A0A087YGD0_POEFO Loading...

SAM and SH3 domain containing 3

AlphaFold DB , UniProt , Accession A0A087YGD0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 397 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
1M45Very low51.2Low239 Ų239167.7 Ų167.7100%1.17784%0.843SS**  0107.10-72.7166.777.600108.7R3M1-R3 PolarHBondContact O-N 3.37Å
2L47.7Very low50.6Low158 Ų158167.8 Ų167.883%0.82783%0.834SS**  trans-60.6123.6176.8-100.566.6000110.3
3R61Low50.2Low248 Ų248168.7 Ų168.794%0.93683%0.834SS**  trans-98.399162.8-75.1-157.3138.4159.6-1.7109.5M1M1-R3 PolarHBondContact O-N 3.37Å
4R61.3Low49.5Very low230 Ų230169 Ų16987%0.86883%0.833SS**PPolyproline II helixtrans-67.1135.7165.7-70.5-178.7165.7176-4.6109.2
5R65.1Low48.7Very low241 Ų241167.1 Ų167.191%0.90984%0.835SS**PPolyproline II helixtrans-94.4139.8164.7-78.1-95176.1146.8-3108.7
6P59Low48.4Very low113 Ų113167.9 Ų167.973%0.73484%0.835SS**PPolyproline II helixtrans-82.1142.2-177.633-32.4000111.5
7S46.6Very low48.3Very low110 Ų110170 Ų17077%0.76984%0.838SS**PPolyproline II helixtrans-62.5136.6156.439.40000110.7
8N43.7Very low48.3Very low169 Ų169171.6 Ų171.690%0.90484%0.839SS**  trans-155136.9150.5-100.2-34.1000111.1
9A46.7Very low48.3Very low94 Ų94173.3 Ų173.378%0.77784%0.842SS**  trans-97.3-179.9-176.800000112
10S46.9Very low48.2Very low103 Ų103173.2 Ų173.272%0.7284%0.844SS**  trans87.6139.2-179.4-139.50000113.1
11E40.8Very low48.1Very low140 Ų140171 Ų17165%0.65484%0.842SS**  cis-171.3151.524.2-158.4167.1119.800109.9
12K43.7Very low48Very low169 Ų169167.4 Ų167.474%0.73583%0.826SS**  trans61104.1153.1-84.4166.1-171.4150.10122.7
13E44.6Very low48.3Very low179 Ų179169 Ų16984%0.83683%0.83SS**  29.1116.4112.3-149.7-177171.300120.7
14Q41.2Very low47.4Very low173 Ų173168.7 Ų168.781%0.80883%0.828SS**  -179.8110.9123.8-101.318036.500110.1
15T37Very low46.6Very low141 Ų141163.6 Ų163.687%0.86583%0.828SS**  trans-126119.2161.642.10000110.6
16Q43.8Very low45.6Very low180 Ų180157.6 Ų157.684%0.84182%0.823SS**PPolyproline II helixtrans-69.4126.5-178.1-65.8175.7-13.200110.9
17K47.9Very low44.9Very low203 Ų203157.6 Ų157.688%0.88383%0.826SS**PPolyproline II helixtrans-84.1119.8171.8-62.1-179.7-178.2175.70109.7
18K48.2Very low44.8Very low199 Ų199161.1 Ų161.187%0.86583%0.828SS**PPolyproline II helixtrans-84.6124167.1-68.5-179.1179.7177.10109.6
19K47.8Very low45.2Very low203 Ų203161.9 Ų161.988%0.88382%0.823SS**PPolyproline II helixtrans-79.6123.6175.5-68.9178.2177.5178.80109.7
20L46.9Very low45.2Very low171 Ų171162.8 Ų162.890%0.89582%0.815SS**PPolyproline II helixtrans-97.1117.6166.8-79.4163.4000108.9
21T46Very low45.2Very low129 Ų129168.3 Ų168.379%0.79183%0.826SS**  trans-86.4111.7176.853.30000109.6Q23T21-Q23 PolarHBondContact O-N 3.48Å
22L42.9Very low45.6Very low163 Ų163168.5 Ų168.585%0.85383%0.829SS**  trans-80.8106.4171.3-119.688.4000109.6
23Q52.9Low45.8Very low191 Ų191168.3 Ų168.389%0.89383%0.828SS**  trans-75.9129163.9-75.5-138.4-49.500110T21T21-Q23 PolarHBondContact O-N 3.48Å
24R42.2Very low45.8Very low241 Ų241168.5 Ų168.591%0.90983%0.829SS**  trans-91114.7172.4-63.4168.892.3148.72107.7
25S45Very low46.1Very low123 Ų123169.4 Ų169.486%0.8683%0.83SS**  trans-84.9116.2161.846.40000109.2
26S43.3Very low46.7Very low115 Ų115168.9 Ų168.980%0.80483%0.829SS**  trans-81.5126.1166149.30000108
27S44.2Very low46.3Very low114 Ų114166.3 Ų166.380%0.79783%0.825SS**  trans-143.2102.8161.3-1700000109.7
28F45.8Very low45.8Very low183 Ų183161.7 Ų161.780%0.80382%0.819SS**  trans-87.8122.3168.4178.2-91.6000107.1
29K52.2Low45.5Very low186 Ų186157.7 Ų157.781%0.80981%0.813SS**  trans-152.9116.8163.6-135.3168-176.7175.60111.9
30D45.8Very low44.5Very low113 Ų113153.9 Ų153.960%0.60481%0.81SS**  trans3.7135.5154.9-67.5-67.6000119.4
31F47.9Very low43.9Very low218 Ų218151.3 Ų151.396%0.95680%0.802SS**  -145.3117.1125-103.8-80.1000110.9
32M48.7Very low44Very low144 Ų144150.2 Ų150.271%0.70980%0.797SS**  trans-95.1141.4173.4-138-155.6177.300109
33K48Very low43.3Very low165 Ų165149.4 Ų149.472%0.71779%0.794SS**  trans72.5134165.5-59.1166.8175.7176.30113.9
34H43.8Very low42.8Very low184 Ų184150.1 Ų150.185%0.85279%0.794SS**  -149145.867.7-75.7-92.3000113.7
35K48Very low42.3Very low191 Ų191147.2 Ų147.283%0.8379%0.791SS**PPolyproline II helixtrans-77.9150.9160.8-62.1-173.8175.4-173.40109.8
36P49.6Very low41.5Very low130 Ų130151.6 Ų151.684%0.84480%0.795SS**PPolyproline II helixtrans-101.7123.9146.830.3-25.2000111
37T35.3Very low40.7Very low126 Ų126151.7 Ų151.777%0.77379%0.79SS**PPolyproline II helixtrans-78134.2169.6-78.40000109.6
38S37.2Very low40Very low106 Ų106153.2 Ų153.274%0.74179%0.789SS**PPolyproline II helixtrans-72.3153.8162.447.90000112
39P41.4Very low39.3Very low116 Ų116150.3 Ų150.375%0.75378%0.782SS**  -144.1138.7110.429.4-10.4000112.6
40C28.4Very low38Very low122 Ų122149.5 Ų149.582%0.82478%0.781SS**  77.7129.782.3-155.20000114.3
41T33.5Very low37.3Very low117 Ų117151.9 Ų151.972%0.71879%0.788SS**  trans-64.8172.2179.154.50000112.9
42P47.2Very low36.3Very low107 Ų107147.4 Ų147.470%0.69578%0.778SS**  -150.9151.784.931.9-9.4000118
43D29Very low35.3Very low145 Ų145143.7 Ų143.778%0.77578%0.777SS**  trans48120.8130.7-46.4-30.2000122.4
44K42.4Very low34.2Very low207 Ų207143.9 Ų143.990%0.978%0.78SS**  -173.9132.6114.5-115.6166.4177.4166.50115.3
45E32.3Very low33.3Very low180 Ų180141.1 Ų141.184%0.84177%0.772SS**  trans-61.5145.5167.4-59.4159.8148.900112.7
46F27Very low32.2Very low214 Ų214137 Ų13794%0.93976%0.763SS**  trans-153122.7144.2-138.9-97000111.9
47T26.6Very low31.1Very low117 Ų117135.9 Ų135.972%0.71875%0.753SS**  trans-69.6146.7168.5-56.40000111.5
48L28.9Very low30.7Very low147 Ų147137.1 Ų137.177%0.7775%0.75SS**  153.7121.7129.2-168.3140.6000114.6
49D31.2Very low30.4Very low122 Ų122139.7 Ų139.765%0.65275%0.75SS**  trans38.8125.5146.5-68.4-116.6000125.4
50E26.5Very low29.8Very low169 Ų169141.6 Ų141.679%0.7975%0.749SS**  42.6114.8114.4-161.5176.8122.200119.6
51H30.3Very low29.7Very low163 Ų163140.4 Ų140.476%0.75575%0.748SS**  -175.3141.4116-148.8-99.4000114.3
52V25.9Very low29.6Very low124 Ų124140 Ų14075%0.75275%0.745SS**  trans-30.5149.6165.7167.90000119.4
53G28.3Very low29Very low65 Ų65144 Ų14467%0.6775%0.751SS**  trans14292148.900000112.5
54E24.5Very low29Very low170 Ų170142.7 Ų142.779%0.79475%0.754SS**  62.112483.8-151.5-173.8145.500115
55N25Very low28.7Very low126 Ų126136.9 Ų136.967%0.67475%0.752SS**  trans96.2117.5151.9-87.8-28.9000121.9
56V26.4Very low28.7Very low105 Ų105133.4 Ų133.464%0.63675%0.748SS**  95.8118115.11550000119.5
57T25Very low29.8Very low105 Ų105133 Ų13364%0.64475%0.746SS**  trans65.5149.9141.263.40000116.6
58E26.9Very low30.5Very low153 Ų153135.7 Ų135.772%0.71576%0.755SS**  cis176.61627.3-120.1168.8-170.600104.7
59E30.9Very low31.1Very low159 Ų159131.4 Ų131.474%0.74375%0.747SS**  trans73.5108.9145.9-55.8-97.2130.800117.1
60E28.6Very low32.3Very low157 Ų157136 Ų13673%0.73476%0.761SS**  77.7117.785.9-85.9-84.3139.800113.5
61A28.3Very low33.8Very low96 Ų96137 Ų13779%0.79376%0.763SS**  trans169.180.314300000113.1
62V29.8Very low34.5Very low108 Ų108140.8 Ų140.866%0.65577%0.77SS**  18.5143.1125.3-173.70000121.5
63K34.5Very low35.9Very low191 Ų191145.7 Ų145.783%0.8378%0.776SS**  trans93.9111.9150.7-89.8151.8-165.6168.70119.4
64S29.3Very low37Very low119 Ų119149.5 Ų149.583%0.83278%0.781SS**  -172117.8100.750.20000112.4
65G36.3Very low38.5Very low84 Ų84147.8 Ų147.887%0.86678%0.781SS**  trans-73.7138169.300000111.5
66S32.1Very low40Very low107 Ų107149.9 Ų149.975%0.74879%0.791SS**  trans-137.2106.2162.3-168.80000109.7L68S66-L68 PolarHBondContact O-N 3.37Å
67K51.1Low41.3Very low205 Ų205150.1 Ų150.189%0.89180%0.797SS**  trans-47.1127.6161-74.4162.2174.7157.90108.6
68L40.2Very low42.9Very low174 Ų174156.4 Ų156.491%0.91181%0.809SS**  trans-178.2125.4149.5-97.5152.6000109.4S66S66-L68 PolarHBondContact O-N 3.37Å
69G43.1Very low44.5Very low58 Ų58155.1 Ų155.160%0.59881%0.812SS**  trans15929.9161.100000121.1K71G69-K71 PolarHBondContact O-N 3.09Å
70K56.3Low45.3Very low217 Ų217156.2 Ų156.294%0.94382%0.819SS**  trans-66.166.3162.6-68.8178.4179.5174.80111.3
71K58.2Low46.8Very low191 Ų191155 Ų15583%0.8382%0.822SS**  trans-15363.7177.1-63-172.1177.4178.40113G69G69-K71 PolarHBondContact O-N 3.09Å
72W43.3Very low48.4Very low242 Ų242162.2 Ų162.292%0.91783%0.829SS**  trans-11713.4167.3-80.879.6000114.3
73R55.1Low49.7Very low228 Ų228166.7 Ų166.786%0.8684%0.84SS**SBendtrans-97.495.7164.5-61.6-150.8-60.3-100.14.6108
74N53Low50.6Low145 Ų145164.7 Ų164.778%0.77584%0.844SS**SBendtrans164.933.9148.1-80.1-2.7000113.9
75V55.8Low51.4Low134 Ų134164.8 Ų164.881%0.81284%0.844SS**SBendtrans-123.748.3171.8-1650000110.9
76I55.4Low52.3Low170 Ų170170.8 Ų170.887%0.87285%0.847SS**SBendtrans-142.239.6168.3-43.4178000111.6
77S55.4Low53.1Low109 Ų109174.8 Ų174.876%0.76286%0.856SS**  trans-152.252.7178.535.40000113.8
78R57.3Low53.1Low237 Ų237171.7 Ų171.789%0.89485%0.854SS**SBendtrans-124-3.6175.5-149.2158.887.4175.73.9118.3
79T59.8Low53.3Low127 Ų127172.9 Ų172.978%0.77986%0.855SS**SBendtrans-155.173.4-178.555.10000114
80M49.4Very low53.4Low181 Ų181180.2 Ų180.289%0.89287%0.87SS**  trans-156.148.3167.8-106.8-59.4119.800114.1
81T60.1Low52.9Low132 Ų132174.4 Ų174.481%0.8186%0.863SS**  trans-147.595.5163.848.10000111.7
82R60.9Low52Low247 Ų247173.9 Ų173.993%0.93287%0.868SS**  trans172.297.5147.6-97.4158165.7-137.5-5.7109.8
83K57.7Low52Low203 Ų203167.1 Ų167.188%0.88386%0.864SS**SBendtrans167.892.5144.6-96.4169.6165.4-172.20109.6
84T52.4Low51.4Low148 Ų148165.4 Ų165.491%0.90887%0.865SS**  trans174.772.2145.247.40000107.8
85S47.5Very low50.5Low121 Ų121167.3 Ų167.385%0.84687%0.87SS**  trans-147.984.4164.8-168.50000107.7
86K54Low49.6Very low210 Ų210165 Ų16591%0.91387%0.872SS**  trans-176.668.1167.2-104.9174.9-175.4-173.90108.9
87M49.9Very low48.7Very low192 Ų192161.1 Ų161.195%0.94687%0.866SS**  trans-156.537.5161-126.6-177.3174.300113
88V50.9Low47.7Very low140 Ų140164.7 Ų164.785%0.84887%0.871SS**SBendtrans-133.186.5165.8-178.20000106.7
89Q44.8Very low46.5Very low199 Ų199159.4 Ų159.493%0.9387%0.87SS**SBendtrans174.961.7159.5-98.5175.817.200108.9
90K45.4Very low45.2Very low211 Ų211156.2 Ų156.292%0.91786%0.862SS**SBendtrans-162.561.8161.9-162.6177.8173.8-178.30109.3
91A44.3Very low44.3Very low95 Ų95156.6 Ų156.679%0.78586%0.862SS**SBendtrans-146.929.3175.600000111.9
92L39.4Very low43Very low180 Ų180158 Ų15894%0.94286%0.859SS**SBendtrans-142.224.7-180-78.8179.1000113.4
93A43.6Very low41.7Very low101 Ų101153 Ų15384%0.83585%0.851SS**SBendtrans-145.355.1-179.200000111.8
94E43.2Very low40.4Very low191 Ų191149.1 Ų149.189%0.89385%0.849SS**SBendtrans-175.385.5153.4-165.7172.3-168.800108.9
95E34.3Very low40.5Very low186 Ų186147.7 Ų147.787%0.86984%0.842SS**  trans176.792.4137.3-111.7-164.4129.400107.5
96G35.5Very low39.6Very low84 Ų84149 Ų14987%0.86685%0.845SS**  trans-111.4106.6151.100000106.1
97A36Very low38.5Very low89 Ų89144.1 Ų144.174%0.73684%0.837SS**  trans-145.4112.915400000107.3
98E34.6Very low37.5Very low184 Ų184139.6 Ų139.686%0.8682%0.824SS**  trans-68.3171.8-18060.4-146.589.300115.1
99S32.8Very low36.6Very low126 Ų126138.9 Ų138.988%0.88182%0.816SS**  trans89122.2168.1-160.30000114.6
100G32.6Very low36Very low60 Ų60138.8 Ų138.862%0.61981%0.813SS**  cis149.4141.614.200000107
101E30.5Very low35.9Very low190 Ų190136.5 Ų136.589%0.88881%0.809SS**  trans90.1111.3156.3-51.2179.713300120.8
102E33.8Very low35.9Very low160 Ų160137.5 Ų137.575%0.74881%0.808SS**  71.1112.4126.8-59.5-93.6120.300122.6
103L31.8Very low35.4Very low143 Ų143135.4 Ų135.475%0.74980%0.798SS**  trans64.9110.9131.3-54.4179.7000123.2
104S32Very low35.2Very low122 Ų122137.4 Ų137.485%0.85379%0.794SS**  trans69.5157.5131.1-116.70000122.6
105P52.7Low34.6Very low117 Ų117133.7 Ų133.776%0.7679%0.789SS**  trans-108.5154.8-155.540.6-32.9000115
106V29.8Very low34.5Very low149 Ų149129.8 Ų129.890%0.90379%0.788SS**  trans-166.2154.2149.372.10000112.2
107S30.1Very low34.3Very low107 Ų107129 Ų12975%0.74878%0.78SS**  trans-77.5172.5-173.2-66.80000117.5
108S30.3Very low34.1Very low97 Ų97133.1 Ų133.168%0.67878%0.784SS**  trans94.6116.2145.4-87.40000120.7
109D31.5Very low34.2Very low126 Ų126134.2 Ų134.267%0.67478%0.781SS**  54.6120.3124.4-53.3-47.1000120.3
110F32.9Very low34.4Very low197 Ų197133.2 Ų133.286%0.86477%0.769SS**  144.6117.1125.9-91.6-87.5000111.9
111L41.6Very low34.7Very low162 Ų162135.2 Ų135.285%0.84877%0.774SS**  trans-78144.8150.4-66.8172.4000107.7
112P44.8Very low35.1Very low117 Ų117132.1 Ų132.176%0.7677%0.767SS**  -149.2142.6102.533.9-15.2000116
113D28.6Very low35Very low136 Ų136129.8 Ų129.873%0.72777%0.767SS**  42.5123.3122-145.640.8000123
114L38.9Very low35.5Very low142 Ų142128.3 Ų128.374%0.74377%0.769SS**  trans45.7115.8143-66.2170.6000120.9
115S32.1Very low35.9Very low113 Ų113129.4 Ų129.479%0.7977%0.771SS**  149.1144.497.461.90000114.4
116A31.8Very low35Very low104 Ų104127.3 Ų127.386%0.8677%0.77SS**  trans63.2121.3147.400000120.4
117G30.2Very low35.6Very low67 Ų67124.9 Ų124.969%0.69176%0.76SS**  trans145.4105.9131.500000117.3
118Q31.8Very low36.1Very low177 Ų177127.2 Ų127.283%0.82776%0.759SS**  89.1118.9127.5-75.9-168.6-37.600121
119R37.6Very low36.6Very low207 Ų207128.8 Ų128.878%0.78176%0.76SS**  trans83.9138.1136.8-62.9170.590.2-153.4-0.3114.8
120T36.6Very low36.9Very low105 Ų105130.3 Ų130.364%0.64477%0.765SS**  cis-174.8144.315.416.10000108.6
121S38.9Very low37.6Very low102 Ų102126.8 Ų126.871%0.71376%0.76SS**  trans64.4141.3138.581.80000118.9
122V39.9Very low38.1Very low124 Ų124125.1 Ų125.175%0.75276%0.759SS**  cis-167.3151.531.6-90.70000110.6
123C31.3Very low37.6Very low111 Ų111124.9 Ų124.975%0.7576%0.76SS**  trans55.4114.3149.5-55.50000121
124S41.3Very low39Very low112 Ų112124 Ų12478%0.78376%0.761SS**  65.1117.179.1-60.20000112.7
125T41.9Very low38.9Very low145 Ų145124 Ų12489%0.8977%0.767SS**  -169.5147.678.149.60000107.7
126G32.9Very low39.3Very low73 Ų73123.7 Ų123.775%0.75376%0.764SS**  cis125.2144.339.800000108.5
127S42.1Very low39.7Very low98 Ų98130.2 Ų130.269%0.68577%0.766SS**  trans93.296.6172.2-146.90000114.7
128E42Very low40.5Very low157 Ų157134.7 Ų134.773%0.73477%0.769SS**  62.612976.893.3-155126.500111.5
129D40.2Very low40.9Very low129 Ų129134.8 Ų134.869%0.6977%0.774SS**  cis-174.6161.237.9-107.2-47000112.1
130M37.9Very low41.1Very low158 Ų158130.4 Ų130.478%0.77878%0.776SS**  trans77.4103.9145.7-73.8-164.8164.100125.5
131T47.4Very low41.1Very low124 Ų124129.8 Ų129.876%0.76178%0.781SS**  trans63.8145.113268.80000123.1
132P51.8Low41.2Very low127 Ų127130.2 Ų130.283%0.82578%0.784SS**  trans-97.4144.417737.5-30000112.9
133S34.8Very low41.4Very low111 Ų111128.9 Ų128.978%0.77678%0.78SS**  trans-155.9141.5160.9176.80000112.1
134P57.8Low42Very low117 Ų117131.4 Ų131.476%0.7679%0.786SS**  trans-100131.7-174.436.2-27.6000112.3
135V36.8Very low42.6Very low142 Ų142137.2 Ų137.286%0.86179%0.791SS**  trans-146.9128.6159.8174.20000111.4
136C40.2Very low42.8Very low107 Ų107139.4 Ų139.472%0.72379%0.791SS**  trans-57.1139170.1174.10000114.4
137R40.1Very low43.2Very low241 Ų241141.1 Ų141.191%0.90979%0.792SS**  trans-169.393.8138.6-107179.5-156.6157.86.3112
138Q47.7Very low43.2Very low162 Ų162144.5 Ų144.576%0.75780%0.801SS**  21.5114.6125.5-166.2177.8-31.300118.3
139L39.5Very low43Very low178 Ų178144 Ų14493%0.93280%0.804SS**  trans-148.7130.6134.4-75.3-174.3000110.2
140S42.6Very low43.4Very low116 Ų116143 Ų14381%0.81181%0.806SS**  trans-70.4144.5-178.2-54.90000113.6
141A36.7Very low43.9Very low92 Ų92139.2 Ų139.276%0.7681%0.808SS**  trans-155.8111.6149.800000110.5
142S40.3Very low43.9Very low110 Ų110141.7 Ų141.777%0.76981%0.805SS**  trans32.6124.4146.359.30000121.2
143S44.1Very low43.6Very low97 Ų97141.9 Ų141.968%0.67881%0.808SS**  63.1109.4126.6-164.90000117
144D44.1Very low44.2Very low164 Ų164142.6 Ų142.688%0.87780%0.798SS**  -155.1129.9123.1-90.1-39.2000111.2
145R53.3Low43.9Very low234 Ų234147.8 Ų147.888%0.88380%0.803SS**  trans-72.2141.4179.1-70.4169.463-178.1-0.4108.6S147R145-S147 PolarHBondContact O-N 3.25Å
146Q46Very low44.3Very low191 Ų191146.5 Ų146.589%0.89379%0.791SS**  trans-45.3124.8174.4-66.4168.8-2600111.8
147S42.8Very low44.7Very low109 Ų109145.8 Ų145.876%0.76279%0.788SS**  trans-58125.6160.354.80000110.3R145R145-S147 PolarHBondContact O-N 3.25Å
148L40.8Very low45Very low168 Ų168142.8 Ų142.888%0.8879%0.786SS**  trans-152.8110147.5-77.7-174.4000109.9
149D39Very low45Very low148 Ų148146.1 Ų146.179%0.79179%0.792SS**  trans81.6142.3134.5-16351.5000121.8
150S46.8Very low45.4Very low106 Ų106146 Ų14674%0.74179%0.791SS**  trans81.657166.3-69.20000117.9
151G49.4Very low45.9Very low79 Ų79148.5 Ų148.581%0.81479%0.79SS**  trans-127.259.916400000112.6
152Y47Very low46.9Very low177 Ų177148.1 Ų148.169%0.69478%0.775SS**  trans-16390163.1-160.6-98.4000111.1
153C46.3Very low47.7Very low131 Ų131148 Ų14889%0.88577%0.774SS**  trans-101.991.8159520000109.1
154Q47.6Very low49.1Very low125 Ų125145.7 Ų145.758%0.58476%0.761SS**  trans39.383.2141.5-131.170.816.300116.9D156Q154-D156 VanDerWaalsContact C-N 3.25Å; Q154-D156 PolarHBondContact O-N 2.6Å
155R51.7Low50.8Low227 Ų227141.1 Ų141.186%0.85773%0.732SS**SBendtrans-88.518.9168.2-148.2-138.3-152.5-173.78.1113.8
156D45.1Very low52.1Low114 Ų114137.4 Ų137.461%0.6173%0.729SS**  trans-144.378.2-179.1-74.6-61.4000111.1Q154Q154-D156 VanDerWaalsContact C-N 3.25Å; Q154-D156 PolarHBondContact O-N 2.6Å
157S47Very low53.8Low93 Ų93129.4 Ų129.465%0.6570%0.699SS**  trans-141.249.3168.9-62.30000111.2R159S157-R159 PolarHBondContact O-N 3.47Å
158M47.5Very low55.9Low177 Ų177127.7 Ų127.787%0.87269%0.685SS**  trans-84.520.4167.260.6-162.9-75.900112.9L160M158-L160 PolarHBondContact O-N 2.93Å
159R46.9Very low58.3Low233 Ų233123.1 Ų123.188%0.87966%0.658SS**  trans-82.199.5165.7-81.8-170.4152.589.21.8108S157 E161S157-R159 PolarHBondContact O-N 3.47Å; R159-E161 PolarHBondContact O-N 3.42Å
160L48.9Very low60.7Low176 Ų176118.7 Ų118.792%0.92164%0.638SS**  trans-64.769.6169.9-179.6111.5000110.3M158M158-L160 PolarHBondContact O-N 2.93Å
161E52.3Low62.8Low168 Ų168113.9 Ų113.979%0.78561%0.605SS**SBendtrans-144.4119.6173.1-107.9-76.6113.100108.5R159R159-E161 PolarHBondContact O-N 3.42Å
162D57.3Low65Low84 Ų84113 Ų11345%0.44958%0.578SS.*  trans45.579.9176-141.717.1000115.5A164D162-A164 PolarHBondContact O-N 3.23Å
163S58.5Low67.3Low107 Ų107104.6 Ų104.675%0.74854%0.544SS*.  trans-59.987.4167.5-72.70000109.5Y165S163-Y165 PolarHBondContact O-N 3.36Å
164A73.1Confident69.6Low49 Ų49100.2 Ų100.241%0.40551%0.514SS..  trans-60.891.6170.300000107.7D162 N166D162-A164 PolarHBondContact O-N 3.23Å; A164-N166 PolarHBondContact O-N 3.28Å; A164-N166 PolarHBondContact O-ND2 3.22Å
165Y79.6Confident72Confident68 Ų6894.4 Ų94.427%0.26749%0.486SS..  trans-58.1114.6174.1178.8-92000107.7S163 G167 P168 F169 I200 K211 V216S163-Y165 PolarHBondContact O-N 3.36Å; Y165-G167 WeakPolarHBondContact CE1-O 3.43Å; Y165-G167 VanDerWaalsContact CZ-CA 3.4Å; Y165-P168 PolarHBondContact OH-O 3.44Å; Y165-F169 HydrophobicContact CD1-CD1 4.39Å; Y165-F169 AromaticContact CD1-CE1 3.61Å; Y165-F169 HydrophobicContact CD1-CE1 3.61Å; Y165-F169 AromaticContact CD1-CZ 3.75Å; Y165-F169 HydrophobicContact CD1-CZ 3.75Å; Y165-F169 HydrophobicContact CE1-CD1 4.22Å; Y165-F169 AromaticContact CE1-CE1 3.89Å; Y165-F169 HydrophobicContact CE1-CE1 3.89Å; Y165-F169 HydrophobicContact CE1-CZ 4.24Å; Y165-I200 HydrophobicContact CD1-CD1 3.49Å; Y165-I200 VanDerWaalsContact CD1-CD1 3.49Å; Y165-I200 HydrophobicContact CD1-CG1 3.77Å; Y165-I200 HydrophobicContact CD2-CD1 3.93Å; Y165-I200 HydrophobicContact CE1-CB 4.32Å; Y165-I200 HydrophobicContact CE1-CD1 3.74Å; Y165-I200 HydrophobicContact CE1-CG1 3.54Å; Y165-I200 HydrophobicContact CE1-CG2 3.96Å; Y165-I200 HydrophobicContact CE2-CD1 4.16Å; Y165-I200 HydrophobicContact CE2-CG1 4.5Å; Y165-I200 HydrophobicContact CE2-CG2 3.81Å; Y165-I200 HydrophobicContact CG-CD1 3.59Å; Y165-I200 HydrophobicContact CG-CG1 4.34Å; Y165-I200 VanDerWaalsContact CZ-CG2 3.44Å; Y165-I200 WeakPolarHBondContact OH-CG2 3.18Å; Y165-K211 PolarHBondContact O-NZ 3.3Å; Y165-V216 VanDerWaalsContact CB-CG2 3.43Å; Y165-V216 HydrophobicContact CG-CG2 4.46Å
166N80Confident74.1Confident155 Ų15586.7 Ų86.783%0.82946%0.46SS*.  trans-105.513176.3-76.2-68000111A164A164-N166 PolarHBondContact O-N 3.28Å; A164-N166 PolarHBondContact O-ND2 3.22Å
167G82.1Confident76.6Confident24 Ų2483.9 Ų83.925%0.24745%0.447CS..SBendtrans-79.7175176.600000112.7Y165Y165-G167 WeakPolarHBondContact CE1-O 3.43Å; Y165-G167 VanDerWaalsContact CZ-CA 3.4Å
168P87.1Confident78.9Confident72 Ų7284.4 Ų84.447%0.46844%0.442SS..  trans-71.2135.9-179.429.6-34.1000111.6Y165Y165-P168 PolarHBondContact OH-O 3.44Å
169F91Very high81.2Confident73 Ų7378.5 Ų78.532%0.3241%0.412SS..  trans-87.9142.3169.3-59.2-72.7000110.4Y165 H198 I199 I200 K211Y165-F169 HydrophobicContact CD1-CD1 4.39Å; Y165-F169 AromaticContact CD1-CE1 3.61Å; Y165-F169 HydrophobicContact CD1-CE1 3.61Å; Y165-F169 AromaticContact CD1-CZ 3.75Å; Y165-F169 HydrophobicContact CD1-CZ 3.75Å; Y165-F169 HydrophobicContact CE1-CD1 4.22Å; Y165-F169 AromaticContact CE1-CE1 3.89Å; Y165-F169 HydrophobicContact CE1-CE1 3.89Å; Y165-F169 HydrophobicContact CE1-CZ 4.24Å; F169-H198 HydrophobicContact CD1-CB 3.47Å; F169-H198 VanDerWaalsContact CD1-CB 3.47Å; F169-H198 HydrophobicContact CD2-CB 4.39Å; F169-H198 HydrophobicContact CE1-CB 3.64Å; F169-H198 HydrophobicContact CG-CB 3.87Å; F169-H198 HydrophobicContact CZ-CB 4.2Å; F169-I199 CarbonylContact C-O 3.58Å; F169-I199 VanDerWaalsContact CA-O 3.29Å; F169-I199 WeakPolarHBondContact CA-O 3.42Å; F169-I199 WeakPolarHBondContact CB-O 3.4Å; F169-I200 HydrophobicContact CD1-CG1 3.75Å; F169-I200 HydrophobicContact CE1-CD1 4.21Å; F169-I200 HydrophobicContact CE1-CG1 3.71Å; F169-K211 HydrophobicContact CE1-CB 3.88Å; F169-K211 HydrophobicContact CE1-CD 4.15Å; F169-K211 HydrophobicContact CZ-CB 4.37Å; F169-K211 HydrophobicContact CZ-CD 3.8Å
170C89.6Confident83.4Confident54 Ų5472.3 Ų72.337%0.36540%0.4SS..  trans-99-2.9179.162.30000113.8I199 I200C170-I199 PolarHBondContact N-O 3.48Å; C170-I199 WeakPolarHBondContact SG-CG2 3.3Å; C170-I199 PolarHBondContact SG-O 2.95Å; C170-I199 VanDerWaalsContact SG-O 3.34Å; C170-I200 VanDerWaalsContact SG-C 3.52Å; C170-I200 PolarHBondContact SG-O 3.29Å
171G91.5Very high85.5Confident6 Ų665.1 Ų65.16%0.06236%0.364CS..EExtended strand (participates in β ladder)trans166.5-173164.600000113.2I199 D229G171-I199 PolarHBondContact O-N 3.39Å; G171-D229 VanDerWaalsContact CA-CG 3.49Å; G171-D229 WeakPolarHBondContact CA-OD1 3.22Å; G171-D229 WeakPolarHBondContact CA-OD2 3.31Å
172R94.4Very high87.4Confident61 Ų6160.2 Ų60.223%0.2335%0.348CS..EExtended strand (participates in β ladder)trans-118.2147.5172.2-60.3-175.8-58.3-163.26.4111.1I196 I197 L227 D229 E230R172-I196 HydrophobicContact CB-CG2 4.33Å; R172-I197 WeakPolarHBondContact CA-O 3.01Å; R172-L227 HydrophobicContact CB-CB 4.45Å; R172-L227 PolarHBondContact O-N 3.47Å; R172-D229 PolarHBondContact N-OD1 2.87Å; R172-E230 VanDerWaalsContact NH2-CB 3.33Å; R172-E230 IonicContact NH2-OE2 2.63Å
173A94.9Very high89Confident0 Ų062 Ų620%036%0.364CS..EExtended strand (participates in β ladder)trans-138148.2171.100000111I196 I197 I199 V224 N225A173-I196 CarbonylContact O-C 3.45Å; A173-I196 WeakPolarHBondContact O-CA 3.16Å; A173-I197 PolarHBondContact N-O 2.87Å; A173-I197 PolarHBondContact O-N 3.07Å; A173-I199 HydrophobicContact CB-CD1 3.84Å; A173-I199 HydrophobicContact CB-CG1 4.27Å; A173-V224 HydrophobicContact CB-CB 3.9Å; A173-V224 HydrophobicContact CB-CG2 3.72Å; A173-N225 CarbonylContact C-O 3.49Å; A173-N225 VanDerWaalsContact CA-O 3.23Å; A173-N225 WeakPolarHBondContact CA-O 3.49Å; A173-N225 WeakPolarHBondContact CB-O 3.27Å
174V96.3Very high90.6Very high39 Ų3967.1 Ų67.124%0.23637%0.369CS..EExtended strand (participates in β ladder)trans-102.7130.4175163.30000108H176 D195 I196 V224 N225 L227V174-H176 PolarHBondContact O-N 2.65Å; V174-D195 CarbonylContact C-O 3.57Å; V174-D195 WeakPolarHBondContact CA-O 3.45Å; V174-I196 HydrophobicContact CG2-CG1 3.79Å; V174-V224 CarbonylContact O-C 3.59Å; V174-V224 WeakPolarHBondContact O-CA 3.35Å; V174-N225 PolarHBondContact N-O 3.04Å; V174-N225 PolarHBondContact O-N 3.48Å; V174-L227 HydrophobicContact CB-CD1 3.38Å; V174-L227 HydrophobicContact CG2-CD1 3.21Å; V174-L227 HydrophobicContact CG2-CD2 3.64Å; V174-L227 HydrophobicContact CG2-CG 4.06Å; V174-L227 VanDerWaalsContact N-CD1 3.26Å
175V96.9Very high91.3Very high2 Ų267.8 Ų67.81%0.01237%0.365CS..EExtended strand (participates in β ladder)trans-68127.5174.2178.70000109.5T177 L191 Q192 G194 D195 I197 V224V175-T177 WeakPolarHBondContact CG1-O 3.18Å; V175-L191 HydrophobicContact CG1-CB 3.75Å; V175-L191 HydrophobicContact CG1-CD1 4.49Å; V175-L191 HydrophobicContact CG2-CB 4.02Å; V175-L191 HydrophobicContact CG2-CD1 4.44Å; V175-L191 HydrophobicContact CG2-CD2 4.22Å; V175-L191 HydrophobicContact CG2-CG 4.46Å; V175-Q192 VanDerWaalsContact CB-O 3.24Å; V175-Q192 WeakPolarHBondContact CB-O 3.44Å; V175-Q192 VanDerWaalsContact CG1-O 3.31Å; V175-Q192 WeakPolarHBondContact CG1-O 3.5Å; V175-G194 PolarHBondContact O-N 3.3Å; V175-D195 HydrophobicContact CB-CB 4.28Å; V175-D195 HydrophobicContact CG2-CB 3.9Å; V175-D195 PolarHBondContact N-O 2.83Å; V175-I197 HydrophobicContact CG2-CD1 3.75Å; V175-I197 HydrophobicContact CG2-CG1 3.9Å; V175-V224 HydrophobicContact CG2-CG1 4.03Å
176H96.2Very high91.8Very high65 Ų6570.8 Ų70.830%0.30139%0.391SS..  trans-105.9-17.2172.866.171.4000113.1V174 K193 I222 Y223 V224 N225V174-H176 PolarHBondContact O-N 2.65Å; H176-K193 WeakPolarHBondContact O-CD 3.38Å; H176-K193 WeakPolarHBondContact O-CG 3.45Å; H176-I222 PolarHBondContact CE1-O 3.34Å; H176-I222 PolarHBondContact NE2-O 3.14Å; H176-I222 VanDerWaalsContact NE2-O 3.16Å; H176-Y223 VanDerWaalsContact CD2-C 3.47Å; H176-Y223 PolarHBondContact CD2-O 3.06Å; H176-Y223 PolarHBondContact N-O 2.61Å; H176-V224 VanDerWaalsContact CD2-C 3.41Å; H176-V224 PolarHBondContact CD2-N 2.98Å; H176-V224 PolarHBondContact NE2-N 3.03Å; H176-N225 PolarHBondContact CD2-OD1 3.31Å
177T96.9Very high92.3Very high56 Ų5670.1 Ų70.134%0.34438%0.382SS..SBendtrans-127.6130.3-179.7-61.40000110.7V175 Y223V175-T177 WeakPolarHBondContact CG1-O 3.18Å; T177-Y223 HydrophobicContact CG2-CD1 3.85Å; T177-Y223 HydrophobicContact CG2-CE1 4.33Å; T177-Y223 PolarHBondContact N-O 3.34Å
178D95.8Very high92.9Very high103 Ų10370 Ų7055%0.55138%0.378SS*.  trans-65.6136.7175.2-62.3-46.3000111.4Q192 K193D178-Q192 VanDerWaalsContact OD1-CA 3.27Å; D178-Q192 WeakPolarHBondContact OD1-CA 3.47Å; D178-K193 WeakPolarHBondContact OD1-CB 3.19Å; D178-K193 PolarHBondContact OD1-N 3.14Å
179F94.8Very high93.2Very high54 Ų5467 Ų6724%0.23736%0.358CS..BIsolated β-bridgetrans-140.2123.9175175.8-107.2000110.5P181 L189 K190 L191 Y223F179-P181 HydrophobicContact CE1-CB 3.88Å; F179-P181 HydrophobicContact CE1-CG 4.49Å; F179-P181 HydrophobicContact CZ-CB 4.22Å; F179-L189 WeakPolarHBondContact CD1-O 3.32Å; F179-K190 CarbonylContact O-C 3.52Å; F179-K190 WeakPolarHBondContact O-CA 3.24Å; F179-L191 HydrophobicContact CB-CB 4.06Å; F179-L191 HydrophobicContact CB-CD1 4.07Å; F179-L191 HydrophobicContact CB-CG 4.09Å; F179-L191 HydrophobicContact CD1-CG 4.41Å; F179-L191 PolarHBondContact N-O 3.47Å; F179-L191 PolarHBondContact O-N 3.34Å; F179-Y223 HydrophobicContact CB-CD2 4.12Å; F179-Y223 HydrophobicContact CB-CE2 4.17Å; F179-Y223 AromaticContact CD2-CE2 3.82Å; F179-Y223 HydrophobicContact CD2-CE2 3.82Å; F179-Y223 HydrophobicContact CE2-CE2 4.39Å; F179-Y223 HydrophobicContact CG-CD2 4.27Å; F179-Y223 AromaticContact CG-CE2 3.93Å; F179-Y223 HydrophobicContact CG-CE2 3.93Å
180T93.9Very high93.4Very high102 Ų10269.1 Ų69.163%0.62637%0.367SS*.  trans-112.6112.5173.3-59.90000108.7
181P92.6Very high93.6Very high25 Ų2566.6 Ų66.616%0.16235%0.35CS..  trans-67.6162.4179.227.9-34.5000111.6F179 D185 K190F179-P181 HydrophobicContact CE1-CB 3.88Å; F179-P181 HydrophobicContact CE1-CG 4.49Å; F179-P181 HydrophobicContact CZ-CB 4.22Å; P181-D185 HydrophobicContact CB-CB 4.29Å; P181-K190 HydrophobicContact CG-CB 4.48Å
182S92.2Very high93.8Very high65 Ų6571.3 Ų71.346%0.45537%0.37SS..  trans-63145.8172-179.10000110Y184 D185S182-Y184 PolarHBondContact O-N 3.02Å; S182-D185 WeakPolarHBondContact O-CB 3.44Å; S182-D185 PolarHBondContact O-N 3.1Å
183P90.9Very high93.9Very high121 Ų12175.5 Ų75.579%0.78639%0.39SS*.THydrogen-bonded Turntrans-56-20.6175.6-26.835.3000114.9
184Y92.1Very high93.9Very high216 Ų21677.9 Ų77.985%0.84741%0.414SS*.THydrogen-bonded Turntrans-86.6-13.1176.3-59-75.6000113.6S182 V186S182-Y184 PolarHBondContact O-N 3.02Å; Y184-V186 PolarHBondContact O-N 3.19Å
185D89.4Confident93.9Very high62 Ų6277.6 Ų77.633%0.33241%0.412SS..  trans-95.675.4-178.8-171.50.7000109.9P181 S182 E187 S188P181-D185 HydrophobicContact CB-CB 4.29Å; S182-D185 WeakPolarHBondContact O-CB 3.44Å; S182-D185 PolarHBondContact O-N 3.1Å; D185-E187 PolarHBondContact O-N 3.41Å; D185-S188 VanDerWaalsContact CG-CB 3.43Å; D185-S188 PolarHBondContact O-N 3.23Å; D185-S188 PolarHBondContact OD1-N 3.21Å; D185-S188 PolarHBondContact OD1-OG 3Å; D185-S188 WeakPolarHBondContact OD2-CB 3.24Å; D185-S188 PolarHBondContact OD2-OG 3.18Å
186V88.5Confident93.8Very high131 Ų13181.5 Ų81.579%0.79443%0.431SS*.THydrogen-bonded Turntrans-69-16.3-178.9-63.30000113.1Y184Y184-V186 PolarHBondContact O-N 3.19Å
187E90.7Very high93.8Very high141 Ų14178.4 Ų78.466%0.65942%0.417SS*.THydrogen-bonded Turntrans-89.9-19.9-178.5-61.6-173.5169.700112D185 G217 S218D185-E187 PolarHBondContact O-N 3.41Å; E187-G217 CarbonylContact O-C 3.55Å; E187-G217 VanDerWaalsContact O-C 3.31Å; E187-G217 WeakPolarHBondContact O-CA 3.27Å; E187-S218 PolarHBondContact O-N 3.34Å
188S94.4Very high93.6Very high22 Ų2279.3 Ų79.315%0.15442%0.417CS..BIsolated β-bridgetrans-83139.3179.6-78.10000113.3D185 S218D185-S188 VanDerWaalsContact CG-CB 3.43Å; D185-S188 PolarHBondContact O-N 3.23Å; D185-S188 PolarHBondContact OD1-N 3.21Å; D185-S188 PolarHBondContact OD1-OG 3Å; D185-S188 WeakPolarHBondContact OD2-CB 3.24Å; D185-S188 PolarHBondContact OD2-OG 3.18Å; S188-S218 CarbonylContact C-O 3.59Å; S188-S218 WeakPolarHBondContact CA-O 3.21Å
189L93.6Very high93.6Very high8 Ų874.4 Ų74.44%0.04239%0.391CS..PPolyproline II helixtrans-77.7132.8173.4-65.7175.7000110.7F179 L191 I197 L212 K215 S218 F219F179-L189 WeakPolarHBondContact CD1-O 3.32Å; L189-L191 HydrophobicContact CB-CD2 3.75Å; L189-L191 PolarHBondContact O-N 3.27Å; L189-I197 HydrophobicContact CD1-CG2 4.24Å; L189-L212 HydrophobicContact CD1-CB 3.97Å; L189-L212 HydrophobicContact CD2-CB 4.35Å; L189-K215 HydrophobicContact CD2-CB 4.15Å; L189-S218 PolarHBondContact N-O 3.04Å; L189-F219 HydrophobicContact CD1-CD1 4Å
190K94.9Very high93.5Very high119 Ų11973.1 Ų73.152%0.51739%0.387SS..PPolyproline II helixtrans-72.8121.1163-177.1-178.4179.2-1760108.5F179 P181 L212F179-K190 CarbonylContact O-C 3.52Å; F179-K190 WeakPolarHBondContact O-CA 3.24Å; P181-K190 HydrophobicContact CG-CB 4.48Å; K190-L212 VanDerWaalsContact O-CD2 3.24Å; K190-L212 WeakPolarHBondContact O-CD2 3.35Å
191L95.4Very high93.5Very high1 Ų172.5 Ų72.51%0.00538%0.38CS..BIsolated β-bridgetrans-107.6134.1-177.8-48.5-176.8000109.9V175 F179 L189 I197 L212 F219 Y223V175-L191 HydrophobicContact CG1-CB 3.75Å; V175-L191 HydrophobicContact CG1-CD1 4.49Å; V175-L191 HydrophobicContact CG2-CB 4.02Å; V175-L191 HydrophobicContact CG2-CD1 4.44Å; V175-L191 HydrophobicContact CG2-CD2 4.22Å; V175-L191 HydrophobicContact CG2-CG 4.46Å; F179-L191 HydrophobicContact CB-CB 4.06Å; F179-L191 HydrophobicContact CB-CD1 4.07Å; F179-L191 HydrophobicContact CB-CG 4.09Å; F179-L191 HydrophobicContact CD1-CG 4.41Å; F179-L191 PolarHBondContact N-O 3.47Å; F179-L191 PolarHBondContact O-N 3.34Å; L189-L191 HydrophobicContact CB-CD2 3.75Å; L189-L191 PolarHBondContact O-N 3.27Å; L191-I197 HydrophobicContact CD2-CD1 3.48Å; L191-I197 VanDerWaalsContact CD2-CD1 3.48Å; L191-I197 HydrophobicContact CD2-CG1 4.47Å; L191-L212 HydrophobicContact CD2-CD2 3.91Å; L191-F219 HydrophobicContact CD1-CB 4.01Å; L191-F219 HydrophobicContact CD2-CB 4.18Å; L191-Y223 HydrophobicContact CD1-CD2 4.07Å; L191-Y223 HydrophobicContact CD1-CG 4.43Å
192Q95.9Very high93.5Very high104 Ų10476.7 Ų76.749%0.48640%0.395SS..  trans-117.4141.2166.2-51.5-167.4-71.200109.9V175 D178 G194 D195V175-Q192 VanDerWaalsContact CB-O 3.24Å; V175-Q192 WeakPolarHBondContact CB-O 3.44Å; V175-Q192 VanDerWaalsContact CG1-O 3.31Å; V175-Q192 WeakPolarHBondContact CG1-O 3.5Å; D178-Q192 VanDerWaalsContact OD1-CA 3.27Å; D178-Q192 WeakPolarHBondContact OD1-CA 3.47Å; Q192-G194 PolarHBondContact O-N 3.04Å; Q192-D195 WeakPolarHBondContact CB-OD2 3.33Å; Q192-D195 PolarHBondContact N-OD2 2.84Å; Q192-D195 WeakPolarHBondContact O-CB 3.41Å; Q192-D195 VanDerWaalsContact O-CG 3.23Å; Q192-D195 PolarHBondContact O-N 3.48Å
193K96.5Very high93.5Very high150 Ų15075.5 Ų75.565%0.65239%0.386SS*.THydrogen-bonded Turntrans-56.3123.5178.5-179.3178.1-179.7-178.50109.4H176 D178H176-K193 WeakPolarHBondContact O-CD 3.38Å; H176-K193 WeakPolarHBondContact O-CG 3.45Å; D178-K193 WeakPolarHBondContact OD1-CB 3.19Å; D178-K193 PolarHBondContact OD1-N 3.14Å
194G94.5Very high93.3Very high49 Ų4975.9 Ų75.951%0.50539%0.388SS..THydrogen-bonded Turntrans99.3-11.3-174.900000114.5V175 Q192V175-G194 PolarHBondContact O-N 3.3Å; Q192-G194 PolarHBondContact O-N 3.04Å
195D95.6Very high93.1Very high33 Ų3371.2 Ų71.218%0.17638%0.382CS..  trans-66.2142.7175.8-75.8-13.2000111.6V174 V175 Q192 L212V174-D195 CarbonylContact C-O 3.57Å; V174-D195 WeakPolarHBondContact CA-O 3.45Å; V175-D195 HydrophobicContact CB-CB 4.28Å; V175-D195 HydrophobicContact CG2-CB 3.9Å; V175-D195 PolarHBondContact N-O 2.83Å; Q192-D195 WeakPolarHBondContact CB-OD2 3.33Å; Q192-D195 PolarHBondContact N-OD2 2.84Å; Q192-D195 WeakPolarHBondContact O-CB 3.41Å; Q192-D195 VanDerWaalsContact O-CG 3.23Å; Q192-D195 PolarHBondContact O-N 3.48Å; D195-L212 HydrophobicContact CB-CD1 3.76Å; D195-L212 HydrophobicContact CB-CD2 4.17Å
196I95.4Very high93.2Very high84 Ų8470.1 Ų70.143%0.43139%0.385SS..EExtended strand (participates in β ladder)trans-102.5115.8176-58.8171.4000109.5R172 A173 V174 L212R172-I196 HydrophobicContact CB-CG2 4.33Å; A173-I196 CarbonylContact O-C 3.45Å; A173-I196 WeakPolarHBondContact O-CA 3.16Å; V174-I196 HydrophobicContact CG2-CG1 3.79Å; I196-L212 WeakPolarHBondContact O-CD1 3.48Å
197I95.2Very high93.4Very high0 Ų067.2 Ų67.20%037%0.368CS..EExtended strand (participates in β ladder)trans-96.7133.1175.7-48.1-178.7000109.5R172 A173 V175 L189 L191 L212 F219 V224R172-I197 WeakPolarHBondContact CA-O 3.01Å; A173-I197 PolarHBondContact N-O 2.87Å; A173-I197 PolarHBondContact O-N 3.07Å; V175-I197 HydrophobicContact CG2-CD1 3.75Å; V175-I197 HydrophobicContact CG2-CG1 3.9Å; L189-I197 HydrophobicContact CD1-CG2 4.24Å; L191-I197 HydrophobicContact CD2-CD1 3.48Å; L191-I197 VanDerWaalsContact CD2-CD1 3.48Å; L191-I197 HydrophobicContact CD2-CG1 4.47Å; I197-L212 HydrophobicContact CG1-CB 4.3Å; I197-L212 HydrophobicContact CG1-CD1 4.38Å; I197-L212 HydrophobicContact CG1-CD2 4.27Å; I197-F219 HydrophobicContact CD1-CD1 4.07Å; I197-F219 HydrophobicContact CD1-CD2 4Å; I197-F219 HydrophobicContact CD1-CE1 4.15Å; I197-F219 HydrophobicContact CD1-CE2 4.11Å; I197-F219 HydrophobicContact CD1-CG 3.98Å; I197-F219 HydrophobicContact CD1-CZ 4.16Å; I197-F219 HydrophobicContact CG2-CD1 4.28Å; I197-F219 HydrophobicContact CG2-CE1 3.72Å; I197-F219 HydrophobicContact CG2-CZ 4.11Å; I197-V224 HydrophobicContact CD1-CG1 3.9Å
198H94.3Very high93.7Very high75 Ų7561.8 Ų61.835%0.34734%0.341SS..EExtended strand (participates in β ladder)trans-87.6111168.3-61.675.5000108.8F169 G210 K211F169-H198 HydrophobicContact CD1-CB 3.47Å; F169-H198 VanDerWaalsContact CD1-CB 3.47Å; F169-H198 HydrophobicContact CD2-CB 4.39Å; F169-H198 HydrophobicContact CE1-CB 3.64Å; F169-H198 HydrophobicContact CG-CB 3.87Å; F169-H198 HydrophobicContact CZ-CB 4.2Å; H198-G210 CarbonylContact O-C 3.59Å; H198-G210 WeakPolarHBondContact O-CA 3.38Å; H198-K211 HydrophobicContact CB-CB 4.41Å; H198-K211 PolarHBondContact N-O 3.16Å; H198-K211 PolarHBondContact O-N 3.29Å
199I94.1Very high93.7Very high1 Ų163 Ų631%0.00535%0.348CS..EExtended strand (participates in β ladder)trans-75.6129.6-175.1-51.8169.2000109F169 C170 G171 A173 K202 W208 F219 L226F169-I199 CarbonylContact C-O 3.58Å; F169-I199 VanDerWaalsContact CA-O 3.29Å; F169-I199 WeakPolarHBondContact CA-O 3.42Å; F169-I199 WeakPolarHBondContact CB-O 3.4Å; C170-I199 PolarHBondContact N-O 3.48Å; C170-I199 WeakPolarHBondContact SG-CG2 3.3Å; C170-I199 PolarHBondContact SG-O 2.95Å; C170-I199 VanDerWaalsContact SG-O 3.34Å; G171-I199 PolarHBondContact O-N 3.39Å; A173-I199 HydrophobicContact CB-CD1 3.84Å; A173-I199 HydrophobicContact CB-CG1 4.27Å; I199-K202 HydrophobicContact CG2-CB 4.18Å; I199-W208 HydrophobicContact CD1-CE3 4Å; I199-W208 HydrophobicContact CD1-CZ3 3.83Å; I199-W208 HydrophobicContact CG2-CE3 4.39Å; I199-F219 HydrophobicContact CG1-CZ 4.32Å; I199-L226 HydrophobicContact CD1-CD2 3.58Å
200I94.1Very high93.8Very high27 Ų2762.7 Ų62.714%0.13835%0.346CS..EExtended strand (participates in β ladder)trans-97.7-49.6176.3-65.8170.6000109.6Y165 F169 C170 T209 K211 V216Y165-I200 HydrophobicContact CD1-CD1 3.49Å; Y165-I200 VanDerWaalsContact CD1-CD1 3.49Å; Y165-I200 HydrophobicContact CD1-CG1 3.77Å; Y165-I200 HydrophobicContact CD2-CD1 3.93Å; Y165-I200 HydrophobicContact CE1-CB 4.32Å; Y165-I200 HydrophobicContact CE1-CD1 3.74Å; Y165-I200 HydrophobicContact CE1-CG1 3.54Å; Y165-I200 HydrophobicContact CE1-CG2 3.96Å; Y165-I200 HydrophobicContact CE2-CD1 4.16Å; Y165-I200 HydrophobicContact CE2-CG1 4.5Å; Y165-I200 HydrophobicContact CE2-CG2 3.81Å; Y165-I200 HydrophobicContact CG-CD1 3.59Å; Y165-I200 HydrophobicContact CG-CG1 4.34Å; Y165-I200 VanDerWaalsContact CZ-CG2 3.44Å; Y165-I200 WeakPolarHBondContact OH-CG2 3.18Å; F169-I200 HydrophobicContact CD1-CG1 3.75Å; F169-I200 HydrophobicContact CE1-CD1 4.21Å; F169-I200 HydrophobicContact CE1-CG1 3.71Å; C170-I200 VanDerWaalsContact SG-C 3.52Å; C170-I200 PolarHBondContact SG-O 3.29Å; I200-T209 WeakPolarHBondContact CA-O 3.49Å; I200-T209 HydrophobicContact CB-CG2 4.46Å; I200-T209 WeakPolarHBondContact CB-O 3.48Å; I200-T209 PolarHBondContact N-O 2.97Å; I200-K211 HydrophobicContact CD1-CB 4.38Å; I200-V216 HydrophobicContact CD1-CG1 3.7Å; I200-V216 HydrophobicContact CD1-CG2 4.28Å
201D93.1Very high93.8Very high89 Ų8958.6 Ų58.648%0.47633%0.328SS..EExtended strand (participates in β ladder)trans-136139.3178.3-169.625.8000111.2T209D201-T209 PolarHBondContact N-O 3.27Å; D201-T209 PolarHBondContact O-N 3.12Å
202K93.3Very high93.7Very high113 Ų11358.9 Ų58.949%0.49133%0.33SS..  trans-129.573.2-17753.9160-143.267.10111.6I199 W208I199-K202 HydrophobicContact CG2-CB 4.18Å; K202-W208 HydrophobicContact CB-CD2 4.06Å; K202-W208 HydrophobicContact CB-CG 4.41Å; K202-W208 HydrophobicContact CB-CZ2 4.23Å
203P92.1Very high93.5Very high39 Ų3959.5 Ų59.525%0.25334%0.337SS..  trans-49.9142.5166.7-26.535.1000110.8V205 W208P203-V205 PolarHBondContact O-N 2.9Å; P203-V205 VanDerWaalsContact O-N 3.15Å; P203-W208 PolarHBondContact O-NE1 3.45Å
204P86.8Confident93.1Very high129 Ų12957.3 Ų57.384%0.83833%0.332SS*.SBendtrans-63.5-20.7-179.126.1-34.6000113
205V87.6Confident93Very high119 Ų11961.6 Ų61.672%0.72134%0.337SS*.SBendtrans-140.8146.9-179.9-174.30000109P203P203-V205 PolarHBondContact O-N 2.9Å; P203-V205 VanDerWaalsContact O-N 3.15Å
206G90.4Very high92.9Very high38 Ų3862.7 Ų62.739%0.39234%0.344SS..SBendtrans99.7-131.4169.600000114.1F221G206-F221 VanDerWaalsContact O-CD1 3.31Å; G206-F221 WeakPolarHBondContact O-CD1 3.34Å
207T94.3Very high92.8Very high71 Ų7159 Ų5944%0.43633%0.327SS..EExtended strand (participates in β ladder)trans-99.6139.6-179.646.30000110.5F219 K220T207-F219 CarbonylContact C-O 3.55Å; T207-F219 WeakPolarHBondContact CA-O 3.18Å; T207-K220 HydrophobicContact CG2-CG 3.96Å
208W96.1Very high92.8Very high26 Ų2660.2 Ų60.210%0.09834%0.336CS..EExtended strand (participates in β ladder)trans-97.9156.6171.4-70.84.3000109.7I199 K202 P203 S218 F219 F221 V224 L226I199-W208 HydrophobicContact CD1-CE3 4Å; I199-W208 HydrophobicContact CD1-CZ3 3.83Å; I199-W208 HydrophobicContact CG2-CE3 4.39Å; K202-W208 HydrophobicContact CB-CD2 4.06Å; K202-W208 HydrophobicContact CB-CG 4.41Å; K202-W208 HydrophobicContact CB-CZ2 4.23Å; P203-W208 PolarHBondContact O-NE1 3.45Å; W208-S218 CarbonylContact O-C 3.47Å; W208-S218 VanDerWaalsContact O-CA 3.22Å; W208-S218 WeakPolarHBondContact O-CA 3.25Å; W208-F219 HydrophobicContact CB-CD1 4.45Å; W208-F219 HydrophobicContact CB-CD2 4.44Å; W208-F219 HydrophobicContact CB-CE1 3.92Å; W208-F219 HydrophobicContact CB-CE2 3.89Å; W208-F219 HydrophobicContact CB-CZ 3.63Å; W208-F219 AromaticContact CE3-CE2 3.95Å; W208-F219 HydrophobicContact CE3-CE2 3.95Å; W208-F219 AromaticContact CE3-CZ 3.97Å; W208-F219 HydrophobicContact CE3-CZ 3.97Å; W208-F219 PolarHBondContact N-O 3.27Å; W208-F219 PolarHBondContact O-N 3.26Å; W208-F219 VanDerWaalsContact O-O 3.13Å; W208-F221 HydrophobicContact CD2-CB 3.57Å; W208-F221 VanDerWaalsContact CE2-CB 3.4Å; W208-F221 HydrophobicContact CE3-CB 3.93Å; W208-F221 HydrophobicContact CG-CB 4.07Å; W208-F221 HydrophobicContact CH2-CB 3.94Å; W208-F221 HydrophobicContact CZ2-CB 3.62Å; W208-F221 HydrophobicContact CZ2-CG 4.24Å; W208-F221 HydrophobicContact CZ3-CB 4.1Å; W208-V224 HydrophobicContact CE3-CG2 4.41Å; W208-V224 HydrophobicContact CZ3-CG2 4.23Å; W208-L226 HydrophobicContact CH2-CD1 3.93Å; W208-L226 HydrophobicContact CH2-CD2 4Å; W208-L226 HydrophobicContact CH2-CG 3.99Å; W208-L226 HydrophobicContact CZ3-CD2 3.85Å; W208-L226 HydrophobicContact CZ3-CG 4.11Å
209T95.3Very high92.9Very high49 Ų4956.7 Ų56.730%0.30132%0.32SS..EExtended strand (participates in β ladder)trans-112.2132.6176.2-56.10000108.4I200 D201 V216 G217I200-T209 WeakPolarHBondContact CA-O 3.49Å; I200-T209 HydrophobicContact CB-CG2 4.46Å; I200-T209 WeakPolarHBondContact CB-O 3.48Å; I200-T209 PolarHBondContact N-O 2.97Å; D201-T209 PolarHBondContact N-O 3.27Å; D201-T209 PolarHBondContact O-N 3.12Å; T209-V216 HydrophobicContact CG2-CG1 4.35Å; T209-G217 WeakPolarHBondContact CA-O 3.35Å
210G95.1Very high92.9Very high0 Ų061.5 Ų61.50%034%0.34CS..EExtended strand (participates in β ladder)trans-151.7179.3-179.500000113H198 V216 G217H198-G210 CarbonylContact O-C 3.59Å; H198-G210 WeakPolarHBondContact O-CA 3.38Å; G210-V216 WeakPolarHBondContact O-CA 3.48Å; G210-G217 PolarHBondContact N-O 3.22Å; G210-G217 PolarHBondContact O-N 2.9Å; G210-G217 VanDerWaalsContact O-O 3.14Å
211K94.9Very high92.9Very high33 Ų3364 Ų6414%0.14335%0.351CS..EExtended strand (participates in β ladder)trans-119.4124.5177.1-173-178.1-176.3177.80109.7Y165 F169 H198 I200 K215 V216Y165-K211 PolarHBondContact O-NZ 3.3Å; F169-K211 HydrophobicContact CE1-CB 3.88Å; F169-K211 HydrophobicContact CE1-CD 4.15Å; F169-K211 HydrophobicContact CZ-CB 4.37Å; F169-K211 HydrophobicContact CZ-CD 3.8Å; H198-K211 HydrophobicContact CB-CB 4.41Å; H198-K211 PolarHBondContact N-O 3.16Å; H198-K211 PolarHBondContact O-N 3.29Å; I200-K211 HydrophobicContact CD1-CB 4.38Å; K211-K215 CarbonylContact C-O 3.31Å; K211-K215 VanDerWaalsContact CA-O 3.25Å; K211-K215 WeakPolarHBondContact CA-O 3.12Å; K211-V216 HydrophobicContact CB-CG2 4.22Å; K211-V216 HydrophobicContact CD-CG2 4.38Å; K211-V216 HydrophobicContact CG-CG2 4.05Å
212L93.8Very high93Very high8 Ų864.1 Ų64.14%0.04235%0.35CS..EExtended strand (participates in β ladder)trans-137.8133.117717762.8000108.8L189 K190 L191 D195 I196 I197 N214 K215L189-L212 HydrophobicContact CD1-CB 3.97Å; L189-L212 HydrophobicContact CD2-CB 4.35Å; K190-L212 VanDerWaalsContact O-CD2 3.24Å; K190-L212 WeakPolarHBondContact O-CD2 3.35Å; L191-L212 HydrophobicContact CD2-CD2 3.91Å; D195-L212 HydrophobicContact CB-CD1 3.76Å; D195-L212 HydrophobicContact CB-CD2 4.17Å; I196-L212 WeakPolarHBondContact O-CD1 3.48Å; I197-L212 HydrophobicContact CG1-CB 4.3Å; I197-L212 HydrophobicContact CG1-CD1 4.38Å; I197-L212 HydrophobicContact CG1-CD2 4.27Å; L212-N214 VanDerWaalsContact C-N 3.27Å; L212-N214 PolarHBondContact O-N 3.49Å; L212-K215 PolarHBondContact N-O 3.47Å; L212-K215 PolarHBondContact O-N 3.36Å; L212-K215 VanDerWaalsContact O-O 3.11Å
213N90.4Very high93.1Very high116 Ų11660.9 Ų60.962%0.6234%0.335SS*.THydrogen-bonded Turntrans49.747.8179.3-62-31000112.9K215N213-K215 PolarHBondContact O-N 3.08Å
214N89.6Confident93.2Very high105 Ų10559.5 Ų59.556%0.56133%0.326SS*.THydrogen-bonded Turntrans65.1-13.1-174.9-7065.7000116.6L212L212-N214 VanDerWaalsContact C-N 3.27Å; L212-N214 PolarHBondContact O-N 3.49Å
215K91.7Very high93.6Very high138 Ų13858 Ų5860%0.631%0.311SS*.EExtended strand (participates in β ladder)trans-85.9139.3177.8-63.7-173.6174.8-171.20111.6L189 K211 L212 N213L189-K215 HydrophobicContact CD2-CB 4.15Å; K211-K215 CarbonylContact C-O 3.31Å; K211-K215 VanDerWaalsContact CA-O 3.25Å; K211-K215 WeakPolarHBondContact CA-O 3.12Å; L212-K215 PolarHBondContact N-O 3.47Å; L212-K215 PolarHBondContact O-N 3.36Å; L212-K215 VanDerWaalsContact O-O 3.11Å; N213-K215 PolarHBondContact O-N 3.08Å
216V93.8Very high93.9Very high56 Ų5657.6 Ų57.634%0.33930%0.304SS..EExtended strand (participates in β ladder)trans-103.5130.7175177.30000108.1Y165 I200 T209 G210 K211Y165-V216 VanDerWaalsContact CB-CG2 3.43Å; Y165-V216 HydrophobicContact CG-CG2 4.46Å; I200-V216 HydrophobicContact CD1-CG1 3.7Å; I200-V216 HydrophobicContact CD1-CG2 4.28Å; T209-V216 HydrophobicContact CG2-CG1 4.35Å; G210-V216 WeakPolarHBondContact O-CA 3.48Å; K211-V216 HydrophobicContact CB-CG2 4.22Å; K211-V216 HydrophobicContact CD-CG2 4.38Å; K211-V216 HydrophobicContact CG-CG2 4.05Å
217G94Very high93.9Very high7 Ų758.3 Ų58.37%0.07230%0.298CS..EExtended strand (participates in β ladder)trans-168.5178.6-178.700000113.1E187 T209 G210E187-G217 CarbonylContact O-C 3.55Å; E187-G217 VanDerWaalsContact O-C 3.31Å; E187-G217 WeakPolarHBondContact O-CA 3.27Å; T209-G217 WeakPolarHBondContact CA-O 3.35Å; G210-G217 PolarHBondContact N-O 3.22Å; G210-G217 PolarHBondContact O-N 2.9Å; G210-G217 VanDerWaalsContact O-O 3.14Å
218S95.3Very high93.2Very high25 Ų2560.4 Ų60.418%0.17531%0.313CS..EExtended strand (participates in β ladder)trans-91.4150.2178.7770000111.7E187 S188 L189 W208E187-S218 PolarHBondContact O-N 3.34Å; S188-S218 CarbonylContact C-O 3.59Å; S188-S218 WeakPolarHBondContact CA-O 3.21Å; L189-S218 PolarHBondContact N-O 3.04Å; W208-S218 CarbonylContact O-C 3.47Å; W208-S218 VanDerWaalsContact O-CA 3.22Å; W208-S218 WeakPolarHBondContact O-CA 3.25Å
219F95.4Very high91.9Very high2 Ų262.8 Ų62.81%0.00933%0.328CS..EExtended strand (participates in β ladder)trans-152.5154.8174.466.1-84.1000109.6L189 L191 I197 I199 T207 W208 V224L189-F219 HydrophobicContact CD1-CD1 4Å; L191-F219 HydrophobicContact CD1-CB 4.01Å; L191-F219 HydrophobicContact CD2-CB 4.18Å; I197-F219 HydrophobicContact CD1-CD1 4.07Å; I197-F219 HydrophobicContact CD1-CD2 4Å; I197-F219 HydrophobicContact CD1-CE1 4.15Å; I197-F219 HydrophobicContact CD1-CE2 4.11Å; I197-F219 HydrophobicContact CD1-CG 3.98Å; I197-F219 HydrophobicContact CD1-CZ 4.16Å; I197-F219 HydrophobicContact CG2-CD1 4.28Å; I197-F219 HydrophobicContact CG2-CE1 3.72Å; I197-F219 HydrophobicContact CG2-CZ 4.11Å; I199-F219 HydrophobicContact CG1-CZ 4.32Å; T207-F219 CarbonylContact C-O 3.55Å; T207-F219 WeakPolarHBondContact CA-O 3.18Å; W208-F219 HydrophobicContact CB-CD1 4.45Å; W208-F219 HydrophobicContact CB-CD2 4.44Å; W208-F219 HydrophobicContact CB-CE1 3.92Å; W208-F219 HydrophobicContact CB-CE2 3.89Å; W208-F219 HydrophobicContact CB-CZ 3.63Å; W208-F219 AromaticContact CE3-CE2 3.95Å; W208-F219 HydrophobicContact CE3-CE2 3.95Å; W208-F219 AromaticContact CE3-CZ 3.97Å; W208-F219 HydrophobicContact CE3-CZ 3.97Å; W208-F219 PolarHBondContact N-O 3.27Å; W208-F219 PolarHBondContact O-N 3.26Å; W208-F219 VanDerWaalsContact O-O 3.13Å; F219-V224 HydrophobicContact CD2-CG1 3.8Å; F219-V224 HydrophobicContact CD2-CG2 4.35Å; F219-V224 HydrophobicContact CE2-CB 4.36Å; F219-V224 HydrophobicContact CE2-CG1 3.75Å; F219-V224 HydrophobicContact CE2-CG2 3.64Å
220K94.8Very high90Very high102 Ų10268.5 Ų68.544%0.44335%0.351SS..EExtended strand (participates in β ladder)trans-83.2135.5176.4-61-179.9171.1177.10110.1T207 I222 Y223T207-K220 HydrophobicContact CG2-CG 3.96Å; K220-I222 HydrophobicContact CB-CD1 4.38Å; K220-I222 HydrophobicContact CB-CG1 3.74Å; K220-I222 HydrophobicContact CD-CD1 4.16Å; K220-I222 HydrophobicContact CD-CG1 4.42Å; K220-I222 PolarHBondContact O-N 2.71Å; K220-I222 VanDerWaalsContact O-N 3.13Å; K220-Y223 HydrophobicContact CB-CD2 3.89Å; K220-Y223 HydrophobicContact CB-CE2 3.84Å; K220-Y223 HydrophobicContact CD-CE2 3.97Å; K220-Y223 HydrophobicContact CG-CE2 4.15Å; K220-Y223 PolarHBondContact O-N 3.08Å
221F93.4Very high87.9Confident80 Ų8071.6 Ų71.635%0.35137%0.37SS..G310 helixtrans-61.3-24.5179.974.8-90.7000113G206 W208 Y223 V224G206-F221 VanDerWaalsContact O-CD1 3.31Å; G206-F221 WeakPolarHBondContact O-CD1 3.34Å; W208-F221 HydrophobicContact CD2-CB 3.57Å; W208-F221 VanDerWaalsContact CE2-CB 3.4Å; W208-F221 HydrophobicContact CE3-CB 3.93Å; W208-F221 HydrophobicContact CG-CB 4.07Å; W208-F221 HydrophobicContact CH2-CB 3.94Å; W208-F221 HydrophobicContact CZ2-CB 3.62Å; W208-F221 HydrophobicContact CZ2-CG 4.24Å; W208-F221 HydrophobicContact CZ3-CB 4.1Å; F221-Y223 PolarHBondContact O-N 3.34Å; F221-Y223 VanDerWaalsContact O-N 3.08Å; F221-V224 PolarHBondContact O-N 3.26Å; F221-V224 VanDerWaalsContact O-N 3.16Å; F221-V224 VanDerWaalsContact O-O 3.08Å
222I94.9Very high85.6Confident90 Ų9075.2 Ų75.246%0.46240%0.397SS..G310 helixtrans-63.5-11.1178.265.3168.2000114.6H176 K220H176-I222 PolarHBondContact CE1-O 3.34Å; H176-I222 PolarHBondContact NE2-O 3.14Å; H176-I222 VanDerWaalsContact NE2-O 3.16Å; K220-I222 HydrophobicContact CB-CD1 4.38Å; K220-I222 HydrophobicContact CB-CG1 3.74Å; K220-I222 HydrophobicContact CD-CD1 4.16Å; K220-I222 HydrophobicContact CD-CG1 4.42Å; K220-I222 PolarHBondContact O-N 2.71Å; K220-I222 VanDerWaalsContact O-N 3.13Å
223Y95.3Very high83.4Confident45 Ų4580.5 Ų80.518%0.17643%0.432CS..G310 helixtrans-101.4-2.8179.8-56.4-43000113H176 T177 F179 L191 K220 F221H176-Y223 VanDerWaalsContact CD2-C 3.47Å; H176-Y223 PolarHBondContact CD2-O 3.06Å; H176-Y223 PolarHBondContact N-O 2.61Å; T177-Y223 HydrophobicContact CG2-CD1 3.85Å; T177-Y223 HydrophobicContact CG2-CE1 4.33Å; T177-Y223 PolarHBondContact N-O 3.34Å; F179-Y223 HydrophobicContact CB-CD2 4.12Å; F179-Y223 HydrophobicContact CB-CE2 4.17Å; F179-Y223 AromaticContact CD2-CE2 3.82Å; F179-Y223 HydrophobicContact CD2-CE2 3.82Å; F179-Y223 HydrophobicContact CE2-CE2 4.39Å; F179-Y223 HydrophobicContact CG-CD2 4.27Å; F179-Y223 AromaticContact CG-CE2 3.93Å; F179-Y223 HydrophobicContact CG-CE2 3.93Å; L191-Y223 HydrophobicContact CD1-CD2 4.07Å; L191-Y223 HydrophobicContact CD1-CG 4.43Å; K220-Y223 HydrophobicContact CB-CD2 3.89Å; K220-Y223 HydrophobicContact CB-CE2 3.84Å; K220-Y223 HydrophobicContact CD-CE2 3.97Å; K220-Y223 HydrophobicContact CG-CE2 4.15Å; K220-Y223 PolarHBondContact O-N 3.08Å; F221-Y223 PolarHBondContact O-N 3.34Å; F221-Y223 VanDerWaalsContact O-N 3.08Å
224V95.1Very high81.4Confident10 Ų1079.5 Ų79.56%0.06143%0.43CS..EExtended strand (participates in β ladder)trans-130.9148.4-173.7-49.40000111.8A173 V174 V175 H176 I197 W208 F219 F221A173-V224 HydrophobicContact CB-CB 3.9Å; A173-V224 HydrophobicContact CB-CG2 3.72Å; V174-V224 CarbonylContact O-C 3.59Å; V174-V224 WeakPolarHBondContact O-CA 3.35Å; V175-V224 HydrophobicContact CG2-CG1 4.03Å; H176-V224 VanDerWaalsContact CD2-C 3.41Å; H176-V224 PolarHBondContact CD2-N 2.98Å; H176-V224 PolarHBondContact NE2-N 3.03Å; I197-V224 HydrophobicContact CD1-CG1 3.9Å; W208-V224 HydrophobicContact CE3-CG2 4.41Å; W208-V224 HydrophobicContact CZ3-CG2 4.23Å; F219-V224 HydrophobicContact CD2-CG1 3.8Å; F219-V224 HydrophobicContact CD2-CG2 4.35Å; F219-V224 HydrophobicContact CE2-CB 4.36Å; F219-V224 HydrophobicContact CE2-CG1 3.75Å; F219-V224 HydrophobicContact CE2-CG2 3.64Å; F221-V224 PolarHBondContact O-N 3.26Å; F221-V224 VanDerWaalsContact O-N 3.16Å; F221-V224 VanDerWaalsContact O-O 3.08Å
225N94.7Very high79.4Confident97 Ų9785.8 Ų85.852%0.51945%0.446SS..EExtended strand (participates in β ladder)trans-104.3129.1168.7-71.6-34.9000108.6A173 V174 H176 L227A173-N225 CarbonylContact C-O 3.49Å; A173-N225 VanDerWaalsContact CA-O 3.23Å; A173-N225 WeakPolarHBondContact CA-O 3.49Å; A173-N225 WeakPolarHBondContact CB-O 3.27Å; V174-N225 PolarHBondContact N-O 3.04Å; V174-N225 PolarHBondContact O-N 3.48Å; H176-N225 PolarHBondContact CD2-OD1 3.31Å; N225-L227 WeakPolarHBondContact O-CD1 3.31Å; N225-L227 PolarHBondContact O-N 3.17Å
226L93.4Very high77.3Confident111 Ų11187.1 Ų87.158%0.58145%0.447SS*.EExtended strand (participates in β ladder)trans-61.6127.7173.9-78.2159.6000109.6I199 W208I199-L226 HydrophobicContact CD1-CD2 3.58Å; W208-L226 HydrophobicContact CH2-CD1 3.93Å; W208-L226 HydrophobicContact CH2-CD2 4Å; W208-L226 HydrophobicContact CH2-CG 3.99Å; W208-L226 HydrophobicContact CZ3-CD2 3.85Å; W208-L226 HydrophobicContact CZ3-CG 4.11Å
227L90.1Very high75.1Confident53 Ų5394.5 Ų94.528%0.27748%0.475SS..EExtended strand (participates in β ladder)trans-87.1144.4169.8-93.768.6000108.8R172 V174 N225 D229R172-L227 HydrophobicContact CB-CB 4.45Å; R172-L227 PolarHBondContact O-N 3.47Å; V174-L227 HydrophobicContact CB-CD1 3.38Å; V174-L227 HydrophobicContact CG2-CD1 3.21Å; V174-L227 HydrophobicContact CG2-CD2 3.64Å; V174-L227 HydrophobicContact CG2-CG 4.06Å; V174-L227 VanDerWaalsContact N-CD1 3.26Å; N225-L227 WeakPolarHBondContact O-CD1 3.31Å; N225-L227 PolarHBondContact O-N 3.17Å; L227-D229 PolarHBondContact O-N 3.16Å; L227-D229 VanDerWaalsContact O-N 3.17Å
228P80.2Confident72.8Confident115 Ų115102.4 Ų102.475%0.74750%0.502SS*.PPolyproline II helixtrans-58.3123.5165.625.6-31.5000108.2E230P228-E230 PolarHBondContact O-N 3.18Å
229D67.8Low70.3Confident77 Ų77107 Ų10741%0.41253%0.534SS..  trans-66100.5179.5-78.2-26.2000109.7G171 R172 L227 T231G171-D229 VanDerWaalsContact CA-CG 3.49Å; G171-D229 WeakPolarHBondContact CA-OD1 3.22Å; G171-D229 WeakPolarHBondContact CA-OD2 3.31Å; R172-D229 PolarHBondContact N-OD1 2.87Å; L227-D229 PolarHBondContact O-N 3.16Å; L227-D229 VanDerWaalsContact O-N 3.17Å; D229-T231 PolarHBondContact O-N 3.17Å
230E55.3Low67.9Low168 Ų168113.5 Ų113.579%0.78556%0.564SS**  trans-761169.5-155.7-176.2167.300112R172 P228R172-E230 VanDerWaalsContact NH2-CB 3.33Å; R172-E230 IonicContact NH2-OE2 2.63Å; P228-E230 PolarHBondContact O-N 3.18Å
231T51Low65.8Low65 Ų65112.2 Ų112.240%0.39957%0.568SS.*SBendtrans-84.2123.4170.754.60000108.5D229D229-T231 PolarHBondContact O-N 3.17Å
232P48.5Very low63.7Low109 Ų109116.4 Ų116.471%0.70859%0.586SS**  trans-54.3140.2177.224.8-33.8000108.4T234P232-T234 PolarHBondContact O-N 3.41Å
233P46.1Very low61.4Low119 Ų119115.6 Ų115.677%0.77360%0.599SS**  trans-52108.8-171.921.7-33.6000108.5R235P233-R235 PolarHBondContact O-N 2.88Å
234T49.1Very low59.3Low95 Ų95116.8 Ų116.858%0.58361%0.609SS**  trans-56.7117.4175.763.90000105.1P232 R236P232-T234 PolarHBondContact O-N 3.41Å; T234-R236 PolarHBondContact O-N 3.32Å
235R46.5Very low57.1Low238 Ų238124.6 Ų124.690%0.89864%0.637SS**  trans-66.381.4-172.1-62178.789172.86.4108.1P233 K237P233-R235 PolarHBondContact O-N 2.88Å; R235-K237 PolarHBondContact O-N 3.19Å
236R47.5Very low54.9Low166 Ų166125.3 Ų125.363%0.62665%0.65SS**  trans-52.9126.8139.1-69.6-159.2179.5-171.15103.7T234 R238T234-R236 PolarHBondContact O-N 3.32Å; R236-R238 PolarHBondContact O-N 3.46Å
237K48.6Very low53.3Low211 Ų211126.1 Ų126.192%0.91765%0.649SS**SBendtrans-62.570166.9-65.7-174.5179.6-176.90108.3R235R235-K237 PolarHBondContact O-N 3.19Å
238R46.1Very low52.3Low172 Ų172127.4 Ų127.465%0.64966%0.662SS**  trans-105.296.8150.3-96.8-173.2-86.7154.6-5.6103.2R236 H240R236-R238 PolarHBondContact O-N 3.46Å; R238-H240 PolarHBondContact O-N 3.3Å
239C42.9Very low52.2Low123 Ų123127.8 Ų127.883%0.83165%0.652SS**  trans-47.683.9157.233.90000109.1
240H44.9Very low52.9Low138 Ų138125.1 Ų125.164%0.63964%0.639SS**  trans-122.393.3162.5-75.3-47.2000108.2R238 K242R238-H240 PolarHBondContact O-N 3.3Å; H240-K242 VanDerWaalsContact C-N 3.31Å; H240-K242 PolarHBondContact O-N 3.41Å
241S49.8Very low54.2Low75 Ų75125.5 Ų125.552%0.52464%0.638SS.*  trans-22.284.3147.7-1730000113.8R245S241-R245 PolarHBondContact O-NE 3.49Å; S241-R245 PolarHBondContact O-NH2 3.26Å
242K49.6Very low56.1Low168 Ų168125.9 Ų125.973%0.7364%0.64SS**  trans-132.56.7167-78.3-165.5176.7-177.50113.7H240 R245H240-K242 VanDerWaalsContact C-N 3.31Å; H240-K242 PolarHBondContact O-N 3.41Å; K242-R245 VanDerWaalsContact CE-NH2 3.33Å
243G46.7Very low58.2Low73 Ų73121.4 Ų121.475%0.75361%0.61SS**SBendtrans-105.5-5.5168.700000114.6
244N50.7Low60.3Low70 Ų70122.4 Ų122.437%0.37460%0.604SS.*SBendtrans-123.23.8-175.3-145.519.1000114.3S246 K247N244-S246 PolarHBondContact O-N 2.94Å; N244-K247 PolarHBondContact O-N 3.45Å; N244-K247 WeakPolarHBondContact OD1-CD 3.11Å
245R49.3Very low62.4Low173 Ų173120.7 Ų120.765%0.65359%0.59SS**THydrogen-bonded Turntrans-70.7-12.7178.5-61.3-167.2-152.6-155.7-0.1113.8S241 K242S241-R245 PolarHBondContact O-NE 3.49Å; S241-R245 PolarHBondContact O-NH2 3.26Å; K242-R245 VanDerWaalsContact CE-NH2 3.33Å
246S48.6Very low64.6Low113 Ų113109.6 Ų109.679%0.7955%0.549SS*.THydrogen-bonded Turntrans-95.5-3.317853.90000113.8N244N244-S246 PolarHBondContact O-N 2.94Å
247K59.8Low66.8Low127 Ų127101.8 Ų101.855%0.55252%0.519SS*.SBendtrans-96.5110.1163.6-61.3-173.1-171.1-179.60105.5N244N244-K247 PolarHBondContact O-N 3.45Å; N244-K247 WeakPolarHBondContact OD1-CD 3.11Å
248S70Confident68.9Low80 Ų8096.8 Ų96.856%0.55950%0.503SS*.  trans-38.8144.4171.443.10000110.8P250 R259S248-P250 VanDerWaalsContact O-N 3.17Å; S248-R259 VanDerWaalsContact O-CZ 3.29Å; S248-R259 PolarHBondContact O-NH1 3.35Å; S248-R259 PolarHBondContact O-NH2 2.95Å
249K77.9Confident71.1Confident124 Ų12492.9 Ų92.954%0.53949%0.488SS..  trans-51.4127171.8-66.3177.3-179.4-170.40107.5K251 S312K249-K251 PolarHBondContact O-N 2.93Å; K249-S312 PolarHBondContact NZ-O 2.87Å
250P82.3Confident73.4Confident20 Ų2088.6 Ų88.613%0.1346%0.457CS..  trans-62.7130.9-178.927.9-31.1000107.8S248 E255 V256 L277 L309S248-P250 VanDerWaalsContact O-N 3.17Å; P250-E255 WeakPolarHBondContact CA-OE2 3.4Å; P250-E255 HydrophobicContact CB-CB 4.08Å; P250-E255 HydrophobicContact CB-CG 3.96Å; P250-V256 HydrophobicContact CB-CG2 3.72Å; P250-V256 HydrophobicContact CG-CG2 3.53Å; P250-L277 WeakPolarHBondContact O-CD1 3.3Å; P250-L309 HydrophobicContact CG-CD2 3.85Å
251K81.6Confident75.7Confident177 Ų17784.5 Ų84.577%0.7745%0.451SS*.  trans-93.2-19-174.8-65.7-177.7-179.6-178.10112.5K249 E255K249-K251 PolarHBondContact O-N 2.93Å; K251-E255 PolarHBondContact N-OE2 2.98Å
252T91.1Very high77.7Confident72 Ų7281.2 Ų81.244%0.44243%0.428SS..SBendtrans-125.1151.8-178.466.10000110.6E254 E255 V256T252-E254 PolarHBondContact O-N 3.4Å; T252-E255 PolarHBondContact O-N 3.13Å; T252-E255 WeakPolarHBondContact OG1-CB 3.44Å; T252-E255 PolarHBondContact OG1-N 3.09Å; T252-V256 PolarHBondContact O-N 2.9Å
253L92.4Very high79.7Confident16 Ų1676.2 Ų76.28%0.08441%0.411CS..Hα-helixtrans-57.9-40.3173.8174.558.7000111.6E255 V256 L257 F274 F280L253-E255 VanDerWaalsContact C-N 3.3Å; L253-E255 PolarHBondContact O-N 3.28Å; L253-V256 WeakPolarHBondContact O-CB 3.46Å; L253-V256 PolarHBondContact O-N 3.2Å; L253-V256 VanDerWaalsContact O-N 3.12Å; L253-L257 HydrophobicContact CD1-CD1 4.38Å; L253-L257 HydrophobicContact CD1-CG 4.2Å; L253-L257 HydrophobicContact CG-CD1 4.18Å; L253-L257 HydrophobicContact CG-CG 4.42Å; L253-L257 WeakPolarHBondContact O-CG 3.36Å; L253-L257 PolarHBondContact O-N 3.33Å; L253-F274 WeakPolarHBondContact CD2-O 3.46Å; L253-F280 HydrophobicContact CD1-CB 3.72Å; L253-F280 HydrophobicContact CD1-CD1 4.31Å; L253-F280 HydrophobicContact CD1-CD2 3.25Å; L253-F280 HydrophobicContact CD1-CE2 3.86Å; L253-F280 HydrophobicContact CD1-CG 3.49Å; L253-F280 VanDerWaalsContact CD1-CG 3.49Å
254E91.4Very high81.9Confident139 Ų13981 Ų8165%0.6541%0.414SS*.Hα-helixtrans-58.7-41.1177.9-172.1177.6-169.300112.1T252 V256 L257 D258T252-E254 PolarHBondContact O-N 3.4Å; E254-V256 VanDerWaalsContact C-N 3.32Å; E254-V256 PolarHBondContact O-N 2.88Å; E254-L257 PolarHBondContact O-N 3.1Å; E254-D258 WeakPolarHBondContact O-CB 3.48Å; E254-D258 PolarHBondContact O-N 2.93Å
255E92.5Very high83.8Confident59 Ų5978.8 Ų78.828%0.27640%0.402SS..Hα-helixtrans-66.4-34.8177.3-169.4-176.4177.400112P250 K251 T252 L253 R259P250-E255 WeakPolarHBondContact CA-OE2 3.4Å; P250-E255 HydrophobicContact CB-CB 4.08Å; P250-E255 HydrophobicContact CB-CG 3.96Å; K251-E255 PolarHBondContact N-OE2 2.98Å; T252-E255 PolarHBondContact O-N 3.13Å; T252-E255 WeakPolarHBondContact OG1-CB 3.44Å; T252-E255 PolarHBondContact OG1-N 3.09Å; L253-E255 VanDerWaalsContact C-N 3.3Å; L253-E255 PolarHBondContact O-N 3.28Å; E255-R259 WeakPolarHBondContact O-CB 3.04Å; E255-R259 WeakPolarHBondContact O-CD 3.44Å; E255-R259 WeakPolarHBondContact O-CG 3.31Å; E255-R259 PolarHBondContact O-N 2.98Å; E255-R259 IonicContact OE1-CZ 2.65Å; E255-R259 IonicContact OE1-NE 3.43Å; E255-R259 IonicContact OE1-NH2 3.28Å; E255-R259 PolarHBondContact OE1-NH2 3.03Å
256V93.1Very high85.8Confident6 Ų672.7 Ų72.74%0.03639%0.386CS..Hα-helixtrans-63.6-47.9172.6-179.90000110.1P250 T252 L253 E254 D258 R259 I260 L277 F280 A305 L309P250-V256 HydrophobicContact CB-CG2 3.72Å; P250-V256 HydrophobicContact CG-CG2 3.53Å; T252-V256 PolarHBondContact O-N 2.9Å; L253-V256 WeakPolarHBondContact O-CB 3.46Å; L253-V256 PolarHBondContact O-N 3.2Å; L253-V256 VanDerWaalsContact O-N 3.12Å; E254-V256 VanDerWaalsContact C-N 3.32Å; E254-V256 PolarHBondContact O-N 2.88Å; V256-D258 VanDerWaalsContact C-N 3.34Å; V256-D258 PolarHBondContact O-N 3.32Å; V256-R259 PolarHBondContact O-N 3.43Å; V256-I260 WeakPolarHBondContact O-CG1 3.33Å; V256-I260 PolarHBondContact O-N 3.35Å; V256-I260 VanDerWaalsContact O-N 3.14Å; V256-L277 HydrophobicContact CG2-CD2 3.65Å; V256-F280 HydrophobicContact CG1-CD1 4.42Å; V256-F280 HydrophobicContact CG1-CE1 3.66Å; V256-F280 HydrophobicContact CG1-CZ 3.84Å; V256-A305 HydrophobicContact CG1-CB 3.96Å; V256-L309 HydrophobicContact CG1-CD1 4.39Å; V256-L309 HydrophobicContact CG2-CD1 4.01Å
257L93.6Very high88Confident1 Ų171.1 Ų71.11%0.00538%0.375CS..Hα-helixtrans-64.3-37.4-180-66.7179.3000112.2L253 E254 I260 G261 L262 L269 F280L253-L257 HydrophobicContact CD1-CD1 4.38Å; L253-L257 HydrophobicContact CD1-CG 4.2Å; L253-L257 HydrophobicContact CG-CD1 4.18Å; L253-L257 HydrophobicContact CG-CG 4.42Å; L253-L257 WeakPolarHBondContact O-CG 3.36Å; L253-L257 PolarHBondContact O-N 3.33Å; E254-L257 PolarHBondContact O-N 3.1Å; L257-I260 HydrophobicContact CD2-CD1 3.82Å; L257-I260 VanDerWaalsContact O-CG1 3.24Å; L257-I260 WeakPolarHBondContact O-CG1 3.49Å; L257-I260 PolarHBondContact O-N 3.29Å; L257-G261 PolarHBondContact O-N 3.46Å; L257-L262 PolarHBondContact O-N 2.98Å; L257-L269 HydrophobicContact CD1-CD1 3.94Å; L257-L269 HydrophobicContact CD2-CD1 3.95Å; L257-F280 HydrophobicContact CD2-CE2 4.1Å
258D92.9Very high89.5Confident107 Ų10768 Ų6857%0.57236%0.364SS*.Hα-helixtrans-64.7-45.6174.1-173.259.3000111.7E254 V256 I260 G261 T263E254-D258 WeakPolarHBondContact O-CB 3.48Å; E254-D258 PolarHBondContact O-N 2.93Å; V256-D258 VanDerWaalsContact C-N 3.34Å; V256-D258 PolarHBondContact O-N 3.32Å; D258-I260 VanDerWaalsContact C-N 3.28Å; D258-I260 PolarHBondContact O-N 3.06Å; D258-G261 PolarHBondContact O-N 2.94Å; D258-T263 HydrophobicContact CB-CG2 3.89Å
259R91.5Very high90.6Very high89 Ų8964.1 Ų64.134%0.33634%0.337SS..Hα-helixtrans-60.8-33.8177.2-74171-174.8-153.52.4113.6S248 E255 V256S248-R259 VanDerWaalsContact O-CZ 3.29Å; S248-R259 PolarHBondContact O-NH1 3.35Å; S248-R259 PolarHBondContact O-NH2 2.95Å; E255-R259 WeakPolarHBondContact O-CB 3.04Å; E255-R259 WeakPolarHBondContact O-CD 3.44Å; E255-R259 WeakPolarHBondContact O-CG 3.31Å; E255-R259 PolarHBondContact O-N 2.98Å; E255-R259 IonicContact OE1-CZ 2.65Å; E255-R259 IonicContact OE1-NE 3.43Å; E255-R259 IonicContact OE1-NH2 3.28Å; E255-R259 PolarHBondContact OE1-NH2 3.03Å; V256-R259 PolarHBondContact O-N 3.43Å
260I92.5Very high91.3Very high34 Ų3460.8 Ų60.817%0.17433%0.33CS..Hα-helixtrans-88.1-7.8176.565.8-176000113.3V256 L257 D258 L262 K301 I302 A305V256-I260 WeakPolarHBondContact O-CG1 3.33Å; V256-I260 PolarHBondContact O-N 3.35Å; V256-I260 VanDerWaalsContact O-N 3.14Å; L257-I260 HydrophobicContact CD2-CD1 3.82Å; L257-I260 VanDerWaalsContact O-CG1 3.24Å; L257-I260 WeakPolarHBondContact O-CG1 3.49Å; L257-I260 PolarHBondContact O-N 3.29Å; D258-I260 VanDerWaalsContact C-N 3.28Å; D258-I260 PolarHBondContact O-N 3.06Å; I260-L262 HydrophobicContact CD1-CB 4.09Å; I260-L262 HydrophobicContact CD1-CD1 3.78Å; I260-L262 HydrophobicContact CD1-CG 4.18Å; I260-L262 HydrophobicContact CG1-CB 3.91Å; I260-L262 HydrophobicContact CG1-CD1 4.1Å; I260-L262 HydrophobicContact CG1-CG 3.97Å; I260-K301 PolarHBondContact O-NZ 2.94Å; I260-I302 HydrophobicContact CD1-CG1 4.32Å; I260-A305 HydrophobicContact CG2-CB 3.93Å
261G91.4Very high91.7Very high51 Ų5167.1 Ų67.153%0.52636%0.359SS..THydrogen-bonded Turntrans7036.4-17800000113.4L257 D258L257-G261 PolarHBondContact O-N 3.46Å; D258-G261 PolarHBondContact O-N 2.94Å
262L92.9Very high92.2Very high7 Ų763.7 Ų63.74%0.03735%0.346CS..  trans-123.338.4178.8-61.3178.6000111.5L257 I260 E264 L265 H298 K301 I302L257-L262 PolarHBondContact O-N 2.98Å; I260-L262 HydrophobicContact CD1-CB 4.09Å; I260-L262 HydrophobicContact CD1-CD1 3.78Å; I260-L262 HydrophobicContact CD1-CG 4.18Å; I260-L262 HydrophobicContact CG1-CB 3.91Å; I260-L262 HydrophobicContact CG1-CD1 4.1Å; I260-L262 HydrophobicContact CG1-CG 3.97Å; L262-E264 PolarHBondContact O-N 3.35Å; L262-L265 HydrophobicContact CB-CD1 4.1Å; L262-L265 HydrophobicContact CB-CG 4.43Å; L262-L265 HydrophobicContact CD1-CD1 4.13Å; L262-L265 HydrophobicContact CD2-CD1 4.42Å; L262-L265 HydrophobicContact CG-CD1 4.46Å; L262-L265 PolarHBondContact O-N 3.46Å; L262-L265 VanDerWaalsContact O-N 3.07Å; L262-H298 HydrophobicContact CD1-CB 4.18Å; L262-H298 HydrophobicContact CD2-CB 4.33Å; L262-K301 HydrophobicContact CD1-CB 3.93Å; L262-K301 HydrophobicContact CD1-CD 4.14Å; L262-K301 HydrophobicContact CG-CD 4.34Å; L262-I302 HydrophobicContact CD1-CD1 4.18Å; L262-I302 HydrophobicContact CD1-CG1 3.79Å
263T92.1Very high92.1Very high62 Ų6262.1 Ų62.138%0.3834%0.344SS..THydrogen-bonded Turntrans-59.2-27.9179.153.30000112.8D258 L265 S266D258-T263 HydrophobicContact CB-CG2 3.89Å; T263-L265 PolarHBondContact O-N 3.17Å; T263-S266 WeakPolarHBondContact O-CB 3.23Å; T263-S266 PolarHBondContact O-N 3.13Å; T263-S266 VanDerWaalsContact O-N 3.09Å; T263-S266 PolarHBondContact O-OG 3.19Å
264E91.8Very high92.1Very high174 Ų17462.9 Ų62.981%0.81335%0.347SS*.THydrogen-bonded Turntrans-62.8-25.7176.4-61.1179179.400113.2L262 S266L262-E264 PolarHBondContact O-N 3.35Å; E264-S266 VanDerWaalsContact C-N 3.29Å
265L91.2Very high92.1Very high23 Ų2362.8 Ų62.812%0.1235%0.346CS..Hα-helixtrans-83.3-6.8178.5-59-179.9000112.7L262 T263 S267 L268 L269 I293 H298 I302L262-L265 HydrophobicContact CB-CD1 4.1Å; L262-L265 HydrophobicContact CB-CG 4.43Å; L262-L265 HydrophobicContact CD1-CD1 4.13Å; L262-L265 HydrophobicContact CD2-CD1 4.42Å; L262-L265 HydrophobicContact CG-CD1 4.46Å; L262-L265 PolarHBondContact O-N 3.46Å; L262-L265 VanDerWaalsContact O-N 3.07Å; T263-L265 PolarHBondContact O-N 3.17Å; L265-S267 PolarHBondContact O-N 3.23Å; L265-L268 HydrophobicContact CD2-CD2 4.09Å; L265-L268 PolarHBondContact O-N 3.16Å; L265-L269 HydrophobicContact CB-CD1 4.33Å; L265-L269 WeakPolarHBondContact O-CB 3.2Å; L265-L269 WeakPolarHBondContact O-CG 3.49Å; L265-L269 PolarHBondContact O-N 3.33Å; L265-I293 HydrophobicContact CD1-CD1 4.08Å; L265-I293 HydrophobicContact CD1-CG1 4.47Å; L265-I293 HydrophobicContact CD1-CG2 4.36Å; L265-I293 HydrophobicContact CD2-CD1 4.35Å; L265-I293 HydrophobicContact CD2-CG1 4.26Å; L265-H298 HydrophobicContact CD1-CB 4.5Å; L265-I302 HydrophobicContact CD1-CD1 3.79Å
266S92Very high92Very high46 Ų4662 Ų6232%0.32235%0.347SS..Hα-helixtrans-56.7-50.6179.658.80000112T263 E264 L268 L269 S270T263-S266 WeakPolarHBondContact O-CB 3.23Å; T263-S266 PolarHBondContact O-N 3.13Å; T263-S266 VanDerWaalsContact O-N 3.09Å; T263-S266 PolarHBondContact O-OG 3.19Å; E264-S266 VanDerWaalsContact C-N 3.29Å; S266-L268 PolarHBondContact O-N 3.43Å; S266-L269 PolarHBondContact O-N 2.9Å; S266-S270 VanDerWaalsContact O-CB 3.27Å; S266-S270 WeakPolarHBondContact O-CB 3.49Å; S266-S270 PolarHBondContact O-N 3.48Å
267S93.2Very high92Very high80 Ų8064 Ų6456%0.55936%0.357SS*.Hα-helixtrans-64.6-40.8179.3179.70000111.6L265 S270 M271L265-S267 PolarHBondContact O-N 3.23Å; S267-S270 PolarHBondContact O-N 3.01Å; S267-M271 WeakPolarHBondContact O-CB 3.15Å; S267-M271 VanDerWaalsContact O-CG 3.24Å; S267-M271 WeakPolarHBondContact O-CG 3.45Å; S267-M271 PolarHBondContact O-N 3.5Å
268L93.1Very high91.9Very high60 Ų6071.4 Ų71.431%0.31439%0.392SS..Hα-helixtrans-63.5-48.6178.1-173.874.1000111.4L265 S266 S270 M271 H272 L291 I293L265-L268 HydrophobicContact CD2-CD2 4.09Å; L265-L268 PolarHBondContact O-N 3.16Å; S266-L268 PolarHBondContact O-N 3.43Å; L268-S270 VanDerWaalsContact C-N 3.35Å; L268-S270 PolarHBondContact O-N 3.01Å; L268-M271 PolarHBondContact O-N 2.84Å; L268-H272 PolarHBondContact O-CD2 2.94Å; L268-H272 VanDerWaalsContact O-CD2 3.26Å; L268-H272 PolarHBondContact O-N 2.92Å; L268-L291 HydrophobicContact CD2-CB 4.28Å; L268-L291 WeakPolarHBondContact CD2-O 3.27Å; L268-L291 HydrophobicContact CG-CD2 4.43Å; L268-I293 HydrophobicContact CD2-CD1 4.11Å; L268-I293 HydrophobicContact CD2-CG1 3.97Å
269L92.2Very high91.8Very high0 Ų069.4 Ų69.40%038%0.381CS..Hα-helixtrans-61.2-44.1177.1-75.5169.9000111.3L257 L265 S266 M271 H272 G273 F274 L283 L291L257-L269 HydrophobicContact CD1-CD1 3.94Å; L257-L269 HydrophobicContact CD2-CD1 3.95Å; L265-L269 HydrophobicContact CB-CD1 4.33Å; L265-L269 WeakPolarHBondContact O-CB 3.2Å; L265-L269 WeakPolarHBondContact O-CG 3.49Å; L265-L269 PolarHBondContact O-N 3.33Å; S266-L269 PolarHBondContact O-N 2.9Å; L269-M271 PolarHBondContact O-N 3.24Å; L269-H272 CarbonylContact O-C 3.52Å; L269-H272 PolarHBondContact O-N 3.34Å; L269-H272 VanDerWaalsContact O-N 3.16Å; L269-G273 PolarHBondContact O-N 3.15Å; L269-F274 CarbonylContact C-O 3.55Å; L269-F274 HydrophobicContact CB-CB 3.97Å; L269-F274 HydrophobicContact CD2-CB 4.06Å; L269-F274 HydrophobicContact CD2-CD2 3.87Å; L269-F274 HydrophobicContact CD2-CG 4.06Å; L269-F274 WeakPolarHBondContact O-CB 3.43Å; L269-F274 PolarHBondContact O-N 3.21Å; L269-L283 HydrophobicContact CD2-CD1 3.69Å; L269-L291 HydrophobicContact CD2-CD1 3.58Å
270S92.6Very high91.8Very high54 Ų5465.1 Ų65.138%0.37837%0.365SS..Hα-helixtrans-61.2-43177.1-175.40000112.7S266 S267 L268 H272 G273S266-S270 VanDerWaalsContact O-CB 3.27Å; S266-S270 WeakPolarHBondContact O-CB 3.49Å; S266-S270 PolarHBondContact O-N 3.48Å; S267-S270 PolarHBondContact O-N 3.01Å; L268-S270 VanDerWaalsContact C-N 3.35Å; L268-S270 PolarHBondContact O-N 3.01Å; S270-H272 PolarHBondContact O-N 3.37Å; S270-G273 PolarHBondContact O-N 3.43Å; S270-G273 VanDerWaalsContact O-N 3.08Å
271M90.9Very high91.8Very high152 Ų15264.6 Ų64.675%0.74936%0.364SS*.Hα-helixtrans-62.8-26.8177.8-75.5-61.4-58.100112.7S267 L268 L269S267-M271 WeakPolarHBondContact O-CB 3.15Å; S267-M271 VanDerWaalsContact O-CG 3.24Å; S267-M271 WeakPolarHBondContact O-CG 3.45Å; S267-M271 PolarHBondContact O-N 3.5Å; L268-M271 PolarHBondContact O-N 2.84Å; L269-M271 PolarHBondContact O-N 3.24Å
272H92Very high91.8Very high106 Ų10664.1 Ų64.149%0.49136%0.359SS..THydrogen-bonded Turntrans-968.6177.4-77.5-91.2000113.6L268 L269 S270 F274 L291L268-H272 PolarHBondContact O-CD2 2.94Å; L268-H272 VanDerWaalsContact O-CD2 3.26Å; L268-H272 PolarHBondContact O-N 2.92Å; L269-H272 CarbonylContact O-C 3.52Å; L269-H272 PolarHBondContact O-N 3.34Å; L269-H272 VanDerWaalsContact O-N 3.16Å; S270-H272 PolarHBondContact O-N 3.37Å; H272-F274 HydrophobicContact CB-CD2 3.99Å; H272-F274 HydrophobicContact CB-CE2 4.07Å; H272-L291 HydrophobicContact CB-CD2 3.49Å; H272-L291 VanDerWaalsContact CB-CD2 3.49Å; H272-L291 WeakPolarHBondContact CD2-CD2 3.5Å
273G89.4Confident91.7Very high39 Ų3964.1 Ų64.140%0.40236%0.359SS..THydrogen-bonded Turntrans89.82.2174.200000115.4L269 S270 Q275L269-G273 PolarHBondContact O-N 3.15Å; S270-G273 PolarHBondContact O-N 3.43Å; S270-G273 VanDerWaalsContact O-N 3.08Å; G273-Q275 PolarHBondContact O-N 3.5Å; G273-Q275 VanDerWaalsContact O-N 3.08Å
274F92.3Very high91.8Very high32 Ų3267.6 Ų67.614%0.1437%0.369CS..  trans-82.883.8173.7-58.7-82.3000109.4L253 L269 H272 D279 L283 H287 L291L253-F274 WeakPolarHBondContact CD2-O 3.46Å; L269-F274 CarbonylContact C-O 3.55Å; L269-F274 HydrophobicContact CB-CB 3.97Å; L269-F274 HydrophobicContact CD2-CB 4.06Å; L269-F274 HydrophobicContact CD2-CD2 3.87Å; L269-F274 HydrophobicContact CD2-CG 4.06Å; L269-F274 WeakPolarHBondContact O-CB 3.43Å; L269-F274 PolarHBondContact O-N 3.21Å; H272-F274 HydrophobicContact CB-CD2 3.99Å; H272-F274 HydrophobicContact CB-CE2 4.07Å; F274-D279 HydrophobicContact CB-CB 4.41Å; F274-D279 HydrophobicContact CD1-CB 3.84Å; F274-L283 HydrophobicContact CD1-CD1 3.77Å; F274-L283 HydrophobicContact CD1-CG 4.33Å; F274-L283 HydrophobicContact CE1-CD1 3.94Å; F274-L283 HydrophobicContact CE1-CG 4.02Å; F274-L283 HydrophobicContact CG-CD1 4.12Å; F274-L283 HydrophobicContact CZ-CD1 4.4Å; F274-L283 HydrophobicContact CZ-CG 4.43Å; F274-H287 HydrophobicContact CZ-CB 3.99Å; F274-L291 HydrophobicContact CD2-CD1 4.38Å; F274-L291 HydrophobicContact CE2-CD1 4.04Å; F274-L291 HydrophobicContact CE2-CD2 4.44Å
275Q90.8Very high91.8Very high136 Ų13662.6 Ų62.664%0.63635%0.345SS*.  trans-111.5-24.7-178.4-68.317868.700112.6G273G273-Q275 PolarHBondContact O-N 3.5Å; G273-Q275 VanDerWaalsContact O-N 3.08Å
276S91.4Very high92Very high43 Ų4364.1 Ų64.130%0.30136%0.358SS..SBendtrans-99.7165.4179.576.80000112.8E278 D279 F280S276-E278 VanDerWaalsContact C-N 3.26Å; S276-E278 PolarHBondContact OG-N 3.23Å; S276-D279 WeakPolarHBondContact CB-OD2 3.31Å; S276-D279 PolarHBondContact N-OD2 3.09Å; S276-D279 VanDerWaalsContact N-OD2 3.14Å; S276-D279 PolarHBondContact OG-N 3.48Å; S276-D279 PolarHBondContact OG-OD2 3.14Å; S276-F280 PolarHBondContact O-N 3.21Å
277L91.4Very high92Very high48 Ų4864.5 Ų64.525%0.25135%0.354SS..Hα-helixtrans-66.3-31.5170.1-69.4176.3000111.6P250 V256 F280 T281 L309P250-L277 WeakPolarHBondContact O-CD1 3.3Å; V256-L277 HydrophobicContact CG2-CD2 3.65Å; L277-F280 WeakPolarHBondContact O-CB 3.24Å; L277-F280 PolarHBondContact O-N 3.45Å; L277-T281 WeakPolarHBondContact O-CG2 3.39Å; L277-T281 PolarHBondContact O-N 3.4Å; L277-T281 PolarHBondContact O-OG1 2.92Å; L277-L309 HydrophobicContact CD2-CD1 4.21Å
278E91.4Very high92.1Very high156 Ų15660.7 Ų60.773%0.72933%0.328SS*.Hα-helixtrans-66.2-44.2178.5-174.7174.9-177.700111.8S276 F280 T281 G282S276-E278 VanDerWaalsContact C-N 3.26Å; S276-E278 PolarHBondContact OG-N 3.23Å; E278-F280 PolarHBondContact O-N 3.43Å; E278-T281 PolarHBondContact O-N 3.3Å; E278-T281 PolarHBondContact O-OG1 2.88Å; E278-G282 PolarHBondContact O-N 2.81Å; E278-G282 VanDerWaalsContact O-N 3.14Å
279D91.8Very high92.1Very high65 Ų6561.6 Ų61.635%0.34833%0.333SS..Hα-helixtrans-62-35.9174.9-54.3-49.6000110.9F274 S276 G282 L283F274-D279 HydrophobicContact CB-CB 4.41Å; F274-D279 HydrophobicContact CD1-CB 3.84Å; S276-D279 WeakPolarHBondContact CB-OD2 3.31Å; S276-D279 PolarHBondContact N-OD2 3.09Å; S276-D279 VanDerWaalsContact N-OD2 3.14Å; S276-D279 PolarHBondContact OG-N 3.48Å; S276-D279 PolarHBondContact OG-OD2 3.14Å; D279-G282 PolarHBondContact O-N 3.41Å; D279-L283 PolarHBondContact O-N 3.17Å
280F92.6Very high92.1Very high0 Ų068.1 Ų68.10%036%0.363CS..Hα-helixtrans-73.4-37.1179.9-174.6-94.6000113L253 V256 L257 S276 L277 E278 G282 L283 I302 A305 A306 L309L253-F280 HydrophobicContact CD1-CB 3.72Å; L253-F280 HydrophobicContact CD1-CD1 4.31Å; L253-F280 HydrophobicContact CD1-CD2 3.25Å; L253-F280 HydrophobicContact CD1-CE2 3.86Å; L253-F280 HydrophobicContact CD1-CG 3.49Å; L253-F280 VanDerWaalsContact CD1-CG 3.49Å; V256-F280 HydrophobicContact CG1-CD1 4.42Å; V256-F280 HydrophobicContact CG1-CE1 3.66Å; V256-F280 HydrophobicContact CG1-CZ 3.84Å; L257-F280 HydrophobicContact CD2-CE2 4.1Å; S276-F280 PolarHBondContact O-N 3.21Å; L277-F280 WeakPolarHBondContact O-CB 3.24Å; L277-F280 PolarHBondContact O-N 3.45Å; E278-F280 PolarHBondContact O-N 3.43Å; F280-G282 VanDerWaalsContact C-N 3.27Å; F280-G282 PolarHBondContact O-N 3.2Å; F280-L283 HydrophobicContact CD2-CD1 4.23Å; F280-L283 WeakPolarHBondContact O-CB 3.07Å; F280-L283 PolarHBondContact O-N 3.06Å; F280-I302 HydrophobicContact CE2-CG2 3.75Å; F280-I302 HydrophobicContact CZ-CG2 3.95Å; F280-A305 HydrophobicContact CE1-CB 3.94Å; F280-A305 HydrophobicContact CZ-CB 4.03Å; F280-A306 HydrophobicContact CD1-CB 4.27Å; F280-A306 HydrophobicContact CE1-CB 4.1Å; F280-A306 WeakPolarHBondContact O-CB 3.33Å; F280-L309 HydrophobicContact CD1-CD1 3.79Å; F280-L309 HydrophobicContact CE1-CD1 4.04Å
281T91.8Very high92.1Very high23 Ų2365.9 Ų65.914%0.14135%0.347CS..Hα-helixtrans-69.2-27.1174.257.90000112.1L277 E278 L283 L309 R310L277-T281 WeakPolarHBondContact O-CG2 3.39Å; L277-T281 PolarHBondContact O-N 3.4Å; L277-T281 PolarHBondContact O-OG1 2.92Å; E278-T281 PolarHBondContact O-N 3.3Å; E278-T281 PolarHBondContact O-OG1 2.88Å; T281-L283 VanDerWaalsContact C-N 3.26Å; T281-L283 PolarHBondContact O-N 2.96Å; T281-L309 HydrophobicContact CG2-CB 3.69Å; T281-L309 HydrophobicContact CG2-CD1 4.29Å; T281-R310 HydrophobicContact CG2-CG 4.17Å
282G90.4Very high92.1Very high41 Ų4164.9 Ų64.942%0.42335%0.345SS..THydrogen-bonded Turntrans-78.7-2.6172.300000114.9E278 D279 F280 K284E278-G282 PolarHBondContact O-N 2.81Å; E278-G282 VanDerWaalsContact O-N 3.14Å; D279-G282 PolarHBondContact O-N 3.41Å; F280-G282 VanDerWaalsContact C-N 3.27Å; F280-G282 PolarHBondContact O-N 3.2Å; G282-K284 PolarHBondContact O-N 2.93Å
283L92.1Very high92.1Very high7 Ų760.2 Ų60.24%0.03732%0.323CS..  trans-73.2125.4-171.7-149.5153.4000111.1L269 F274 D279 F280 T281 H287 L288 I302 L303L269-L283 HydrophobicContact CD2-CD1 3.69Å; F274-L283 HydrophobicContact CD1-CD1 3.77Å; F274-L283 HydrophobicContact CD1-CG 4.33Å; F274-L283 HydrophobicContact CE1-CD1 3.94Å; F274-L283 HydrophobicContact CE1-CG 4.02Å; F274-L283 HydrophobicContact CG-CD1 4.12Å; F274-L283 HydrophobicContact CZ-CD1 4.4Å; F274-L283 HydrophobicContact CZ-CG 4.43Å; D279-L283 PolarHBondContact O-N 3.17Å; F280-L283 HydrophobicContact CD2-CD1 4.23Å; F280-L283 WeakPolarHBondContact O-CB 3.07Å; F280-L283 PolarHBondContact O-N 3.06Å; T281-L283 VanDerWaalsContact C-N 3.26Å; T281-L283 PolarHBondContact O-N 2.96Å; L283-H287 HydrophobicContact CD2-CB 4.23Å; L283-H287 HydrophobicContact CG-CB 4.35Å; L283-L288 HydrophobicContact CD2-CD1 4.16Å; L283-L288 HydrophobicContact CD2-CD2 3.38Å; L283-L288 HydrophobicContact CD2-CG 3.46Å; L283-L288 VanDerWaalsContact CD2-CG 3.46Å; L283-I302 HydrophobicContact CD1-CG2 4.42Å; L283-I302 HydrophobicContact CD2-CG2 4Å; L283-L303 WeakPolarHBondContact O-CD2 3.31Å
284K93.1Very high92.2Very high135 Ų13562.7 Ų62.759%0.58733%0.331SS*.  trans-115.2165.9-178.1-68.8178.4-174.1168.60110.8G282 S286 H287 L288G282-K284 PolarHBondContact O-N 2.93Å; K284-S286 PolarHBondContact O-N 2.78Å; K284-S286 VanDerWaalsContact O-N 3.15Å; K284-H287 PolarHBondContact N-ND1 2.65Å; K284-H287 VanDerWaalsContact N-ND1 3.17Å; K284-H287 WeakPolarHBondContact O-CB 3.33Å; K284-H287 PolarHBondContact O-N 3.28Å; K284-L288 PolarHBondContact O-N 2.63Å
285E93.2Very high92.4Very high69 Ų6965.3 Ų65.332%0.32235%0.346SS..Hα-helixtrans-56.8-30.1175.7-164.757.9-87.400113.7N289 R299 L303E285-N289 VanDerWaalsContact O-CG 3.32Å; E285-N289 PolarHBondContact O-N 3.36Å; E285-N289 PolarHBondContact O-ND2 2.78Å; E285-R299 VanDerWaalsContact CD-CZ 3.44Å; E285-R299 VanDerWaalsContact CG-NH2 3.28Å; E285-R299 IonicContact OE1-CZ 3.88Å; E285-R299 IonicContact OE1-NE 2.65Å; E285-R299 PolarHBondContact OE1-NE 3.42Å; E285-R299 IonicContact OE1-NH2 3.02Å; E285-R299 PolarHBondContact OE1-NH2 2.81Å; E285-R299 IonicContact OE2-CZ 3.54Å; E285-R299 IonicContact OE2-NE 3.66Å; E285-R299 PolarHBondContact OE2-NE 3.46Å; E285-R299 IonicContact OE2-NH2 3.79Å; E285-L303 HydrophobicContact CB-CD1 4.45Å; E285-L303 VanDerWaalsContact OE2-CD1 3.31Å; E285-L303 WeakPolarHBondContact OE2-CD1 3.36Å
286S93.4Very high92.5Very high55 Ų5563.2 Ų63.239%0.38535%0.345SS..Hα-helixtrans-63.4-46.3173.148.60000112.2K284 L288 N289 E290K284-S286 PolarHBondContact O-N 2.78Å; K284-S286 VanDerWaalsContact O-N 3.15Å; S286-L288 VanDerWaalsContact C-N 3.31Å; S286-L288 PolarHBondContact O-N 3.25Å; S286-N289 WeakPolarHBondContact O-CB 3.24Å; S286-N289 PolarHBondContact O-N 3.17Å; S286-N289 VanDerWaalsContact O-N 3.16Å; S286-E290 PolarHBondContact O-N 2.92Å; S286-E290 VanDerWaalsContact O-N 3.13Å
287H93.9Very high92.7Very high54 Ų5466.5 Ų66.525%0.2536%0.358CS..Hα-helixtrans-63.8-40.1179.6-51146.3000110.5F274 L283 K284 N289 E290 L291F274-H287 HydrophobicContact CZ-CB 3.99Å; L283-H287 HydrophobicContact CD2-CB 4.23Å; L283-H287 HydrophobicContact CG-CB 4.35Å; K284-H287 PolarHBondContact N-ND1 2.65Å; K284-H287 VanDerWaalsContact N-ND1 3.17Å; K284-H287 WeakPolarHBondContact O-CB 3.33Å; K284-H287 PolarHBondContact O-N 3.28Å; H287-N289 VanDerWaalsContact C-N 3.29Å; H287-N289 PolarHBondContact O-N 2.89Å; H287-E290 PolarHBondContact O-N 2.67Å; H287-E290 VanDerWaalsContact O-N 3.17Å; H287-L291 WeakPolarHBondContact O-CB 3.19Å; H287-L291 WeakPolarHBondContact O-CG 3.14Å; H287-L291 PolarHBondContact O-N 3.22Å
288L94.3Very high92.8Very high0 Ų066.7 Ų66.70%036%0.358CS..Hα-helixtrans-61.9-35.9175.8-64.4175.8000113L283 K284 S286 L291 N292 I293 R299 I302 L303L283-L288 HydrophobicContact CD2-CD1 4.16Å; L283-L288 HydrophobicContact CD2-CD2 3.38Å; L283-L288 HydrophobicContact CD2-CG 3.46Å; L283-L288 VanDerWaalsContact CD2-CG 3.46Å; K284-L288 PolarHBondContact O-N 2.63Å; S286-L288 VanDerWaalsContact C-N 3.31Å; S286-L288 PolarHBondContact O-N 3.25Å; L288-L291 HydrophobicContact CD2-CD1 4.5Å; L288-L291 PolarHBondContact O-N 2.83Å; L288-N292 PolarHBondContact O-N 2.86Å; L288-I293 HydrophobicContact CB-CB 4.41Å; L288-I293 HydrophobicContact CD2-CB 4.36Å; L288-I293 HydrophobicContact CD2-CD1 3.69Å; L288-I293 PolarHBondContact O-N 2.79Å; L288-R299 HydrophobicContact CB-CG 4.39Å; L288-R299 HydrophobicContact CD1-CB 3.94Å; L288-R299 HydrophobicContact CD1-CG 4.01Å; L288-I302 HydrophobicContact CD2-CB 4.46Å; L288-I302 HydrophobicContact CD2-CD1 3.69Å; L288-I302 HydrophobicContact CD2-CG2 4.11Å; L288-L303 HydrophobicContact CD1-CD1 4.37Å; L288-L303 HydrophobicContact CD1-CD2 4.23Å; L288-L303 HydrophobicContact CD1-CG 4.01Å
289N93.4Very high93Very high78 Ų7861.8 Ų61.842%0.41733%0.333SS..Hα-helixtrans-66.8-41.7174.4-67.9-32.3000111.7E285 S286 H287 L291 N292 R299E285-N289 VanDerWaalsContact O-CG 3.32Å; E285-N289 PolarHBondContact O-N 3.36Å; E285-N289 PolarHBondContact O-ND2 2.78Å; S286-N289 WeakPolarHBondContact O-CB 3.24Å; S286-N289 PolarHBondContact O-N 3.17Å; S286-N289 VanDerWaalsContact O-N 3.16Å; H287-N289 VanDerWaalsContact C-N 3.29Å; H287-N289 PolarHBondContact O-N 2.89Å; N289-L291 VanDerWaalsContact C-N 3.28Å; N289-L291 PolarHBondContact O-N 2.82Å; N289-N292 PolarHBondContact O-N 2.87Å; N289-R299 PolarHBondContact OD1-NH2 2.64Å
290E92.5Very high93.1Very high138 Ų13861.8 Ų61.865%0.64534%0.338SS*.Hα-helixtrans-65.2-34177.3-68.9166.9-159.600111.8S286 H287 N292S286-E290 PolarHBondContact O-N 2.92Å; S286-E290 VanDerWaalsContact O-N 3.13Å; H287-E290 PolarHBondContact O-N 2.67Å; H287-E290 VanDerWaalsContact O-N 3.17Å; E290-N292 PolarHBondContact O-N 2.97Å
291L91.4Very high93.2Very high6 Ų666 Ų663%0.03136%0.356CS..THydrogen-bonded Turntrans-75.20.6173.1-63.9168.9000113.5L268 L269 H272 F274 H287 L288 N289 I293L268-L291 HydrophobicContact CD2-CB 4.28Å; L268-L291 WeakPolarHBondContact CD2-O 3.27Å; L268-L291 HydrophobicContact CG-CD2 4.43Å; L269-L291 HydrophobicContact CD2-CD1 3.58Å; H272-L291 HydrophobicContact CB-CD2 3.49Å; H272-L291 VanDerWaalsContact CB-CD2 3.49Å; H272-L291 WeakPolarHBondContact CD2-CD2 3.5Å; F274-L291 HydrophobicContact CD2-CD1 4.38Å; F274-L291 HydrophobicContact CE2-CD1 4.04Å; F274-L291 HydrophobicContact CE2-CD2 4.44Å; H287-L291 WeakPolarHBondContact O-CB 3.19Å; H287-L291 WeakPolarHBondContact O-CG 3.14Å; H287-L291 PolarHBondContact O-N 3.22Å; L288-L291 HydrophobicContact CD2-CD1 4.5Å; L288-L291 PolarHBondContact O-N 2.83Å; N289-L291 VanDerWaalsContact C-N 3.28Å; N289-L291 PolarHBondContact O-N 2.82Å; L291-I293 HydrophobicContact CB-CD1 3.79Å; L291-I293 HydrophobicContact CB-CG1 3.94Å; L291-I293 HydrophobicContact CD1-CD1 3.97Å; L291-I293 PolarHBondContact O-N 2.67Å
292N91.3Very high93.3Very high132 Ų13265 Ų6571%0.70635%0.35SS*.THydrogen-bonded Turntrans5823.1-173.4-61.5-71.5000114.6L288 N289 E290 T294L288-N292 PolarHBondContact O-N 2.86Å; N289-N292 PolarHBondContact O-N 2.87Å; E290-N292 PolarHBondContact O-N 2.97Å; N292-T294 VanDerWaalsContact C-N 3.28Å; N292-T294 PolarHBondContact O-N 3.24Å
293I91.9Very high93.5Very high7 Ų765 Ų654%0.03634%0.34CS..  trans-82.179.9173.8-56.5165.3000107.8L265 L268 L288 L291 H298 R299 I302L265-I293 HydrophobicContact CD1-CD1 4.08Å; L265-I293 HydrophobicContact CD1-CG1 4.47Å; L265-I293 HydrophobicContact CD1-CG2 4.36Å; L265-I293 HydrophobicContact CD2-CD1 4.35Å; L265-I293 HydrophobicContact CD2-CG1 4.26Å; L268-I293 HydrophobicContact CD2-CD1 4.11Å; L268-I293 HydrophobicContact CD2-CG1 3.97Å; L288-I293 HydrophobicContact CB-CB 4.41Å; L288-I293 HydrophobicContact CD2-CB 4.36Å; L288-I293 HydrophobicContact CD2-CD1 3.69Å; L288-I293 PolarHBondContact O-N 2.79Å; L291-I293 HydrophobicContact CB-CD1 3.79Å; L291-I293 HydrophobicContact CB-CG1 3.94Å; L291-I293 HydrophobicContact CD1-CD1 3.97Å; L291-I293 PolarHBondContact O-N 2.67Å; I293-H298 HydrophobicContact CG2-CB 3.74Å; I293-R299 HydrophobicContact CG2-CG 4.29Å; I293-R299 VanDerWaalsContact O-CD 3.31Å; I293-R299 WeakPolarHBondContact O-CD 3.29Å; I293-R299 VanDerWaalsContact O-CG 3.22Å; I293-R299 WeakPolarHBondContact O-CG 3.46Å; I293-I302 HydrophobicContact CD1-CD1 4.22Å; I293-I302 HydrophobicContact CG2-CD1 4.46Å
294T92.9Very high93.6Very high92 Ų9269.9 Ų69.956%0.56437%0.366SS*.  trans-86-17.3-175.752.60000113.6N292N292-T294 VanDerWaalsContact C-N 3.28Å; N292-T294 PolarHBondContact O-N 3.24Å
295N94.8Very high93.6Very high87 Ų8764 Ų6447%0.46534%0.342SS..  trans-64.7120.8-178.7-71.5-43.8000111.4D297 H298 R299N295-D297 VanDerWaalsContact C-N 3.27Å; N295-D297 PolarHBondContact O-N 3.16Å; N295-H298 HydrophobicContact CB-CB 4.06Å; N295-H298 PolarHBondContact O-N 3.44Å; N295-H298 VanDerWaalsContact O-N 3.13Å; N295-R299 WeakPolarHBondContact O-CD 3.46Å; N295-R299 VanDerWaalsContact O-CG 3.27Å; N295-R299 WeakPolarHBondContact O-CG 3.49Å; N295-R299 PolarHBondContact O-N 3.48Å
296P93.5Very high93.6Very high92 Ų9260.8 Ų60.860%0.59733%0.328SS*.Hα-helixtrans-63.7-32.7-175.625.9-34.4000112.8S300P296-S300 WeakPolarHBondContact O-CB 3.25Å; P296-S300 PolarHBondContact O-N 3.31Å; P296-S300 PolarHBondContact O-OG 3.05Å
297D95.2Very high93.5Very high111 Ų11162.4 Ų62.459%0.59433%0.332SS*.Hα-helixtrans-68.3-39176.7-62.4-43.4000111.7N295 S300 K301N295-D297 VanDerWaalsContact C-N 3.27Å; N295-D297 PolarHBondContact O-N 3.16Å; D297-S300 PolarHBondContact O-OG 3.08Å; D297-S300 VanDerWaalsContact O-OG 3.1Å; D297-K301 WeakPolarHBondContact O-CB 3.47Å; D297-K301 WeakPolarHBondContact O-CG 3.5Å; D297-K301 PolarHBondContact O-N 3.3Å; D297-K301 VanDerWaalsContact O-N 3.09Å
298H94.4Very high93.3Very high53 Ų5363.7 Ų63.725%0.24534%0.341CS..Hα-helixtrans-69.5-43.9178-66.1-164.9000110.3L262 L265 I293 N295 K301 I302L262-H298 HydrophobicContact CD1-CB 4.18Å; L262-H298 HydrophobicContact CD2-CB 4.33Å; L265-H298 HydrophobicContact CD1-CB 4.5Å; I293-H298 HydrophobicContact CG2-CB 3.74Å; N295-H298 HydrophobicContact CB-CB 4.06Å; N295-H298 PolarHBondContact O-N 3.44Å; N295-H298 VanDerWaalsContact O-N 3.13Å; H298-K301 PolarHBondContact O-N 3.39Å; H298-I302 VanDerWaalsContact O-CG1 3.3Å; H298-I302 WeakPolarHBondContact O-CG1 3.22Å; H298-I302 PolarHBondContact O-N 2.94Å
299R94.6Very high92.9Very high53 Ų5365 Ų6520%0.235%0.347CS..Hα-helixtrans-59.9-50.7178.6-64.1161.770.3148.930.2111.7E285 L288 N289 I293 N295 K301 I302 L303E285-R299 VanDerWaalsContact CD-CZ 3.44Å; E285-R299 VanDerWaalsContact CG-NH2 3.28Å; E285-R299 IonicContact OE1-CZ 3.88Å; E285-R299 IonicContact OE1-NE 2.65Å; E285-R299 PolarHBondContact OE1-NE 3.42Å; E285-R299 IonicContact OE1-NH2 3.02Å; E285-R299 PolarHBondContact OE1-NH2 2.81Å; E285-R299 IonicContact OE2-CZ 3.54Å; E285-R299 IonicContact OE2-NE 3.66Å; E285-R299 PolarHBondContact OE2-NE 3.46Å; E285-R299 IonicContact OE2-NH2 3.79Å; L288-R299 HydrophobicContact CB-CG 4.39Å; L288-R299 HydrophobicContact CD1-CB 3.94Å; L288-R299 HydrophobicContact CD1-CG 4.01Å; N289-R299 PolarHBondContact OD1-NH2 2.64Å; I293-R299 HydrophobicContact CG2-CG 4.29Å; I293-R299 VanDerWaalsContact O-CD 3.31Å; I293-R299 WeakPolarHBondContact O-CD 3.29Å; I293-R299 VanDerWaalsContact O-CG 3.22Å; I293-R299 WeakPolarHBondContact O-CG 3.46Å; N295-R299 WeakPolarHBondContact O-CD 3.46Å; N295-R299 VanDerWaalsContact O-CG 3.27Å; N295-R299 WeakPolarHBondContact O-CG 3.49Å; N295-R299 PolarHBondContact O-N 3.48Å; R299-K301 PolarHBondContact O-N 2.98Å; R299-I302 PolarHBondContact O-N 2.79Å; R299-L303 WeakPolarHBondContact O-CB 3.45Å; R299-L303 VanDerWaalsContact O-CG 3.3Å; R299-L303 WeakPolarHBondContact O-CG 3.36Å; R299-L303 PolarHBondContact O-N 2.9Å
300S94.1Very high92.6Very high64 Ų6468.4 Ų68.445%0.44835%0.354SS..Hα-helixtrans-63.3-39.1179.358.50000112.6P296 D297 N304P296-S300 WeakPolarHBondContact O-CB 3.25Å; P296-S300 PolarHBondContact O-N 3.31Å; P296-S300 PolarHBondContact O-OG 3.05Å; D297-S300 PolarHBondContact O-OG 3.08Å; D297-S300 VanDerWaalsContact O-OG 3.1Å; S300-N304 WeakPolarHBondContact O-CB 3.39Å; S300-N304 PolarHBondContact O-N 3.16Å
301K95.3Very high91.9Very high90 Ų9067.5 Ų67.539%0.39135%0.354SS..Hα-helixtrans-62.6-46.5174.7-78.1175174.9-164.60112.6I260 L262 D297 H298 R299 A305I260-K301 PolarHBondContact O-NZ 2.94Å; L262-K301 HydrophobicContact CD1-CB 3.93Å; L262-K301 HydrophobicContact CD1-CD 4.14Å; L262-K301 HydrophobicContact CG-CD 4.34Å; D297-K301 WeakPolarHBondContact O-CB 3.47Å; D297-K301 WeakPolarHBondContact O-CG 3.5Å; D297-K301 PolarHBondContact O-N 3.3Å; D297-K301 VanDerWaalsContact O-N 3.09Å; H298-K301 PolarHBondContact O-N 3.39Å; R299-K301 PolarHBondContact O-N 2.98Å; K301-A305 VanDerWaalsContact O-CB 3.31Å; K301-A305 WeakPolarHBondContact O-CB 3.47Å; K301-A305 PolarHBondContact O-N 2.89Å
302I94.3Very high90.8Very high0 Ų069.1 Ų69.10%037%0.366CS..Hα-helixtrans-64.4-50.3179.9-67.8165000110.4I260 L262 L265 F280 L283 L288 I293 H298 R299 N304 A305 A306I260-I302 HydrophobicContact CD1-CG1 4.32Å; L262-I302 HydrophobicContact CD1-CD1 4.18Å; L262-I302 HydrophobicContact CD1-CG1 3.79Å; L265-I302 HydrophobicContact CD1-CD1 3.79Å; F280-I302 HydrophobicContact CE2-CG2 3.75Å; F280-I302 HydrophobicContact CZ-CG2 3.95Å; L283-I302 HydrophobicContact CD1-CG2 4.42Å; L283-I302 HydrophobicContact CD2-CG2 4Å; L288-I302 HydrophobicContact CD2-CB 4.46Å; L288-I302 HydrophobicContact CD2-CD1 3.69Å; L288-I302 HydrophobicContact CD2-CG2 4.11Å; I293-I302 HydrophobicContact CD1-CD1 4.22Å; I293-I302 HydrophobicContact CG2-CD1 4.46Å; H298-I302 VanDerWaalsContact O-CG1 3.3Å; H298-I302 WeakPolarHBondContact O-CG1 3.22Å; H298-I302 PolarHBondContact O-N 2.94Å; R299-I302 PolarHBondContact O-N 2.79Å; I302-N304 VanDerWaalsContact C-N 3.35Å; I302-N304 PolarHBondContact O-N 2.8Å; I302-A305 PolarHBondContact O-N 3.27Å; I302-A306 WeakPolarHBondContact O-CB 3.45Å; I302-A306 PolarHBondContact O-N 2.79Å
303L93.9Very high89.4Confident43 Ų4369.2 Ų69.223%0.22536%0.362CS..Hα-helixtrans-62.3-41.7179.9-67.1173.6000111.8L283 E285 L288 R299 A305 A306 D307L283-L303 WeakPolarHBondContact O-CD2 3.31Å; E285-L303 HydrophobicContact CB-CD1 4.45Å; E285-L303 VanDerWaalsContact OE2-CD1 3.31Å; E285-L303 WeakPolarHBondContact OE2-CD1 3.36Å; L288-L303 HydrophobicContact CD1-CD1 4.37Å; L288-L303 HydrophobicContact CD1-CD2 4.23Å; L288-L303 HydrophobicContact CD1-CG 4.01Å; R299-L303 WeakPolarHBondContact O-CB 3.45Å; R299-L303 VanDerWaalsContact O-CG 3.3Å; R299-L303 WeakPolarHBondContact O-CG 3.36Å; R299-L303 PolarHBondContact O-N 2.9Å; L303-A305 PolarHBondContact O-N 2.81Å; L303-A306 PolarHBondContact O-N 3.15Å; L303-D307 PolarHBondContact O-N 3.34Å
304N94.4Very high87.5Confident108 Ų10876.2 Ų76.258%0.57840%0.4SS*.Hα-helixtrans-64.8-39.4176.8-170.5-85.1000112.4S300 I302 D307 L308S300-N304 WeakPolarHBondContact O-CB 3.39Å; S300-N304 PolarHBondContact O-N 3.16Å; I302-N304 VanDerWaalsContact C-N 3.35Å; I302-N304 PolarHBondContact O-N 2.8Å; N304-D307 PolarHBondContact O-N 3.18Å; N304-L308 WeakPolarHBondContact O-CB 3.35Å; N304-L308 PolarHBondContact O-N 3.05Å
305A93.6Very high85.7Confident11 Ų1180.6 Ų80.69%0.09141%0.414CS..Hα-helixtrans-66.9-40.317600000111.8V256 I260 F280 K301 I302 L303 L308 L309V256-A305 HydrophobicContact CG1-CB 3.96Å; I260-A305 HydrophobicContact CG2-CB 3.93Å; F280-A305 HydrophobicContact CE1-CB 3.94Å; F280-A305 HydrophobicContact CZ-CB 4.03Å; K301-A305 VanDerWaalsContact O-CB 3.31Å; K301-A305 WeakPolarHBondContact O-CB 3.47Å; K301-A305 PolarHBondContact O-N 2.89Å; I302-A305 PolarHBondContact O-N 3.27Å; L303-A305 PolarHBondContact O-N 2.81Å; A305-L308 PolarHBondContact O-N 3.18Å; A305-L309 WeakPolarHBondContact O-CG 2.93Å; A305-L309 PolarHBondContact O-N 3.13Å
306A92.9Very high83.4Confident2 Ų279.9 Ų79.92%0.01742%0.415CS..Hα-helixtrans-61.8-45.1174.500000111.9F280 I302 L303 L308 L309 R310F280-A306 HydrophobicContact CD1-CB 4.27Å; F280-A306 HydrophobicContact CE1-CB 4.1Å; F280-A306 WeakPolarHBondContact O-CB 3.33Å; I302-A306 WeakPolarHBondContact O-CB 3.45Å; I302-A306 PolarHBondContact O-N 2.79Å; L303-A306 PolarHBondContact O-N 3.15Å; A306-L308 PolarHBondContact O-N 2.88Å; A306-L309 PolarHBondContact O-N 3.2Å; A306-R310 PolarHBondContact O-N 2.78Å
307D91.2Very high80.8Confident89 Ų8984.5 Ų84.548%0.47643%0.429SS..Hα-helixtrans-62-43.1176.3-73-25.2000111.9L303 N304 L309 R310 D311L303-D307 PolarHBondContact O-N 3.34Å; N304-D307 PolarHBondContact O-N 3.18Å; D307-L309 VanDerWaalsContact C-N 3.28Å; D307-L309 PolarHBondContact O-N 2.74Å; D307-R310 PolarHBondContact O-N 2.95Å; D307-D311 PolarHBondContact O-N 3.25Å; D307-D311 VanDerWaalsContact O-N 3.09Å
308L89.4Confident78.4Confident82 Ų8285.4 Ų85.443%0.42944%0.441SS..Hα-helixtrans-64.2-32.8-179.5-176.463.2000113N304 A305 A306 S312N304-L308 WeakPolarHBondContact O-CB 3.35Å; N304-L308 PolarHBondContact O-N 3.05Å; A305-L308 PolarHBondContact O-N 3.18Å; A306-L308 PolarHBondContact O-N 2.88Å; L308-S312 PolarHBondContact O-OG 2.96Å
309L86.9Confident76Confident26 Ų2692.6 Ų92.614%0.13648%0.475CS..Hα-helixtrans-69.5-43.4175.4-70.4170.2000111P250 V256 L277 F280 T281 A305 A306 D307 D311 S312 E313P250-L309 HydrophobicContact CG-CD2 3.85Å; V256-L309 HydrophobicContact CG1-CD1 4.39Å; V256-L309 HydrophobicContact CG2-CD1 4.01Å; L277-L309 HydrophobicContact CD2-CD1 4.21Å; F280-L309 HydrophobicContact CD1-CD1 3.79Å; F280-L309 HydrophobicContact CE1-CD1 4.04Å; T281-L309 HydrophobicContact CG2-CB 3.69Å; T281-L309 HydrophobicContact CG2-CD1 4.29Å; A305-L309 WeakPolarHBondContact O-CG 2.93Å; A305-L309 PolarHBondContact O-N 3.13Å; A306-L309 PolarHBondContact O-N 3.2Å; D307-L309 VanDerWaalsContact C-N 3.28Å; D307-L309 PolarHBondContact O-N 2.74Å; L309-D311 VanDerWaalsContact C-N 3.33Å; L309-D311 PolarHBondContact O-N 2.96Å; L309-S312 PolarHBondContact O-N 2.83Å; L309-E313 PolarHBondContact O-N 2.88Å
310R86.1Confident73.4Confident151 Ų15193.3 Ų93.357%0.5750%0.499SS*.Hα-helixtrans-58.7-42.6175.9-71.9179.863.2172.40112.7T281 A306 D307 S312 E313T281-R310 HydrophobicContact CG2-CG 4.17Å; A306-R310 PolarHBondContact O-N 2.78Å; D307-R310 PolarHBondContact O-N 2.95Å; R310-S312 PolarHBondContact O-N 3.44Å; R310-E313 PolarHBondContact O-N 2.93Å
311D77Confident70.7Confident118 Ų11898.4 Ų98.463%0.63152%0.521SS*.Hα-helixtrans-65.3-18.7178.8-71.1-15.6000113.1D307 L309D307-D311 PolarHBondContact O-N 3.25Å; D307-D311 VanDerWaalsContact O-N 3.09Å; L309-D311 VanDerWaalsContact C-N 3.33Å; L309-D311 PolarHBondContact O-N 2.96Å
312S68.9Low68.4Low41 Ų41102.8 Ų102.829%0.28754%0.543SS..Hα-helixtrans-98-12.5-175.1-58.30000114.4K249 L308 L309 R310K249-S312 PolarHBondContact NZ-O 2.87Å; L308-S312 PolarHBondContact O-OG 2.96Å; L309-S312 PolarHBondContact O-N 2.83Å; R310-S312 PolarHBondContact O-N 3.44Å
313E61.4Low65.8Low133 Ų133111.8 Ų111.862%0.62159%0.585SS**Hα-helixtrans-85.6-31173.9-69.3-173.1101.400111.7L309 R310 E315L309-E313 PolarHBondContact O-N 2.88Å; R310-E313 PolarHBondContact O-N 2.93Å; E313-E315 VanDerWaalsContact C-N 3.28Å; E313-E315 PolarHBondContact O-N 2.74Å
314D52.5Low63.3Low155 Ų155118.3 Ų118.383%0.82961%0.614SS**THydrogen-bonded Turntrans-71.5-15.2-178.2-160.280.1000114
315E55.2Low60.7Low183 Ų183121.7 Ų121.786%0.85563%0.627SS**THydrogen-bonded Turntrans-101.14.1-172.5-138.6-156.515400115.3E313E313-E315 VanDerWaalsContact C-N 3.28Å; E313-E315 PolarHBondContact O-N 2.74Å
316S45.7Very low57.8Low72 Ų72127.4 Ų127.450%0.50366%0.656SS.*  trans-128.890.9-177.7510000113.3
317E39.8Very low55.1Low189 Ų189137.3 Ų137.388%0.88369%0.693SS**  trans-114.3137.1158.2-62.5-141.5147.200110.3
318P45.2Very low52.4Low130 Ų130138.1 Ų138.184%0.84471%0.705SS**  trans-89.5136.6177.433.7-31.4000112.5
319E43.6Very low50.1Low204 Ų204138.9 Ų138.995%0.95372%0.723SS**  trans-96145.6171.6-68.1-132.9163.100112.3
320G40.5Very low47.8Very low69 Ų69146 Ų14671%0.71176%0.756SS**  trans133101.1152.300000115.8
321D36.2Very low45.3Very low170 Ų170145 Ų14591%0.90976%0.762SS**  -179.9150.8105.2-102.2-20.4000113.2
322E47.8Very low43.5Very low182 Ų182143 Ų14385%0.8576%0.757SS**  trans-95154.5-169.9-52.3-179.3170.100111.6
323E39.9Very low42.2Very low189 Ų189150.3 Ų150.388%0.88378%0.784SS**  trans175.7110.8140.8-95.3173.7-152.300112.6
324E41.6Very low41.5Very low181 Ų181152.2 Ų152.285%0.84679%0.793SS**  trans32.3154.3138.5-62.5-64.8165.800127.5
325E39.2Very low41.7Very low178 Ų178150.9 Ų150.983%0.83279%0.792SS**  trans104.294.8155.3-55.3-155.1164.500122.3
326D32Very low41.7Very low131 Ų131153.1 Ų153.170%0.70179%0.793SS**  36.3120.5120.5-153.923.5000122
327R37.1Very low41.4Very low210 Ų210156.5 Ų156.579%0.79281%0.806SS**  152.3135.3114.7-78.8-167.1177.9-176.61.6117.9
328S35.2Very low41.9Very low106 Ų106152.9 Ų152.974%0.74180%0.801SS**  trans65.5106.6139650000123.4
329A40.7Very low41.8Very low98 Ų98150.5 Ų150.581%0.8180%0.8SS**  52.3133113.600000123.4
330E38.5Very low41.8Very low177 Ų177145.9 Ų145.983%0.82779%0.789SS**  trans83.1111.8146.3-153.6177.5169.600118.4
331N34Very low41.8Very low128 Ų128152.3 Ų152.368%0.68480%0.798SS**  170.8140.794.4-156.4-1.4000113.3
332S38.8Very low41.8Very low77 Ų77152.2 Ų152.254%0.53879%0.792SS.*  trans78.9109.3138.748.20000123.5
333K40.5Very low41.2Very low195 Ų195148.8 Ų148.885%0.84879%0.788SS**  89.298.2120.5-67.5170.8-172.1172.40118.3
334E48.5Very low41.3Very low173 Ų173145.7 Ų145.781%0.80879%0.787SS**  trans-53.8156.8150.7-64.7159.4150.900112.4
335P56Low41.3Very low126 Ų126145.8 Ų145.882%0.81879%0.788SS**  trans-116119.3135.831.8-20.5000110.1
336R55.5Low41Very low230 Ų230143.5 Ų143.587%0.86878%0.781SS**  trans-54.9132.7156.4-75.3172.3161.2135.6-4.3109.6
337D38.2Very low41.3Very low144 Ų144146 Ų14677%0.7779%0.794SS**  trans-152.8106.7141.9-157.59.1000112
338S51.6Low41.3Very low113 Ų113143.6 Ų143.679%0.7979%0.791SS**  trans32114.1139.8-36.70000120.5
339G42.4Very low41.1Very low80 Ų80145.8 Ų145.883%0.82580%0.795SS**  trans-164.354.4165.400000112.9
340C44.2Very low40.7Very low106 Ų106144.6 Ų144.672%0.71679%0.792SS**  trans-71.3122.2167.6-179.20000109.6
341F40.4Very low40.4Very low204 Ų204147.5 Ų147.590%0.89580%0.795SS**  trans-133.6100.8149.6-114.7-85.6000108.3
342E36Very low40.3Very low168 Ų168150.2 Ų150.279%0.78580%0.804SS**  trans-86.9121.8172.6-162.6170.5-142.900107.3
343S35.5Very low40.2Very low111 Ų111153.7 Ų153.778%0.77681%0.812SS**  trans-159.186.3166.1-68.60000109.6
344S41.4Very low40.3Very low123 Ų123150.1 Ų150.186%0.8681%0.808SS**  trans-140.588.8148.342.50000107.8
345E41.1Very low39.3Very low184 Ų184149.5 Ų149.586%0.8680%0.803SS**  trans-70.2127164.554.3177.813800110.2
346N32.8Very low38Very low130 Ų130148.7 Ų148.770%0.69580%0.796SS**  trans38.3119.5147.4-88.5-59.6000120.8
347L38Very low36.8Very low184 Ų184146.4 Ų146.496%0.96380%0.795SS**  -142.6128.8111.6-80.8-174.1000111.5
348E37.9Very low36.6Very low158 Ų158148.6 Ų148.674%0.73880%0.8SS**  trans-92.5156.4-177.5168.7161-135.100112
349N31.8Very low35.7Very low153 Ų153151.9 Ų151.982%0.81880%0.803SS**  trans87.4112.7161-86.121.2000122.3
350G30.7Very low35.2Very low72 Ų72156.4 Ų156.474%0.74280%0.803SS**  137.392.7115.100000119
351R34Very low34.4Very low238 Ų238156.5 Ų156.590%0.89881%0.805SS**  trans39.7137.7135.5-89.4-179.9176.7-174.3-0.2119.8
352E31.6Very low33.8Very low185 Ų185152.3 Ų152.386%0.86480%0.801SS**  -156.5152.353.4-74.9-174.9140.200114.4
353E35.8Very low33.6Very low151 Ų151152.7 Ų152.771%0.70680%0.803SS**  trans-48170.6164.3-80-113165.100116.5
354P42.7Very low33.9Very low119 Ų119152.7 Ų152.777%0.77380%0.8SS**  cis-147.7158.843.737.7-14.8000121.4
355K26.9Very low33.3Very low161 Ų161152.4 Ų152.470%0.779%0.793SS**  trans7.3144136.3-84.5175.7171.6-178.10118.3
356T28.9Very low33.1Very low109 Ų109153.1 Ų153.167%0.66980%0.797SS**  cis-173.1123.744.5-10.30000106
357E31Very low33.2Very low181 Ų181157.7 Ų157.785%0.84680%0.804SS**  70.9127104.6-66.5175.8-171.700117.1
358E34.4Very low33.2Very low190 Ų190157 Ų15789%0.88880%0.796SS**  trans-79164.4176.3-59171.5148.400111.9
359E31.7Very low33.3Very low182 Ų182158 Ų15885%0.8580%0.801SS**  trans166152.8141.6-95.7-179.6-16400107.8
360E32.1Very low33.7Very low175 Ų175160.4 Ų160.482%0.81881%0.807SS**  cis-168.6163.2-38-120.4-155.8139.200104.7
361S27.4Very low34.1Very low109 Ų109166.4 Ų166.476%0.76281%0.812SS**  trans72.7110.7153.1-161.20000120.7
362S28.4Very low34.6Very low115 Ų115158.1 Ų158.180%0.80479%0.791SS**  -179126.3101.329.40000112.5
363Q32.3Very low35.2Very low176 Ų176157.5 Ų157.582%0.82279%0.788SS**  trans-74161.5161.9-100.2-173.718.900109.8
364P40.2Very low35.5Very low112 Ų112158.9 Ų158.973%0.72780%0.795SS**  -145.9168.45137.5-15.2000118.5
365T30.1Very low35.5Very low116 Ų116158.2 Ų158.271%0.71279%0.789SS**  trans-13135.4159.752.80000119.3
366E36Very low36.4Very low200 Ų200160 Ų16094%0.93579%0.791SS**  -159.5141127-105.5163.8-156.600110.1
367R35.2Very low37.4Very low226 Ų226162.3 Ų162.385%0.85379%0.794SS**  trans-118.8148.5-170.5-167.7-172.6-169.2164.30.8105.6
368E38.6Very low38.4Very low169 Ų169156.6 Ų156.679%0.7978%0.778SS**  trans87.2106.5169-48.8-175.9177.500115.3
369E39Very low39.3Very low179 Ų179149.5 Ų149.584%0.83676%0.756SS**  trans175.776.9140.8-99.4179.1-168.200110.6
370E39.9Very low40.5Very low203 Ų203146.6 Ų146.695%0.94975%0.746SS**  trans-144.869.2156.3-75.4-165.6157.500108.2
371K39.3Very low41.7Very low198 Ų198144.4 Ų144.486%0.86174%0.739SS**  trans-148.343.3168.4-161.7-164.2173.6-176.10110.9
372S44.4Very low43.4Very low65 Ų65146.1 Ų146.146%0.45574%0.735SS.*SBendtrans-136.64.2-173.349.40000115.4
373E45.1Very low45.2Very low171 Ų171142.9 Ų142.980%0.79972%0.716SS**SBendtrans-103.5-15.9174-71.5-168.314600114.4
374E42.2Very low47Very low181 Ų181138.4 Ų138.485%0.84670%0.7SS**THydrogen-bonded Turntrans-86-11.6177.3-158.7174.3153.700113.6
375T41.7Very low48.3Very low104 Ų104139.3 Ų139.364%0.63870%0.695SS**THydrogen-bonded Turntrans-93.2-2.3179.144.70000114.2
376R47.8Very low50.2Low200 Ų200140.6 Ų140.676%0.75569%0.693SS**THydrogen-bonded Turntrans-91.5-28.6178-69.5-176176.2177.11.1113.6
377E48.7Very low51.7Low156 Ų156137.4 Ų137.473%0.72968%0.678SS**Hα-helixtrans-80.1-24.8176.5-79.7-169.1147.400113.5
378A51.2Low53.1Low62 Ų62132.3 Ų132.351%0.51267%0.666SS.*Hα-helixtrans-70.6-33.3178.800000113.2E382A378-E382 PolarHBondContact O-N 2.8Å
379G53.8Low54.3Low41 Ų41130.6 Ų130.642%0.42366%0.659SS.*Hα-helixtrans-72.1-31.9179.300000113.7A383G379-A383 PolarHBondContact O-N 3.07Å; G379-A383 VanDerWaalsContact O-N 3.16Å
380D56.5Low55.4Low121 Ų121129.5 Ų129.565%0.64765%0.654SS**Hα-helixtrans-72.3-31.8178.3-104.5-4.6000112V384D380-V384 VanDerWaalsContact O-CG2 3.25Å; D380-V384 WeakPolarHBondContact O-CG2 3.16Å; D380-V384 PolarHBondContact O-N 3.33Å
381L57.6Low56.4Low128 Ų128126.4 Ų126.467%0.6764%0.643SS**Hα-helixtrans-72.1-36.7176.1-66.7177.5000112.4V384 Q385L381-V384 PolarHBondContact O-N 2.73Å; L381-Q385 WeakPolarHBondContact O-CB 3.47Å; L381-Q385 PolarHBondContact O-N 3.43Å
382E63.9Low57.4Low146 Ų146120.7 Ų120.768%0.68263%0.633SS**Hα-helixtrans-68.6-40.2177-166.4169-157.300111.4A378 V384 Q385 E386A378-E382 PolarHBondContact O-N 2.8Å; E382-V384 PolarHBondContact O-N 3.2Å; E382-Q385 PolarHBondContact O-N 2.73Å; E382-E386 PolarHBondContact O-N 2.59Å
383A66.4Low58.1Low47 Ų47123.4 Ų123.439%0.38865%0.646SS.*Hα-helixtrans-65.6-35.9175.600000113.2G379 Q387G379-A383 PolarHBondContact O-N 3.07Å; G379-A383 VanDerWaalsContact O-N 3.16Å; A383-Q387 PolarHBondContact O-N 3.22Å
384V69.6Low58.6Low82 Ų82122.4 Ų122.450%0.49765%0.646SS.*Hα-helixtrans-71.9-35.2175.1172.30000111.4D380 L381 E382 L388D380-V384 VanDerWaalsContact O-CG2 3.25Å; D380-V384 WeakPolarHBondContact O-CG2 3.16Å; D380-V384 PolarHBondContact O-N 3.33Å; L381-V384 PolarHBondContact O-N 2.73Å; E382-V384 PolarHBondContact O-N 3.2Å; V384-L388 PolarHBondContact O-N 2.86Å
385Q66.6Low59.3Low131 Ų131123.2 Ų123.261%0.61265%0.65SS**Hα-helixtrans-69.7-36.9177.1-169167.6-1.100112L381 E382 L388 Q389L381-Q385 WeakPolarHBondContact O-CB 3.47Å; L381-Q385 PolarHBondContact O-N 3.43Å; E382-Q385 PolarHBondContact O-N 2.73Å; Q385-L388 PolarHBondContact O-N 3.32Å; Q385-Q389 PolarHBondContact O-N 3.31Å; Q385-Q389 VanDerWaalsContact O-N 3.1Å
386E70.5Confident60Low143 Ų143121.3 Ų121.367%0.66865%0.651SS**Hα-helixtrans-66.9-39.6175.6-156.9175.3-165.600111.7E382 L388 Q389 E390E382-E386 PolarHBondContact O-N 2.59Å; E386-L388 VanDerWaalsContact C-N 3.34Å; E386-L388 PolarHBondContact O-N 2.86Å; E386-Q389 PolarHBondContact O-N 3Å; E386-E390 PolarHBondContact O-N 3.46Å
387Q67.3Low59.8Low133 Ų133125 Ų12562%0.62168%0.677SS**Hα-helixtrans-64.2-34173.7-81.3-176.84.400113.6A383 L391A383-Q387 PolarHBondContact O-N 3.22Å; Q387-L391 PolarHBondContact O-N 3.3Å
388L66Low60.4Low118 Ų118123.5 Ų123.562%0.61867%0.674SS**Hα-helixtrans-72.3-31.1174.8-76.2172.2000112.4V384 Q385 E386 A392V384-L388 PolarHBondContact O-N 2.86Å; Q385-L388 PolarHBondContact O-N 3.32Å; E386-L388 VanDerWaalsContact C-N 3.34Å; E386-L388 PolarHBondContact O-N 2.86Å; L388-A392 PolarHBondContact O-N 3.42Å
389Q62.6Low60.9Low134 Ų134126.7 Ų126.763%0.62668%0.683SS**Hα-helixtrans-73.9-35.8177.2-162.5117.730.700111.7Q385 E386 A392Q385-Q389 PolarHBondContact O-N 3.31Å; Q385-Q389 VanDerWaalsContact O-N 3.1Å; E386-Q389 PolarHBondContact O-N 3Å; Q389-A392 PolarHBondContact O-N 3.39Å
390E63.4Low61.3Low156 Ų156131.4 Ų131.473%0.72970%0.697SS**Hα-helixtrans-70.5-31.7178-159.8174.6-165.200112.5E386E386-E390 PolarHBondContact O-N 3.46Å
391L59.3Low61.6Low138 Ų138132.1 Ų132.172%0.72370%0.7SS**Hα-helixtrans-75-19.8174.9-78.7165.1000114.1Q387Q387-L391 PolarHBondContact O-N 3.3Å
392A60.4Low61.8Low78 Ų78132.3 Ų132.365%0.64570%0.702SS**THydrogen-bonded Turntrans-84.4-7.5-178.800000113.9L388 Q389L388-A392 PolarHBondContact O-N 3.42Å; Q389-A392 PolarHBondContact O-N 3.39Å
393V58.8Low61.7Low121 Ų121131.4 Ų131.473%0.73370%0.704SS**SBendtrans-94.3-8.9-174.2178.60000113.1
394D57.2Low61.3Low151 Ų151137.4 Ų137.481%0.80773%0.726SS**SBendtrans-93.8-3.7-175.6-156.962000115.3G396D394-G396 PolarHBondContact O-N 3.43Å
395E56.9Low60.7Low197 Ų197141.7 Ų141.792%0.92174%0.744SS**SBendtrans-97.558.9174.1-73.7-159.4140.200112.6
396G56.2Low60.2Low65 Ų65142.6 Ų142.667%0.6776%0.755SS**  trans-167.653.8-179.500000117D394D394-G396 PolarHBondContact O-N 3.43Å
397Q44.1Very low59.3Low277 Ų277142.5 Ų142.5100%1.29476%0.762SS**  trans-140.40154.3-98.9-171.7-15.600113

Retrieved 397 of 397 residues in 52 ms (Link to these results)