8-64.4-67.6-179.600109.7A186 L190 M211A186-M204 HydrophobicContact CB-CE 3.99Å; A186-M204 HydrophobicContact CB-SD 4.05Å; L190-M204 HydrophobicContact CB-CE 4.39Å; L190-M204 HydrophobicContact CD2-CE 4.18Å; M204-M211 HydrophobicContact CE-SD 3.69Å; M204-M211 HydrophobicContact SD-CB 3.63Å; M204-M211 HydrophobicContact SD-CG 4.27Å; M204-M211 HydrophobicContact SD-SD 3.79Å
205S92.3Very high95.2Very high23 Ų2356.5 Ų56.516%0.16129%0.294CS..  trans-68.8139.9166.3-175.70000110.4T207 G208 W210S205-T207 PolarHBondContact OG-N 3.22Å; S205-G208 PolarHBondContact OG-N 2.86Å; S205-G208 VanDerWaalsContact OG-N 3.16Å; S205-W210 WeakPolarHBondContact CB-O 3.48Å; S205-W210 PolarHBondContact N-O 2.84Å
206N86.7Confident95.2Very high148 Ų14856.6 Ų56.679%0.79130%0.295SS*.SBendtrans-90-6.9174.164-10.6000113.1
207T86.7Confident95.2Very high117 Ų11757.4 Ų57.472%0.71831%0.305SS*.SBendtrans-132.82.9-169.740.50000112.9S205S205-T207 PolarHBondContact OG-N 3.22Å
208G90.4Very high95.1Very high25 Ų2561.8 Ų61.826%0.25832%0.32SS..SBendtrans-157.3165.7-172.200000114.7S205 W210S205-G208 PolarHBondContact OG-N 2.86Å; S205-G208 VanDerWaalsContact OG-N 3.16Å; G208-W210 VanDerWaalsContact CA-CZ3 3.47Å; G208-W210 PolarHBondContact O-N 3.43Å; G208-W210 VanDerWaalsContact O-N 3.08Å
209N95.8Very high95.1Very high81 Ų8163.9 Ų63.943%0.43333%0.331SS..SBendtrans-84.642.3-177.866.1-27.1000113F179 G180 F181F179-N209 VanDerWaalsContact CA-O 3.29Å; F179-N209 WeakPolarHBondContact CA-O 3.43Å; G180-N209 PolarHBondContact N-O 3.48Å; G180-N209 VanDerWaalsContact N-O 3.16Å; F181-N209 WeakPolarHBondContact O-CB 3.43Å
210W96.8Very high95.1Very high97 Ų9764 Ų6437%0.36733%0.331SS..EExtended strand (participates in β ladder)trans-141.5159.1-175.564.386.4000113.9T177 V178 F179 S205 G208 H212T177-W210 HydrophobicContact CG2-CB 4.23Å; V178-W210 CarbonylContact O-C 3.52Å; V178-W210 WeakPolarHBondContact O-CA 3.38Å; V178-W210 WeakPolarHBondContact O-CB 3.38Å; F179-W210 HydrophobicContact CB-CB 3.63Å; S205-W210 WeakPolarHBondContact CB-O 3.48Å; S205-W210 PolarHBondContact N-O 2.84Å; G208-W210 VanDerWaalsContact CA-CZ3 3.47Å; G208-W210 PolarHBondContact O-N 3.43Å; G208-W210 VanDerWaalsContact O-N 3.08Å; W210-H212 AromaticContact CD1-NE2 3.61Å; W210-H212 AromaticContact NE1-NE2 3.8Å
211M97.4Very high95.2Very high0 Ų059.3 Ų59.30%031%0.306CS..EExtended strand (participates in β ladder)trans-143.3149.4173.563.9179159.900111T177 V178 F181 I189 L190 V203 M204 I213T177-M211 WeakPolarHBondContact CA-O 3.44Å; V178-M211 HydrophobicContact CB-CE 4.05Å; V178-M211 HydrophobicContact CB-CG 4.07Å; V178-M211 HydrophobicContact CG1-CE 4.02Å; V178-M211 HydrophobicContact CG2-CE 4.49Å; V178-M211 PolarHBondContact N-O 2.82Å; V178-M211 PolarHBondContact O-N 3.14Å; F181-M211 HydrophobicContact CE1-CE 3.86Å; F181-M211 HydrophobicContact CE1-CG 3.96Å; F181-M211 HydrophobicContact CE1-SD 4.47Å; F181-M211 HydrophobicContact CZ-CB 4.08Å; F181-M211 HydrophobicContact CZ-CE 4.09Å; F181-M211 HydrophobicContact CZ-CG 3.74Å; F181-M211 HydrophobicContact CZ-SD 4.17Å; I189-M211 HydrophobicContact CB-CE 3.96Å; I189-M211 HydrophobicContact CG2-CE 3.56Å; L190-M211 HydrophobicContact CB-CE 4.35Å; L190-M211 HydrophobicContact CB-SD 4.25Å; L190-M211 HydrophobicContact CD1-SD 4.14Å; V203-M211 CarbonylContact O-C 3.48Å; V203-M211 VanDerWaalsContact O-CA 3.26Å; V203-M211 WeakPolarHBondContact O-CA 3.44Å; V203-M211 WeakPolarHBondContact O-CB 3.38Å; M204-M211 HydrophobicContact CE-SD 3.69Å; M204-M211 HydrophobicContact SD-CB 3.63Å; M204-M211 HydrophobicContact SD-CG 4.27Å; M204-M211 HydrophobicContact SD-SD 3.79Å; M211-I213 HydrophobicContact CE-CD1 4.06Å; M211-I213 HydrophobicContact CG-CD1 4.44Å; M211-I213 HydrophobicContact CG-CG1 4.32Å; M211-I213 HydrophobicContact SD-CD1 4.13Å; M211-I213 HydrophobicContact SD-CG1 4.39Å
212H97.2Very high95.3Very high16 Ų1664.3 Ų64.37%0.07432%0.323CS..EExtended strand (participates in β ladder)trans-101.1136174.4-50.1-80.5000109.3W175 V176 T177 H202 V203 W210 C243 V248W175-H212 HydrophobicContact CE3-CB 4.01Å; W175-H212 HydrophobicContact CZ3-CB 3.98Å; V176-H212 CarbonylContact O-C 3.51Å; V176-H212 WeakPolarHBondContact O-CA 3.46Å; T177-H212 PolarHBondContact OG1-CE1 3.11Å; T177-H212 PolarHBondContact OG1-ND1 2.96Å; H202-H212 CarbonylContact C-O 3.58Å; H202-H212 WeakPolarHBondContact CA-O 3.2Å; V203-H212 PolarHBondContact N-O 3.44Å; V203-H212 PolarHBondContact O-N 3.1Å; W210-H212 AromaticContact CD1-NE2 3.61Å; W210-H212 AromaticContact NE1-NE2 3.8Å; H212-C243 PolarHBondContact ND1-SG 3.37Å; H212-C243 VanDerWaalsContact ND1-SG 3.4Å; H212-V248 HydrophobicContact CB-CG1 3.77Å
213I97.6Very high95.5Very high0 Ų065 Ų650%033%0.325CS..EExtended strand (participates in β ladder)trans-128.9122.6-177.4-59.1-178.1000109W175 V176 V178 L190 F193 I199 H202 M211 Y215W175-I213 VanDerWaalsContact CA-O 3.31Å; W175-I213 WeakPolarHBondContact CA-O 3.18Å; V176-I213 HydrophobicContact CG2-CB 4.05Å; V176-I213 PolarHBondContact N-O 3.37Å; V176-I213 PolarHBondContact O-N 2.96Å; V178-I213 HydrophobicContact CG2-CD1 3.79Å; V178-I213 HydrophobicContact CG2-CG1 4.35Å; L190-I213 HydrophobicContact CD1-CD1 3.95Å; L190-I213 HydrophobicContact CD1-CG1 4.37Å; F193-I213 HydrophobicContact CB-CD1 3.88Å; F193-I213 HydrophobicContact CD1-CD1 4.28Å; F193-I213 HydrophobicContact CG-CD1 4.28Å; I199-I213 HydrophobicContact CB-CG2 4.35Å; I199-I213 HydrophobicContact CD1-CD1 4.43Å; I199-I213 HydrophobicContact CD1-CG2 3.78Å; I199-I213 HydrophobicContact CG1-CG2 3.71Å; I199-I213 HydrophobicContact CG2-CG2 3.84Å; H202-I213 HydrophobicContact CB-CG1 4.32Å; M211-I213 HydrophobicContact CE-CD1 4.06Å; M211-I213 HydrophobicContact CG-CD1 4.44Å; M211-I213 HydrophobicContact CG-CG1 4.32Å; M211-I213 HydrophobicContact SD-CD1 4.13Å; M211-I213 HydrophobicContact SD-CG1 4.39Å; I213-Y215 HydrophobicContact CG2-CD2 4.19Å; I213-Y215 HydrophobicContact CG2-CE1 4.44Å; I213-Y215 HydrophobicContact CG2-CE2 3.84Å
214R97.1Very high95.6Very high39 Ų3962.8 Ų62.815%0.14731%0.312CS..EExtended strand (participates in β ladder)trans-92.1119.8168.6-162.9-178.9-154.1172.715109.4D172 S174 W175 L200 K201 D253D172-R214 IonicContact OD2-CZ 3.48Å; D172-R214 IonicContact OD2-NE 2.72Å; D172-R214 PolarHBondContact OD2-NE 3.46Å; D172-R214 IonicContact OD2-NH2 3.29Å; D172-R214 PolarHBondContact OD2-NH2 3.11Å; S174-R214 WeakPolarHBondContact OG-CG 3.3Å; W175-R214 HydrophobicContact CD2-CB 3.68Å; W175-R214 HydrophobicContact CD2-CG 3.99Å; W175-R214 HydrophobicContact CE3-CB 3.94Å; W175-R214 HydrophobicContact CG-CB 4.28Å; W175-R214 HydrophobicContact CG-CG 4.22Å; W175-R214 HydrophobicContact CH2-CB 3.96Å; W175-R214 HydrophobicContact CZ2-CB 3.67Å; W175-R214 HydrophobicContact CZ2-CG 3.94Å; W175-R214 HydrophobicContact CZ3-CB 4.08Å; L200-R214 HydrophobicContact CB-CB 4.5Å; L200-R214 PolarHBondContact N-O 3.48Å; K201-R214 HydrophobicContact CB-CB 4.27Å; K201-R214 PolarHBondContact O-N 3.21Å; R214-D253 IonicContact CZ-OD1 3.9Å; R214-D253 IonicContact CZ-OD2 3.54Å; R214-D253 IonicContact NH1-OD1 3.79Å; R214-D253 PolarHBondContact NH1-OD1 2.92Å; R214-D253 IonicContact NH1-OD2 2.73Å; R214-D253 IonicContact NH2-OD1 3.1Å; R214-D253 PolarHBondContact NH2-OD1 3Å; R214-D253 IonicContact NH2-OD2 3.19Å; R214-D253 PolarHBondContact NH2-OD2 3.49Å; R214-D253 VanDerWaalsContact NH2-OD2 3.1Å
215Y98.3Very high95.8Very high1 Ų161.9 Ų61.90%0.00431%0.308CS..EExtended strand (participates in β ladder)trans-88.5166.4171-76.3-75.4000112.2S174 V176 F193 N198 I199 I213 S217 Q220 A221 A224S174-Y215 WeakPolarHBondContact CB-O 3.29Å; S174-Y215 PolarHBondContact O-N 3.14Å; V176-Y215 HydrophobicContact CG2-CD2 4.4Å; V176-Y215 HydrophobicContact CG2-CE2 3.85Å; F193-Y215 WeakPolarHBondContact CB-OH 3.48Å; F193-Y215 PolarHBondContact O-OH 2.92Å; N198-Y215 CarbonylContact O-C 3.55Å; N198-Y215 WeakPolarHBondContact O-CA 3.41Å; I199-Y215 HydrophobicContact CD1-CE1 4.49Å; I199-Y215 HydrophobicContact CG1-CD1 4.17Å; I199-Y215 HydrophobicContact CG1-CE1 3.78Å; I213-Y215 HydrophobicContact CG2-CD2 4.19Å; I213-Y215 HydrophobicContact CG2-CE1 4.44Å; I213-Y215 HydrophobicContact CG2-CE2 3.84Å; Y215-S217 VanDerWaalsContact C-N 3.26Å; Y215-S217 PolarHBondContact O-N 2.85Å; Y215-Q220 HydrophobicContact CD1-CB 3.8Å; Y215-Q220 HydrophobicContact CG-CB 3.83Å; Y215-A221 HydrophobicContact CD2-CB 4.07Å; Y215-A224 HydrophobicContact CE2-CB 3.52Å
216Q96.6Very high96Very high118 Ų11864 Ų6455%0.55132%0.323SS*.SBendtrans-73.2-16.6173.6-168.1177.613.400113.1N198 L200 Q220N198-Q216 HydrophobicContact CB-CB 4.02Å; N198-Q216 PolarHBondContact ND2-OE1 3.07Å; N198-Q216 PolarHBondContact O-N 2.94Å; L200-Q216 HydrophobicContact CD1-CB 4.44Å; L200-Q216 HydrophobicContact CD2-CB 4.16Å; L200-Q216 HydrophobicContact CD2-CG 4.27Å; L200-Q216 HydrophobicContact CG-CB 4.2Å; Q216-Q220 VanDerWaalsContact N-OE1 3.16Å
217S96.8Very high96.6Very high48 Ų4858.8 Ų58.834%0.33629%0.293SS..SBendtrans-153.9154.6174.975.30000114.5Y215 L219 Q220 A221Y215-S217 VanDerWaalsContact C-N 3.26Å; Y215-S217 PolarHBondContact O-N 2.85Å; S217-L219 PolarHBondContact O-N 3.45Å; S217-L219 VanDerWaalsContact O-N 3.14Å; S217-Q220 WeakPolarHBondContact O-CB 3.44Å; S217-Q220 PolarHBondContact O-N 3.38Å; S217-Q220 PolarHBondContact OG-N 2.82Å; S217-A221 PolarHBondContact O-N 3.16Å; S217-A221 VanDerWaalsContact O-N 3.11Å
218K96.1Very high97.1Very high106 Ų10656.4 Ų56.446%0.46128%0.276SS..Hα-helixtrans-53-30.7172.6-179.8166.7-167.1164.30113.3D173 R222D173-K218 HydrophobicContact CB-CB 4.2Å; D173-K218 HydrophobicContact CB-CD 3.49Å; D173-K218 VanDerWaalsContact CB-CD 3.49Å; D173-K218 HydrophobicContact CB-CG 3.76Å; D173-K218 WeakPolarHBondContact OD1-CE 3.45Å; D173-K218 IonicContact OD1-NZ 2.65Å; D173-K218 PolarHBondContact OD1-NZ 2.9Å; D173-K218 WeakPolarHBondContact OD2-CE 3.39Å; D173-K218 IonicContact OD2-NZ 2.81Å; D173-K218 PolarHBondContact OD2-NZ 2.84Å; K218-R222 WeakPolarHBondContact O-CB 3.46Å; K218-R222 VanDerWaalsContact O-CG 3.27Å; K218-R222 WeakPolarHBondContact O-CG 3.45Å; K218-R222 PolarHBondContact O-N 2.91Å
219L97.6Very high97.4Very high128 Ų12857.4 Ų57.467%0.6729%0.286SS*.Hα-helixtrans-71-37.1177-175.460.5000112.3S217 R222 K223S217-L219 PolarHBondContact O-N 3.45Å; S217-L219 VanDerWaalsContact O-N 3.14Å; L219-R222 PolarHBondContact O-N 2.84Å; L219-K223 PolarHBondContact O-N 3.08Å
220Q98.1Very high97.4Very high41 Ų4160.5 Ų60.519%0.19229%0.292CS..Hα-helixtrans-67.7-43.7174.6-68.5173300110.9G197 N198 Y215 Q216 S217 R222 K223 A224G197-Q220 VanDerWaalsContact CA-CD 3.49Å; N198-Q220 PolarHBondContact O-OE1 2.62Å; Y215-Q220 HydrophobicContact CD1-CB 3.8Å; Y215-Q220 HydrophobicContact CG-CB 3.83Å; Q216-Q220 VanDerWaalsContact N-OE1 3.16Å; S217-Q220 WeakPolarHBondContact O-CB 3.44Å; S217-Q220 PolarHBondContact O-N 3.38Å; S217-Q220 PolarHBondContact OG-N 2.82Å; Q220-R222 PolarHBondContact O-N 3.21Å; Q220-K223 WeakPolarHBondContact O-CB 3.26Å; Q220-K223 PolarHBondContact O-N 2.93Å; Q220-K223 VanDerWaalsContact O-N 3.11Å; Q220-A224 PolarHBondContact O-N 3.02Å
221A97.8Very high97.4Very high0 Ų060.5 Ų60.50%030%0.298CS..Hα-helixtrans-58.4-45.7172.200000112D173 V176 Y215 S217 K223 A224 L225D173-A221 WeakPolarHBondContact O-CB 3.37Å; V176-A221 HydrophobicContact CG1-CB 4.01Å; Y215-A221 HydrophobicContact CD2-CB 4.07Å; S217-A221 PolarHBondContact O-N 3.16Å; S217-A221 VanDerWaalsContact O-N 3.11Å; A221-K223 VanDerWaalsContact C-N 3.31Å; A221-K223 PolarHBondContact O-N 2.87Å; A221-A224 WeakPolarHBondContact O-CB 3.37Å; A221-A224 PolarHBondContact O-N 2.96Å; A221-A224 VanDerWaalsContact O-N 3.1Å; A221-L225 WeakPolarHBondContact O-CG 3.47Å; A221-L225 PolarHBondContact O-N 2.87Å
222R97.8Very high97.3Very high164 Ų16461.4 Ų61.462%0.61930%0.302SS*.Hα-helixtrans-61.1-35.1173.1-73.5178.471.8-165.52.5113.3K218 L219 Q220 L225 S226K218-R222 WeakPolarHBondContact O-CB 3.46Å; K218-R222 VanDerWaalsContact O-CG 3.27Å; K218-R222 WeakPolarHBondContact O-CG 3.45Å; K218-R222 PolarHBondContact O-N 2.91Å; L219-R222 PolarHBondContact O-N 2.84Å; Q220-R222 PolarHBondContact O-N 3.21Å; R222-L225 PolarHBondContact O-N 2.86Å; R222-S226 PolarHBondContact O-N 2.98Å
223K98.1Very high97Very high98 Ų9862.5 Ų62.543%0.42632%0.318SS..Hα-helixtrans-67.5-35.2173.4-177.5176.3157.9-152.20111.7Q195 Y196 L219 Q220 A221 S226Q195-K223 PolarHBondContact O-NZ 3.36Å; Y196-K223 WeakPolarHBondContact O-CD 3.19Å; Y196-K223 PolarHBondContact O-NZ 2.84Å; Y196-K223 VanDerWaalsContact O-NZ 3.09Å; L219-K223 PolarHBondContact O-N 3.08Å; Q220-K223 WeakPolarHBondContact O-CB 3.26Å; Q220-K223 PolarHBondContact O-N 2.93Å; Q220-K223 VanDerWaalsContact O-N 3.11Å; A221-K223 VanDerWaalsContact C-N 3.31Å; A221-K223 PolarHBondContact O-N 2.87Å; K223-S226 PolarHBondContact O-OG 2.85Å
224A98.1Very high96.8Very high0 Ų072 Ų720%036%0.362CS..Hα-helixtrans-69.6-43.517100000112.5V176 F193 Y196 Y215 Q220 A221 S226 K227V176-A224 HydrophobicContact CG1-CB 4.47Å; V176-A224 HydrophobicContact CG2-CB 4.32Å; F193-A224 HydrophobicContact CD1-CB 3.96Å; F193-A224 HydrophobicContact CE1-CB 4Å; Y196-A224 HydrophobicContact CD2-CB 4.37Å; Y215-A224 HydrophobicContact CE2-CB 3.52Å; Q220-A224 PolarHBondContact O-N 3.02Å; A221-A224 WeakPolarHBondContact O-CB 3.37Å; A221-A224 PolarHBondContact O-N 2.96Å; A221-A224 VanDerWaalsContact O-N 3.1Å; A224-S226 PolarHBondContact O-N 3.24Å; A224-K227 VanDerWaalsContact O-CB 3.26Å; A224-K227 WeakPolarHBondContact O-CB 3.22Å; A224-K227 WeakPolarHBondContact O-CG 3.05Å; A224-K227 PolarHBondContact O-N 2.92Å
225L98.1Very high96.7Very high49 Ų4974.9 Ų74.926%0.25739%0.388SS..Hα-helixtrans-58.1-30.5174.6-70.6164000112.6V176 A221 R222 K227 D228 V240 P242V176-L225 HydrophobicContact CG1-CD1 4.27Å; V176-L225 HydrophobicContact CG1-CD2 4.04Å; V176-L225 HydrophobicContact CG1-CG 3.8Å; A221-L225 WeakPolarHBondContact O-CG 3.47Å; A221-L225 PolarHBondContact O-N 2.87Å; R222-L225 PolarHBondContact O-N 2.86Å; L225-K227 PolarHBondContact O-N 2.59Å; L225-D228 PolarHBondContact O-N 3.1Å; L225-V240 HydrophobicContact CD2-CG1 4.07Å; L225-P242 HydrophobicContact CD2-CG 4.25Å
226S97.9Very high96.7Very high69 Ų6975.5 Ų75.548%0.48339%0.391SS..THydrogen-bonded Turntrans-66.29.717182.40000115.1R222 K223 A224R222-S226 PolarHBondContact O-N 2.98Å; K223-S226 PolarHBondContact O-OG 2.85Å; A224-S226 PolarHBondContact O-N 3.24Å
227K97.7Very high96.7Very high37 Ų3775.4 Ų75.416%0.16139%0.393CS..THydrogen-bonded Turntrans-118.14.6177.8-49.6-67.9166.6-108.60113.7F193 Y196 A224 L225 G229 R230 F232 V240F193-K227 HydrophobicContact CZ-CB 4.31Å; Y196-K227 HydrophobicContact CD2-CG 4.15Å; Y196-K227 HydrophobicContact CE2-CB 4.47Å; Y196-K227 HydrophobicContact CE2-CD 4.21Å; Y196-K227 HydrophobicContact CE2-CG 3.61Å; A224-K227 VanDerWaalsContact O-CB 3.26Å; A224-K227 WeakPolarHBondContact O-CB 3.22Å; A224-K227 WeakPolarHBondContact O-CG 3.05Å; A224-K227 PolarHBondContact O-N 2.92Å; L225-K227 PolarHBondContact O-N 2.59Å; K227-G229 PolarHBondContact O-N 2.95Å; K227-R230 HydrophobicContact CB-CB 4.4Å; K227-R230 HydrophobicContact CB-CG 4.04Å; K227-R230 HydrophobicContact CD-CG 4.11Å; K227-R230 VanDerWaalsContact O-CB 3.24Å; K227-R230 WeakPolarHBondContact O-CB 3.39Å; K227-R230 WeakPolarHBondContact O-CG 3.2Å; K227-R230 PolarHBondContact O-N 2.85Å; K227-F232 HydrophobicContact CB-CZ 4.37Å; K227-V240 HydrophobicContact CB-CG2 4.29Å
228D97.6Very high96.8Very high68 Ų6873.1 Ų73.136%0.36438%0.377SS..THydrogen-bonded Turntrans-53.4130167.1-166.742.8000110.5L225 R230 G239 V240 K241L225-D228 PolarHBondContact O-N 3.1Å; D228-R230 VanDerWaalsContact C-N 3.29Å; D228-R230 PolarHBondContact O-N 3.34Å; D228-G239 WeakPolarHBondContact OD1-CA 3.4Å; D228-V240 HydrophobicContact CB-CB 4.3Å; D228-V240 WeakPolarHBondContact CB-O 3.38Å; D228-V240 PolarHBondContact OD1-N 3.18Å; D228-K241 IonicContact OD1-NZ 2.67Å; D228-K241 IonicContact OD2-NZ 2.85Å; D228-K241 PolarHBondContact OD2-NZ 3.24Å
229G96.6Very high96.9Very high45 Ų4568.5 Ų68.546%0.46436%0.359SS..THydrogen-bonded Turntrans74.14.1-175.600000116K227 I238K227-G229 PolarHBondContact O-N 2.95Å; G229-I238 WeakPolarHBondContact CA-O 3.31Å; G229-I238 PolarHBondContact N-O 2.9Å
230R97.3Very high96.9Very high146 Ų14662.5 Ų62.555%0.55133%0.327SS*.EExtended strand (participates in β ladder)trans-78.5140.5178.1-68-74.4-68.7-142.8-0.6111.5K227 D228 F232 I238K227-R230 HydrophobicContact CB-CB 4.4Å; K227-R230 HydrophobicContact CB-CG 4.04Å; K227-R230 HydrophobicContact CD-CG 4.11Å; K227-R230 VanDerWaalsContact O-CB 3.24Å; K227-R230 WeakPolarHBondContact O-CB 3.39Å; K227-R230 WeakPolarHBondContact O-CG 3.2Å; K227-R230 PolarHBondContact O-N 2.85Å; D228-R230 VanDerWaalsContact C-N 3.29Å; D228-R230 PolarHBondContact O-N 3.34Å; R230-F232 HydrophobicContact CB-CD2 4.29Å; R230-F232 HydrophobicContact CB-CE2 3.74Å; R230-F232 HydrophobicContact CB-CZ 4.45Å; R230-I238 PolarHBondContact O-N 2.94Å
231I96.8Very high96.9Very high98 Ų9864 Ų6450%0.50333%0.333SS..EExtended strand (participates in β ladder)trans-87.8134.6171.1-57175.8000109.7I236 M237I231-I236 CarbonylContact C-O 3.58Å; I231-I236 WeakPolarHBondContact CA-O 3.49Å; I231-M237 HydrophobicContact CD1-CE 4.28Å; I231-M237 HydrophobicContact CG1-CB 4.27Å; I231-M237 HydrophobicContact CG1-CE 4.22Å; I231-M237 HydrophobicContact CG1-CG 4.48Å
232F94.3Very high96.8Very high18 Ų1867.3 Ų67.38%0.07936%0.355CS..EExtended strand (participates in β ladder)trans-124.4150.4175.4-69.4-97.8000109.8Y188 I189 Q192 F193 Y196 K227 R230 E234 S235 I236 I238Y188-F232 HydrophobicContact CE1-CB 4.24Å; I189-F232 HydrophobicContact CD1-CB 3.96Å; I189-F232 HydrophobicContact CD1-CG 4.38Å; Q192-F232 HydrophobicContact CB-CD1 4.02Å; Q192-F232 HydrophobicContact CB-CE1 3.84Å; Q192-F232 HydrophobicContact CG-CD1 3.86Å; Q192-F232 HydrophobicContact CG-CE1 4.17Å; F193-F232 HydrophobicContact CE2-CE2 4.21Å; F193-F232 AromaticContact CE2-CZ 3.98Å; F193-F232 HydrophobicContact CE2-CZ 3.98Å; Y196-F232 HydrophobicContact CE2-CZ 4.29Å; Y196-F232 VanDerWaalsContact OH-CE1 3.23Å; Y196-F232 WeakPolarHBondContact OH-CE1 3.22Å; Y196-F232 VanDerWaalsContact OH-CZ 3.32Å; Y196-F232 WeakPolarHBondContact OH-CZ 3.24Å; K227-F232 HydrophobicContact CB-CZ 4.37Å; R230-F232 HydrophobicContact CB-CD2 4.29Å; R230-F232 HydrophobicContact CB-CE2 3.74Å; R230-F232 HydrophobicContact CB-CZ 4.45Å; F232-E234 PolarHBondContact O-N 3.29Å; F232-E234 VanDerWaalsContact O-N 3.09Å; F232-S235 PolarHBondContact O-N 2.73Å; F232-I236 PolarHBondContact N-O 2.83Å; F232-I236 WeakPolarHBondContact O-CB 3.35Å; F232-I236 PolarHBondContact O-N 3.34Å; F232-I238 HydrophobicContact CB-CG1 4.5Å; F232-I238 HydrophobicContact CD2-CB 3.9Å; F232-I238 HydrophobicContact CD2-CG1 3.41Å; F232-I238 VanDerWaalsContact CD2-CG1 3.41Å; F232-I238 HydrophobicContact CE2-CB 3.96Å; F232-I238 HydrophobicContact CE2-CG1 3.9Å; F232-I238 HydrophobicContact CE2-CG2 4.48Å; F232-I238 HydrophobicContact CG-CG1 4.25Å
233G91.4Very high96.6Very high39 Ų3959.7 Ų59.740%0.40233%0.326SS..THydrogen-bonded Turntrans52.830.6-176.400000113.7Y188 S235Y188-G233 PolarHBondContact OH-N 3.1Å; G233-S235 PolarHBondContact O-N 2.72Å; G233-S235 PolarHBondContact O-OG 2.85Å
234E93.6Very high96.4Very high199 Ų19956.2 Ų56.293%0.9331%0.312SS*.THydrogen-bonded Turntrans57.6-2.5-178.2-66.9162.2-170.500116.4F232F232-E234 PolarHBondContact O-N 3.29Å; F232-E234 VanDerWaalsContact O-N 3.09Å
235S95.3Very high96Very high100 Ų10058.6 Ų58.670%0.69933%0.325SS*.THydrogen-bonded Turntrans-139.7-14.9-166.654.20000114.6F232 G233F232-S235 PolarHBondContact O-N 2.73Å; G233-S235 PolarHBondContact O-N 2.72Å; G233-S235 PolarHBondContact O-OG 2.85Å
236I96.3Very high95.5Very high14 Ų1460.6 Ų60.67%0.07233%0.332CS..EExtended strand (participates in β ladder)trans-111.4104.5-173.9-50172.3000109.6F181 P182 I189 I231 F232 I238F181-I236 HydrophobicContact CB-CG2 3.9Å; P182-I236 HydrophobicContact CG-CD1 4.37Å; I189-I236 HydrophobicContact CD1-CD1 4.41Å; I189-I236 HydrophobicContact CD1-CG2 4.5Å; I231-I236 CarbonylContact C-O 3.58Å; I231-I236 WeakPolarHBondContact CA-O 3.49Å; F232-I236 PolarHBondContact N-O 2.83Å; F232-I236 WeakPolarHBondContact O-CB 3.35Å; F232-I236 PolarHBondContact O-N 3.34Å; I236-I238 HydrophobicContact CG2-CD1 3.61Å; I236-I238 HydrophobicContact CG2-CG1 4.25Å
237M97.6Very high95Very high117 Ų11761.1 Ų61.158%0.57634%0.335SS*.EExtended strand (participates in β ladder)trans-79.1120.5170.4-173.6178.6-70.800110I231I231-M237 HydrophobicContact CD1-CE 4.28Å; I231-M237 HydrophobicContact CG1-CB 4.27Å; I231-M237 HydrophobicContact CG1-CE 4.22Å; I231-M237 HydrophobicContact CG1-CG 4.48Å
238I98.2Very high94.6Very high0 Ų060.1 Ų60.10%033%0.332CS..EExtended strand (participates in β ladder)trans-100.8128-176.6-63.2-63.9000110.9V178 F179 F181 I189 F193 G229 R230 F232 I236 V240V178-I238 HydrophobicContact CG1-CG2 3.53Å; F179-I238 WeakPolarHBondContact O-CA 3.48Å; F181-I238 HydrophobicContact CB-CD1 3.81Å; F181-I238 HydrophobicContact CD1-CD1 4Å; F181-I238 HydrophobicContact CG-CD1 4.41Å; I189-I238 HydrophobicContact CD1-CD1 3.76Å; I189-I238 HydrophobicContact CD1-CG1 4.08Å; I189-I238 HydrophobicContact CG1-CD1 3.94Å; I189-I238 HydrophobicContact CG2-CD1 3.97Å; I189-I238 HydrophobicContact CG2-CG1 4.46Å; F193-I238 HydrophobicContact CE2-CG2 4.03Å; F193-I238 HydrophobicContact CZ-CG2 3.8Å; G229-I238 WeakPolarHBondContact CA-O 3.31Å; G229-I238 PolarHBondContact N-O 2.9Å; R230-I238 PolarHBondContact O-N 2.94Å; F232-I238 HydrophobicContact CB-CG1 4.5Å; F232-I238 HydrophobicContact CD2-CB 3.9Å; F232-I238 HydrophobicContact CD2-CG1 3.41Å; F232-I238 VanDerWaalsContact CD2-CG1 3.41Å; F232-I238 HydrophobicContact CE2-CB 3.96Å; F232-I238 HydrophobicContact CE2-CG1 3.9Å; F232-I238 HydrophobicContact CE2-CG2 4.48Å; F232-I238 HydrophobicContact CG-CG1 4.25Å; I236-I238 HydrophobicContact CG2-CD1 3.61Å; I236-I238 HydrophobicContact CG2-CG1 4.25Å; I238-V240 HydrophobicContact CG2-CG2 3.85Å
239G98Very high94.1Very high8 Ų857.5 Ų57.58%0.08232%0.318CS..EExtended strand (participates in β ladder)trans-89.2143.1163.900000111V178 F179 D228V178-G239 WeakPolarHBondContact CA-O 3.38Å; F179-G239 PolarHBondContact N-O 3.29Å; F179-G239 PolarHBondContact O-N 3.15Å; D228-G239 WeakPolarHBondContact OD1-CA 3.4Å
240V98.3Very high93.5Very high3 Ų360 Ų602%0.01832%0.318CS..EExtended strand (participates in β ladder)trans-139.9119.2175.2-163.10000109.7V176 T177 V178 F193 L225 K227 D228 I238V176-V240 HydrophobicContact CB-CG1 4.01Å; V176-V240 HydrophobicContact CG1-CG1 4.42Å; V176-V240 HydrophobicContact CG2-CG1 4.27Å; T177-V240 WeakPolarHBondContact O-CA 3.45Å; V178-V240 HydrophobicContact CG2-CG1 4.38Å; F193-V240 HydrophobicContact CE1-CG1 4.09Å; F193-V240 HydrophobicContact CE1-CG2 3.69Å; F193-V240 HydrophobicContact CZ-CG2 3.51Å; L225-V240 HydrophobicContact CD2-CG1 4.07Å; K227-V240 HydrophobicContact CB-CG2 4.29Å; D228-V240 HydrophobicContact CB-CB 4.3Å; D228-V240 WeakPolarHBondContact CB-O 3.38Å; D228-V240 PolarHBondContact OD1-N 3.18Å; I238-V240 HydrophobicContact CG2-CG2 3.85Å
241K97.6Very high92.5Very high72 Ų7255.7 Ų55.731%0.31331%0.31SS..EExtended strand (participates in β ladder)trans-131.3162.6178.2-55.1-68.4178.5-168.40110.4F158 V176 T177 F179 D228F158-K241 HydrophobicContact CE1-CB 4.18Å; F158-K241 HydrophobicContact CE2-CB 3.59Å; F158-K241 HydrophobicContact CE2-CG 4.17Å; F158-K241 HydrophobicContact CZ-CB 3.37Å; F158-K241 HydrophobicContact CZ-CG 4.09Å; V176-K241 CarbonylContact C-O 3.54Å; V176-K241 WeakPolarHBondContact CA-O 3.46Å; T177-K241 PolarHBondContact N-O 3.33Å; T177-K241 PolarHBondContact O-N 2.93Å; F179-K241 HydrophobicContact CE1-CG 3.79Å; F179-K241 HydrophobicContact CZ-CG 4.32Å; D228-K241 IonicContact OD1-NZ 2.67Å; D228-K241 IonicContact OD2-NZ 2.85Å; D228-K241 PolarHBondContact OD2-NZ 3.24Å
242P95.9Very high91Very high69 Ų6951.7 Ų51.745%0.44829%0.291SS..EExtended strand (participates in β ladder)trans-56.2149.1170.9-23.335.1000110.8F158 L225F158-P242 WeakPolarHBondContact CZ-O 3.5Å; L225-P242 HydrophobicContact CD2-CG 4.25Å
243C94.8Very high89.5Confident4 Ų454.3 Ų54.33%0.02731%0.305CS..  trans-77.2129.9174.1-167.50000110.6W175 H212 M249W175-C243 HydrophobicContact CB-CB 3.4Å; W175-C243 VanDerWaalsContact CB-CB 3.4Å; W175-C243 HydrophobicContact CG-CB 4.37Å; W175-C243 PolarHBondContact O-N 3.3Å; H212-C243 PolarHBondContact ND1-SG 3.37Å; H212-C243 VanDerWaalsContact ND1-SG 3.4Å; C243-M249 HydrophobicContact CB-CE 4.41Å; C243-M249 WeakPolarHBondContact O-CE 3.39Å
244I92.8Very high87.9Confident26 Ų2659.2 Ų59.213%0.13331%0.312CS..  trans-106.9-7.217563-179.6000112.9F158 Q161 L165 L171 K246F158-I244 HydrophobicContact CD2-CD1 3.98Å; F158-I244 HydrophobicContact CE2-CD1 4.14Å; F158-I244 HydrophobicContact CE2-CG1 4.46Å; F158-I244 HydrophobicContact CG-CD1 4.26Å; F158-I244 HydrophobicContact CZ-CG2 4.12Å; Q161-I244 HydrophobicContact CB-CD1 4.09Å; L165-I244 HydrophobicContact CD1-CB 4.35Å; L165-I244 HydrophobicContact CD1-CG2 4.09Å; L171-I244 HydrophobicContact CD1-CG2 4.43Å; I244-K246 PolarHBondContact O-N 3.37Å; I244-K246 VanDerWaalsContact O-N 3.13Å
245D89.4Confident85.7Confident50 Ų5054.7 Ų54.727%0.26730%0.301SS..  trans-80.297.3-179.6-169.4-32.2000111.2S247 V248 M249D245-S247 VanDerWaalsContact C-N 3.25Å; D245-S247 PolarHBondContact O-N 3.39Å; D245-S247 WeakPolarHBondContact OD1-CA 3.46Å; D245-S247 WeakPolarHBondContact OD1-CB 3.26Å; D245-S247 PolarHBondContact OD1-N 2.89Å; D245-S247 PolarHBondContact OD1-OG 3.38Å; D245-V248 HydrophobicContact CB-CB 4.11Å; D245-V248 HydrophobicContact CB-CG2 4.11Å; D245-V248 PolarHBondContact O-N 3.05Å; D245-V248 PolarHBondContact OD1-N 3.37Å; D245-V248 WeakPolarHBondContact OD2-CG2 3.44Å; D245-M249 WeakPolarHBondContact O-CE 3.4Å; D245-M249 WeakPolarHBondContact O-CG 3.33Å; D245-M249 PolarHBondContact O-N 3.39Å
246K88.4Confident83.5Confident90 Ų9053.7 Ų53.739%0.39130%0.299SS..Hα-helixtrans-60.6-32.3177.1-51.9-170.9-168.3-171.70112.9D169 L171 I244 M249 E250D169-K246 WeakPolarHBondContact OD1-CE 3.23Å; D169-K246 IonicContact OD1-NZ 3.13Å; D169-K246 PolarHBondContact OD1-NZ 3.3Å; D169-K246 IonicContact OD2-NZ 2.65Å; D169-K246 PolarHBondContact OD2-NZ 3.01Å; L171-K246 HydrophobicContact CD2-CD 4.43Å; L171-K246 HydrophobicContact CD2-CG 4.02Å; I244-K246 PolarHBondContact O-N 3.37Å; I244-K246 VanDerWaalsContact O-N 3.13Å; K246-M249 PolarHBondContact O-N 2.65Å; K246-E250 WeakPolarHBondContact O-CB 3.41Å; K246-E250 PolarHBondContact O-N 3.29Å
247S88.3Confident81.2Confident80 Ų8059.8 Ų59.856%0.55933%0.331SS*.Hα-helixtrans-70.5-40.8-17878.60000111.4D245 M249 S251D245-S247 VanDerWaalsContact C-N 3.25Å; D245-S247 PolarHBondContact O-N 3.39Å; D245-S247 WeakPolarHBondContact OD1-CA 3.46Å; D245-S247 WeakPolarHBondContact OD1-CB 3.26Å; D245-S247 PolarHBondContact OD1-N 2.89Å; D245-S247 PolarHBondContact OD1-OG 3.38Å; S247-M249 VanDerWaalsContact C-N 3.34Å; S247-S251 VanDerWaalsContact O-CB 3.26Å; S247-S251 WeakPolarHBondContact O-CB 3.48Å; S247-S251 PolarHBondContact O-N 3.15Å; S247-S251 PolarHBondContact O-OG 2.81Å
248V88.1Confident78.7Confident16 Ų1658.5 Ų58.510%0.09733%0.333CS..Hα-helixtrans-63.3-42173.4169.70000110.7W175 V203 H212 D245 S251 S252W175-V248 HydrophobicContact CE3-CG1 4.21Å; W175-V248 HydrophobicContact CH2-CG1 3.84Å; W175-V248 HydrophobicContact CZ3-CG1 3.55Å; V203-V248 HydrophobicContact CB-CG1 4.27Å; V203-V248 HydrophobicContact CG2-CG1 4.08Å; H212-V248 HydrophobicContact CB-CG1 3.77Å; D245-V248 HydrophobicContact CB-CB 4.11Å; D245-V248 HydrophobicContact CB-CG2 4.11Å; D245-V248 PolarHBondContact O-N 3.05Å; D245-V248 PolarHBondContact OD1-N 3.37Å; D245-V248 WeakPolarHBondContact OD2-CG2 3.44Å; V248-S251 PolarHBondContact O-OG 2.65Å; V248-S252 PolarHBondContact O-OG 3.38Å
249M86.9Confident76Confident13 Ų1362.4 Ų62.46%0.06436%0.361CS..Hα-helixtrans-62.7-60.1176.2-66.8-172.7-98.300111.5L171 D172 W175 C243 D245 K246 S247 S251 S252L171-M249 HydrophobicContact CB-CE 4.27Å; L171-M249 HydrophobicContact CD1-CE 4.43Å; L171-M249 HydrophobicContact CD2-CE 3.86Å; L171-M249 HydrophobicContact CG-CE 4.41Å; D172-M249 HydrophobicContact CB-SD 4.03Å; W175-M249 HydrophobicContact CB-SD 4.36Å; W175-M249 HydrophobicContact CD2-CG 3.97Å; W175-M249 HydrophobicContact CG-CG 3.86Å; W175-M249 HydrophobicContact CG-SD 4.15Å; C243-M249 HydrophobicContact CB-CE 4.41Å; C243-M249 WeakPolarHBondContact O-CE 3.39Å; D245-M249 WeakPolarHBondContact O-CE 3.4Å; D245-M249 WeakPolarHBondContact O-CG 3.33Å; D245-M249 PolarHBondContact O-N 3.39Å; K246-M249 PolarHBondContact O-N 2.65Å; S247-M249 VanDerWaalsContact C-N 3.34Å; M249-S251 VanDerWaalsContact C-N 3.28Å; M249-S251 PolarHBondContact O-N 2.83Å; M249-S252 VanDerWaalsContact O-CB 3.24Å; M249-S252 WeakPolarHBondContact O-CB 3.27Å; M249-S252 PolarHBondContact O-N 3.16Å; M249-S252 VanDerWaalsContact O-N 3.08Å; M249-S252 PolarHBondContact O-OG 3.05Å
250E84.3Confident73.7Confident98 Ų9868.1 Ų68.146%0.45840%0.396SS..Hα-helixtrans-61.5-31.9-175.1-158.1-160.5152.500113.3K246 S252 D253 R254K246-E250 WeakPolarHBondContact O-CB 3.41Å; K246-E250 PolarHBondContact O-N 3.29Å; E250-S252 PolarHBondContact O-N 2.98Å; E250-D253 PolarHBondContact O-N 2.91Å; E250-R254 HydrophobicContact CG-CG 4.47Å; E250-R254 WeakPolarHBondContact O-CG 3.26Å; E250-R254 PolarHBondContact O-N 3.45Å; E250-R254 IonicContact OE1-CZ 2.76Å; E250-R254 IonicContact OE1-NE 2.78Å; E250-R254 PolarHBondContact OE1-NE 2.98Å; E250-R254 IonicContact OE1-NH2 2.68Å; E250-R254 PolarHBondContact OE1-NH2 3.4Å
251S77.3Confident71Confident55 Ų5573.4 Ų73.439%0.38543%0.433SS..Hα-helixtrans-56.4-11175.575.80000114.6K201 S247 V248 M249K201-S251 PolarHBondContact NZ-O 3.13Å; K201-S251 PolarHBondContact NZ-OG 3.16Å; S247-S251 VanDerWaalsContact O-CB 3.26Å; S247-S251 WeakPolarHBondContact O-CB 3.48Å; S247-S251 PolarHBondContact O-N 3.15Å; S247-S251 PolarHBondContact O-OG 2.81Å; V248-S251 PolarHBondContact O-OG 2.65Å; M249-S251 VanDerWaalsContact C-N 3.28Å; M249-S251 PolarHBondContact O-N 2.83Å
252S64.1Low68.5Low15 Ų1578.1 Ų78.111%0.10546%0.461CS..Hα-helixtrans-91.2-43.6-177.9-45.30000111.8W175 K201 V248 M249 E250 C255W175-S252 WeakPolarHBondContact CZ2-OG 3.46Å; K201-S252 WeakPolarHBondContact CD-OG 3.26Å; K201-S252 PolarHBondContact NZ-OG 3.5Å; V248-S252 PolarHBondContact O-OG 3.38Å; M249-S252 VanDerWaalsContact O-CB 3.24Å; M249-S252 WeakPolarHBondContact O-CB 3.27Å; M249-S252 PolarHBondContact O-N 3.16Å; M249-S252 VanDerWaalsContact O-N 3.08Å; M249-S252 PolarHBondContact O-OG 3.05Å; E250-S252 PolarHBondContact O-N 2.98Å; S252-C255 WeakPolarHBondContact O-CB 3.4Å; S252-C255 PolarHBondContact O-N 2.73Å
253D62.6Low65.9Low72 Ų7279.2 Ų79.239%0.38548%0.476SS..Hα-helixtrans-84-22.5-173.7-55.8-37.5000110.8R214 E250 C255 A256 L257R214-D253 IonicContact CZ-OD1 3.9Å; R214-D253 IonicContact CZ-OD2 3.54Å; R214-D253 IonicContact NH1-OD1 3.79Å; R214-D253 PolarHBondContact NH1-OD1 2.92Å; R214-D253 IonicContact NH1-OD2 2.73Å; R214-D253 IonicContact NH2-OD1 3.1Å; R214-D253 PolarHBondContact NH2-OD1 3Å; R214-D253 IonicContact NH2-OD2 3.19Å; R214-D253 PolarHBondContact NH2-OD2 3.49Å; R214-D253 VanDerWaalsContact NH2-OD2 3.1Å; E250-D253 PolarHBondContact O-N 2.91Å; D253-C255 PolarHBondContact O-N 2.86Å; D253-A256 WeakPolarHBondContact O-CB 3.46Å; D253-A256 PolarHBondContact O-N 3.26Å; D253-L257 PolarHBondContact O-N 2.85Å
254R57.9Low63.4Low143 Ų14388.6 Ų88.654%0.5452%0.517SS..Hα-helixtrans-57.1-33.2164.4-67.3-70.9173.9-177.3-4112.9E250 A256 L257 S258E250-R254 HydrophobicContact CG-CG 4.47Å; E250-R254 WeakPolarHBondContact O-CG 3.26Å; E250-R254 PolarHBondContact O-N 3.45Å; E250-R254 IonicContact OE1-CZ 2.76Å; E250-R254 IonicContact OE1-NE 2.78Å; E250-R254 PolarHBondContact OE1-NE 2.98Å; E250-R254 IonicContact OE1-NH2 2.68Å; E250-R254 PolarHBondContact OE1-NH2 3.4Å; R254-A256 VanDerWaalsContact C-N 3.29Å; R254-A256 PolarHBondContact O-N 3.34Å; R254-L257 PolarHBondContact O-N 3.18Å; R254-S258 VanDerWaalsContact O-CB 3.23Å; R254-S258 WeakPolarHBondContact O-CB 3.5Å; R254-S258 PolarHBondContact O-N 3.08Å; R254-S258 PolarHBondContact O-OG 3.22Å
255C47.5Very low61.6Low104 Ų10493.1 Ų93.170%0.70355%0.545SS*.Hα-helixtrans-68.7-23.3174.3-790000113.9S252 D253S252-C255 WeakPolarHBondContact O-CB 3.4Å; S252-C255 PolarHBondContact O-N 2.73Å; D253-C255 PolarHBondContact O-N 2.86Å
256A49.8Very low59.5Low78 Ų7895.6 Ų95.665%0.64556%0.564SS**Hα-helixtrans-80.5-36.6174.600000111.9D253 R254D253-A256 WeakPolarHBondContact O-CB 3.46Å; D253-A256 PolarHBondContact O-N 3.26Å; R254-A256 VanDerWaalsContact C-N 3.29Å; R254-A256 PolarHBondContact O-N 3.34Å
257L48.2Very low57.3Low143 Ų14397.2 Ų97.275%0.74958%0.584SS**Hα-helixtrans-90.8-22.3-175.8-70.4165.4000114.2D253 R254 S259D253-L257 PolarHBondContact O-N 2.85Å; R254-L257 PolarHBondContact O-N 3.18Å; L257-S259 VanDerWaalsContact C-N 3.28Å; L257-S259 PolarHBondContact O-N 3.33Å
258S44.5Very low55.1Low90 Ų90101.5 Ų101.563%0.62960%0.599SS**  trans-9235.5174.4-62.50000113.5R254R254-S258 VanDerWaalsContact O-CB 3.23Å; R254-S258 WeakPolarHBondContact O-CB 3.5Å; R254-S258 PolarHBondContact O-N 3.08Å; R254-S258 PolarHBondContact O-OG 3.22Å
259S42Very low52.8Low82 Ų82110.1 Ų110.157%0.57364%0.635SS**SBendtrans-65.4126.8148.7-70.10000107.9L257 S261L257-S259 VanDerWaalsContact C-N 3.28Å; L257-S259 PolarHBondContact O-N 3.33Å; S259-S261 PolarHBondContact O-N 2.61Å
260P48.9Very low50.3Low127 Ų127116.2 Ų116.283%0.82567%0.673SS**  trans-67.69917727-33.1000109.3L262P260-L262 PolarHBondContact O-N 2.86Å
261S41.4Very low48.1Very low114 Ų114120 Ų12080%0.79770%0.695SS**PPolyproline II helixtrans-62.4127.7178.444.20000110S259 A263S259-S261 PolarHBondContact O-N 2.61Å; S261-A263 PolarHBondContact O-N 3.35Å
262L46.4Very low46Very low171 Ų171120.8 Ų120.890%0.89571%0.713SS**PPolyproline II helixtrans-57.9132.5178.6-68.1168.5000109.8P260 F264P260-L262 PolarHBondContact O-N 2.86Å; L262-F264 PolarHBondContact O-N 3Å
263A41Very low44.7Very low92 Ų92126.8 Ų126.876%0.7675%0.748SS**PPolyproline II helixtrans-57.1126.8-17200000112.1S261 T265S261-A263 PolarHBondContact O-N 3.35Å; A263-T265 PolarHBondContact O-N 3.21Å
264F42.6Very low44.2Very low202 Ų202128.8 Ų128.889%0.88677%0.765SS**  trans-81.981.1-171.8-161.8-88.3000111.3L262L262-F264 PolarHBondContact O-N 3Å
265T54.2Low42.9Very low120 Ų120128.1 Ų128.174%0.73678%0.778SS**PPolyproline II helixtrans-77.6123.8175.453.80000111.1A263A263-T265 PolarHBondContact O-N 3.21Å
266P45.1Very low42.5Very low102 Ų102131.1 Ų131.166%0.66278%0.781SS**PPolyproline II helixtrans-72.9148.9-179.830-35.1000112.3
267P43.4Very low42.5Very low124 Ų124133.1 Ų133.181%0.80579%0.788SS**PPolyproline II helixtrans-84.8124-175.732.4-33.8000112.8
268I40.7Very low41.8Very low171 Ų171129.6 Ų129.688%0.87779%0.786SS**  trans-114.2135.816322.3174000109.5
269K40.2Very low41.5Very low197 Ų197130 Ų13086%0.85779%0.789SS**  trans-109.7110.1-172.7-61.1175.6-177.6176.20111
270T33.9Very low41.6Very low141 Ų141132.1 Ų132.187%0.86580%0.798SS**  trans-150.5119.2158.8-80000114.2
271L38.5Very low41.7Very low177 Ų177131.2 Ų131.293%0.92779%0.792SS**  trans-20.1131.8158.7-176.167.1000117.8
272G32.8Very low41.9Very low72 Ų72136.3 Ų136.374%0.74279%0.794SS**  trans171.9127.1164.600000114.9
273T36.3Very low41.8Very low140 Ų140134.7 Ų134.786%0.85979%0.785SS**  trans-124.5174.3174.651.60000109.6
274P52.3Low42Very low114 Ų114135.6 Ų135.674%0.7479%0.786SS**  cis-128.2-156.2-14.935-14.6000112.3
275T31.3Very low42.4Very low130 Ų130131.8 Ų131.880%0.79878%0.779SS**  trans125.1128.2142.5-43.60000116.8
276Q39Very low42Very low166 Ų166134.9 Ų134.978%0.77679%0.788SS**  trans-117.7176.1172-90.9-104.7-4.900107.4
277P50.6Low43Very low120 Ų120139.1 Ų139.178%0.77979%0.79SS**  cis-148.6171.524.742.9-22.6000119.8
278G33.4Very low43.8Very low69 Ų69138 Ų13871%0.71178%0.783SS**  trans78.6166.7143.100000120.1
279S37.4Very low44.4Very low99 Ų99137.3 Ų137.369%0.69278%0.78SS**  cis-165.1130.9-20.9-175.60000112.6
280T45.3Very low45.2Very low126 Ų126131.2 Ų131.277%0.77377%0.767SS**  trans61.4165.3152.749.40000120.1
281P50.1Low46Very low108 Ų108127.5 Ų127.570%0.70174%0.744SS**  cis-138.7162.4-45.838-22.7000114.8
282R45.1Very low46.6Very low221 Ų221122.1 Ų122.183%0.83473%0.725SS**  162.7112.2128-83.3-99.9-106.7-171.8-4.2114.6
283I44.8Very low47.5Very low138 Ų138125.6 Ų125.671%0.70872%0.717SS**  trans46.3104.4136.2-50.2-180000119.6
284S46.2Very low48.5Very low111 Ų111125.7 Ų125.778%0.77671%0.705SS**  trans54142.8130.4-1180000121.2
285T49.9Very low48.4Very low121 Ų121124.2 Ų124.274%0.74270%0.703SS**  cis-137.2176.427.560.80000114
286M46.8Very low48.9Very low186 Ų186123 Ų12392%0.91670%0.699SS**  trans77.2118.4-178.6-60.3-169.668.400116.8
287R65.9Low49.5Very low191 Ų191120.3 Ų120.372%0.72169%0.694SS**  trans-110.6131.1175.3-173.8-179.2-166.6153.26.3109.1L289 T291R287-L289 PolarHBondContact O-N 3.41Å; R287-T291 PolarHBondContact NE-OG1 3.13Å
288P58.9Low49.7Very low99 Ų99119 Ų11964%0.64369%0.689SS**  trans-59.4131.3172.3-24.534.7000111.5A290 T291P288-A290 PolarHBondContact O-N 3.09Å; P288-T291 PolarHBondContact O-N 2.67Å; P288-T291 PolarHBondContact O-OG1 2.81Å
289L53.9Low50.6Low157 Ų157122.4 Ų122.482%0.82269%0.69SS**G310 helixtrans-55.9-22.5-175.4-63.4171.7000113.4R287 T291 A292R287-L289 PolarHBondContact O-N 3.41Å; L289-T291 PolarHBondContact O-N 2.76Å; L289-T291 VanDerWaalsContact O-N 3.09Å; L289-A292 PolarHBondContact O-N 2.85Å
290A56.3Low50.8Low70 Ų70128.6 Ų128.658%0.57970%0.7SS**G310 helixtrans-59.1-14176.500000115.7P288 Y293P288-A290 PolarHBondContact O-N 3.09Å; A290-Y293 HydrophobicContact CB-CE1 4.46Å; A290-Y293 WeakPolarHBondContact O-CD1 3.41Å; A290-Y293 WeakPolarHBondContact O-CE1 3.39Å
291T52.2Low51Low63 Ų63131.1 Ų131.139%0.38770%0.703SS.*G310 helixtrans-87.7-19.31704.80000114.4R287 P288 L289R287-T291 PolarHBondContact NE-OG1 3.13Å; P288-T291 PolarHBondContact O-N 2.67Å; P288-T291 PolarHBondContact O-OG1 2.81Å; L289-T291 PolarHBondContact O-N 2.76Å; L289-T291 VanDerWaalsContact O-N 3.09Å
292A49.5Very low50.8Low64 Ų64132 Ų13253%0.52971%0.706SS.*THydrogen-bonded Turntrans-74.5-40-174.800000112.3L289 K294 A295L289-A292 PolarHBondContact O-N 2.85Å; A292-K294 PolarHBondContact O-N 3.09Å; A292-K294 VanDerWaalsContact O-N 3.09Å; A292-A295 PolarHBondContact O-N 3.08Å
293Y53.4Low50.8Low145 Ų145128.8 Ų128.857%0.56970%0.704SS**THydrogen-bonded Turntrans-66.3-15-176.685.9-90.1000114.2A290A290-Y293 HydrophobicContact CB-CE1 4.46Å; A290-Y293 WeakPolarHBondContact O-CD1 3.41Å; A290-Y293 WeakPolarHBondContact O-CE1 3.39Å
294K57.1Low51.3Low141 Ų141128 Ų12861%0.61371%0.711SS**THydrogen-bonded Turntrans-90.7-6.5173.6-69.5-57.7-166.2-174.20114.2A292A292-K294 PolarHBondContact O-N 3.09Å; A292-K294 VanDerWaalsContact O-N 3.09Å
295A48.8Very low51.3Low83 Ų83128.7 Ų128.769%0.68671%0.706SS**SBendtrans-100.85.6178.300000113.2A292A292-A295 PolarHBondContact O-N 3.08Å
296S42.6Very low51.5Low104 Ų104134.4 Ų134.473%0.72771%0.714SS**SBendtrans-130.630.9-175.2-171.80000112.4
297T51Low51.7Low110 Ų110133.7 Ų133.768%0.67571%0.708SS**  trans-131.249.3176.564.60000111
298S55.2Low50.8Low94 Ų94130.1 Ų130.166%0.65771%0.708SS**  trans-144.478.217558.50000109.6
299D52.3Low50Low139 Ų139131.9 Ų131.974%0.74372%0.719SS**SBendtrans-175.4165.9143.9-89.2-31.7000108.2
300Y40.8Very low50.1Low229 Ų229132.4 Ų132.490%0.89872%0.715SS**  trans64.151.6179.9-43.9-68.2000116.6
301Q50Low50Low180 Ų180137 Ų13784%0.84172%0.722SS**  trans-88.6160.1142.3-162178.323.200109.2
302V45.6Very low50.2Low126 Ų126139.9 Ų139.976%0.76474%0.735SS**  trans79.291.4174-166.80000115
303I46.4Very low50.8Low154 Ų154144.3 Ų144.379%0.7974%0.744SS**  -154.4135.9105.7-90.2149.6000107.4D305I303-D305 HydrophobicContact CG2-CB 4.35Å; I303-D305 PolarHBondContact O-N 3.42Å
304S54.7Low51.3Low121 Ų121140.4 Ų140.485%0.84674%0.739SS**  trans-92.678.9175.5-66.70000110.6
305D45.3Very low51.8Low126 Ų126141 Ų14167%0.67475%0.748SS**  trans-78.6125.3172.7-170.21.2000111I303 Q307I303-D305 HydrophobicContact CG2-CB 4.35Å; I303-D305 PolarHBondContact O-N 3.42Å; D305-Q307 PolarHBondContact OD1-N 3.18Å
306R54.3Low52.5Low240 Ų240141.9 Ų141.991%0.90674%0.744SS**  trans-106.533.8-178.1-69.2-173.770.5-173.42.6112.5
307Q52.3Low53.7Low171 Ų171139.7 Ų139.780%0.79973%0.729SS**  trans-133.371.3-177.8-111.9163.4-30.400115.2D305D305-Q307 PolarHBondContact OD1-N 3.18Å
308T45.4Very low54.5Low116 Ų116140.6 Ų140.671%0.71272%0.724SS**  trans-120125.8154.548.50000109.5K310T308-K310 PolarHBondContact O-N 2.91Å
309P42.9Very low55.3Low137 Ų137138.5 Ų138.589%0.8971%0.712SS**  trans-72111.4-17928.1-33000110.1
310K56.9Low56.2Low167 Ų167136.5 Ų136.573%0.72670%0.699SS**  trans-86.1141.5168.9-69.7-171.2174.7-175.60109.5T308 D312T308-K310 PolarHBondContact O-N 2.91Å; K310-D312 PolarHBondContact O-N 2.88Å
311K53.3Low57.6Low166 Ų166131 Ų13172%0.72268%0.681SS**  trans-75.290.4173-173.4-159178.8-160.80108.5E313K311-E313 HydrophobicContact CD-CG 4.35Å; K311-E313 WeakPolarHBondContact CE-OE1 3.02Å; K311-E313 IonicContact NZ-OE1 2.68Å; K311-E313 PolarHBondContact NZ-OE1 3.12Å; K311-E313 PolarHBondContact O-N 2.9Å
312D57.1Low58.4Low125 Ų125131.9 Ų131.967%0.66868%0.679SS**  trans-73.4106.9176.6-67.3-38.9000110.3K310 S314 S317K310-D312 PolarHBondContact O-N 2.88Å; D312-S314 PolarHBondContact O-N 3.48Å; D312-S317 PolarHBondContact O-OG 2.96Å
313E60.5Low59.2Low156 Ų156132.6 Ų132.673%0.72968%0.676SS**  trans-77.352.4177.3-56-153.3146.600111.8K311K311-E313 HydrophobicContact CD-CG 4.35Å; K311-E313 WeakPolarHBondContact CE-OE1 3.02Å; K311-E313 IonicContact NZ-OE1 2.68Å; K311-E313 PolarHBondContact NZ-OE1 3.12Å; K311-E313 PolarHBondContact O-N 2.9Å
314S64.8Low60.5Low64 Ų64131.9 Ų131.945%0.44867%0.667SS.*  trans-65.5150.4171.3-176.70000111D312 V316 S317 K318D312-S314 PolarHBondContact O-N 3.48Å; S314-V316 PolarHBondContact O-N 3.08Å; S314-V316 VanDerWaalsContact O-N 3.16Å; S314-S317 VanDerWaalsContact O-CB 3.27Å; S314-S317 WeakPolarHBondContact O-CB 3.38Å; S314-S317 PolarHBondContact O-N 2.78Å; S314-S317 PolarHBondContact O-OG 2.97Å; S314-K318 PolarHBondContact O-N 2.96Å
315L66.7Low60.7Low153 Ų153129 Ų12980%0.80166%0.657SS**Hα-helixtrans-59.6-29.2-179.8-158.4151.8000111.8K318 A319L315-K318 PolarHBondContact O-N 2.96Å; L315-A319 PolarHBondContact O-N 2.83Å
316V65.5Low61.1Low101 Ų101137.9 Ų137.961%0.61268%0.681SS**Hα-helixtrans-66.7-41172173.60000112.2S314 K318 A319 M320S314-V316 PolarHBondContact O-N 3.08Å; S314-V316 VanDerWaalsContact O-N 3.16Å; V316-K318 VanDerWaalsContact C-N 3.26Å; V316-K318 PolarHBondContact O-N 3.1Å; V316-A319 PolarHBondContact O-N 2.68Å; V316-A319 VanDerWaalsContact O-N 3.17Å; V316-M320 WeakPolarHBondContact O-CG 3.41Å; V316-M320 PolarHBondContact O-N 3.34Å
317S67.1Low61.4Low59 Ų59132.8 Ų132.841%0.41367%0.67SS.*Hα-helixtrans-58-42.6176.8-47.70000110.7D312 S314 M320 E321D312-S317 PolarHBondContact O-OG 2.96Å; S314-S317 VanDerWaalsContact O-CB 3.27Å; S314-S317 WeakPolarHBondContact O-CB 3.38Å; S314-S317 PolarHBondContact O-N 2.78Å; S314-S317 PolarHBondContact O-OG 2.97Å; S317-M320 PolarHBondContact O-N 3.31Å; S317-E321 PolarHBondContact O-N 3.38Å; S317-E321 VanDerWaalsContact O-N 3.08Å
318K68.1Low61.9Low129 Ų129130.8 Ų130.856%0.56166%0.663SS**Hα-helixtrans-73.7-27.4178.7-163.8154.1-169.6155.80113.8S314 L315 V316 Y322S314-K318 PolarHBondContact O-N 2.96Å; L315-K318 PolarHBondContact O-N 2.96Å; V316-K318 VanDerWaalsContact C-N 3.26Å; V316-K318 PolarHBondContact O-N 3.1Å; K318-Y322 WeakPolarHBondContact O-CD2 3.49Å; K318-Y322 PolarHBondContact O-N 3.27Å
319A72.2Confident62.8Low49 Ų49131.6 Ų131.641%0.40566%0.66SS.*Hα-helixtrans-69.6-40.1170.300000111.8L315 V316 Y322 M323L315-A319 PolarHBondContact O-N 2.83Å; V316-A319 PolarHBondContact O-N 2.68Å; V316-A319 VanDerWaalsContact O-N 3.17Å; A319-Y322 PolarHBondContact O-N 2.81Å; A319-M323 WeakPolarHBondContact O-CG 3.33Å; A319-M323 PolarHBondContact O-N 2.85Å; A319-M323 VanDerWaalsContact O-N 3.14Å
320M71.4Confident64Low98 Ų98131.3 Ų131.348%0.48365%0.647SS.*Hα-helixtrans-64.4-41174.9-67.6-69.4-7000111.9V316 S317 Y322 M323 F324V316-M320 WeakPolarHBondContact O-CG 3.41Å; V316-M320 PolarHBondContact O-N 3.34Å; S317-M320 PolarHBondContact O-N 3.31Å; M320-Y322 VanDerWaalsContact C-N 3.33Å; M320-Y322 PolarHBondContact O-N 3.14Å; M320-M323 PolarHBondContact O-N 3.12Å; M320-M323 VanDerWaalsContact O-N 3.1Å; M320-F324 HydrophobicContact CE-CD2 3.83Å; M320-F324 HydrophobicContact CE-CE2 3.52Å; M320-F324 WeakPolarHBondContact O-CD2 3.39Å; M320-F324 PolarHBondContact O-N 2.79Å; M320-F324 HydrophobicContact SD-CD2 4.32Å; M320-F324 HydrophobicContact SD-CE2 3.91Å
321E69.3Low64.4Low112 Ų112129.1 Ų129.152%0.52364%0.642SS.*Hα-helixtrans-53.1-48.4173.3-168.4178.6169.900111.3S317 M323 G325S317-E321 PolarHBondContact O-N 3.38Å; S317-E321 VanDerWaalsContact O-N 3.08Å; E321-M323 VanDerWaalsContact C-N 3.34Å; E321-M323 PolarHBondContact O-N 2.86Å; E321-G325 PolarHBondContact O-N 2.98Å
322Y66.6Low65.2Low199 Ų199126.6 Ų126.678%0.7864%0.636SS**Hα-helixtrans-68.9-22.9176.5-95.6-85.2000115.3K318 A319 M320K318-Y322 WeakPolarHBondContact O-CD2 3.49Å; K318-Y322 PolarHBondContact O-N 3.27Å; A319-Y322 PolarHBondContact O-N 2.81Å; M320-Y322 VanDerWaalsContact C-N 3.33Å; M320-Y322 PolarHBondContact O-N 3.14Å
323M63.1Low65.8Low142 Ų142126.7 Ų126.770%0.763%0.634SS**Hα-helixtrans-89-25.7178.7-74.3-17566.300113.8A319 M320 E321A319-M323 WeakPolarHBondContact O-CG 3.33Å; A319-M323 PolarHBondContact O-N 2.85Å; A319-M323 VanDerWaalsContact O-N 3.14Å; M320-M323 PolarHBondContact O-N 3.12Å; M320-M323 VanDerWaalsContact O-N 3.1Å; E321-M323 VanDerWaalsContact C-N 3.34Å; E321-M323 PolarHBondContact O-N 2.86Å
324F72.2Confident66.2Low139 Ų139124.5 Ų124.561%0.6163%0.627SS**Hα-helixtrans-120.4-6-171.3-65.9-75.3000115.3M320M320-F324 HydrophobicContact CE-CD2 3.83Å; M320-F324 HydrophobicContact CE-CE2 3.52Å; M320-F324 WeakPolarHBondContact O-CD2 3.39Å; M320-F324 PolarHBondContact O-N 2.79Å; M320-F324 HydrophobicContact SD-CD2 4.32Å; M320-F324 HydrophobicContact SD-CE2 3.91Å
325G59.3Low66.3Low61 Ų61129.5 Ų129.563%0.62964%0.641SS**  trans56.783.2154.900000117E321E321-G325 PolarHBondContact O-N 2.98Å
326W53.9Low66.2Low312 Ų312127.4 Ų127.4100%1.18263%0.627SS**  trans-131.90169.1-85.977000110.6

Retrieved 326 of 326 residues in 347.6 ms (Link to these results)