A0A087YCK8_POEFO Loading...

GATA binding protein 5

AlphaFold DB , UniProt , Accession A0A087YCK8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 372 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M43.7Very low41.1Very low237 Ų237146.7 Ų146.7100%1.16779%0.788SS**  0940-52.1172.2-161.200104.9
2Y34.9Very low40.8Very low220 Ų220142.3 Ų142.386%0.86378%0.777SS**  49.1105.477.7-92.1-80.3000112.9
3Q47.9Very low41.8Very low159 Ų159140.3 Ų140.374%0.74378%0.776SS**  -156.5136107-156.27164.400109.9
4S43.8Very low41.5Very low106 Ų106143.3 Ų143.374%0.74177%0.771SS**  trans-135.1141.8167.4-54.50000108.3
5L53.5Low42.3Very low150 Ų150141.8 Ų141.879%0.78577%0.772SS**  trans-142.1118.6172.6-64.7173.5000106.2
6A43.8Very low42.4Very low78 Ų78142.4 Ų142.465%0.64577%0.768SS**  71.7111.372.400000111.2
7L41.3Very low42Very low172 Ų172141.4 Ų141.490%0.90176%0.762SS**  64.5134.676.8-65.7167000111.8
8S36.6Very low42.2Very low104 Ų104140.3 Ų140.373%0.72776%0.761SS**  cis-156.2-164.220.2-1600000113.8
9S35.8Very low41.9Very low87 Ų87136.7 Ų136.761%0.60876%0.76SS**  trans-38.6168.8168.8650000117
10N36Very low41.6Very low125 Ų125137.8 Ų137.867%0.66876%0.764SS**  cis-174.2164.447.8-146.8-42.4000115.7
11Q34.4Very low41.6Very low176 Ų176140.6 Ų140.682%0.82277%0.765SS**  trans82.6148145.7-112.2149.695.100124.4
12S38.5Very low41.7Very low94 Ų94137.1 Ų137.166%0.65775%0.749SS**  trans-108.6179.2-173.6-156.40000110.1
13P53.5Low42.1Very low116 Ų116134.7 Ų134.775%0.75375%0.745SS**  -153.2158.772.238.9-17.5000119.3
14Y37.6Very low42.1Very low182 Ų182133 Ų13371%0.71475%0.748SS**  trans7.9167.8139-69-64.1000123.6H16Y14-H16 HydrophobicContact CD1-CB 4.08Å; Y14-H16 AromaticContact CD1-CD2 3.82Å; Y14-H16 AromaticContact CE1-CD2 3.56Å
15P53.3Low41.8Very low121 Ų121133.6 Ų133.679%0.78675%0.752SS**  cis-122.3178.413.543.3-29.4000114.8
16H43.2Very low41.4Very low151 Ų151131.2 Ų131.270%0.69975%0.754SS**  cis98.81137.3-131.3-20.8000119.4Y14Y14-H16 HydrophobicContact CD1-CB 4.08Å; Y14-H16 AromaticContact CD1-CD2 3.82Å; Y14-H16 AromaticContact CE1-CD2 3.56Å
17D36.8Very low41.1Very low126 Ų126133.3 Ų133.367%0.67476%0.764SS**  trans-141.7172.6150.1-140.3-19.8000104.4
18T44.3Very low41.2Very low121 Ų121130.4 Ų130.474%0.74276%0.758SS**  cis68.7144.311.631.90000117
19G37.1Very low41.8Very low72 Ų72131 Ų13174%0.74276%0.759SS**  cis-140.1-162.8-17.900000109.8
20N37.2Very low42.1Very low158 Ų158133 Ų13385%0.84577%0.768SS**  cis-159.2-174.5-3.3-160.4-4.5000109.8
21Y41.2Very low42.4Very low198 Ų198136.9 Ų136.978%0.77678%0.775SS**  trans-71152.6-177.2-86.9-103.7000117.1
22I44.2Very low42.8Very low164 Ų164133.5 Ų133.584%0.84177%0.766SS**  -175145.5121.4-96159.5000111.3
23H43.8Very low42.8Very low168 Ų168134.3 Ų134.378%0.77877%0.769SS**  trans-102.2154.4170.6-87-84000111.6
24P48.3Very low42.3Very low124 Ų124134.4 Ų134.481%0.80577%0.767SS**  -135.6-176.8124.438.1-27.9000114.2
25S38.7Very low42.6Very low118 Ų118132 Ų13283%0.82577%0.772SS**  trans-97.9150.8-156.4-53.50000116.8
26A43.3Very low42.3Very low101 Ų101137.8 Ų137.884%0.83578%0.778SS**  trans32.8109.5140.400000120.5
27S38.7Very low42.2Very low122 Ų122136.9 Ų136.985%0.85378%0.783SS**  trans-150.2155.4132.657.30000110.4
28S42.8Very low42.5Very low110 Ų110136.6 Ų136.677%0.76979%0.788SS**  trans-116.4119-176.3179.80000111
29P49.7Very low42.4Very low116 Ų116135.2 Ų135.275%0.75379%0.788SS**  trans-92.9120.3168.332.9-28.3000111Y31P29-Y31 PolarHBondContact O-N 3.06Å
30V42.5Very low42.9Very low129 Ų129140.8 Ų140.878%0.78280%0.797SS**  trans-69.2115.9173.9175.80000109.8V32V30-V32 PolarHBondContact O-N 3.38Å
31Y40.6Very low43.5Very low208 Ų208140.4 Ų140.482%0.81680%0.795SS**  trans-85.7104.8178.7-164-88.6000111.6P29P29-Y31 PolarHBondContact O-N 3.06Å
32V43.2Very low43.8Very low105 Ų105136.8 Ų136.864%0.63680%0.796SS**  trans-82.5127.2173.1-178.30000109.5V30 T34V30-V32 PolarHBondContact O-N 3.38Å; V32-T34 PolarHBondContact O-N 2.96Å
33P38.8Very low43.8Very low111 Ų111135.5 Ų135.572%0.72180%0.795SS**  trans-75.691179.8-14.830.5000112.4
34T43.3Very low43.7Very low118 Ų118135.1 Ų135.172%0.72480%0.798SS**  trans-62.6146.5170-580000111.1V32 R36V32-T34 PolarHBondContact O-N 2.96Å; T34-R36 PolarHBondContact O-N 2.9Å
35T44.4Very low43.6Very low132 Ų132135.5 Ų135.581%0.8180%0.801SS**  trans-62.7126.7-177.944.70000112
36R45.4Very low44Very low242 Ų242140 Ų14091%0.91380%0.801SS**  trans-98.4114.2178.138.3179.5163.7168.3-4.1111.1T34T34-R36 PolarHBondContact O-N 2.9Å
37V41.5Very low44.1Very low132 Ų132142.1 Ų142.180%0.880%0.798SS**PPolyproline II helixtrans-63.2138173-1660000109.1A39V37-A39 PolarHBondContact O-N 2.86Å
38P43.7Very low44.6Very low119 Ų119145 Ų14577%0.77380%0.797SS**PPolyproline II helixtrans-71.1123.917928.1-34.3000111.3
39A41Very low44.8Very low92 Ų92144.8 Ų144.876%0.7679%0.792SS**PPolyproline II helixtrans-75.5140.8169.700000110.7V37 L41V37-A39 PolarHBondContact O-N 2.86Å; A39-L41 PolarHBondContact O-N 2.84Å
40M47.7Very low44.9Very low189 Ų189142 Ų14293%0.93178%0.775SS**PPolyproline II helixtrans-68.3125173.1-67.9-70.1-171.700110.1
41L51Low44.8Very low151 Ų151143.7 Ų143.779%0.79177%0.774SS**  trans-107.1135.3166.6-71.8173.7000109.2A39A39-L41 PolarHBondContact O-N 2.84Å
42P46.3Very low44.7Very low122 Ų122137.8 Ų137.879%0.79276%0.763SS**PPolyproline II helixtrans-67.9133.6173.628.8-33.5000110.4
43T44.8Very low44.4Very low136 Ų136139.2 Ų139.283%0.83477%0.772SS**PPolyproline II helixtrans-81.3135.8-176.434.60000112.6
44L42.6Very low44.5Very low160 Ų160141.2 Ų141.284%0.83877%0.772SS**PPolyproline II helixtrans-77130.3172.5-66.9172.1000110.7Y46L44-Y46 PolarHBondContact O-N 2.97Å
45P45.7Very low44.1Very low132 Ų132144.3 Ų144.386%0.85778%0.778SS**THydrogen-bonded Turntrans-81.979.8-176.233.3-35.9000112.1
46Y47Very low43.6Very low213 Ų213143.2 Ų143.284%0.83578%0.775SS**THydrogen-bonded Turntrans-136.2-15.1166.8-168.3-107.8000115L44L44-Y46 PolarHBondContact O-N 2.97Å
47L44.5Very low43.1Very low145 Ų145140.5 Ų140.576%0.75977%0.773SS**  trans-99.590.6169.2-65.6-179.1000109.3T49L47-T49 PolarHBondContact O-N 2.99Å
48Q49.7Very low42.7Very low182 Ų182137.6 Ų137.685%0.8577%0.769SS**  trans-72.881171.2-167164.52.300109.3C50Q48-C50 PolarHBondContact O-N 2.92Å
49T46.3Very low42.5Very low106 Ų106140.5 Ų140.565%0.6578%0.778SS**  trans-53.5131.3175.939.30000110.2L47 E51L47-T49 PolarHBondContact O-N 2.99Å; T49-E51 PolarHBondContact O-N 3.21Å
50C52.6Low42.2Very low58 Ų58141.4 Ų141.439%0.39279%0.785SS.*  trans-73.978.9179.456.20000110.7Q48 S52 C229Q48-C50 PolarHBondContact O-N 2.92Å; C50-S52 PolarHBondContact O-N 2.66Å; C50-C229 HydrophobicContact CB-CB 4.23Å
51E39.6Very low41.5Very low164 Ų164135.5 Ų135.577%0.76677%0.772SS**  trans-75.3110.7176.9-164162.914100110.1T49 T53T49-E51 PolarHBondContact O-N 3.21Å; E51-T53 PolarHBondContact O-N 3.35Å
52S39.8Very low41Very low85 Ų85136.3 Ų136.359%0.59477%0.772SS**  trans-79.1100179.1-65.60000110C50 H54C50-S52 PolarHBondContact O-N 2.66Å; S52-H54 VanDerWaalsContact C-N 3.3Å; S52-H54 PolarHBondContact O-N 2.88Å
53T37.3Very low40.5Very low135 Ų135139.1 Ų139.183%0.82877%0.774SS**  trans-64.684175.753.70000112E51E51-T53 PolarHBondContact O-N 3.35Å
54H41.1Very low40.1Very low152 Ų152136.1 Ų136.170%0.70477%0.77SS**  trans-96.2104165-83.3-83.8000109.3S52 S56S52-H54 VanDerWaalsContact C-N 3.3Å; S52-H54 PolarHBondContact O-N 2.88Å; H54-S56 PolarHBondContact O-N 3.08Å
55Q35.1Very low39.5Very low184 Ų184140.5 Ų140.586%0.8678%0.776SS**  trans-68.6120.5163.5-73.3177.4-18.600108.8
56S33.7Very low39.2Very low108 Ų108138.2 Ų138.276%0.75577%0.768SS**  trans-132.9110.7166.757.70000108.5H54 G58H54-S56 PolarHBondContact O-N 3.08Å; S56-G58 PolarHBondContact O-N 2.87Å
57H34.8Very low38.7Very low186 Ų186136.1 Ų136.186%0.86177%0.766SS**  trans-65.5122.2176.5-73.4-98.2000110
58G31.8Very low38.3Very low70 Ų70134.7 Ų134.772%0.72277%0.768SS**  trans-90.6140.2171.400000111.2S56S56-G58 PolarHBondContact O-N 2.87Å
59L40.8Very low37.5Very low181 Ų181130.5 Ų130.595%0.94877%0.765SS**  trans-130144.1160.8-69.8176.2000107.9
60A34.7Very low37Very low110 Ų110129.4 Ų129.491%0.90977%0.766SS**  trans-107.9160.2-172.800000112.2
61G32.6Very low36.2Very low65 Ų65134.7 Ų134.767%0.6779%0.791SS**  trans176.9159.2175.300000115.8
62H40Very low35.9Very low169 Ų169130.7 Ų130.778%0.78279%0.793SS**  trans-139.9174.6179.4-57.4-68.5000108.4
63H35.6Very low35.8Very low180 Ų180131.9 Ų131.983%0.83380%0.801SS**  cis-139.1173.716.1-59.9-104000109.5
64G36.4Very low35.7Very low74 Ų74130.2 Ų130.276%0.76380%0.795SS**  cis111.260.12.100000114.2
65W30Very low35.5Very low252 Ų252133.1 Ų133.196%0.95581%0.806SS**  trans-140.8148.5-177.5-130-25.8000112.4
66A39.4Very low35.6Very low84 Ų84128.5 Ų128.569%0.69480%0.799SS**  trans-159.1145.6173.100000112.3
67Q37.9Very low36.6Very low169 Ų169128.9 Ų128.979%0.7980%0.799SS**  trans-177140.4160-99.8147.5100.600106.8
68S34.7Very low36.4Very low115 Ų115126 Ų12680%0.80480%0.8SS**  74.8139.258.2-54.50000113
69A33.6Very low36.9Very low94 Ų94128.1 Ų128.178%0.77780%0.804SS**  cis-167.7-164.6-12.700000108.8
70A35Very low37.5Very low83 Ų83124.1 Ų124.169%0.68679%0.789SS**  trans72.5153.7166.300000117.9
71D36.1Very low37.7Very low169 Ų169127.1 Ų127.190%0.90478%0.783SS**  cis-164.8168.5-27.3-101.2-35.8000109.5
72G32.8Very low38.7Very low79 Ų79128.8 Ų128.881%0.81478%0.783SS**  trans126.8137162.700000115.6
73S38.6Very low39.1Very low110 Ų110126.8 Ų126.877%0.76978%0.784SS**  trans-141.5154.5-172.967.20000114.6
74S35.8Very low39.5Very low100 Ų100126.9 Ų126.970%0.69979%0.785SS**  trans67.4119.9155.1-53.80000119.5
75F35.1Very low39.8Very low214 Ų214125.5 Ų125.594%0.93977%0.771SS**  -170.2164.4103.6-105-75.5000111
76A39.1Very low40.3Very low86 Ų86122.8 Ų122.871%0.71177%0.766SS**  trans-149.4-175.4-175.300000108.4
77P53.4Low40.2Very low116 Ų116122.7 Ų122.775%0.75376%0.76SS**  cis-136.1175-0.643.1-26.8000115.9
78S31.8Very low40.2Very low126 Ų126125 Ų12588%0.88176%0.763SS**  trans-149.3145.5156.7-85.70000110.5
79S40.9Very low40.1Very low114 Ų114124.1 Ų124.180%0.79776%0.757SS**  trans-125.9172.8-178.9-80.10000109.3
80P54.2Low40.2Very low97 Ų97128.2 Ų128.263%0.6376%0.76SS**  cis-146.9-176.423.142-21000118.8
81H38.2Very low40.5Very low173 Ų173129.8 Ų129.880%0.80177%0.766SS**  trans81.6155.8155.6-62.2-35.4000118.1
82P55Low41.1Very low101 Ų101127.4 Ų127.466%0.65676%0.76SS**  -135173.5-102.228.5-3.2000116.8
83P48.3Very low42.1Very low126 Ų126129.6 Ų129.682%0.81876%0.759SS**  trans-91.4164.9172.937.2-35.5000113.7
84H44Very low42.3Very low182 Ų182131.1 Ų131.184%0.84376%0.764SS**  trans-111.9132.7175.8-79.9-95.5000113.4
85G41.1Very low42.2Very low46 Ų46131.3 Ų131.347%0.47477%0.765SS.*  trans-80.8-168153.600000111.1
86F40.8Very low42.1Very low195 Ų195126.8 Ų126.886%0.85576%0.755SS**  cis-151.6160.713.5-58.5-87.2000108.5
87S37.5Very low41.9Very low81 Ų81130 Ų13057%0.56676%0.76SS**  cis112.8105.67.7-62.70000115.6
88Y37.2Very low41.6Very low217 Ų217130.2 Ų130.285%0.85176%0.762SS**  trans84.4143.6159.1-39.5-58.9000122.2
89S33.1Very low41.6Very low97 Ų97127.3 Ų127.368%0.67875%0.752SS**  trans100.8104.7136.8-68.30000123.1
90H37Very low41.4Very low181 Ų181132.6 Ų132.684%0.83876%0.755SS**  trans64.7150.6132.2-62.1-68000123.2
91S41.5Very low40.4Very low115 Ų115134.3 Ų134.380%0.80476%0.758SS**  trans-87.1156.5-178.1-41.70000113.7
92P47.8Very low40.2Very low119 Ų119129.7 Ų129.777%0.77376%0.758SS**  trans-132.2-158.114746.8-34000110.5
93P52.6Low39Very low125 Ų125128.3 Ų128.381%0.81276%0.762SS**  -133.4-168.2-117.534-8.5000115.6
94V43.8Very low38.3Very low143 Ų143132.7 Ų132.787%0.86776%0.763SS**  trans-78132.7173.71690000112.2
95S33.1Very low37.9Very low103 Ų103132.4 Ų132.472%0.7276%0.762SS**  trans-165.2131.6140-153.60000114.8
96T33Very low37.4Very low120 Ų120135.2 Ų135.274%0.73678%0.775SS**  trans34.3123.9134.6-35.30000122.6
97N35.1Very low37.1Very low152 Ų152132.9 Ų132.981%0.81377%0.767SS**  trans4.2152.5143.6-80.5-3000120.9
98P48.3Very low37.2Very low121 Ų121138.8 Ų138.879%0.78678%0.778SS**  cis-149.5158.336.940.9-20.9000120.3
99G30.9Very low37Very low66 Ų66132.2 Ų132.268%0.6878%0.776SS**  81.8139.7120.200000123.1
100R36.7Very low37Very low225 Ų225131 Ų13185%0.84978%0.778SS**  trans73.3146.2154.5-54.1-173.590.21467.5117.2
101D33Very low36.9Very low132 Ų132127 Ų12771%0.70678%0.777SS**  cis-153.1160.9-10.5-112.8-21.2000110.4
102G34.9Very low36.8Very low77 Ų77129.3 Ų129.379%0.79478%0.779SS**  trans123.8116.9166.100000116
103G30.4Very low36.4Very low71 Ų71129.8 Ų129.873%0.73278%0.78SS**  cis155.560.8-8.900000116.1
104Y33.6Very low35.4Very low218 Ų218134.8 Ų134.886%0.85578%0.783SS**  trans-159140.6164.939.3-95.9000109.8
105Q33.8Very low35.1Very low176 Ų176133.4 Ų133.482%0.82278%0.779SS**  cis176.5113.5-19.7162.8176.1-21.300104.2
106S31.9Very low35.2Very low105 Ų105135.2 Ų135.273%0.73479%0.785SS**  trans57.6148.5166.2-70.60000118.5
107Q34.4Very low35.1Very low147 Ų147133.3 Ų133.369%0.68779%0.79SS**  cis-154.4168.86-127.3168.6-10.900106.8
108Y38.9Very low34.7Very low205 Ų205129.9 Ų129.980%0.80479%0.79SS**  cis-134.8-162.113.5-54-96.8000110.7
109G32.4Very low34.1Very low78 Ų78129.9 Ų129.980%0.80479%0.793SS**  trans-118.1-177.5165.600000112
110G34.9Very low34.3Very low71 Ų71137 Ų13773%0.73280%0.801SS**  cis156.8159.2-5.100000113.6
111A34.8Very low34.2Very low97 Ų97131.7 Ų131.780%0.80280%0.798SS**  trans64.3160.5178.800000114.8
112L39.2Very low34.5Very low164 Ų164130.3 Ų130.386%0.85980%0.799SS**  cis-138.9171.610.8-68160.7000107.5
113V38.3Very low35.2Very low130 Ų130131.8 Ų131.879%0.78880%0.795SS**  cis-160.4173.8-10122.20000108.5
114R32.4Very low35.4Very low230 Ų230139.3 Ų139.387%0.86880%0.803SS**  trans-92.2152.6172.8-74.5175163-178.9-5.4113.8
115S36.3Very low35.6Very low113 Ų113134.2 Ų134.279%0.7981%0.805SS**  172.1133.6126.2-77.60000110
116V35.6Very low35.8Very low141 Ų141135.3 Ų135.386%0.85580%0.803SS**  76.7116.862176.90000114.2
117G30.8Very low36Very low81 Ų81138.1 Ų138.184%0.83581%0.807SS**  trans104.7131.5153.300000117.7
118G27.9Very low36.2Very low79 Ų79136.1 Ų136.181%0.81481%0.809SS**  trans158.8121170.700000112.2
119S35.5Very low36.8Very low121 Ų121131.9 Ų131.985%0.84681%0.807SS**  trans-134.4146.1-164.7-61.10000114.5
120Y34.8Very low36.9Very low217 Ų217137.5 Ų137.585%0.85181%0.812SS**  trans62.7118.8145-144.1-95.5000120.1
121S33.4Very low37.4Very low113 Ų113142.9 Ų142.979%0.7982%0.821SS**  -172.5144.9117.3-81.40000112.7
122S41Very low37.8Very low103 Ų103143 Ų14372%0.7282%0.821SS**  trans-151135.8164.7173.70000108.4
123P49.9Very low37.7Very low108 Ų108141.4 Ų141.470%0.70182%0.818SS**  trans-139138.9143.233.5-18.6000114
124Y33.4Very low37.4Very low229 Ų229140.6 Ų140.690%0.89882%0.818SS**  trans28.9112.8149.9-66.2-86.8000120.2
125A37.1Very low37.5Very low110 Ų110134.9 Ų134.991%0.90981%0.814SS**  trans-126.9135141.800000108.8
126Y38.3Very low37.7Very low199 Ų199141.6 Ų141.678%0.7882%0.822SS**  trans-112.6126.7-170.2164.1-82.5000110.1
127M37.7Very low37.9Very low164 Ų164141.3 Ų141.381%0.80882%0.821SS**  trans-164.2154.5146.7-138.263.476.300110.4
128S37.5Very low38.5Very low106 Ų106143.2 Ų143.274%0.74182%0.819SS**  trans-120.9177.2-179.6-112.60000111.3
129P52.5Low38.9Very low116 Ų116142.7 Ų142.775%0.75381%0.813SS**  trans-102.8140.1-152.637.2-33.7000115
130E34.1Very low39.5Very low195 Ų195143.3 Ų143.391%0.91181%0.814SS**  trans-152.3168164.5-127.2175.8139.700114.1
131M45.1Very low39.5Very low185 Ų185142.7 Ų142.791%0.91182%0.816SS**  trans51.684.5-175.371.5168.7-166.900118.3
132A42.6Very low39.9Very low98 Ų98145.9 Ų145.981%0.8182%0.819SS**  trans-102.6101.2147.500000109.7
133T36.8Very low39.5Very low131 Ų131146.9 Ų146.980%0.80483%0.826SS**  trans-175.998.2156.330.90000113.8
134S33.5Very low38.8Very low113 Ų113145.1 Ų145.179%0.7983%0.827SS**  trans-175.493147.845.90000108.5
135S34.4Very low39.4Very low110 Ų110141 Ų14177%0.76983%0.825SS**  65.4116.771.4-57.30000112.8
136W40Very low39.7Very low254 Ų254143.7 Ų143.796%0.96282%0.823SS**PPolyproline II helixtrans-74.5151.4-177-70.359.8000111.8P138W136-P138 WeakPolarHBondContact O-CD 3.47Å
137T39Very low39.7Very low136 Ų136139.1 Ų139.183%0.83482%0.82SS**PPolyproline II helixtrans-82.3133.917441.60000112.7
138P43.5Very low39.8Very low121 Ų121138.9 Ų138.979%0.78682%0.821SS**PPolyproline II helixtrans-101160.3146.7-626.6000110.8W136W136-P138 WeakPolarHBondContact O-CD 3.47Å
139G36.8Very low40Very low67 Ų67142 Ų14269%0.69182%0.824SS**PPolyproline II helixtrans-76.4169.4178.500000114.5
140P49.3Very low39.1Very low135 Ų135140.4 Ų140.488%0.87783%0.829SS**PPolyproline II helixtrans-87.5143.3-170.434.1-35.3000114.3
141F34.6Very low39.4Very low204 Ų204141.1 Ų141.190%0.89582%0.823SS**  trans-143.9154.2140.964-93.5000108.9
142E40.3Very low39.2Very low180 Ų180139.9 Ų139.984%0.84182%0.815SS**  trans-73.9145.5-175.1-63.4-178.890.800112.9
143S33.4Very low38.8Very low124 Ų124139.1 Ų139.187%0.86782%0.817SS**  157.2162.897.6-164.30000111.9
144G34.5Very low39.2Very low71 Ų71137.4 Ų137.473%0.73282%0.816SS**  trans99.793.1166.200000116.1
145V47.1Very low39.7Very low142 Ų142140.8 Ų140.886%0.86182%0.824SS**  trans-71.4143.1158.9-65.90000110.6
146I42.6Very low40Very low167 Ų167139.5 Ų139.586%0.85683%0.828SS**  -158.7144.6119.5-57.7-161.2000107.1
147S39.6Very low39.8Very low102 Ų102131 Ų13171%0.71382%0.819SS**  trans-132.1140.9167.2176.60000109.9
148L38.2Very low40.2Very low160 Ų160136 Ų13684%0.83882%0.823SS**  trans-170.8152.2154.2-109.5161.3000113.5
149Q43.3Very low40.1Very low171 Ų171141.5 Ų141.580%0.79983%0.828SS**  trans-73.8154.6-175.1-81.377.8-800115.1
150G32.6Very low40.9Very low83 Ų83145 Ų14586%0.85684%0.841SS**  trans-143.6138.2157.900000110
151R40.9Very low40.8Very low209 Ų209143.6 Ų143.679%0.78984%0.835SS**  trans-130.4137.4-164.3-158.7-163.2-169.1-145.116.9112.6
152Q39.9Very low41.2Very low160 Ų160141 Ų14175%0.74883%0.83SS**  trans63.2148157.5-82.3165.6-29.300119.7
153G34.2Very low41.7Very low82 Ų82141.5 Ų141.585%0.84583%0.832SS**  trans155.293.8170.300000112.3
154A45.3Very low42.6Very low95 Ų95143.8 Ų143.879%0.78583%0.833SS**  trans-114.5135.217800000111.2
155L43.7Very low43.5Very low184 Ų184148.5 Ų148.596%0.96384%0.838SS**  trans-151.9139.7149.8-77.8-171.1000108.9
156G41.3Very low43.2Very low83 Ų83148.9 Ų148.986%0.85684%0.836SS**  trans-106.7138.2172.300000111.1
157G35.3Very low43.6Very low74 Ų74148.3 Ų148.376%0.76383%0.834SS**  trans-174.469.5-173.300000116.7
158R47.2Very low43.8Very low243 Ų243150.1 Ų150.192%0.91783%0.833SS**  trans38.8112157.1-62-179.1176.7-168.8-1.2118.7
159R41.9Very low44.5Very low236 Ų236147.2 Ų147.289%0.89182%0.824SS**  trans-161100.3135.4-111.3160.4-165.4-79.8-1.4112.6S161R159-S161 VanDerWaalsContact C-N 3.33Å; R159-S161 PolarHBondContact O-N 2.83Å
160S52.9Low45Very low139 Ų139143.8 Ų143.897%0.97282%0.815SS**  trans-77.183.1167-55.50000109.7
161S47.1Very low46.3Very low106 Ų106146.5 Ų146.574%0.74181%0.805SS**  trans-162.565.3171.3-161.40000110.3R159R159-S161 VanDerWaalsContact C-N 3.33Å; R159-S161 PolarHBondContact O-N 2.83Å
162L44.5Very low47.9Very low151 Ų151139.9 Ų139.979%0.79180%0.802SS**  trans-150.940.8170.4-136.2176.1000111.7M165L162-M165 HydrophobicContact CD2-CG 4.5Å
163E49.6Very low50.1Low190 Ų190137.2 Ų137.289%0.88879%0.785SS**  trans-89.4162.2147.7-75.6-140.2126.800108.7
164L53.2Low52.9Low171 Ų171136.3 Ų136.390%0.89576%0.759SS**SBendtrans73.550.5174.6-155.777.3000117
165M53Low55.2Low170 Ų170131.8 Ų131.884%0.83772%0.722SS**  trans-158.544.6146.147.6-178.859.100114.7L162L162-M165 HydrophobicContact CD2-CG 4.5Å
166D41.5Very low57.5Low151 Ų151127 Ų12781%0.80770%0.699SS**  trans-112.956162.1-166.2-126.1000110.6M168D166-M168 VanDerWaalsContact C-N 3.32Å; D166-M168 PolarHBondContact O-N 3.43Å
167D49.9Very low59.8Low155 Ų155124.4 Ų124.483%0.82967%0.666SS**  trans-94.566.6168.2-163.8-123.4000109.5
168M44.8Very low62.3Low140 Ų140122.1 Ų122.169%0.6964%0.638SS**SBendtrans-126.1153.9175.4-85.7-70.2-79.600109.7D166 T170D166-M168 VanDerWaalsContact C-N 3.32Å; D166-M168 PolarHBondContact O-N 3.43Å; M168-T170 PolarHBondContact O-N 3.4Å
169P51.6Low64.3Low98 Ų98111.3 Ų111.364%0.63660%0.602SS**SBend-75.988.2-12524.5-36.4000115.7E171P169-E171 VanDerWaalsContact C-N 3.28Å
170T54.7Low66.6Low100 Ų100102.2 Ų102.261%0.61358%0.575SS**  trans-73.9-21.7158.248.30000112.6M168 G172 R173M168-T170 PolarHBondContact O-N 3.4Å; T170-G172 PolarHBondContact O-N 2.84Å; T170-R173 PolarHBondContact O-N 3.22Å
171E59.6Low68.4Low140 Ų14099.3 Ų99.365%0.65455%0.551SS**THydrogen-bonded Turntrans-47.3-18.1179.9-175.458.5-163.400116.2P169 R224P169-E171 VanDerWaalsContact C-N 3.28Å; E171-R224 IonicContact OE1-NH2 2.87Å
172G73.6Confident70.4Confident70 Ų7098.4 Ų98.472%0.72255%0.545SS*.THydrogen-bonded Turntrans-86.2-9.5-178.600000116.9T170T170-G172 PolarHBondContact O-N 2.84Å
173R87.4Confident72.7Confident104 Ų10492.8 Ų92.839%0.39252%0.517SS..  trans-109.2107.6-173.9-82.4173.4-79.7-156.8-5.6112.3T170 W186 Y194T170-R173 PolarHBondContact O-N 3.22Å; R173-W186 HydrophobicContact CB-CH2 4.13Å; R173-W186 HydrophobicContact CB-CZ2 3.72Å; R173-W186 VanDerWaalsContact O-CH2 3.23Å; R173-W186 WeakPolarHBondContact O-CH2 3.25Å; R173-W186 WeakPolarHBondContact O-CZ2 3.28Å; R173-Y194 HydrophobicContact CG-CD1 4.2Å; R173-Y194 HydrophobicContact CG-CD2 4.3Å; R173-Y194 HydrophobicContact CG-CE1 4.12Å; R173-Y194 HydrophobicContact CG-CE2 4.23Å; R173-Y194 HydrophobicContact CG-CG 4.3Å
174E92.4Very high74.6Confident63 Ų6389.8 Ų89.829%0.29451%0.514SS..  trans-111.2149.8166.972.2164.3151.800112.4V176 G179 V181 Q220E174-V176 PolarHBondContact O-N 2.87Å; E174-G179 WeakPolarHBondContact OE2-CA 3.45Å; E174-V181 HydrophobicContact CB-CG1 4.37Å; E174-Q220 VanDerWaalsContact CD-NE2 3.32Å; E174-Q220 PolarHBondContact OE2-NE2 3.27Å; E174-Q220 PolarHBondContact OE2-OE1 2.96Å
175C93.1Very high76.5Confident0 Ų085.7 Ų85.70%049%0.492CS..  trans-73.2117.6171.5173.70000111.2N177 C178 G179 S180 W186 Y194 C196C175-N177 PolarHBondContact O-N 3.43Å; C175-C178 PolarHBondContact O-N 3.32Å; C175-G179 WeakPolarHBondContact O-CA 3.34Å; C175-G179 PolarHBondContact O-N 3.25Å; C175-S180 PolarHBondContact N-O 2.87Å; C175-W186 HydrophobicContact CB-CZ3 4.19Å; C175-Y194 WeakPolarHBondContact CA-O 3.28Å; C175-C196 HydrophobicContact CB-CB 3.84Å; C175-C196 PolarHBondContact SG-N 2.74Å; C175-C196 VanDerWaalsContact SG-SG 3.61Å
176V91.8Very high78.4Confident82 Ų8281 Ų8150%0.49747%0.465SS..THydrogen-bonded Turntrans-60.9-19.9-175-60.80000115.2E174 H193 Y194 L195E174-V176 PolarHBondContact O-N 2.87Å; V176-H193 HydrophobicContact CG1-CB 3.96Å; V176-H193 HydrophobicContact CG2-CB 3.8Å; V176-Y194 PolarHBondContact N-O 2.69Å; V176-L195 HydrophobicContact CG2-CD2 3.68Å; V176-L195 HydrophobicContact CG2-CG 4.48Å
177N90.1Very high81Confident30 Ų3078 Ų7816%0.1644%0.443CS..THydrogen-bonded Turntrans-97-14.8177.7-174.764000114.4C175 L195 C199 N209 R210C175-N177 PolarHBondContact O-N 3.43Å; N177-L195 HydrophobicContact CB-CD2 4.01Å; N177-C199 HydrophobicContact CB-CB 4.32Å; N177-C199 PolarHBondContact ND2-SG 2.85Å; N177-N209 WeakPolarHBondContact OD1-CB 3.23Å; N177-N209 PolarHBondContact OD1-OD1 3.47Å; N177-R210 WeakPolarHBondContact ND2-CB 3.2Å; N177-R210 PolarHBondContact ND2-N 3Å; N177-R210 PolarHBondContact ND2-O 3.06Å
178C89.2Confident83.1Confident25 Ų2577.8 Ų77.817%0.16943%0.43CS..THydrogen-bonded Turntrans-1471.8-176.284.40000116.7C175 S180 L212 Q216C175-C178 PolarHBondContact O-N 3.32Å; C178-S180 PolarHBondContact O-N 3.02Å; C178-L212 HydrophobicContact CB-CD1 3.89Å; C178-L212 HydrophobicContact CB-CD2 3.83Å; C178-L212 HydrophobicContact CB-CG 4.39Å; C178-Q216 PolarHBondContact O-NE2 3.5Å
179G88.9Confident85.1Confident16 Ų1673.1 Ų73.117%0.16541%0.408CS..  trans55.920.1178.900000115.7E174 C175 V181 Q216E174-G179 WeakPolarHBondContact OE2-CA 3.45Å; C175-G179 WeakPolarHBondContact O-CA 3.34Å; C175-G179 PolarHBondContact O-N 3.25Å; G179-V181 PolarHBondContact O-N 2.93Å; G179-Q216 VanDerWaalsContact N-NE2 3.14Å
180S89.9Confident86.8Confident45 Ų4572.8 Ų72.832%0.31542%0.423SS..  trans-67.7120.2171.4-155.50000107.8C175 C178 S182 W186C175-S180 PolarHBondContact N-O 2.87Å; C178-S180 PolarHBondContact O-N 3.02Å; S180-S182 WeakPolarHBondContact CB-O 3.47Å; S180-S182 PolarHBondContact OG-O 3.16Å; S180-W186 WeakPolarHBondContact O-CH2 3.42Å
181V91.3Very high88.5Confident79 Ų7973.1 Ų73.148%0.47943%0.425SS..SBendtrans-83.9-23.2174.7-64.70000112.1E174 G179 W186E174-V181 HydrophobicContact CB-CG1 4.37Å; G179-V181 PolarHBondContact O-N 2.93Å; V181-W186 WeakPolarHBondContact O-CZ2 3.41Å
182S89.4Confident89.9Confident86 Ų8668 Ų6860%0.60141%0.41SS*.  trans-108.2147.2170.460.20000111.3S180S180-S182 WeakPolarHBondContact CB-O 3.47Å; S180-S182 PolarHBondContact OG-O 3.16Å
183T91.3Very high90.8Very high33 Ų3369.1 Ų69.120%0.20240%0.396CS..  trans-164.6145172.4-1710000110L185 W186 C196 N197T183-L185 PolarHBondContact O-N 3.49Å; T183-L185 PolarHBondContact OG1-O 2.89Å; T183-W186 HydrophobicContact CG2-CD2 3.46Å; T183-W186 VanDerWaalsContact CG2-CD2 3.46Å; T183-W186 VanDerWaalsContact CG2-CE2 3.48Å; T183-W186 HydrophobicContact CG2-CE3 3.85Å; T183-W186 HydrophobicContact CG2-CG 3.83Å; T183-W186 HydrophobicContact CG2-CH2 4.22Å; T183-W186 HydrophobicContact CG2-CZ2 3.87Å; T183-W186 HydrophobicContact CG2-CZ3 4.21Å; T183-C196 HydrophobicContact CG2-CB 4.16Å; T183-C196 WeakPolarHBondContact OG1-CB 3.38Å; T183-N197 PolarHBondContact OG1-N 3.39Å
184P90.5Very high91.1Very high127 Ų12767.9 Ų67.983%0.82539%0.392SS*.SBendtrans-69.3-14.6177.927.1-36.5000114.1
185L92.3Very high91.1Very high86 Ų8665.2 Ų65.245%0.4538%0.379SS..SBendtrans-154.6122.9171.5178.862000110.4T183 N197T183-L185 PolarHBondContact O-N 3.49Å; T183-L185 PolarHBondContact OG1-O 2.89Å; L185-N197 HydrophobicContact CB-CB 4.1Å; L185-N197 WeakPolarHBondContact O-CA 3.33Å; L185-N197 WeakPolarHBondContact O-CB 3.36Å; L185-N197 PolarHBondContact O-N 3.46Å
186W94.2Very high91.2Very high72 Ų7265.5 Ų65.527%0.27338%0.381SS..EExtended strand (participates in β ladder)trans-76.1133.1168.8-75.3109.2000110.6R173 C175 S180 V181 T183R173-W186 HydrophobicContact CB-CH2 4.13Å; R173-W186 HydrophobicContact CB-CZ2 3.72Å; R173-W186 VanDerWaalsContact O-CH2 3.23Å; R173-W186 WeakPolarHBondContact O-CH2 3.25Å; R173-W186 WeakPolarHBondContact O-CZ2 3.28Å; C175-W186 HydrophobicContact CB-CZ3 4.19Å; S180-W186 WeakPolarHBondContact O-CH2 3.42Å; V181-W186 WeakPolarHBondContact O-CZ2 3.41Å; T183-W186 HydrophobicContact CG2-CD2 3.46Å; T183-W186 VanDerWaalsContact CG2-CD2 3.46Å; T183-W186 VanDerWaalsContact CG2-CE2 3.48Å; T183-W186 HydrophobicContact CG2-CE3 3.85Å; T183-W186 HydrophobicContact CG2-CG 3.83Å; T183-W186 HydrophobicContact CG2-CH2 4.22Å; T183-W186 HydrophobicContact CG2-CZ2 3.87Å; T183-W186 HydrophobicContact CG2-CZ3 4.21Å
187R94.1Very high91.4Very high88 Ų8863.5 Ų63.533%0.33237%0.368SS..EExtended strand (participates in β ladder)trans-116.9158.4172.3-63.8-177.4178.9-80.2-2.7109.1L195 N197R187-L195 HydrophobicContact CB-CB 4.45Å; R187-L195 PolarHBondContact N-O 3.45Å; R187-L195 PolarHBondContact O-N 2.96Å; R187-N197 VanDerWaalsContact CZ-OD1 3.28Å; R187-N197 PolarHBondContact NE-OD1 3.11Å; R187-N197 PolarHBondContact NH2-OD1 2.93Å
188R94.2Very high91.5Very high149 Ų14964.1 Ų64.156%0.56238%0.378SS*.EExtended strand (participates in β ladder)trans-111.6149.3166.1-64.8-174.6-174.5-81.21.6109.9G192 H193 Y194R188-G192 PolarHBondContact NH1-O 3.2Å; R188-H193 VanDerWaalsContact CA-O 3.28Å; R188-H193 WeakPolarHBondContact CA-O 3.33Å; R188-Y194 VanDerWaalsContact CZ-CE1 3.49Å; R188-Y194 VanDerWaalsContact NH1-CE1 3.27Å; R188-Y194 PolarHBondContact NH1-OH 3.05Å; R188-Y194 PolarHBondContact NH2-OH 3.03Å
189D87.5Confident91.7Very high42 Ų4263 Ų6323%0.22537%0.37CS..  trans-82.8174.1160.567.821.8000111.2T191 G192 H193 L195D189-T191 PolarHBondContact O-N 3.5Å; D189-T191 VanDerWaalsContact O-N 3.08Å; D189-T191 VanDerWaalsContact OD1-CA 3.25Å; D189-T191 WeakPolarHBondContact OD1-CA 3.36Å; D189-T191 WeakPolarHBondContact OD1-CB 3.42Å; D189-T191 PolarHBondContact OD1-N 2.99Å; D189-T191 PolarHBondContact OD1-OG1 3.44Å; D189-T191 PolarHBondContact OD2-OG1 3.5Å; D189-G192 PolarHBondContact O-N 2.93Å; D189-G192 PolarHBondContact OD1-N 3.03Å; D189-H193 PolarHBondContact N-O 3.05Å; D189-H193 IonicContact OD1-CG 3.24Å; D189-H193 PolarHBondContact OD1-N 3.05Å; D189-H193 IonicContact OD1-ND1 3.87Å; D189-H193 PolarHBondContact OD1-ND1 3.27Å; D189-H193 WeakPolarHBondContact OD2-CB 3.45Å; D189-H193 IonicContact OD2-CG 3.86Å; D189-H193 IonicContact OD2-ND1 3.35Å; D189-H193 PolarHBondContact OD2-ND1 2.76Å; D189-L195 HydrophobicContact CB-CD1 4.1Å
190G87Confident91.9Very high92 Ų9262.8 Ų62.895%0.94837%0.367SS*.THydrogen-bonded Turntrans-66.4-3.217700000114.8
191T89.9Confident92Very high107 Ų10764.6 Ų64.666%0.65637%0.373SS*.THydrogen-bonded Turntrans-108.97.317343.40000112.5D189 H193D189-T191 PolarHBondContact O-N 3.5Å; D189-T191 VanDerWaalsContact O-N 3.08Å; D189-T191 VanDerWaalsContact OD1-CA 3.25Å; D189-T191 WeakPolarHBondContact OD1-CA 3.36Å; D189-T191 WeakPolarHBondContact OD1-CB 3.42Å; D189-T191 PolarHBondContact OD1-N 2.99Å; D189-T191 PolarHBondContact OD1-OG1 3.44Å; D189-T191 PolarHBondContact OD2-OG1 3.5Å; T191-H193 PolarHBondContact OG1-CE1 3.28Å; T191-H193 VanDerWaalsContact OG1-CE1 3.32Å; T191-H193 PolarHBondContact OG1-ND1 3.47Å
192G89.2Confident92.1Very high33 Ų3363.7 Ų63.734%0.3436%0.362SS..  trans87.3-6.7174.100000116.3R188 D189R188-G192 PolarHBondContact NH1-O 3.2Å; D189-G192 PolarHBondContact O-N 2.93Å; D189-G192 PolarHBondContact OD1-N 3.03Å
193H92.6Very high92.1Very high93 Ų9363 Ų6343%0.43135%0.349SS..  trans-66.2145.3-176.1-54.8107.5000112.3V176 R188 D189 T191V176-H193 HydrophobicContact CG1-CB 3.96Å; V176-H193 HydrophobicContact CG2-CB 3.8Å; R188-H193 VanDerWaalsContact CA-O 3.28Å; R188-H193 WeakPolarHBondContact CA-O 3.33Å; D189-H193 PolarHBondContact N-O 3.05Å; D189-H193 IonicContact OD1-CG 3.24Å; D189-H193 PolarHBondContact OD1-N 3.05Å; D189-H193 IonicContact OD1-ND1 3.87Å; D189-H193 PolarHBondContact OD1-ND1 3.27Å; D189-H193 WeakPolarHBondContact OD2-CB 3.45Å; D189-H193 IonicContact OD2-CG 3.86Å; D189-H193 IonicContact OD2-ND1 3.35Å; D189-H193 PolarHBondContact OD2-ND1 2.76Å; T191-H193 PolarHBondContact OG1-CE1 3.28Å; T191-H193 VanDerWaalsContact OG1-CE1 3.32Å; T191-H193 PolarHBondContact OG1-ND1 3.47Å
194Y94.2Very high92.1Very high77 Ų7770.1 Ų70.130%0.30238%0.377SS..EExtended strand (participates in β ladder)trans-73.7127.3175.7-62.8-76.5000111.7R173 C175 V176 R188R173-Y194 HydrophobicContact CG-CD1 4.2Å; R173-Y194 HydrophobicContact CG-CD2 4.3Å; R173-Y194 HydrophobicContact CG-CE1 4.12Å; R173-Y194 HydrophobicContact CG-CE2 4.23Å; R173-Y194 HydrophobicContact CG-CG 4.3Å; C175-Y194 WeakPolarHBondContact CA-O 3.28Å; V176-Y194 PolarHBondContact N-O 2.69Å; R188-Y194 VanDerWaalsContact CZ-CE1 3.49Å; R188-Y194 VanDerWaalsContact NH1-CE1 3.27Å; R188-Y194 PolarHBondContact NH1-OH 3.05Å; R188-Y194 PolarHBondContact NH2-OH 3.03Å
195L93.6Very high91.9Very high7 Ų771.1 Ų71.14%0.03737%0.372CS..EExtended strand (participates in β ladder)trans-124.5138.7172.4-68.6174.6000109.8V176 N177 R187 D189 C199V176-L195 HydrophobicContact CG2-CD2 3.68Å; V176-L195 HydrophobicContact CG2-CG 4.48Å; N177-L195 HydrophobicContact CB-CD2 4.01Å; R187-L195 HydrophobicContact CB-CB 4.45Å; R187-L195 PolarHBondContact N-O 3.45Å; R187-L195 PolarHBondContact O-N 2.96Å; D189-L195 HydrophobicContact CB-CD1 4.1Å; L195-C199 HydrophobicContact CD2-CB 4.26Å
196C95.1Very high91.8Very high6 Ų670.4 Ų70.44%0.04137%0.369CS..EExtended strand (participates in β ladder)trans-68155.9168.7720000110.5C175 T183 A198 C199 G200C175-C196 HydrophobicContact CB-CB 3.84Å; C175-C196 PolarHBondContact SG-N 2.74Å; C175-C196 VanDerWaalsContact SG-SG 3.61Å; T183-C196 HydrophobicContact CG2-CB 4.16Å; T183-C196 WeakPolarHBondContact OG1-CB 3.38Å; C196-A198 PolarHBondContact O-N 3Å; C196-A198 VanDerWaalsContact O-N 3.11Å; C196-C199 PolarHBondContact O-N 3.04Å; C196-G200 PolarHBondContact O-N 3.27Å
197N95.1Very high91.5Very high40 Ų4069.7 Ų69.721%0.21438%0.384CS..Hα-helixtrans-48.2-46.9-175.9-168.723.2000112.4T183 L185 R187 C199 G200 L201T183-N197 PolarHBondContact OG1-N 3.39Å; L185-N197 HydrophobicContact CB-CB 4.1Å; L185-N197 WeakPolarHBondContact O-CA 3.33Å; L185-N197 WeakPolarHBondContact O-CB 3.36Å; L185-N197 PolarHBondContact O-N 3.46Å; R187-N197 VanDerWaalsContact CZ-OD1 3.28Å; R187-N197 PolarHBondContact NE-OD1 3.11Å; R187-N197 PolarHBondContact NH2-OD1 2.93Å; N197-C199 PolarHBondContact O-N 3.29Å; N197-G200 PolarHBondContact O-N 3.09Å; N197-L201 WeakPolarHBondContact O-CB 3.49Å; N197-L201 VanDerWaalsContact O-CG 3.28Å; N197-L201 WeakPolarHBondContact O-CG 3.33Å; N197-L201 PolarHBondContact O-N 3.19Å; N197-L201 WeakPolarHBondContact OD1-CD1 3.37Å
198A92.5Very high91.2Very high44 Ų4469.1 Ų69.136%0.36439%0.387SS..Hα-helixtrans-67.3-33.6-179.400000114.3C196 Y202C196-A198 PolarHBondContact O-N 3Å; C196-A198 VanDerWaalsContact O-N 3.11Å; A198-Y202 VanDerWaalsContact O-CB 3.31Å; A198-Y202 WeakPolarHBondContact O-CB 3.38Å; A198-Y202 PolarHBondContact O-N 3.22Å
199C93.3Very high90.7Very high1 Ų166.6 Ų66.61%0.00738%0.384CS..Hα-helixtrans-79.3-39.4176.2-710000111.7N177 L195 C196 N197 Y202 H203N177-C199 HydrophobicContact CB-CB 4.32Å; N177-C199 PolarHBondContact ND2-SG 2.85Å; L195-C199 HydrophobicContact CD2-CB 4.26Å; C196-C199 PolarHBondContact O-N 3.04Å; N197-C199 PolarHBondContact O-N 3.29Å; C199-Y202 PolarHBondContact O-N 3.24Å; C199-H203 WeakPolarHBondContact O-CB 3.38Å; C199-H203 PolarHBondContact O-N 3.33Å
200G93.5Very high90.7Very high11 Ų1169.9 Ų69.911%0.11339%0.393CS..Hα-helixtrans-67-38.7176.500000113C196 N197 K204C196-G200 PolarHBondContact O-N 3.27Å; N197-G200 PolarHBondContact O-N 3.09Å; G200-K204 WeakPolarHBondContact O-CB 3.49Å; G200-K204 PolarHBondContact O-N 3.37Å
201L91.9Very high90.4Very high84 Ų8469.4 Ų69.444%0.4437%0.374SS..Hα-helixtrans-64.4-47.2172.6-75170.3000111.8N197 H203 K204 M205N197-L201 WeakPolarHBondContact O-CB 3.49Å; N197-L201 VanDerWaalsContact O-CG 3.28Å; N197-L201 WeakPolarHBondContact O-CG 3.33Å; N197-L201 PolarHBondContact O-N 3.19Å; N197-L201 WeakPolarHBondContact OD1-CD1 3.37Å; L201-H203 PolarHBondContact O-N 2.94Å; L201-K204 PolarHBondContact O-N 3.25Å; L201-M205 WeakPolarHBondContact O-CB 3.43Å; L201-M205 PolarHBondContact O-N 3.45Å
202Y92.1Very high89.9Confident59 Ų5967.5 Ų67.523%0.23136%0.359CS..Hα-helixtrans-62.2-44.5178.2-170.3-85.2000111.9A198 C199 K204 M205 N206 I208 R210 P211A198-Y202 VanDerWaalsContact O-CB 3.31Å; A198-Y202 WeakPolarHBondContact O-CB 3.38Å; A198-Y202 PolarHBondContact O-N 3.22Å; C199-Y202 PolarHBondContact O-N 3.24Å; Y202-K204 VanDerWaalsContact C-N 3.34Å; Y202-K204 PolarHBondContact O-N 3.2Å; Y202-M205 PolarHBondContact O-N 3.12Å; Y202-N206 HydrophobicContact CD1-CB 4.27Å; Y202-N206 WeakPolarHBondContact CD2-OD1 3.31Å; Y202-N206 HydrophobicContact CE1-CB 3.96Å; Y202-N206 WeakPolarHBondContact CE2-OD1 3.42Å; Y202-N206 WeakPolarHBondContact O-CB 3.42Å; Y202-N206 PolarHBondContact O-N 3.31Å; Y202-N206 PolarHBondContact O-OD1 2.72Å; Y202-I208 WeakPolarHBondContact CD1-O 3.38Å; Y202-I208 HydrophobicContact CE1-CD1 4.14Å; Y202-I208 HydrophobicContact CE1-CG1 3.96Å; Y202-R210 HydrophobicContact CD1-CB 3.63Å; Y202-R210 HydrophobicContact CD1-CG 3.98Å; Y202-R210 HydrophobicContact CD2-CG 4.08Å; Y202-R210 HydrophobicContact CE1-CB 4.21Å; Y202-R210 HydrophobicContact CE1-CG 4.41Å; Y202-R210 HydrophobicContact CG-CB 3.85Å; Y202-R210 HydrophobicContact CG-CG 3.78Å; Y202-P211 VanDerWaalsContact CZ-CD 3.5Å; Y202-P211 WeakPolarHBondContact OH-CD 3.24Å
203H90.7Very high89.1Confident73 Ų7374 Ų7434%0.33838%0.384SS..Hα-helixtrans-62.7-39.9176.3-172-76000112C199 L201 G207C199-H203 WeakPolarHBondContact O-CB 3.38Å; C199-H203 PolarHBondContact O-N 3.33Å; L201-H203 PolarHBondContact O-N 2.94Å; H203-G207 WeakPolarHBondContact O-CA 3.48Å; H203-G207 PolarHBondContact O-N 3.02Å
204K89.9Confident88Confident181 Ų18178 Ų7879%0.78740%0.401SS*.Hα-helixtrans-66.3-37.2175.9-173.3179.1179.1-175.60112.6G200 L201 Y202G200-K204 WeakPolarHBondContact O-CB 3.49Å; G200-K204 PolarHBondContact O-N 3.37Å; L201-K204 PolarHBondContact O-N 3.25Å; Y202-K204 VanDerWaalsContact C-N 3.34Å; Y202-K204 PolarHBondContact O-N 3.2Å
205M87.1Confident86.3Confident148 Ų14879.9 Ų79.973%0.72942%0.422SS*.Hα-helixtrans-83.3-36.7-175.9-172.9174.172.600113.3L201 Y202L201-M205 WeakPolarHBondContact O-CB 3.43Å; L201-M205 PolarHBondContact O-N 3.45Å; Y202-M205 PolarHBondContact O-N 3.12Å
206N90.4Very high84.6Confident72 Ų7283.5 Ų83.539%0.38544%0.439SS..Hα-helixtrans-109.9-8.7-171.2-62.995.6000114Y202 I208Y202-N206 HydrophobicContact CD1-CB 4.27Å; Y202-N206 WeakPolarHBondContact CD2-OD1 3.31Å; Y202-N206 HydrophobicContact CE1-CB 3.96Å; Y202-N206 WeakPolarHBondContact CE2-OD1 3.42Å; Y202-N206 WeakPolarHBondContact O-CB 3.42Å; Y202-N206 PolarHBondContact O-N 3.31Å; Y202-N206 PolarHBondContact O-OD1 2.72Å; N206-I208 HydrophobicContact CB-CG1 3.79Å; N206-I208 PolarHBondContact O-N 3.44Å; N206-I208 VanDerWaalsContact O-N 3.09Å
207G87.2Confident82.7Confident56 Ų5691.7 Ų91.758%0.57747%0.474SS*.SBendtrans66.56.1-177.100000114.9H203H203-G207 WeakPolarHBondContact O-CA 3.48Å; H203-G207 PolarHBondContact O-N 3.02Å
208I87.6Confident80.8Confident77 Ų7797.3 Ų97.340%0.39549%0.492SS..SBendtrans-130.5154-177.554.1157.4000111.2Y202 N206Y202-I208 WeakPolarHBondContact CD1-O 3.38Å; Y202-I208 HydrophobicContact CE1-CD1 4.14Å; Y202-I208 HydrophobicContact CE1-CG1 3.96Å; N206-I208 HydrophobicContact CB-CG1 3.79Å; N206-I208 PolarHBondContact O-N 3.44Å; N206-I208 VanDerWaalsContact O-N 3.09Å
209N85.4Confident79Confident96 Ų96100.2 Ų100.251%0.51350%0.501SS..  trans-62.9138.5173.2-82.5-52.7000111.5N177 P211N177-N209 WeakPolarHBondContact OD1-CB 3.23Å; N177-N209 PolarHBondContact OD1-OD1 3.47Å; N209-P211 WeakPolarHBondContact O-CD 3.33Å
210R86.4Confident77.1Confident110 Ų110103.1 Ų103.142%0.41551%0.514SS..  trans-62.1120.8-175.6-169.6-179.3180-141.42.5110.3N177 Y202 L212N177-R210 WeakPolarHBondContact ND2-CB 3.2Å; N177-R210 PolarHBondContact ND2-N 3Å; N177-R210 PolarHBondContact ND2-O 3.06Å; Y202-R210 HydrophobicContact CD1-CB 3.63Å; Y202-R210 HydrophobicContact CD1-CG 3.98Å; Y202-R210 HydrophobicContact CD2-CG 4.08Å; Y202-R210 HydrophobicContact CE1-CB 4.21Å; Y202-R210 HydrophobicContact CE1-CG 4.41Å; Y202-R210 HydrophobicContact CG-CB 3.85Å; Y202-R210 HydrophobicContact CG-CG 3.78Å; R210-L212 VanDerWaalsContact O-CD1 3.23Å; R210-L212 WeakPolarHBondContact O-CD1 3.23Å; R210-L212 PolarHBondContact O-N 3.31Å
211P81.1Confident75.3Confident82 Ų82104.7 Ų104.753%0.53252%0.522SS..  trans-69.2115.3-178.826.8-33.1000110.3Y202 N209 I213Y202-P211 VanDerWaalsContact CZ-CD 3.5Å; Y202-P211 WeakPolarHBondContact OH-CD 3.24Å; N209-P211 WeakPolarHBondContact O-CD 3.33Å; P211-I213 PolarHBondContact O-N 2.85Å
212L79.7Confident73.6Confident68 Ų68105 Ų10536%0.35653%0.527SS..  trans-84.2101.5179.4-99.268.7000110.7C178 R210 K214 Q216C178-L212 HydrophobicContact CB-CD1 3.89Å; C178-L212 HydrophobicContact CB-CD2 3.83Å; C178-L212 HydrophobicContact CB-CG 4.39Å; R210-L212 VanDerWaalsContact O-CD1 3.23Å; R210-L212 WeakPolarHBondContact O-CD1 3.23Å; R210-L212 PolarHBondContact O-N 3.31Å; L212-K214 PolarHBondContact O-N 3.3Å; L212-Q216 HydrophobicContact CD2-CG 3.5Å
213I72.7Confident71.9Confident169 Ų169106.6 Ų106.687%0.86755%0.547SS*.SBendtrans-58.8-29.7179.3-61.3170.3000112.1P211P211-I213 PolarHBondContact O-N 2.85Å
214K68.6Low70.4Confident177 Ų177112.3 Ų112.377%0.7757%0.566SS**SBendtrans-105.8124.7168.1-73177.3177.5174.20108.8L212 Q216L212-K214 PolarHBondContact O-N 3.3Å; K214-Q216 PolarHBondContact O-N 2.99Å
215P57.9Low69.1Low116 Ų116107.3 Ų107.375%0.75354%0.542SS*.  trans-61.7136.217527.1-34.1000109.4K217P215-K217 PolarHBondContact O-N 3.44Å; P215-K217 VanDerWaalsContact O-N 3.11Å
216Q58Low68.2Low83 Ų83104.6 Ų104.639%0.38854%0.543SS..  trans-59.3119.4-179-75.9-171.9-11000111.4C178 G179 L212 K214 R218C178-Q216 PolarHBondContact O-NE2 3.5Å; G179-Q216 VanDerWaalsContact N-NE2 3.14Å; L212-Q216 HydrophobicContact CD2-CG 3.5Å; K214-Q216 PolarHBondContact O-N 2.99Å; Q216-R218 VanDerWaalsContact C-N 3.27Å; Q216-R218 PolarHBondContact O-N 2.81Å
217K55.6Low67.7Low178 Ų178104.2 Ų104.277%0.77456%0.556SS**  trans-66.391.5152.6-69.4-171.5177.2-175.60107.5P215 L219P215-K217 PolarHBondContact O-N 3.44Å; P215-K217 VanDerWaalsContact O-N 3.11Å; K217-L219 HydrophobicContact CB-CD1 3.69Å; K217-L219 HydrophobicContact CB-CG 3.95Å; K217-L219 HydrophobicContact CD-CD1 4.21Å; K217-L219 PolarHBondContact O-N 3.29Å
218R55.7Low67.8Low159 Ų159104.4 Ų104.460%0.654%0.543SS*.  trans-72.364.1176.1-165.8-177.4-179.8-161.8-0.9111Q216 Q220Q216-R218 VanDerWaalsContact C-N 3.27Å; Q216-R218 PolarHBondContact O-N 2.81Å; R218-Q220 VanDerWaalsContact C-N 3.34Å; R218-Q220 PolarHBondContact O-N 3.31Å
219L53.2Low68.2Low104 Ų104102.3 Ų102.355%0.54554%0.535SS..Hα-helixtrans-65-31-168-84.2148.7000113.8K217 T221 T222 S223K217-L219 HydrophobicContact CB-CD1 3.69Å; K217-L219 HydrophobicContact CB-CG 3.95Å; K217-L219 HydrophobicContact CD-CD1 4.21Å; K217-L219 PolarHBondContact O-N 3.29Å; L219-T221 PolarHBondContact O-N 3.39Å; L219-T222 HydrophobicContact CD2-CG2 3.96Å; L219-T222 PolarHBondContact O-N 2.76Å; L219-S223 PolarHBondContact O-N 2.94Å
220Q55.1Low68.6Low63 Ų6397.8 Ų97.829%0.29451%0.511SS..Hα-helixtrans-50.4-29.5-179.3-52.6132.9-28.700113.1E174 R218E174-Q220 VanDerWaalsContact CD-NE2 3.32Å; E174-Q220 PolarHBondContact OE2-NE2 3.27Å; E174-Q220 PolarHBondContact OE2-OE1 2.96Å; R218-Q220 VanDerWaalsContact C-N 3.34Å; R218-Q220 PolarHBondContact O-N 3.31Å
221T55Low69.1Low43 Ų4394.8 Ų94.826%0.26451%0.505SS..Hα-helixtrans-97.2-22.6-177.9-67.90000113.3L219 R225L219-T221 PolarHBondContact O-N 3.39Å; T221-R225 VanDerWaalsContact CG2-NE 3.31Å; T221-R225 VanDerWaalsContact CG2-NH2 3.32Å; T221-R225 WeakPolarHBondContact O-CD 3.37Å; T221-R225 WeakPolarHBondContact O-CG 3.46Å; T221-R225 PolarHBondContact O-NE 2.85Å
222T55.9Low69.8Low90 Ų9093 Ų9355%0.55249%0.491SS*.Hα-helixtrans-88-28.7-178.4-153.50000113.4L219 R225L219-T222 HydrophobicContact CD2-CG2 3.96Å; L219-T222 PolarHBondContact O-N 2.76Å; T222-R225 PolarHBondContact O-N 3.22Å
223S56.4Low70.5Confident93 Ų9389.9 Ų89.965%0.6548%0.475SS*.Hα-helixtrans-66.4-51.6176.6170.50000111L219 R225 A226L219-S223 PolarHBondContact O-N 2.94Å; S223-R225 PolarHBondContact O-N 2.93Å; S223-A226 PolarHBondContact O-N 3.38Å
224R58.8Low71.6Confident194 Ų19487.4 Ų87.473%0.73246%0.459SS*.THydrogen-bonded Turntrans-69.320.3172.4-48.2-170.5-146.8-141.30.8114.3E171E171-R224 IonicContact OE1-NH2 2.87Å
225R64.4Low72.7Confident76 Ų7679.8 Ų79.829%0.28743%0.428SS..THydrogen-bonded Turntrans-124.72.3176.9-78.4178.8-173.1-165.41.8114.3T221 T222 S223 G227 L228 W241T221-R225 VanDerWaalsContact CG2-NE 3.31Å; T221-R225 VanDerWaalsContact CG2-NH2 3.32Å; T221-R225 WeakPolarHBondContact O-CD 3.37Å; T221-R225 WeakPolarHBondContact O-CG 3.46Å; T221-R225 PolarHBondContact O-NE 2.85Å; T222-R225 PolarHBondContact O-N 3.22Å; S223-R225 PolarHBondContact O-N 2.93Å; R225-G227 PolarHBondContact O-N 3.01Å; R225-L228 HydrophobicContact CB-CD1 4.41Å; R225-L228 HydrophobicContact CG-CD1 4.37Å; R225-L228 PolarHBondContact O-N 2.78Å; R225-W241 VanDerWaalsContact CZ-CD1 3.5Å
226A66.5Low74.4Confident90 Ų9077.1 Ų77.174%0.74441%0.411SS*.THydrogen-bonded Turntrans-54.4132.8166.200000109.8S223 L228S223-A226 PolarHBondContact O-N 3.38Å; A226-L228 PolarHBondContact O-N 2.96Å
227G81Confident75.9Confident64 Ų6476.7 Ų76.766%0.6642%0.415SS*.THydrogen-bonded Turntrans84.1-9.9179.200000117.1R225 C229R225-G227 PolarHBondContact O-N 3.01Å; G227-C229 PolarHBondContact O-N 3.32Å
228L89.8Confident77.7Confident61 Ų6169.4 Ų69.432%0.31939%0.385SS..  trans-77.8124.1173.6-77.9103.5000111.6R225 A226 S236 W241 P249R225-L228 HydrophobicContact CB-CD1 4.41Å; R225-L228 HydrophobicContact CG-CD1 4.37Å; R225-L228 PolarHBondContact O-N 2.78Å; A226-L228 PolarHBondContact O-N 2.96Å; L228-S236 WeakPolarHBondContact O-CA 3.11Å; L228-W241 HydrophobicContact CB-CH2 4.33Å; L228-W241 HydrophobicContact CB-CZ2 3.66Å; L228-W241 WeakPolarHBondContact O-CH2 3.44Å; L228-W241 VanDerWaalsContact O-CZ2 3.25Å; L228-W241 WeakPolarHBondContact O-CZ2 3.46Å; L228-P249 HydrophobicContact CD2-CB 4.06Å
229C94Very high79.3Confident33 Ų3366.7 Ų66.722%0.22339%0.386CS..  trans-118.1160.7171.267.70000110.7C50 G227C50-C229 HydrophobicContact CB-CB 4.23Å; G227-C229 PolarHBondContact O-N 3.32Å
230C95.8Very high81.2Confident0 Ų065.4 Ų65.40%038%0.38CS..  trans-85.5122.3174.91790000110.5N232 C233 H234 T235 W241 P249 C251C230-N232 VanDerWaalsContact C-N 3.26Å; C230-N232 PolarHBondContact O-N 2.94Å; C230-C233 PolarHBondContact O-N 2.89Å; C230-H234 WeakPolarHBondContact O-CA 3.21Å; C230-H234 PolarHBondContact O-N 3.44Å; C230-T235 PolarHBondContact N-O 3.41Å; C230-W241 HydrophobicContact CB-CZ3 4.04Å; C230-P249 WeakPolarHBondContact CA-O 3.32Å; C230-C251 HydrophobicContact CB-CB 3.97Å; C230-C251 PolarHBondContact SG-N 3.23Å
231T96.2Very high83.1Confident47 Ų4764.1 Ų64.129%0.28837%0.372SS..THydrogen-bonded Turntrans-59.9-33.8-177.959.10000113.6H234 E248 P249T231-H234 PolarHBondContact O-CE1 3.31Å; T231-H234 VanDerWaalsContact O-CE1 3.23Å; T231-E248 WeakPolarHBondContact CB-OE2 3.39Å; T231-E248 HydrophobicContact CG2-CB 3.8Å; T231-E248 HydrophobicContact CG2-CG 4.35Å; T231-E248 WeakPolarHBondContact CG2-OE2 3.39Å; T231-E248 PolarHBondContact OG1-OE2 2.89Å; T231-P249 PolarHBondContact N-O 3.44Å; T231-P249 VanDerWaalsContact N-O 3.07Å
232N95.6Very high85Confident44 Ų4466.4 Ų66.424%0.23538%0.376CS..THydrogen-bonded Turntrans-83.6-17.8179.2166.1-110.2000115.8C230 C254C230-N232 VanDerWaalsContact C-N 3.26Å; C230-N232 PolarHBondContact O-N 2.94Å; N232-C254 HydrophobicContact CB-CB 4.37Å; N232-C254 VanDerWaalsContact OD1-CB 3.32Å; N232-C254 WeakPolarHBondContact OD1-CB 3.49Å; N232-C254 PolarHBondContact OD1-SG 3.4Å
233C95.1Very high86.9Confident3 Ų371.4 Ų71.42%0.0239%0.385CS..THydrogen-bonded Turntrans-147.14.7-175.379.10000116.3C230 T235 L267 K270C230-C233 PolarHBondContact O-N 2.89Å; C233-T235 PolarHBondContact O-N 3.28Å; C233-T235 PolarHBondContact O-OG1 3.11Å; C233-T235 PolarHBondContact SG-OG1 2.99Å; C233-L267 HydrophobicContact CB-CD2 4.03Å; C233-K270 PolarHBondContact O-NZ 3.21Å; C233-K270 VanDerWaalsContact O-NZ 3.13Å
234H94.3Very high88.7Confident118 Ų11869.1 Ų69.155%0.54637%0.365SS..  trans54.42.8178.8-45.9-55.3000117C230 T231 S236C230-H234 WeakPolarHBondContact O-CA 3.21Å; C230-H234 PolarHBondContact O-N 3.44Å; T231-H234 PolarHBondContact O-CE1 3.31Å; T231-H234 VanDerWaalsContact O-CE1 3.23Å; H234-S236 PolarHBondContact O-N 3.23Å
235T93.1Very high90.3Very high17 Ų1764.7 Ų64.710%0.10437%0.37CS..  trans-61.3121.2174.4-49.50000110.6C230 C233 T237 W241C230-T235 PolarHBondContact N-O 3.41Å; C233-T235 PolarHBondContact O-N 3.28Å; C233-T235 PolarHBondContact O-OG1 3.11Å; C233-T235 PolarHBondContact SG-OG1 2.99Å; T235-T237 VanDerWaalsContact CG2-O 3.27Å; T235-T237 WeakPolarHBondContact CG2-O 3.28Å; T235-W241 WeakPolarHBondContact O-CH2 3.31Å
236S92.6Very high91.7Very high59 Ų5967.8 Ų67.841%0.41339%0.388SS..  trans-82.5-17.6176.854.30000113.9L228 H234 W241L228-S236 WeakPolarHBondContact O-CA 3.11Å; H234-S236 PolarHBondContact O-N 3.23Å; S236-W241 WeakPolarHBondContact O-CZ2 3.47Å
237T90.8Very high93Very high74 Ų7464.7 Ų64.745%0.45437%0.365SS..  trans-102.6126.4178.463.80000111.5T235T235-T237 VanDerWaalsContact CG2-O 3.27Å; T235-T237 WeakPolarHBondContact CG2-O 3.28Å
238T92.4Very high93.6Very high26 Ų2665.6 Ų65.616%0.1635%0.352CS..  trans-153.3152.1173.9-162.40000112.9L240 W241 C251 N252T238-L240 VanDerWaalsContact C-N 3.31Å; T238-L240 WeakPolarHBondContact CG2-O 3.39Å; T238-W241 HydrophobicContact CG2-CD2 3.45Å; T238-W241 VanDerWaalsContact CG2-CD2 3.45Å; T238-W241 HydrophobicContact CG2-CE3 3.69Å; T238-W241 HydrophobicContact CG2-CG 3.89Å; T238-W241 HydrophobicContact CG2-CH2 4.24Å; T238-W241 HydrophobicContact CG2-CZ2 4.05Å; T238-W241 HydrophobicContact CG2-CZ3 4.08Å; T238-C251 HydrophobicContact CG2-CB 4.32Å; T238-N252 PolarHBondContact OG1-N 3.46Å
239T90.6Very high93.9Very high102 Ų10264.7 Ų64.763%0.62635%0.35SS*.SBendtrans-71.2-26.517852.40000112.9I274T239-I274 HydrophobicContact CG2-CG2 3.77Å
240L91.8Very high94Very high77 Ų7763.5 Ų63.540%0.40334%0.341SS..SBendtrans-154.8123176.1173.363.1000109.1T238 R242 N252T238-L240 VanDerWaalsContact C-N 3.31Å; T238-L240 WeakPolarHBondContact CG2-O 3.39Å; L240-R242 HydrophobicContact CG-CG 4.46Å; L240-N252 HydrophobicContact CB-CB 4.08Å; L240-N252 WeakPolarHBondContact O-CA 3.06Å; L240-N252 VanDerWaalsContact O-CB 3.31Å; L240-N252 WeakPolarHBondContact O-CB 3.12Å; L240-N252 PolarHBondContact O-N 3.46Å
241W94.4Very high94Very high35 Ų3563.8 Ų63.813%0.13334%0.344CS..EExtended strand (participates in β ladder)trans-73.5140.6165.1-71.9125.2000109.4R225 L228 C230 T235 S236 T238 P249 C251R225-W241 VanDerWaalsContact CZ-CD1 3.5Å; L228-W241 HydrophobicContact CB-CH2 4.33Å; L228-W241 HydrophobicContact CB-CZ2 3.66Å; L228-W241 WeakPolarHBondContact O-CH2 3.44Å; L228-W241 VanDerWaalsContact O-CZ2 3.25Å; L228-W241 WeakPolarHBondContact O-CZ2 3.46Å; C230-W241 HydrophobicContact CB-CZ3 4.04Å; T235-W241 WeakPolarHBondContact O-CH2 3.31Å; S236-W241 WeakPolarHBondContact O-CZ2 3.47Å; T238-W241 HydrophobicContact CG2-CD2 3.45Å; T238-W241 VanDerWaalsContact CG2-CD2 3.45Å; T238-W241 HydrophobicContact CG2-CE3 3.69Å; T238-W241 HydrophobicContact CG2-CG 3.89Å; T238-W241 HydrophobicContact CG2-CH2 4.24Å; T238-W241 HydrophobicContact CG2-CZ2 4.05Å; T238-W241 HydrophobicContact CG2-CZ3 4.08Å; W241-P249 HydrophobicContact CE3-CB 4.38Å; W241-C251 HydrophobicContact CZ3-CB 4.32Å
242R95.3Very high94.1Very high91 Ų9163.2 Ų63.234%0.34334%0.338SS..EExtended strand (participates in β ladder)trans-123.5172.8171.7-65.4-179.6176.2-81.9-5.1108.4L240 V250 N252L240-R242 HydrophobicContact CG-CG 4.46Å; R242-V250 HydrophobicContact CB-CG2 3.89Å; R242-V250 PolarHBondContact N-O 2.96Å; R242-V250 PolarHBondContact O-N 3.38Å; R242-N252 PolarHBondContact NE-OD1 3.06Å; R242-N252 PolarHBondContact NH2-OD1 3.11Å
243R95.6Very high94.1Very high195 Ų19563 Ų6374%0.73634%0.343SS*.EExtended strand (participates in β ladder)trans-109.7150163.5-63.3-179.4-174.1-969.1110G247 E248R243-G247 VanDerWaalsContact CD-O 3.24Å; R243-G247 WeakPolarHBondContact CD-O 3.46Å; R243-G247 WeakPolarHBondContact CG-O 3.42Å; R243-G247 PolarHBondContact NH1-O 3.05Å; R243-E248 WeakPolarHBondContact CA-O 3.49Å
244N94.1Very high94.2Very high46 Ų4663 Ų6325%0.24634%0.343CS..  trans-80-171.3162.958-4.6000110.1E246 G247 E248 V250N244-E246 WeakPolarHBondContact CB-OE2 3.46Å; N244-E246 PolarHBondContact ND2-OE2 2.9Å; N244-E246 PolarHBondContact O-N 3.37Å; N244-E246 PolarHBondContact OD1-OE2 3.07Å; N244-G247 PolarHBondContact O-N 3.28Å; N244-G247 PolarHBondContact OD1-N 3.44Å; N244-G247 VanDerWaalsContact OD1-N 3.12Å; N244-E248 PolarHBondContact N-O 3.19Å; N244-E248 PolarHBondContact ND2-OE2 3.31Å; N244-E248 WeakPolarHBondContact OD1-CA 3.4Å; N244-E248 VanDerWaalsContact OD1-CB 3.28Å; N244-E248 WeakPolarHBondContact OD1-CB 3.25Å; N244-E248 PolarHBondContact OD1-N 3.15Å; N244-E248 PolarHBondContact OD1-O 3.26Å; N244-V250 HydrophobicContact CB-CG1 4.11Å
245A93.9Very high94.3Very high101 Ų10158.3 Ų58.384%0.83533%0.326SS*.THydrogen-bonded Turntrans-69-28.1179.800000111.5G247A245-G247 VanDerWaalsContact C-N 3.26Å; A245-G247 PolarHBondContact O-N 3.11Å
246E93.3Very high94.5Very high140 Ų14061.5 Ų61.565%0.65434%0.342SS*.THydrogen-bonded Turntrans-78-9.2179.3-54.469.2-152.300112.2N244 E248N244-E246 WeakPolarHBondContact CB-OE2 3.46Å; N244-E246 PolarHBondContact ND2-OE2 2.9Å; N244-E246 PolarHBondContact O-N 3.37Å; N244-E246 PolarHBondContact OD1-OE2 3.07Å; E246-E248 HydrophobicContact CB-CG 4.17Å
247G93.7Very high94.7Very high26 Ų2661 Ų6127%0.26833%0.332SS..  trans87.6-5176.900000115.6R243 N244 A245R243-G247 VanDerWaalsContact CD-O 3.24Å; R243-G247 WeakPolarHBondContact CD-O 3.46Å; R243-G247 WeakPolarHBondContact CG-O 3.42Å; R243-G247 PolarHBondContact NH1-O 3.05Å; N244-G247 PolarHBondContact O-N 3.28Å; N244-G247 PolarHBondContact OD1-N 3.44Å; N244-G247 VanDerWaalsContact OD1-N 3.12Å; A245-G247 VanDerWaalsContact C-N 3.26Å; A245-G247 PolarHBondContact O-N 3.11Å
248E94.1Very high95Very high83 Ų8361.8 Ų61.839%0.38833%0.331SS..  trans-67.3156.2179.7-48.4-177.5125.600113.9T231 R243 N244 E246 V250T231-E248 WeakPolarHBondContact CB-OE2 3.39Å; T231-E248 HydrophobicContact CG2-CB 3.8Å; T231-E248 HydrophobicContact CG2-CG 4.35Å; T231-E248 WeakPolarHBondContact CG2-OE2 3.39Å; T231-E248 PolarHBondContact OG1-OE2 2.89Å; R243-E248 WeakPolarHBondContact CA-O 3.49Å; N244-E248 PolarHBondContact N-O 3.19Å; N244-E248 PolarHBondContact ND2-OE2 3.31Å; N244-E248 WeakPolarHBondContact OD1-CA 3.4Å; N244-E248 VanDerWaalsContact OD1-CB 3.28Å; N244-E248 WeakPolarHBondContact OD1-CB 3.25Å; N244-E248 PolarHBondContact OD1-N 3.15Å; N244-E248 PolarHBondContact OD1-O 3.26Å; E246-E248 HydrophobicContact CB-CG 4.17Å; E248-V250 PolarHBondContact O-N 3.21Å
249P95.4Very high95.2Very high42 Ų4269.7 Ų69.727%0.27336%0.363SS..EExtended strand (participates in β ladder)trans-71.3121.4175.829.3-34.9000113.3L228 C230 T231 W241L228-P249 HydrophobicContact CD2-CB 4.06Å; C230-P249 WeakPolarHBondContact CA-O 3.32Å; T231-P249 PolarHBondContact N-O 3.44Å; T231-P249 VanDerWaalsContact N-O 3.07Å; W241-P249 HydrophobicContact CE3-CB 4.38Å
250V96.3Very high95.5Very high7 Ų771.2 Ų71.24%0.04237%0.367CS..EExtended strand (participates in β ladder)trans-125.4145.9171.2-580000112R242 N244 E248R242-V250 HydrophobicContact CB-CG2 3.89Å; R242-V250 PolarHBondContact N-O 2.96Å; R242-V250 PolarHBondContact O-N 3.38Å; N244-V250 HydrophobicContact CB-CG1 4.11Å; E248-V250 PolarHBondContact O-N 3.21Å
251C96.5Very high95.7Very high7 Ų772.4 Ų72.45%0.04737%0.37CS..EExtended strand (participates in β ladder)trans-71156.6179.491.90000111.3C230 T238 W241 A253 C254 G255C230-C251 HydrophobicContact CB-CB 3.97Å; C230-C251 PolarHBondContact SG-N 3.23Å; T238-C251 HydrophobicContact CG2-CB 4.32Å; W241-C251 HydrophobicContact CZ3-CB 4.32Å; C251-A253 PolarHBondContact O-N 2.99Å; C251-A253 VanDerWaalsContact O-N 3.11Å; C251-C254 PolarHBondContact O-N 3.37Å; C251-C254 VanDerWaalsContact O-N 3.15Å; C251-C254 PolarHBondContact SG-SG 2.92Å; C251-G255 PolarHBondContact O-N 3.12Å
252N96.8Very high95.8Very high34 Ų3473.8 Ų73.818%0.18240%0.395CS..Hα-helixtrans-54.1-36.8-176.9-176.963.4000113.7T238 L240 R242 L256T238-N252 PolarHBondContact OG1-N 3.46Å; L240-N252 HydrophobicContact CB-CB 4.08Å; L240-N252 WeakPolarHBondContact O-CA 3.06Å; L240-N252 VanDerWaalsContact O-CB 3.31Å; L240-N252 WeakPolarHBondContact O-CB 3.12Å; L240-N252 PolarHBondContact O-N 3.46Å; R242-N252 PolarHBondContact NE-OD1 3.06Å; R242-N252 PolarHBondContact NH2-OD1 3.11Å; N252-L256 WeakPolarHBondContact ND2-CD1 3.39Å; N252-L256 VanDerWaalsContact O-CB 3.32Å; N252-L256 WeakPolarHBondContact O-CB 3.34Å; N252-L256 WeakPolarHBondContact O-CD1 3.33Å; N252-L256 WeakPolarHBondContact O-CG 3.32Å; N252-L256 PolarHBondContact O-N 2.86Å; N252-L256 VanDerWaalsContact O-N 3.12Å
253A96.3Very high95.8Very high40 Ų4073 Ų7333%0.33140%0.4SS..Hα-helixtrans-71.8-41.2-178.300000112.3C251 Y257C251-A253 PolarHBondContact O-N 2.99Å; C251-A253 VanDerWaalsContact O-N 3.11Å; A253-Y257 WeakPolarHBondContact O-CB 3.19Å; A253-Y257 PolarHBondContact O-N 3.39Å
254C96.8Very high95.8Very high4 Ų467.5 Ų67.53%0.02739%0.39CS..Hα-helixtrans-69.5-45.2178.6-59.80000111.4N232 C251 L256 Y257 M258 R265N232-C254 HydrophobicContact CB-CB 4.37Å; N232-C254 VanDerWaalsContact OD1-CB 3.32Å; N232-C254 WeakPolarHBondContact OD1-CB 3.49Å; N232-C254 PolarHBondContact OD1-SG 3.4Å; C251-C254 PolarHBondContact O-N 3.37Å; C251-C254 VanDerWaalsContact O-N 3.15Å; C251-C254 PolarHBondContact SG-SG 2.92Å; C254-L256 VanDerWaalsContact C-N 3.31Å; C254-L256 PolarHBondContact O-N 3.38Å; C254-Y257 PolarHBondContact O-N 3.4Å; C254-M258 PolarHBondContact O-N 3.44Å; C254-R265 HydrophobicContact CB-CB 4.48Å
255G96.6Very high95.9Very high18 Ų1867.5 Ų67.519%0.18639%0.386CS..Hα-helixtrans-66.7-27.3177.100000114.3C251 K259C251-G255 PolarHBondContact O-N 3.12Å; G255-K259 WeakPolarHBondContact O-CB 3.32Å; G255-K259 PolarHBondContact O-N 2.83Å
256L96.4Very high95.9Very high84 Ų8465.2 Ų65.244%0.4436%0.363SS..Hα-helixtrans-77.4-38.3171.2-74.7173.9000112.4N252 C254 K259 L260N252-L256 WeakPolarHBondContact ND2-CD1 3.39Å; N252-L256 VanDerWaalsContact O-CB 3.32Å; N252-L256 WeakPolarHBondContact O-CB 3.34Å; N252-L256 WeakPolarHBondContact O-CD1 3.33Å; N252-L256 WeakPolarHBondContact O-CG 3.32Å; N252-L256 PolarHBondContact O-N 2.86Å; N252-L256 VanDerWaalsContact O-N 3.12Å; C254-L256 VanDerWaalsContact C-N 3.31Å; C254-L256 PolarHBondContact O-N 3.38Å; L256-K259 PolarHBondContact O-N 2.85Å; L256-L260 WeakPolarHBondContact O-CB 3.47Å; L256-L260 PolarHBondContact O-N 3.22Å; L256-L260 VanDerWaalsContact O-N 3.11Å
257Y97.4Very high95.9Very high50 Ų5063.8 Ų63.820%0.19636%0.36CS..Hα-helixtrans-64.6-48.9178.1-172.9-85.8000111.3A253 C254 K259 L260 H261 V263 P264 R265 P266 M269A253-Y257 WeakPolarHBondContact O-CB 3.19Å; A253-Y257 PolarHBondContact O-N 3.39Å; C254-Y257 PolarHBondContact O-N 3.4Å; Y257-K259 VanDerWaalsContact C-N 3.29Å; Y257-K259 PolarHBondContact O-N 3.23Å; Y257-L260 PolarHBondContact O-N 3.2Å; Y257-H261 AromaticContact CD2-CD2 3.46Å; Y257-H261 VanDerWaalsContact CD2-CD2 3.46Å; Y257-H261 WeakPolarHBondContact CD2-CD2 3.2Å; Y257-H261 AromaticContact CD2-NE2 3.89Å; Y257-H261 HydrophobicContact CE1-CB 4.25Å; Y257-H261 AromaticContact CE2-CD2 3.44Å; Y257-H261 VanDerWaalsContact CE2-CD2 3.44Å; Y257-H261 WeakPolarHBondContact CE2-CD2 3.27Å; Y257-H261 AromaticContact CE2-NE2 3.78Å; Y257-H261 AromaticContact CG-CD2 3.78Å; Y257-H261 AromaticContact CZ-CD2 3.75Å; Y257-H261 PolarHBondContact O-CD2 2.99Å; Y257-H261 PolarHBondContact O-N 2.86Å; Y257-V263 WeakPolarHBondContact CD1-O 3.49Å; Y257-V263 HydrophobicContact CE1-CG2 4.05Å; Y257-P264 WeakPolarHBondContact CE1-O 3.44Å; Y257-R265 HydrophobicContact CD1-CB 3.72Å; Y257-R265 HydrophobicContact CD1-CG 4.23Å; Y257-R265 HydrophobicContact CD2-CG 4.22Å; Y257-R265 HydrophobicContact CE1-CB 4.32Å; Y257-R265 HydrophobicContact CG-CB 3.85Å; Y257-R265 HydrophobicContact CG-CG 3.96Å; Y257-P266 WeakPolarHBondContact OH-CD 3.11Å; Y257-M269 HydrophobicContact CE2-CE 4.47Å; Y257-M269 HydrophobicContact CE2-SD 3.87Å
258M96.8Very high95.8Very high90 Ų9067.6 Ų67.644%0.44339%0.388SS..Hα-helixtrans-55.8-43.3175.2-175.566.689.300111.6C254 L260 G262 P264C254-M258 PolarHBondContact O-N 3.44Å; M258-L260 VanDerWaalsContact C-N 3.31Å; M258-L260 PolarHBondContact O-N 3.42Å; M258-G262 WeakPolarHBondContact O-CA 3.45Å; M258-G262 PolarHBondContact O-N 3.23Å; M258-P264 HydrophobicContact CE-CB 4.08Å
259K96.1Very high95.6Very high192 Ų19268.8 Ų68.884%0.83540%0.395SS*.Hα-helixtrans-69.7-22.9178.9-175.2161.5-175166.30114.2G255 L256 Y257G255-K259 WeakPolarHBondContact O-CB 3.32Å; G255-K259 PolarHBondContact O-N 2.83Å; L256-K259 PolarHBondContact O-N 2.85Å; Y257-K259 VanDerWaalsContact C-N 3.29Å; Y257-K259 PolarHBondContact O-N 3.23Å
260L97.1Very high95.4Very high133 Ų13370.3 Ų70.370%0.69640%0.397SS*.Hα-helixtrans-93.7-31.6-179.8-176.559.7000113.1L256 Y257 M258L256-L260 WeakPolarHBondContact O-CB 3.47Å; L256-L260 PolarHBondContact O-N 3.22Å; L256-L260 VanDerWaalsContact O-N 3.11Å; Y257-L260 PolarHBondContact O-N 3.2Å; M258-L260 VanDerWaalsContact C-N 3.31Å; M258-L260 PolarHBondContact O-N 3.42Å
261H96.7Very high95.1Very high102 Ų10274.8 Ų74.847%0.47242%0.417SS..Hα-helixtrans-117.7-10.2-171.4-58.6-70.6000114.5Y257 V263Y257-H261 AromaticContact CD2-CD2 3.46Å; Y257-H261 VanDerWaalsContact CD2-CD2 3.46Å; Y257-H261 WeakPolarHBondContact CD2-CD2 3.2Å; Y257-H261 AromaticContact CD2-NE2 3.89Å; Y257-H261 HydrophobicContact CE1-CB 4.25Å; Y257-H261 AromaticContact CE2-CD2 3.44Å; Y257-H261 VanDerWaalsContact CE2-CD2 3.44Å; Y257-H261 WeakPolarHBondContact CE2-CD2 3.27Å; Y257-H261 AromaticContact CE2-NE2 3.78Å; Y257-H261 AromaticContact CG-CD2 3.78Å; Y257-H261 AromaticContact CZ-CD2 3.75Å; Y257-H261 PolarHBondContact O-CD2 2.99Å; Y257-H261 PolarHBondContact O-N 2.86Å; H261-V263 HydrophobicContact CB-CG2 3.78Å; H261-V263 PolarHBondContact O-N 2.76Å
262G95.9Very high94.4Very high64 Ų6480.2 Ų80.266%0.6644%0.441SS*.SBendtrans71.81.7-176.900000115.1M258M258-G262 WeakPolarHBondContact O-CA 3.45Å; M258-G262 PolarHBondContact O-N 3.23Å
263V95.9Very high93.9Very high74 Ų7482.2 Ų82.245%0.44846%0.458SS..SBendtrans-127.2152.5-175.5-72.30000112Y257 H261Y257-V263 WeakPolarHBondContact CD1-O 3.49Å; Y257-V263 HydrophobicContact CE1-CG2 4.05Å; H261-V263 HydrophobicContact CB-CG2 3.78Å; H261-V263 PolarHBondContact O-N 2.76Å
264P94.5Very high93.4Very high80 Ų8084.4 Ų84.452%0.51946%0.463SS..PPolyproline II helixtrans-61.3148.2176.925.5-34.9000111.9Y257 M258 P266Y257-P264 WeakPolarHBondContact CE1-O 3.44Å; M258-P264 HydrophobicContact CE-CB 4.08Å; P264-P266 WeakPolarHBondContact O-CD 3.46Å
265R96.3Very high92.9Very high46 Ų4690.6 Ų90.617%0.17449%0.491CS..PPolyproline II helixtrans-69.6124.6-178.7-175.2-178.5168.7-148.55.3110.3C254 Y257 M269C254-R265 HydrophobicContact CB-CB 4.48Å; Y257-R265 HydrophobicContact CD1-CB 3.72Å; Y257-R265 HydrophobicContact CD1-CG 4.23Å; Y257-R265 HydrophobicContact CD2-CG 4.22Å; Y257-R265 HydrophobicContact CE1-CB 4.32Å; Y257-R265 HydrophobicContact CG-CB 3.85Å; Y257-R265 HydrophobicContact CG-CG 3.96Å; R265-M269 PolarHBondContact NH2-O 3.07Å
266P95.1Very high92.3Very high54 Ų5496.1 Ų96.135%0.35152%0.522SS..PPolyproline II helixtrans-67.7138.1178.726.9-34000110.8Y257 P264 A268 M269Y257-P266 WeakPolarHBondContact OH-CD 3.11Å; P264-P266 WeakPolarHBondContact O-CD 3.46Å; P266-A268 PolarHBondContact O-N 3.31Å; P266-M269 HydrophobicContact CG-CB 4.46Å; P266-M269 HydrophobicContact CG-CG 3.95Å; P266-M269 HydrophobicContact CG-SD 3.82Å; P266-M269 PolarHBondContact O-N 3.38Å
267L92.8Very high91.6Very high110 Ų110102.3 Ų102.358%0.57654%0.539SS*.G310 helixtrans-64.3-24.9-177-64.5179.3000113C233 M269 K270C233-L267 HydrophobicContact CB-CD2 4.03Å; L267-M269 PolarHBondContact O-N 2.69Å; L267-M269 VanDerWaalsContact O-N 3.15Å; L267-K270 WeakPolarHBondContact O-CB 3.3Å; L267-K270 PolarHBondContact O-N 3.3Å
268A92.2Very high90.7Very high105 Ų105110.1 Ų110.187%0.86857%0.574SS**G310 helixtrans-59.1-22.3170.800000113.6P266P266-A268 PolarHBondContact O-N 3.31Å
269M89.6Confident89.7Confident108 Ų108116.9 Ų116.953%0.53260%0.595SS.*G310 helixtrans-92.51.6172.9-63.5-177.28200113.3Y257 R265 P266 L267Y257-M269 HydrophobicContact CE2-CE 4.47Å; Y257-M269 HydrophobicContact CE2-SD 3.87Å; R265-M269 PolarHBondContact NH2-O 3.07Å; P266-M269 HydrophobicContact CG-CB 4.46Å; P266-M269 HydrophobicContact CG-CG 3.95Å; P266-M269 HydrophobicContact CG-SD 3.82Å; P266-M269 PolarHBondContact O-N 3.38Å; L267-M269 PolarHBondContact O-N 2.69Å; L267-M269 VanDerWaalsContact O-N 3.15Å
270K90.1Very high88.7Confident74 Ų74117 Ų11732%0.32260%0.595SS.*  trans-64.6143.6173.6-177.4177.5167.5175.30109C233 L267 E272C233-K270 PolarHBondContact O-NZ 3.21Å; C233-K270 VanDerWaalsContact O-NZ 3.13Å; L267-K270 WeakPolarHBondContact O-CB 3.3Å; L267-K270 PolarHBondContact O-N 3.3Å; K270-E272 VanDerWaalsContact CE-OE2 3.3Å; K270-E272 WeakPolarHBondContact CE-OE2 3.45Å; K270-E272 IonicContact NZ-OE2 3.54Å
271K90.1Very high87.3Confident102 Ų102116.2 Ų116.244%0.44360%0.598SS.*  trans-132134.5170.3179168.8176.8148.30108.5S273 Q275K271-S273 WeakPolarHBondContact CE-OG 3.18Å; K271-S273 WeakPolarHBondContact CG-O 3.5Å; K271-Q275 HydrophobicContact CD-CG 4.12Å
272E82.3Confident85.8Confident120 Ų120121.1 Ų121.156%0.56162%0.618SS**SBendtrans-73.5-33.5-173.9-152.851-134.900112.9K270K270-E272 VanDerWaalsContact CE-OE2 3.3Å; K270-E272 WeakPolarHBondContact CE-OE2 3.45Å; K270-E272 IonicContact NZ-OE2 3.54Å
273S85.9Confident84.3Confident76 Ų76125 Ų12553%0.53162%0.623SS.*SBendtrans-101.4130.4177.153.70000113.4K271 Q275K271-S273 WeakPolarHBondContact CE-OG 3.18Å; K271-S273 WeakPolarHBondContact CG-O 3.5Å; S273-Q275 PolarHBondContact O-N 3.31Å; S273-Q275 VanDerWaalsContact O-N 3.13Å
274I86.8Confident82.5Confident87 Ų87125.7 Ų125.745%0.44663%0.628SS.*  trans-65.9110.6174.7-60.2178.8000109.5T239 T276T239-I274 HydrophobicContact CG2-CG2 3.77Å; I274-T276 PolarHBondContact O-N 3.13Å
275Q86.8Confident80.3Confident133 Ų133131.5 Ų131.562%0.62165%0.645SS**  trans-67.4120.1173.5-76.8175.1-39.800111.3K271 S273K271-Q275 HydrophobicContact CD-CG 4.12Å; S273-Q275 PolarHBondContact O-N 3.31Å; S273-Q275 VanDerWaalsContact O-N 3.13Å
276T83.1Confident77.7Confident134 Ų134135.6 Ų135.682%0.82268%0.676SS**  trans-76.8149.4164.858.70000109.8I274I274-T276 PolarHBondContact O-N 3.13Å
277R81.5Confident75.3Confident214 Ų214142.9 Ų142.981%0.80870%0.702SS**  trans-125.8133.3169.2-64.4-173-177-170.20.7108R279R277-R279 PolarHBondContact O-N 3.46Å
278K78.2Confident72.9Confident214 Ų214142.1 Ų142.193%0.9371%0.712SS**  trans-66.990.8179.1-171175-177.6177.30109.7K280K278-K280 PolarHBondContact O-N 3.15Å
279R76.1Confident70.8Confident232 Ų232142.9 Ų142.988%0.87571%0.71SS**PPolyproline II helixtrans-63.1126.8176.1-71.5-179.1170.3179.4-3.8108.8R277R277-R279 PolarHBondContact O-N 3.46Å
280K75Confident68.5Low195 Ų195144.1 Ų144.185%0.84873%0.725SS**PPolyproline II helixtrans-56.9132.6167.2-70.8-175.5176.4-177.70108.1K278 K282K278-K280 PolarHBondContact O-N 3.15Å; K280-K282 PolarHBondContact O-N 2.87Å
281P68.7Low66.3Low117 Ų117144.2 Ų144.276%0.7675%0.746SS**PPolyproline II helixtrans-55.4136.9174.7-25.834.9000110.8I283P281-I283 PolarHBondContact O-N 2.97Å
282K65.3Low63.8Low204 Ų204145.2 Ų145.289%0.88777%0.766SS**  trans-72.696166.6-81.7-169.5172.6-172.40107.8K280K280-K282 PolarHBondContact O-N 2.87Å
283I64.1Low62.2Low147 Ų147146.9 Ų146.975%0.75478%0.777SS**  trans-57.5125.7165.4-57.9172.6000106.8P281 K285P281-I283 PolarHBondContact O-N 2.97Å; I283-K285 PolarHBondContact O-N 3.23Å
284P58.1Low60.1Low87 Ų87150.1 Ų150.157%0.56579%0.794SS**  trans-66.3117.9175.127.2-32.2000108.6T286P284-T286 PolarHBondContact O-N 3.13Å
285K49.4Very low58Low202 Ų202150.7 Ų150.788%0.87881%0.806SS**  trans-67.5104.1164.2-78.2-167.3173.8-169.70107.4I283 K287I283-K285 PolarHBondContact O-N 3.23Å; K285-K287 PolarHBondContact O-N 3.37Å
286T41.6Very low55.6Low132 Ų132151.3 Ų151.381%0.8181%0.813SS**  trans-56.5117.6165.434.70000108.4P284 A288P284-T286 PolarHBondContact O-N 3.13Å; T286-A288 PolarHBondContact O-N 2.8Å
287K44.7Very low53.4Low207 Ų207151.1 Ų151.190%0.981%0.812SS**  trans-74.993.2169.7-75.6-168.8175.3-171.70107.9K285 S289K285-K287 PolarHBondContact O-N 3.37Å; K287-S289 PolarHBondContact O-N 3.3Å
288A40.6Very low51.4Low95 Ų95146 Ų14679%0.78581%0.81SS**  trans-62128.4162.400000108.4T286T286-A288 PolarHBondContact O-N 2.8Å
289S48.8Very low49.7Very low120 Ų120141.1 Ų141.184%0.83980%0.802SS**  trans-93.9101.6-177.3530000110.8K287K287-S289 PolarHBondContact O-N 3.3Å
290T40.9Very low49.1Very low135 Ų135135.4 Ų135.483%0.82880%0.795SS**  trans-127.4121.5159.7-530000107.2
291G44Very low47.1Very low76 Ų76131.7 Ų131.778%0.78479%0.794SS**  trans-82.4146.1173.900000110.9
292S38.9Very low45.6Very low122 Ų122131.8 Ų131.885%0.85380%0.797SS**  trans-142.5141.8154.2-167.80000108.7
293I48.2Very low44.7Very low155 Ų155130.1 Ų130.180%0.79580%0.797SS**  trans-93139.4179.245.9172.1000110.1
294T42.5Very low43.2Very low144 Ų144129 Ų12988%0.88380%0.802SS**  trans179156.7147.115.40000108.5
295S40.8Very low42.2Very low99 Ų99131.4 Ų131.469%0.69282%0.815SS**  trans-119.4159.6-159.3-40.40000114
296D36.3Very low41.7Very low146 Ų146126 Ų12678%0.78180%0.803SS**  trans51.4124147.6-46.5-36000120.9
297T37.8Very low41.5Very low130 Ų130128.1 Ų128.180%0.79880%0.803SS**  161.2139.2113-680000113.7
298S39.9Very low41.2Very low108 Ų108126.8 Ų126.876%0.75580%0.8SS**  trans2138.3170.366.70000124.2
299S42.2Very low40.9Very low110 Ų110126.4 Ų126.477%0.76980%0.797SS**  trans-77.6-176.8149.8-29.60000111.8
300P62.7Low40.4Very low112 Ų112125.6 Ų125.673%0.72779%0.791SS**  cis-136.2-169.6-6.741.1-22.4000115
301S34.2Very low40.1Very low118 Ų118125.7 Ų125.783%0.82579%0.792SS**  trans73.2162.7164.3-50.90000116.1
302S36.6Very low39.9Very low118 Ų118129.9 Ų129.983%0.82579%0.794SS**  cis-143.6-173.42.960.30000112.7
303L46.3Very low39.8Very low170 Ų170132.9 Ų132.989%0.8979%0.792SS**  trans-68.5153.3178.6-58.8166.1000114.5
304S32.6Very low39.1Very low122 Ų122130.5 Ų130.585%0.85379%0.79SS**  trans-154.4152.7149.260.20000111.7
305V38.2Very low38.8Very low138 Ų138132.2 Ų132.284%0.83679%0.787SS**  trans-138153.7-178.4172.30000108.8
306S37Very low38.9Very low90 Ų90133.4 Ų133.463%0.62979%0.793SS**  trans122118.4172.6-174.80000110.5
307E39Very low38.5Very low176 Ų176132.3 Ų132.382%0.82280%0.797SS**  cis89.687.646.4-76.6-161.3103.400115.4
308H38.4Very low38.5Very low178 Ų178134.7 Ų134.782%0.82480%0.801SS**  trans-177.6151150.839.8-84.8000108.3
309A34.3Very low38.4Very low88 Ų88133.8 Ų133.873%0.72780%0.8SS**  cis-171.6160.4-15.300000107.1
310S37.8Very low38.9Very low103 Ų103134.5 Ų134.572%0.7280%0.802SS**  cis-171.2179.1-18.4-88.50000107.7
311T33.8Very low37.5Very low136 Ų136134.9 Ų134.983%0.83481%0.807SS**  trans76.4150.3178-15.10000112
312I41.2Very low38.4Very low164 Ų164134.7 Ų134.784%0.84180%0.803SS**  cis-136.2163.927.4-47.8160.5000112.8
313K35.1Very low38.3Very low185 Ų185140.2 Ų140.280%0.80481%0.808SS**  trans-74.8156.6-175.8-177.7-164.9176.9-174.40115.4
314S34.9Very low37.9Very low106 Ų106136.2 Ų136.274%0.74180%0.799SS**  trans127148.4142.7-49.20000117.1
315E36.4Very low38Very low179 Ų179133.5 Ų133.584%0.83679%0.79SS**  trans-59.3166.4-173.4-71.4-177.3108.100119
316P41.4Very low37.9Very low124 Ų124136.4 Ų136.481%0.80580%0.795SS**  trans-85.9137.3153.135.9-29.8000112.5
317S29.2Very low37.7Very low124 Ų124137.9 Ų137.987%0.86780%0.8SS**  trans-136.4163.8166.1-168.20000111
318M37.5Very low37.5Very low179 Ų179136.9 Ų136.988%0.88280%0.799SS**  trans-104.3175.7-161.8-67.9-155.477.600115.3
319A37.8Very low37.5Very low90 Ų90133.9 Ų133.974%0.74479%0.793SS**  trans82.4166.4159.800000116.8
320P53.7Low37.5Very low125 Ų125135.5 Ų135.581%0.81280%0.799SS**  cis-134.6178.1-49.135.6-21.2000113.1
321S32.5Very low37.2Very low119 Ų119134 Ų13483%0.83280%0.8SS**  trans-155.6143.9160-165.90000112.5
322P53.3Low37.3Very low114 Ų114132.2 Ų132.274%0.7479%0.793SS**  trans-120.7153.5-169.440.8-29.9000116.5
323Y34.6Very low37Very low234 Ų234132.8 Ų132.892%0.91879%0.793SS**  trans-160.9167.8131-143.5-107.2000112.6
324A36.5Very low36.7Very low86 Ų86129.2 Ų129.271%0.71179%0.786SS**  trans-77.9162.8-176.100000113.9
325G34.8Very low36.7Very low65 Ų65128.9 Ų128.967%0.6778%0.784SS**  cis140.6155.8-3.900000113.1
326Q36.9Very low36.7Very low199 Ų199125.1 Ų125.193%0.9378%0.777SS**  trans-165.4154.6160-118.6165.790.200114.4
327T33.9Very low36.3Very low122 Ų122127.1 Ų127.175%0.74878%0.776SS**  trans-64.8169.5-177.40.40000113.5
328I34.6Very low36.5Very low154 Ų154127.7 Ų127.779%0.7977%0.768SS**  cis-144.8140.133.8-62.8172.9000113.8
329T37Very low36.2Very low115 Ų115125.5 Ų125.571%0.70676%0.761SS**  trans-2.2133.2151.8-40.80000122.9
330S34.5Very low36Very low122 Ų122125.4 Ų125.485%0.85375%0.754SS**  157.8135.7124.2-68.70000111.9
331G31Very low35.1Very low71 Ų71126.1 Ų126.173%0.73276%0.757SS**  cis176.9148.5-12.100000112.5
332S36.5Very low35.1Very low100 Ų100125.4 Ų125.470%0.69976%0.758SS**  trans44.1113.3155.8-68.70000121.2
333Q35.1Very low34.3Very low176 Ų176126.3 Ų126.382%0.82277%0.767SS**  79.8145.686.1-78179.49900114.4
334T29.8Very low34.2Very low110 Ų110118.6 Ų118.668%0.67576%0.759SS**  cis-144171.18.953.60000113.2
335S34.1Very low34.2Very low99 Ų99122.2 Ų122.269%0.69276%0.76SS**  trans45.2149.6135.666.40000124.3
336S36.1Very low34.4Very low99 Ų99125.2 Ų125.269%0.69277%0.766SS**  cis179.1144.8-20.851.40000112.3
337Q32.8Very low34.4Very low166 Ų166122 Ų12278%0.77676%0.755SS**  trans57.8125.9149.2-76.4-170-63.400124
338L34.4Very low34.6Very low136 Ų136124 Ų12471%0.71276%0.759SS**  trans64.4155.7134.9-55.6175.8000119.4
339D29.8Very low34.5Very low134 Ų134123.9 Ų123.972%0.71775%0.753SS**  cis-140.2-154.4-0.3-145.5-50.9000111.9
340S34.7Very low34.4Very low88 Ų88129.2 Ų129.262%0.61576%0.762SS**  trans-108.4165.7-149.6-54.10000117.9
341T33.7Very low34.5Very low140 Ų140129 Ų12986%0.85975%0.747SS**  trans59.9112.6155.150.40000121
342A32.9Very low34.7Very low104 Ų104132.8 Ų132.886%0.8675%0.751SS**  -165.9155.6126.600000111.7
343S36.3Very low34.7Very low132 Ų132137.3 Ų137.392%0.92375%0.754SS**  trans-72.2144-179.8-51.80000113.5
344G33.3Very low35.4Very low73 Ų73133.8 Ų133.875%0.75375%0.747SS**  trans-154.896.1173.300000112.9
345H35.8Very low35.7Very low161 Ų161138.6 Ų138.675%0.74576%0.758SS**  trans-83.1126.7172.9177.7-79.9000109.9D347H345-D347 IonicContact CE1-OD2 3.94Å; H345-D347 PolarHBondContact CE1-OD2 3.24Å; H345-D347 VanDerWaalsContact CE1-OD2 3.24Å; H345-D347 IonicContact ND1-OD2 3.7Å
346V38.4Very low36.3Very low129 Ų129140 Ų14078%0.78276%0.763SS**  trans-135.3113.1174.3-80.40000111.2
347D37.7Very low37Very low132 Ų132141 Ų14171%0.70677%0.767SS**  trans-61.5132.5166.3-74.8-89.4000111H345H345-D347 IonicContact CE1-OD2 3.94Å; H345-D347 PolarHBondContact CE1-OD2 3.24Å; H345-D347 VanDerWaalsContact CE1-OD2 3.24Å; H345-D347 IonicContact ND1-OD2 3.7Å
348I37.9Very low37.4Very low163 Ų163140.1 Ų140.184%0.83677%0.773SS**  trans-121.892.4154.3-60.4-174.6000107.9
349K32.9Very low37.7Very low152 Ų152138.8 Ų138.866%0.66178%0.775SS**  trans-64.3124.7175-175.7-172.9-174.5-161.30110.4E351K349-E351 HydrophobicContact CD-CG 4.33Å; K349-E351 WeakPolarHBondContact CE-OE1 2.99Å; K349-E351 HydrophobicContact CG-CG 4.32Å; K349-E351 IonicContact NZ-OE1 2.61Å; K349-E351 PolarHBondContact NZ-OE1 2.61Å
350Y34.5Very low38Very low227 Ų227140.8 Ų140.889%0.8978%0.783SS**  trans-115.2124.9160.8-152.1-88.6000107.4
351E37.6Very low38.3Very low117 Ų117140.6 Ų140.655%0.54779%0.786SS.*  trans-85.3134.5-177.7-74-155.5149.600112.3K349K349-E351 HydrophobicContact CD-CG 4.33Å; K349-E351 WeakPolarHBondContact CE-OE1 2.99Å; K349-E351 HydrophobicContact CG-CG 4.32Å; K349-E351 IonicContact NZ-OE1 2.61Å; K349-E351 PolarHBondContact NZ-OE1 2.61Å
352D34Very low39.1Very low151 Ų151139.1 Ų139.181%0.80778%0.779SS**  trans-84.5129.7167.1-159.7-29000108.2
353Y36.2Very low39.6Very low194 Ų194143.2 Ų143.276%0.76178%0.78SS**  trans-111.1112.9-177.3-127.4-90.3000109.9
354P49.8Very low39.8Very low103 Ų103143.5 Ų143.567%0.66977%0.771SS**  trans-78.9135.4-15928.9-35.9000113.9
355F36.6Very low40.1Very low210 Ų210144.9 Ų144.992%0.92177%0.77SS**  trans-87.9123.1159.9-88.7-92.5000110.4
356T46.3Very low40.1Very low129 Ų129149.3 Ų149.379%0.79178%0.78SS**  trans-132.4154.216540.50000111
357P52.5Low40.6Very low121 Ų121149.5 Ų149.579%0.78679%0.785SS**  trans-107.5163.2-147.939.5-35.5000115.2
358T39.5Very low41Very low147 Ų147147.2 Ų147.290%0.90279%0.785SS**  trans-130.9139160-61.90000109.6
359S41.6Very low41.4Very low107 Ų107147.7 Ų147.775%0.74879%0.788SS**  trans-127.4135.8177.3169.20000109.5
360M35.8Very low41.9Very low177 Ų177146.2 Ų146.287%0.87280%0.798SS**  trans-160.8114149.5-80.4-14082.100112.1
361A42Very low42.7Very low84 Ų84144.9 Ų144.969%0.69480%0.799SS**  trans56153.1138.800000122.4
362P50.3Low43.4Very low108 Ų108147.9 Ų147.970%0.70184%0.844SS**  trans-96.8166.3-171.538.9-36.6000114.9
363Q42.1Very low43.9Very low190 Ų190147.8 Ų147.889%0.88885%0.846SS**  trans-115.7143.8163.8-79.1-68.1-16.300110.6
364N40.7Very low44.3Very low138 Ų138145.3 Ų145.374%0.73885%0.851SS**  trans-104.9179.8-173-81.9-42.6000112.4
365S39.7Very low44Very low103 Ų103147.7 Ų147.772%0.7286%0.861SS**  trans63.6112.8155.160.80000119
366W36.3Very low44.4Very low253 Ų253144 Ų14496%0.95886%0.857SS**  -140110.4126.8-90.491.8000109.1
367C49.1Very low44.3Very low133 Ų133144.9 Ų144.990%0.89986%0.861SS**  trans-143.6107.8171.5-82.10000110
368A45.7Very low43.8Very low85 Ų85146.5 Ų146.570%0.70287%0.867SS**  trans-150.1113.5163.300000106.6
369L46.2Very low44.1Very low172 Ų172146.5 Ų146.590%0.90186%0.864SS**  73.494.477.5-89.6165.9000114.1
370S43.5Very low44.3Very low122 Ų122149.5 Ų149.585%0.85387%0.873SS**  -148.8125.5127.557.50000110.4
371Q51.3Low45Very low198 Ų198147.3 Ų147.393%0.92587%0.873SS**  trans-155107161.2-152.4-177120.700107.3
372A52.7Low45.2Very low181 Ų181153 Ų153100%1.49689%0.889SS**  trans-161.60173.500000107.1

Retrieved 372 of 372 residues in 73.1 ms (Link to these results)