A0A077Z437_TRITR Loading...

Netrin receptor UNC5A

AlphaFold DB , UniProt , Accession A0A077Z437, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 236 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
1M47.1Very low49.9Very low239 Ų239151.1 Ų151.1100%1.17786%0.859SS**  0126.60-74.4150.9173.500107.9
2K43.5Very low49.3Very low213 Ų213144.4 Ų144.493%0.92685%0.848SS**  trans-83.6112.5-174.7-70175178.51780109.1
3I47.8Very low49.6Very low167 Ų167138.5 Ų138.586%0.85684%0.836SS**  trans-83.8115.4174.3-61.7169.8000107.2
4S49.5Very low50.2Low105 Ų105137.5 Ų137.573%0.73483%0.834SS**PPolyproline II helixtrans-77.8142.9171.3-76.70000110.3
5P58.3Low50.4Low126 Ų126136.3 Ų136.382%0.81883%0.831SS**PPolyproline II helixtrans-78.1123.3-178.130.1-31.8000110.9S7P5-S7 PolarHBondContact O-N 3.16Å
6A52.1Low50.3Low104 Ų104142.8 Ų142.886%0.8684%0.835SS**PPolyproline II helixtrans-74.5119.517100000109.7
7S53.8Low50.5Low114 Ų114145.3 Ų145.380%0.79784%0.837SS**PPolyproline II helixtrans-55.3130.5-178.5-176.50000113.4P5 A9P5-S7 PolarHBondContact O-N 3.16Å; S7-A9 PolarHBondContact O-N 3.29Å
8L50.8Low50.4Low171 Ų171145.8 Ų145.890%0.89584%0.835SS**  trans-58.7108166.1-73.4148000110S10L8-S10 PolarHBondContact O-N 3.45Å
9A49.1Very low50.1Low82 Ų82147 Ų14768%0.67884%0.837SS**  trans-82.595.2167.500000108.9S7 Y11S7-A9 PolarHBondContact O-N 3.29Å; A9-Y11 HydrophobicContact CB-CD2 4.33Å; A9-Y11 HydrophobicContact CB-CE2 4.35Å; A9-Y11 PolarHBondContact O-N 3.4Å
10S49.6Very low49.9Very low119 Ų119142.9 Ų142.983%0.83283%0.828SS**  trans-71.498168.4-165.10000108.8L8L8-S10 PolarHBondContact O-N 3.45Å
11Y47.6Very low49.9Very low222 Ų222141.9 Ų141.987%0.87183%0.827SS**  trans-88.3106.7166.8-90.6-85.9000109A9 G13A9-Y11 HydrophobicContact CB-CD2 4.33Å; A9-Y11 HydrophobicContact CB-CE2 4.35Å; A9-Y11 PolarHBondContact O-N 3.4Å; Y11-G13 PolarHBondContact O-N 3.49Å
12G42.7Very low49.8Very low71 Ų71138.7 Ų138.773%0.73281%0.813SS**PPolyproline II helixtrans-61.2128176.400000111.8
13G53.3Low49.7Very low67 Ų67139.7 Ų139.769%0.69181%0.811SS**PPolyproline II helixtrans-70147.3168.200000111.3Y11Y11-G13 PolarHBondContact O-N 3.49Å
14P57.2Low49.2Very low125 Ų125137 Ų13781%0.81281%0.808SS**PPolyproline II helixtrans-71.2155.5-179.729.4-33.3000112
15P53.1Low49.1Very low120 Ų120139.7 Ų139.778%0.77981%0.811SS**PPolyproline II helixtrans-75.1146.6-170.129.8-33.4000113E17P15-E17 PolarHBondContact O-N 3.19Å
16R49.7Very low48.2Very low239 Ų239137.9 Ų137.990%0.90281%0.806SS**  trans-65.6109.2170.5-74.9175142.1-160.1-5.1110.2
17E52.9Low47.6Very low186 Ų186139.7 Ų139.787%0.86981%0.807SS**  trans-77.7131.6165.4-89.5-80.3101.700110.3P15P15-E17 PolarHBondContact O-N 3.19Å
18L49Very low47Very low154 Ų154138.7 Ų138.781%0.80681%0.805SS**  trans-80.6147.7-169.3-84.6110.9000113.6G20L18-G20 PolarHBondContact O-N 3.39Å
19I45Very low46.4Very low169 Ų169137.2 Ų137.287%0.86780%0.803SS**  trans-39.7120.8163.6-59.4157000112.5
20G47.1Very low45.7Very low64 Ų64137.4 Ų137.466%0.6681%0.813SS**  trans-112.7143.3163.900000111.2L18L18-G20 PolarHBondContact O-N 3.39Å
21P49.2Very low45Very low123 Ų123134.9 Ų134.980%0.79981%0.806SS**  trans-89.1159-160.734.8-35.3000115.6
22L44.1Very low44.5Very low171 Ų171136.6 Ų136.690%0.89581%0.811SS**  trans-27.9125.2168.8-87.368000115
23R41.7Very low44.5Very low234 Ų234139.9 Ų139.988%0.88381%0.811SS**  trans-109.7110.1150.8-87.3-175175.3-145.6-0.2109.9
24S38.4Very low43.9Very low112 Ų112147.6 Ų147.678%0.78382%0.819SS**  trans-78.4122161.7176.40000109.1
25M45.6Very low43.2Very low161 Ų161149.3 Ų149.379%0.79381%0.814SS**  trans-149.7102.8157-73.2-167.8174.500106.2
26A39.7Very low42.5Very low87 Ų87148.8 Ų148.872%0.71981%0.812SS**  78.997.390.400000112.7
27T39.5Very low41.9Very low143 Ų143146.3 Ų146.388%0.87781%0.808SS**  trans0.9124.7139.248.70000117.7
28A41.9Very low41.3Very low92 Ų92146 Ų14676%0.7681%0.806SS**  trans-170.3105.4137.900000111.7
29T38.5Very low40.6Very low141 Ų141142.2 Ų142.287%0.86581%0.805SS**  trans22.1122.8134.555.60000120.4
30G33.7Very low40.2Very low86 Ų86139 Ų13989%0.88780%0.797SS**  87.9122128.200000117.3
31G35.6Very low39.7Very low65 Ų65142.9 Ų142.967%0.6780%0.802SS**  trans157.484.3164.500000113.1L33G31-L33 PolarHBondContact O-N 2.91Å; G31-L33 VanDerWaalsContact O-N 3.16Å
32W37Very low39.1Very low259 Ų259142.5 Ų142.598%0.98180%0.797SS**  trans-64.5108.1167.1-74.741.4000108.9
33L41.9Very low38.7Very low139 Ų139142.7 Ų142.773%0.72879%0.794SS**  trans-111.999166.9-86.7153000108.8G31 F35G31-L33 PolarHBondContact O-N 2.91Å; G31-L33 VanDerWaalsContact O-N 3.16Å; L33-F35 HydrophobicContact CB-CD2 4.13Å; L33-F35 HydrophobicContact CB-CE2 3.82Å; L33-F35 HydrophobicContact CD2-CE2 4.33Å; L33-F35 HydrophobicContact CG-CE2 4.49Å; L33-F35 PolarHBondContact O-N 3.06Å
34R41.7Very low38.8Very low230 Ų230137.2 Ų137.287%0.86879%0.791SS**  trans-76.497.3172-155-177.5-149176.54.8107.1C36R34-C36 PolarHBondContact O-N 2.83Å
35F41.2Very low38.7Very low160 Ų160139 Ų13970%0.70279%0.791SS**  trans-85.9101.7172.7-83.2-86000109.7L33 F37L33-F35 HydrophobicContact CB-CD2 4.13Å; L33-F35 HydrophobicContact CB-CE2 3.82Å; L33-F35 HydrophobicContact CD2-CE2 4.33Å; L33-F35 HydrophobicContact CG-CE2 4.49Å; L33-F35 PolarHBondContact O-N 3.06Å; F35-F37 HydrophobicContact CD1-CE2 4.44Å
36C39.4Very low38.4Very low109 Ų109134.9 Ų134.974%0.73679%0.79SS**  trans-84.4101.4162.2-67.10000108R34 H38R34-C36 PolarHBondContact O-N 2.83Å; C36-H38 PolarHBondContact O-N 3.41Å
37F38Very low38.4Very low188 Ų188137.4 Ų137.483%0.82579%0.792SS**  trans-88.1101.4165.8-108.3-91.5000109F35F35-F37 HydrophobicContact CD1-CE2 4.44Å
38H38.8Very low38.3Very low178 Ų178138.5 Ų138.582%0.82479%0.789SS**  trans-79123.7156.4-111.6-103000107.1C36C36-H38 PolarHBondContact O-N 3.41Å
39G35.4Very low38.2Very low75 Ų75139.6 Ų139.677%0.77379%0.791SS**  trans-157.287.1177.600000110
40S36.7Very low38.2Very low102 Ų102138.2 Ų138.271%0.71378%0.783SS**  trans-72150.6177.9-69.40000113.2
41L35.4Very low38.6Very low146 Ų146141 Ų14176%0.76478%0.782SS**  trans92.1150.6134.7-117.387.6000121.5
42T37.5Very low38.7Very low114 Ų114145.6 Ų145.670%0.69979%0.792SS**  trans77.892.7170.574.40000115.7
43E36.3Very low38.8Very low176 Ų176136.2 Ų136.282%0.82278%0.775SS**  53.8100.679.1-78.7-178.898.200113.4
44S41.9Very low39.1Very low118 Ų118134.5 Ų134.583%0.82577%0.772SS**  trans-140.5104.3149.453.90000107.5
45L38Very low39.1Very low150 Ų150134.8 Ų134.879%0.78577%0.774SS**  trans-53.5133167.7-75.2100.6000110
46G38.1Very low38.9Very low75 Ų75137.8 Ų137.877%0.77378%0.78SS**  trans-137.7113.5166.900000107.8
47D40.2Very low39.2Very low140 Ų140142.6 Ų142.675%0.74978%0.783SS**  trans-63.9129-163.2-69.7-61.2000115.6
48M36.4Very low40Very low166 Ų166141 Ų14182%0.81878%0.778SS**  35.299.2118.1-144.1126.579.700118
49S41.6Very low40.3Very low115 Ų115139.2 Ų139.280%0.80478%0.775SS**  trans-134.987.1146.269.70000110.1T51S49-T51 PolarHBondContact O-N 2.94Å
50T38.3Very low40.9Very low112 Ų112142.3 Ų142.369%0.68777%0.772SS**  trans-58.5120.7163.4-61.60000109.9
51T41.2Very low41.6Very low144 Ų144143.5 Ų143.588%0.88378%0.775SS**  trans-136.9101.8147.8-8.90000109.2S49S49-T51 PolarHBondContact O-N 2.94Å
52D37.2Very low42.1Very low161 Ų161140.5 Ų140.586%0.86177%0.771SS**  trans-70.6132.2172.9-145.1-20.5000108.9
53G40.7Very low42.9Very low62 Ų62140.5 Ų140.564%0.63977%0.774SS**  trans-165.9141.4-179.400000111.9
54P47.2Very low43.5Very low103 Ų103143.9 Ų143.967%0.66978%0.779SS**  -87.1143.6-125.430.8-35.4000115.5W56P54-W56 PolarHBondContact O-N 3.3Å; P54-W56 VanDerWaalsContact O-N 3.17Å
55R42Very low43.7Very low236 Ų236149.7 Ų149.789%0.89178%0.783SS**  trans-72.590.8179.9-164.7176.9-163.4168.64.9111.2R57R55-R57 PolarHBondContact O-N 3.34Å; R55-R57 VanDerWaalsContact O-N 3.09Å
56W37.2Very low44.3Very low223 Ų223153.7 Ų153.785%0.84579%0.787SS**  trans-69.7103.4171.2-61.791.5000110.4P54 Q58P54-W56 PolarHBondContact O-N 3.3Å; P54-W56 VanDerWaalsContact O-N 3.17Å; W56-Q58 PolarHBondContact O-N 3.41Å
57R44.9Very low44.6Very low210 Ų210160.5 Ų160.579%0.79279%0.79SS**  trans-8788.9173.1-168.2-165.3-70.2-118.17.3108.5R55 N59R55-R57 PolarHBondContact O-N 3.34Å; R55-R57 VanDerWaalsContact O-N 3.09Å; R57-N59 PolarHBondContact O-N 3.3Å
58Q54.7Low45.1Very low154 Ų154165.3 Ų165.372%0.7280%0.797SS**  trans-88.4100.9170-72.2-174.7-9.800109.8W56 I60W56-Q58 PolarHBondContact O-N 3.41Å; Q58-I60 HydrophobicContact CB-CG1 4.27Å; Q58-I60 PolarHBondContact O-N 3.31Å; Q58-I60 VanDerWaalsContact O-N 3.14Å
59N45.2Very low45.4Very low141 Ų141162.9 Ų162.975%0.75479%0.788SS**  trans-66.297.2161.2-84-10.2000108.2R57R57-N59 PolarHBondContact O-N 3.3Å
60I48.3Very low45.6Very low141 Ų141166 Ų16672%0.72379%0.789SS**  trans-102.395.6168.5-55-179.2000107.7Q58 A62Q58-I60 HydrophobicContact CB-CG1 4.27Å; Q58-I60 PolarHBondContact O-N 3.31Å; Q58-I60 VanDerWaalsContact O-N 3.14Å; I60-A62 PolarHBondContact O-N 2.04Å
61T51.9Low46.1Very low126 Ų126167.9 Ų167.977%0.77379%0.79SS**PPolyproline II helixtrans-46.5121.8168.4-54.30000110.4
62A46.1Very low46.2Very low83 Ų83169 Ų16969%0.68679%0.79SS**PPolyproline II helixtrans-60.4126176.800000110.9I60 R64I60-A62 PolarHBondContact O-N 2.04Å; A62-R64 PolarHBondContact O-N 3.01Å
63P53.1Low46.6Very low115 Ų115166.2 Ų166.275%0.74779%0.79SS**PPolyproline II helixtrans-72.1116.9173.826.4-29.7000109.8R65P63-R65 PolarHBondContact O-N 3.31Å
64R48.7Very low46.7Very low246 Ų246168.2 Ų168.293%0.92880%0.8SS**  trans-53.9103.9164.3-86.1-178.2170.6178-2.3108.9A62 R66A62-R64 PolarHBondContact O-N 3.01Å; R64-R66 PolarHBondContact O-N 2.73Å; R64-R66 VanDerWaalsContact O-N 3.14Å
65R47.8Very low46.6Very low241 Ų241166.5 Ų166.591%0.90980%0.801SS**  trans-68.6110.1167.9-72.8-166-177.4-144.82.4108.5P63P63-R65 PolarHBondContact O-N 3.31Å
66R49.4Very low46.3Very low233 Ų233161.7 Ų161.788%0.87980%0.802SS**  trans-57.6131.8169.3-72.6-171.7-179.1-166.71.4109.3R64 R68R64-R66 PolarHBondContact O-N 2.73Å; R64-R66 VanDerWaalsContact O-N 3.14Å; R66-R68 PolarHBondContact O-N 2.78Å
67R45.7Very low47.2Very low218 Ų218156.8 Ų156.882%0.82380%0.799SS**  trans-55.5121.6163.1-71.5-175.6-178.4-152.50.9107.9D69R67-D69 PolarHBondContact O-N 2.82Å
68R50.2Low47.2Very low241 Ų241151 Ų15191%0.90980%0.796SS**  trans-95.981.8167.1-162.1-177.2-70.2-173.7-3.1105.7R66R66-R68 PolarHBondContact O-N 2.78Å
69D42.7Very low47Very low115 Ų115149 Ų14962%0.61580%0.796SS**  trans-83.6102.5163.5-71.1-55.3000106R67R67-D69 PolarHBondContact O-N 2.82Å
70E44.6Very low47.8Very low180 Ų180148.7 Ų148.784%0.84180%0.799SS**  trans-152.788.7162.2-125.5163.2104.300110.3
71Q48.7Very low47.8Very low152 Ų152147.5 Ų147.571%0.7180%0.802SS**  trans32.9115.2135.6-97.173.7-16.200120
72L44.4Very low47.7Very low168 Ų168148.7 Ų148.788%0.8880%0.803SS**  18.9104.9127.2-68.2103.7000117.1
73A44.4Very low47.7Very low103 Ų103150.3 Ų150.385%0.85181%0.809SS**  trans-110.7103.9145.700000107.8
74A44.1Very low47.7Very low104 Ų104150.1 Ų150.186%0.8681%0.811SS**  trans-57.2143.6166.600000110.3
75G44.1Very low48.1Very low66 Ų66149.6 Ų149.668%0.6881%0.809SS**  trans15666.5168.100000113.9P77G75-P77 VanDerWaalsContact C-CD 3.44Å; G75-P77 WeakPolarHBondContact O-CD 3.34Å
76C36.7Very low48.1Very low135 Ų135147.8 Ų147.891%0.91281%0.808SS**  trans-9398.1156.2-67.50000108.6A78C76-A78 PolarHBondContact O-N 2.91Å
77P55.4Low48.4Very low121 Ų121145.2 Ų145.279%0.78681%0.806SS**  trans-79.5111.8153.629.3-27000108.1G75G75-P77 VanDerWaalsContact C-CD 3.44Å; G75-P77 WeakPolarHBondContact O-CD 3.34Å
78A44.8Very low49.1Very low89 Ų89140.5 Ų140.574%0.73680%0.801SS**  trans-67.7168.9165.700000110.4C76C76-A78 PolarHBondContact O-N 2.91Å
79P51.3Low49.1Very low110 Ų110136.8 Ų136.871%0.71480%0.796SS**  trans-90.9145.9-139.535.6-36.1000113.7
80V61.3Low49.7Very low135 Ų135136.3 Ų136.382%0.81880%0.797SS**  trans-105.8104.4155.7-84.30000109L82V80-L82 HydrophobicContact CB-CD1 4.45Å; V80-L82 PolarHBondContact O-N 3.34Å
81C47.5Very low50.4Low117 Ų117134.6 Ų134.679%0.79179%0.789SS**  trans-59.3113.5162.8-56.30000109.1
82L49.9Very low50.3Low151 Ų151136.2 Ų136.279%0.79179%0.794SS**  trans-124.3102.6155.6-91.397.3000109.8V80 S84V80-L82 HydrophobicContact CB-CD1 4.45Å; V80-L82 PolarHBondContact O-N 3.34Å; L82-S84 PolarHBondContact O-N 3.24Å
83S46.4Very low50.9Low117 Ų117138.6 Ų138.682%0.81879%0.791SS**  trans-57.5115.9158.6162.50000109.5
84S52.9Low51.4Low110 Ų110141.9 Ų141.977%0.76979%0.789SS**  trans-140.9110.4157.7-91.60000110.2L82L82-S84 PolarHBondContact O-N 3.24Å
85R57.5Low51.5Low235 Ų235144.4 Ų144.489%0.88779%0.785SS**  trans0.5110.7159.2-64.7175-169.2-151.20.1115.4E87R85-E87 PolarHBondContact O-N 2.99Å; R85-E87 VanDerWaalsContact O-N 3.1Å
86F47.7Very low52Low204 Ų204149.1 Ų149.190%0.89579%0.79SS**  trans-66.199.7159.3-119.4-104.3000108.2V88F86-V88 PolarHBondContact O-N 3.5Å
87E56.5Low52.5Low178 Ų178148 Ų14883%0.83278%0.779SS**  trans-71.6111.1160.1-77.3179.3149.100107.5R85 M89R85-E87 PolarHBondContact O-N 2.99Å; R85-E87 VanDerWaalsContact O-N 3.1Å; E87-M89 VanDerWaalsContact C-N 3.3Å; E87-M89 PolarHBondContact O-N 2.97Å
88V60.8Low52.1Low119 Ų119148.3 Ų148.372%0.72178%0.778SS**  trans-65.291.6173.7179.20000107.4F86 T90F86-V88 PolarHBondContact O-N 3.5Å; V88-T90 VanDerWaalsContact C-N 3.29Å; V88-T90 HydrophobicContact CG1-CG2 4.22Å; V88-T90 PolarHBondContact O-N 3.45Å
89M50.3Low52.5Low164 Ų164151.8 Ų151.881%0.80878%0.783SS**  trans-7293.5163.3-98.3-155.3-115.300108.2E87 Q91E87-M89 VanDerWaalsContact C-N 3.3Å; E87-M89 PolarHBondContact O-N 2.97Å; M89-Q91 PolarHBondContact O-N 3.43Å
90T54Low52.2Low105 Ų105149.5 Ų149.564%0.64478%0.779SS**  trans-59.384.9157.741.20000109.3V88 F92V88-T90 VanDerWaalsContact C-N 3.29Å; V88-T90 HydrophobicContact CG1-CG2 4.22Å; V88-T90 PolarHBondContact O-N 3.45Å; T90-F92 HydrophobicContact CG2-CE2 4.39Å; T90-F92 PolarHBondContact O-N 3.07Å
91Q60Low51.6Low144 Ų144150.7 Ų150.767%0.67378%0.776SS**  trans-90.887.1158-86.8-176.9-10.300108M89 R93M89-Q91 PolarHBondContact O-N 3.43Å; Q91-R93 PolarHBondContact O-N 3.16Å
92F47.3Very low51.9Low185 Ų185150.4 Ų150.481%0.81177%0.773SS**  trans-60.986.2154.2-78.6-89.5000107.5T90 Q94T90-F92 HydrophobicContact CG2-CE2 4.39Å; T90-F92 PolarHBondContact O-N 3.07Å; F92-Q94 VanDerWaalsContact C-N 3.31Å; F92-Q94 PolarHBondContact O-N 3.1Å; F92-Q94 VanDerWaalsContact O-N 3.07Å
93R55.2Low51.9Low218 Ų218148 Ų14882%0.82376%0.764SS**  trans-71.199.1160-87-176173.3172.9-1.8106.4Q91 M95Q91-R93 PolarHBondContact O-N 3.16Å; R93-M95 VanDerWaalsContact C-N 3.29Å; R93-M95 PolarHBondContact O-N 3.22Å
94Q56.7Low52.1Low172 Ų172151.2 Ų151.280%0.80477%0.766SS**  trans-54.999.3159.1-67.8170.5-47.800106.6F92 E96F92-Q94 VanDerWaalsContact C-N 3.31Å; F92-Q94 PolarHBondContact O-N 3.1Å; F92-Q94 VanDerWaalsContact O-N 3.07Å; Q94-E96 PolarHBondContact O-N 2.96Å
95M46Very low51.8Low158 Ų158153 Ų15378%0.77877%0.767SS**  trans-82.396.1162.2-169.275.8178.900104.8R93 T97R93-M95 VanDerWaalsContact C-N 3.29Å; R93-M95 PolarHBondContact O-N 3.22Å; M95-T97 HydrophobicContact CG-CG2 4.3Å; M95-T97 PolarHBondContact O-N 3.32Å
96E53.5Low51.4Low165 Ų165150.5 Ų150.577%0.77177%0.766SS**  trans-61.386.7158.7-97.5151114.800107.1Q94 T98Q94-E96 PolarHBondContact O-N 2.96Å; E96-T98 PolarHBondContact O-N 3.37Å
97T48.6Very low51.6Low111 Ų111148.1 Ų148.168%0.68176%0.762SS**  trans-6693.915932.20000106.1M95 I99M95-T97 HydrophobicContact CG-CG2 4.3Å; M95-T97 PolarHBondContact O-N 3.32Å; T97-I99 PolarHBondContact O-N 3.38Å; T97-I99 VanDerWaalsContact O-N 3.11Å
98T46.2Very low51.3Low127 Ų127146.4 Ų146.478%0.77975%0.754SS**  trans-34.8118.3156.7-53.10000107.6E96 G100E96-T98 PolarHBondContact O-N 3.37Å; T98-G100 PolarHBondContact O-N 3.14Å
99I52.7Low51Low162 Ų162146.4 Ų146.483%0.83176%0.76SS**  trans-63.182.4167.8-59.8166.6000104.6T97 E101T97-I99 PolarHBondContact O-N 3.38Å; T97-I99 VanDerWaalsContact O-N 3.11Å; I99-E101 PolarHBondContact O-N 3.28Å
100G44.5Very low51.9Low62 Ų62140.8 Ų140.864%0.63974%0.735SS**  trans-68.895.3164.700000105.1T98 P102T98-G100 PolarHBondContact O-N 3.14Å; G100-P102 VanDerWaalsContact O-N 3.17Å
101E50.4Low53.3Low160 Ų160138 Ų13875%0.74872%0.722SS**  trans-28114.6162.9-155.4163.3112.400109.6I99 T103I99-E101 PolarHBondContact O-N 3.28Å; E101-T103 PolarHBondContact O-N 3.08Å
102P52.1Low54.7Low111 Ų111136.7 Ų136.772%0.72171%0.714SS**  trans-63.5100.1163.725.3-27.6000104.8G100 E104G100-P102 VanDerWaalsContact O-N 3.17Å; P102-E104 PolarHBondContact O-N 3.38Å
103T51.6Low57Low101 Ų101128 Ų12862%0.6268%0.676SS**  trans-51.1111166.536.30000106.3E101 N105E101-T103 PolarHBondContact O-N 3.08Å; T103-N105 PolarHBondContact O-N 2.76Å; T103-N105 PolarHBondContact O-ND2 3.23Å
104E49.2Very low58.9Low184 Ų184121.3 Ų121.386%0.8666%0.659SS**  trans-5888.4172.7-62.9175.8138.900106P102 E106P102-E104 PolarHBondContact O-N 3.38Å; E104-E106 VanDerWaalsContact C-N 3.26Å; E104-E106 PolarHBondContact O-N 2.88Å
105N46.3Very low60.7Low147 Ų147115 Ų11579%0.78663%0.631SS**  trans-7197.9166.4-69.7-68.1000105T103 D107T103-N105 PolarHBondContact O-N 2.76Å; T103-N105 PolarHBondContact O-ND2 3.23Å; N105-D107 PolarHBondContact O-N 2.96Å; N105-D107 VanDerWaalsContact O-N 3.13Å
106E50Low63.1Low184 Ų184111.4 Ų111.486%0.8661%0.614SS**  trans-47.7113.9177.6-69.7-179.6107.300111E104 Q108E104-E106 VanDerWaalsContact C-N 3.26Å; E104-E106 PolarHBondContact O-N 2.88Å; E106-Q108 PolarHBondContact O-N 3.28Å
107D51.2Low65.1Low154 Ų154107.4 Ų107.482%0.82460%0.596SS**SBend66.551.8123-144.324.1000118.4N105N105-D107 PolarHBondContact O-N 2.96Å; N105-D107 VanDerWaalsContact O-N 3.13Å
108Q49.9Very low67.4Low142 Ų142104.5 Ų104.566%0.66458%0.578SS**  trans-141.177136.2-154.9150.421.900107E106 T110E106-Q108 PolarHBondContact O-N 3.28Å; Q108-T110 PolarHBondContact O-N 3.29Å
109S55.4Low69.8Low119 Ų11998.9 Ų98.983%0.83254%0.543SS*.  trans-7169.4-168.5-161.40000111.8A111S109-A111 PolarHBondContact O-N 2.83Å; S109-A111 VanDerWaalsContact O-N 3.07Å
110T69.1Low71.9Confident46 Ų4696.8 Ų96.828%0.28253%0.534SS..  trans-71.699.916760.20000105.9Q108 K112 T208Q108-T110 PolarHBondContact O-N 3.29Å; T110-K112 PolarHBondContact O-N 3.48Å; T110-T208 HydrophobicContact CG2-CG2 4.18Å; T110-T208 WeakPolarHBondContact CG2-OG1 3.33Å
111A83.1Confident74.4Confident46 Ų4698 Ų9838%0.3853%0.526SS..  trans-58112.2-177.600000109.7S109 H142S109-A111 PolarHBondContact O-N 2.83Å; S109-A111 VanDerWaalsContact O-N 3.07Å; A111-H142 HydrophobicContact CB-CB 3.77Å
112K90.1Very high76.5Confident117 Ų11791 Ų9151%0.50950%0.495SS..  trans-65.6136.7177.7172.4161.9179.7-70.30109.5T110 V114 V213 V215T110-K112 PolarHBondContact O-N 3.48Å; K112-V114 PolarHBondContact O-N 2.93Å; K112-V213 HydrophobicContact CB-CG1 3.93Å; K112-V213 HydrophobicContact CD-CG1 3.81Å; K112-V213 HydrophobicContact CG-CG1 3.58Å; K112-V215 HydrophobicContact CD-CG2 4.41Å; K112-V215 HydrophobicContact CG-CG2 3.98Å; K112-V215 VanDerWaalsContact NZ-CG2 3.35Å
113P94.9Very high78.3Confident1 Ų191.2 Ų91.21%0.00648%0.482CS..  trans-56.3139.1176.1-2633.5000112.1L141 A143 A203 V215P113-L141 VanDerWaalsContact CA-O 3.29Å; P113-L141 WeakPolarHBondContact CA-O 3.25Å; P113-A143 HydrophobicContact CB-CB 4.24Å; P113-A203 HydrophobicContact CB-CB 3.93Å; P113-V215 HydrophobicContact CB-CG2 4.15Å; P113-V215 WeakPolarHBondContact O-CG2 3.06Å
114V94.9Very high80.2Confident78 Ų7886.4 Ų86.447%0.47345%0.453SS..EExtended strand (participates in β ladder)trans-121.6118.9175.5-178.90000108.5K112 I116 A140 L141K112-V114 PolarHBondContact O-N 2.93Å; V114-I116 PolarHBondContact O-N 2.83Å; V114-A140 CarbonylContact O-C 3.47Å; V114-A140 WeakPolarHBondContact O-CA 3.33Å; V114-L141 HydrophobicContact CB-CB 4.49Å; V114-L141 PolarHBondContact N-O 2.96Å; V114-L141 PolarHBondContact O-N 2.9Å
115L95.7Very high82Confident40 Ų4080 Ų8021%0.20943%0.426CS..EExtended strand (participates in β ladder)trans-73.9118.5175.4-67.4146.3000108.8T118 C138 A203 V215L115-T118 HydrophobicContact CB-CG2 4.13Å; L115-T118 HydrophobicContact CD2-CG2 4.42Å; L115-C138 VanDerWaalsContact CD2-SG 3.52Å; L115-A203 HydrophobicContact CD2-CB 4.36Å; L115-V215 HydrophobicContact CD1-CB 4.23Å; L115-V215 HydrophobicContact CD1-CG1 3.53Å; L115-V215 HydrophobicContact CG-CG1 4.4Å
116I95.3Very high83.4Confident83 Ų8376 Ų7643%0.42640%0.4SS..EExtended strand (participates in β ladder)trans-92.9-38.7172-49.3164.6000109.9V114 K139 L141V114-I116 PolarHBondContact O-N 2.83Å; I116-K139 PolarHBondContact N-O 2.69Å; I116-L141 HydrophobicContact CD1-CD1 3.75Å; I116-L141 HydrophobicContact CD1-CD2 3.47Å; I116-L141 VanDerWaalsContact CD1-CD2 3.47Å; I116-L141 HydrophobicContact CD1-CG 3.28Å; I116-L141 HydrophobicContact CG1-CD1 4.01Å; I116-L141 HydrophobicContact CG1-CD2 4.44Å; I116-L141 HydrophobicContact CG1-CG 3.72Å
117E96.1Very high84.4Confident81 Ų8169.1 Ų69.138%0.37938%0.378SS..EExtended strand (participates in β ladder)trans-127.8121179.6-165.1-178.1149.600108.7C138 K139E117-C138 WeakPolarHBondContact O-CA 3.42Å; E117-K139 HydrophobicContact CB-CB 3.6Å; E117-K139 PolarHBondContact N-O 3.1Å; E117-K139 PolarHBondContact O-N 3.19Å
118T96.7Very high85Confident50 Ų5071 Ų7131%0.30737%0.374SS..PPolyproline II helixtrans-101.2151.2173.554.10000110L115 N120L115-T118 HydrophobicContact CB-CG2 4.13Å; L115-T118 HydrophobicContact CD2-CG2 4.42Å; T118-N120 PolarHBondContact O-N 3.49Å
119P97.3Very high85.8Confident8 Ų871.9 Ų71.95%0.05238%0.377CS..PPolyproline II helixtrans-61.1135.7175.227.9-35.6000109.8L136 T137 F148 C201 A220P119-L136 HydrophobicContact CB-CB 4.19Å; P119-T137 VanDerWaalsContact CA-O 3.23Å; P119-T137 WeakPolarHBondContact CA-O 3.35Å; P119-F148 HydrophobicContact CB-CE1 4.18Å; P119-F148 HydrophobicContact CG-CE1 4.13Å; P119-C201 HydrophobicContact CG-CB 4.01Å; P119-A220 HydrophobicContact CB-CB 3.86Å; P119-A220 HydrophobicContact CG-CB 4.05Å; P119-A220 WeakPolarHBondContact O-CB 3.45Å
120N96.5Very high86.2Confident119 Ų11975.2 Ų75.264%0.63638%0.38SS*.PPolyproline II helixtrans-95.7156.8176.9-67.9-42.5000110.8T118 A122T118-N120 PolarHBondContact O-N 3.49Å; N120-A122 PolarHBondContact O-N 3.5Å
121D96.4Very high86.8Confident88 Ų8877 Ų7747%0.47139%0.385SS..PPolyproline II helixtrans-54.4136.2170.1-74.1-27.5000110.7T221D121-T221 WeakPolarHBondContact CA-O 3.38Å; D121-T221 PolarHBondContact OD1-N 2.93Å; D121-T221 PolarHBondContact OD1-OG1 2.64Å
122A94.2Very high86.9Confident11 Ų1179.3 Ų79.39%0.09139%0.389CS..EExtended strand (participates in β ladder)trans-127.5148.3-173.100000111.8N120 V134 L136 T221 V222 R223N120-A122 PolarHBondContact O-N 3.5Å; A122-V134 HydrophobicContact CB-CB 4.37Å; A122-V134 HydrophobicContact CB-CG1 3.88Å; A122-V134 HydrophobicContact CB-CG2 3.7Å; A122-L136 HydrophobicContact CB-CD2 3.93Å; A122-T221 PolarHBondContact N-O 3.07Å; A122-V222 HydrophobicContact CB-CG1 4.44Å; A122-V222 HydrophobicContact CB-CG2 4.35Å; A122-V222 WeakPolarHBondContact O-CA 3.29Å; A122-R223 PolarHBondContact O-N 2.72Å
123Y91.6Very high87Confident117 Ų11776.5 Ų76.546%0.45938%0.384SS..EExtended strand (participates in β ladder)trans-121.3130.8179.6-60.6-86.5000110.2Q131 R223 A225Y123-Q131 PolarHBondContact O-NE2 3.36Å; Y123-R223 CarbonylContact C-O 3.53Å; Y123-R223 VanDerWaalsContact CA-O 3.3Å; Y123-R223 WeakPolarHBondContact CA-O 3.18Å; Y123-R223 HydrophobicContact CD1-CB 4.06Å; Y123-R223 HydrophobicContact CE1-CB 4.18Å; Y123-A225 HydrophobicContact CD1-CB 4.34Å
124L91.2Very high87Confident0 Ų077.8 Ų77.80%039%0.392CS..EExtended strand (participates in β ladder)trans-100.8101.1173.4-70.4165.8000107.8V134 R183 V186 V222 R223 V224 A225L124-V134 HydrophobicContact CD1-CG1 4.42Å; L124-V134 HydrophobicContact CD2-CB 3.82Å; L124-V134 HydrophobicContact CD2-CG1 3.89Å; L124-V134 HydrophobicContact CG-CB 4.47Å; L124-V134 HydrophobicContact CG-CG1 4.1Å; L124-R183 HydrophobicContact CD1-CB 4.19Å; L124-V186 HydrophobicContact CD1-CB 4.34Å; L124-V186 HydrophobicContact CD1-CG2 3.83Å; L124-V222 HydrophobicContact CD1-CG1 3.65Å; L124-V222 HydrophobicContact CG-CG1 4.03Å; L124-R223 PolarHBondContact N-O 3.11Å; L124-V224 WeakPolarHBondContact O-CA 3.47Å; L124-A225 PolarHBondContact O-N 3.37Å
125V85.3Confident87Confident49 Ų4976.4 Ų76.430%0.29739%0.389SS..EExtended strand (participates in β ladder)trans-79.6123.7-176.8-174.60000110G127 A225 K227V125-G127 PolarHBondContact O-N 3.33Å; V125-A225 CarbonylContact C-O 3.54Å; V125-A225 WeakPolarHBondContact CA-O 2.84Å; V125-A225 HydrophobicContact CG2-CB 4.46Å; V125-K227 HydrophobicContact CG1-CB 4.26Å
126R75.9Confident87.1Confident64 Ų6474.7 Ų74.724%0.24238%0.38CS..EExtended strand (participates in β ladder)trans-68.8122.6170.4-68.3-176.9174.2150.92.7109.6E187 V224 A225 F235R126-E187 IonicContact CZ-OE1 2.73Å; R126-E187 VanDerWaalsContact CZ-OE1 3.29Å; R126-E187 IonicContact NE-OE1 3.89Å; R126-E187 PolarHBondContact NE-OE1 2.72Å; R126-E187 IonicContact NH2-OE1 3.29Å; R126-E187 PolarHBondContact NH2-OE1 2.9Å; R126-V224 HydrophobicContact CG-CG1 3.65Å; R126-V224 VanDerWaalsContact NE-CG1 3.29Å; R126-A225 PolarHBondContact N-O 3.14Å; R126-F235 VanDerWaalsContact NH1-CE1 3.33Å
127G72.8Confident87.2Confident39 Ų3972.2 Ų72.240%0.40237%0.369SS..SBendtrans172.9-172.6-17900000111.7V125 H129V125-G127 PolarHBondContact O-N 3.33Å; G127-H129 PolarHBondContact O-N 2.94Å
128R63.5Low87.3Confident193 Ų19368.4 Ų68.473%0.72835%0.351SS*.SBendtrans-67.2113.8-175.6-65.3-165.9-72.8-149.80.2112.4Q130 D236R128-Q130 VanDerWaalsContact C-N 3.32Å; R128-Q130 PolarHBondContact O-N 3.19Å; R128-D236 HydrophobicContact CG-CB 4.3Å
129H65.2Low87.3Confident160 Ų16067.4 Ų67.474%0.74134%0.342SS*.SBendtrans56.2-34.6160.7-75.8-81.2000121.7G127G127-H129 PolarHBondContact O-N 2.94Å
130Q65.4Low87.3Confident190 Ų19067 Ų6789%0.88834%0.34SS*.SBendtrans-89-19-159.6-69.3171.5-3.800115.8R128R128-Q130 VanDerWaalsContact C-N 3.32Å; R128-Q130 PolarHBondContact O-N 3.19Å
131Q79.8Confident87.2Confident84 Ų8462.2 Ų62.239%0.39331%0.314SS..  trans-122.152.1-173.9-159.8170.2-300112.4Y123 S133Y123-Q131 PolarHBondContact O-NE2 3.36Å; Q131-S133 VanDerWaalsContact C-N 3.35Å
132M86.8Confident87.1Confident94 Ų9461.4 Ų61.446%0.46331%0.307SS..SBendtrans-80.4-18.1176.3-63.2-178.3113.400112.9R183M132-R183 WeakPolarHBondContact O-CB 3.24Å; M132-R183 PolarHBondContact O-N 2.03Å
133S92.4Very high87.1Confident58 Ų5861.5 Ų61.541%0.40631%0.308SS..EExtended strand (participates in β ladder)trans-140.9155.8177.353.10000110.7Q131 I181Q131-S133 VanDerWaalsContact C-N 3.35Å; S133-I181 CarbonylContact C-O 3.48Å; S133-I181 WeakPolarHBondContact CA-O 3.35Å
134V94.1Very high87.1Confident27 Ų2760.2 Ų60.216%0.16431%0.309CS..EExtended strand (participates in β ladder)trans-129.5136174.865.20000109.9A122 L124 I181 V222A122-V134 HydrophobicContact CB-CB 4.37Å; A122-V134 HydrophobicContact CB-CG1 3.88Å; A122-V134 HydrophobicContact CB-CG2 3.7Å; L124-V134 HydrophobicContact CD1-CG1 4.42Å; L124-V134 HydrophobicContact CD2-CB 3.82Å; L124-V134 HydrophobicContact CD2-CG1 3.89Å; L124-V134 HydrophobicContact CG-CB 4.47Å; L124-V134 HydrophobicContact CG-CG1 4.1Å; V134-I181 HydrophobicContact CG1-CB 4.28Å; V134-I181 PolarHBondContact N-O 2.9Å; V134-I181 PolarHBondContact O-N 2.86Å; V134-V222 HydrophobicContact CG1-CG1 3.8Å
135A95.2Very high87.3Confident50 Ų5062.8 Ų62.841%0.41332%0.321SS..EExtended strand (participates in β ladder)trans-85122.7174.900000109.4V179 L180A135-V179 CarbonylContact C-O 3.53Å; A135-V179 WeakPolarHBondContact CA-O 3.37Å; A135-L180 HydrophobicContact CB-CD2 3.84Å
136L97.1Very high87.8Confident3 Ų360.8 Ų60.82%0.01631%0.309CS..EExtended strand (participates in β ladder)trans-94.7123.4165.7-62.1-178.6000108P119 A122 F148 S178 V179 I181 C199 V222P119-L136 HydrophobicContact CB-CB 4.19Å; A122-L136 HydrophobicContact CB-CD2 3.93Å; L136-F148 HydrophobicContact CB-CE1 4.13Å; L136-S178 CarbonylContact O-C 3.57Å; L136-S178 WeakPolarHBondContact O-CA 3.27Å; L136-V179 HydrophobicContact CB-CG2 4.02Å; L136-V179 PolarHBondContact N-O 2.9Å; L136-V179 PolarHBondContact O-N 2.73Å; L136-I181 HydrophobicContact CD1-CG1 3.95Å; L136-I181 HydrophobicContact CG-CG1 4.18Å; L136-C199 HydrophobicContact CD1-CB 3.61Å; L136-V222 HydrophobicContact CD1-CG2 3.98Å; L136-V222 HydrophobicContact CD2-CG2 4.28Å; L136-V222 HydrophobicContact CG-CG2 4.47Å
137T97.5Very high88.8Confident32 Ų3262.1 Ų62.120%0.19631%0.313CS..EExtended strand (participates in β ladder)trans-112.4143-175.7-57.20000110.1P119 Q176P119-T137 VanDerWaalsContact CA-O 3.23Å; P119-T137 WeakPolarHBondContact CA-O 3.35Å; T137-Q176 HydrophobicContact CG2-CG 3.76Å; T137-Q176 VanDerWaalsContact CG2-NE2 3.29Å
138C97.7Very high90Very high0 Ų060.2 Ų60.20%029%0.294CS..EExtended strand (participates in β ladder)trans-140.6135.8174.9-172.20000109.7L115 E117 I146 F148 Q176 T177 C201L115-C138 VanDerWaalsContact CD2-SG 3.52Å; E117-C138 WeakPolarHBondContact O-CA 3.42Å; C138-I146 HydrophobicContact CB-CG2 4.25Å; C138-F148 HydrophobicContact CB-CE1 4.3Å; C138-F148 HydrophobicContact CB-CE2 4.2Å; C138-F148 HydrophobicContact CB-CZ 3.57Å; C138-Q176 CarbonylContact O-C 3.51Å; C138-Q176 VanDerWaalsContact O-CA 3.28Å; C138-Q176 WeakPolarHBondContact O-CA 3.08Å; C138-T177 PolarHBondContact N-O 2.74Å; C138-T177 PolarHBondContact O-N 2.63Å; C138-C201 HydrophobicContact CB-CB 3.72Å; C138-C201 WeakPolarHBondContact CB-SG 3.29Å; C138-C201 WeakPolarHBondContact SG-CB 3.37Å; C138-C201 CovalentContact SG-SG 2.03Å; C138-C201 PolarHBondContact SG-SG 2.91Å
139K97.5Very high91.6Very high29 Ų2953.7 Ų53.713%0.12627%0.271CS..EExtended strand (participates in β ladder)trans-129130-179-170.6-178.8171.7-1690110.2I116 E117 D167 F174 V175 Q176I116-K139 PolarHBondContact N-O 2.69Å; E117-K139 HydrophobicContact CB-CB 3.6Å; E117-K139 PolarHBondContact N-O 3.1Å; E117-K139 PolarHBondContact O-N 3.19Å; K139-D167 IonicContact NZ-OD1 3.75Å; K139-D167 PolarHBondContact NZ-OD1 2.81Å; K139-F174 HydrophobicContact CD-CD2 3.88Å; K139-F174 HydrophobicContact CD-CE2 4.18Å; K139-F174 HydrophobicContact CD-CG 4.22Å; K139-F174 VanDerWaalsContact CE-CD1 3.5Å; K139-F174 HydrophobicContact CG-CB 4.21Å; K139-F174 HydrophobicContact CG-CD2 3.66Å; K139-F174 HydrophobicContact CG-CE2 4.32Å; K139-F174 HydrophobicContact CG-CG 4.14Å; K139-V175 WeakPolarHBondContact CA-O 3.46Å; K139-Q176 HydrophobicContact CB-CB 4.36Å; K139-Q176 HydrophobicContact CB-CG 4.4Å; K139-Q176 HydrophobicContact CG-CB 4.21Å
140A96.6Very high93.2Very high0 Ų046.3 Ų46.30%024%0.237CC..EExtended strand (participates in β ladder)trans-136.7143.5179.400000112.5V114 A143 I146 F174 V175 A203V114-A140 CarbonylContact O-C 3.47Å; V114-A140 WeakPolarHBondContact O-CA 3.33Å; A140-A143 HydrophobicContact CB-CB 3.8Å; A140-I146 HydrophobicContact CB-CD1 3.96Å; A140-I146 HydrophobicContact CB-CG1 4.5Å; A140-F174 WeakPolarHBondContact O-CA 3.18Å; A140-V175 PolarHBondContact N-O 2.88Å; A140-V175 PolarHBondContact O-N 2.82Å; A140-A203 HydrophobicContact CB-CB 3.74Å
141L95.6Very high94.6Very high18 Ų1839.1 Ų39.19%0.09421%0.205CC..EExtended strand (participates in β ladder)trans-87.3153.2167.2-60.9175.7000110.1P113 V114 I116 A143 D167 A170 I172 F174P113-L141 VanDerWaalsContact CA-O 3.29Å; P113-L141 WeakPolarHBondContact CA-O 3.25Å; V114-L141 HydrophobicContact CB-CB 4.49Å; V114-L141 PolarHBondContact N-O 2.96Å; V114-L141 PolarHBondContact O-N 2.9Å; I116-L141 HydrophobicContact CD1-CD1 3.75Å; I116-L141 HydrophobicContact CD1-CD2 3.47Å; I116-L141 VanDerWaalsContact CD1-CD2 3.47Å; I116-L141 HydrophobicContact CD1-CG 3.28Å; I116-L141 HydrophobicContact CG1-CD1 4.01Å; I116-L141 HydrophobicContact CG1-CD2 4.44Å; I116-L141 HydrophobicContact CG1-CG 3.72Å; L141-A143 PolarHBondContact O-N 2.98Å; L141-D167 HydrophobicContact CD2-CB 4.15Å; L141-A170 HydrophobicContact CD1-CB 3.82Å; L141-I172 HydrophobicContact CD2-CB 4.41Å; L141-I172 HydrophobicContact CD2-CG2 4.32Å; L141-F174 HydrophobicContact CD2-CB 3.79Å
142H93.3Very high95.2Very high71 Ų7137.7 Ų37.733%0.32921%0.212SC..SBendtrans54.720.6178.5-48.9-70.4000113.7A111 I172A111-H142 HydrophobicContact CB-CB 3.77Å; H142-I172 VanDerWaalsContact CE1-CG2 3.41Å; H142-I172 WeakPolarHBondContact CE1-CG2 3.47Å
143A94.1Very high95.7Very high13 Ų1338 Ų3811%0.10722%0.22CC..  trans-93134.3173.300000108.5P113 A140 L141 I146 V175 A203 F204P113-A143 HydrophobicContact CB-CB 4.24Å; A140-A143 HydrophobicContact CB-CB 3.8Å; L141-A143 PolarHBondContact O-N 2.98Å; A143-I146 HydrophobicContact CB-CG1 4.46Å; A143-V175 WeakPolarHBondContact O-CG2 3.09Å; A143-A203 HydrophobicContact CB-CB 4.15Å; A143-F204 CarbonylContact C-O 3.52Å; A143-F204 WeakPolarHBondContact CA-O 3.5Å
144D92.8Very high95.9Very high90 Ų9040.5 Ų40.548%0.48122%0.22SC..SBendtrans-77-44.3167.5173.253.8000109.9R162 F204D144-R162 VanDerWaalsContact O-CZ 3.23Å; D144-R162 PolarHBondContact O-NH1 2.81Å; D144-R162 PolarHBondContact O-NH2 2.81Å; D144-F204 PolarHBondContact N-O 2.78Å
145H94.4Very high96Very high55 Ų5540 Ų4026%0.25522%0.217SC..EExtended strand (participates in β ladder)trans-151.3159.5175.663-83000113.5R162 F204H145-R162 VanDerWaalsContact CA-NH1 3.3Å; H145-F204 AromaticContact CD2-CD2 3.66Å; H145-F204 AromaticContact CE1-CG 3.9Å; H145-F204 PolarHBondContact N-O 2.71Å; H145-F204 AromaticContact NE2-CD2 3.44Å; H145-F204 WeakPolarHBondContact NE2-CD2 3.5Å; H145-F204 AromaticContact NE2-CG 3.5Å; H145-F204 WeakPolarHBondContact NE2-CG 3.47Å; H145-F204 PolarHBondContact O-N 2.87Å
146I96.6Very high96Very high7 Ų744.7 Ų44.74%0.03623%0.23CC..EExtended strand (participates in β ladder)trans-123.5132.4179.1-62.6174.6000108.6C138 A140 A143 F148 V175 C201 Y202 A203C138-I146 HydrophobicContact CB-CG2 4.25Å; A140-I146 HydrophobicContact CB-CD1 3.96Å; A140-I146 HydrophobicContact CB-CG1 4.5Å; A143-I146 HydrophobicContact CB-CG1 4.46Å; I146-F148 HydrophobicContact CG2-CE2 4.36Å; I146-V175 HydrophobicContact CD1-CB 4.27Å; I146-V175 HydrophobicContact CD1-CG1 4.14Å; I146-V175 VanDerWaalsContact CD1-O 3.23Å; I146-V175 WeakPolarHBondContact CD1-O 3.45Å; I146-V175 HydrophobicContact CG1-CG1 4.21Å; I146-C201 WeakPolarHBondContact CG2-SG 3.22Å; I146-Y202 CarbonylContact C-O 3.49Å; I146-Y202 VanDerWaalsContact CA-O 3.32Å; I146-Y202 WeakPolarHBondContact CA-O 3.31Å; I146-A203 HydrophobicContact CG1-CB 4.19Å
147R97Very high95.9Very high91 Ų9149 Ų4934%0.34325%0.253SS..EExtended strand (participates in β ladder)trans-126149.2172.9-75.4-177.8164.11670.5111.4W154 D157 Y202 F204R147-W154 HydrophobicContact CB-CE3 3.96Å; R147-W154 HydrophobicContact CB-CZ3 3.75Å; R147-D157 IonicContact CZ-OD1 3.32Å; R147-D157 IonicContact CZ-OD2 2.77Å; R147-D157 IonicContact NE-OD1 2.63Å; R147-D157 PolarHBondContact NE-OD1 3.25Å; R147-D157 IonicContact NE-OD2 3.53Å; R147-D157 IonicContact NH2-OD1 2.94Å; R147-D157 PolarHBondContact NH2-OD1 3.18Å; R147-D157 IonicContact NH2-OD2 3.88Å; R147-D157 PolarHBondContact NH2-OD2 3.42Å; R147-Y202 PolarHBondContact N-O 2.91Å; R147-Y202 PolarHBondContact O-N 2.9Å; R147-F204 HydrophobicContact CB-CE2 4.2Å
148F97.9Very high95.8Very high0 Ų052.2 Ų52.20%028%0.283CS..EExtended strand (participates in β ladder)trans-101.7139.7174.1-76.7-94.8000111.5P119 L136 C138 I146 V155 H160 T177 V179 E200 C201P119-F148 HydrophobicContact CB-CE1 4.18Å; P119-F148 HydrophobicContact CG-CE1 4.13Å; L136-F148 HydrophobicContact CB-CE1 4.13Å; C138-F148 HydrophobicContact CB-CE1 4.3Å; C138-F148 HydrophobicContact CB-CE2 4.2Å; C138-F148 HydrophobicContact CB-CZ 3.57Å; I146-F148 HydrophobicContact CG2-CE2 4.36Å; F148-V155 HydrophobicContact CB-CB 4.26Å; F148-V155 HydrophobicContact CB-CG2 3.97Å; F148-V155 PolarHBondContact O-N 3.37Å; F148-H160 AromaticContact CD2-CD2 3.82Å; F148-H160 AromaticContact CD2-NE2 3.87Å; F148-H160 PolarHBondContact N-NE2 2.77Å; F148-T177 HydrophobicContact CE2-CG2 4.22Å; F148-V179 HydrophobicContact CB-CG1 4.12Å; F148-V179 HydrophobicContact CB-CG2 4.14Å; F148-V179 HydrophobicContact CD1-CG2 3.83Å; F148-V179 HydrophobicContact CD2-CB 4.29Å; F148-V179 HydrophobicContact CD2-CG1 3.48Å; F148-V179 VanDerWaalsContact CD2-CG1 3.48Å; F148-V179 HydrophobicContact CD2-CG2 3.81Å; F148-V179 HydrophobicContact CE1-CG2 4.11Å; F148-V179 HydrophobicContact CE2-CG1 4.07Å; F148-V179 HydrophobicContact CE2-CG2 4.1Å; F148-V179 HydrophobicContact CG-CB 4.47Å; F148-V179 HydrophobicContact CG-CG1 3.93Å; F148-V179 HydrophobicContact CG-CG2 3.65Å; F148-V179 HydrophobicContact CZ-CG2 4.23Å; F148-E200 WeakPolarHBondContact CA-O 3.46Å; F148-C201 HydrophobicContact CD1-CB 4.4Å; F148-C201 HydrophobicContact CE1-CB 4.04Å; F148-C201 HydrophobicContact CZ-CB 4.4Å
149K97.7Very high95.6Very high55 Ų5556.6 Ų56.624%0.23930%0.304CS..EExtended strand (participates in β ladder)trans-119.4110.7171.4-166.6178.3-173.3177.80109G152 V153 W154 C199 E200 Y202K149-G152 VanDerWaalsContact CE-C 3.43Å; K149-G152 WeakPolarHBondContact CE-O 3.3Å; K149-V153 CarbonylContact C-O 3.47Å; K149-V153 WeakPolarHBondContact CA-O 3.12Å; K149-W154 HydrophobicContact CB-CD2 4.23Å; K149-W154 HydrophobicContact CB-CE3 3.86Å; K149-W154 HydrophobicContact CB-CH2 4.41Å; K149-W154 HydrophobicContact CB-CZ3 3.96Å; K149-W154 HydrophobicContact CD-CD2 4.36Å; K149-W154 HydrophobicContact CD-CH2 4.45Å; K149-W154 HydrophobicContact CD-CZ2 4.11Å; K149-W154 HydrophobicContact CG-CD2 4.2Å; K149-W154 HydrophobicContact CG-CE3 4.34Å; K149-C199 CarbonylContact O-C 3.54Å; K149-C199 WeakPolarHBondContact O-CA 3.43Å; K149-E200 PolarHBondContact N-O 2.68Å; K149-E200 PolarHBondContact O-N 3.43Å; K149-Y202 HydrophobicContact CB-CD2 4.01Å; K149-Y202 HydrophobicContact CB-CE2 3.65Å; K149-Y202 HydrophobicContact CD-CE2 3.98Å; K149-Y202 HydrophobicContact CG-CE2 4.48Å
150C97.2Very high95.6Very high5 Ų556.5 Ų56.53%0.03430%0.304CS..EExtended strand (participates in β ladder)trans-107126.2-180-62.80000110.2G152 V153 V155 Y197 A198 C199C150-G152 PolarHBondContact O-N 2.93Å; C150-G152 VanDerWaalsContact O-N 3.11Å; C150-V153 PolarHBondContact N-O 3.03Å; C150-V153 PolarHBondContact O-N 3.09Å; C150-V155 HydrophobicContact CB-CG2 4.26Å; C150-Y197 HydrophobicContact CB-CE1 3.82Å; C150-A198 CarbonylContact C-O 3.54Å; C150-A198 VanDerWaalsContact CA-O 3.27Å; C150-A198 WeakPolarHBondContact CA-O 3.45Å; C150-C199 HydrophobicContact CB-CB 4.16Å; C150-C199 WeakPolarHBondContact CB-SG 3.39Å; C150-C199 WeakPolarHBondContact SG-CB 3.17Å; C150-C199 CovalentContact SG-SG 2.04Å; C150-C199 PolarHBondContact SG-SG 3.32Å
151N94.9Very high95.7Very high40 Ų4060.7 Ų60.721%0.21432%0.324CS..THydrogen-bonded Turntrans51.834.8-179.8-56.5-45.7000113.8V153 Y189 Y197 A198N151-V153 VanDerWaalsContact C-N 3.32Å; N151-V153 PolarHBondContact O-N 3.43Å; N151-Y189 HydrophobicContact CB-CD2 4.38Å; N151-Y189 HydrophobicContact CB-CE1 4.05Å; N151-Y189 HydrophobicContact CB-CE2 3.6Å; N151-Y189 VanDerWaalsContact CB-CZ 3.44Å; N151-Y189 WeakPolarHBondContact CB-OH 3.36Å; N151-Y189 WeakPolarHBondContact OD1-CE1 3.4Å; N151-Y197 WeakPolarHBondContact ND2-CD2 3.15Å; N151-Y197 WeakPolarHBondContact ND2-CE2 3.44Å; N151-Y197 WeakPolarHBondContact OD1-CA 3.07Å; N151-A198 PolarHBondContact N-O 2.94Å; N151-A198 PolarHBondContact OD1-N 3.17Å; N151-A198 PolarHBondContact OD1-O 2.93Å
152G93.9Very high95.7Very high53 Ų5364.7 Ų64.755%0.54634%0.337SS..THydrogen-bonded Turntrans84.8-3.5-177.800000115.3K149 C150K149-G152 VanDerWaalsContact CE-C 3.43Å; K149-G152 WeakPolarHBondContact CE-O 3.3Å; C150-G152 PolarHBondContact O-N 2.93Å; C150-G152 VanDerWaalsContact O-N 3.11Å
153V95.7Very high95.9Very high101 Ų10168.2 Ų68.261%0.61235%0.348SS*.EExtended strand (participates in β ladder)trans-108.5134.4-179.7-176.30000110.2K149 C150 N151K149-V153 CarbonylContact C-O 3.47Å; K149-V153 WeakPolarHBondContact CA-O 3.12Å; C150-V153 PolarHBondContact N-O 3.03Å; C150-V153 PolarHBondContact O-N 3.09Å; N151-V153 VanDerWaalsContact C-N 3.32Å; N151-V153 PolarHBondContact O-N 3.43Å
154W96.8Very high96Very high110 Ų11073.9 Ų73.942%0.41737%0.372SS..EExtended strand (participates in β ladder)trans-70.3130.3174.4-68.3107.7000110.6R147 K149 Y202 F204R147-W154 HydrophobicContact CB-CE3 3.96Å; R147-W154 HydrophobicContact CB-CZ3 3.75Å; K149-W154 HydrophobicContact CB-CD2 4.23Å; K149-W154 HydrophobicContact CB-CE3 3.86Å; K149-W154 HydrophobicContact CB-CH2 4.41Å; K149-W154 HydrophobicContact CB-CZ3 3.96Å; K149-W154 HydrophobicContact CD-CD2 4.36Å; K149-W154 HydrophobicContact CD-CH2 4.45Å; K149-W154 HydrophobicContact CD-CZ2 4.11Å; K149-W154 HydrophobicContact CG-CD2 4.2Å; K149-W154 HydrophobicContact CG-CE3 4.34Å; W154-Y202 AromaticContact CH2-CD1 3.98Å; W154-Y202 HydrophobicContact CH2-CD1 3.98Å; W154-Y202 AromaticContact CH2-CD2 3.6Å; W154-Y202 HydrophobicContact CH2-CD2 3.6Å; W154-Y202 HydrophobicContact CH2-CE1 4.39Å; W154-Y202 HydrophobicContact CH2-CE2 4.06Å; W154-Y202 AromaticContact CH2-CG 3.55Å; W154-Y202 HydrophobicContact CH2-CG 3.55Å; W154-Y202 AromaticContact CZ3-CD2 3.71Å; W154-Y202 HydrophobicContact CZ3-CD2 3.71Å; W154-Y202 HydrophobicContact CZ3-CE2 4.39Å; W154-Y202 AromaticContact CZ3-CG 3.93Å; W154-Y202 HydrophobicContact CZ3-CG 3.93Å; W154-F204 HydrophobicContact CH2-CE2 4.43Å; W154-F204 HydrophobicContact CH2-CZ 4.02Å
155V97Very high96.1Very high17 Ų1770.9 Ų70.910%0.10336%0.362CS..PPolyproline II helixtrans-68.8147.71721790000108.3F148 C150 E159 H160 V179F148-V155 HydrophobicContact CB-CB 4.26Å; F148-V155 HydrophobicContact CB-CG2 3.97Å; F148-V155 PolarHBondContact O-N 3.37Å; C150-V155 HydrophobicContact CB-CG2 4.26Å; V155-E159 HydrophobicContact CG1-CB 3.8Å; V155-E159 HydrophobicContact CG1-CG 4.01Å; V155-E159 WeakPolarHBondContact CG1-OE2 3.26Å; V155-H160 PolarHBondContact O-CE1 2.75Å; V155-V179 HydrophobicContact CG1-CG1 4.1Å
156Q95.6Very high96.2Very high148 Ų14874.4 Ų74.469%0.69238%0.382SS*.PPolyproline II helixtrans-75.3143.2-179.9-66.3-178.9-6.700110.7A158 E159 H160Q156-A158 PolarHBondContact O-N 3.04Å; Q156-E159 PolarHBondContact O-N 3.17Å; Q156-H160 PolarHBondContact O-CE1 2.93Å; Q156-H160 PolarHBondContact O-ND1 3.34Å
157D94Very high96Very high93 Ų9374.9 Ų74.950%0.49739%0.385SS..G310 helixtrans-56.4-26.5180-64.8-37.2000112.5R147 E159 H160R147-D157 IonicContact CZ-OD1 3.32Å; R147-D157 IonicContact CZ-OD2 2.77Å; R147-D157 IonicContact NE-OD1 2.63Å; R147-D157 PolarHBondContact NE-OD1 3.25Å; R147-D157 IonicContact NE-OD2 3.53Å; R147-D157 IonicContact NH2-OD1 2.94Å; R147-D157 PolarHBondContact NH2-OD1 3.18Å; R147-D157 IonicContact NH2-OD2 3.88Å; R147-D157 PolarHBondContact NH2-OD2 3.42Å; D157-E159 VanDerWaalsContact C-N 3.3Å; D157-E159 PolarHBondContact O-N 2.04Å; D157-H160 WeakPolarHBondContact CA-ND1 3.42Å; D157-H160 WeakPolarHBondContact O-CB 3.38Å; D157-H160 PolarHBondContact O-N 3.11Å
158A94.8Very high95.7Very high100 Ų10076.2 Ų76.283%0.82641%0.408SS*.G310 helixtrans-66.6-23.5175.500000114.9Q156Q156-A158 PolarHBondContact O-N 3.04Å
159E95.4Very high95.4Very high92 Ų9282.6 Ų82.643%0.4345%0.446SS..G310 helixtrans-90.6-4.3176.7-172.4171.7-170.500111.9V155 Q156 D157 L180V155-E159 HydrophobicContact CG1-CB 3.8Å; V155-E159 HydrophobicContact CG1-CG 4.01Å; V155-E159 WeakPolarHBondContact CG1-OE2 3.26Å; Q156-E159 PolarHBondContact O-N 3.17Å; D157-E159 VanDerWaalsContact C-N 3.3Å; D157-E159 PolarHBondContact O-N 2.04Å; E159-L180 VanDerWaalsContact OE1-O 3.11Å
160H97.1Very high94.9Very high27 Ų2782.2 Ų82.213%0.12545%0.453CS..EExtended strand (participates in β ladder)trans-90.3117.6178-6677.8000110.5F148 V155 Q156 D157 R162 T177F148-H160 AromaticContact CD2-CD2 3.82Å; F148-H160 AromaticContact CD2-NE2 3.87Å; F148-H160 PolarHBondContact N-NE2 2.77Å; V155-H160 PolarHBondContact O-CE1 2.75Å; Q156-H160 PolarHBondContact O-CE1 2.93Å; Q156-H160 PolarHBondContact O-ND1 3.34Å; D157-H160 WeakPolarHBondContact CA-ND1 3.42Å; D157-H160 WeakPolarHBondContact O-CB 3.38Å; D157-H160 PolarHBondContact O-N 3.11Å; H160-R162 PolarHBondContact O-N 3.45Å; H160-T177 HydrophobicContact CB-CG2 3.65Å
161E97.5Very high94.7Very high89 Ų8984.7 Ų84.742%0.41648%0.48SS..EExtended strand (participates in β ladder)trans-88.799.1166-173.8-175.6167.100108.8R163 T177 S178E161-R163 IonicContact OE1-CZ 2.69Å; E161-R163 VanDerWaalsContact OE1-CZ 3.29Å; E161-R163 IonicContact OE1-NE 3.22Å; E161-R163 PolarHBondContact OE1-NE 2.72Å; E161-R163 VanDerWaalsContact OE1-NE 3.1Å; E161-R163 IonicContact OE1-NH2 3.1Å; E161-R163 PolarHBondContact OE1-NH2 2.89Å; E161-T177 CarbonylContact O-C 3.59Å; E161-T177 WeakPolarHBondContact O-CA 3.19Å; E161-S178 PolarHBondContact N-O 2.82Å; E161-S178 PolarHBondContact O-N 2.87Å
162R96.5Very high94.6Very high101 Ų10185.4 Ų85.438%0.38148%0.483SS..EExtended strand (participates in β ladder)trans-88.6138.2178.1-179.1-173.8168.7109.8-1.6111.1D144 H145 H160 E164 V175 Q176D144-R162 VanDerWaalsContact O-CZ 3.23Å; D144-R162 PolarHBondContact O-NH1 2.81Å; D144-R162 PolarHBondContact O-NH2 2.81Å; H145-R162 VanDerWaalsContact CA-NH1 3.3Å; H160-R162 PolarHBondContact O-N 3.45Å; R162-E164 IonicContact CZ-OE1 2.74Å; R162-E164 IonicContact NE-OE1 2.87Å; R162-E164 PolarHBondContact NE-OE1 2.87Å; R162-E164 IonicContact NH2-OE1 3.06Å; R162-E164 PolarHBondContact NH2-OE1 3.39Å; R162-V175 HydrophobicContact CG-CG1 4.25Å; R162-Q176 CarbonylContact C-O 3.6Å; R162-Q176 WeakPolarHBondContact CA-O 3.45Å
163R97Very high94.6Very high146 Ų14687.1 Ų87.155%0.55149%0.485SS*.EExtended strand (participates in β ladder)trans-137.3145.1173.2-62.5-173.4-178.4-173.40.3109.7E161 Q176E161-R163 IonicContact OE1-CZ 2.69Å; E161-R163 VanDerWaalsContact OE1-CZ 3.29Å; E161-R163 IonicContact OE1-NE 3.22Å; E161-R163 PolarHBondContact OE1-NE 2.72Å; E161-R163 VanDerWaalsContact OE1-NE 3.1Å; E161-R163 IonicContact OE1-NH2 3.1Å; E161-R163 PolarHBondContact OE1-NH2 2.89Å; R163-Q176 PolarHBondContact N-O 2.78Å; R163-Q176 PolarHBondContact O-N 2.9Å
164E96Very high94.6Very high132 Ų13283.6 Ų83.662%0.61746%0.461SS*.EExtended strand (participates in β ladder)trans-126.2152.5178.1-68.3170-152.100109.4R162 F174 V175R162-E164 IonicContact CZ-OE1 2.74Å; R162-E164 IonicContact NE-OE1 2.87Å; R162-E164 PolarHBondContact NE-OE1 2.87Å; R162-E164 IonicContact NH2-OE1 3.06Å; R162-E164 PolarHBondContact NH2-OE1 3.39Å; E164-F174 WeakPolarHBondContact CA-O 3.09Å; E164-V175 HydrophobicContact CG-CG2 4.27Å
165G95.7Very high94.6Very high27 Ų2778.8 Ų78.828%0.27844%0.444SS..EExtended strand (participates in β ladder)trans-171.2-175.6176.900000111.3P173 F174G165-P173 CarbonylContact O-C 3.59Å; G165-P173 VanDerWaalsContact O-CA 3.24Å; G165-P173 WeakPolarHBondContact O-CA 2.95Å; G165-F174 VanDerWaalsContact C-CD1 3.45Å; G165-F174 VanDerWaalsContact C-CE1 3.45Å; G165-F174 PolarHBondContact N-O 2.84Å; G165-F174 VanDerWaalsContact N-O 3.17Å; G165-F174 VanDerWaalsContact O-CD1 3.32Å; G165-F174 WeakPolarHBondContact O-CD1 3.43Å; G165-F174 PolarHBondContact O-N 2.7Å
166I95.5Very high94.6Very high128 Ų12880.3 Ų80.366%0.65645%0.45SS*.EExtended strand (participates in β ladder)trans-106.4129.8172.7-59.4173.5000107.1S168I166-S168 PolarHBondContact O-N 2.81Å
167D92.8Very high94.8Very high18 Ų1873.3 Ų73.310%0.09642%0.417CS..  trans-74.6128.4178.7-171.876.8000109.2K139 L141 V169 A170 G171 I172 F174K139-D167 IonicContact NZ-OD1 3.75Å; K139-D167 PolarHBondContact NZ-OD1 2.81Å; L141-D167 HydrophobicContact CD2-CB 4.15Å; D167-V169 PolarHBondContact O-N 3.4Å; D167-V169 WeakPolarHBondContact OD2-CA 3.33Å; D167-V169 WeakPolarHBondContact OD2-CB 3.46Å; D167-V169 PolarHBondContact OD2-N 3.32Å; D167-A170 HydrophobicContact CB-CB 4.17Å; D167-A170 PolarHBondContact OD2-N 2.94Å; D167-G171 VanDerWaalsContact O-CA 3.29Å; D167-G171 WeakPolarHBondContact O-CA 3.33Å; D167-G171 PolarHBondContact O-N 2.77Å; D167-I172 PolarHBondContact N-O 3.49Å; D167-F174 HydrophobicContact CB-CD1 4.02Å
168S91Very high94.9Very high119 Ų11969.6 Ų69.683%0.83240%0.398SS*.THydrogen-bonded Turntrans-68.8-24.2-176.155.10000113.2I166I166-S168 PolarHBondContact O-N 2.81Å
169V90.5Very high95Very high134 Ų13464.8 Ų64.881%0.81236%0.359SS*.THydrogen-bonded Turntrans-88.5-46.8-178.7-1760000110D167D167-V169 PolarHBondContact O-N 3.4Å; D167-V169 WeakPolarHBondContact OD2-CA 3.33Å; D167-V169 WeakPolarHBondContact OD2-CB 3.46Å; D167-V169 PolarHBondContact OD2-N 3.32Å
170A88.6Confident95.1Very high46 Ų4664.8 Ų64.838%0.3836%0.361SS..THydrogen-bonded Turntrans-83-23.7-178.300000113.8L141 D167 I172L141-A170 HydrophobicContact CD1-CB 3.82Å; D167-A170 HydrophobicContact CB-CB 4.17Å; D167-A170 PolarHBondContact OD2-N 2.94Å; A170-I172 HydrophobicContact CB-CB 4.35Å; A170-I172 HydrophobicContact CB-CD1 4.44Å; A170-I172 WeakPolarHBondContact O-CG1 3.39Å; A170-I172 PolarHBondContact O-N 2.88Å
171G92.9Very high95Very high58 Ų5863.5 Ų63.560%0.59836%0.356SS*.  trans68.515.1-174.300000114.1D167D167-G171 VanDerWaalsContact O-CA 3.29Å; D167-G171 WeakPolarHBondContact O-CA 3.33Å; D167-G171 PolarHBondContact O-N 2.77Å
172I92.3Very high94.8Very high54 Ų5461.4 Ų61.428%0.27735%0.351SS..SBendtrans-118.8147.7-172.5-66.4165000108.6L141 H142 D167 A170 F174L141-I172 HydrophobicContact CD2-CB 4.41Å; L141-I172 HydrophobicContact CD2-CG2 4.32Å; H142-I172 VanDerWaalsContact CE1-CG2 3.41Å; H142-I172 WeakPolarHBondContact CE1-CG2 3.47Å; D167-I172 PolarHBondContact N-O 3.49Å; A170-I172 HydrophobicContact CB-CB 4.35Å; A170-I172 HydrophobicContact CB-CD1 4.44Å; A170-I172 WeakPolarHBondContact O-CG1 3.39Å; A170-I172 PolarHBondContact O-N 2.88Å; I172-F174 PolarHBondContact O-N 3.39Å
173P94.2Very high94.5Very high89 Ų8959.4 Ų59.458%0.57834%0.343SS*.EExtended strand (participates in β ladder)trans-60.1137.4174.425.2-35.8000112.3G165G165-P173 CarbonylContact O-C 3.59Å; G165-P173 VanDerWaalsContact O-CA 3.24Å; G165-P173 WeakPolarHBondContact O-CA 2.95Å
174F96Very high94.3Very high28 Ų2858.4 Ų58.412%0.12335%0.345CS..EExtended strand (participates in β ladder)trans-117.6152.717273.8-96.7000110.7K139 A140 L141 E164 G165 D167 I172 Q176K139-F174 HydrophobicContact CD-CD2 3.88Å; K139-F174 HydrophobicContact CD-CE2 4.18Å; K139-F174 HydrophobicContact CD-CG 4.22Å; K139-F174 VanDerWaalsContact CE-CD1 3.5Å; K139-F174 HydrophobicContact CG-CB 4.21Å; K139-F174 HydrophobicContact CG-CD2 3.66Å; K139-F174 HydrophobicContact CG-CE2 4.32Å; K139-F174 HydrophobicContact CG-CG 4.14Å; A140-F174 WeakPolarHBondContact O-CA 3.18Å; L141-F174 HydrophobicContact CD2-CB 3.79Å; E164-F174 WeakPolarHBondContact CA-O 3.09Å; G165-F174 VanDerWaalsContact C-CD1 3.45Å; G165-F174 VanDerWaalsContact C-CE1 3.45Å; G165-F174 PolarHBondContact N-O 2.84Å; G165-F174 VanDerWaalsContact N-O 3.17Å; G165-F174 VanDerWaalsContact O-CD1 3.32Å; G165-F174 WeakPolarHBondContact O-CD1 3.43Å; G165-F174 PolarHBondContact O-N 2.7Å; D167-F174 HydrophobicContact CB-CD1 4.02Å; I172-F174 PolarHBondContact O-N 3.39Å; F174-Q176 HydrophobicContact CD2-CB 4.01Å; F174-Q176 HydrophobicContact CE2-CB 3.82Å
175V96.8Very high94.1Very high9 Ų953.3 Ų53.36%0.05533%0.325CS..EExtended strand (participates in β ladder)trans-111131.8165.4-178.30000107.6K139 A140 A143 I146 R162 E164K139-V175 WeakPolarHBondContact CA-O 3.46Å; A140-V175 PolarHBondContact N-O 2.88Å; A140-V175 PolarHBondContact O-N 2.82Å; A143-V175 WeakPolarHBondContact O-CG2 3.09Å; I146-V175 HydrophobicContact CD1-CB 4.27Å; I146-V175 HydrophobicContact CD1-CG1 4.14Å; I146-V175 VanDerWaalsContact CD1-O 3.23Å; I146-V175 WeakPolarHBondContact CD1-O 3.45Å; I146-V175 HydrophobicContact CG1-CG1 4.21Å; R162-V175 HydrophobicContact CG-CG1 4.25Å; E164-V175 HydrophobicContact CG-CG2 4.27Å
176Q97.5Very high94.1Very high48 Ų4852.2 Ų52.222%0.22431%0.313CS..EExtended strand (participates in β ladder)trans-121.8130.1173.6179.4178.4-25.200108.6T137 C138 K139 R162 R163 F174T137-Q176 HydrophobicContact CG2-CG 3.76Å; T137-Q176 VanDerWaalsContact CG2-NE2 3.29Å; C138-Q176 CarbonylContact O-C 3.51Å; C138-Q176 VanDerWaalsContact O-CA 3.28Å; C138-Q176 WeakPolarHBondContact O-CA 3.08Å; K139-Q176 HydrophobicContact CB-CB 4.36Å; K139-Q176 HydrophobicContact CB-CG 4.4Å; K139-Q176 HydrophobicContact CG-CB 4.21Å; R162-Q176 CarbonylContact C-O 3.6Å; R162-Q176 WeakPolarHBondContact CA-O 3.45Å; R163-Q176 PolarHBondContact N-O 2.78Å; R163-Q176 PolarHBondContact O-N 2.9Å; F174-Q176 HydrophobicContact CD2-CB 4.01Å; F174-Q176 HydrophobicContact CE2-CB 3.82Å
177T97.9Very high93.9Very high2 Ų248.1 Ų48.11%0.01229%0.291CS..EExtended strand (participates in β ladder)trans-129.9139176-590000109.7C138 F148 H160 E161C138-T177 PolarHBondContact N-O 2.74Å; C138-T177 PolarHBondContact O-N 2.63Å; F148-T177 HydrophobicContact CE2-CG2 4.22Å; H160-T177 HydrophobicContact CB-CG2 3.65Å; E161-T177 CarbonylContact O-C 3.59Å; E161-T177 WeakPolarHBondContact O-CA 3.19Å
178S97.5Very high93.9Very high14 Ų1454.5 Ų54.510%0.09831%0.314CS..EExtended strand (participates in β ladder)trans-125.7148.817462.70000112.1L136 E161L136-S178 CarbonylContact O-C 3.57Å; L136-S178 WeakPolarHBondContact O-CA 3.27Å; E161-S178 PolarHBondContact N-O 2.82Å; E161-S178 PolarHBondContact O-N 2.87Å
179V97.2Very high94Very high0 Ų051.5 Ų51.50%029%0.285CS..EExtended strand (participates in β ladder)trans-128.4138.7177-67.60000110A135 L136 F148 V155 I181A135-V179 CarbonylContact C-O 3.53Å; A135-V179 WeakPolarHBondContact CA-O 3.37Å; L136-V179 HydrophobicContact CB-CG2 4.02Å; L136-V179 PolarHBondContact N-O 2.9Å; L136-V179 PolarHBondContact O-N 2.73Å; F148-V179 HydrophobicContact CB-CG1 4.12Å; F148-V179 HydrophobicContact CB-CG2 4.14Å; F148-V179 HydrophobicContact CD1-CG2 3.83Å; F148-V179 HydrophobicContact CD2-CB 4.29Å; F148-V179 HydrophobicContact CD2-CG1 3.48Å; F148-V179 VanDerWaalsContact CD2-CG1 3.48Å; F148-V179 HydrophobicContact CD2-CG2 3.81Å; F148-V179 HydrophobicContact CE1-CG2 4.11Å; F148-V179 HydrophobicContact CE2-CG1 4.07Å; F148-V179 HydrophobicContact CE2-CG2 4.1Å; F148-V179 HydrophobicContact CG-CB 4.47Å; F148-V179 HydrophobicContact CG-CG1 3.93Å; F148-V179 HydrophobicContact CG-CG2 3.65Å; F148-V179 HydrophobicContact CZ-CG2 4.23Å; V155-V179 HydrophobicContact CG1-CG1 4.1Å; V179-I181 HydrophobicContact CG2-CD1 4.09Å
180L95.8Very high94.1Very high91 Ų9151.3 Ų51.348%0.47627%0.269SS..EExtended strand (participates in β ladder)trans-96.4103.7-177.3-75.8172.7000111.4A135 E159A135-L180 HydrophobicContact CB-CD2 3.84Å; E159-L180 VanDerWaalsContact OE1-O 3.11Å
181I95.3Very high94.3Very high1 Ų156.3 Ų56.31%0.00529%0.289CS..EExtended strand (participates in β ladder)trans-89.2117.2179.2-51.4-53.7000110S133 V134 L136 V179 V186 Y197S133-I181 CarbonylContact C-O 3.48Å; S133-I181 WeakPolarHBondContact CA-O 3.35Å; V134-I181 HydrophobicContact CG1-CB 4.28Å; V134-I181 PolarHBondContact N-O 2.9Å; V134-I181 PolarHBondContact O-N 2.86Å; L136-I181 HydrophobicContact CD1-CG1 3.95Å; L136-I181 HydrophobicContact CG-CG1 4.18Å; V179-I181 HydrophobicContact CG2-CD1 4.09Å; I181-V186 HydrophobicContact CG2-CG2 3.65Å; I181-Y197 HydrophobicContact CD1-CE1 4.16Å; I181-Y197 HydrophobicContact CG1-CE1 4.38Å; I181-Y197 HydrophobicContact CG2-CD1 4.02Å; I181-Y197 HydrophobicContact CG2-CE1 3.6Å
182S93.3Very high94.3Very high45 Ų4559.8 Ų59.832%0.31529%0.292SS..EExtended strand (participates in β ladder)trans-80.6148.2177.670.50000113.4Q184 A185 V186S182-Q184 VanDerWaalsContact C-N 3.26Å; S182-Q184 PolarHBondContact O-N 2.98Å; S182-A185 WeakPolarHBondContact O-CB 3.49Å; S182-A185 PolarHBondContact O-N 2.87Å; S182-A185 VanDerWaalsContact O-N 3.08Å; S182-A185 WeakPolarHBondContact OG-CB 3.36Å; S182-A185 PolarHBondContact OG-N 2.66Å; S182-V186 PolarHBondContact O-N 2.87Å
183R91.6Very high94.3Very high59 Ų5965.9 Ų65.922%0.22331%0.312CS..Hα-helixtrans-55.9-41173.4-170.3-177.980.4-169.13112.1L124 M132 A185 V186 E187 V224L124-R183 HydrophobicContact CD1-CB 4.19Å; M132-R183 WeakPolarHBondContact O-CB 3.24Å; M132-R183 PolarHBondContact O-N 2.03Å; R183-A185 VanDerWaalsContact C-N 3.29Å; R183-A185 PolarHBondContact O-N 3.17Å; R183-V186 PolarHBondContact O-N 2.89Å; R183-E187 HydrophobicContact CG-CG 4.18Å; R183-E187 IonicContact NE-OE1 3.01Å; R183-E187 IonicContact NE-OE2 3.29Å; R183-E187 WeakPolarHBondContact O-CB 3.35Å; R183-E187 WeakPolarHBondContact O-CG 3.41Å; R183-E187 PolarHBondContact O-N 2.87Å; R183-V224 HydrophobicContact CG-CG2 4.37Å
184Q91.8Very high94.1Very high125 Ų12564.7 Ų64.758%0.58432%0.315SS*.Hα-helixtrans-63.2-35.4178.4-63.1-177.415.800112.3S182 R188S182-Q184 VanDerWaalsContact C-N 3.26Å; S182-Q184 PolarHBondContact O-N 2.98Å; Q184-R188 VanDerWaalsContact O-CB 3.25Å; Q184-R188 WeakPolarHBondContact O-CB 3.23Å; Q184-R188 WeakPolarHBondContact O-CG 3.48Å; Q184-R188 PolarHBondContact O-N 3.07Å; Q184-R188 PolarHBondContact O-NE 3.49Å; Q184-R188 VanDerWaalsContact O-NE 3.16Å
185A93.2Very high93.9Very high24 Ų2465.7 Ų65.720%0.19833%0.326CS..Hα-helixtrans-66.7-46.4175.700000111.4S182 R183 Y189 Y197S182-A185 WeakPolarHBondContact O-CB 3.49Å; S182-A185 PolarHBondContact O-N 2.87Å; S182-A185 VanDerWaalsContact O-N 3.08Å; S182-A185 WeakPolarHBondContact OG-CB 3.36Å; S182-A185 PolarHBondContact OG-N 2.66Å; R183-A185 VanDerWaalsContact C-N 3.29Å; R183-A185 PolarHBondContact O-N 3.17Å; A185-Y189 VanDerWaalsContact O-CB 3.31Å; A185-Y189 WeakPolarHBondContact O-CB 3.15Å; A185-Y189 PolarHBondContact O-N 2.81Å; A185-Y197 HydrophobicContact CB-CE2 4.5Å
186V94.7Very high93.8Very high5 Ų567.4 Ų67.43%0.0334%0.335CS..Hα-helixtrans-63.3-47.1179.1178.10000111.5L124 I181 S182 R183 Y189 R190 Y197 V222 V224L124-V186 HydrophobicContact CD1-CB 4.34Å; L124-V186 HydrophobicContact CD1-CG2 3.83Å; I181-V186 HydrophobicContact CG2-CG2 3.65Å; S182-V186 PolarHBondContact O-N 2.87Å; R183-V186 PolarHBondContact O-N 2.89Å; V186-Y189 PolarHBondContact O-N 3.33Å; V186-R190 WeakPolarHBondContact O-CB 3.48Å; V186-R190 PolarHBondContact O-N 2.91Å; V186-Y197 HydrophobicContact CB-CG 4.49Å; V186-Y197 HydrophobicContact CG2-CD1 4.17Å; V186-Y197 HydrophobicContact CG2-CD2 4.2Å; V186-Y197 HydrophobicContact CG2-CG 3.88Å; V186-V222 HydrophobicContact CG2-CB 4.18Å; V186-V222 HydrophobicContact CG2-CG1 3.85Å; V186-V224 HydrophobicContact CB-CG2 4.46Å; V186-V224 HydrophobicContact CG1-CG2 3.89Å
187E91.7Very high93.7Very high42 Ų4266.7 Ų66.720%0.19633%0.33CS..Hα-helixtrans-63.7-47.2179.5-72.1177.2155.800111.5R126 R183 Y189 R190 L191 V224R126-E187 IonicContact CZ-OE1 2.73Å; R126-E187 VanDerWaalsContact CZ-OE1 3.29Å; R126-E187 IonicContact NE-OE1 3.89Å; R126-E187 PolarHBondContact NE-OE1 2.72Å; R126-E187 IonicContact NH2-OE1 3.29Å; R126-E187 PolarHBondContact NH2-OE1 2.9Å; R183-E187 HydrophobicContact CG-CG 4.18Å; R183-E187 IonicContact NE-OE1 3.01Å; R183-E187 IonicContact NE-OE2 3.29Å; R183-E187 WeakPolarHBondContact O-CB 3.35Å; R183-E187 WeakPolarHBondContact O-CG 3.41Å; R183-E187 PolarHBondContact O-N 2.87Å; E187-Y189 VanDerWaalsContact C-N 3.35Å; E187-Y189 PolarHBondContact O-N 2.9Å; E187-R190 PolarHBondContact O-N 2.8Å; E187-L191 WeakPolarHBondContact O-CB 3.46Å; E187-L191 WeakPolarHBondContact O-CG 3.39Å; E187-L191 PolarHBondContact O-N 3.02Å; E187-V224 HydrophobicContact CG-CG2 3.85Å
188R92.6Very high93.6Very high151 Ų15167.9 Ų67.957%0.5734%0.341SS*.Hα-helixtrans-59.7-45.4176.7-76.3-175.2-65.4168.9-2.5111.8Q184 L191 I192Q184-R188 VanDerWaalsContact O-CB 3.25Å; Q184-R188 WeakPolarHBondContact O-CB 3.23Å; Q184-R188 WeakPolarHBondContact O-CG 3.48Å; Q184-R188 PolarHBondContact O-N 3.07Å; Q184-R188 PolarHBondContact O-NE 3.49Å; Q184-R188 VanDerWaalsContact O-NE 3.16Å; R188-L191 PolarHBondContact O-N 3.3Å; R188-I192 WeakPolarHBondContact O-CD1 3.32Å; R188-I192 VanDerWaalsContact O-CG1 3.26Å; R188-I192 WeakPolarHBondContact O-CG1 3.4Å; R188-I192 PolarHBondContact O-N 3.2Å; R188-I192 VanDerWaalsContact O-N 3.1Å
189Y94Very high93.6Very high57 Ų5767.2 Ų67.222%0.22434%0.336CS..Hα-helixtrans-62.6-46.6179.8-175.8-98.7000111.8N151 A185 V186 E187 L191 I192 R193 S195 Y197N151-Y189 HydrophobicContact CB-CD2 4.38Å; N151-Y189 HydrophobicContact CB-CE1 4.05Å; N151-Y189 HydrophobicContact CB-CE2 3.6Å; N151-Y189 VanDerWaalsContact CB-CZ 3.44Å; N151-Y189 WeakPolarHBondContact CB-OH 3.36Å; N151-Y189 WeakPolarHBondContact OD1-CE1 3.4Å; A185-Y189 VanDerWaalsContact O-CB 3.31Å; A185-Y189 WeakPolarHBondContact O-CB 3.15Å; A185-Y189 PolarHBondContact O-N 2.81Å; V186-Y189 PolarHBondContact O-N 3.33Å; E187-Y189 VanDerWaalsContact C-N 3.35Å; E187-Y189 PolarHBondContact O-N 2.9Å; Y189-L191 VanDerWaalsContact C-N 3.31Å; Y189-L191 PolarHBondContact O-N 3.1Å; Y189-I192 PolarHBondContact O-N 3.41Å; Y189-R193 HydrophobicContact CD2-CG 4.23Å; Y189-R193 HydrophobicContact CE1-CB 4.26Å; Y189-R193 HydrophobicContact CE2-CB 4.31Å; Y189-R193 HydrophobicContact CE2-CG 3.71Å; Y189-R193 PolarHBondContact O-N 2.77Å; Y189-S195 VanDerWaalsContact CE1-OG 3.24Å; Y189-S195 WeakPolarHBondContact CE1-OG 2.99Å; Y189-Y197 HydrophobicContact CD1-CD2 4.04Å; Y189-Y197 AromaticContact CG-CD2 3.94Å; Y189-Y197 HydrophobicContact CG-CD2 3.94Å; Y189-Y197 HydrophobicContact CG-CE2 4.5Å
190R92.3Very high93.7Very high130 Ų13069.2 Ų69.249%0.49135%0.345SS..Hα-helixtrans-59.9-40.2176.8-171.6-175.3-176.486.40.4111.9V186 E187 G194 D196V186-R190 WeakPolarHBondContact O-CB 3.48Å; V186-R190 PolarHBondContact O-N 2.91Å; E187-R190 PolarHBondContact O-N 2.8Å; R190-G194 WeakPolarHBondContact O-CA 2.99Å; R190-G194 PolarHBondContact O-N 2.84Å; R190-D196 IonicContact CZ-OD1 3.7Å; R190-D196 IonicContact NH1-OD1 3.7Å; R190-D196 PolarHBondContact NH1-OD1 2.92Å
191L92.4Very high93.8Very high150 Ų15064.9 Ų64.979%0.78532%0.323SS*.Hα-helixtrans-65.4-37.2178-72.8167.1000112.7E187 R188 Y189E187-L191 WeakPolarHBondContact O-CB 3.46Å; E187-L191 WeakPolarHBondContact O-CG 3.39Å; E187-L191 PolarHBondContact O-N 3.02Å; R188-L191 PolarHBondContact O-N 3.3Å; Y189-L191 VanDerWaalsContact C-N 3.31Å; Y189-L191 PolarHBondContact O-N 3.1Å
192I93.5Very high93.9Very high132 Ų13265.7 Ų65.768%0.67733%0.326SS*.Hα-helixtrans-82.3-42.1-176.7-63163.1000111.8R188 Y189R188-I192 WeakPolarHBondContact O-CD1 3.32Å; R188-I192 VanDerWaalsContact O-CG1 3.26Å; R188-I192 WeakPolarHBondContact O-CG1 3.4Å; R188-I192 PolarHBondContact O-N 3.2Å; R188-I192 VanDerWaalsContact O-N 3.1Å; Y189-I192 PolarHBondContact O-N 3.41Å
193R91.9Very high94Very high182 Ų18263.5 Ų63.569%0.68731%0.311SS*.Hα-helixtrans-106.3-15.7-171.1-63.8-63.8-172.7137-0.2114.3Y189 S195Y189-R193 HydrophobicContact CD2-CG 4.23Å; Y189-R193 HydrophobicContact CE1-CB 4.26Å; Y189-R193 HydrophobicContact CE2-CB 4.31Å; Y189-R193 HydrophobicContact CE2-CG 3.71Å; Y189-R193 PolarHBondContact O-N 2.77Å; R193-S195 PolarHBondContact O-N 2.88Å
194G90.2Very high94.2Very high63 Ų6361.9 Ų61.965%0.64931%0.305SS*.SBendtrans69.94-177.500000115R190R190-G194 WeakPolarHBondContact O-CA 2.99Å; R190-G194 PolarHBondContact O-N 2.84Å
195S91.8Very high94.1Very high49 Ų4956.1 Ų56.134%0.34328%0.279SS..SBendtrans-106165.2-179.770.30000112Y189 R193Y189-S195 VanDerWaalsContact CE1-OG 3.24Å; Y189-S195 WeakPolarHBondContact CE1-OG 2.99Å; R193-S195 PolarHBondContact O-N 2.88Å
196D93Very high93.7Very high46 Ų4657.8 Ų57.825%0.24629%0.293CS..  trans-69.5153.6170.8-66.4-31.2000110.9R190 R223R190-D196 IonicContact CZ-OD1 3.7Å; R190-D196 IonicContact NH1-OD1 3.7Å; R190-D196 PolarHBondContact NH1-OD1 2.92Å; D196-R223 IonicContact OD1-NE 2.68Å; D196-R223 IonicContact OD2-CZ 2.71Å; D196-R223 IonicContact OD2-NE 3.78Å; D196-R223 PolarHBondContact OD2-NE 2.9Å; D196-R223 IonicContact OD2-NH2 2.91Å; D196-R223 PolarHBondContact OD2-NH2 2.99Å
197Y95.8Very high93Very high32 Ų3262.2 Ų62.213%0.12532%0.324CS..EExtended strand (participates in β ladder)trans-83.5115.2175-167.3-82.1000108.2C150 N151 I181 A185 V186 Y189 C199 T221 V222C150-Y197 HydrophobicContact CB-CE1 3.82Å; N151-Y197 WeakPolarHBondContact ND2-CD2 3.15Å; N151-Y197 WeakPolarHBondContact ND2-CE2 3.44Å; N151-Y197 WeakPolarHBondContact OD1-CA 3.07Å; I181-Y197 HydrophobicContact CD1-CE1 4.16Å; I181-Y197 HydrophobicContact CG1-CE1 4.38Å; I181-Y197 HydrophobicContact CG2-CD1 4.02Å; I181-Y197 HydrophobicContact CG2-CE1 3.6Å; A185-Y197 HydrophobicContact CB-CE2 4.5Å; V186-Y197 HydrophobicContact CB-CG 4.49Å; V186-Y197 HydrophobicContact CG2-CD1 4.17Å; V186-Y197 HydrophobicContact CG2-CD2 4.2Å; V186-Y197 HydrophobicContact CG2-CG 3.88Å; Y189-Y197 HydrophobicContact CD1-CD2 4.04Å; Y189-Y197 AromaticContact CG-CD2 3.94Å; Y189-Y197 HydrophobicContact CG-CD2 3.94Å; Y189-Y197 HydrophobicContact CG-CE2 4.5Å; Y197-C199 WeakPolarHBondContact CE1-SG 3.06Å; Y197-T221 CarbonylContact O-C 3.54Å; Y197-T221 WeakPolarHBondContact O-CA 3.42Å; Y197-V222 HydrophobicContact CD1-CB 4.34Å; Y197-V222 HydrophobicContact CD1-CG2 4.35Å; Y197-V222 PolarHBondContact O-N 2.7Å
198A96.7Very high92Very high28 Ų2864.2 Ų64.223%0.23134%0.34CS..EExtended strand (participates in β ladder)trans-121.1137.6-176.600000111C150 N151 A220 T221C150-A198 CarbonylContact C-O 3.54Å; C150-A198 VanDerWaalsContact CA-O 3.27Å; C150-A198 WeakPolarHBondContact CA-O 3.45Å; N151-A198 PolarHBondContact N-O 2.94Å; N151-A198 PolarHBondContact OD1-N 3.17Å; N151-A198 PolarHBondContact OD1-O 2.93Å; A198-A220 CarbonylContact C-O 3.59Å; A198-A220 WeakPolarHBondContact CA-O 3.49Å; A198-T221 HydrophobicContact CB-CG2 4.31Å
199C97.9Very high90.8Very high0 Ų060.9 Ų60.90%033%0.333CS..EExtended strand (participates in β ladder)trans-124.6141.5178-640000111.4L136 K149 C150 Y197 P219 A220L136-C199 HydrophobicContact CD1-CB 3.61Å; K149-C199 CarbonylContact O-C 3.54Å; K149-C199 WeakPolarHBondContact O-CA 3.43Å; C150-C199 HydrophobicContact CB-CB 4.16Å; C150-C199 WeakPolarHBondContact CB-SG 3.39Å; C150-C199 WeakPolarHBondContact SG-CB 3.17Å; C150-C199 CovalentContact SG-SG 2.04Å; C150-C199 PolarHBondContact SG-SG 3.32Å; Y197-C199 WeakPolarHBondContact CE1-SG 3.06Å; C199-P219 WeakPolarHBondContact O-CA 3.28Å; C199-A220 PolarHBondContact N-O 2.84Å; C199-A220 PolarHBondContact O-N 3.5Å
200E97.6Very high89.5Confident42 Ų4268.3 Ų68.320%0.19637%0.37CS..EExtended strand (participates in β ladder)trans-120.4133.1179.8-62.4177.4145.500108.4F148 K149 Y202 K216 P219F148-E200 WeakPolarHBondContact CA-O 3.46Å; K149-E200 PolarHBondContact N-O 2.68Å; K149-E200 PolarHBondContact O-N 3.43Å; E200-Y202 HydrophobicContact CB-CD2 4.29Å; E200-Y202 HydrophobicContact CB-CE2 3.67Å; E200-Y202 PolarHBondContact OE2-OH 2.85Å; E200-K216 WeakPolarHBondContact OE1-CE 3.09Å; E200-K216 IonicContact OE1-NZ 2.72Å; E200-K216 PolarHBondContact OE1-NZ 2.81Å; E200-K216 WeakPolarHBondContact OE2-CE 3.23Å; E200-K216 IonicContact OE2-NZ 2.66Å; E200-K216 PolarHBondContact OE2-NZ 3.39Å; E200-P219 HydrophobicContact CG-CB 3.88Å
201C97.9Very high88.2Confident0 Ų069.8 Ų69.80%038%0.384CS..EExtended strand (participates in β ladder)trans-89.2134173.4173.60000109.8P119 C138 I146 F148 K216 S217P119-C201 HydrophobicContact CG-CB 4.01Å; C138-C201 HydrophobicContact CB-CB 3.72Å; C138-C201 WeakPolarHBondContact CB-SG 3.29Å; C138-C201 WeakPolarHBondContact SG-CB 3.37Å; C138-C201 CovalentContact SG-SG 2.03Å; C138-C201 PolarHBondContact SG-SG 2.91Å; I146-C201 WeakPolarHBondContact CG2-SG 3.22Å; F148-C201 HydrophobicContact CD1-CB 4.4Å; F148-C201 HydrophobicContact CE1-CB 4.04Å; F148-C201 HydrophobicContact CZ-CB 4.4Å; C201-K216 WeakPolarHBondContact O-CA 3.32Å; C201-S217 WeakPolarHBondContact CB-OG 3.24Å; C201-S217 PolarHBondContact N-OG 3.31Å; C201-S217 PolarHBondContact O-N 3Å
202Y97.4Very high87.3Confident17 Ų1764.9 Ų64.97%0.06737%0.365CS..EExtended strand (participates in β ladder)trans-121.5117.8174.8-71.9-99.4000109.4I146 R147 K149 W154 E200 V215 K216I146-Y202 CarbonylContact C-O 3.49Å; I146-Y202 VanDerWaalsContact CA-O 3.32Å; I146-Y202 WeakPolarHBondContact CA-O 3.31Å; R147-Y202 PolarHBondContact N-O 2.91Å; R147-Y202 PolarHBondContact O-N 2.9Å; K149-Y202 HydrophobicContact CB-CD2 4.01Å; K149-Y202 HydrophobicContact CB-CE2 3.65Å; K149-Y202 HydrophobicContact CD-CE2 3.98Å; K149-Y202 HydrophobicContact CG-CE2 4.48Å; W154-Y202 AromaticContact CH2-CD1 3.98Å; W154-Y202 HydrophobicContact CH2-CD1 3.98Å; W154-Y202 AromaticContact CH2-CD2 3.6Å; W154-Y202 HydrophobicContact CH2-CD2 3.6Å; W154-Y202 HydrophobicContact CH2-CE1 4.39Å; W154-Y202 HydrophobicContact CH2-CE2 4.06Å; W154-Y202 AromaticContact CH2-CG 3.55Å; W154-Y202 HydrophobicContact CH2-CG 3.55Å; W154-Y202 AromaticContact CZ3-CD2 3.71Å; W154-Y202 HydrophobicContact CZ3-CD2 3.71Å; W154-Y202 HydrophobicContact CZ3-CE2 4.39Å; W154-Y202 AromaticContact CZ3-CG 3.93Å; W154-Y202 HydrophobicContact CZ3-CG 3.93Å; E200-Y202 HydrophobicContact CB-CD2 4.29Å; E200-Y202 HydrophobicContact CB-CE2 3.67Å; E200-Y202 PolarHBondContact OE2-OH 2.85Å; Y202-V215 WeakPolarHBondContact CA-O 3.27Å; Y202-K216 HydrophobicContact CD1-CB 4.17Å; Y202-K216 HydrophobicContact CD1-CG 4.3Å; Y202-K216 HydrophobicContact CE1-CB 3.94Å; Y202-K216 HydrophobicContact CE1-CD 3.93Å; Y202-K216 HydrophobicContact CE1-CG 3.78Å; Y202-K216 HydrophobicContact CE2-CG 4.28Å; Y202-K216 WeakPolarHBondContact OH-CD 3.4Å; Y202-K216 WeakPolarHBondContact OH-CE 3.5Å
203A96.6Very high87.1Confident0 Ų060.8 Ų60.80%035%0.346CS..EExtended strand (participates in β ladder)trans-101.6125.1174.200000109.5P113 L115 A140 A143 I146 Q214 V215P113-A203 HydrophobicContact CB-CB 3.93Å; L115-A203 HydrophobicContact CD2-CB 4.36Å; A140-A203 HydrophobicContact CB-CB 3.74Å; A143-A203 HydrophobicContact CB-CB 4.15Å; I146-A203 HydrophobicContact CG1-CB 4.19Å; A203-Q214 CarbonylContact O-C 3.54Å; A203-Q214 VanDerWaalsContact O-CA 3.27Å; A203-Q214 WeakPolarHBondContact O-CA 3.44Å; A203-V215 PolarHBondContact N-O 2.97Å; A203-V215 PolarHBondContact O-N 3.44Å
204F94.3Very high87.1Confident24 Ų2456.8 Ų56.811%0.10534%0.335CS..EExtended strand (participates in β ladder)trans-106131.6-179.3-63.7-93.3000109.6A143 D144 H145 R147 W154 Q214A143-F204 CarbonylContact C-O 3.52Å; A143-F204 WeakPolarHBondContact CA-O 3.5Å; D144-F204 PolarHBondContact N-O 2.78Å; H145-F204 AromaticContact CD2-CD2 3.66Å; H145-F204 AromaticContact CE1-CG 3.9Å; H145-F204 PolarHBondContact N-O 2.71Å; H145-F204 AromaticContact NE2-CD2 3.44Å; H145-F204 WeakPolarHBondContact NE2-CD2 3.5Å; H145-F204 AromaticContact NE2-CG 3.5Å; H145-F204 WeakPolarHBondContact NE2-CG 3.47Å; H145-F204 PolarHBondContact O-N 2.87Å; R147-F204 HydrophobicContact CB-CE2 4.2Å; W154-F204 HydrophobicContact CH2-CE2 4.43Å; W154-F204 HydrophobicContact CH2-CZ 4.02Å; F204-Q214 HydrophobicContact CD1-CB 3.76Å; F204-Q214 HydrophobicContact CE1-CB 3.87Å; F204-Q214 HydrophobicContact CG-CB 4.43Å
205G91.3Very high87.4Confident4 Ų455 Ų554%0.04131%0.311CS..  trans-84.5-176.4176.600000112.2S207 V213G205-S207 PolarHBondContact O-N 3.45Å; G205-V213 PolarHBondContact N-O 3.07Å
206A85.1Confident87.6Confident59 Ų5957.3 Ų57.349%0.48832%0.315SS..  trans-61130.9172.800000110.6T208A206-T208 PolarHBondContact O-N 3.38Å
207S79.7Confident87.7Confident99 Ų9955.5 Ų55.569%0.69231%0.307SS*.  trans-87.793.1176.858.30000109.9G205G205-S207 PolarHBondContact O-N 3.45Å
208T71.1Confident87.8Confident84 Ų8461.6 Ų61.652%0.51534%0.336SS..  trans-105.1-29.417453.20000112.4T110 A206T110-T208 HydrophobicContact CG2-CG2 4.18Å; T110-T208 WeakPolarHBondContact CG2-OG1 3.33Å; A206-T208 PolarHBondContact O-N 3.38Å
209D66.8Low87.8Confident81 Ų8163.7 Ų63.743%0.43335%0.347SS..SBendtrans-130.6147.1-174.6-54.8-67.3000108.2M211D209-M211 CarbonylContact O-C 3.32Å; D209-M211 VanDerWaalsContact O-C 3.32Å; D209-M211 PolarHBondContact O-N 3.4Å
210E65.5Low87.7Confident213 Ų21363.7 Ų63.7100%0.99535%0.348SS*.SBendtrans-49.1-6.5-164.6-71.3178.2124.200117.2
211M66.1Low87.7Confident161 Ų16163.1 Ų63.179%0.79335%0.347SS*.SBendtrans-111.9103.1169.1-159.669.870.300110.7D209 V213D209-M211 CarbonylContact O-C 3.32Å; D209-M211 VanDerWaalsContact O-C 3.32Å; D209-M211 PolarHBondContact O-N 3.4Å; M211-V213 PolarHBondContact O-N 3.08Å; M211-V213 VanDerWaalsContact O-N 3.08Å
212A73.8Confident87.6Confident46 Ų4663.1 Ų63.138%0.3835%0.347SS..  trans-59.1116.6171.700000109.9Q214A212-Q214 PolarHBondContact O-N 3.05Å
213V88Confident87.4Confident47 Ų4767.4 Ų67.429%0.28536%0.363SS..  trans-68.7108.8178.1-176.90000108.2K112 G205 M211K112-V213 HydrophobicContact CB-CG1 3.93Å; K112-V213 HydrophobicContact CD-CG1 3.81Å; K112-V213 HydrophobicContact CG-CG1 3.58Å; G205-V213 PolarHBondContact N-O 3.07Å; M211-V213 PolarHBondContact O-N 3.08Å; M211-V213 VanDerWaalsContact O-N 3.08Å
214Q92.8Very high87.1Confident98 Ų9869.4 Ų69.446%0.45838%0.375SS..EExtended strand (participates in β ladder)trans-114147.7177.763.8172.654.100111.5A203 F204 A212A203-Q214 CarbonylContact O-C 3.54Å; A203-Q214 VanDerWaalsContact O-CA 3.27Å; A203-Q214 WeakPolarHBondContact O-CA 3.44Å; F204-Q214 HydrophobicContact CD1-CB 3.76Å; F204-Q214 HydrophobicContact CE1-CB 3.87Å; F204-Q214 HydrophobicContact CG-CB 4.43Å; A212-Q214 PolarHBondContact O-N 3.05Å
215V95.6Very high86.7Confident24 Ų2469.6 Ų69.615%0.14538%0.382CS..EExtended strand (participates in β ladder)trans-124.4133.9173.2-171.10000109.7K112 P113 L115 Y202 A203K112-V215 HydrophobicContact CD-CG2 4.41Å; K112-V215 HydrophobicContact CG-CG2 3.98Å; K112-V215 VanDerWaalsContact NZ-CG2 3.35Å; P113-V215 HydrophobicContact CB-CG2 4.15Å; P113-V215 WeakPolarHBondContact O-CG2 3.06Å; L115-V215 HydrophobicContact CD1-CB 4.23Å; L115-V215 HydrophobicContact CD1-CG1 3.53Å; L115-V215 HydrophobicContact CG-CG1 4.4Å; Y202-V215 WeakPolarHBondContact CA-O 3.27Å; A203-V215 PolarHBondContact N-O 2.97Å; A203-V215 PolarHBondContact O-N 3.44Å
216K96.3Very high86.1Confident98 Ų9870.8 Ų70.843%0.42639%0.389SS..EExtended strand (participates in β ladder)trans-105135.3-177.4-177.4-174.1172.1168.40110.1E200 C201 Y202E200-K216 WeakPolarHBondContact OE1-CE 3.09Å; E200-K216 IonicContact OE1-NZ 2.72Å; E200-K216 PolarHBondContact OE1-NZ 2.81Å; E200-K216 WeakPolarHBondContact OE2-CE 3.23Å; E200-K216 IonicContact OE2-NZ 2.66Å; E200-K216 PolarHBondContact OE2-NZ 3.39Å; C201-K216 WeakPolarHBondContact O-CA 3.32Å; Y202-K216 HydrophobicContact CD1-CB 4.17Å; Y202-K216 HydrophobicContact CD1-CG 4.3Å; Y202-K216 HydrophobicContact CE1-CB 3.94Å; Y202-K216 HydrophobicContact CE1-CD 3.93Å; Y202-K216 HydrophobicContact CE1-CG 3.78Å; Y202-K216 HydrophobicContact CE2-CG 4.28Å; Y202-K216 WeakPolarHBondContact OH-CD 3.4Å; Y202-K216 WeakPolarHBondContact OH-CE 3.5Å
217S96.7Very high85.5Confident9 Ų975 Ų756%0.06340%0.396CS..PPolyproline II helixtrans-79.7171.1172.776.60000112.6C201C201-S217 WeakPolarHBondContact CB-OG 3.24Å; C201-S217 PolarHBondContact N-OG 3.31Å; C201-S217 PolarHBondContact O-N 3Å
218Q96.1Very high85.1Confident159 Ų15978 Ų7874%0.74340%0.397SS*.PPolyproline II helixtrans-62.9148160.6-67.6-176-15.600110.3
219P96.4Very high84.9Confident72 Ų7276 Ų7647%0.46839%0.387SS..PPolyproline II helixtrans-70.8131.6176.828.7-33.4000110.5C199 E200C199-P219 WeakPolarHBondContact O-CA 3.28Å; E200-P219 HydrophobicContact CG-CB 3.88Å
220A97.5Very high84.9Confident1 Ų182 Ų821%0.00841%0.409CS..EExtended strand (participates in β ladder)trans-99.5126.2172.500000109.9P119 A198 C199P119-A220 HydrophobicContact CB-CB 3.86Å; P119-A220 HydrophobicContact CG-CB 4.05Å; P119-A220 WeakPolarHBondContact O-CB 3.45Å; A198-A220 CarbonylContact C-O 3.59Å; A198-A220 WeakPolarHBondContact CA-O 3.49Å; C199-A220 PolarHBondContact N-O 2.84Å; C199-A220 PolarHBondContact O-N 3.5Å
221T96.6Very high84.9Confident29 Ų2980.2 Ų80.218%0.17841%0.405CS..EExtended strand (participates in β ladder)trans-93.6136.8178.562.70000111.2D121 A122 Y197 A198D121-T221 WeakPolarHBondContact CA-O 3.38Å; D121-T221 PolarHBondContact OD1-N 2.93Å; D121-T221 PolarHBondContact OD1-OG1 2.64Å; A122-T221 PolarHBondContact N-O 3.07Å; Y197-T221 CarbonylContact O-C 3.54Å; Y197-T221 WeakPolarHBondContact O-CA 3.42Å; A198-T221 HydrophobicContact CB-CG2 4.31Å
222V96.4Very high84.8Confident1 Ų176.2 Ų76.21%0.00639%0.39CS..EExtended strand (participates in β ladder)trans-111.2116.6174.6-170.50000108.6A122 L124 V134 L136 V186 Y197A122-V222 HydrophobicContact CB-CG1 4.44Å; A122-V222 HydrophobicContact CB-CG2 4.35Å; A122-V222 WeakPolarHBondContact O-CA 3.29Å; L124-V222 HydrophobicContact CD1-CG1 3.65Å; L124-V222 HydrophobicContact CG-CG1 4.03Å; V134-V222 HydrophobicContact CG1-CG1 3.8Å; L136-V222 HydrophobicContact CD1-CG2 3.98Å; L136-V222 HydrophobicContact CD2-CG2 4.28Å; L136-V222 HydrophobicContact CG-CG2 4.47Å; V186-V222 HydrophobicContact CG2-CB 4.18Å; V186-V222 HydrophobicContact CG2-CG1 3.85Å; Y197-V222 HydrophobicContact CD1-CB 4.34Å; Y197-V222 HydrophobicContact CD1-CG2 4.35Å; Y197-V222 PolarHBondContact O-N 2.7Å
223R92.9Very high84.1Confident106 Ų10676.3 Ų76.340%0.439%0.387SS..EExtended strand (participates in β ladder)trans-119.4144-176.5-69.8179169.5168.42.4111.3A122 Y123 L124 D196A122-R223 PolarHBondContact O-N 2.72Å; Y123-R223 CarbonylContact C-O 3.53Å; Y123-R223 VanDerWaalsContact CA-O 3.3Å; Y123-R223 WeakPolarHBondContact CA-O 3.18Å; Y123-R223 HydrophobicContact CD1-CB 4.06Å; Y123-R223 HydrophobicContact CE1-CB 4.18Å; L124-R223 PolarHBondContact N-O 3.11Å; D196-R223 IonicContact OD1-NE 2.68Å; D196-R223 IonicContact OD2-CZ 2.71Å; D196-R223 IonicContact OD2-NE 3.78Å; D196-R223 PolarHBondContact OD2-NE 2.9Å; D196-R223 IonicContact OD2-NH2 2.91Å; D196-R223 PolarHBondContact OD2-NH2 2.99Å
224V89.7Confident82.6Confident42 Ų4278.4 Ų78.426%0.25540%0.397SS..EExtended strand (participates in β ladder)trans-83.6122.6171.9-175.50000108.4L124 R126 R183 V186 E187L124-V224 WeakPolarHBondContact O-CA 3.47Å; R126-V224 HydrophobicContact CG-CG1 3.65Å; R126-V224 VanDerWaalsContact NE-CG1 3.29Å; R183-V224 HydrophobicContact CG-CG2 4.37Å; V186-V224 HydrophobicContact CB-CG2 4.46Å; V186-V224 HydrophobicContact CG1-CG2 3.89Å; E187-V224 HydrophobicContact CG-CG2 3.85Å
225A85.9Confident80.8Confident29 Ų2980.7 Ų80.724%0.2441%0.405CS..EExtended strand (participates in β ladder)trans-112.9159176.900000109.8Y123 L124 V125 R126Y123-A225 HydrophobicContact CD1-CB 4.34Å; L124-A225 PolarHBondContact O-N 3.37Å; V125-A225 CarbonylContact C-O 3.54Å; V125-A225 WeakPolarHBondContact CA-O 2.84Å; V125-A225 HydrophobicContact CG2-CB 4.46Å; R126-A225 PolarHBondContact N-O 3.14Å
226C78.7Confident78.6Confident29 Ų2987.1 Ų87.120%0.19644%0.439CS..EExtended strand (participates in β ladder)trans-114.6147.5167.5-500000109.1F228 C233C226-F228 PolarHBondContact O-N 2.92Å; C226-C233 HydrophobicContact CB-CB 3.71Å; C226-C233 WeakPolarHBondContact CB-SG 3.18Å; C226-C233 WeakPolarHBondContact SG-CB 3.41Å; C226-C233 CovalentContact SG-SG 2.04Å; C226-C233 PolarHBondContact SG-SG 3.34Å
227K74.1Confident77.7Confident148 Ų14886.6 Ų86.664%0.64344%0.439SS*.  trans-72.8117.1159.4-173.2173.7179.9173.90108.2V125 S229V125-K227 HydrophobicContact CG1-CB 4.26Å; K227-S229 PolarHBondContact O-N 3.49Å
228F69.9Low76.7Confident162 Ų16290.6 Ų90.671%0.71146%0.459SS*.EExtended strand (participates in β ladder)trans-69.6117.9169-85.3-87.1000108.7C226C226-F228 PolarHBondContact O-N 2.92Å
229S67.8Low75.6Confident42 Ų4286.8 Ų86.829%0.29444%0.443SS..EExtended strand (participates in β ladder)trans-137.7124.4166.5-73.70000107.8K227 L231 T232K227-S229 PolarHBondContact O-N 3.49Å; S229-L231 PolarHBondContact O-N 3.13Å; S229-T232 PolarHBondContact O-N 2.98Å; S229-T232 PolarHBondContact O-OG1 3.31Å
230F66.4Low74.4Confident207 Ų20787.7 Ų87.791%0.90844%0.442SS*.THydrogen-bonded Turntrans40.962.9-176.3-66.5-82.3000113.5T232F230-T232 PolarHBondContact O-N 2.76Å
231L66Low72.9Confident174 Ų17493.1 Ų93.191%0.91147%0.469SS*.THydrogen-bonded Turntrans59.86.1172.3-68.6163.7000117.3S229S229-L231 PolarHBondContact O-N 3.13Å
232T62.7Low71.4Confident78 Ų7897.4 Ų97.448%0.47949%0.488SS..EExtended strand (participates in β ladder)trans-118.5132.6176.754.80000110.8S229 F230 L234S229-T232 PolarHBondContact O-N 2.98Å; S229-T232 PolarHBondContact O-OG1 3.31Å; F230-T232 PolarHBondContact O-N 2.76Å; T232-L234 VanDerWaalsContact C-N 3.3Å; T232-L234 PolarHBondContact O-N 2.9Å
233C60Low69.6Low47 Ų47104.3 Ų104.332%0.31852%0.523SS..EExtended strand (participates in β ladder)trans-64.398.3155.6-100.80000105C226 F235C226-C233 HydrophobicContact CB-CB 3.71Å; C226-C233 WeakPolarHBondContact CB-SG 3.18Å; C226-C233 WeakPolarHBondContact SG-CB 3.41Å; C226-C233 CovalentContact SG-SG 2.04Å; C226-C233 PolarHBondContact SG-SG 3.34Å; C233-F235 HydrophobicContact CB-CE2 4.37Å; C233-F235 WeakPolarHBondContact O-CD2 2.9Å; C233-F235 PolarHBondContact O-N 2.84Å
234L56.4Low67.8Low92 Ų92104.2 Ų104.248%0.48253%0.532SS..  trans-62.4105173.4-92.1154.6000108.5T232 D236T232-L234 VanDerWaalsContact C-N 3.3Å; T232-L234 PolarHBondContact O-N 2.9Å; L234-D236 VanDerWaalsContact C-N 3.33Å; L234-D236 PolarHBondContact O-N 3.01Å
235F55.1Low65.9Low146 Ų146109.3 Ų109.364%0.6456%0.555SS**  trans-77.692.1151.8-63.1-92.3000104.5R126 C233R126-F235 VanDerWaalsContact NH1-CE1 3.33Å; C233-F235 HydrophobicContact CB-CE2 4.37Å; C233-F235 WeakPolarHBondContact O-CD2 2.9Å; C233-F235 PolarHBondContact O-N 2.84Å
236D48.6Very low64.1Low158 Ų158116.6 Ų116.685%0.84558%0.584SS**  trans-73.70161.8-156.6-77.1000107.5R128 L234R128-D236 HydrophobicContact CG-CB 4.3Å; L234-D236 VanDerWaalsContact C-N 3.33Å; L234-D236 PolarHBondContact O-N 3.01Å

Retrieved 236 of 236 residues in 213.1 ms (Link to these results)