A0A096MAZ8_POEFO Loading...

Lysine-rich nucleolar protein 1

AlphaFold DB , UniProt , Accession A0A096MAZ8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 496 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
1M34Very low41.6Very low234 Ų234155.1 Ų155.1100%1.15386%0.859SS**  01380-72.9161.116500106.9
2E39.8Very low41.6Very low201 Ų201157.8 Ų157.894%0.93986%0.856SS**  trans46.6135.8159.5-60.1174.2-16700119.7
3G36.6Very low41.7Very low71 Ų71161.5 Ų161.573%0.73286%0.859SS**  cis157.3128.7-4.900000111.1
4E45.3Very low41.9Very low197 Ų197162.6 Ų162.692%0.92186%0.857SS**  trans-132.8133.9179.1-68.1-169.1138.600112.2
5N43.5Very low42Very low174 Ų174163.3 Ų163.393%0.9385%0.85SS**  trans-111.1154.4168.5-59.6-69.4000107.7
6G39.4Very low42.4Very low78 Ų78163.9 Ų163.980%0.80484%0.844SS**  cis151.8104.22.200000109.9
7E44.1Very low42.3Very low164 Ų164164.2 Ų164.277%0.76684%0.84SS**  trans-84.3148.9179.2-74.1-161.2161.400113.2K9E7-K9 VanDerWaalsContact OE2-CE 3.29Å; E7-K9 WeakPolarHBondContact OE2-CE 3.43Å; E7-K9 IonicContact OE2-NZ 2.81Å; E7-K9 PolarHBondContact OE2-NZ 2.69Å
8A42.7Very low42.7Very low104 Ų104165.6 Ų165.686%0.8684%0.839SS**  trans-142.2137.5163.200000112.3
9K46.3Very low42.4Very low166 Ų166169.3 Ų169.372%0.72284%0.842SS**  trans-125.3138.9-178.8-64.7163.6-176.1142.80109.8E7E7-K9 VanDerWaalsContact OE2-CE 3.29Å; E7-K9 WeakPolarHBondContact OE2-CE 3.43Å; E7-K9 IonicContact OE2-NZ 2.81Å; E7-K9 PolarHBondContact OE2-NZ 2.69Å
10I41.8Very low41.8Very low162 Ų162164.2 Ų164.283%0.83183%0.834SS**  trans-137.5144.6168.9-62.5-175.4000110.9
11I44.6Very low41.8Very low155 Ų155165.1 Ų165.180%0.79584%0.835SS**  trans-128.7138-170.3-58.7162.5000111.1
12K41.6Very low41.7Very low188 Ų188161.1 Ų161.182%0.81782%0.817SS**  trans-157159.4164.5-63.7-173.8-176.3174.50109.9
13K42.2Very low41.4Very low206 Ų206157.2 Ų157.290%0.89681%0.811SS**  cis-168156.1-47.3-119.7178.8179.41780108.3
14E44.2Very low41.6Very low177 Ų177158.7 Ų158.783%0.82781%0.81SS**  trans-80.1177.8-178-50.2173.880.500115.7
15K44.5Very low42.1Very low173 Ų173155.1 Ų155.175%0.75280%0.804SS**  161.8107.4103.5-175179.4-179.9-176.30118.9
16K47.6Very low41.6Very low173 Ų173153.8 Ų153.875%0.75279%0.792SS**  trans65.2167.1145.1-55.3179.5-175.7-175.60118.7
17Q41.5Very low41.7Very low169 Ų169158.3 Ų158.379%0.7980%0.796SS**  cis-140.715215.9-32.9-174.810.800113.2
18K48.3Very low41.8Very low188 Ų188157.6 Ų157.682%0.81779%0.793SS**  59149.4101.4-58.8-169.2174-172.70117.3
19R36.9Very low41.6Very low237 Ų237160.3 Ų160.389%0.89479%0.791SS**  cis-162.5158.720-159.1-179.5-177.3177.7-0113.6
20G31.3Very low41.2Very low67 Ų67158.4 Ų158.469%0.69180%0.797SS**  trans121.2116.2168.200000113.1
21Q41.8Very low40.9Very low183 Ų183155.4 Ų155.486%0.85580%0.797SS**  cis74.8125.546.3-132.5-179.6-10.400111.6
22I32.4Very low40.5Very low150 Ų150152.5 Ų152.577%0.76980%0.796SS**  cis-150.4142.640.9-71.9160000113.6
23C32.5Very low40.2Very low120 Ų120152.1 Ų152.181%0.81180%0.797SS**  trans44.6156.6148.5-145.10000125.5
24S40.2Very low39.9Very low102 Ų102149.9 Ų149.971%0.71380%0.795SS**  trans-141.2162.4172.5-47.50000110.8
25P57Low39.3Very low122 Ų122144.9 Ų144.979%0.79279%0.791SS**  trans-120.2142.6133.9-0.121.6000110.3
26E32.5Very low38.9Very low145 Ų145142.9 Ų142.968%0.67880%0.799SS**  77.1107.958.8-163.1-173.5157.800113.8Q28E26-Q28 PolarHBondContact OE1-NE2 2.99Å
27I42.3Very low38.3Very low173 Ų173143.2 Ų143.289%0.88780%0.803SS**  trans-134.6141.2154-65.7-176000106.9
28Q45.3Very low38Very low149 Ų149140.2 Ų140.270%0.69681%0.807SS**  trans-91.9160.6-160.9-68.3164.7-800114.3E26E26-Q28 PolarHBondContact OE1-NE2 2.99Å
29I39.2Very low37.5Very low162 Ų162140.1 Ų140.183%0.83181%0.806SS**  trans-97.3137166.7-60.4171000108
30C38.5Very low37.5Very low125 Ų125137.3 Ų137.385%0.84581%0.807SS**  trans-127.7153.5160.1-73.80000109.7
31A34.4Very low37.6Very low100 Ų100143.5 Ų143.583%0.82682%0.815SS**  trans-135.9151.5-169.700000112.8
32A36.2Very low37.6Very low93 Ų93144.5 Ų144.577%0.76982%0.817SS**  trans-152.6111.8153.500000104.5
33E34.5Very low37.7Very low180 Ų180147.5 Ų147.584%0.84182%0.824SS**  79.4148.560.6-165.2163.4-12400112.7
34N37Very low38.1Very low159 Ų159153.7 Ų153.785%0.8583%0.83SS**  trans72.1111.3-158.5-48.7-70.1000113.4
35G31.3Very low37.8Very low72 Ų72159 Ų15974%0.74284%0.841SS**  cis123.892.6-6.900000113.5
36S35.9Very low36.8Very low132 Ų132161.8 Ų161.892%0.92384%0.84SS**  trans-163.8145.4155.7-89.40000110.9
37Q35.8Very low36.8Very low180 Ų180159.8 Ų159.884%0.84184%0.838SS**  trans-106.9143.3-174.6-52.7-178.427.900111.5
38A34.9Very low36.1Very low105 Ų105159.7 Ų159.787%0.86883%0.833SS**  trans-155.3117.114700000111
39K37.1Very low35.4Very low187 Ų187158 Ų15881%0.81383%0.833SS**  trans-93.7140.8167.1-60.8163.3-176.2163.50108.2
40I37.1Very low34.9Very low178 Ų178157 Ų15791%0.91383%0.834SS**  trans-154.3158.5150.3-108.3148.6000111
41K33.2Very low34.5Very low197 Ų197155.5 Ų155.586%0.85783%0.831SS**  trans-100.2162.4-156.2-62.3171-178171.90113.6
42K42.1Very low34.4Very low203 Ų203158.8 Ų158.888%0.88383%0.827SS**  trans-21.7141.4159.1-62.1172.7176.6174.60115.1
43K33.7Very low34.1Very low214 Ų214160 Ų16093%0.9382%0.817SS**  -153.3137.9128.8-112.9166-174.9177.90111.8
44R40.9Very low34.2Very low249 Ų249160 Ų16094%0.9481%0.814SS**  trans-90.1147.8162.1-71.3175.3169.7171.4-5.8108
45K35.7Very low33.9Very low214 Ų214161.6 Ų161.693%0.9382%0.816SS**  trans-140.5164.4152.9-142.6-174.4177.8-166.80109.5
46K35.3Very low34.1Very low181 Ų181166.4 Ų166.479%0.78782%0.82SS**  trans-157.3146.6-159.7-169.8-151.5172.1-167.30109.1
47V31.9Very low34Very low102 Ų102169.8 Ų169.862%0.61882%0.818SS**  trans66.6136.5173.5-147.70000112.2
48E27.5Very low33.9Very low171 Ų171165.8 Ų165.880%0.79982%0.815SS**  cis-142161.744-75.7165.7107.300111.6
49T30.1Very low33.9Very low113 Ų113168.5 Ų168.569%0.69382%0.815SS**  cis72.976.618.972.90000118
50V28.7Very low33.8Very low141 Ų141168.3 Ų168.386%0.85582%0.817SS**  trans-122.6134.4150.4177.90000108.7
51A31.4Very low33.6Very low94 Ų94169.9 Ų169.978%0.77782%0.817SS**  trans-142.4135.9170.400000109.3
52K32.1Very low33.6Very low170 Ų170169.8 Ų169.874%0.73982%0.817SS**  trans-162.8117.5156.3-108.7169.1178.4-71.10107.3
53E30.5Very low33.1Very low119 Ų119165.7 Ų165.756%0.55680%0.804SS**  71.7101.1102-67.8-164.4117.300112.1
54K36.4Very low33.2Very low178 Ų178163.1 Ų163.177%0.77479%0.793SS**  82.7113.780.6-82.1177.7-170.6158.50111.1
55E30.7Very low32.8Very low194 Ų194160.2 Ų160.291%0.90779%0.787SS**  -157171.7112.8-127.9-173.3171.100111.3
56E36Very low32.6Very low173 Ų173159.2 Ų159.281%0.80878%0.783SS**  trans-90.1147.8-178.2-60.1176.696.300112.4
57K32.4Very low32.6Very low203 Ų203155.1 Ų155.188%0.88378%0.783SS**  -168.3151.3110.7-99.5146.6-170.1160.70111.6
58A34.7Very low32.7Very low95 Ų95160.2 Ų160.279%0.78580%0.797SS**  trans-87.8155.8174.800000110.8
59D33.6Very low33.1Very low163 Ų163163.4 Ų163.487%0.87280%0.802SS**  -155161.5126.5-135.9-31000113
60Q36.4Very low33.4Very low182 Ų182168 Ų16885%0.8581%0.812SS**  trans-92.8151.6-180-57.6-178.53300111.7
61K31.9Very low33.9Very low211 Ų211169 Ų16992%0.91781%0.805SS**  trans-147.3106167.3-138.2163.7-169.8166.50115
62K33Very low34.1Very low196 Ų196173.6 Ų173.685%0.85280%0.802SS**  trans-101.4134.8151.1-71.7176.9176.9172.40107.6
63D33.1Very low34Very low116 Ų116171 Ų17162%0.6280%0.797SS**  169.2135.8106.6-114.3-3.3000115.1
64K34.3Very low34Very low160 Ų160171.8 Ų171.870%0.69680%0.804SS**  trans41.1159136.4-63.2177.3-168.681.90124
65K32.4Very low33.9Very low188 Ų188169.1 Ų169.182%0.81780%0.803SS**  trans80.5152.7148-101.6175178.91710115.7
66K32.5Very low34Very low193 Ų193164.3 Ų164.384%0.83979%0.79SS**  cis-137.2169.66.8-61.4-179.8-179.7167.20111.9
67A35.1Very low33.8Very low96 Ų96161 Ų16179%0.79379%0.787SS**  trans-95.4165.7166.900000113.5
68K34.9Very low33.7Very low208 Ų208156.9 Ų156.990%0.90478%0.778SS**  trans-120.1127.1156-66.7179178.4177.70106.3
69R34.5Very low33.8Very low239 Ų239159 Ų15990%0.90278%0.775SS**  61.110953.9-97.2-171.5170.8-175.4-2.1114.7
70K37.4Very low33.8Very low209 Ų209159 Ų15991%0.90977%0.77SS**  trans-127.4150145.9-156.5178.9-177.9-174.70107.4
71K39.6Very low33.7Very low162 Ų162155.6 Ų155.670%0.70476%0.762SS**  trans-96.3-175.2172.4-60.3178.7158-169.40108.8
72R35.5Very low33.7Very low191 Ų191153 Ų15372%0.72176%0.758SS**  cis-170.5-179.518.9-151.3-176.6174.71660.7110.8
73D29.9Very low33.8Very low116 Ų116150.9 Ų150.962%0.6276%0.756SS**  trans72.8143.5157.9-46.3-34.9000116.7
74D29.9Very low33.8Very low134 Ų134148.3 Ų148.372%0.71776%0.757SS**  cis-160.2172.9-12.7-120.7-27000113.2
75V34.1Very low34Very low122 Ų122147.2 Ų147.274%0.73976%0.759SS**  trans30.7136.2144.6173.40000120.6
76S33.6Very low34.6Very low93 Ų93146.9 Ų146.965%0.6576%0.757SS**  cis-172.8171.7-9.458.70000112
77S31.7Very low34.9Very low104 Ų104148.9 Ų148.973%0.72776%0.759SS**  trans57.6147.9146.858.20000120.7
78T30.6Very low35.1Very low116 Ų116154.1 Ų154.171%0.71276%0.764SS**  cis-147.7133.113.2-38.80000108.4
79I35.2Very low35.4Very low140 Ų140154.1 Ų154.172%0.71876%0.764SS**  34137.296.90.6176.3000114.9
80E34.8Very low35.8Very low163 Ų163152 Ų15276%0.76276%0.761SS**  cis-151.7131.636-104.3170.6-165.900112.8
81T33.1Very low36.2Very low111 Ų111148 Ų14868%0.68176%0.757SS**  77.5143.294.160.70000118.5
82D32.9Very low36Very low156 Ų156145.2 Ų145.283%0.83476%0.764SS**  cis-139-101.8-29.6-152.8-111.3000111
83D35.5Very low35.7Very low151 Ų151139.6 Ų139.681%0.80777%0.766SS**  cis-159.2162.7-14.6-178.934.5000110
84G32.2Very low35.8Very low62 Ų62142.2 Ų142.264%0.63978%0.78SS**  trans78139.3163.900000118
85D39.7Very low35.8Very low137 Ų137139 Ų13973%0.73378%0.778SS**  cis-149.7165.7-18.6-177.427.3000108.8
86K44.5Very low35.7Very low182 Ų182139.9 Ų139.979%0.79178%0.783SS**  trans-106.5140-176.2-62159.4-175.1153.40111.8
87R37.4Very low35.8Very low234 Ų234142.7 Ų142.788%0.88379%0.789SS**  trans-159.8149.6147.4-106.3144-123.8-120.36.9113.2
88K40.8Very low36Very low206 Ų206146.1 Ų146.190%0.89679%0.794SS**  trans-101146.1179.7-57173.3-177.8174.70110.3
89K41.3Very low36Very low208 Ų208146.5 Ų146.590%0.90480%0.796SS**  trans-138.4144151.1-82.8-168175.7-178.60110.2
90K42.8Very low36Very low194 Ų194149 Ų14984%0.84381%0.805SS**  trans-85.9159.4165.3-58.9-179.5178.5-178.50109.2
91P45.7Very low36.1Very low127 Ų127147.7 Ų147.783%0.82580%0.803SS**  trans-94.8148.6136.534.4-28.4000110.7
92A34.4Very low36Very low103 Ų103152.5 Ų152.585%0.85182%0.815SS**  trans-135.3147.3158.900000106.5
93G29.4Very low35.9Very low73 Ų73149.7 Ų149.775%0.75380%0.804SS**  trans167.5110.5-175.800000111
94D32Very low35.9Very low171 Ų171149.8 Ų149.891%0.91480%0.804SS**  trans-69.4162175.2-51.4-87.2000111.1
95G29.8Very low35.9Very low65 Ų65156.4 Ų156.467%0.6782%0.815SS**  cis178.6-132.64.300000110.5
96V31.5Very low35.4Very low141 Ų141155 Ų15586%0.85582%0.822SS**  trans7984.9174.2-170.40000116.1
97I35.8Very low34.6Very low152 Ų152150 Ų15078%0.77982%0.822SS**  trans-10.5141.1133.78.4178000114.1
98Q36.3Very low34.2Very low176 Ų176148.3 Ų148.382%0.82282%0.821SS**  cis-147.2156.649-68.5176.4-10.100115
99T31.6Very low33.8Very low124 Ų124146.4 Ų146.476%0.76182%0.82SS**  trans-130.3132.1162.553.10000109
100E34.8Very low33.4Very low194 Ų194143 Ų14391%0.90781%0.807SS**  trans-126.1127.4159.7-69.9-158.6153.500110.5
101N36.7Very low33.2Very low134 Ų134143.1 Ų143.172%0.71781%0.808SS**  trans-112.4147.1162.9-58.5-92.5000106.2
102F30.6Very low32.6Very low212 Ų212145.2 Ų145.293%0.9380%0.804SS**  trans-148.8163.9145.6-120.2-80.1000112.4
103T30.8Very low32.6Very low98 Ų98149.8 Ų149.860%0.60181%0.805SS**  trans-151155.1-145.3-31.70000112.2
104L35.3Very low32.9Very low153 Ų153157.1 Ų157.180%0.80181%0.81SS**  trans73.3167.9169.3-41.6172.2000114.3
105K32Very low32.9Very low200 Ų200157.7 Ų157.787%0.8780%0.804SS**  cis-131.2173.67.4-80.4-177.3177.9173.90112.4
106A30.6Very low33.2Very low108 Ų108162.6 Ų162.689%0.89381%0.809SS**  trans-92160.6-177.100000115
107G26Very low33.3Very low77 Ų77165 Ų16579%0.79481%0.811SS**  trans-133.4163.6167.100000111.5
108K30.8Very low33.3Very low198 Ų198166.5 Ų166.586%0.86181%0.812SS**  trans-117.3169.2-172.6-61.3179.6179174.40112.9
109L30.5Very low33.3Very low167 Ų167166.1 Ų166.187%0.87482%0.815SS**  trans74.5156.7165.1-57.8160.3000114.6
110E33.4Very low33.6Very low136 Ų136168.9 Ų168.964%0.63682%0.816SS**  cis-138.3170.21-147.6-157.2161.300111.4K112E110-K112 IonicContact OE1-NZ 2.76Å; E110-K112 PolarHBondContact OE1-NZ 2.81Å; E110-K112 IonicContact OE2-NZ 3.15Å; E110-K112 PolarHBondContact OE2-NZ 3.27Å
111K38.8Very low33.7Very low196 Ų196169 Ų16985%0.85282%0.817SS**  trans-103130.9168.1-70.2177.1-179.7172.30110.5
112K33.6Very low33.6Very low171 Ų171171.5 Ų171.574%0.74382%0.822SS**  trans-146.8159.8155.9-101.3120.5-178.1171.20111.8E110E110-K112 IonicContact OE1-NZ 2.76Å; E110-K112 PolarHBondContact OE1-NZ 2.81Å; E110-K112 IonicContact OE2-NZ 3.15Å; E110-K112 PolarHBondContact OE2-NZ 3.27Å
113K33.9Very low33.8Very low199 Ų199167.7 Ų167.787%0.86582%0.82SS**  trans-127.9147.4-179.1-57.3176.2-180-179.50109.1
114R36.1Very low34Very low228 Ų228168.5 Ų168.586%0.8682%0.824SS**  143.3145.7128.6-85.2175.5163.3170.4-4.4113.8
115K31.9Very low34.2Very low182 Ų182170.3 Ų170.379%0.79183%0.828SS**  trans63.8131.4161.9-66.9179.1173.9-163.50115.3
116E36.3Very low34.3Very low168 Ų168168 Ų16879%0.78582%0.824SS**  cis74.991.744.6-169.1-173.9-158.600112.9
117E33.9Very low34.8Very low192 Ų192171.8 Ų171.890%0.89782%0.821SS**  trans-147162134.1-167.8153.8-169.800109
118K36.2Very low35.8Very low183 Ų183174 Ų17480%0.79682%0.821SS**  trans-101.6145.6177.5-58.1164.1-175164.90108.9
119L35.5Very low35.7Very low168 Ų168171.7 Ų171.788%0.8881%0.813SS**  trans-154.2171.3136.4-111.7171.6000110.9
120K38.2Very low35.9Very low182 Ų182169.2 Ų169.279%0.79180%0.801SS**  trans-93.2151.5-172.6-53156.6-174.4167.60109
121E35.9Very low35.9Very low196 Ų196171.8 Ų171.892%0.91682%0.815SS**  -166.3-179.3115.8-109.7168.7-151.500114
122K36Very low35.9Very low188 Ų188171.3 Ų171.382%0.81781%0.813SS**PPolyproline II helixtrans-91.8142-160.7-60.1167.7-175.7168.70111.4V124K122-V124 PolarHBondContact O-N 3.26Å
123C33Very low35.9Very low132 Ų132169.2 Ų169.289%0.89281%0.814SS**PPolyproline II helixtrans-66.2118.7170.1-177.40000110.1
124V35.1Very low36Very low115 Ų115166.7 Ų166.770%0.69781%0.806SS**PPolyproline II helixtrans-90.5140.1173.4173.80000109.2K122K122-V124 PolarHBondContact O-N 3.26Å
125Q40.6Very low36.1Very low190 Ų190163.2 Ų163.289%0.88880%0.797SS**PPolyproline II helixtrans-69.7132.2175.4-61.3173.13.100110.3
126I34.4Very low36.1Very low152 Ų152162.3 Ų162.378%0.77980%0.801SS**  trans-126.8114.1172.4-60.9-179.9000109
127K40.4Very low36.5Very low188 Ų188163.4 Ų163.482%0.81781%0.806SS**  trans-83.9154.5156.2-66.6-178.3179.5-1790108.9
128P46.6Very low36.8Very low123 Ų123163.1 Ų163.180%0.79980%0.804SS**  trans-122.5111.414532.9-22.2000112.4
129E30.3Very low36.7Very low149 Ų149162 Ų16270%0.69680%0.804SS**  trans-61.9159131.7-84176.884.300108.7
130N32.9Very low36.9Very low116 Ų116159.5 Ų159.562%0.6280%0.798SS**  cis-159.5150.82.5-109.8-31.9000108.1
131M33.9Very low36.6Very low189 Ų189157.7 Ų157.793%0.93180%0.795SS**  trans-150.1149.8143.5-79.9-143.680.900109.5
132K39.7Very low36.3Very low186 Ų186158.9 Ų158.981%0.80979%0.791SS**  trans-114.3153.3-169.8-59.9178.6179.6-179.50112.4
133V33.3Very low36.3Very low128 Ų128155.3 Ų155.378%0.77679%0.79SS**  trans-178.5112.7136.1144.60000104
134E35.3Very low36.4Very low146 Ų146156.1 Ų156.168%0.68279%0.785SS**  56.7134.1102.8-108.4-162.7132.700114
135K37.6Very low36.4Very low155 Ų155157.8 Ų157.867%0.67479%0.791SS**  cis-161.615012.5-165.6-167.1-158.587.70108.9
136D33.4Very low36.2Very low163 Ų163159.5 Ų159.587%0.87279%0.789SS**  trans173.6151.6144.8-93.3-13.3000111
137E43.7Very low36.2Very low191 Ų191161.7 Ų161.789%0.89379%0.793SS**  trans-115.2151.8-171.2-63.2-177139.500113.3
138E40.8Very low36.4Very low185 Ų185162.3 Ų162.386%0.86480%0.795SS**  trans-79.4148.3177-65.8-171114.600113.4
139M33.2Very low36.3Very low160 Ų160162.6 Ų162.679%0.78880%0.797SS**  trans-144.4112.2159.3-91.7-63.5-74.600112.1I141M139-I141 HydrophobicContact CE-CD1 4.42Å
140P40Very low36.7Very low116 Ų116165.4 Ų165.475%0.75381%0.807SS**  trans-97.9131.4175.934.6-30.7000112.8
141I31.7Very low37.1Very low144 Ų144170.1 Ų170.174%0.73882%0.822SS**  trans-127.291.1178.8-54-174.9000113.4M139M139-I141 HydrophobicContact CE-CD1 4.42Å
142R29.6Very low37Very low220 Ų220164.3 Ų164.383%0.8381%0.81SS**  39117.4123.1-158.3176.1-165.71695.8119.3
143S37.4Very low36.9Very low113 Ų113165.9 Ų165.979%0.7982%0.817SS**  trans-66147.1165.153.60000113.3
144N34Very low36.9Very low149 Ų149163.4 Ų163.480%0.79782%0.818SS**  trans-156.5146.1166.3-110.7-33.7000112.5
145N36.1Very low36.8Very low151 Ų151166.3 Ų166.381%0.80783%0.828SS**  trans-106.9142.2178.6-76.2-70.3000111.1
146R35.8Very low36.5Very low226 Ų226165.9 Ų165.985%0.85383%0.833SS**  159.4151.6122.1-89.8168.6170.8-172.6-3.4116.2
147K35.2Very low36.5Very low198 Ų198166.5 Ų166.586%0.86184%0.836SS**  trans77.7147.8152.7-74.5167.7179.7-177.30120.1
148K43.1Very low36Very low200 Ų200162 Ų16287%0.8783%0.831SS**  trans-114.9163176.1-49174.6-178.8179.10109.7
149P45.3Very low35.7Very low129 Ų129159 Ų15984%0.83883%0.83SS**  trans-108.8-171.814534.3-28.1000113.1
150K39.3Very low35.8Very low208 Ų208163 Ų16390%0.90484%0.837SS**  trans-118.5169.1-162.4-69.4178179.2173.30114.8
151K40.6Very low35.4Very low216 Ų216163.9 Ų163.994%0.93984%0.84SS**  trans-58148.2171-81.1-178.7168.4-178.60115.7
152G32.3Very low35.5Very low66 Ų66161.5 Ų161.568%0.6884%0.841SS**  trans-143.4136.1137.100000107.3
153K37Very low35.8Very low220 Ų220160.1 Ų160.196%0.95784%0.844SS**  46.6110.371.3-69.6-167.6175.8-172.40112
154G32.8Very low35.4Very low76 Ų76160.6 Ų160.678%0.78484%0.843SS**  cis117.8129.8-5.400000113.9
155K33.7Very low35.6Very low206 Ų206163.3 Ų163.390%0.89685%0.848SS**  trans-170.9163.7165.4-116.5179.8-179.6-172.90112.1
156D30.9Very low35.6Very low147 Ų147164.8 Ų164.879%0.78685%0.85SS**  trans-82.2156.9-178.7-37.7-98.2000113
157L34Very low35.7Very low176 Ų176161.9 Ų161.992%0.92185%0.85SS**  -169.2156.9121.2-105.4165.4000111.1
158A33.4Very low35.4Very low96 Ų96158.2 Ų158.279%0.79384%0.844SS**  trans-113.3146.5179.700000111.1
159S34.3Very low34.9Very low121 Ų121155 Ų15585%0.84684%0.841SS**  trans-144126.4162.846.10000110.2
160R35.3Very low34.4Very low246 Ų246153.6 Ų153.693%0.92882%0.823SS**  trans-104.9118.8167.3-92.3-179.6164.8-174.7-3.7108.1
161T32.3Very low34Very low134 Ų134151.7 Ų151.782%0.82282%0.815SS**  trans-140.9118.2146.235.40000104.9
162A33.3Very low33.7Very low93 Ų93149.2 Ų149.277%0.76980%0.804SS**  cis66.685.440.500000111.9
163E35.1Very low33.9Very low191 Ų191155.2 Ų155.289%0.89381%0.811SS**  trans-145.4143.9155-138.6174.6-109.100109.2
164T30.3Very low33.8Very low123 Ų123154.7 Ų154.776%0.75581%0.809SS**  trans-118.1141.6-163.944.40000111.8
165K38.4Very low34Very low207 Ų207157 Ų15790%0.981%0.808SS**  trans-139.3120.6155.9-67.5-166.7177.2179.10110.2
166E35.5Very low34.4Very low182 Ų182152.9 Ų152.985%0.8580%0.802SS**  trans-91.3157.5177.9-56.2-179.4114.600111.7
167L38.2Very low34.4Very low165 Ų165151.6 Ų151.686%0.86480%0.8SS**  trans-150.4105.6149.8-87.9-176.4000111.5
168V28.8Very low34.4Very low121 Ų121150.9 Ų150.973%0.73380%0.795SS**  trans24115.2131.8-172.10000117.1
169V32.5Very low34.6Very low131 Ų131151.1 Ų151.179%0.79479%0.787SS**  cis80.2128.147.3179.10000113.2
170E33.7Very low34.5Very low101 Ų101153.1 Ų153.147%0.47279%0.788SS.*  cis-133.1-96.416.4-169.6-159.716400114.6K172E170-K172 WeakPolarHBondContact OE1-CD 3.46Å; E170-K172 WeakPolarHBondContact OE1-CE 3.35Å; E170-K172 WeakPolarHBondContact OE1-CG 3.36Å; E170-K172 IonicContact OE1-NZ 2.59Å; E170-K172 PolarHBondContact OE1-NZ 3.2Å
171K31.4Very low34.2Very low167 Ų167144.6 Ų144.673%0.72678%0.777SS**  cis-153.937.6-7.9-148.3144.8-160.676.20118.7
172K34.4Very low34.1Very low164 Ų164145.8 Ų145.871%0.71378%0.783SS**  trans70.4140.7154.9-75.3172.5175.4128.90123.6E170E170-K172 WeakPolarHBondContact OE1-CD 3.46Å; E170-K172 WeakPolarHBondContact OE1-CE 3.35Å; E170-K172 WeakPolarHBondContact OE1-CG 3.36Å; E170-K172 IonicContact OE1-NZ 2.59Å; E170-K172 PolarHBondContact OE1-NZ 3.2Å
173K36.8Very low33.8Very low193 Ų193145 Ų14584%0.83979%0.785SS**  trans65.3124.1144.5-71.2179.3178.7-174.20122.3
174K34.5Very low33.9Very low208 Ų208142.6 Ų142.690%0.90477%0.773SS**  -170.7150.1104.5-100.5170.3-176.21780112.3
175T36.3Very low34.1Very low125 Ų125143 Ų14377%0.76778%0.776SS**  trans-108.4172.9165.951.10000109.5
176P42.2Very low34Very low119 Ų119141 Ų14177%0.77377%0.767SS**  -136.7164.494.438.9-28.6000114.5
177V31.9Very low34.1Very low121 Ų121137.4 Ų137.473%0.73377%0.769SS**  trans-104.1137.1166.8171.80000108.1T179V177-T179 HydrophobicContact CG1-CG2 4.31Å
178I34.3Very low34Very low160 Ų160139.4 Ų139.482%0.82177%0.771SS**  trans-132.3127.7161.2-63-177.5000107.8
179T36.5Very low34.7Very low102 Ų102143.7 Ų143.763%0.62678%0.779SS**  trans-93.9-179.4176.148.40000111.5V177V177-T179 HydrophobicContact CG1-CG2 4.31Å
180N32.7Very low34.9Very low162 Ų162147 Ų14787%0.86678%0.783SS**  trans93.3137.4-177.3-47.4-19.3000113.2
181G28.8Very low35.1Very low67 Ų67146.2 Ų146.269%0.69179%0.794SS**  cis156.9118.1-10.500000113.7
182V30Very low35.3Very low159 Ų159148 Ų14896%0.96480%0.801SS**  trans61.6132.9162.3-174.40000118
183G28.4Very low35.3Very low77 Ų77147.5 Ų147.579%0.79481%0.806SS**  trans170.194.6168.600000114.6
184E36.2Very low35.2Very low141 Ų141145.8 Ų145.866%0.65981%0.805SS**  trans-85.7159178.7-54.6-178109.700114.2K186E184-K186 VanDerWaalsContact OE2-CE 3.32Å; E184-K186 WeakPolarHBondContact OE2-CE 3.23Å; E184-K186 IonicContact OE2-NZ 3.8Å; E184-K186 PolarHBondContact OE2-NZ 2.97Å
185T34.3Very low35.1Very low132 Ų132144 Ų14481%0.8180%0.8SS**  -172113128.317.60000109.2
186K37.2Very low35.2Very low163 Ų163144.9 Ų144.971%0.70980%0.8SS**  78.7103.170.7-75.2167.5169.6139.60115.6E184E184-K186 VanDerWaalsContact OE2-CE 3.32Å; E184-K186 WeakPolarHBondContact OE2-CE 3.23Å; E184-K186 IonicContact OE2-NZ 3.8Å; E184-K186 PolarHBondContact OE2-NZ 2.97Å
187A36.5Very low34.7Very low108 Ų108142.9 Ų142.989%0.89380%0.8SS**  trans-151.3139.8144.800000110.3
188K37.8Very low34.8Very low207 Ų207144.7 Ų144.790%0.981%0.805SS**  trans-112.6155.7-177.5-64.7179.8178.2-179.70111.5
189K43.5Very low34.6Very low210 Ų210145.9 Ų145.991%0.91380%0.804SS**  trans-156.5129.8135.1-114.1170.3-174.4-178.70112.8
190K36.7Very low34.3Very low202 Ų202147.5 Ų147.588%0.87881%0.813SS**  trans-87.7177.7159.9-57.1-170.2176.6-172.10107.2
191A36Very low34.3Very low83 Ų83148.7 Ų148.769%0.68681%0.813SS**  cis-159.9156.717.400000114
192K36.8Very low34.6Very low204 Ų204154.2 Ų154.289%0.88782%0.818SS**  trans45.1128.5135.3-68.4-169.3173.6-167.20121.9
193L33.9Very low34.8Very low154 Ų154155.3 Ų155.381%0.80681%0.813SS**  trans-66.8160.4146.5-77159.3000111.4
194L35.4Very low35Very low157 Ų157159.8 Ų159.882%0.82281%0.813SS**  trans-142.3114.7152.7-117.7172.6000108.1
195E32.2Very low34.9Very low170 Ų170159.7 Ų159.779%0.79482%0.823SS**  trans-126.6109-179.6178.7-177.9172.400107.1
196N37.2Very low34.9Very low145 Ų145162 Ų16278%0.77582%0.824SS**  trans-120.3105.3175.3-78.8-2.3000108.2
197G33.6Very low34.6Very low76 Ų76160.3 Ų160.378%0.78483%0.827SS**  trans-86.5145.4172.600000111.9
198I32.4Very low34.4Very low160 Ų160160.2 Ų160.282%0.82182%0.82SS**  trans-127.8135.5167.1-66-177.2000109
199K31.6Very low34.1Very low185 Ų185160.4 Ų160.480%0.80482%0.821SS**  trans-1.3119.9162.8-65.6174.8-177.5-179.90115.9
200V30.4Very low33.6Very low135 Ų135157.3 Ų157.382%0.81882%0.819SS**  6199.484.5176.20000111.6
201E31Very low33.3Very low187 Ų187156.3 Ų156.387%0.87482%0.815SS**  -154.6157.3123.7-122.5158.3-152.800110
202K34.8Very low33.2Very low183 Ų183159.2 Ų159.280%0.79682%0.818SS**  trans-141.8109173.8-102.4-161.1171.6-153.40106.7
203E35.2Very low33Very low183 Ų183157.9 Ų157.986%0.85581%0.812SS**  trans-123.3133.9157-67.7-160137.100108.6
204E33.5Very low32.8Very low170 Ų170155.8 Ų155.879%0.79481%0.811SS**  trans-99.1127.7172-66.6172.9174.600107
205T32.5Very low32.8Very low140 Ų140157 Ų15786%0.85981%0.809SS**  trans-151.9137.7161.48.10000110.4
206E34.8Very low32.9Very low180 Ų180157.6 Ų157.684%0.84181%0.809SS**  trans-93.4168.8178.7-54.8-179.4105.500111.4
207V30.4Very low32.6Very low127 Ų127157.7 Ų157.777%0.7781%0.805SS**  trans63.5115.5163-164.20000114.6
208S32Very low32.6Very low107 Ų107162.1 Ų162.175%0.74880%0.803SS**  -164.4144.891.8-780000115.1
209K32.7Very low32.4Very low211 Ų211159.6 Ų159.692%0.91779%0.787SS**  trans-83.7120.9164.1-62.9167.4-177.3165.40109
210V31.9Very low32.5Very low144 Ų144156.6 Ų156.687%0.87379%0.79SS**  trans-127.9148.8158.3-176.80000109.1
211K32.1Very low32.6Very low182 Ų182157.2 Ų157.279%0.79178%0.781SS**  trans-128.6154.8-167.2-145.1-178.9-172.3-179.60108.8
212L33Very low32.7Very low143 Ų143153.7 Ų153.775%0.74978%0.778SS**  trans84.9149157.7-62.6165.2000121.1
213K32.6Very low32.4Very low176 Ų176153.2 Ų153.277%0.76578%0.778SS**  trans78.984.8146.6-78.1166.7-179.7-174.50120.9
214S30.5Very low32.1Very low111 Ų111147.8 Ų147.878%0.77677%0.771SS**  31.8126.9110.764.80000120.4
215K34.5Very low32Very low181 Ų181147.5 Ų147.579%0.78778%0.775SS**  trans-140.2161.3139.4-139.1-169.7176.4-125.80110.7E217K215-E217 IonicContact NZ-OE1 2.81Å; K215-E217 IonicContact NZ-OE2 4Å; K215-E217 PolarHBondContact NZ-OE2 2.95Å
216K33.6Very low32Very low184 Ų184149 Ų14980%0.877%0.773SS**  trans-144120.5-175.1170.2-165.8172-175.60109.8
217E30.9Very low32.2Very low146 Ų146146.2 Ų146.268%0.68276%0.762SS**  trans-151.3132.1157.5-96.2125.4179.300104.9K215K215-E217 IonicContact NZ-OE1 2.81Å; K215-E217 IonicContact NZ-OE2 4Å; K215-E217 PolarHBondContact NZ-OE2 2.95Å
218K33.2Very low32.4Very low170 Ų170148.8 Ų148.874%0.73976%0.763SS**  62.1144.560.6-84.7-144.1171.8-143.80113.3
219E29.2Very low32.4Very low106 Ų106148 Ų14850%0.49576%0.763SS.*  cis-171.6135.3-24.8177.9178.3168.500106.3K221E219-K221 WeakPolarHBondContact OE1-CE 3.29Å; E219-K221 IonicContact OE1-NZ 2.69Å; E219-K221 PolarHBondContact OE1-NZ 3.1Å
220S34.3Very low32.5Very low123 Ų123147.2 Ų147.286%0.8676%0.759SS**  trans-149.9151.4161.556.40000110.5
221K31.4Very low32.5Very low147 Ų147151.8 Ų151.864%0.63976%0.761SS**  trans-135.4143.7-166.9-76.3178.4167.61200112.4E219E219-K221 WeakPolarHBondContact OE1-CE 3.29Å; E219-K221 IonicContact OE1-NZ 2.69Å; E219-K221 PolarHBondContact OE1-NZ 3.1Å
222S33.9Very low32.9Very low114 Ų114153.4 Ų153.480%0.79777%0.768SS**  trans-164.8121.2144.144.60000105.2
223E28.7Very low33Very low172 Ų172155.4 Ų155.480%0.80477%0.771SS**  cis55.4111.541.8-60.8-176.9-170.400112
224G28.2Very low33.2Very low69 Ų69152.2 Ų152.271%0.71177%0.77SS**  cis178.4-163.6-2.100000113.3
225N32.3Very low33.1Very low164 Ų164151.1 Ų151.188%0.87776%0.759SS**  trans65.876.7166.2-60.2-9.9000118.6
226E31.3Very low33.1Very low173 Ų173151.3 Ų151.381%0.80876%0.763SS**  -14.5143.1121.2-167.7-167-105.100116.1
227I39.9Very low33.1Very low120 Ų120149.1 Ų149.162%0.61576%0.76SS**  161.7123.8128.3-85.2175.1000115.2
228K34.3Very low33.5Very low182 Ų182151.4 Ų151.479%0.79177%0.771SS**  trans59.2101.6150.8-67.7164.9-156.61550123.6
229A32.8Very low33.6Very low89 Ų89151.4 Ų151.474%0.73677%0.773SS**  87.215499.900000124.2
230K33.8Very low34Very low195 Ų195153.8 Ų153.885%0.84879%0.788SS**  trans7387.5157.1-70.7177.3-179177.10120.5
231R33.2Very low34.2Very low240 Ų240155.4 Ų155.491%0.90679%0.786SS**  46.599.5104.8-172.3-169.3-172.8-1733.3117.3
232K38.9Very low35.1Very low216 Ų216152.7 Ų152.794%0.93978%0.783SS**  trans-128.1159.5142.4-82.2-167.3174.9-176.30110.1
233K36.4Very low35.1Very low186 Ų186155.4 Ų155.481%0.80978%0.781SS**  trans-153.2122.3-173.9-179.5-158.3176.3-161.50109.7
234S35.5Very low35.3Very low108 Ų108155.5 Ų155.576%0.75578%0.778SS**  trans-159.6132.6158.243.30000106.1
235T29.8Very low35.6Very low89 Ų89160.6 Ų160.655%0.54678%0.781SS.*  cis68.588.631.575.30000114.5
236E34.1Very low35.7Very low184 Ų184160 Ų16086%0.8678%0.778SS**  -121.9131.5113.7-81.1142.3-155.600104.1
237D32.9Very low36Very low138 Ų138159.7 Ų159.774%0.73877%0.774SS**  77.4134.456.4-57.1-36.9000111.1
238E39.9Very low35.9Very low195 Ų195160.2 Ų160.291%0.91178%0.777SS**  cis-112.3163.422.4-60.8-167.4121.900117.7
239E34.8Very low36.1Very low170 Ų170160 Ų16079%0.79478%0.776SS**  trans-75.7148.8162-170.2166.4-151.600109.2
240I36.6Very low36.2Very low156 Ų156163.1 Ų163.180%0.878%0.78SS**  -174.2133.990.8-83.5160.5000110
241L39.7Very low36.2Very low156 Ų156162 Ų16282%0.81778%0.775SS**  trans-95.8-166.3172.4-57.1170.9000109
242P50.8Low35.9Very low90 Ų90156.7 Ų156.758%0.58476%0.761SS**  cis-148.5-168.5-0.242.2-20.8000116.9
243K33.6Very low35.6Very low172 Ų172153.3 Ų153.375%0.74875%0.752SS**  trans92.5115.5146.3-75.7160.2-158.4153.70121.4
244K33.4Very low35.2Very low173 Ų173149.7 Ų149.775%0.75275%0.75SS**  trans94.8111.6130.2-70.2167.7-178.3174.90121.8
245K34.3Very low34.8Very low177 Ų177150.3 Ų150.377%0.7775%0.749SS**  78.6145.4127.8-70.1-173.7174.5-173.70120.9
246N34Very low35Very low150 Ų150153.7 Ų153.780%0.80276%0.758SS**  trans73.3160.7156.9-63.8-15.7000118
247K37.3Very low35Very low167 Ų167154 Ų15473%0.72676%0.76SS**  cis-175.9135.6-42.4-151.6-168.6179.8178.80107.9
248L38.9Very low34.8Very low132 Ų132154.4 Ų154.469%0.69176%0.762SS**  trans68.6162.9169.1-45.1-175.3000114.4
249K37Very low34.4Very low177 Ų177150.7 Ų150.777%0.7775%0.752SS**  cis-158.6166.4-11.1-125.6170.3-171.1-1780111.9
250N35.1Very low34.3Very low154 Ų154147.6 Ų147.682%0.82475%0.749SS**  trans-61.1157.2-177.1-37.53000117.4
251K33.7Very low34.1Very low171 Ų171148.2 Ų148.274%0.74375%0.749SS**  trans-156.2158.4146.1-99.9170.5162.3-79.60105.8
252E27.8Very low33.8Very low129 Ų129144.8 Ų144.860%0.60373%0.734SS**  cis-151.5150.24.6-156.399.9-127.300111.2
253I31.3Very low32.8Very low146 Ų146148.9 Ų148.975%0.74974%0.743SS**  trans17.6137.9146.6-66.2164.9000123.7
254S28.2Very low32.7Very low109 Ų109146 Ų14676%0.76275%0.745SS**  trans-173.4168.7136.961.40000110
255V28.7Very low32.6Very low122 Ų122147.2 Ų147.274%0.73975%0.75SS**  cis-163.5171.4-30.5137.60000107.6
256E33.8Very low32.5Very low159 Ų159148.2 Ų148.274%0.74375%0.754SS**  trans-59.2-176.9170.6-64.789.7177.900115.3
257E32.8Very low32.6Very low192 Ų192149.6 Ų149.690%0.89775%0.753SS**  cis-151.7-156.819.9-157.1168.1-11300113.3
258D29.3Very low32.3Very low146 Ų146149.7 Ų149.778%0.78176%0.761SS**  trans-149.4-171.7-130.6-168.931.1000118.5
259V31Very low32Very low116 Ų116153.4 Ų153.470%0.70377%0.772SS**  trans88140.5160.8-148.50000120.5
260S32.2Very low31.8Very low105 Ų105150.2 Ų150.273%0.73477%0.772SS**  trans91.1123.515670.90000119
261E33.2Very low31.9Very low170 Ų170152.5 Ų152.579%0.79477%0.774SS**  79.4137.353.5-80.6-124.3125.200113.2
262V33.2Very low31.8Very low83 Ų83154.2 Ų154.250%0.50378%0.782SS.*  cis-166.4156.8-1.981.30000113.5
263K30.7Very low32Very low176 Ų176152 Ų15277%0.76579%0.786SS**  trans59.4162.8158.7-73.5152.2-148.3151.40118.1
264S31.5Very low32.2Very low112 Ų112154.6 Ų154.678%0.78379%0.792SS**  cis-157.2170.4-15.841.20000112.6
265K31.6Very low32.3Very low198 Ų198157.3 Ų157.386%0.86179%0.793SS**  trans-71.8174.2170.5-57.6160.6-174.1167.50109.8
266K32.2Very low32.5Very low198 Ų198159.8 Ų159.886%0.86180%0.796SS**  cis-166167.528.8-165.5178.1176.7-1740111.6
267K35.3Very low32.4Very low180 Ų180159.9 Ų159.978%0.78380%0.801SS**  trans-52.9159173.6-50.2174.2178.5-179.90114.9
268N30.3Very low32.1Very low168 Ų168154 Ų15490%0.89879%0.792SS**  -161.7175.1114.5-104.2-7.8000115.2
269K33.8Very low32Very low211 Ų211154.3 Ų154.392%0.91779%0.794SS**  trans-113150.7-168.9-175.5179178.4-1770110.9
270S32.3Very low32.1Very low109 Ų109154 Ų15476%0.76279%0.792SS**  trans-106.8153.2-161.254.20000117.2
271K36.3Very low32Very low202 Ų202157.8 Ų157.888%0.87880%0.798SS**  trans146.9106.9154.2-85.1173.3-179.1-169.70107.2
272K32.8Very low31.9Very low207 Ų207153.9 Ų153.990%0.980%0.795SS**  cis74.5123.149.7-165.1-177.6-177.3173.60112.7
273A32.3Very low31.8Very low84 Ų84158 Ų15869%0.69481%0.809SS**  cis-172.1159.8-19.300000110.4
274K34.1Very low31.7Very low199 Ų199157.2 Ų157.287%0.86581%0.808SS**  trans-171.9154134.6-114.9-166.7172.4-156.90111.5
275E31.8Very low31.7Very low167 Ų167159 Ų15978%0.7881%0.806SS**  trans-64.8168158.2-63101.2152.100110.9
276E32.4Very low31.9Very low173 Ų173157.6 Ų157.681%0.80880%0.802SS**  cis-158.3158.528.2-159.8163-150.100111.1
277D31.6Very low32.8Very low161 Ų161151.8 Ų151.886%0.86179%0.785SS**  trans31.6153.3164.6-80.8-34.8000125
278G26.4Very low32.5Very low68 Ų68150.7 Ų150.770%0.70178%0.782SS**  128.143.8124.100000124.4
279N27.9Very low32.7Very low154 Ų154150.4 Ų150.482%0.82477%0.773SS**  trans63.1158.1140.7-156.120.1000122
280V32.4Very low32.8Very low109 Ų109149 Ų14966%0.66177%0.767SS**  trans57.1111.8169.5-156.90000115.7
281E29.9Very low33Very low184 Ų184152.7 Ų152.786%0.8677%0.769SS**  74.1145.359-164.2172.2-112.400114.6
282A32.2Very low32.9Very low88 Ų88154.5 Ų154.573%0.72777%0.771SS**  trans65.5152.4178.300000117.2
283E30.5Very low32.8Very low170 Ų170153 Ų15379%0.79476%0.764SS**  cis-161.6162.6-35.9-147.4177.5176.800108.1
284E28.1Very low32.6Very low160 Ų160159.3 Ų159.375%0.74877%0.77SS**  trans59.3163162.7-66.8-151119.100118.2
285M32.3Very low32.4Very low149 Ų149156.1 Ų156.173%0.73477%0.767SS**  cis-147.1138.3-6.3-129.4170.979.400110.3
286E35.3Very low32.5Very low168 Ų168156.2 Ų156.279%0.78577%0.765SS**  trans-80.9-177.9146.7-123.7-161.8-162.300107.6
287P50Low32.4Very low76 Ų76154 Ų15449%0.49475%0.754SS.*  cis-138.8-156.1-8.126.10.2000113.8
288Q29.5Very low32.3Very low158 Ų158154.3 Ų154.374%0.73875%0.751SS**  trans88.9139.1154.9-48.3-155.95600116.5
289K34Very low32.4Very low162 Ų162160 Ų16070%0.70476%0.759SS**  cis125.6107.85.1-85.8166-176.2159.30110
290K37.2Very low32.2Very low181 Ų181155.8 Ų155.879%0.78775%0.752SS**  trans79.1118.1141.1-61.9173.1179.7174.20122
291K36.4Very low32.1Very low187 Ų187157 Ų15781%0.81376%0.76SS**  89.4143.7126.2-76.6-176.8173.2-1700122.1
292R33.8Very low32.1Very low240 Ų240156.8 Ų156.891%0.90676%0.758SS**  trans78.9152.1166.2-65.4168.6158.9-179.9-7.5114.1
293K29.9Very low32.1Very low174 Ų174160.5 Ų160.576%0.75777%0.766SS**  cis-158143.812.3-160.9-177.4177.2-174.80111.8
294R29Very low32Very low217 Ų217155.3 Ų155.382%0.81976%0.759SS**  trans52.4124.1160.1-79.7-176.3176.2178.9-3.9118.9
295V30.3Very low32.1Very low133 Ų133154.5 Ų154.581%0.80676%0.764SS**  91.997.361.7167.40000114.2
296K33.7Very low31.9Very low169 Ų169151.3 Ų151.374%0.73576%0.761SS**  trans179.6148.9135.6-102.2-177.3164.1-118.80106.3
297E30Very low31.6Very low126 Ų126151.1 Ų151.159%0.58977%0.765SS**  cis-133.5168.81.4-153.298.9-124.900109.2
298E29.9Very low30.5Very low167 Ų167152.3 Ų152.378%0.7878%0.781SS**  trans-31.1159.3173.1-72.9148.4-163.800116.9
299E27.3Very low30.6Very low188 Ų188149.4 Ų149.488%0.87978%0.784SS**  cis174.9148.7-6.4175.8171.6-115.200102.8
300G25.1Very low30.5Very low66 Ų66149.7 Ų149.768%0.6879%0.788SS**  cis-154.1-154.32.200000112.3
301V29.1Very low30.9Very low135 Ų135146.1 Ų146.182%0.81878%0.783SS**  trans-92.2162.8179-177.20000107.9
302E30.8Very low30.8Very low178 Ų178143.6 Ų143.683%0.83277%0.774SS**  -177.3141.594.8-92.2177-170.900114.9
303D32.4Very low30.9Very low166 Ų166137.2 Ų137.289%0.88877%0.767SS**  trans-72.2121.5148-77-67.2000108.4
304G28.7Very low31.2Very low62 Ų62136.3 Ų136.364%0.63976%0.763SS**  trans-159.757.1-165.700000119.6
305V30.1Very low31.5Very low143 Ų143135.6 Ų135.687%0.86777%0.765SS**  trans46.3130.9140.2177.40000121.5
306A27.1Very low31.9Very low81 Ų81135.2 Ų135.267%0.66977%0.769SS**  trans90.5116.8151.600000122.3
307L29.6Very low32.3Very low165 Ų165136.9 Ų136.986%0.86478%0.776SS**  60.5108.6126.4-61.2173.5000122.1
308A27.8Very low32.7Very low100 Ų100142.8 Ų142.883%0.82679%0.793SS**  81.2170.9126.500000120.1
309A29.7Very low33Very low98 Ų98144 Ų14481%0.8180%0.795SS**  trans72.497.9177.300000118.2
310E33.6Very low33.5Very low168 Ų168143.2 Ų143.279%0.78579%0.789SS**  trans-41.6160.4134.1-123.3-150.3112.600111.6Q312E310-Q312 PolarHBondContact OE1-N 3.47Å
311P44.1Very low33.9Very low106 Ų106147.6 Ų147.669%0.68880%0.797SS**  -160169.661.843.8-22.2000120.6
312Q34.7Very low34.1Very low133 Ų133145.8 Ų145.862%0.62179%0.79SS**  trans87.4133.1149-55.7-142.732.600123.1E310E310-Q312 PolarHBondContact OE1-N 3.47Å
313S36Very low34.2Very low107 Ų107142.3 Ų142.375%0.74879%0.792SS**  trans96148.2137.182.90000119.8
314K36.6Very low34.4Very low155 Ų155142.6 Ų142.667%0.67479%0.785SS**  cis-168.5131.5-46.9-111.2153.2-172.6162.10109.8
315K36.1Very low34.5Very low201 Ų201145.9 Ų145.987%0.87479%0.788SS**  trans57.1132.1151.3-59.3176.4178.8178.50120.6
316S37Very low34.3Very low125 Ų125142.2 Ų142.287%0.87478%0.78SS**  trans-140.9164.6134.976.80000110.7
317K42.7Very low34.5Very low204 Ų204147.4 Ų147.489%0.88779%0.79SS**  trans-99.8154.7-174.8-67.9173.9177.3171.60111.3
318R38.2Very low34.4Very low251 Ų251145.7 Ų145.795%0.94778%0.781SS**  trans-135.6150.7151-161.2162.8-179.9155.6-0.1111.6
319K36.8Very low34.6Very low191 Ų191148 Ų14883%0.8379%0.785SS**  trans-105.8152.4-174-72.4-179.4175.2176.50112.1
320K37.7Very low34.6Very low172 Ų172150 Ų15075%0.74878%0.783SS**  trans48.5124.1134.4-171.8179.1177.4-175.70118.7
321N33.9Very low34.5Very low158 Ų158147.4 Ų147.485%0.84578%0.778SS**  -159.4153.8116.8-96.5-12.1000111.5
322S32.5Very low33.7Very low97 Ų97149.9 Ų149.968%0.67878%0.781SS**  trans-141.4124.1-175.453.30000109
323A33.7Very low33.5Very low105 Ų105146.6 Ų146.687%0.86878%0.776SS**  trans-78.4164.8163.200000109.7
324K36.8Very low33.3Very low172 Ų172150.3 Ų150.375%0.74878%0.779SS**  trans-143.9161-171.2-139.5-179161.7-82.90112
325D29.2Very low33.1Very low132 Ų132147.5 Ų147.571%0.70678%0.784SS**  trans72.1132.5167.8-50.6-33.7000116.8
326G27.5Very low33.1Very low66 Ų66143.9 Ų143.968%0.6878%0.779SS**  cis-174.6-174.1-4.300000115.6
327Q30.5Very low32.9Very low190 Ų190148.1 Ų148.189%0.88878%0.776SS**  trans65152.3177.2-66.7-165.1-66.100118.1
328D27.2Very low32.6Very low128 Ų128146.8 Ų146.868%0.68477%0.77SS**  cis-160.8127.8-39.3-152.7-22.5000108.8
329V32.2Very low32.4Very low150 Ų150144.1 Ų144.191%0.90977%0.765SS**  trans-167.9123.9161.7-105.90000108.9
330N29.1Very low32.6Very low140 Ų140144.6 Ų144.675%0.74977%0.767SS**  trans-149.6158.6176.3-164.23.1000110
331T31.1Very low32.6Very low113 Ų113145.2 Ų145.269%0.69377%0.77SS**  trans71.1148.817191.10000116.4
332E28.8Very low32.8Very low158 Ų158146.1 Ų146.174%0.73877%0.767SS**  cis-155.2169-8.3-139-165.4113.500113.7
333A30Very low32.8Very low63 Ų63147.1 Ų147.152%0.52176%0.764SS.*  trans70.2125.7135.400000123.8
334K30.9Very low32.9Very low186 Ų186148.5 Ų148.581%0.80975%0.751SS**  65.4111.8129.8-65.4167.7-174.1147.40119.3
335A33.3Very low32.7Very low96 Ų96147 Ų14779%0.79375%0.746SS**  trans-69.3151.9158.700000112.7
336T35.2Very low32.9Very low124 Ų124147.3 Ų147.376%0.76174%0.743SS**  trans-161.8142.7142.49.70000113.8
337R32.5Very low33.2Very low214 Ų214152.7 Ų152.781%0.80875%0.751SS**  trans72.4105.2147.2-71171.2175.2-167.9-1.6121.5
338K37.1Very low33.4Very low177 Ų177152 Ų15277%0.7775%0.748SS**  108.398.8123-71.2175.1177.9-179.30121.7
339K34.7Very low33.6Very low194 Ų194153.5 Ų153.584%0.84376%0.756SS**  68.1101.9122.1-67.5-171.7173.5-174.10122.2
340K40.2Very low34.1Very low202 Ų202151.5 Ų151.588%0.87875%0.748SS**  -179123.5113.3-97.4175179.2-179.10106.1
341K38.4Very low34.3Very low184 Ų184154.3 Ų154.380%0.876%0.757SS**  cis61.6116.837.8-153.5173.1-171.7176.90111.1
342K37.7Very low34.7Very low178 Ų178155.5 Ų155.577%0.77476%0.759SS**  cis-128.8139.539.1-81.3-175.4170.9-175.50113.7
343N32.9Very low35Very low117 Ų117157.9 Ų157.963%0.62677%0.767SS**  94127.697.4-7129.9000113
344K36.1Very low36.1Very low135 Ų135160.2 Ų160.259%0.58778%0.777SS**  71.5127.880.6-130.4-170.9176-63.90110E346K344-E346 VanDerWaalsContact NZ-CD 3.32Å; K344-E346 IonicContact NZ-OE1 2.65Å; K344-E346 PolarHBondContact NZ-OE1 3.15Å; K344-E346 IonicContact NZ-OE2 2.68Å; K344-E346 PolarHBondContact NZ-OE2 2.8Å; K344-E346 VanDerWaalsContact NZ-OE2 3.15Å
345E32.3Very low36.8Very low141 Ų141161.7 Ų161.766%0.65978%0.784SS**  cis-136176.942-138.587.8176.100116.1
346E32.8Very low37.2Very low137 Ų137160.2 Ų160.264%0.6478%0.778SS**  trans-47.1164.9170.5-68.792.2-97.800114.6K344K344-E346 VanDerWaalsContact NZ-CD 3.32Å; K344-E346 IonicContact NZ-OE1 2.65Å; K344-E346 PolarHBondContact NZ-OE1 3.15Å; K344-E346 IonicContact NZ-OE2 2.68Å; K344-E346 PolarHBondContact NZ-OE2 2.8Å; K344-E346 VanDerWaalsContact NZ-OE2 3.15Å
347Q34.1Very low37.6Very low179 Ų179161.5 Ų161.584%0.83678%0.78SS**  cis-157166.941.3-173.5173-15.500114
348E34.3Very low38.6Very low176 Ų176156.4 Ų156.482%0.82277%0.773SS**  trans-51.2152.9166.7-65.4163.2127.200112
349D31.4Very low39.6Very low160 Ų160152.8 Ų152.886%0.85677%0.765SS**  -154.3168.670-146.1-22.9000114.5
350S42.9Very low40.4Very low107 Ų107152.5 Ų152.575%0.74876%0.764SS**  trans-102.7129.9-173.5-61.60000113.6
351Q34.4Very low41.1Very low200 Ų200150.5 Ų150.594%0.93576%0.762SS**  trans-156138.9147.4-120.8169.738.800113.6
352D38.1Very low42Very low138 Ų138146.8 Ų146.874%0.73876%0.76SS**  trans-65148.9173.9-78-71.3000112.8
353F36.4Very low43Very low207 Ų207143 Ų14391%0.90876%0.762SS**  -171.7144.7107.5-92.1-62.5000110.9
354P52.4Low44.6Very low113 Ų113146.6 Ų146.673%0.73477%0.772SS**  trans-95.1136.3-170.835.2-31.9000113.3
355K44.8Very low45.9Very low216 Ų216146.4 Ų146.494%0.93978%0.784SS**  trans-161.5122.1160.1-125.1163.7-173.51680115.1
356G42.3Very low46.8Very low66 Ų66143 Ų14368%0.6879%0.787SS**  trans62.687.6152.600000117.2V358G356-V358 VanDerWaalsContact C-N 3.32Å; G356-V358 PolarHBondContact O-N 2.93Å
357D44.3Very low47.7Very low151 Ų151141.5 Ų141.581%0.80778%0.783SS**  trans-69.487165.2-175.116.3000110.7V359D357-V359 PolarHBondContact O-N 2.96Å; D357-V359 WeakPolarHBondContact OD1-CG2 3.45Å
358V53.3Low48.8Very low107 Ų107137.1 Ų137.165%0.64877%0.773SS**  trans-91.985.9174.9-177.90000108.5G356 F360G356-V358 VanDerWaalsContact C-N 3.32Å; G356-V358 PolarHBondContact O-N 2.93Å; V358-F360 HydrophobicContact CG1-CD2 4.13Å; V358-F360 HydrophobicContact CG1-CE2 3.88Å; V358-F360 WeakPolarHBondContact O-CD2 3.24Å; V358-F360 PolarHBondContact O-N 3.3Å
359V58.8Low49.8Very low100 Ų100134.5 Ų134.561%0.60676%0.764SS**  trans-64.297.2175.3-177.80000110D357 L361D357-V359 PolarHBondContact O-N 2.96Å; D357-V359 WeakPolarHBondContact OD1-CG2 3.45Å; V359-L361 PolarHBondContact O-N 2.81Å
360F49.9Very low50.9Low188 Ų188132.5 Ų132.583%0.82575%0.75SS**  trans-6893.4169.4-85.3-90.6000110V358 S362V358-F360 HydrophobicContact CG1-CD2 4.13Å; V358-F360 HydrophobicContact CG1-CE2 3.88Å; V358-F360 WeakPolarHBondContact O-CD2 3.24Å; V358-F360 PolarHBondContact O-N 3.3Å; F360-S362 PolarHBondContact O-N 3.18Å
361L56.2Low51.6Low160 Ų160133.8 Ų133.884%0.83875%0.753SS**  trans-60.2101.6166.4-70.8174.3000109V359 A363V359-L361 PolarHBondContact O-N 2.81Å; L361-A363 PolarHBondContact O-N 3.43Å
362S55.9Low52.7Low107 Ų107128.3 Ų128.375%0.74874%0.742SS**  trans-63.7131.8179.851.10000110.6F360 K364F360-S362 PolarHBondContact O-N 3.18Å; S362-K364 PolarHBondContact O-N 3.47Å
363A59.8Low53.8Low99 Ų99126.1 Ų126.182%0.81873%0.729SS**  trans-65.3107.8-178.100000110.2L361L361-A363 PolarHBondContact O-N 3.43Å
364K67.1Low55.5Low191 Ų191121.6 Ų121.683%0.8371%0.714SS**PPolyproline II helixtrans-60.8128.5167.8-65.5-179.5-179.7178.80107.9S362 G366S362-K364 PolarHBondContact O-N 3.47Å; K364-G366 PolarHBondContact O-N 2.84Å
365P62.2Low56.9Low131 Ų131123 Ų12385%0.85171%0.711SS**PPolyproline II helixtrans-61.3121.9175.525.3-32.6000109
366G51.6Low58.4Low69 Ų69120.3 Ų120.371%0.71170%0.702SS**PPolyproline II helixtrans-68.8151.3-179.700000112.2K364 S368K364-G366 PolarHBondContact O-N 2.84Å; G366-S368 PolarHBondContact O-N 3.47Å; G366-S368 VanDerWaalsContact O-N 3.12Å
367N52.5Low60.3Low106 Ų106125 Ų12557%0.56770%0.699SS**  trans-35.9108.3-179.5-169.623.8000113.9D369 E370N367-D369 VanDerWaalsContact C-N 3.31Å; N367-E370 PolarHBondContact ND2-OE1 2.89Å
368S57.2Low62.1Low88 Ų88127.3 Ų127.362%0.61570%0.697SS**  trans-77.7-16.318041.40000114G366 E370G366-S368 PolarHBondContact O-N 3.47Å; G366-S368 VanDerWaalsContact O-N 3.12Å; S368-E370 PolarHBondContact O-N 3.25Å
369D54.8Low63.6Low121 Ų121128.4 Ų128.465%0.64769%0.692SS**G310 helixtrans-90.5-7.3-155-59.30.3000112.6N367 V371N367-D369 VanDerWaalsContact C-N 3.31Å; D369-V371 PolarHBondContact O-N 2.89Å
370E53.6Low64.7Low117 Ų117126.2 Ų126.255%0.54769%0.685SS.*G310 helixtrans-72.9-10.8175.4-72.8176-129.400113.9N367 S368 A372 I373N367-E370 PolarHBondContact ND2-OE1 2.89Å; S368-E370 PolarHBondContact O-N 3.25Å; E370-A372 PolarHBondContact O-N 2.94Å; E370-I373 HydrophobicContact CB-CD1 3.79Å; E370-I373 HydrophobicContact CB-CG1 4.45Å; E370-I373 HydrophobicContact CG-CD1 4.02Å; E370-I373 WeakPolarHBondContact O-CB 3.41Å; E370-I373 WeakPolarHBondContact O-CD1 3.44Å; E370-I373 WeakPolarHBondContact O-CG1 3.3Å; E370-I373 PolarHBondContact O-N 3.14Å
371V57.4Low66.5Low134 Ų134121 Ų12181%0.81267%0.665SS**G310 helixtrans-69.5-16177.5-172.60000112D369 I373D369-V371 PolarHBondContact O-N 2.89Å; V371-I373 VanDerWaalsContact C-N 3.33Å
372A58Low68Low85 Ų85118 Ų11870%0.70265%0.647SS**G310 helixtrans-83.21.2171.500000114.3E370 N374E370-A372 PolarHBondContact O-N 2.94Å; A372-N374 PolarHBondContact O-N 2.99Å; A372-N374 VanDerWaalsContact O-N 3.09Å
373I61.8Low69.3Low92 Ų92118.9 Ų118.947%0.47264%0.641SS.*SBendtrans-60.4116.4176.7-70.2168.8000110.1E370 V371 Q375E370-I373 HydrophobicContact CB-CD1 3.79Å; E370-I373 HydrophobicContact CB-CG1 4.45Å; E370-I373 HydrophobicContact CG-CD1 4.02Å; E370-I373 WeakPolarHBondContact O-CB 3.41Å; E370-I373 WeakPolarHBondContact O-CD1 3.44Å; E370-I373 WeakPolarHBondContact O-CG1 3.3Å; E370-I373 PolarHBondContact O-N 3.14Å; V371-I373 VanDerWaalsContact C-N 3.33Å; I373-Q375 PolarHBondContact O-N 2.77Å; I373-Q375 VanDerWaalsContact O-N 3.08Å
374N72.1Confident70.4Confident113 Ų113120 Ų12060%0.60463%0.629SS**  trans-30.4108.2-176.7-63.8-6.6000113.4A372 E376 R377 R378A372-N374 PolarHBondContact O-N 2.99Å; A372-N374 VanDerWaalsContact O-N 3.09Å; N374-E376 PolarHBondContact O-N 2.91Å; N374-E376 VanDerWaalsContact O-N 3.1Å; N374-R377 HydrophobicContact CB-CB 4.04Å; N374-R377 WeakPolarHBondContact O-CA 3.32Å; N374-R377 WeakPolarHBondContact O-CB 3.48Å; N374-R377 PolarHBondContact O-N 3.05Å; N374-R378 PolarHBondContact O-N 3.19Å; N374-R378 VanDerWaalsContact O-N 3.14Å
375Q80.8Confident71.1Confident141 Ų141116.1 Ų116.166%0.65962%0.616SS**Hα-helixtrans-57.1-30.5-179.8-62-174.813.600112.2I373 R378 K379I373-Q375 PolarHBondContact O-N 2.77Å; I373-Q375 VanDerWaalsContact O-N 3.08Å; Q375-R378 PolarHBondContact O-N 3.32Å; Q375-K379 WeakPolarHBondContact O-CB 3.44Å; Q375-K379 VanDerWaalsContact O-CG 3.3Å; Q375-K379 WeakPolarHBondContact O-CG 3.33Å; Q375-K379 PolarHBondContact O-N 3.19Å
376E77.2Confident72.1Confident161 Ų161114.6 Ų114.675%0.75260%0.598SS**Hα-helixtrans-64.8-42.1174.4-63177.7168.100112N374 R378 K379 A380N374-E376 PolarHBondContact O-N 2.91Å; N374-E376 VanDerWaalsContact O-N 3.1Å; E376-R378 VanDerWaalsContact C-N 3.32Å; E376-R378 PolarHBondContact O-N 3.19Å; E376-K379 PolarHBondContact O-N 2.94Å; E376-A380 WeakPolarHBondContact O-CB 3.42Å; E376-A380 PolarHBondContact O-N 2.89Å
377R81.1Confident73.5Confident165 Ų165118.4 Ų118.462%0.62360%0.597SS**Hα-helixtrans-63.8-39.2173.2-171.7-177.7-179.1-155.5-0.4111.1N374 A380 L381N374-R377 HydrophobicContact CB-CB 4.04Å; N374-R377 WeakPolarHBondContact O-CA 3.32Å; N374-R377 WeakPolarHBondContact O-CB 3.48Å; N374-R377 PolarHBondContact O-N 3.05Å; R377-A380 PolarHBondContact O-N 3.14Å; R377-L381 HydrophobicContact CG-CD1 4.17Å; R377-L381 WeakPolarHBondContact O-CB 3.48Å; R377-L381 WeakPolarHBondContact O-CG 3.18Å; R377-L381 PolarHBondContact O-N 2.88Å
378R82.2Confident74.3Confident199 Ų199117.6 Ų117.675%0.75161%0.605SS**Hα-helixtrans-66.4-38.6176-169.5173.4-176.9163.62.6112.2N374 Q375 E376 Q382N374-R378 PolarHBondContact O-N 3.19Å; N374-R378 VanDerWaalsContact O-N 3.14Å; Q375-R378 PolarHBondContact O-N 3.32Å; E376-R378 VanDerWaalsContact C-N 3.32Å; E376-R378 PolarHBondContact O-N 3.19Å; R378-Q382 VanDerWaalsContact O-CB 3.32Å; R378-Q382 WeakPolarHBondContact O-CB 3.41Å; R378-Q382 PolarHBondContact O-N 3.05Å
379K84.8Confident74.6Confident129 Ų129117.4 Ų117.456%0.56160%0.603SS**Hα-helixtrans-69.5-40.7174.3-73168.7-176.9173.10112.3Q375 E376 Q382 M383Q375-K379 WeakPolarHBondContact O-CB 3.44Å; Q375-K379 VanDerWaalsContact O-CG 3.3Å; Q375-K379 WeakPolarHBondContact O-CG 3.33Å; Q375-K379 PolarHBondContact O-N 3.19Å; E376-K379 PolarHBondContact O-N 2.94Å; K379-Q382 PolarHBondContact O-N 3.22Å; K379-M383 WeakPolarHBondContact O-CG 3.28Å; K379-M383 PolarHBondContact O-N 3.01Å
380A82.6Confident75Confident55 Ų55118.2 Ų118.246%0.45560%0.603SS.*Hα-helixtrans-62.2-48.3176.300000111.4E376 R377 Q382 M383 E384E376-A380 WeakPolarHBondContact O-CB 3.42Å; E376-A380 PolarHBondContact O-N 2.89Å; R377-A380 PolarHBondContact O-N 3.14Å; A380-Q382 VanDerWaalsContact C-N 3.31Å; A380-Q382 PolarHBondContact O-N 2.85Å; A380-M383 PolarHBondContact O-N 2.87Å; A380-E384 WeakPolarHBondContact O-CB 3.41Å; A380-E384 PolarHBondContact O-N 2.71Å
381L86.9Confident75Confident77 Ų77117.7 Ų117.740%0.40361%0.61SS.*Hα-helixtrans-62.5-37.3174.5-70.1167.1000112.2R377 I385R377-L381 HydrophobicContact CG-CD1 4.17Å; R377-L381 WeakPolarHBondContact O-CB 3.48Å; R377-L381 WeakPolarHBondContact O-CG 3.18Å; R377-L381 PolarHBondContact O-N 2.88Å; L381-I385 WeakPolarHBondContact O-CB 3.46Å; L381-I385 WeakPolarHBondContact O-CD1 3.27Å; L381-I385 WeakPolarHBondContact O-CG1 3.36Å; L381-I385 PolarHBondContact O-N 3.39Å
382Q88.6Confident75Confident98 Ų98118.8 Ų118.846%0.45861%0.612SS.*Hα-helixtrans-64.3-42.4174.4-175.465.436.300111.6R378 K379 A380 I385 E386R378-Q382 VanDerWaalsContact O-CB 3.32Å; R378-Q382 WeakPolarHBondContact O-CB 3.41Å; R378-Q382 PolarHBondContact O-N 3.05Å; K379-Q382 PolarHBondContact O-N 3.22Å; A380-Q382 VanDerWaalsContact C-N 3.31Å; A380-Q382 PolarHBondContact O-N 2.85Å; Q382-I385 PolarHBondContact O-N 3.3Å; Q382-E386 WeakPolarHBondContact CG-OE1 3.48Å; Q382-E386 PolarHBondContact NE2-OE1 3.18Å; Q382-E386 WeakPolarHBondContact O-CB 3.46Å; Q382-E386 WeakPolarHBondContact O-CG 3.35Å; Q382-E386 PolarHBondContact O-N 2.89Å
383M83.2Confident75.1Confident126 Ų126122.2 Ų122.262%0.62161%0.611SS**Hα-helixtrans-66.9-41.9175.6-75177.259.300112.3K379 A380 I385 E386 E387K379-M383 WeakPolarHBondContact O-CG 3.28Å; K379-M383 PolarHBondContact O-N 3.01Å; A380-M383 PolarHBondContact O-N 2.87Å; M383-I385 VanDerWaalsContact C-N 3.31Å; M383-I385 PolarHBondContact O-N 3.34Å; M383-E386 PolarHBondContact O-N 2.79Å; M383-E387 VanDerWaalsContact O-CB 3.27Å; M383-E387 WeakPolarHBondContact O-CB 3.17Å; M383-E387 PolarHBondContact O-N 2.89Å
384E82.6Confident74.8Confident123 Ų123123.7 Ų123.758%0.57563%0.626SS**Hα-helixtrans-61-40.1175.5-175.4-179.4-178.100111.2A380 A388A380-E384 WeakPolarHBondContact O-CB 3.41Å; A380-E384 PolarHBondContact O-N 2.71Å; E384-A388 WeakPolarHBondContact O-CB 3.42Å; E384-A388 PolarHBondContact O-N 2.98Å
385I82.3Confident74.1Confident108 Ų108122.5 Ų122.555%0.55463%0.632SS**Hα-helixtrans-67.5-42.7172.9-69.7164.7000111.3L381 Q382 M383 S389L381-I385 WeakPolarHBondContact O-CB 3.46Å; L381-I385 WeakPolarHBondContact O-CD1 3.27Å; L381-I385 WeakPolarHBondContact O-CG1 3.36Å; L381-I385 PolarHBondContact O-N 3.39Å; Q382-I385 PolarHBondContact O-N 3.3Å; M383-I385 VanDerWaalsContact C-N 3.31Å; M383-I385 PolarHBondContact O-N 3.34Å; I385-S389 WeakPolarHBondContact O-CB 3.4Å; I385-S389 PolarHBondContact O-N 2.84Å; I385-S389 PolarHBondContact O-OG 3.42Å
386E82.6Confident72.9Confident100 Ų100120.4 Ų120.447%0.46763%0.628SS.*Hα-helixtrans-66.5-41.8179.2-78.7171.3-160.300111.9Q382 M383 S389 Q390Q382-E386 WeakPolarHBondContact CG-OE1 3.48Å; Q382-E386 PolarHBondContact NE2-OE1 3.18Å; Q382-E386 WeakPolarHBondContact O-CB 3.46Å; Q382-E386 WeakPolarHBondContact O-CG 3.35Å; Q382-E386 PolarHBondContact O-N 2.89Å; M383-E386 PolarHBondContact O-N 2.79Å; E386-S389 WeakPolarHBondContact CA-OG 3.19Å; E386-S389 PolarHBondContact O-N 3.03Å; E386-S389 PolarHBondContact O-OG 3.28Å; E386-Q390 WeakPolarHBondContact O-CG 3.38Å; E386-Q390 PolarHBondContact O-N 3.2Å
387E81.1Confident72.2Confident149 Ų149116.1 Ų116.170%0.69661%0.61SS**Hα-helixtrans-63.1-51.7173.9-173.2168.3-166.400111.2M383 S389 Q390M383-E387 VanDerWaalsContact O-CB 3.27Å; M383-E387 WeakPolarHBondContact O-CB 3.17Å; M383-E387 PolarHBondContact O-N 2.89Å; E387-S389 PolarHBondContact O-N 3.45Å; E387-Q390 WeakPolarHBondContact O-CB 3.41Å; E387-Q390 PolarHBondContact O-N 3.45Å
388A68.8Low71.5Confident88 Ų88110.5 Ų110.573%0.72760%0.604SS**Hα-helixtrans-66.3-16.7175.800000114E384E384-A388 WeakPolarHBondContact O-CB 3.42Å; E384-A388 PolarHBondContact O-N 2.98Å
389S64.8Low71.1Confident84 Ų84109 Ų10959%0.58761%0.606SS**THydrogen-bonded Turntrans-84.6-12.2173.379.90000113.9I385 E386 E387 P391I385-S389 WeakPolarHBondContact O-CB 3.4Å; I385-S389 PolarHBondContact O-N 2.84Å; I385-S389 PolarHBondContact O-OG 3.42Å; E386-S389 WeakPolarHBondContact CA-OG 3.19Å; E386-S389 PolarHBondContact O-N 3.03Å; E386-S389 PolarHBondContact O-OG 3.28Å; E387-S389 PolarHBondContact O-N 3.45Å; S389-P391 WeakPolarHBondContact O-CD 3.32Å
390Q63.6Low70.4Confident138 Ų138108.1 Ų108.165%0.64560%0.599SS**SBendtrans-71.5126.2177.9-61.3-139.424.300110.3E386 E387 D392E386-Q390 WeakPolarHBondContact O-CG 3.38Å; E386-Q390 PolarHBondContact O-N 3.2Å; E387-Q390 WeakPolarHBondContact O-CB 3.41Å; E387-Q390 PolarHBondContact O-N 3.45Å; Q390-D392 VanDerWaalsContact C-N 3.31Å; Q390-D392 PolarHBondContact O-N 3.47Å
391P52.7Low69.4Low106 Ų106107.6 Ų107.669%0.68859%0.592SS**  trans-78.981.9179.232.4-34.5000110.4S389 K393S389-P391 WeakPolarHBondContact O-CD 3.32Å; P391-K393 PolarHBondContact O-N 2.86Å
392D56.6Low68.7Low158 Ų158109.4 Ų109.485%0.84561%0.606SS**SBendtrans-51.7-13170.8-92.7-10.3000114.4Q390Q390-D392 VanDerWaalsContact C-N 3.31Å; Q390-D392 PolarHBondContact O-N 3.47Å
393K60Low68Low157 Ų157106.2 Ų106.268%0.68360%0.597SS**SBendtrans-129.4136.9179.6-68160.1-169163.20108P391 A395P391-K393 PolarHBondContact O-N 2.86Å; K393-A395 PolarHBondContact O-N 2.99Å
394P56.3Low67.8Low122 Ų122109.2 Ų109.279%0.79261%0.609SS**SBendtrans-54.7129.8-179.624.1-34.2000109.5V396P394-V396 PolarHBondContact O-N 2.8Å
395A57.5Low67.8Low88 Ų88105.8 Ų105.873%0.72759%0.593SS**  trans-44.6106.7-163.300000112.6K393 L397K393-A395 PolarHBondContact O-N 2.99Å; A395-L397 PolarHBondContact O-N 3.34Å
396V56.5Low68Low97 Ų97108.8 Ų108.859%0.58861%0.61SS**  trans-66.998.2-173.1-177.20000108.3P394 G398P394-V396 PolarHBondContact O-N 2.8Å; V396-G398 PolarHBondContact O-N 3.14Å
397L61.5Low68.3Low71 Ų71106.4 Ų106.437%0.37260%0.604SS.*  trans-74.765.3-172.3-170.559.4000111.7A395 L415 F421A395-L397 PolarHBondContact O-N 3.34Å; L397-L415 HydrophobicContact CD2-CD1 4.36Å; L397-L415 HydrophobicContact CD2-CD2 4.28Å; L397-F421 HydrophobicContact CD2-CD2 3.84Å; L397-F421 HydrophobicContact CD2-CE2 4.33Å
398G67.3Low68.5Low47 Ų47103.1 Ų103.149%0.48560%0.598SS.*G310 helixtrans61.6-161.1-175.300000113.8V396 W400 S401V396-G398 PolarHBondContact O-N 3.14Å; G398-W400 PolarHBondContact O-N 3.46Å; G398-S401 PolarHBondContact O-N 3.28Å; G398-S401 VanDerWaalsContact O-N 3.14Å
399Q72.8Confident69.4Low169 Ų169104.4 Ų104.479%0.7959%0.588SS**G310 helixtrans-60-10.3178.8-66.3166.4-38.300114T402Q399-T402 PolarHBondContact O-OG1 3.24Å
400W69.4Low70.6Confident109 Ų109104.9 Ų104.941%0.41358%0.581SS.*G310 helixtrans-88.1-14.4180-53.1116.7000113.6G398 T402 A403 F414 L415 M418G398-W400 PolarHBondContact O-N 3.46Å; W400-T402 VanDerWaalsContact C-N 3.29Å; W400-T402 PolarHBondContact O-N 2.91Å; W400-A403 PolarHBondContact O-N 2.91Å; W400-F414 HydrophobicContact CB-CE1 4.18Å; W400-F414 HydrophobicContact CD2-CE1 4.09Å; W400-F414 HydrophobicContact CD2-CZ 4.31Å; W400-F414 AromaticContact CE3-CE1 3.59Å; W400-F414 HydrophobicContact CE3-CE1 3.59Å; W400-F414 AromaticContact CE3-CZ 3.5Å; W400-F414 HydrophobicContact CE3-CZ 3.5Å; W400-F414 HydrophobicContact CG-CE1 4.35Å; W400-F414 HydrophobicContact CZ3-CE1 4.35Å; W400-F414 AromaticContact CZ3-CZ 3.79Å; W400-F414 HydrophobicContact CZ3-CZ 3.79Å; W400-L415 HydrophobicContact CB-CD2 3.71Å; W400-M418 HydrophobicContact CH2-CE 3.74Å; W400-M418 HydrophobicContact CZ2-CE 3.58Å; W400-M418 HydrophobicContact CZ3-CE 4.41Å
401S63.2Low71.8Confident45 Ų45101.5 Ų101.532%0.31557%0.566SS.*THydrogen-bonded Turntrans-79.1-10.5-179.4-169.20000114G398G398-S401 PolarHBondContact O-N 3.28Å; G398-S401 VanDerWaalsContact O-N 3.14Å
402T70.9Confident73.3Confident114 Ų114101.6 Ų101.670%0.69956%0.557SS**THydrogen-bonded Turntrans-95.2-8.1174.3470000113.2Q399 W400 Q404Q399-T402 PolarHBondContact O-OG1 3.24Å; W400-T402 VanDerWaalsContact C-N 3.29Å; W400-T402 PolarHBondContact O-N 2.91Å; T402-Q404 PolarHBondContact O-N 3.16Å
403A73.9Confident74.8Confident32 Ų32100 Ų10026%0.26454%0.543SS..  trans-69.9116.5175.100000110W400 F405W400-A403 PolarHBondContact O-N 2.91Å; A403-F405 HydrophobicContact CB-CD2 4.43Å; A403-F405 HydrophobicContact CB-CE2 3.55Å; A403-F405 HydrophobicContact CB-CZ 3.78Å; A403-F405 VanDerWaalsContact O-CD2 3.23Å; A403-F405 WeakPolarHBondContact O-CD2 3.47Å; A403-F405 WeakPolarHBondContact O-CE2 3.32Å
404Q80.1Confident76.1Confident189 Ų18994.9 Ų94.988%0.88352%0.52SS*.  trans-75.5139.5173.4-68.6-170.6-2500110.3T402T402-Q404 PolarHBondContact O-N 3.16Å
405F83.3Confident77.5Confident51 Ų5190 Ų9022%0.22449%0.487CS..  trans-139.7134.3174.9-60.6-82.9000108.6A403 S407 Q410 Q411 F414A403-F405 HydrophobicContact CB-CD2 4.43Å; A403-F405 HydrophobicContact CB-CE2 3.55Å; A403-F405 HydrophobicContact CB-CZ 3.78Å; A403-F405 VanDerWaalsContact O-CD2 3.23Å; A403-F405 WeakPolarHBondContact O-CD2 3.47Å; A403-F405 WeakPolarHBondContact O-CE2 3.32Å; F405-S407 PolarHBondContact O-N 3.37Å; F405-S407 VanDerWaalsContact O-N 3.1Å; F405-Q410 HydrophobicContact CD1-CG 3.83Å; F405-Q410 HydrophobicContact CE1-CG 4.48Å; F405-Q411 HydrophobicContact CB-CB 4.16Å; F405-Q411 HydrophobicContact CD2-CB 3.57Å; F405-Q411 HydrophobicContact CD2-CG 3.65Å; F405-Q411 HydrophobicContact CE2-CB 4.24Å; F405-Q411 HydrophobicContact CE2-CG 4.03Å; F405-Q411 HydrophobicContact CG-CB 4.04Å; F405-F414 HydrophobicContact CE1-CB 4.02Å; F405-F414 HydrophobicContact CE1-CD1 4.37Å; F405-F414 HydrophobicContact CE1-CD2 4.16Å; F405-F414 AromaticContact CE1-CG 3.93Å; F405-F414 HydrophobicContact CE1-CG 3.93Å; F405-F414 HydrophobicContact CE2-CB 4.42Å; F405-F414 AromaticContact CE2-CD1 3.94Å; F405-F414 HydrophobicContact CE2-CD1 3.94Å; F405-F414 HydrophobicContact CE2-CG 4.26Å; F405-F414 HydrophobicContact CZ-CB 3.75Å; F405-F414 AromaticContact CZ-CD1 3.4Å; F405-F414 HydrophobicContact CZ-CD1 3.4Å; F405-F414 AromaticContact CZ-CD2 3.91Å; F405-F414 HydrophobicContact CZ-CD2 3.91Å; F405-F414 AromaticContact CZ-CE1 3.9Å; F405-F414 HydrophobicContact CZ-CE1 3.9Å; F405-F414 HydrophobicContact CZ-CE2 4.37Å; F405-F414 AromaticContact CZ-CG 3.39Å; F405-F414 HydrophobicContact CZ-CG 3.39Å; F405-F414 HydrophobicContact CZ-CZ 4.35Å
406D84.9Confident78.9Confident170 Ų17091.1 Ų91.191%0.90947%0.473SS*.SBendtrans-67.5-11.9179.4-42.9-74.2000112.8
407S90.3Very high80.4Confident51 Ų5193.3 Ų93.336%0.35748%0.481SS..  trans-134.8127.8176-175.40000112.1F405 Q409 Q410 Q411F405-S407 PolarHBondContact O-N 3.37Å; F405-S407 VanDerWaalsContact O-N 3.1Å; S407-Q409 PolarHBondContact O-N 2.75Å; S407-Q409 PolarHBondContact OG-N 3.08Å; S407-Q410 WeakPolarHBondContact O-CA 3.42Å; S407-Q410 WeakPolarHBondContact O-CB 3.3Å; S407-Q410 PolarHBondContact O-N 2.89Å; S407-Q411 PolarHBondContact O-N 3.1Å
408S84.6Confident81.5Confident80 Ų8094 Ų9456%0.55948%0.483SS*.Hα-helixtrans-58.9-26.5169.459.80000112.7Q412S408-Q412 WeakPolarHBondContact O-CB 3.49Å; S408-Q412 VanDerWaalsContact O-CG 3.3Å; S408-Q412 WeakPolarHBondContact O-CG 3.39Å; S408-Q412 PolarHBondContact O-N 3.09Å
409Q88Confident82Confident114 Ų11494 Ų9453%0.53348%0.483SS..Hα-helixtrans-70.5-35.4173.1-160.4-160.276.300111.6S407 K413S407-Q409 PolarHBondContact O-N 2.75Å; S407-Q409 PolarHBondContact OG-N 3.08Å; Q409-K413 WeakPolarHBondContact O-CB 3.34Å; Q409-K413 WeakPolarHBondContact O-CD 3.35Å; Q409-K413 VanDerWaalsContact O-CG 3.24Å; Q409-K413 WeakPolarHBondContact O-CG 3.32Å; Q409-K413 PolarHBondContact O-N 3.07Å; Q409-K413 VanDerWaalsContact OE1-CE 3.31Å
410Q89.6Confident82Confident94 Ų9487.9 Ų87.944%0.43947%0.465SS..Hα-helixtrans-69.8-43.7173.9-175.7176-14.300110.7F405 S407 Q412 K413 F414F405-Q410 HydrophobicContact CD1-CG 3.83Å; F405-Q410 HydrophobicContact CE1-CG 4.48Å; S407-Q410 WeakPolarHBondContact O-CA 3.42Å; S407-Q410 WeakPolarHBondContact O-CB 3.3Å; S407-Q410 PolarHBondContact O-N 2.89Å; Q410-Q412 PolarHBondContact O-N 3.23Å; Q410-K413 WeakPolarHBondContact O-CB 3.49Å; Q410-K413 PolarHBondContact O-N 3.34Å; Q410-F414 WeakPolarHBondContact O-CB 3.18Å; Q410-F414 PolarHBondContact O-N 3.03Å
411Q87.9Confident81.9Confident68 Ų6887.4 Ų87.432%0.31847%0.466SS..Hα-helixtrans-55.6-47.5171.5-171.2-17737.700111.8F405 S407 K413 F414 L415F405-Q411 HydrophobicContact CB-CB 4.16Å; F405-Q411 HydrophobicContact CD2-CB 3.57Å; F405-Q411 HydrophobicContact CD2-CG 3.65Å; F405-Q411 HydrophobicContact CE2-CB 4.24Å; F405-Q411 HydrophobicContact CE2-CG 4.03Å; F405-Q411 HydrophobicContact CG-CB 4.04Å; S407-Q411 PolarHBondContact O-N 3.1Å; Q411-K413 PolarHBondContact O-N 2.78Å; Q411-F414 PolarHBondContact O-N 3.01Å; Q411-L415 HydrophobicContact CG-CD1 4.03Å; Q411-L415 HydrophobicContact CG-CG 4.47Å; Q411-L415 WeakPolarHBondContact O-CB 3.34Å; Q411-L415 WeakPolarHBondContact O-CG 3.41Å; Q411-L415 PolarHBondContact O-N 3.15Å
412Q83.9Confident82.3Confident108 Ų10892.2 Ų92.251%0.50548%0.481SS..Hα-helixtrans-67.5-32.7177.3-73.618018.400113.7S408 Q410 R416S408-Q412 WeakPolarHBondContact O-CB 3.49Å; S408-Q412 VanDerWaalsContact O-CG 3.3Å; S408-Q412 WeakPolarHBondContact O-CG 3.39Å; S408-Q412 PolarHBondContact O-N 3.09Å; Q410-Q412 PolarHBondContact O-N 3.23Å; Q412-R416 VanDerWaalsContact O-CB 3.28Å; Q412-R416 WeakPolarHBondContact O-CB 3.47Å; Q412-R416 PolarHBondContact O-N 2.97Å
413K89.2Confident82Confident124 Ų12495.5 Ų95.554%0.53949%0.486SS..Hα-helixtrans-66.5-45.8171.7-78.9163.7169.9170.10110.6Q409 Q410 Q411 R416 L417Q409-K413 WeakPolarHBondContact O-CB 3.34Å; Q409-K413 WeakPolarHBondContact O-CD 3.35Å; Q409-K413 VanDerWaalsContact O-CG 3.24Å; Q409-K413 WeakPolarHBondContact O-CG 3.32Å; Q409-K413 PolarHBondContact O-N 3.07Å; Q409-K413 VanDerWaalsContact OE1-CE 3.31Å; Q410-K413 WeakPolarHBondContact O-CB 3.49Å; Q410-K413 PolarHBondContact O-N 3.34Å; Q411-K413 PolarHBondContact O-N 2.78Å; K413-R416 PolarHBondContact O-N 2.92Å; K413-L417 WeakPolarHBondContact O-CB 3.18Å; K413-L417 PolarHBondContact O-N 3.44Å
414F88Confident81.1Confident50 Ų5097.5 Ų97.522%0.21951%0.509CS..Hα-helixtrans-63.3-52.4178.8179-94.8000112W400 F405 Q410 Q411 R416 L417 M418W400-F414 HydrophobicContact CB-CE1 4.18Å; W400-F414 HydrophobicContact CD2-CE1 4.09Å; W400-F414 HydrophobicContact CD2-CZ 4.31Å; W400-F414 AromaticContact CE3-CE1 3.59Å; W400-F414 HydrophobicContact CE3-CE1 3.59Å; W400-F414 AromaticContact CE3-CZ 3.5Å; W400-F414 HydrophobicContact CE3-CZ 3.5Å; W400-F414 HydrophobicContact CG-CE1 4.35Å; W400-F414 HydrophobicContact CZ3-CE1 4.35Å; W400-F414 AromaticContact CZ3-CZ 3.79Å; W400-F414 HydrophobicContact CZ3-CZ 3.79Å; F405-F414 HydrophobicContact CE1-CB 4.02Å; F405-F414 HydrophobicContact CE1-CD1 4.37Å; F405-F414 HydrophobicContact CE1-CD2 4.16Å; F405-F414 AromaticContact CE1-CG 3.93Å; F405-F414 HydrophobicContact CE1-CG 3.93Å; F405-F414 HydrophobicContact CE2-CB 4.42Å; F405-F414 AromaticContact CE2-CD1 3.94Å; F405-F414 HydrophobicContact CE2-CD1 3.94Å; F405-F414 HydrophobicContact CE2-CG 4.26Å; F405-F414 HydrophobicContact CZ-CB 3.75Å; F405-F414 AromaticContact CZ-CD1 3.4Å; F405-F414 HydrophobicContact CZ-CD1 3.4Å; F405-F414 AromaticContact CZ-CD2 3.91Å; F405-F414 HydrophobicContact CZ-CD2 3.91Å; F405-F414 AromaticContact CZ-CE1 3.9Å; F405-F414 HydrophobicContact CZ-CE1 3.9Å; F405-F414 HydrophobicContact CZ-CE2 4.37Å; F405-F414 AromaticContact CZ-CG 3.39Å; F405-F414 HydrophobicContact CZ-CG 3.39Å; F405-F414 HydrophobicContact CZ-CZ 4.35Å; Q410-F414 WeakPolarHBondContact O-CB 3.18Å; Q410-F414 PolarHBondContact O-N 3.03Å; Q411-F414 PolarHBondContact O-N 3.01Å; F414-R416 PolarHBondContact O-N 2.99Å; F414-L417 WeakPolarHBondContact O-CB 3.47Å; F414-L417 PolarHBondContact O-N 2.83Å; F414-M418 HydrophobicContact CD1-CG 4.16Å; F414-M418 HydrophobicContact CD2-CG 4.27Å; F414-M418 HydrophobicContact CE1-CG 3.78Å; F414-M418 HydrophobicContact CE2-CG 3.89Å; F414-M418 HydrophobicContact CE2-SD 4.31Å; F414-M418 HydrophobicContact CG-CG 4.4Å; F414-M418 HydrophobicContact CZ-CG 3.63Å; F414-M418 HydrophobicContact CZ-SD 4.38Å; F414-M418 WeakPolarHBondContact O-CG 3.42Å; F414-M418 PolarHBondContact O-N 3.42Å
415L84.8Confident79.6Confident19 Ų1995.9 Ų95.910%0.09950%0.5CS..Hα-helixtrans-61.4-27.8177.1-67.2173.9000112.3L397 W400 Q411 G420 F421L397-L415 HydrophobicContact CD2-CD1 4.36Å; L397-L415 HydrophobicContact CD2-CD2 4.28Å; W400-L415 HydrophobicContact CB-CD2 3.71Å; Q411-L415 HydrophobicContact CG-CD1 4.03Å; Q411-L415 HydrophobicContact CG-CG 4.47Å; Q411-L415 WeakPolarHBondContact O-CB 3.34Å; Q411-L415 WeakPolarHBondContact O-CG 3.41Å; Q411-L415 PolarHBondContact O-N 3.15Å; L415-G420 CarbonylContact O-C 3.48Å; L415-G420 WeakPolarHBondContact O-CA 3.32Å; L415-G420 PolarHBondContact O-N 2.76Å; L415-F421 HydrophobicContact CB-CB 4.04Å; L415-F421 PolarHBondContact O-N 2.83Å
416R86.6Confident78.3Confident111 Ų111101.3 Ų101.342%0.41953%0.526SS..Hα-helixtrans-75-40171.3-173.1173.9-56.8140.516.1112.8Q412 K413 F414 G419Q412-R416 VanDerWaalsContact O-CB 3.28Å; Q412-R416 WeakPolarHBondContact O-CB 3.47Å; Q412-R416 PolarHBondContact O-N 2.97Å; K413-R416 PolarHBondContact O-N 2.92Å; F414-R416 PolarHBondContact O-N 2.99Å; R416-G419 PolarHBondContact O-N 3.12Å
417L89.2Confident76.5Confident144 Ų14499.2 Ų99.275%0.75452%0.521SS*.Hα-helixtrans-64.8-43.5177.3-177.863000111.3K413 F414 G419K413-L417 WeakPolarHBondContact O-CB 3.18Å; K413-L417 PolarHBondContact O-N 3.44Å; F414-L417 WeakPolarHBondContact O-CB 3.47Å; F414-L417 PolarHBondContact O-N 2.83Å; L417-G419 PolarHBondContact O-N 2.84Å; L417-G419 VanDerWaalsContact O-N 3.14Å
418M83.6Confident74.3Confident86 Ų86100.9 Ų100.942%0.42454%0.538SS..THydrogen-bonded Turntrans-76.313.2174.3-56.8-49.6-66.400113.5W400 F414 G420W400-M418 HydrophobicContact CH2-CE 3.74Å; W400-M418 HydrophobicContact CZ2-CE 3.58Å; W400-M418 HydrophobicContact CZ3-CE 4.41Å; F414-M418 HydrophobicContact CD1-CG 4.16Å; F414-M418 HydrophobicContact CD2-CG 4.27Å; F414-M418 HydrophobicContact CE1-CG 3.78Å; F414-M418 HydrophobicContact CE2-CG 3.89Å; F414-M418 HydrophobicContact CE2-SD 4.31Å; F414-M418 HydrophobicContact CG-CG 4.4Å; F414-M418 HydrophobicContact CZ-CG 3.63Å; F414-M418 HydrophobicContact CZ-SD 4.38Å; F414-M418 WeakPolarHBondContact O-CG 3.42Å; F414-M418 PolarHBondContact O-N 3.42Å; M418-G420 PolarHBondContact O-N 3.16Å
419G78.9Confident72.3Confident47 Ų47100.5 Ų100.549%0.48555%0.547SS..THydrogen-bonded Turntrans74.4-12.9175.800000116.7R416 L417 F421R416-G419 PolarHBondContact O-N 3.12Å; L417-G419 PolarHBondContact O-N 2.84Å; L417-G419 VanDerWaalsContact O-N 3.14Å; G419-F421 PolarHBondContact O-N 2.59Å
420G72.4Confident70.3Confident39 Ų3999.8 Ų99.840%0.40256%0.561SS.*SBendtrans-66.2-24.2-17700000116L415 M418L415-G420 CarbonylContact O-C 3.48Å; L415-G420 WeakPolarHBondContact O-CA 3.32Å; L415-G420 PolarHBondContact O-N 2.76Å; M418-G420 PolarHBondContact O-N 3.16Å
421F66.1Low68.1Low100 Ų10099.3 Ų99.344%0.43957%0.573SS.*  trans-128.576.8-178.1-127.1-86.9000114.3L397 L415 G419 K423L397-F421 HydrophobicContact CD2-CD2 3.84Å; L397-F421 HydrophobicContact CD2-CE2 4.33Å; L415-F421 HydrophobicContact CB-CB 4.04Å; L415-F421 PolarHBondContact O-N 2.83Å; G419-F421 PolarHBondContact O-N 2.59Å; F421-K423 PolarHBondContact O-N 3.15Å
422K72Confident66.2Low146 Ų146101.5 Ų101.564%0.63560%0.602SS**  trans-64.4113.8168.9-72.7178.2-179.5174.80110.1G424 F425K422-G424 PolarHBondContact O-N 3.17Å; K422-F425 HydrophobicContact CB-CD2 3.73Å; K422-F425 HydrophobicContact CB-CE2 3.95Å; K422-F425 HydrophobicContact CD-CE2 4.05Å; K422-F425 PolarHBondContact O-N 3.01Å; K422-F425 VanDerWaalsContact O-N 3.16Å
423K64.3Low64.7Low182 Ų18299.4 Ų99.479%0.79161%0.61SS**THydrogen-bonded Turntrans-65.595.3-178.7-171.8-172179.9-170.20110.4F421F421-K423 PolarHBondContact O-N 3.15Å
424G54.5Low62.8Low74 Ų7496.1 Ų96.176%0.76361%0.611SS**THydrogen-bonded Turntrans154-24.9-172.700000112.3K422 Q426K422-G424 PolarHBondContact O-N 3.17Å; G424-Q426 PolarHBondContact O-N 2.88Å
425F49.8Very low61.1Low155 Ų15599.1 Ų99.168%0.6865%0.645SS**  trans-72.296.3164.5-74.1-101.2000109.3K422K422-F425 HydrophobicContact CB-CD2 3.73Å; K422-F425 HydrophobicContact CB-CE2 3.95Å; K422-F425 HydrophobicContact CD-CE2 4.05Å; K422-F425 PolarHBondContact O-N 3.01Å; K422-F425 VanDerWaalsContact O-N 3.16Å
426Q54.8Low59.7Low166 Ų166104.7 Ų104.778%0.77668%0.675SS**  trans-58.6147.5134.9-66.1-172.7-69.400107.3G424 A428G424-Q426 PolarHBondContact O-N 2.88Å; Q426-A428 PolarHBondContact O-N 3.41Å
427P48.8Very low58.8Low125 Ų125108.6 Ų108.681%0.81270%0.7SS**  trans-58.3113.7156.627.3-31.2000106.2G429P427-G429 VanDerWaalsContact C-N 3.29Å; P427-G429 PolarHBondContact O-N 3.31Å
428A42.4Very low58.1Low86 Ų86105.5 Ų105.571%0.71170%0.696SS**  trans-65.495.9175.500000107Q426 A430Q426-A428 PolarHBondContact O-N 3.41Å; A428-A430 PolarHBondContact O-N 2.94Å
429G44Very low58.2Low73 Ų73106.2 Ų106.275%0.75370%0.701SS**THydrogen-bonded Turntrans-51.2110-16400000110.8P427 A431P427-G429 VanDerWaalsContact C-N 3.29Å; P427-G429 PolarHBondContact O-N 3.31Å; G429-A431 VanDerWaalsContact C-N 3.32Å; G429-A431 PolarHBondContact O-N 3.44Å
430A45Very low58.7Low99 Ų99106.3 Ų106.382%0.81870%0.702SS**THydrogen-bonded Turntrans-8.280.6-16100000114.6A428 A432A428-A430 PolarHBondContact O-N 2.94Å; A430-A432 PolarHBondContact O-N 2.94Å
431A43.2Very low59.7Low83 Ų83112.3 Ų112.369%0.68672%0.717SS**  trans-58.5113.4173.600000107.7G429 G433G429-A431 VanDerWaalsContact C-N 3.32Å; G429-A431 PolarHBondContact O-N 3.44Å; A431-G433 VanDerWaalsContact C-N 3.33Å; A431-G433 PolarHBondContact O-N 2.83Å
432A48Very low60.9Low114 Ų114113.7 Ų113.794%0.94273%0.729SS**SBendtrans-65.290.2-165.700000111.4A430A430-A432 PolarHBondContact O-N 2.94Å
433G52.4Low61.9Low64 Ų64108.6 Ų108.666%0.6671%0.714SS**  trans-176.252.3-165.800000109.4A431A431-G433 VanDerWaalsContact C-N 3.33Å; A431-G433 PolarHBondContact O-N 2.83Å
434G49.4Very low63.3Low55 Ų55104.2 Ų104.257%0.56770%0.696SS**  trans-65.8152-169.300000114.4N436G434-N436 PolarHBondContact O-N 3.01Å; G434-N436 PolarHBondContact O-ND2 2.88Å
435A53.3Low65.2Low113 Ų113106.5 Ų106.593%0.93469%0.687SS**SBendtrans53.68.8157.800000119.3
436N54.7Low67.4Low137 Ų137105.8 Ų105.873%0.73369%0.686SS**  trans-101.9107.4-179.9-77.1-87.4000110.6G434 A438G434-N436 PolarHBondContact O-N 3.01Å; G434-N436 PolarHBondContact O-ND2 2.88Å; N436-A438 PolarHBondContact O-N 2.83Å; N436-A438 VanDerWaalsContact O-N 3.16Å
437M67.4Low69.3Low192 Ų192102 Ų10295%0.94667%0.671SS**  trans-69-4.6178.5-72.8-110.859.300114.3
438A74.9Confident71.6Confident79 Ų79101.1 Ų101.165%0.65366%0.656SS**SBendtrans-84.1139.2176.600000111.5N436 G440N436-A438 PolarHBondContact O-N 2.83Å; N436-A438 VanDerWaalsContact O-N 3.16Å; A438-G440 PolarHBondContact O-N 3.26Å
439L85.2Confident74.1Confident101 Ų101104.1 Ų104.153%0.52966%0.655SS.*PPolyproline II helixtrans-57.8131.7167.6-71.9156.4000109.7A443 Q444 L447L439-A443 HydrophobicContact CB-CB 4.35Å; L439-A443 HydrophobicContact CD2-CB 4.02Å; L439-Q444 HydrophobicContact CB-CB 4.39Å; L439-L447 HydrophobicContact CD1-CD2 3.55Å
440G91Very high76.6Confident50 Ų50102.2 Ų102.252%0.51564%0.635SS.*PPolyproline II helixtrans-58.8153.7171.200000111.4A438 D442 A443 Q444A438-G440 PolarHBondContact O-N 3.26Å; G440-D442 VanDerWaalsContact C-N 3.25Å; G440-D442 PolarHBondContact O-N 2.94Å; G440-D442 VanDerWaalsContact O-N 3.07Å; G440-A443 CarbonylContact O-C 3.58Å; G440-A443 WeakPolarHBondContact O-CA 3.32Å; G440-A443 WeakPolarHBondContact O-CB 3.37Å; G440-A443 PolarHBondContact O-N 3.3Å; G440-Q444 PolarHBondContact O-N 2.86Å
441K92.4Very high79.1Confident165 Ų165102 Ų10272%0.71762%0.62SS**Hα-helixtrans-48-44.5-170.3-66.7-178.5179.7178.80113.6Q444 Q445K441-Q444 WeakPolarHBondContact O-CB 3.46Å; K441-Q444 PolarHBondContact O-N 2.94Å; K441-Q445 WeakPolarHBondContact O-CG 3.27Å; K441-Q445 PolarHBondContact O-N 2.87Å
442D92.3Very high81.7Confident128 Ų128102.7 Ų102.768%0.68461%0.612SS**Hα-helixtrans-70.5-38.2-177.2-43-32.8000111.5G440 Q445 Q446G440-D442 VanDerWaalsContact C-N 3.25Å; G440-D442 PolarHBondContact O-N 2.94Å; G440-D442 VanDerWaalsContact O-N 3.07Å; D442-Q445 PolarHBondContact O-N 3.44Å; D442-Q446 WeakPolarHBondContact O-CB 3.46Å; D442-Q446 PolarHBondContact O-N 3.32Å
443A91.8Very high84Confident39 Ų3998.5 Ų98.532%0.32258%0.579SS.*Hα-helixtrans-70.4-32.9173.800000112.1L439 G440 L447L439-A443 HydrophobicContact CB-CB 4.35Å; L439-A443 HydrophobicContact CD2-CB 4.02Å; G440-A443 CarbonylContact O-C 3.58Å; G440-A443 WeakPolarHBondContact O-CA 3.32Å; G440-A443 WeakPolarHBondContact O-CB 3.37Å; G440-A443 PolarHBondContact O-N 3.3Å; A443-L447 VanDerWaalsContact O-CB 3.32Å; A443-L447 WeakPolarHBondContact O-CB 3.38Å; A443-L447 PolarHBondContact O-N 3.07Å
444Q94Very high86Confident90 Ų90101.6 Ų101.642%0.42158%0.576SS.*Hα-helixtrans-65.8-45170.5-179.4-175.3-12.600111.1L439 G440 K441 L447 Q448L439-Q444 HydrophobicContact CB-CB 4.39Å; G440-Q444 PolarHBondContact O-N 2.86Å; K441-Q444 WeakPolarHBondContact O-CB 3.46Å; K441-Q444 PolarHBondContact O-N 2.94Å; Q444-L447 PolarHBondContact O-N 2.87Å; Q444-Q448 WeakPolarHBondContact O-CB 3.31Å; Q444-Q448 VanDerWaalsContact O-CG 3.31Å; Q444-Q448 WeakPolarHBondContact O-CG 3.47Å; Q444-Q448 PolarHBondContact O-N 2.91Å
445Q94.9Very high88.1Confident122 Ų122105.4 Ų105.457%0.5758%0.578SS**Hα-helixtrans-63-44.1175.8-74.31787.500111.5K441 D442 L447 Q448 Q449K441-Q445 WeakPolarHBondContact O-CG 3.27Å; K441-Q445 PolarHBondContact O-N 2.87Å; D442-Q445 PolarHBondContact O-N 3.44Å; Q445-L447 VanDerWaalsContact C-N 3.33Å; Q445-L447 PolarHBondContact O-N 2.87Å; Q445-Q448 PolarHBondContact O-N 3.38Å; Q445-Q449 WeakPolarHBondContact O-CB 3.23Å; Q445-Q449 PolarHBondContact O-N 3.03Å
446Q95.6Very high90Very high140 Ų140105.3 Ų105.365%0.65456%0.558SS**Hα-helixtrans-61.4-40.2175.4-169.6-1792400111.8D442 G450D442-Q446 WeakPolarHBondContact O-CB 3.46Å; D442-Q446 PolarHBondContact O-N 3.32Å; Q446-G450 PolarHBondContact O-N 3.28Å
447L95.3Very high91.8Very high87 Ų87106.5 Ų106.546%0.45555%0.552SS.*Hα-helixtrans-64.6-44.9173.6177.560.7000111.6L439 A443 Q444 Q445 G450 L451L439-L447 HydrophobicContact CD1-CD2 3.55Å; A443-L447 VanDerWaalsContact O-CB 3.32Å; A443-L447 WeakPolarHBondContact O-CB 3.38Å; A443-L447 PolarHBondContact O-N 3.07Å; Q444-L447 PolarHBondContact O-N 2.87Å; Q445-L447 VanDerWaalsContact C-N 3.33Å; Q445-L447 PolarHBondContact O-N 2.87Å; L447-G450 PolarHBondContact O-N 2.91Å; L447-L451 HydrophobicContact CD1-CD1 4.08Å; L447-L451 HydrophobicContact CD1-CG 4.09Å; L447-L451 HydrophobicContact CG-CD1 3.97Å; L447-L451 HydrophobicContact CG-CG 4.43Å; L447-L451 WeakPolarHBondContact O-CB 3.45Å; L447-L451 VanDerWaalsContact O-CG 3.27Å; L447-L451 WeakPolarHBondContact O-CG 3.39Å; L447-L451 PolarHBondContact O-N 3.39Å
448Q95.8Very high92.8Very high106 Ų10699.7 Ų99.750%0.49553%0.526SS..Hα-helixtrans-62.5-43.8177.9-74.8173.2-21.400111.8Q444 Q445 L451 L452Q444-Q448 WeakPolarHBondContact O-CB 3.31Å; Q444-Q448 VanDerWaalsContact O-CG 3.31Å; Q444-Q448 WeakPolarHBondContact O-CG 3.47Å; Q444-Q448 PolarHBondContact O-N 2.91Å; Q445-Q448 PolarHBondContact O-N 3.38Å; Q448-L451 PolarHBondContact O-N 3.21Å; Q448-L452 WeakPolarHBondContact O-CB 3.49Å; Q448-L452 PolarHBondContact O-N 2.94Å
449Q96.4Very high93.4Very high149 Ų149100.2 Ų100.270%0.69652%0.515SS*.Hα-helixtrans-62.3-43173.5-171.2-175.941.100111.6Q445 L451 L452 G453Q445-Q449 WeakPolarHBondContact O-CB 3.23Å; Q445-Q449 PolarHBondContact O-N 3.03Å; Q449-L451 VanDerWaalsContact C-N 3.34Å; Q449-L451 PolarHBondContact O-N 3.24Å; Q449-L452 PolarHBondContact O-N 3.12Å; Q449-G453 PolarHBondContact O-N 2.94Å
450G96.8Very high93.4Very high33 Ų3398 Ų9834%0.3451%0.511SS..Hα-helixtrans-66.6-32177.200000113.8Q446 L447 Q454Q446-G450 PolarHBondContact O-N 3.28Å; L447-G450 PolarHBondContact O-N 2.91Å; G450-Q454 WeakPolarHBondContact O-CB 3.34Å; G450-Q454 VanDerWaalsContact O-CG 3.24Å; G450-Q454 WeakPolarHBondContact O-CG 3.39Å; G450-Q454 PolarHBondContact O-N 3.12Å; G450-Q454 PolarHBondContact O-NE2 3.23Å
451L97Very high92.9Very high95 Ų95103.7 Ų103.750%0.49752%0.517SS..Hα-helixtrans-73.5-42.4173-73.6169.4000111.4L447 Q448 Q449 Q454 F455L447-L451 HydrophobicContact CD1-CD1 4.08Å; L447-L451 HydrophobicContact CD1-CG 4.09Å; L447-L451 HydrophobicContact CG-CD1 3.97Å; L447-L451 HydrophobicContact CG-CG 4.43Å; L447-L451 WeakPolarHBondContact O-CB 3.45Å; L447-L451 VanDerWaalsContact O-CG 3.27Å; L447-L451 WeakPolarHBondContact O-CG 3.39Å; L447-L451 PolarHBondContact O-N 3.39Å; Q448-L451 PolarHBondContact O-N 3.21Å; Q449-L451 VanDerWaalsContact C-N 3.34Å; Q449-L451 PolarHBondContact O-N 3.24Å; L451-Q454 PolarHBondContact O-N 3.12Å; L451-F455 WeakPolarHBondContact O-CB 3.41Å; L451-F455 PolarHBondContact O-N 3.2Å
452L96.6Very high92.2Very high98 Ų98102.2 Ų102.251%0.51351%0.51SS..Hα-helixtrans-62.4-49.7176.7-175.862.2000111.4Q448 Q449 Q454 F455 E456Q448-L452 WeakPolarHBondContact O-CB 3.49Å; Q448-L452 PolarHBondContact O-N 2.94Å; Q449-L452 PolarHBondContact O-N 3.12Å; L452-Q454 PolarHBondContact O-N 3.06Å; L452-F455 WeakPolarHBondContact O-CB 3.46Å; L452-F455 PolarHBondContact O-N 3.23Å; L452-E456 WeakPolarHBondContact O-CG 3.45Å; L452-E456 PolarHBondContact O-N 3.49Å
453G96.2Very high91Very high25 Ų25102 Ų10226%0.25851%0.507SS..Hα-helixtrans-68.4-13.1176.100000114.8Q449 R457Q449-G453 PolarHBondContact O-N 2.94Å; G453-R457 VanDerWaalsContact O-CB 3.29Å; G453-R457 WeakPolarHBondContact O-CB 3.41Å
454Q94.6Very high89.9Confident129 Ų129102.9 Ų102.960%0.60351%0.506SS*.Hα-helixtrans-85.2-41166.1-82.6176.477.100111.8G450 L451 L452 R457 A458G450-Q454 WeakPolarHBondContact O-CB 3.34Å; G450-Q454 VanDerWaalsContact O-CG 3.24Å; G450-Q454 WeakPolarHBondContact O-CG 3.39Å; G450-Q454 PolarHBondContact O-N 3.12Å; G450-Q454 PolarHBondContact O-NE2 3.23Å; L451-Q454 PolarHBondContact O-N 3.12Å; L452-Q454 PolarHBondContact O-N 3.06Å; Q454-R457 PolarHBondContact O-N 2.85Å; Q454-A458 WeakPolarHBondContact O-CB 3.24Å; Q454-A458 PolarHBondContact O-N 3.36Å
455F95Very high88.4Confident136 Ų136104.1 Ų104.160%0.59651%0.51SS*.Hα-helixtrans-60.1-49.4174.9172.9-95.8000111.3L451 L452 R457 A458 H459L451-F455 WeakPolarHBondContact O-CB 3.41Å; L451-F455 PolarHBondContact O-N 3.2Å; L452-F455 WeakPolarHBondContact O-CB 3.46Å; L452-F455 PolarHBondContact O-N 3.23Å; F455-R457 VanDerWaalsContact C-N 3.34Å; F455-R457 PolarHBondContact O-N 2.94Å; F455-A458 CarbonylContact O-C 3.6Å; F455-A458 PolarHBondContact O-N 3.37Å; F455-H459 WeakPolarHBondContact O-CB 3.47Å; F455-H459 PolarHBondContact O-N 3.22Å
456E93.3Very high87Confident111 Ų111102.9 Ų102.952%0.51952%0.516SS..Hα-helixtrans-57.6-45.4175.6-70.3168.8177.100111.7L452 A458 H459 A460L452-E456 WeakPolarHBondContact O-CG 3.45Å; L452-E456 PolarHBondContact O-N 3.49Å; E456-A458 VanDerWaalsContact C-N 3.34Å; E456-A458 PolarHBondContact O-N 2.85Å; E456-H459 PolarHBondContact O-N 3.34Å; E456-A460 WeakPolarHBondContact O-CB 3.43Å; E456-A460 PolarHBondContact O-N 2.89Å
457R91.3Very high85.5Confident162 Ų162102.4 Ų102.461%0.61152%0.517SS*.Hα-helixtrans-66.3-34.2178.3-170.8-176.1-53.3-108.1-4.6112.7G453 Q454 F455 R461G453-R457 VanDerWaalsContact O-CB 3.29Å; G453-R457 WeakPolarHBondContact O-CB 3.41Å; Q454-R457 PolarHBondContact O-N 2.85Å; F455-R457 VanDerWaalsContact C-N 3.34Å; F455-R457 PolarHBondContact O-N 2.94Å; R457-R461 WeakPolarHBondContact O-CD 3.29Å; R457-R461 VanDerWaalsContact O-CG 3.27Å; R457-R461 WeakPolarHBondContact O-CG 3.46Å; R457-R461 PolarHBondContact O-N 3.18Å
458A89.1Confident84.2Confident49 Ų49105.1 Ų105.141%0.40552%0.521SS..Hα-helixtrans-71.9-40.3171.900000111.2Q454 F455 E456 R461 K462Q454-A458 WeakPolarHBondContact O-CB 3.24Å; Q454-A458 PolarHBondContact O-N 3.36Å; F455-A458 CarbonylContact O-C 3.6Å; F455-A458 PolarHBondContact O-N 3.37Å; E456-A458 VanDerWaalsContact C-N 3.34Å; E456-A458 PolarHBondContact O-N 2.85Å; A458-R461 WeakPolarHBondContact O-CB 3.27Å; A458-R461 PolarHBondContact O-N 3.13Å; A458-K462 WeakPolarHBondContact O-CG 3.4Å; A458-K462 PolarHBondContact O-N 3.3Å
459H87.5Confident82.5Confident90 Ų90101.2 Ų101.242%0.41751%0.51SS..Hα-helixtrans-64.8-45.3178.5-168.2-97.4000111.8F455 E456 R461 K462 M463F455-H459 WeakPolarHBondContact O-CB 3.47Å; F455-H459 PolarHBondContact O-N 3.22Å; E456-H459 PolarHBondContact O-N 3.34Å; H459-R461 VanDerWaalsContact C-N 3.32Å; H459-R461 PolarHBondContact O-N 3.08Å; H459-K462 WeakPolarHBondContact O-CA 3.44Å; H459-K462 WeakPolarHBondContact O-CB 3.05Å; H459-K462 PolarHBondContact O-N 3.49Å; H459-M463 VanDerWaalsContact CE1-CE 3.43Å; H459-M463 WeakPolarHBondContact CE1-CE 3.41Å; H459-M463 PolarHBondContact O-N 2.84Å
460A84Confident80.9Confident53 Ų5398.9 Ų98.944%0.43852%0.516SS..Hα-helixtrans-55.9-46.3171.500000111.4E456 K462 M463 D464E456-A460 WeakPolarHBondContact O-CB 3.43Å; E456-A460 PolarHBondContact O-N 2.89Å; A460-K462 PolarHBondContact O-N 3.05Å; A460-M463 PolarHBondContact O-N 2.93Å; A460-D464 PolarHBondContact O-N 3.4Å
461R80.9Confident79.2Confident170 Ų170100.5 Ų100.564%0.64253%0.533SS*.Hα-helixtrans-62.6-25.7174.6-74.9171.9174.8-173.4-2.6114.2R457 A458 H459R457-R461 WeakPolarHBondContact O-CD 3.29Å; R457-R461 VanDerWaalsContact O-CG 3.27Å; R457-R461 WeakPolarHBondContact O-CG 3.46Å; R457-R461 PolarHBondContact O-N 3.18Å; A458-R461 WeakPolarHBondContact O-CB 3.27Å; A458-R461 PolarHBondContact O-N 3.13Å; H459-R461 VanDerWaalsContact C-N 3.32Å; H459-R461 PolarHBondContact O-N 3.08Å
462K78.4Confident77.8Confident134 Ų134102.3 Ų102.358%0.58354%0.542SS*.Hα-helixtrans-78.5-27.9173.2-69.6-179.373-179.70112.6A458 H459 A460 F465A458-K462 WeakPolarHBondContact O-CG 3.4Å; A458-K462 PolarHBondContact O-N 3.3Å; H459-K462 WeakPolarHBondContact O-CA 3.44Å; H459-K462 WeakPolarHBondContact O-CB 3.05Å; H459-K462 PolarHBondContact O-N 3.49Å; A460-K462 PolarHBondContact O-N 3.05Å; K462-F465 HydrophobicContact CB-CD2 4.21Å; K462-F465 HydrophobicContact CB-CE2 3.89Å; K462-F465 HydrophobicContact CB-CZ 4.48Å; K462-F465 HydrophobicContact CG-CE2 3.75Å; K462-F465 HydrophobicContact CG-CZ 4.03Å; K462-F465 WeakPolarHBondContact O-CD2 3.48Å; K462-F465 WeakPolarHBondContact O-CG 3.46Å
463M67.6Low76.4Confident124 Ų124101.2 Ų101.261%0.61155%0.554SS**Hα-helixtrans-78.5-31.6171.3-61.1-56175.700111.9H459 A460 F465 S466H459-M463 VanDerWaalsContact CE1-CE 3.43Å; H459-M463 WeakPolarHBondContact CE1-CE 3.41Å; H459-M463 PolarHBondContact O-N 2.84Å; A460-M463 PolarHBondContact O-N 2.93Å; M463-F465 PolarHBondContact O-N 3.29Å; M463-F465 VanDerWaalsContact O-N 3.13Å; M463-S466 PolarHBondContact O-OG 3.45Å
464D67.1Low74.9Confident57 Ų57107.5 Ų107.531%0.30558%0.575SS.*G310 helixtrans-61.9-11.4171.2-87.76.6000114.5A460 S466 N467 R468A460-D464 PolarHBondContact O-N 3.4Å; D464-S466 PolarHBondContact O-N 3.26Å; D464-N467 PolarHBondContact O-N 3.19Å; D464-R468 PolarHBondContact O-N 3.41Å; D464-R468 IonicContact OD2-CZ 2.8Å; D464-R468 IonicContact OD2-NH1 3.15Å; D464-R468 PolarHBondContact OD2-NH1 3.2Å
465F63.3Low73.7Confident116 Ų116105.4 Ų105.451%0.50957%0.571SS.*G310 helixtrans-59.5-17.5-178.8-74.1-32.1000114.3K462 M463 N467K462-F465 HydrophobicContact CB-CD2 4.21Å; K462-F465 HydrophobicContact CB-CE2 3.89Å; K462-F465 HydrophobicContact CB-CZ 4.48Å; K462-F465 HydrophobicContact CG-CE2 3.75Å; K462-F465 HydrophobicContact CG-CZ 4.03Å; K462-F465 WeakPolarHBondContact O-CD2 3.48Å; K462-F465 WeakPolarHBondContact O-CG 3.46Å; M463-F465 PolarHBondContact O-N 3.29Å; M463-F465 VanDerWaalsContact O-N 3.13Å; F465-N467 VanDerWaalsContact C-N 3.34Å
466S65.7Low72.3Confident97 Ų97102 Ų10268%0.67857%0.568SS**G310 helixtrans-68-31170.651.30000113.3M463 D464M463-S466 PolarHBondContact O-OG 3.45Å; D464-S466 PolarHBondContact O-N 3.26Å
467N64.9Low71Confident129 Ų129100.6 Ų100.669%0.6957%0.568SS**THydrogen-bonded Turntrans-115-16.9-172.2-67.8-56.1000113.7D464 F465D464-N467 PolarHBondContact O-N 3.19Å; F465-N467 VanDerWaalsContact C-N 3.34Å
468R66.6Low69.9Low144 Ų14497.2 Ų97.254%0.54357%0.569SS.*SBendtrans-118.2126.6173.5-76.1177.3168.4124.50.8110.2D464D464-R468 PolarHBondContact O-N 3.41Å; D464-R468 IonicContact OD2-CZ 2.8Å; D464-R468 IonicContact OD2-NH1 3.15Å; D464-R468 PolarHBondContact OD2-NH1 3.2Å
469G61.2Low68.8Low25 Ų25102.5 Ų102.526%0.25859%0.591SS.*  trans-56148-177.500000112.7G471 F474G469-G471 PolarHBondContact O-N 2.84Å; G469-F474 WeakPolarHBondContact CA-O 3.32Å; G469-F474 PolarHBondContact N-O 2.78Å
470A61.7Low68.3Low100 Ų100105.9 Ų105.983%0.82661%0.605SS**SBendtrans-53.1111.4-164.600000114L472A470-L472 PolarHBondContact O-N 3.01Å; A470-L472 VanDerWaalsContact O-N 3.12Å
471G61.6Low68.1Low67 Ų67113.1 Ų113.169%0.69163%0.626SS**SBendtrans78.6-12.3154.200000119.2G469G469-G471 PolarHBondContact O-N 2.84Å
472L67.1Low67.6Low133 Ų133112.8 Ų112.870%0.69663%0.629SS**SBendtrans-131.422.3-169.6-15367.3000115.8A470 F474A470-L472 PolarHBondContact O-N 3.01Å; A470-L472 VanDerWaalsContact O-N 3.12Å; L472-F474 HydrophobicContact CB-CD2 4.13Å; L472-F474 HydrophobicContact CD2-CD2 4.21Å; L472-F474 HydrophobicContact CD2-CE2 4Å; L472-F474 HydrophobicContact CG-CD2 4.21Å; L472-F474 HydrophobicContact CG-CE2 4.18Å; L472-F474 VanDerWaalsContact O-CD2 3.23Å; L472-F474 WeakPolarHBondContact O-CD2 3.42Å; L472-F474 PolarHBondContact O-N 3.07Å
473G68.1Low67.5Low74 Ų74111.9 Ų111.976%0.76364%0.64SS**SBendtrans73.7-15.9174.400000115.6T475G473-T475 PolarHBondContact O-N 2.98Å; G473-T475 VanDerWaalsContact O-N 3.12Å
474F63.3Low68.1Low158 Ų158113.2 Ų113.269%0.69365%0.648SS**  trans-69.3101.4168.4-62.1-76.5000110.4G469 L472 A476G469-F474 WeakPolarHBondContact CA-O 3.32Å; G469-F474 PolarHBondContact N-O 2.78Å; L472-F474 HydrophobicContact CB-CD2 4.13Å; L472-F474 HydrophobicContact CD2-CD2 4.21Å; L472-F474 HydrophobicContact CD2-CE2 4Å; L472-F474 HydrophobicContact CG-CD2 4.21Å; L472-F474 HydrophobicContact CG-CE2 4.18Å; L472-F474 VanDerWaalsContact O-CD2 3.23Å; L472-F474 WeakPolarHBondContact O-CD2 3.42Å; L472-F474 PolarHBondContact O-N 3.07Å; F474-A476 PolarHBondContact O-N 2.88Å
475T69.8Low68.7Low85 Ų85114.9 Ų114.952%0.52166%0.657SS.*PPolyproline II helixtrans-55.6126.6161.3-49.80000108.1G473G473-T475 PolarHBondContact O-N 2.98Å; G473-T475 VanDerWaalsContact O-N 3.12Å
476A66.9Low69.3Low63 Ų63116.7 Ų116.752%0.52167%0.671SS.*PPolyproline II helixtrans-58.9132.2176.300000109.1F474 S478F474-A476 PolarHBondContact O-N 2.88Å; A476-S478 PolarHBondContact O-N 3.37Å; A476-S478 VanDerWaalsContact O-N 3.16Å
477P64.4Low69.9Low82 Ų82119 Ų11953%0.53268%0.675SS.*PPolyproline II helixtrans-53.6124.2177.6-28.836.4000110.8N479 F482P477-N479 VanDerWaalsContact C-N 3.26Å; P477-N479 PolarHBondContact O-N 3.21Å; P477-F482 HydrophobicContact CB-CD2 4.32Å; P477-F482 HydrophobicContact CB-CE2 3.77Å; P477-F482 HydrophobicContact CG-CD2 4.38Å; P477-F482 HydrophobicContact CG-CE2 3.85Å
478S68.4Low70.4Confident91 Ų91115.7 Ų115.764%0.63667%0.666SS**  trans-70.778.2-171.8440000111.8A476 K480A476-S478 PolarHBondContact O-N 3.37Å; A476-S478 VanDerWaalsContact O-N 3.16Å; S478-K480 PolarHBondContact O-N 2.74Å
479N67.1Low70.8Confident161 Ų161113 Ų11386%0.86167%0.669SS**SBendtrans51.56.2178.147.2-73.6000116.4P477 K481P477-N479 VanDerWaalsContact C-N 3.26Å; P477-N479 PolarHBondContact O-N 3.21Å; N479-K481 PolarHBondContact O-N 2.75Å
480K75.2Confident71.2Confident161 Ų161123 Ų12370%0.770%0.699SS**  trans-71.7104.1165.7-83.1-175.5172.2179.60109.7S478 F482S478-K480 PolarHBondContact O-N 2.74Å; K480-F482 PolarHBondContact O-N 3.16Å; K480-F482 VanDerWaalsContact O-N 3.08Å
481K79.8Confident71.8Confident204 Ų204122.5 Ų122.589%0.88769%0.689SS**  trans-62.8105.1165.3-60.5178-177.2179.10108.1N479 S483N479-K481 PolarHBondContact O-N 2.75Å; K481-S483 PolarHBondContact O-N 2.81Å; K481-S483 VanDerWaalsContact O-N 3.13Å
482F71.3Confident72.5Confident163 Ų163124.8 Ų124.872%0.71569%0.689SS**  trans-68.7107.4168.7-73.1-69.6000108.6P477 K480 I484P477-F482 HydrophobicContact CB-CD2 4.32Å; P477-F482 HydrophobicContact CB-CE2 3.77Å; P477-F482 HydrophobicContact CG-CD2 4.38Å; P477-F482 HydrophobicContact CG-CE2 3.85Å; K480-F482 PolarHBondContact O-N 3.16Å; K480-F482 VanDerWaalsContact O-N 3.08Å; F482-I484 PolarHBondContact O-N 2.73Å
483S76.9Confident73Confident116 Ų116128 Ų12881%0.81169%0.692SS**  trans-69.8106.1170.951.50000109.3K481 D485K481-S483 PolarHBondContact O-N 2.81Å; K481-S483 VanDerWaalsContact O-N 3.13Å; S483-D485 PolarHBondContact O-N 2.92Å
484I78.8Confident73.3Confident152 Ų152133.5 Ų133.578%0.77970%0.696SS**  trans-73.5105.8163.5-57.9175.1000106.1F482 I486F482-I484 PolarHBondContact O-N 2.73Å; I484-I486 PolarHBondContact O-N 2.89Å
485D79.5Confident73.8Confident91 Ų91132.1 Ų132.149%0.48770%0.696SS.*  trans-68.8112.8168.2177.911.1000108.4S483 N487 A488S483-D485 PolarHBondContact O-N 2.92Å; D485-N487 PolarHBondContact O-N 3.04Å; D485-N487 WeakPolarHBondContact OD1-CB 3.11Å; D485-N487 PolarHBondContact OD1-N 2.92Å; D485-N487 PolarHBondContact OD1-ND2 3.06Å; D485-A488 HydrophobicContact CB-CB 3.81Å; D485-A488 WeakPolarHBondContact O-CB 3.43Å; D485-A488 PolarHBondContact O-N 3.27Å; D485-A488 VanDerWaalsContact O-N 3.12Å
486I76.3Confident73.3Confident155 Ų155139.2 Ų139.280%0.79573%0.73SS**THydrogen-bonded Turntrans-64.9-25.2-177.9-56.5175000110.5I484I484-I486 PolarHBondContact O-N 2.89Å
487N78.6Confident73.6Confident145 Ų145143 Ų14378%0.77574%0.741SS**THydrogen-bonded Turntrans-83.2-17.9178.4-48.7-66.6000112.5D485 S489D485-N487 PolarHBondContact O-N 3.04Å; D485-N487 WeakPolarHBondContact OD1-CB 3.11Å; D485-N487 PolarHBondContact OD1-N 2.92Å; D485-N487 PolarHBondContact OD1-ND2 3.06Å; N487-S489 PolarHBondContact O-N 2.76Å
488A76.7Confident74.1Confident59 Ų59146.2 Ų146.249%0.48875%0.752SS.*  trans-78.241.1-178.600000113.4D485 R490D485-A488 HydrophobicContact CB-CB 3.81Å; D485-A488 WeakPolarHBondContact O-CB 3.43Å; D485-A488 PolarHBondContact O-N 3.27Å; D485-A488 VanDerWaalsContact O-N 3.12Å; A488-R490 VanDerWaalsContact C-N 3.29Å; A488-R490 PolarHBondContact O-N 3.31Å
489S73.2Confident74.4Confident87 Ų87149.3 Ų149.361%0.60876%0.758SS**  trans-71.379.6178.1-173.60000111.5N487 S491N487-S489 PolarHBondContact O-N 2.76Å; S489-S491 PolarHBondContact O-N 3.13Å; S489-S491 PolarHBondContact OG-OG 3.26Å
490R71.3Confident74.8Confident236 Ų236148.6 Ų148.689%0.89175%0.752SS**  trans-75.447.7171.9-61.5-170.670.3-178.52.1112A488 V492A488-R490 VanDerWaalsContact C-N 3.29Å; A488-R490 PolarHBondContact O-N 3.31Å; R490-V492 PolarHBondContact O-N 3.15Å; R490-V492 VanDerWaalsContact O-N 3.15Å
491S73Confident74.8Confident89 Ų89147.8 Ų147.862%0.62276%0.755SS**  trans-77.193.3173.753.70000110S489S489-S491 PolarHBondContact O-N 3.13Å; S489-S491 PolarHBondContact OG-OG 3.26Å
492V77.4Confident74.5Confident115 Ų115144.1 Ų144.170%0.69775%0.746SS**  trans-69.3127.1166.4-178.60000108R490R490-V492 PolarHBondContact O-N 3.15Å; R490-V492 VanDerWaalsContact O-N 3.15Å
493R77.9Confident74.7Confident200 Ų200142.7 Ų142.776%0.75575%0.749SS**  trans-82.3142.3169.7-48.4-177.98397.3-4.9108.6D495R493-D495 VanDerWaalsContact C-N 3.33Å; R493-D495 WeakPolarHBondContact CB-OD2 3.22Å; R493-D495 WeakPolarHBondContact CD-OD2 3.49Å; R493-D495 IonicContact NE-OD2 2.73Å; R493-D495 PolarHBondContact NE-OD2 2.65Å; R493-D495 VanDerWaalsContact NE-OD2 3.15Å; R493-D495 PolarHBondContact O-N 2.68Å
494F72.6Confident74.5Confident191 Ų191144.8 Ų144.884%0.83874%0.744SS**  trans-100.461.9175.9-69.8-84.1000108.9
495D74Confident74.1Confident129 Ų129144.2 Ų144.269%0.6974%0.741SS**  trans-102.467.3177.6-56.3-35.2000107.1R493R493-D495 VanDerWaalsContact C-N 3.33Å; R493-D495 WeakPolarHBondContact CB-OD2 3.22Å; R493-D495 WeakPolarHBondContact CD-OD2 3.49Å; R493-D495 IonicContact NE-OD2 2.73Å; R493-D495 PolarHBondContact NE-OD2 2.65Å; R493-D495 VanDerWaalsContact NE-OD2 3.15Å; R493-D495 PolarHBondContact O-N 2.68Å
496D59.3Low73.7Confident233 Ų233149 Ų149100%1.24676%0.764SS**  trans-160.40-178.3-166.762.5000110.9

Retrieved 496 of 496 residues in 255.4 ms (Link to these results)