A0A087WP47_MOUSE Loading...

Retroelement silencing factor 1

AlphaFold DB , UniProt , Accession A0A087WP47, Species MOUSE (Mus musculus, Mouse), Gene Resf1, Length 1,173 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
1M32.8Very low35.2Very low246 Ų246160 Ų160100%1.21281%0.807SS**  0162.30-74.1175.1171.200108.8
2N39.3Very low35.3Very low129 Ų129163.3 Ų163.369%0.6981%0.812SS**  trans-133.3123.5-170.3164.530.3000109.4
3W31.7Very low35.3Very low216 Ų216159.8 Ų159.882%0.81881%0.808SS**  trans-142.692.9172.2-82.5102.2000111.8T5W3-T5 HydrophobicContact CE3-CG2 4.03Å; W3-T5 HydrophobicContact CZ3-CG2 4.21Å
4N37.8Very low35.5Very low153 Ų153157 Ų15782%0.81881%0.807SS**  trans-79.1125.7150.8-99.2-61.8000108.4
5T41.4Very low35.7Very low119 Ų119155 Ų15573%0.7381%0.808SS**  trans-141.4137.9167.318.60000110.3W3W3-T5 HydrophobicContact CE3-CG2 4.03Å; W3-T5 HydrophobicContact CZ3-CG2 4.21Å
6K37.5Very low35.3Very low207 Ų207160.1 Ų160.190%0.982%0.815SS**  trans-118.5131.3176.2-79-174.3174.3-175.80110.2
7Q32.4Very low35Very low175 Ų175157.7 Ų157.782%0.81882%0.817SS**  trans-156.2158.4155.7-83.7-166.2-77.500107.7
8E29.7Very low34.7Very low138 Ų138160.2 Ų160.265%0.64582%0.82SS**  cis-163.7150.8-26-175.4160.6167.800109.5
9N31.2Very low34.5Very low126 Ų126157.6 Ų157.667%0.67481%0.813SS**  trans24.2118161.6-62.8-36.5000123
10V34.4Very low34.4Very low131 Ų131158.2 Ų158.279%0.79481%0.812SS**  51.3133.7115.5169.80000119
11P39.1Very low34.1Very low120 Ų120153.6 Ų153.678%0.77979%0.794SS**  cis-139.6-177.94127-1.8000118.2
12K35.7Very low34Very low200 Ų200145.5 Ų145.587%0.8776%0.761SS**  trans-115.4157.2169.9-76.9-177.2176.9-177.60111.1
13P36.3Very low33.7Very low117 Ų117145.2 Ų145.276%0.7676%0.758SS**PPolyproline II helixtrans-76.8161.4-178.131.8-37000114.6
14P37.6Very low33.7Very low121 Ų121141.5 Ų141.579%0.78675%0.754SS**PPolyproline II helixtrans-90.6151.2-176.735.7-35.5000114.7
15P38.6Very low33.3Very low127 Ų127140.3 Ų140.383%0.82574%0.743SS**PPolyproline II helixtrans-94.7163.7171.937.1-34.3000114.2
16Y29.6Very low32.7Very low236 Ų236141.1 Ų141.193%0.92574%0.739SS**PPolyproline II helixtrans-72.1164.5179.1-83.3-101.1000114.8
17S30.1Very low32.2Very low120 Ų120139.5 Ų139.584%0.83973%0.732SS**  trans-138.7154.6163.460.10000112
18K28.9Very low32Very low202 Ų202138.1 Ų138.188%0.87873%0.729SS**  trans-126.3150.2174.2-72.4-178.2175-178.30109.2
19T31.4Very low31.8Very low111 Ų111139.4 Ų139.468%0.68174%0.737SS**  -172.4-177.3126.626.40000110.8
20Q33.2Very low31.7Very low169 Ų169139.4 Ų139.479%0.7974%0.742SS**  trans-122.2165.5-168.1-58.5158-82.600112.8
21S28.4Very low31.3Very low62 Ų62138.3 Ų138.343%0.43474%0.74SS.*  trans168143.8141.2-75.90000106.8
22S29.1Very low30.8Very low76 Ų76139.5 Ų139.553%0.53175%0.745SS.*  cis76.3138.43885.40000113.1A1030S22-A1030 PolarHBondContact O-N 3.38Å
23I32.8Very low30.5Very low123 Ų123136 Ų13663%0.63174%0.741SS**  cis-166.316323-144.4170.8000113.4
24L32.4Very low30.3Very low138 Ų138135.1 Ų135.172%0.72374%0.738SS**  trans62.5162.2158.9-67-177.3000120.3
25Q29Very low30.1Very low128 Ų128137.7 Ų137.760%0.59874%0.739SS**  cis-173.5144.8-23.1-168.5178.94.200107.1
26H28.8Very low29.6Very low137 Ų137136.7 Ų136.763%0.63474%0.735SS**  171.1144.789.3-114.9-83.3000111.9
27F27.1Very low29.7Very low172 Ų172129.8 Ų129.875%0.75472%0.721SS**  trans41.6126.7138.5-86.1-119.1000120.5
28L28.2Very low29.5Very low146 Ų146132.6 Ų132.676%0.76472%0.719SS**  -166.4154.864.6-104.1163.6000112
29M26.1Very low29.4Very low165 Ų165128.5 Ų128.581%0.81371%0.706SS**  trans28.2140.3155.1-65.9-175.481.500121.2
30T28.6Very low29.1Very low126 Ų126133.3 Ų133.377%0.77371%0.714SS**  cis-134.2164.538.649.60000114.7
31S25.8Very low28.7Very low108 Ų108130.2 Ų130.276%0.75571%0.71SS**  trans-121.4133.5170.3-51.80000110.2
32T29.9Very low29.6Very low145 Ų145132.2 Ų132.289%0.8972%0.722SS**  trans-118.6102.916037.40000108.1
33T29.7Very low29.5Very low126 Ų126136.2 Ų136.277%0.77373%0.732SS**  trans-150.8108.4-179.3-55.30000108.6
34S31.5Very low29.2Very low99 Ų99136 Ų13669%0.69273%0.732SS**  trans172.7153175.9-84.30000107.4
35Q33.3Very low28.8Very low176 Ų176136.5 Ų136.582%0.82273%0.731SS**  cis-157.9165.9-7.9-112.9164.766.400105
36S28.6Very low28.7Very low105 Ų105138.3 Ų138.373%0.73474%0.739SS**  cis-161.2168.519.240.10000106.5
37S30Very low28.6Very low91 Ų91135.9 Ų135.964%0.63674%0.743SS**  cis-167.4-173.7-15.553.80000105.3
38F27.1Very low28.6Very low179 Ų179132.9 Ų132.979%0.78574%0.743SS**  cis-156.9177.45-109.9-41.2000104.7
39N26.6Very low28.6Very low116 Ų116134.2 Ų134.262%0.6275%0.746SS**  cis-154.2-167.45.8-135.5-22.1000112.4
40Y25.1Very low28.6Very low213 Ų213132.1 Ų132.184%0.83574%0.742SS**  trans-26141.9169.1-76-80.9000122
41S24.1Very low28.5Very low103 Ų103130.9 Ų130.972%0.7274%0.739SS**  trans-89.5170.2143-150.60000108.4
42P47.2Very low28.5Very low104 Ų104134 Ų13468%0.67574%0.739SS**  cis-151.4-165.124.244.7-22.5000118.1
43H27.2Very low28.2Very low161 Ų161132.5 Ų132.575%0.74573%0.725SS**  trans80.8131.4151.7-94.4-67.3000123.1
44N26.3Very low28Very low119 Ų119136.1 Ų136.164%0.63673%0.726SS**  trans71.3136.2143.1-72.57.8000124.6
45Q25.6Very low27.5Very low148 Ų148136.3 Ų136.369%0.69273%0.728SS**  trans65.9126.2141.8-74.4175.6-86.400122.7
46E25.5Very low27.3Very low165 Ų165135.9 Ų135.977%0.77173%0.73SS**  50144.1127.5-61.3176.5112.400123.2
47A27.4Very low27.3Very low86 Ų86137.4 Ų137.471%0.71173%0.725SS**  trans72.3114.9151.800000120.4
48S26Very low27.3Very low109 Ų109138.8 Ų138.876%0.76273%0.725SS**  56.3154.2115.7-53.10000123
49Q29.1Very low27.5Very low174 Ų174137.3 Ų137.381%0.81372%0.721SS**  trans70.5101.5159.3-72.6173.430.200116.4
50T26.8Very low27.7Very low122 Ų122140.6 Ų140.675%0.74873%0.733SS**  82.5125.777.456.40000116.5
51S25.2Very low27.8Very low99 Ų99134.3 Ų134.369%0.69273%0.725SS**  trans101.5143.513784.50000122.2
52F25.5Very low28Very low175 Ų175135.1 Ų135.177%0.76873%0.729SS**  trans63.9116144.6-67.9-49.8000124.9
53N24.6Very low27.1Very low112 Ų112137.6 Ų137.660%0.59973%0.733SS**  88149.4119.1-70.3-14.5000123.6
54Y24.4Very low27.2Very low203 Ų203139.7 Ų139.780%0.79674%0.736SS**  trans61.5128.7165.5-57.3-58.2000117.2
55S22.8Very low27.3Very low103 Ų103139.2 Ų139.272%0.7274%0.742SS**  cis85.2103.440.2-600000114.6
56L27.3Very low27.3Very low166 Ų166135.5 Ų135.587%0.86974%0.744SS**  trans-176.4121.3138.6-119.162.3000105.7
57H29Very low27.4Very low137 Ų137135.4 Ų135.463%0.63475%0.749SS**  cis80.297.738.8-165.954.5000114.3Q59H57-Q59 PolarHBondContact NE2-NE2 3.19Å
58N30.9Very low27.4Very low120 Ų120134.9 Ų134.964%0.64274%0.74SS**  -173.7124.4120.8-86.7-29.6000109.3
59Q31.8Very low27.4Very low148 Ų148136.8 Ų136.869%0.69274%0.741SS**  67.7133.190.5-63-173.76500111.9H57H57-Q59 PolarHBondContact NE2-NE2 3.19Å
60E29.6Very low27.3Very low186 Ų186132.8 Ų132.887%0.86973%0.733SS**  cis-141.5168.133.4-70.3173.513700111.6
61A28.1Very low27.4Very low81 Ų81133.3 Ų133.367%0.66974%0.735SS**  cis-167.6170.5-20.700000110.3
62C28.2Very low27.5Very low119 Ų119133.9 Ų133.980%0.80474%0.74SS**  trans66.3136.7157.7-69.40000119.9
63M28.9Very low27.6Very low156 Ų156133.6 Ų133.677%0.76874%0.741SS**  cis-150.5145.8-6-93.7-70.6-108.700111.5
64Y28.7Very low28.4Very low205 Ų205133.3 Ų133.380%0.80475%0.745SS**  trans6157.2141.2-75.2-109.2000122.1
65S27.2Very low28.5Very low109 Ų109130.7 Ų130.776%0.76274%0.744SS**  cis177.8170.1-18.3-96.30000111.4
66G26.6Very low28.8Very low71 Ų71133.7 Ų133.773%0.73275%0.751SS**  trans123123.816500000113.2
67N26.5Very low28.6Very low162 Ų162131.2 Ų131.287%0.86675%0.748SS**  cis59.813845.4-98.625000114.5
68S28Very low28.6Very low75 Ų75128 Ų12852%0.52475%0.752SS.*  cis178.8159.1-1144.10000110.7
69N27.1Very low28.4Very low149 Ų149133 Ų13380%0.79776%0.762SS**  trans67.8163.9153-67.5-5.2000118.1
70S26.7Very low28.2Very low90 Ų90131.7 Ų131.763%0.62976%0.76SS**  cis179.7161.2-28.859.10000110.9
71V28.8Very low28.1Very low133 Ų133132.9 Ų132.981%0.80676%0.758SS**  trans73138.1162.2-170.80000113
72S27.6Very low28.1Very low112 Ų112137 Ų13778%0.78377%0.767SS**  -153.5159.557.4-55.50000116.4
73Q27.3Very low28.2Very low168 Ų168137.6 Ų137.679%0.78577%0.767SS**  trans-90.8-164.4167.5-67.9-165.6-11.200110.3
74P39.8Very low29Very low107 Ų107135.3 Ų135.370%0.69576%0.764SS**  cis-150.2166.27.846-25.4000121.7
75L27.3Very low28.9Very low148 Ų148133.1 Ų133.178%0.77576%0.761SS**  trans38.9161.4136.9-70.7161.3000125.2
76L28.8Very low29.1Very low165 Ų165133.4 Ų133.486%0.86476%0.758SS**  trans80.7159.7166.6-56.7168.9000117
77S24.2Very low29.2Very low114 Ų114137.6 Ų137.680%0.79776%0.759SS**  cis-179.4152.7-36.5-173.50000108.6
78G27.5Very low29.2Very low71 Ų71136.6 Ų136.673%0.73275%0.752SS**  trans100.2152.2170.900000114.9
79R28Very low29.1Very low223 Ų223138.5 Ų138.584%0.84277%0.765SS**  cis147.2105.4-19.3178.6-178.9-160.5-164.78.2108.4
80N27.9Very low29.1Very low121 Ų121137.4 Ų137.465%0.64776%0.764SS**  trans72.9127151.9-65.714.5000121.8
81Y27.7Very low29.2Very low212 Ų212138.9 Ų138.983%0.83177%0.774SS**  trans44126.5146.4-58.7-65.8000122.1
82I27.9Very low29.2Very low167 Ų167139.5 Ų139.586%0.85677%0.773SS**  -166.6140.9121-97.4152.2000110.7
83T29.1Very low29.7Very low131 Ų131143 Ų14380%0.80478%0.779SS**  trans-131.6161.3159.824.90000106.6
84P46.2Very low30.3Very low109 Ų109141 Ų14171%0.70878%0.78SS**  cis-115.3-152.820.732.3-9.5000111.1
85Q27.7Very low29.8Very low159 Ų159142.2 Ų142.274%0.74379%0.786SS**  cis-167.4139.219.3-157170.80.800111.3
86T29.6Very low29.9Very low115 Ų115146.5 Ų146.571%0.70679%0.792SS**  trans50.1142.8153.152.90000121
87Q28.7Very low29.8Very low158 Ų158144.6 Ų144.674%0.73879%0.787SS**  cis-165.21634.1-126.5177.57.300111.9
88I27.8Very low30.1Very low141 Ų141146.8 Ų146.872%0.72379%0.789SS**  trans58.8105.1154.7-54.6156.1000119
89S25.9Very low30.3Very low116 Ų116149.6 Ų149.681%0.81179%0.791SS**  -175.2142.5116.2-78.60000110.1
90V26.6Very low30.3Very low126 Ų126143.2 Ų143.276%0.76479%0.786SS**  trans-132.5131.5-174.7178.60000111.2
91S29.4Very low30.3Very low121 Ų121143.3 Ų143.385%0.84680%0.796SS**  trans-145.4125.515654.50000109.2
92N27.6Very low30.5Very low145 Ų145142 Ų14278%0.77580%0.797SS**  trans-100.1142.8-172.4-79.8-28.9000112.2
93M38Very low30.5Very low187 Ų187139.8 Ų139.892%0.92180%0.797SS**  trans-115.9131.9164.9-80.1-77.8-178.500109.2
94P40Very low30.5Very low124 Ų124138.7 Ų138.781%0.80580%0.795SS**  trans-107.8125.3161.3-3.224.1000112.4
95T29.1Very low30Very low134 Ų134142.9 Ų142.982%0.82281%0.807SS**  trans-50.7143.2171.7-46.20000113.5
96R29.4Very low30.1Very low238 Ų238142.2 Ų142.290%0.89880%0.804SS**  trans-96.499.6-178.3-169.8-173.6-161.3174.37.8112.1
97T28.4Very low30.4Very low125 Ų125146.2 Ų146.277%0.76781%0.806SS**  trans-85.8144.8173-56.80000111.3
98I30.4Very low30.4Very low160 Ų160145.1 Ų145.182%0.82181%0.81SS**  trans-93.3127.1-176.1-60.2170000109.7
99V31.6Very low30.4Very low130 Ų130144 Ų14479%0.78881%0.809SS**  trans-110.7130.7170.3177.70000108.6
100A27.2Very low30.7Very low89 Ų89143.8 Ų143.874%0.73681%0.808SS**  trans-93.4122.3174.500000110.1Q102A100-Q102 PolarHBondContact O-N 2.76Å
101S28.3Very low30.9Very low123 Ų123143.8 Ų143.886%0.8681%0.809SS**  trans-73.5112.2-179-51.90000111.6
102Q31.4Very low31.1Very low183 Ų183146.1 Ų146.186%0.85581%0.812SS**  trans-78.2129.9163.4-65.6-171.27.100109.8A100 S104A100-Q102 PolarHBondContact O-N 2.76Å; Q102-S104 PolarHBondContact O-N 3.34Å
103S28.9Very low31.1Very low121 Ų121143 Ų14385%0.84681%0.814SS**  trans-96.778179.461.10000111.5M105S103-M105 PolarHBondContact O-N 3.42Å
104S28.7Very low30.8Very low109 Ų109144 Ų14476%0.76281%0.813SS**  trans-80.7107.8170.852.50000110.7Q102 E106Q102-S104 PolarHBondContact O-N 3.34Å; S104-E106 PolarHBondContact O-N 3.43Å
105M34.9Very low30.4Very low196 Ų196141.1 Ų141.197%0.96681%0.807SS**  trans-75.5106.8164.1-71.5-177176.500109.4S103S103-M105 PolarHBondContact O-N 3.42Å
106E30.8Very low30.4Very low145 Ų145141.3 Ų141.368%0.67881%0.81SS**  trans-104.2153.2161.8-175.175.4-95.800109S104S104-E106 PolarHBondContact O-N 3.43Å
107R34.8Very low30.4Very low199 Ų199139.1 Ų139.175%0.75181%0.81SS**  trans-69.5138.8-168.4-69.9149-75.5-171.2-3.7112.6V109R107-V109 PolarHBondContact O-N 3.4Å; R107-V109 VanDerWaalsContact O-N 3.13Å
108V29.4Very low30.4Very low136 Ų136141.7 Ų141.782%0.82481%0.813SS**  trans-60.9113.4162.5177.60000108.8
109V29Very low30.7Very low116 Ų116138.4 Ų138.470%0.70380%0.802SS**  trans-107.1118.3159.8175.90000106.5R107 T111R107-V109 PolarHBondContact O-N 3.4Å; R107-V109 VanDerWaalsContact O-N 3.13Å; V109-T111 PolarHBondContact O-N 3.36Å; V109-T111 VanDerWaalsContact O-N 3.1Å
110S32Very low30.4Very low112 Ų112139.5 Ų139.578%0.78380%0.804SS**  trans-69.5104.6-173-49.40000111.6
111T30.7Very low30.5Very low127 Ų127143.6 Ų143.678%0.77981%0.807SS**  trans-106.1125.2175.853.50000111.7V109 G113V109-T111 PolarHBondContact O-N 3.36Å; V109-T111 VanDerWaalsContact O-N 3.1Å; T111-G113 PolarHBondContact O-N 3.09Å
112N33.1Very low30.5Very low169 Ų169144.2 Ų144.290%0.90480%0.801SS**  trans-39.3110-176.4-62.1-40.4000115.9K114N112-K114 PolarHBondContact O-N 3.3Å
113G28.1Very low30.5Very low81 Ų81144.1 Ų144.184%0.83581%0.805SS**  trans-83.4100.2158.700000110.2T111T111-G113 PolarHBondContact O-N 3.09Å
114K31.3Very low30.5Very low207 Ų207146.4 Ų146.490%0.980%0.802SS**PPolyproline II helixtrans-76.2127.1171.7-141.2178.3-172.5-1780108.2N112N112-K114 PolarHBondContact O-N 3.3Å
115G31.6Very low30.5Very low64 Ų64148.2 Ų148.266%0.6681%0.809SS**PPolyproline II helixtrans-67.5153.2-179.700000112.8
116P28.6Very low30.3Very low137 Ų137145.2 Ų145.289%0.8980%0.801SS**PPolyproline II helixtrans-71.5136.717031-33.4000110.1
117Q29.7Very low30.1Very low192 Ų192143 Ų14390%0.89780%0.802SS**  trans-143123.2158.6-164.2-176.644.300110
118Q29.1Very low29.8Very low180 Ų180139.2 Ų139.284%0.84181%0.806SS**  trans-155.8157.2167.9-115.4-147.622.100108
119P35.5Very low29.8Very low90 Ų90136.1 Ų136.158%0.58480%0.801SS**  -126174.8-64.432.5-17.9000110.6
120N24.8Very low29.7Very low154 Ų154138.2 Ų138.282%0.82481%0.807SS**  trans-157.3117.9151.3-109.7-61.1000111.7
121H30.6Very low29.5Very low175 Ų175139.9 Ų139.981%0.8180%0.804SS**  trans-92.2142.1161.6-72.3-85.7000108.6
122N27.5Very low29.5Very low135 Ų135140.8 Ų140.872%0.72280%0.8SS**  trans-152.1114.9156-105.7-58.7000110.7
123L32.1Very low29.4Very low182 Ų182138.9 Ų138.995%0.95379%0.789SS**  trans-135.6131.8157.2-78.3178.2000106.6
124Q28.1Very low29.3Very low168 Ų168141 Ų14179%0.78579%0.786SS**  trans-141.9114.8-163.5179.8-174.571.700110
125T29.8Very low28.9Very low147 Ų147142.6 Ų142.690%0.90279%0.787SS**  trans-143.4151.5165.839.70000110.7
126V29.9Very low28.6Very low133 Ų133146.4 Ų146.481%0.80679%0.791SS**  trans-125.1159.7-173.9-138.80000105.5
127S27.4Very low29.2Very low98 Ų98144.6 Ų144.669%0.68578%0.779SS**  cis-166.317428.2-1630000112.6
128S28.4Very low29Very low121 Ų121139.9 Ų139.985%0.84677%0.767SS**  trans4147.3157-52.80000121.4
129G27.6Very low29Very low70 Ų70138.7 Ų138.772%0.72276%0.762SS**  cis158.2-176.20.200000113.1
130I27.5Very low28.7Very low161 Ų161139.1 Ų139.183%0.82676%0.763SS**  trans80.5111.3165-61.6177.8000120
131M28.6Very low28.7Very low147 Ų147140 Ų14072%0.72476%0.762SS**  trans61121.2142.6-67.8-178.970.100125.8
132Q30.3Very low28.6Very low145 Ų145135.7 Ų135.768%0.67876%0.757SS**  78.7110.3128-73.9-164.5-10.800124.2
133N30.1Very low28.5Very low129 Ų129135 Ų13569%0.6976%0.758SS**  84.6156.7122.7-59.4-11000122.2
134V26.6Very low28.3Very low126 Ų126133.4 Ų133.476%0.76475%0.748SS**  trans89.490.9158.1-164.20000119.3
135W23.4Very low28.2Very low240 Ų240129.6 Ų129.691%0.90974%0.741SS**  trans74.6139.2131-129.7-65.2000122.8
136L26.1Very low28.2Very low145 Ų145131.1 Ų131.176%0.75974%0.737SS**  trans-60.7-173.9162.2-70.4160.8000112.5
137P39.7Very low28.3Very low99 Ų99132.1 Ų132.164%0.64374%0.738SS**  cis-142.816211.136.5-14.5000119.7
138S25Very low29.1Very low92 Ų92132.4 Ų132.464%0.64374%0.738SS**  trans51.8167.3136.3-49.30000120.7
139H29.8Very low29.2Very low155 Ų155132.9 Ų132.972%0.71873%0.73SS**  cis-159.2147.835.7-102.3-57.9000110.3
140T28.9Very low29.4Very low100 Ų100133.3 Ų133.361%0.61374%0.735SS**  61.5120.386.8-55.90000114.8
141E25.9Very low29.5Very low171 Ų171128.4 Ų128.480%0.79972%0.724SS**  cis-175.6-175.4-12.7-119.7146.287.900112.4
142A28Very low29.7Very low85 Ų85127.5 Ų127.570%0.70273%0.727SS**  trans84.9116.4147.600000124
143T25.7Very low29.6Very low122 Ų122127.8 Ų127.875%0.74873%0.733SS**  71.9115.7109.6-51.90000123.7
144I28.5Very low29.6Very low147 Ų147130 Ų13075%0.75474%0.741SS**  trans80.3104.4141.4-73.4173.5000122.6
145S25.6Very low30.3Very low89 Ų89129.1 Ų129.162%0.62274%0.738SS**  77.8156.2127.282.40000125.4
146H29.7Very low30.6Very low179 Ų179127.4 Ų127.483%0.82973%0.733SS**  trans70.5112.7153.6-66.4-59.6000122.1
147N31.4Very low30.6Very low154 Ų154128.3 Ų128.382%0.82474%0.736SS**  trans-59.2169.4150.2-72.2-4.4000111.5
148P43.9Very low30.2Very low104 Ų104132.1 Ų132.168%0.67574%0.744SS**  cis-150.9-17428.646.5-26.1000119.8
149D31.1Very low31.5Very low130 Ų130133.3 Ų133.370%0.69575%0.75SS**  trans74.4139143.9-69.7-30.8000124.7
150G31.1Very low32Very low79 Ų79130.8 Ų130.881%0.81475%0.747SS**  trans93.5131149.200000117.4
151G29.3Very low32Very low58 Ų58134.4 Ų134.460%0.59876%0.757SS**  cis138122.4-9.500000114
152T32.9Very low31.9Very low128 Ų128132.2 Ų132.279%0.78575%0.751SS**  trans68.4138.1174.372.80000115.6
153N27.9Very low31.9Very low152 Ų152135.5 Ų135.581%0.81375%0.752SS**  cis-156.3171.545.7-82.6-78.7000115
154M31.1Very low32.2Very low174 Ų174136.8 Ų136.886%0.85775%0.753SS**  trans-72176.2167.9-82.2-77.4-176.200112.9
155P41.8Very low32Very low108 Ų108135.4 Ų135.470%0.70175%0.752SS**  cis-146.9178.622.645.1-25.3000119.6
156Y28.1Very low32.3Very low204 Ų204137.5 Ų137.580%0.876%0.76SS**  trans44.6125.1146.5-96.2-104.6000122.1
157M27Very low32.2Very low165 Ų165133.2 Ų133.281%0.81375%0.751SS**  -179.1156.1111.3-94.6-56.3168.800113.9
158H31.2Very low32.2Very low178 Ų178132.2 Ų132.282%0.82475%0.746SS**  trans-141164.9168.6-82.2-60.4000108.1
159P51.8Low31.6Very low117 Ų117131.4 Ų131.476%0.7674%0.739SS**  cis-111.3-148-32.536.4-17.1000108.6
160P40.6Very low31.5Very low102 Ų102135.9 Ų135.966%0.66275%0.747SS**  -152-173.461.343.1-20.6000116.8
161Q29.2Very low31.4Very low177 Ų177136.2 Ų136.283%0.82774%0.737SS**  trans-0.6163.6149-68163-65.800121.5
162N24.8Very low31.5Very low124 Ų124141.2 Ų141.266%0.66375%0.747SS**  cis162.8143.8-19.3-150.12.9000106.4
163Q27.7Very low31.5Very low155 Ų155141.5 Ų141.572%0.72474%0.739SS**  trans69.3161.2157.1-62.2176.315.700122.5
164L30.5Very low31.7Very low149 Ų149140.2 Ų140.278%0.7873%0.732SS**  trans70121169.5-61.2122.4000116.5
165V26.4Very low31.5Very low118 Ų118139.6 Ų139.672%0.71573%0.727SS**  cis94.5106.339170.60000113
166T31.2Very low30.9Very low132 Ų132142 Ų14281%0.8173%0.731SS**  trans-167.4136.9131.131.20000106.7
167S26.8Very low30.8Very low89 Ų89136.2 Ų136.262%0.62273%0.725SS**  cis71.9140.944-68.30000113.5
168D31.9Very low31.6Very low134 Ų134133.5 Ų133.572%0.71772%0.72SS**  cis-168.2165.4-13-117.5108.5000107.2
169T31.7Very low31.3Very low86 Ų86131.6 Ų131.653%0.52872%0.715SS.*  cis-158.4173.31-160.10000109.3
170Y29.5Very low30Very low224 Ų224134.1 Ų134.188%0.87872%0.716SS**  -172.7115.6129.2-108.9-69.8000114.4
171S28.9Very low29.4Very low87 Ų87134.6 Ų134.661%0.60872%0.722SS**  trans-77.9162.7172.8-55.10000111.7
172M30.3Very low29.2Very low163 Ų163129.7 Ų129.780%0.80372%0.719SS**  -178.7160.973.4-86.3-177.27000110.1
173Q32.5Very low29.6Very low133 Ų133133.4 Ų133.462%0.62173%0.729SS**  cis-174.4170.1-25-156.2-177.8-64.400108.2
174L32.1Very low29.7Very low125 Ų125132.7 Ų132.765%0.65474%0.735SS**  trans75.2137.5158.9-60.1164.4000117.9
175Q27.3Very low30.2Very low161 Ų161131.3 Ų131.375%0.75274%0.735SS**  cis-159.5130-16.8-155.9168.112.400113.5
176M29.2Very low30.3Very low159 Ų159133.6 Ų133.678%0.78374%0.74SS**  trans29.5117.2145.1-52.2-68.6-81.400122.4
177A27.1Very low30.2Very low83 Ų83132.7 Ų132.769%0.68673%0.734SS**  61.9172.1111.600000121.5
178P42.4Very low30.4Very low107 Ų107136.4 Ų136.470%0.69574%0.741SS**  -138.5173.7-53.739.1-24000115.3
179L25.5Very low30.5Very low138 Ų138138.4 Ų138.472%0.72375%0.746SS**  trans68.3154.6150.2-77.1161.5000121.2
180H25.6Very low30.4Very low170 Ų170137.6 Ų137.679%0.78776%0.756SS**  trans68.7160.9163-54-47.8000117.7
181S26.3Very low30.4Very low113 Ų113132.3 Ų132.379%0.7975%0.751SS**  cis-169.3118.6-31.7177.80000111.8
182G26.5Very low30.8Very low73 Ų73137.6 Ų137.675%0.75377%0.766SS**  trans68.9177.6150.800000121.2
183K32Very low31Very low203 Ų203132.8 Ų132.888%0.88376%0.759SS**  trans64.592.2163.5-65.7-175.5177.2-179.80120.5
184V29.3Very low31.1Very low140 Ų140134.2 Ų134.285%0.84877%0.77SS**  2.7126.5109.4177.10000114.2
185P42.1Very low31Very low119 Ų119134 Ų13477%0.77377%0.77SS**  -149.7-179.879.341.3-22.4000118.6
186M27.6Very low31.4Very low166 Ų166133.7 Ų133.782%0.81877%0.768SS**  trans-50.7164.3162.8-60.2176.6169.600112.2
187T30.3Very low31.3Very low113 Ų113130.4 Ų130.469%0.69375%0.749SS**  -170150.358.146.10000115
188H31.3Very low31.7Very low168 Ų168130.6 Ų130.678%0.77874%0.738SS**  trans39.5156.2138.5-58.8-61.5000124.3
189Q32.3Very low31.7Very low175 Ų175130 Ų13082%0.81873%0.734SS**  trans81.4144.5147.3-146.1163.415.700116.2
190G29.8Very low31.8Very low70 Ų70127.9 Ų127.972%0.72272%0.723SS**  cis-172.1167.6-4.800000111.9
191S30.3Very low32.8Very low113 Ų113126.8 Ų126.879%0.7972%0.719SS**  trans-93.2172.2-170.354.80000115.5
192Q36.3Very low33.6Very low197 Ų197129.5 Ų129.592%0.92172%0.723SS**  trans119.8143.4166.4-67.3167.811.800113.8
193G35.8Very low34.6Very low63 Ų63129.5 Ų129.565%0.64971%0.709SS**  cis166.4-175.5-5.600000113.2
194L34.2Very low34.5Very low162 Ų162123.3 Ų123.385%0.84869%0.685SS**  trans76.2143.5169.8-54.5137.7000116
195N30.5Very low34.5Very low122 Ų122123.3 Ų123.365%0.65267%0.67SS**  cis93.7136.322.8-65.944.5000113.7
196H36.1Very low33.7Very low153 Ų153122.2 Ų122.271%0.70866%0.661SS**  cis-159.7178.410.1-91.8-57000110.4
197F26.9Very low33.6Very low90 Ų90120 Ų12040%0.39565%0.649SS.*  cis171.4128-32.5-168.246.8000112.7W205 T206F197-W205 HydrophobicContact CD1-CE3 4.03Å; F197-W205 HydrophobicContact CD1-CZ3 4.03Å; F197-W205 HydrophobicContact CE1-CE3 4.14Å; F197-T206 HydrophobicContact CE1-CG2 4.08Å; F197-T206 WeakPolarHBondContact CE1-OG1 3.44Å
198I35Very low33.4Very low88 Ų88124.7 Ų124.745%0.45166%0.655SS.*  trans72146.6165.8-60.9178.4000114.8W205I198-W205 HydrophobicContact CB-CZ3 4.46Å; I198-W205 HydrophobicContact CG1-CD2 4.47Å; I198-W205 HydrophobicContact CG1-CE3 3.7Å; I198-W205 HydrophobicContact CG1-CZ3 3.98Å
199P42.1Very low33.2Very low95 Ų95122.3 Ų122.362%0.61765%0.653SS**  cis-144.6159.331.542.8-22.5000122.2
200D28.1Very low33Very low92 Ų92118.4 Ų118.449%0.49265%0.645SS.*  trans67.6154.8131.1-70.7-3000122.1D204D200-D204 PolarHBondContact N-OD2 3.05Å
201Q45.6Very low33.1Very low148 Ų148122.7 Ų122.769%0.69265%0.651SS**SBendcis-146145.9-4.6-114.3156.747.500109.7V203Q201-V203 HydrophobicContact CB-CG2 4.32Å; Q201-V203 HydrophobicContact CG-CG2 3.89Å
202L43.8Very low33.1Very low170 Ų170126.3 Ų126.389%0.8966%0.656SS**SBendcis-133.498.621.5-17174.5000115.9
203V46.9Very low32.8Very low73 Ų73124.4 Ų124.444%0.44265%0.651SS.*  -158.8170.6-77.2-110.20000115.5Q201Q201-V203 HydrophobicContact CB-CG2 4.32Å; Q201-V203 HydrophobicContact CG-CG2 3.89Å
204D30.2Very low32.3Very low72 Ų72126 Ų12639%0.38565%0.652SS.*  trans59.9145.8133.4-69.413.5000121.3D200D200-D204 PolarHBondContact N-OD2 3.05Å
205W29.8Very low32.2Very low140 Ų140128.9 Ų128.953%0.5365%0.653SS.*  cis-167.2156.2-15.6-119.125000106.4F197 I198F197-W205 HydrophobicContact CD1-CE3 4.03Å; F197-W205 HydrophobicContact CD1-CZ3 4.03Å; F197-W205 HydrophobicContact CE1-CE3 4.14Å; I198-W205 HydrophobicContact CB-CZ3 4.46Å; I198-W205 HydrophobicContact CG1-CD2 4.47Å; I198-W205 HydrophobicContact CG1-CE3 3.7Å; I198-W205 HydrophobicContact CG1-CZ3 3.98Å
206T25.8Very low32.8Very low97 Ų97127.7 Ų127.760%0.59565%0.652SS**  trans59-168.8156.762.70000114.2F197F197-T206 HydrophobicContact CE1-CG2 4.08Å; F197-T206 WeakPolarHBondContact CE1-OG1 3.44Å
207Q24.4Very low32.3Very low118 Ų118128.3 Ų128.355%0.55166%0.655SS**  cis-152.5164.9-0-153.1168.234.100112.5
208Y26.1Very low32.5Very low212 Ų212133.5 Ų133.583%0.83167%0.674SS**  trans-49.4155.5146.6-94.9-113.9000112.4
209T27.8Very low32.5Very low119 Ų119140 Ų14073%0.7369%0.693SS**  -179.1112.8124.621.30000110.1
210S27.3Very low32.4Very low92 Ų92140.5 Ų140.564%0.64370%0.696SS**  62.4111.39970.90000114.9
211N33.1Very low33.7Very low161 Ų161141.9 Ų141.986%0.86171%0.71SS**  58.795.176.3-76-5.9000114.8
212E29.3Very low33.6Very low189 Ų189140 Ų14088%0.88371%0.71SS**  -134.7133.7128-79.5-173136.500107.2
213L29.6Very low32.9Very low156 Ų156140.3 Ų140.382%0.81771%0.705SS**  76.7123.151.4-103.7167.3000115.1
214S25.7Very low32Very low96 Ų96144.7 Ų144.767%0.67172%0.72SS**  trans66.2126.7169.99.80000116.3
215Y32.4Very low31.9Very low223 Ų223151.8 Ų151.888%0.87574%0.743SS**  59.9145.672.1-86.6-96.9000113.9
216P43.2Very low31.9Very low98 Ų98149.6 Ų149.664%0.63675%0.749SS**  cis-137.9-176.69.143.3-25.1000116.5
217E26.2Very low31.8Very low165 Ų165155.7 Ų155.777%0.77176%0.763SS**  trans48.8116.8139.4-73.7179.8114.400125.3
218Y30.5Very low32.1Very low200 Ų200155.5 Ų155.578%0.78476%0.764SS**  54.8125.7121.8-84.4-98.7000123.8
219R34.4Very low32.2Very low224 Ų224153.4 Ų153.485%0.84577%0.766SS**  trans69.2166.8148.8-83.2178.8-177.9-179.13.6118.3
220P40.5Very low33.4Very low106 Ų106153 Ų15369%0.68877%0.766SS**  cis-127.2170.2-25.832.1-14.2000113.6
221P56.1Low33.3Very low121 Ų121152.6 Ų152.679%0.78677%0.768SS**  trans-75.9157.5168.434.3-36.9000111.9
222P43Very low32.9Very low108 Ų108150.9 Ų150.970%0.70176%0.763SS**  -157.2170.6101.141.2-23.4000117.8
223K28.8Very low32.8Very low177 Ų177148.1 Ų148.177%0.7776%0.76SS**  trans65.8111.6154.4-71.9161.1-177.7-179.20117.9
224Q28.6Very low32.7Very low165 Ų165145.3 Ų145.377%0.77175%0.753SS**  70.6115.377.4-76.5-177.7-52.800115
225Y28.2Very low32.8Very low221 Ų221147.4 Ų147.487%0.86776%0.756SS**  -155.2154.4108-109.9-75.3000110.6
226S28.1Very low32.7Very low93 Ų93144.1 Ų144.165%0.6575%0.749SS**  trans-124.9148.8-179.3-53.10000110.4
227Y25.7Very low31.9Very low226 Ų226145 Ų14589%0.88675%0.752SS**  trans-143.1159.8155.8-94.7-70.4000111.4
228I30Very low31.9Very low114 Ų114145.6 Ų145.659%0.58575%0.752SS**  trans-134118-150.5-73174.4000111.4I984I228-I984 HydrophobicContact CD1-CD1 3.66Å
229L28.7Very low31.7Very low167 Ų167142.3 Ų142.387%0.87475%0.748SS**  trans57.8-175.7146-86.1164.5000117.2
230P51.6Low31.4Very low112 Ų112137.3 Ų137.373%0.72774%0.738SS**  trans-115.5-179.4-146.245.3-38.3000114.7
231A25.3Very low30.8Very low82 Ų82140.5 Ų140.568%0.67874%0.744SS**  171.1148.3120.400000115.4
232T26Very low29.5Very low125 Ų125141.9 Ų141.977%0.76774%0.744SS**  trans43.8124.5143.257.10000123.1
233T25.9Very low29.4Very low131 Ų131142.7 Ų142.780%0.80475%0.749SS**  175.1145.9109.831.30000108.4
234S27.7Very low29.3Very low98 Ų98140 Ų14069%0.68575%0.747SS**  cis103.3146.923.8-163.90000113.3
235L28.9Very low29.2Very low139 Ų139141.6 Ų141.673%0.72875%0.748SS**  trans76.7143176.6-49.8138.2000113.9
236Q29.3Very low29.2Very low155 Ų155135.9 Ų135.972%0.72474%0.736SS**  cis-165.2158.60.8-126.8-176.626.100113.3
237V26.4Very low29.3Very low116 Ų116139.7 Ų139.770%0.70374%0.744SS**  trans70.5142.1144.3160.70000117.4
238K26.1Very low29.4Very low178 Ų178134.3 Ų134.377%0.77474%0.739SS**  cis-151.2160.922.3-148.2155.3-169.8173.20113.7
239N26.6Very low29.3Very low130 Ų130135.4 Ų135.470%0.69575%0.745SS**  trans-15.5159.1158.8-48.9-0.6000119.1
240N28.2Very low29.4Very low120 Ų120136.3 Ų136.364%0.64275%0.745SS**  cis-168.9147.943.2-131.1-5.5000115
241Q28.3Very low28.3Very low172 Ų172136.1 Ų136.180%0.80475%0.747SS**  trans62.3141.3142.9-71.217018.400124.9
242L27.8Very low28.5Very low151 Ų151141 Ų14179%0.79175%0.753SS**  trans-75.9166.6160-12975.1000110.4
243P41.7Very low28.7Very low125 Ų125143 Ų14381%0.81275%0.753SS**  -151-153.865.442.6-20.5000115.5
244T26.9Very low28.8Very low119 Ų119142.3 Ų142.373%0.7375%0.753SS**  trans-108.6171.2-158.5-15.50000115.4
245Y26.5Very low28.8Very low200 Ų200144 Ų14478%0.78476%0.759SS**  trans91.8101.8146.4-116-116.8000122.2
246T26.9Very low29.7Very low100 Ų100142.8 Ų142.861%0.61376%0.759SS**  58.6135.9127.967.80000125.7
247Q31.1Very low29.7Very low173 Ų173142.7 Ų142.781%0.80876%0.763SS**  95.5111.7130-162.3171.434.200123.1
248S27.4Very low29.9Very low114 Ų114142 Ų14280%0.79776%0.763SS**  trans-154.5151.7136.164.20000108
249L28.7Very low29.9Very low136 Ų136138.3 Ų138.371%0.71276%0.76SS**  cis112.477.614.2-86.1170.5000117.3
250Q30Very low30.2Very low187 Ų187140 Ų14087%0.87476%0.764SS**  trans63.9122.7135.5-95-173-21.300124.3
251S27.8Very low30.2Very low108 Ų108140.9 Ų140.976%0.75576%0.764SS**  trans-168.9141.8148.6-145.20000109.4
252K29.6Very low30.1Very low185 Ų185141.8 Ų141.880%0.80476%0.761SS**  cis-160-157.3-19.7-123.8174-172.71770111
253H30.8Very low30.1Very low167 Ų167138.8 Ų138.877%0.77376%0.758SS**  trans-68.8161.7-176.8-60.9-72.5000114.6
254S28.6Very low29.5Very low116 Ų116137.4 Ų137.481%0.81176%0.757SS**  cis-138.7160.444.250.40000116.2
255V28.2Very low29.7Very low132 Ų132141 Ų14180%0.877%0.766SS**  trans-148.3123.5-167-1800000114
256P46.7Very low29.8Very low114 Ų114136.6 Ų136.674%0.7477%0.771SS**  trans-127168.7146.6192.5000111.2
257L30Very low30.1Very low153 Ų153137.1 Ų137.180%0.80178%0.779SS**  cis-155140.1-15.9-125.1168.6000107.5
258S29.2Very low30.1Very low101 Ų101139 Ų13971%0.70678%0.784SS**  trans37.7140.3155.256.10000122.6
259S27.7Very low30.3Very low102 Ų102144.1 Ų144.171%0.71379%0.786SS**  cis-173.9160.3-4.346.80000112.9
260H31.4Very low30.5Very low165 Ų165144.5 Ų144.576%0.76479%0.788SS**  trans-13.8159.9157.4-49.1-66.5000120
261Q29.4Very low30.6Very low138 Ų138141 Ų14165%0.64578%0.784SS**  cis-165-169.75.3-123.2158.1-17.800108
262Y26.5Very low30.6Very low192 Ų192140.7 Ų140.775%0.75379%0.788SS**  cis-154.5141.43.3-103.3-54.5000105.6
263A27.7Very low30.9Very low87 Ų87139.7 Ų139.772%0.71979%0.79SS**  83.6151.977.900000118.7
264A29.2Very low31.8Very low97 Ų97136.4 Ų136.480%0.80278%0.784SS**  trans66.1132.8-175.300000116.7
265E29.9Very low31.7Very low195 Ų195139.9 Ų139.991%0.91178%0.78SS**  cis106.799.413.8-170.8174.2-139.800115
266A28.3Very low31.7Very low107 Ų107138.2 Ų138.288%0.88478%0.775SS**  trans-161.6143.4154.200000110.7
267S34.2Very low30.6Very low111 Ų111138.3 Ų138.378%0.77678%0.777SS**  trans-141.2136.1176.2172.70000111
268K31.1Very low30.4Very low211 Ų211142.3 Ų142.392%0.91778%0.781SS**  trans-162.3158.7153.5-108.2146.9-170.2174.90113.1
269R31.2Very low30.3Very low223 Ų223147.2 Ų147.284%0.84279%0.786SS**  trans-92.8147.9-156.5-70.8174.4169.8160.1-5.3115
270L33.2Very low30.2Very low144 Ų144151.7 Ų151.775%0.75480%0.796SS**  38.7121.5126.6-53.6167.9000120.7
271S32.1Very low30.4Very low113 Ų113150.9 Ų150.979%0.7980%0.797SS**  58.7113.3121.6-48.30000121.9
272A26.8Very low30.4Very low101 Ų101153.1 Ų153.184%0.83581%0.807SS**  trans-159.9147.713100000112.6
273L36.1Very low30.5Very low164 Ų164151.6 Ų151.686%0.85981%0.807SS**  trans-89.5-173.9163.3-109.870.1000109.3
274P51.4Low30.8Very low98 Ų98152 Ų15264%0.63680%0.8SS**  cis-136.4-161.2-8.819.19.5000114.3
275Y25.2Very low31.1Very low189 Ų189156.1 Ų156.174%0.74180%0.803SS**  trans93.896156.2-84.4-89.7000122.9
276S27.7Very low30.8Very low98 Ų98154.8 Ų154.869%0.68580%0.802SS**  71.7162.9111.6-152.20000123.9
277C23.6Very low30.8Very low116 Ų116153.7 Ų153.778%0.78479%0.792SS**  trans71.3147.8175.6-57.60000115.8
278R26.7Very low30.6Very low237 Ų237156.3 Ų156.389%0.89479%0.792SS**  cis-131.5163.16-52.8169.1-172.3-169.20.9108.3
279Y27.6Very low31Very low203 Ų203151.7 Ų151.780%0.79678%0.784SS**  cis72.998.933.3-125.2-61.9000115.9
280E24.7Very low30.7Very low197 Ų197146.1 Ų146.192%0.92178%0.775SS**  trans-159.9137.8148.8-157.1147.3-117.300110.4
281N34.9Very low30.2Very low148 Ų148145 Ų14579%0.79178%0.779SS**  trans-172.7120.3-174.4-155.5-0.9000111
282Q31Very low30Very low184 Ų184147.7 Ų147.786%0.8678%0.776SS**  trans176.7159.6175.9-102.4174.554.700110
283H28.7Very low29.9Very low161 Ų161152 Ų15275%0.74578%0.779SS**  cis-163.9124-25.1-152.7-105.4000113.8
284V32.6Very low29.5Very low95 Ų95151.5 Ų151.558%0.57678%0.776SS**  trans34.1117.8140.6-166.80000123.7
285Q37.1Very low28.8Very low183 Ų183151.5 Ų151.586%0.85578%0.776SS**  trans62.4140.7143.6-65.8168.79.100125.2
286N22.9Very low28.7Very low168 Ų168149.7 Ų149.790%0.89878%0.776SS**  trans-154176.8130.6-140.3-39.3000111.9
287A27.3Very low28.5Very low83 Ų83152.7 Ų152.769%0.68678%0.779SS**  trans-147.7164.1-159.100000118.9
288Q31.1Very low28.7Very low166 Ų166152.2 Ų152.278%0.77677%0.773SS**  trans67.1144.1155.2-84.6-82.3-37.500118.8
289P38.2Very low29Very low115 Ų115145 Ų14575%0.74776%0.757SS**  -151.4134.592.837.7-18.4000118.8
290V25.2Very low29Very low105 Ų105140.2 Ų140.264%0.63674%0.742SS**  58.5120.2123-176.90000120.7
291S23.6Very low29.1Very low121 Ų121136.4 Ų136.485%0.84674%0.737SS**  -141.9155121-167.70000110.4
292K28.3Very low28.7Very low169 Ų169134 Ų13474%0.73573%0.732SS**  trans-131.4145.7-177-61174.5-178.3174.50109.4
293H24.1Very low28.5Very low192 Ų192133.5 Ų133.589%0.88973%0.729SS**  trans-163.6137.4135.5-108.3-70.9000113.3
294L28.3Very low28.6Very low154 Ų154131.1 Ų131.181%0.80673%0.726SS**  trans-117.4168.7156-85.4168.9000105.2
295P35.5Very low28.3Very low98 Ų98135.1 Ų135.164%0.63674%0.738SS**  cis-152.1-169.237.244.3-22.8000117.6
296M23.8Very low27.8Very low150 Ų150131.9 Ų131.974%0.73974%0.736SS**  trans62.6157.8149.2-74.3156.480.100118.5
297E22.6Very low28.1Very low161 Ų161129.3 Ų129.375%0.75273%0.73SS**  cis-154.4-179-15.6-127.3164.4-171.800110.8
298V28.7Very low28.1Very low107 Ų107131.9 Ų131.965%0.64873%0.729SS**  trans-124.6133.8179.9168.20000107
299P33.2Very low28Very low86 Ų86131.6 Ų131.656%0.55872%0.724SS**  -157.2153.594.839.4-17.7000121.5M795P299-M795 HydrophobicContact CB-CB 4.36Å; P299-M795 HydrophobicContact CB-CE 3.54Å; P299-M795 HydrophobicContact CB-SD 3.74Å; P299-M795 HydrophobicContact CG-CE 3.9Å; P299-M795 HydrophobicContact CG-SD 3.67Å
300Q26.8Very low27.8Very low102 Ų102135.1 Ų135.148%0.47773%0.728SS.*  trans-34.6142.4157.4177.3-160.96.100120.6F796 S797Q300-F796 VanDerWaalsContact OE1-C 3.25Å; Q300-F796 PolarHBondContact OE1-O 3.46Å; Q300-S797 VanDerWaalsContact CD-CB 3.47Å; Q300-S797 WeakPolarHBondContact CG-OG 3.34Å; Q300-S797 PolarHBondContact NE2-OG 3.05Å; Q300-S797 VanDerWaalsContact OE1-CB 3.25Å; Q300-S797 PolarHBondContact OE1-OG 3.12Å
301S27.5Very low28.2Very low116 Ų116137.6 Ų137.681%0.81173%0.73SS**  trans179.6158.813351.50000109.8
302S26.4Very low28.4Very low98 Ų98137.3 Ų137.369%0.68572%0.719SS**  cis-151.1146.27.547.80000112.7
303E25.6Very low28.4Very low174 Ų174135.1 Ų135.181%0.81372%0.72SS**  trans62.897.8130.6-147.3152.3-143.900120.6
304V31Very low28.6Very low111 Ų111134.9 Ų134.967%0.67371%0.713SS**  87.4146.991.4159.30000114.2
305H26.6Very low28.7Very low178 Ų178137.6 Ų137.682%0.82471%0.712SS**  cis-102.6-113.111.8-64.3-91.1000115.7
306S26.3Very low28.3Very low116 Ų116136.6 Ų136.681%0.81172%0.72SS**  cis-154.9179.113.5-66.10000113.3
307S29.1Very low28.6Very low113 Ų113139.7 Ų139.779%0.7973%0.73SS**  trans-100.4170.5-179.459.70000113.7
308E27.9Very low28.9Very low138 Ų138140.7 Ų140.765%0.64573%0.731SS**  cis-163.1162.722.8-148.6-163.7170.600113.6
309K30.1Very low28.9Very low159 Ų159142.8 Ų142.869%0.69173%0.734SS**  trans53121.4163.9-69.7151-179.71470119.5
310K33.7Very low28.5Very low189 Ų189145.6 Ų145.682%0.82274%0.74SS**  66.9136.963.7-76.1-176.1174.2171.90114.5
311K32.2Very low28.4Very low158 Ų158152.3 Ų152.369%0.68776%0.761SS**  cis-165.5161.523.1-128172163.6-82.30113
312D27.8Very low28.4Very low115 Ų115154 Ų15462%0.61576%0.756SS**  trans25.8145.4145.6-49.5-9.7000122.1
313T29.9Very low28.3Very low123 Ų123156.9 Ų156.976%0.75576%0.764SS**  cis-160-141-1.924.50000108.3
314Y28.6Very low29Very low187 Ų187154 Ų15473%0.73376%0.76SS**  cis-163.4110.75.9-165.6-88.7000116
315R30.3Very low28.8Very low210 Ų210156.2 Ų156.279%0.79277%0.768SS**  trans21.5128.2138.1-177.5-157.9-58.2-89.7-0.6121.9
316G27.2Very low29Very low77 Ų77155.4 Ų155.479%0.79477%0.765SS**  trans172123.5149.500000118.4
317F29.8Very low29.1Very low215 Ų215159 Ų15994%0.94377%0.766SS**  trans-117.4135.6168.8-97-97.2000109.9
318K27.5Very low29.1Very low182 Ų182160.2 Ų160.279%0.79177%0.768SS**  trans-178139.6130-110.9-168.9174.4-161.40117.3
319Q29.5Very low29.1Very low152 Ų152159 Ų15971%0.7178%0.775SS**  trans1.6156.2140.3-59.7173.4-59.200122.4
320Q24.9Very low29.3Very low144 Ų144159.8 Ų159.867%0.67379%0.785SS**  trans89.7116.2141.1-170.8174.4-8.700118.5
321W25.2Very low28.8Very low244 Ų244154 Ų15492%0.92478%0.778SS**  trans-125.2133.6156.2-8693.1000110.2
322Q28Very low28.7Very low151 Ų151154.2 Ų154.271%0.70678%0.782SS**  trans-125171.4165.8-77.8-179.2-45.500108
323N24.2Very low28.5Very low159 Ų159157.1 Ų157.185%0.8579%0.789SS**  trans-55.3142.3-171.3-64.4-24.8000113.8
324P40.3Very low28.8Very low114 Ų114156.4 Ų156.474%0.7479%0.789SS**  trans-80.1150.4172.234.1-34.7000111.7
325N26.8Very low28.7Very low156 Ų156157 Ų15783%0.83480%0.799SS**  trans-157.2147.9153.3-121.5-12.3000113.1
326E29.1Very low28.7Very low162 Ų162152.9 Ų152.976%0.75780%0.797SS**  trans53.286.2158-52.5-153104.400121.8
327K29.2Very low28.6Very low192 Ų192158.1 Ų158.184%0.83580%0.798SS**  48.6154.4115.5-64.4179.8175.9173.20123.4
328V29.4Very low28.4Very low138 Ų138154.9 Ų154.984%0.83679%0.789SS**  trans91.599.3155.3-165.40000118.4
329S27.6Very low28.4Very low113 Ų113153.2 Ų153.279%0.7979%0.788SS**  -161143106.8-166.60000110.9
330I34.4Very low28.3Very low175 Ų175152.7 Ų152.790%0.89779%0.789SS**  trans-142.5136.2-178.5-68.4-179.2000110.9
331G24Very low28.5Very low66 Ų66155 Ų15568%0.6880%0.797SS**  trans138.8157.7170.500000111.9
332Q28.1Very low28.7Very low163 Ų163152.1 Ų152.176%0.76279%0.794SS**  cis-160.2159.8-9.4-99.9173.710.100106
333F25.4Very low29.6Very low176 Ų176150 Ų15077%0.77279%0.793SS**  cis-149-171.34.5-123.9-44.8000109.6
334S34.9Very low29.7Very low108 Ų108152.2 Ų152.276%0.75579%0.791SS**  trans-94.9151.4-179-390000113.6
335E26Very low29.2Very low200 Ų200151.6 Ų151.694%0.93579%0.789SS**  trans-143165.3159.1-158.4157.4-131.700111.2
336V30.7Very low29.1Very low124 Ų124152.8 Ų152.875%0.75279%0.79SS**  trans-141.9151.2-151.5-171.60000113.6
337K24.6Very low29Very low186 Ų186150.1 Ų150.181%0.80979%0.789SS**  trans95.8147148.7-122.5178-173.9177.20120.2
338I26.8Very low28.9Very low147 Ų147146.7 Ų146.775%0.75478%0.784SS**  trans89.686156.2-55.2153.4000119.4
339N26.5Very low29.1Very low147 Ų147151.3 Ų151.379%0.78679%0.787SS**  10129.9126-175.816000120.2
340I27.5Very low29.4Very low142 Ų142151 Ų15173%0.72878%0.782SS**  trans-159.4131.2155.5-114.9156.9000115
341K30.2Very low29.1Very low191 Ų191148.6 Ų148.683%0.8378%0.78SS**  trans71.8124.2155-67175.5-175.2177.80124
342Q29Very low29.2Very low185 Ų185149.1 Ų149.186%0.86479%0.786SS**  trans-66.9-174.2154.1-104.4179.3-19.200113.1
343P47.6Very low29.1Very low107 Ų107149.3 Ų149.370%0.69579%0.792SS**  cis-129.3-166.717.519.410.1000114.1
344Y24.5Very low29.1Very low205 Ų205144.3 Ų144.380%0.80479%0.79SS**  cis-159.4150.328.4-138.9-78.7000112.9
345S30Very low29.1Very low100 Ų100145.7 Ų145.770%0.69979%0.794SS**  trans55.3144.1160.1450000120.4
346E25.5Very low29.2Very low182 Ų182145.1 Ų145.185%0.8579%0.791SS**  cis-150.1158.79.1-163.1142.9-135.900113.7
347S26.8Very low29.3Very low106 Ų106143.7 Ų143.774%0.74179%0.793SS**  trans-8.2155.1161.4-91.80000122.1
348V27.9Very low29.3Very low120 Ų120143 Ų14373%0.72780%0.797SS**  cis-167.1160.5-13.2112.90000109
349R33.5Very low29.4Very low235 Ų235141.7 Ų141.789%0.88780%0.795SS**  trans-112.1140.5160.5-83.3-168.3-178.6-169.91.8110.7
350P34.1Very low29.6Very low107 Ų107143.4 Ų143.470%0.69580%0.799SS**  -108.3149.4118.5-12.931.7000109.9
351S27.7Very low29.6Very low123 Ų123142.6 Ų142.686%0.8680%0.796SS**  cis69.9116.547.3-158.60000112.2
352G26.3Very low29.7Very low77 Ų77139.3 Ų139.379%0.79479%0.787SS**  trans165.9101.8-173.900000112.7
353D25.4Very low29.8Very low167 Ų167138.1 Ų138.189%0.89378%0.782SS**  trans-45.4158.9160.9-164.7-0.7000113.7
354G26.6Very low29Very low71 Ų71139.4 Ų139.473%0.73278%0.778SS**  trans173.761.4-175.200000118.1Q356G354-Q356 PolarHBondContact O-N 3.29Å
355V33.8Very low29.4Very low138 Ų138137.4 Ų137.484%0.83677%0.774SS**  trans-78.4109.7163.4176.50000110.3
356Q27.8Very low29.4Very low187 Ų187142.2 Ų142.287%0.87478%0.777SS**  trans-163.8141.3143.5-117.4170.614.600113.2G354G354-Q356 PolarHBondContact O-N 3.29Å
357A33Very low29.4Very low95 Ų95142.9 Ų142.979%0.78578%0.777SS**  trans-88.4142.916100000109.3
358L24.8Very low29.3Very low172 Ų172146.1 Ų146.190%0.90177%0.774SS**  trans-134129.5158.4-172.659.5000110.1
359V29.9Very low29.2Very low118 Ų118146.8 Ų146.872%0.71578%0.779SS**  trans-83.4132.3179.2171.20000109.8
360Q30.6Very low28.8Very low184 Ų184146.1 Ų146.186%0.8678%0.778SS**  trans-158.2103.4141.4-114.2165.417.700114.5
361N26.4Very low28.6Very low124 Ų124147.6 Ų147.666%0.66378%0.78SS**  trans39.6130135.7-93.3-12.9000122.8
362N32.9Very low29Very low123 Ų123147 Ų14766%0.65877%0.773SS**  trans67140.8137.9-62-27.4000118.3
363Q31.2Very low29.5Very low160 Ų160149 Ų14975%0.74877%0.766SS**  cis-162165.211.9-133.416931.600112
364E30.5Very low29.9Very low134 Ų134146.7 Ų146.763%0.62676%0.758SS**  trans73.8139.3154.2-65.8-142.3112.500124.4
365K32.4Very low30.3Very low162 Ų162150 Ų15070%0.70476%0.758SS**  trans64.359.9143.4-69.2162.6-177149.80119.6K367K365-K367 PolarHBondContact O-N 3.39Å
366R29.5Very low30.7Very low201 Ų201151.3 Ų151.376%0.75876%0.755SS**  trans-66.294.6156.7-174.1-171.2-67.6172.7-1.4111.3Y368R366-Y368 VanDerWaalsContact CD-CE2 3.41Å; R366-Y368 WeakPolarHBondContact CD-OH 3.48Å; R366-Y368 HydrophobicContact CG-CD2 4.28Å; R366-Y368 HydrophobicContact CG-CE2 3.99Å; R366-Y368 PolarHBondContact NH1-OH 3.45Å
367K26.3Very low31.4Very low196 Ų196149 Ų14985%0.85275%0.754SS**  trans-75.2127.5160.9-82.6-173.1174-177.10109.4K365K365-K367 PolarHBondContact O-N 3.39Å
368Y24.8Very low32.3Very low174 Ų174150.6 Ų150.668%0.68275%0.748SS**  trans-89.4113.5171.6-77.4-90.5000110.1R366R366-Y368 VanDerWaalsContact CD-CE2 3.41Å; R366-Y368 WeakPolarHBondContact CD-OH 3.48Å; R366-Y368 HydrophobicContact CG-CD2 4.28Å; R366-Y368 HydrophobicContact CG-CE2 3.99Å; R366-Y368 PolarHBondContact NH1-OH 3.45Å
369T25.3Very low33.3Very low135 Ų135146.9 Ų146.983%0.82873%0.729SS**  trans-90.7106.1166.3-52.90000108.4
370Y25.4Very low34.7Very low220 Ų220144.5 Ų144.586%0.86372%0.715SS**  trans-70135.4169.5-115.8-93.6000109.6
371N31.1Very low36Very low139 Ų139140.3 Ų140.374%0.74370%0.698SS**  trans-133.2101.5-179-171.513.7000110.3N373N371-N373 PolarHBondContact O-N 2.78Å; N371-N373 VanDerWaalsContact O-N 3.1Å
372P35.6Very low37.4Very low109 Ų109137 Ų13771%0.70869%0.687SS**  trans-8384-174.333.1-34.3000112T374P372-T374 PolarHBondContact O-N 2.65Å
373N36.5Very low39.4Very low121 Ų121135.3 Ų135.365%0.64768%0.682SS**  trans-82.692.2165.117914.7000110.5N371 N375N371-N373 PolarHBondContact O-N 2.78Å; N371-N373 VanDerWaalsContact O-N 3.1Å; N373-N375 PolarHBondContact OD1-ND2 2.95Å
374T33.9Very low41.8Very low118 Ų118133.1 Ų133.172%0.72467%0.67SS**  trans-127.376.2164.350.80000110.1P372 Q376P372-T374 PolarHBondContact O-N 2.65Å; T374-Q376 VanDerWaalsContact C-N 3.28Å; T374-Q376 PolarHBondContact O-N 2.89Å
375N34.8Very low44.4Very low139 Ų139133 Ų13374%0.74367%0.669SS**  trans-66.288.6164.5-78.7-80.4000109.5N373 V377N373-N375 PolarHBondContact OD1-ND2 2.95Å; N375-V377 PolarHBondContact O-N 3.26Å
376Q41.3Very low47.2Very low166 Ų166131.1 Ų131.178%0.77666%0.661SS**  trans-65.8117.3162.6-73.9-170.6-0.400108.3T374 I378T374-Q376 VanDerWaalsContact C-N 3.28Å; T374-Q376 PolarHBondContact O-N 2.89Å; Q376-I378 VanDerWaalsContact C-N 3.29Å; Q376-I378 PolarHBondContact O-N 3.1Å
377V43Very low50.1Low139 Ų139126.3 Ų126.384%0.84265%0.65SS**  trans-71.591170.3-179.80000107.6N375 D379N375-V377 PolarHBondContact O-N 3.26Å; V377-D379 PolarHBondContact O-N 2.79Å; V377-D379 VanDerWaalsContact O-N 3.16Å
378I51.5Low53.4Low129 Ų129121.7 Ų121.766%0.66264%0.638SS**  trans-63114.9168.7-61.3175.7000106.7Q376 T380Q376-I378 VanDerWaalsContact C-N 3.29Å; Q376-I378 PolarHBondContact O-N 3.1Å; I378-T380 HydrophobicContact CG2-CG2 4.39Å; I378-T380 PolarHBondContact O-N 3.25Å
379D46.6Very low56.6Low94 Ų94120.8 Ų120.850%0.50363%0.633SS.*  trans-74.977.9-176.3-169.5-2.4000111.5V377 N381 A382V377-D379 PolarHBondContact O-N 2.79Å; V377-D379 VanDerWaalsContact O-N 3.16Å; D379-N381 PolarHBondContact O-N 3.26Å; D379-N381 VanDerWaalsContact O-N 3.08Å; D379-N381 WeakPolarHBondContact OD1-CB 3.4Å; D379-N381 PolarHBondContact OD1-N 2.92Å; D379-N381 VanDerWaalsContact OD1-N 3.12Å; D379-A382 PolarHBondContact O-N 2.89Å
380T59Low59.9Low68 Ų68118.3 Ų118.342%0.41762%0.615SS.*Hα-helixtrans-62.4-12177.660.90000113.2I378 K384I378-T380 HydrophobicContact CG2-CG2 4.39Å; I378-T380 PolarHBondContact O-N 3.25Å; T380-K384 VanDerWaalsContact O-CD 3.3Å; T380-K384 WeakPolarHBondContact O-CD 3.17Å; T380-K384 WeakPolarHBondContact O-CG 3.3Å; T380-K384 PolarHBondContact O-N 3.24Å; T380-K384 VanDerWaalsContact O-N 3.08Å; T380-K384 PolarHBondContact OG1-NZ 3.28Å
381N57.6Low63.3Low96 Ų96112.3 Ų112.351%0.51360%0.597SS.*Hα-helixtrans-76.9-42.9177.7-55.3-44.2000110.6D379 T383 K384 E385D379-N381 PolarHBondContact O-N 3.26Å; D379-N381 VanDerWaalsContact O-N 3.08Å; D379-N381 WeakPolarHBondContact OD1-CB 3.4Å; D379-N381 PolarHBondContact OD1-N 2.92Å; D379-N381 VanDerWaalsContact OD1-N 3.12Å; N381-T383 PolarHBondContact O-N 2.92Å; N381-K384 PolarHBondContact O-N 3.46Å; N381-K384 VanDerWaalsContact O-N 3.11Å; N381-K384 PolarHBondContact OD1-NZ 3.3Å; N381-E385 PolarHBondContact O-N 3.26Å
382A57.3Low66.5Low53 Ų53113 Ų11344%0.43859%0.593SS.*Hα-helixtrans-56.9-37.7171.300000112.1D379 K386D379-A382 PolarHBondContact O-N 2.89Å; A382-K386 PolarHBondContact O-N 3.08Å; A382-K386 VanDerWaalsContact O-N 3.1Å
383T73.2Confident69.4Low88 Ų88110.7 Ų110.754%0.5458%0.58SS.*Hα-helixtrans-68.5-41.9175.2-31.10000112.4N381 K386 L387N381-T383 PolarHBondContact O-N 2.92Å; T383-K386 PolarHBondContact O-N 2.92Å; T383-L387 WeakPolarHBondContact O-CB 3.35Å; T383-L387 PolarHBondContact O-N 3.16Å
384K81.5Confident72.3Confident114 Ų114110.5 Ų110.550%0.49658%0.578SS.*Hα-helixtrans-63.6-44.1176.7-71.6159.6-166.1158.60111.6T380 N381 K386 L387 V388T380-K384 VanDerWaalsContact O-CD 3.3Å; T380-K384 WeakPolarHBondContact O-CD 3.17Å; T380-K384 WeakPolarHBondContact O-CG 3.3Å; T380-K384 PolarHBondContact O-N 3.24Å; T380-K384 VanDerWaalsContact O-N 3.08Å; T380-K384 PolarHBondContact OG1-NZ 3.28Å; N381-K384 PolarHBondContact O-N 3.46Å; N381-K384 VanDerWaalsContact O-N 3.11Å; N381-K384 PolarHBondContact OD1-NZ 3.3Å; K384-K386 VanDerWaalsContact C-N 3.32Å; K384-K386 PolarHBondContact O-N 3.11Å; K384-L387 PolarHBondContact O-N 3.08Å; K384-V388 WeakPolarHBondContact O-CG2 3.32Å; K384-V388 PolarHBondContact O-N 3.1Å
385E86.1Confident75.3Confident131 Ų131109.4 Ų109.461%0.61257%0.571SS**Hα-helixtrans-67.6-31177.1-71.5-166.9172.500113.3N381 R389N381-E385 PolarHBondContact O-N 3.26Å; E385-R389 WeakPolarHBondContact O-CG 3.41Å; E385-R389 PolarHBondContact O-N 3.43Å; E385-R389 PolarHBondContact O-NE 3.2Å; E385-R389 VanDerWaalsContact O-NE 3.1Å
386K90.1Very high78.2Confident123 Ų123107.2 Ų107.254%0.53556%0.557SS.*Hα-helixtrans-64.7-51.9168.7-171.6-173.2172.3-175.50110.3A382 T383 K384 V388 R389 D390A382-K386 PolarHBondContact O-N 3.08Å; A382-K386 VanDerWaalsContact O-N 3.1Å; T383-K386 PolarHBondContact O-N 2.92Å; K384-K386 VanDerWaalsContact C-N 3.32Å; K384-K386 PolarHBondContact O-N 3.11Å; K386-V388 VanDerWaalsContact C-N 3.31Å; K386-V388 PolarHBondContact O-N 3.1Å; K386-R389 WeakPolarHBondContact O-CA 3.39Å; K386-R389 WeakPolarHBondContact O-CB 3.44Å; K386-R389 PolarHBondContact O-N 3.25Å; K386-D390 WeakPolarHBondContact CE-OD2 3.48Å; K386-D390 VanDerWaalsContact O-CG 3.32Å; K386-D390 PolarHBondContact O-N 3.06Å
387L92.3Very high80.8Confident101 Ų101104 Ų10453%0.52954%0.544SS..Hα-helixtrans-57.6-40.8179.6-179.460.9000112.7T383 K384 R389 D390 I391T383-L387 WeakPolarHBondContact O-CB 3.35Å; T383-L387 PolarHBondContact O-N 3.16Å; K384-L387 PolarHBondContact O-N 3.08Å; L387-R389 PolarHBondContact O-N 3.03Å; L387-D390 PolarHBondContact O-N 3.23Å; L387-I391 HydrophobicContact CD1-CD1 3.97Å; L387-I391 HydrophobicContact CD1-CG1 4.19Å; L387-I391 HydrophobicContact CG-CD1 3.86Å; L387-I391 HydrophobicContact CG-CG1 4.49Å; L387-I391 WeakPolarHBondContact O-CB 3.46Å; L387-I391 VanDerWaalsContact O-CG1 3.25Å; L387-I391 WeakPolarHBondContact O-CG1 3.48Å; L387-I391 PolarHBondContact O-N 3.05Å
388V93.9Very high83.3Confident98 Ų98104.7 Ų104.759%0.59454%0.535SS*.Hα-helixtrans-64.2-38.1175.6169.30000111.9K384 K386 K392K384-V388 WeakPolarHBondContact O-CG2 3.32Å; K384-V388 PolarHBondContact O-N 3.1Å; K386-V388 VanDerWaalsContact C-N 3.31Å; K386-V388 PolarHBondContact O-N 3.1Å; V388-K392 WeakPolarHBondContact O-CB 3.46Å; V388-K392 PolarHBondContact O-N 3.09Å
389R93.6Very high85.4Confident155 Ų155105.3 Ų105.359%0.58553%0.533SS*.Hα-helixtrans-67.7-42.7173.3-76.2179.8-75.1168.4-8.4112E385 K386 L387 K392 S393E385-R389 WeakPolarHBondContact O-CG 3.41Å; E385-R389 PolarHBondContact O-N 3.43Å; E385-R389 PolarHBondContact O-NE 3.2Å; E385-R389 VanDerWaalsContact O-NE 3.1Å; K386-R389 WeakPolarHBondContact O-CA 3.39Å; K386-R389 WeakPolarHBondContact O-CB 3.44Å; K386-R389 PolarHBondContact O-N 3.25Å; L387-R389 PolarHBondContact O-N 3.03Å; R389-K392 PolarHBondContact O-N 3.47Å; R389-S393 WeakPolarHBondContact O-CB 3.49Å; R389-S393 PolarHBondContact O-N 3.19Å
390D94.4Very high87.7Confident84 Ų84106.9 Ų106.945%0.44954%0.535SS..Hα-helixtrans-65.3-42.8179.8-65.8-17.6000111.2K386 L387 S393 L394K386-D390 WeakPolarHBondContact CE-OD2 3.48Å; K386-D390 VanDerWaalsContact O-CG 3.32Å; K386-D390 PolarHBondContact O-N 3.06Å; L387-D390 PolarHBondContact O-N 3.23Å; D390-S393 WeakPolarHBondContact O-CB 3.25Å; D390-S393 PolarHBondContact O-N 3.33Å; D390-L394 WeakPolarHBondContact O-CB 3.42Å; D390-L394 PolarHBondContact O-N 2.89Å
391I97.3Very high89.3Confident93 Ų93110.5 Ų110.548%0.47755%0.546SS..Hα-helixtrans-61.4-45.1172.6-70167.2000111.1L387 S393 L394 V395L387-I391 HydrophobicContact CD1-CD1 3.97Å; L387-I391 HydrophobicContact CD1-CG1 4.19Å; L387-I391 HydrophobicContact CG-CD1 3.86Å; L387-I391 HydrophobicContact CG-CG1 4.49Å; L387-I391 WeakPolarHBondContact O-CB 3.46Å; L387-I391 VanDerWaalsContact O-CG1 3.25Å; L387-I391 WeakPolarHBondContact O-CG1 3.48Å; L387-I391 PolarHBondContact O-N 3.05Å; I391-S393 VanDerWaalsContact C-N 3.33Å; I391-S393 PolarHBondContact O-N 3.49Å; I391-L394 PolarHBondContact O-N 2.95Å; I391-V395 WeakPolarHBondContact O-CG2 3.41Å; I391-V395 PolarHBondContact O-N 3.33Å
392K96.9Very high90.6Very high153 Ų153109 Ų10967%0.66554%0.543SS*.Hα-helixtrans-61-41.8177.3-175.6-179.4177.3-175.30111.5V388 R389 V395 E396V388-K392 WeakPolarHBondContact O-CB 3.46Å; V388-K392 PolarHBondContact O-N 3.09Å; R389-K392 PolarHBondContact O-N 3.47Å; K392-V395 PolarHBondContact O-N 3.24Å; K392-E396 PolarHBondContact O-N 3.08Å; K392-E396 VanDerWaalsContact O-N 3.08Å
393S96.3Very high92.1Very high61 Ų61109.9 Ų109.943%0.42754%0.538SS..Hα-helixtrans-61.8-47.5174.9-173.40000111.7R389 D390 I391 V395 E396 I397R389-S393 WeakPolarHBondContact O-CB 3.49Å; R389-S393 PolarHBondContact O-N 3.19Å; D390-S393 WeakPolarHBondContact O-CB 3.25Å; D390-S393 PolarHBondContact O-N 3.33Å; I391-S393 VanDerWaalsContact C-N 3.33Å; I391-S393 PolarHBondContact O-N 3.49Å; S393-V395 VanDerWaalsContact C-N 3.33Å; S393-V395 PolarHBondContact O-N 2.93Å; S393-E396 PolarHBondContact O-N 3.45Å; S393-E396 VanDerWaalsContact O-N 3.08Å; S393-I397 WeakPolarHBondContact O-CG1 3.46Å; S393-I397 PolarHBondContact O-N 3.36Å
394L97.1Very high92.9Very high117 Ų117109.9 Ų109.961%0.61353%0.534SS*.Hα-helixtrans-60.5-39.4178.2-176.261.5000112.7D390 I391 I397 K398D390-L394 WeakPolarHBondContact O-CB 3.42Å; D390-L394 PolarHBondContact O-N 2.89Å; I391-L394 PolarHBondContact O-N 2.95Å; L394-I397 PolarHBondContact O-N 3.36Å; L394-K398 WeakPolarHBondContact O-CB 3.46Å; L394-K398 PolarHBondContact O-N 3.45Å
395V96.9Very high92.9Very high96 Ų96107.2 Ų107.258%0.58253%0.533SS*.Hα-helixtrans-65-39.6173.8171.60000111.6I391 K392 S393 K398 K399I391-V395 WeakPolarHBondContact O-CG2 3.41Å; I391-V395 PolarHBondContact O-N 3.33Å; K392-V395 PolarHBondContact O-N 3.24Å; S393-V395 VanDerWaalsContact C-N 3.33Å; S393-V395 PolarHBondContact O-N 2.93Å; V395-K398 PolarHBondContact O-N 3.08Å; V395-K399 WeakPolarHBondContact O-CB 3.45Å; V395-K399 PolarHBondContact O-N 3.29Å
396E96Very high92.7Very high93 Ų93109.4 Ų109.444%0.43554%0.536SS..Hα-helixtrans-68-39.9175.9-164.4-178.8135.100112.2K392 S393 K399 K400K392-E396 PolarHBondContact O-N 3.08Å; K392-E396 VanDerWaalsContact O-N 3.08Å; S393-E396 PolarHBondContact O-N 3.45Å; S393-E396 VanDerWaalsContact O-N 3.08Å; E396-K399 WeakPolarHBondContact O-CB 3.36Å; E396-K399 PolarHBondContact O-N 2.93Å; E396-K400 WeakPolarHBondContact O-CG 3.02Å; E396-K400 PolarHBondContact O-N 3.28Å; E396-K400 WeakPolarHBondContact OE1-CE 3.06Å; E396-K400 IonicContact OE1-NZ 2.66Å; E396-K400 PolarHBondContact OE1-NZ 3.17Å
397I96.8Very high92.3Very high98 Ų98109.8 Ų109.850%0.50354%0.538SS..Hα-helixtrans-62-47.2173.3-67.3164.9000110.2S393 L394 K399 K400 F401S393-I397 WeakPolarHBondContact O-CG1 3.46Å; S393-I397 PolarHBondContact O-N 3.36Å; L394-I397 PolarHBondContact O-N 3.36Å; I397-K399 VanDerWaalsContact C-N 3.27Å; I397-K399 PolarHBondContact O-N 3.44Å; I397-K400 PolarHBondContact O-N 2.87Å; I397-K400 VanDerWaalsContact O-N 3.17Å; I397-F401 WeakPolarHBondContact O-CB 3.34Å; I397-F401 PolarHBondContact O-N 2.86Å
398K95.3Very high91.9Very high154 Ų154109.6 Ų109.667%0.6754%0.536SS*.Hα-helixtrans-58.2-39.5174.6-174.8173.1-178.9173.60111.5L394 V395 S402L394-K398 WeakPolarHBondContact O-CB 3.46Å; L394-K398 PolarHBondContact O-N 3.45Å; V395-K398 PolarHBondContact O-N 3.08Å; K398-S402 WeakPolarHBondContact O-CB 3.46Å; K398-S402 PolarHBondContact O-N 3.01Å; K398-S402 PolarHBondContact O-OG 2.88Å
399K96.2Very high90.5Very high142 Ų142114.1 Ų114.162%0.61755%0.548SS*.Hα-helixtrans-65-46.4174.6-176.6-176.8175.2-173.90112V395 E396 I397 S402 E403V395-K399 WeakPolarHBondContact O-CB 3.45Å; V395-K399 PolarHBondContact O-N 3.29Å; E396-K399 WeakPolarHBondContact O-CB 3.36Å; E396-K399 PolarHBondContact O-N 2.93Å; I397-K399 VanDerWaalsContact C-N 3.27Å; I397-K399 PolarHBondContact O-N 3.44Å; K399-S402 PolarHBondContact O-N 3.33Å; K399-E403 PolarHBondContact O-N 2.89Å
400K93.6Very high89.5Confident126 Ų126112 Ų11255%0.54855%0.547SS..Hα-helixtrans-61.7-43.3177.2-74172.4-176.6167.30111.7E396 I397 E403 L404E396-K400 WeakPolarHBondContact O-CG 3.02Å; E396-K400 PolarHBondContact O-N 3.28Å; E396-K400 WeakPolarHBondContact OE1-CE 3.06Å; E396-K400 IonicContact OE1-NZ 2.66Å; E396-K400 PolarHBondContact OE1-NZ 3.17Å; I397-K400 PolarHBondContact O-N 2.87Å; I397-K400 VanDerWaalsContact O-N 3.17Å; K400-E403 PolarHBondContact O-N 2.86Å; K400-L404 WeakPolarHBondContact O-CB 3.48Å; K400-L404 PolarHBondContact O-N 2.63Å
401F92.8Very high88Confident144 Ų144112.2 Ų112.263%0.63255%0.548SS*.Hα-helixtrans-65-41.5174.5-168.1-94.2000112.3I397 E403 L404 A405I397-F401 WeakPolarHBondContact O-CB 3.34Å; I397-F401 PolarHBondContact O-N 2.86Å; F401-E403 VanDerWaalsContact C-N 3.33Å; F401-E403 PolarHBondContact O-N 2.66Å; F401-L404 WeakPolarHBondContact O-CB 3.36Å; F401-L404 PolarHBondContact O-N 3.36Å; F401-A405 WeakPolarHBondContact O-CB 3.33Å; F401-A405 PolarHBondContact O-N 3.29Å
402S84.4Confident86.9Confident65 Ų65115.3 Ų115.346%0.45556%0.558SS.*Hα-helixtrans-63.7-38.2175.4-54.50000112.1K398 K399 R406K398-S402 WeakPolarHBondContact O-CB 3.46Å; K398-S402 PolarHBondContact O-N 3.01Å; K398-S402 PolarHBondContact O-OG 2.88Å; K399-S402 PolarHBondContact O-N 3.33Å; S402-R406 WeakPolarHBondContact O-CB 3.46Å; S402-R406 PolarHBondContact O-N 3.3Å
403E89.3Confident85Confident72 Ų72111.7 Ų111.734%0.33655%0.552SS.*Hα-helixtrans-73.2-33.6175.6-161.9-177.9142.500112.1K399 K400 F401 R406 K407K399-E403 PolarHBondContact O-N 2.89Å; K400-E403 PolarHBondContact O-N 2.86Å; F401-E403 VanDerWaalsContact C-N 3.33Å; F401-E403 PolarHBondContact O-N 2.66Å; E403-R406 PolarHBondContact O-N 3.2Å; E403-R406 IonicContact OE1-NH2 2.65Å; E403-K407 HydrophobicContact CG-CD 4.46Å; E403-K407 WeakPolarHBondContact O-CB 3.33Å; E403-K407 VanDerWaalsContact O-CG 3.31Å; E403-K407 WeakPolarHBondContact O-CG 3.41Å; E403-K407 PolarHBondContact O-N 3.21Å; E403-K407 WeakPolarHBondContact OE1-CE 3.45Å; E403-K407 IonicContact OE1-NZ 3.83Å; E403-K407 PolarHBondContact OE1-NZ 3.26Å
404L89.4Confident83.8Confident87 Ų87114.4 Ų114.446%0.45556%0.561SS.*Hα-helixtrans-63-49.7171-179.662.1000110.6K400 F401 R406 K407 I408K400-L404 WeakPolarHBondContact O-CB 3.48Å; K400-L404 PolarHBondContact O-N 2.63Å; F401-L404 WeakPolarHBondContact O-CB 3.36Å; F401-L404 PolarHBondContact O-N 3.36Å; L404-R406 PolarHBondContact O-N 3.17Å; L404-K407 CarbonylContact O-C 3.54Å; L404-K407 WeakPolarHBondContact O-CA 3.31Å; L404-K407 PolarHBondContact O-N 3.13Å; L404-I408 HydrophobicContact CD1-CD1 4.1Å; L404-I408 HydrophobicContact CD1-CG1 4.12Å; L404-I408 HydrophobicContact CG-CD1 3.86Å; L404-I408 HydrophobicContact CG-CG1 4.3Å; L404-I408 WeakPolarHBondContact O-CG1 3.45Å; L404-I408 PolarHBondContact O-N 3.39Å
405A82.4Confident82.4Confident58 Ų58112 Ų11248%0.47955%0.549SS..Hα-helixtrans-58.6-31.8174.700000112.8F401F401-A405 WeakPolarHBondContact O-CB 3.33Å; F401-A405 PolarHBondContact O-N 3.29Å
406R80.7Confident81Confident177 Ų177112.2 Ų112.267%0.66854%0.544SS*.Hα-helixtrans-75.2-27.4172.4-169.1-173.564.877.4-1.2113.5S402 E403 L404S402-R406 WeakPolarHBondContact O-CB 3.46Å; S402-R406 PolarHBondContact O-N 3.3Å; E403-R406 PolarHBondContact O-N 3.2Å; E403-R406 IonicContact OE1-NH2 2.65Å; L404-R406 PolarHBondContact O-N 3.17Å
407K82.6Confident79.6Confident132 Ų132111.8 Ų111.857%0.57456%0.557SS**Hα-helixtrans-84.2-34.3177-77.4170.6-178.2166.50112.4E403 L404 K409E403-K407 HydrophobicContact CG-CD 4.46Å; E403-K407 WeakPolarHBondContact O-CB 3.33Å; E403-K407 VanDerWaalsContact O-CG 3.31Å; E403-K407 WeakPolarHBondContact O-CG 3.41Å; E403-K407 PolarHBondContact O-N 3.21Å; E403-K407 WeakPolarHBondContact OE1-CE 3.45Å; E403-K407 IonicContact OE1-NZ 3.83Å; E403-K407 PolarHBondContact OE1-NZ 3.26Å; L404-K407 CarbonylContact O-C 3.54Å; L404-K407 WeakPolarHBondContact O-CA 3.31Å; L404-K407 PolarHBondContact O-N 3.13Å; K407-K409 PolarHBondContact O-N 2.96Å
408I83.6Confident78.3Confident96 Ų96110.3 Ų110.349%0.49256%0.559SS.*SBendtrans-68.586.8169-58.6168.9000107.1L404 I410L404-I408 HydrophobicContact CD1-CD1 4.1Å; L404-I408 HydrophobicContact CD1-CG1 4.12Å; L404-I408 HydrophobicContact CG-CD1 3.86Å; L404-I408 HydrophobicContact CG-CG1 4.3Å; L404-I408 WeakPolarHBondContact O-CG1 3.45Å; L404-I408 PolarHBondContact O-N 3.39Å; I408-I410 HydrophobicContact CG2-CG1 3.66Å; I408-I410 PolarHBondContact O-N 2.98Å
409K65.6Low76.2Confident193 Ų193105.6 Ų105.684%0.83955%0.554SS**  trans-72.570.3174.5-173.8-169174.9-172.90108.9K407 N411K407-K409 PolarHBondContact O-N 2.96Å; K409-N411 PolarHBondContact O-N 2.9Å
410I72Confident74.1Confident111 Ų111103.5 Ų103.557%0.56956%0.556SS**  trans-54.2113.1178-50.2175.8000107.3I408 K412 L415I408-I410 HydrophobicContact CG2-CG1 3.66Å; I408-I410 PolarHBondContact O-N 2.98Å; I410-K412 PolarHBondContact O-N 2.65Å; I410-K412 VanDerWaalsContact O-N 3.09Å; I410-L415 HydrophobicContact CB-CD1 4.41Å; I410-L415 HydrophobicContact CG2-CD1 3.53Å; I410-L415 HydrophobicContact CG2-CD2 4.45Å; I410-L415 HydrophobicContact CG2-CG 3.71Å
411N63.2Low71.8Confident89 Ų8999.4 Ų99.448%0.47654%0.544SS..  trans-70.2115.4-173.2-1773000108.8K409 S413 L414 L415K409-N411 PolarHBondContact O-N 2.9Å; N411-S413 VanDerWaalsContact CG-OG 3.31Å; N411-S413 PolarHBondContact ND2-OG 3.04Å; N411-S413 PolarHBondContact O-N 2.9Å; N411-S413 VanDerWaalsContact O-N 3.14Å; N411-S413 PolarHBondContact OD1-N 2.89Å; N411-S413 VanDerWaalsContact OD1-N 3.12Å; N411-S413 PolarHBondContact OD1-OG 3.14Å; N411-S413 VanDerWaalsContact OD1-OG 3.14Å; N411-L414 HydrophobicContact CB-CB 4.06Å; N411-L414 WeakPolarHBondContact O-CA 3.48Å; N411-L414 WeakPolarHBondContact O-CB 3.45Å; N411-L414 PolarHBondContact O-N 3.41Å; N411-L415 PolarHBondContact O-N 3.3Å; N411-L415 VanDerWaalsContact O-N 3.07Å
412K73.9Confident69.6Low158 Ų158102 Ų10269%0.68756%0.555SS**Hα-helixtrans-56.6-31.4179.6-172.9172.5-178.9175.70112.1I410 L414 M416I410-K412 PolarHBondContact O-N 2.65Å; I410-K412 VanDerWaalsContact O-N 3.09Å; K412-L414 VanDerWaalsContact C-N 3.3Å; K412-L414 PolarHBondContact O-N 2.92Å; K412-M416 HydrophobicContact CG-CG 4.4Å; K412-M416 WeakPolarHBondContact O-CB 3.5Å; K412-M416 WeakPolarHBondContact O-CG 3.35Å; K412-M416 PolarHBondContact O-N 3.25Å
413S58Low67.6Low76 Ų76103.7 Ų103.753%0.53156%0.562SS.*Hα-helixtrans-69.3-28.7174.873.30000112.9N411 A417N411-S413 VanDerWaalsContact CG-OG 3.31Å; N411-S413 PolarHBondContact ND2-OG 3.04Å; N411-S413 PolarHBondContact O-N 2.9Å; N411-S413 VanDerWaalsContact O-N 3.14Å; N411-S413 PolarHBondContact OD1-N 2.89Å; N411-S413 VanDerWaalsContact OD1-N 3.12Å; N411-S413 PolarHBondContact OD1-OG 3.14Å; N411-S413 VanDerWaalsContact OD1-OG 3.14Å; S413-A417 VanDerWaalsContact O-CB 3.23Å; S413-A417 WeakPolarHBondContact O-CB 3.35Å; S413-A417 PolarHBondContact O-N 3.43Å
414L70.1Confident65.2Low118 Ų118104 Ų10462%0.61858%0.578SS**Hα-helixtrans-76.9-41.7176.7-167.168.1000111.3N411 K412 M416 A417 A418N411-L414 HydrophobicContact CB-CB 4.06Å; N411-L414 WeakPolarHBondContact O-CA 3.48Å; N411-L414 WeakPolarHBondContact O-CB 3.45Å; N411-L414 PolarHBondContact O-N 3.41Å; K412-L414 VanDerWaalsContact C-N 3.3Å; K412-L414 PolarHBondContact O-N 2.92Å; L414-M416 VanDerWaalsContact C-N 3.31Å; L414-M416 PolarHBondContact O-N 2.85Å; L414-A417 PolarHBondContact O-N 2.93Å; L414-A418 VanDerWaalsContact O-CB 3.31Å; L414-A418 WeakPolarHBondContact O-CB 3.43Å; L414-A418 PolarHBondContact O-N 3.22Å
415L67.2Low62.8Low68 Ų68106.7 Ų106.736%0.35659%0.592SS.*Hα-helixtrans-60.2-38.9171-86.7171.9000112.8I410 N411 G419 C420 S421I410-L415 HydrophobicContact CB-CD1 4.41Å; I410-L415 HydrophobicContact CG2-CD1 3.53Å; I410-L415 HydrophobicContact CG2-CD2 4.45Å; I410-L415 HydrophobicContact CG2-CG 3.71Å; N411-L415 PolarHBondContact O-N 3.3Å; N411-L415 VanDerWaalsContact O-N 3.07Å; L415-G419 PolarHBondContact O-N 3.33Å; L415-C420 HydrophobicContact CD2-CB 3.85Å; L415-C420 PolarHBondContact O-N 3.07Å; L415-S421 PolarHBondContact O-OG 3.45Å
416M68Low60.6Low99 Ų99110 Ų11049%0.48861%0.606SS.*Hα-helixtrans-68.9-40.8174.3-69-72.8-5000111.6K412 L414 G419 S421K412-M416 HydrophobicContact CG-CG 4.4Å; K412-M416 WeakPolarHBondContact O-CB 3.5Å; K412-M416 WeakPolarHBondContact O-CG 3.35Å; K412-M416 PolarHBondContact O-N 3.25Å; L414-M416 VanDerWaalsContact C-N 3.31Å; L414-M416 PolarHBondContact O-N 2.85Å; M416-G419 PolarHBondContact O-N 3.45Å; M416-S421 PolarHBondContact SD-OG 3.36Å
417A66.1Low58.2Low85 Ų85106 Ų10670%0.70261%0.606SS**Hα-helixtrans-69.8-33.9178.700000113.2S413 L414 G419S413-A417 VanDerWaalsContact O-CB 3.23Å; S413-A417 WeakPolarHBondContact O-CB 3.35Å; S413-A417 PolarHBondContact O-N 3.43Å; L414-A417 PolarHBondContact O-N 2.93Å; A417-G419 PolarHBondContact O-N 2.84Å
418A69.6Low55.5Low67 Ų67110.7 Ų110.755%0.55462%0.622SS**THydrogen-bonded Turntrans-77.80.6174.500000113.6L414 C420L414-A418 VanDerWaalsContact O-CB 3.31Å; L414-A418 WeakPolarHBondContact O-CB 3.43Å; L414-A418 PolarHBondContact O-N 3.22Å; A418-C420 PolarHBondContact O-N 2.85Å; A418-C420 VanDerWaalsContact O-N 3.07Å; A418-C420 PolarHBondContact O-SG 3.06Å
419G52.2Low53.1Low55 Ų55111.6 Ų111.657%0.56763%0.632SS**THydrogen-bonded Turntrans71.8-6.4-179.200000115.6L415 M416 A417 S421L415-G419 PolarHBondContact O-N 3.33Å; M416-G419 PolarHBondContact O-N 3.45Å; A417-G419 PolarHBondContact O-N 2.84Å; G419-S421 PolarHBondContact O-N 3.07Å; G419-S421 VanDerWaalsContact O-N 3.13Å
420C51.3Low51.1Low97 Ų97110 Ų11066%0.65563%0.628SS**  trans-65.1-17.2-174.2-56.20000114.4L415 A418L415-C420 HydrophobicContact CD2-CB 3.85Å; L415-C420 PolarHBondContact O-N 3.07Å; A418-C420 PolarHBondContact O-N 2.85Å; A418-C420 VanDerWaalsContact O-N 3.07Å; A418-C420 PolarHBondContact O-SG 3.06Å
421S45.6Very low49.1Very low40 Ų40110.3 Ų110.328%0.2864%0.637SS.*  trans-109.772177.558.40000112.5L415 M416 G419 T423L415-S421 PolarHBondContact O-OG 3.45Å; M416-S421 PolarHBondContact SD-OG 3.36Å; G419-S421 PolarHBondContact O-N 3.07Å; G419-S421 VanDerWaalsContact O-N 3.13Å; S421-T423 PolarHBondContact O-N 3.4Å; S421-T423 VanDerWaalsContact O-N 3.15Å
422K46Very low47.3Very low200 Ų200113.1 Ų113.187%0.8765%0.65SS**  trans-63.9107.2166.2-164175.1-171176.90108.6A424K422-A424 PolarHBondContact O-N 3.4Å
423T43.3Very low45.2Very low99 Ų99114.1 Ų114.161%0.60766%0.657SS**  trans-70.289.7-17741.80000111.6S421 N425S421-T423 PolarHBondContact O-N 3.4Å; S421-T423 VanDerWaalsContact O-N 3.15Å; T423-N425 PolarHBondContact O-N 3.25Å
424A38.8Very low43.7Very low80 Ų80119.4 Ų119.466%0.66167%0.673SS**  trans-7166.2166.800000110.7K422 T426K422-A424 PolarHBondContact O-N 3.4Å; A424-T426 PolarHBondContact O-N 3.37Å
425N39.6Very low41.7Very low143 Ų143118.2 Ų118.277%0.76567%0.674SS**  trans-76.249.1168.9-74.2-10.6000110.7T423 S427T423-N425 PolarHBondContact O-N 3.25Å; N425-S427 VanDerWaalsContact C-N 3.26Å; N425-S427 PolarHBondContact O-N 3Å; N425-S427 VanDerWaalsContact O-N 3.14Å
426T34.5Very low39.9Very low126 Ų126122.4 Ų122.477%0.77369%0.692SS**  trans-82.876166.746.40000108.3A424 Y428A424-T426 PolarHBondContact O-N 3.37Å; T426-Y428 PolarHBondContact O-N 3.47Å; T426-Y428 VanDerWaalsContact O-N 3.1Å
427S30.5Very low38Very low95 Ų95126.7 Ų126.766%0.66471%0.709SS**  trans-61.9110.2168.9510000109.1N425 T429N425-S427 VanDerWaalsContact C-N 3.26Å; N425-S427 PolarHBondContact O-N 3Å; N425-S427 VanDerWaalsContact O-N 3.14Å; S427-T429 PolarHBondContact O-N 3.36Å; S427-T429 PolarHBondContact O-OG1 2.98Å
428Y27.1Very low36.1Very low230 Ų230128.3 Ų128.390%0.90272%0.715SS**  trans-52.3109.9-180-155.7-92.8000109.6T426T426-Y428 PolarHBondContact O-N 3.47Å; T426-Y428 VanDerWaalsContact O-N 3.1Å
429T31.7Very low34.3Very low115 Ų115128.6 Ų128.671%0.70672%0.717SS**  trans-122.9111.8179.8-51.10000106.9S427S427-T429 PolarHBondContact O-N 3.36Å; S427-T429 PolarHBondContact O-OG1 2.98Å
430E25.2Very low33.2Very low160 Ų160136.1 Ų136.175%0.74873%0.734SS**  trans-67.8120.8-172-169.5169.7-144.500110.9I432E430-I432 PolarHBondContact O-N 3.38Å
431P29.1Very low32.1Very low117 Ų117139.7 Ų139.776%0.7674%0.741SS**  trans-86.494.8-171.532.5-33.8000112.3Q433P431-Q433 PolarHBondContact O-N 2.94Å
432I25.9Very low31.2Very low147 Ų147146.6 Ų146.675%0.75477%0.771SS**  trans-75.7116.9163.8-61.4178.3000108.6E430E430-I432 PolarHBondContact O-N 3.38Å
433Q29.2Very low30.4Very low180 Ų180142.4 Ų142.484%0.84177%0.767SS**  trans-77.2126.8178.5-69.2-178.6-19.600112.2P431P431-Q433 PolarHBondContact O-N 2.94Å
434H27Very low29.8Very low187 Ų187141.5 Ų141.587%0.86677%0.77SS**  trans-143.3139.5145.5-79.5-65.8000109.5
435S28.1Very low29.4Very low92 Ų92146.9 Ų146.964%0.64378%0.778SS**  trans-72.7169.8175-133.30000110.8
436E28.7Very low29Very low156 Ų156147.2 Ų147.273%0.72978%0.78SS**  cis-153.3-175.418.7-153132.3-98.900113.4
437F28.4Very low29Very low190 Ų190144.2 Ų144.283%0.83377%0.774SS**  trans-78.6156.4-166.5-64.1-95.5000116.8
438S26.5Very low29.8Very low119 Ų119146.8 Ų146.883%0.83278%0.78SS**  -156149.4118.7-1670000110.8
439A30.6Very low30.4Very low72 Ų72142.4 Ų142.460%0.59577%0.772SS**  trans-128.6146-170.500000113
440K30.4Very low30.8Very low213 Ų213141.5 Ų141.593%0.92677%0.77SS**  trans-142.7135.7149.7-151.9165.2-171.5174.60112.6
441E28.8Very low32.2Very low172 Ų172136.2 Ų136.280%0.80475%0.751SS**  trans-79136.8-170174.3-171.8-178.200113.4
442M25.8Very low34Very low186 Ų186138 Ų13892%0.91675%0.751SS**  trans-143.3125.5140.7-77.3-162.576.100109.1
443S28.3Very low35.9Very low111 Ų111138 Ų13878%0.77675%0.747SS**  trans-73.1129.1-176.6-179.60000112.5
444A31.7Very low37.5Very low81 Ų81134.5 Ų134.567%0.66973%0.734SS**  trans-113.4115.4166.300000108.9N446A444-N446 PolarHBondContact O-N 3.37Å
445K31.1Very low39.5Very low193 Ų193130.2 Ų130.284%0.83972%0.717SS**  trans-76.482.9-171.4-170.4179.6179.4-178.80111.7G447K445-G447 VanDerWaalsContact C-N 3.33Å; K445-G447 PolarHBondContact O-N 3.22Å
446N31.1Very low41.3Very low149 Ų149127.9 Ų127.980%0.79770%0.703SS**  trans-6888.2170.1-76.8-8.5000110.3A444 N448A444-N446 PolarHBondContact O-N 3.37Å; N446-N448 VanDerWaalsContact C-N 3.27Å; N446-N448 PolarHBondContact O-N 2.92Å
447G34.9Very low43.2Very low63 Ų63124.3 Ų124.365%0.64969%0.692SS**  trans-68.878.1177.400000112.7K445 D449K445-G447 VanDerWaalsContact C-N 3.33Å; K445-G447 PolarHBondContact O-N 3.22Å; G447-D449 VanDerWaalsContact C-N 3.34Å
448N45.8Very low44.7Very low149 Ų149118.7 Ų118.780%0.79768%0.676SS**  trans-102.149.8164.9106.9112.8000110.2N446 C450N446-N448 VanDerWaalsContact C-N 3.27Å; N446-N448 PolarHBondContact O-N 2.92Å; N448-C450 PolarHBondContact O-N 2.81Å
449D41.1Very low46.5Very low138 Ų138118.4 Ų118.474%0.73866%0.664SS**  trans-87.580.3173.1-62.2-55.7000108.7G447 S451G447-D449 VanDerWaalsContact C-N 3.34Å; D449-S451 VanDerWaalsContact C-N 3.35Å; D449-S451 PolarHBondContact O-N 2.83Å
450C38.9Very low47.7Very low97 Ų97118.9 Ų118.966%0.65566%0.663SS**  trans-66.299.7163.5-1750000106.9N448 M452N448-C450 PolarHBondContact O-N 2.81Å; C450-M452 PolarHBondContact O-N 2.79Å
451S55.3Low48.9Very low49 Ų49114.9 Ų114.934%0.34365%0.651SS.*  trans-62.2137-168.771.50000110.8D449 E453 L454 L455D449-S451 VanDerWaalsContact C-N 3.35Å; D449-S451 PolarHBondContact O-N 2.83Å; S451-E453 PolarHBondContact O-N 3.21Å; S451-E453 VanDerWaalsContact O-N 3.11Å; S451-L454 WeakPolarHBondContact O-CB 3.47Å; S451-L454 PolarHBondContact O-N 3.46Å; S451-L454 PolarHBondContact OG-N 3.27Å; S451-L455 PolarHBondContact O-N 3.42Å
452M65.9Low49.5Very low155 Ų155117.7 Ų117.776%0.76466%0.655SS**Hα-helixtrans-60.4-25-179.5-138.7-86.6-74.100111.2C450 L455 A456C450-M452 PolarHBondContact O-N 2.79Å; M452-L455 PolarHBondContact O-N 3.35Å; M452-A456 VanDerWaalsContact O-CB 3.3Å; M452-A456 WeakPolarHBondContact O-CB 3.35Å; M452-A456 PolarHBondContact O-N 3.15Å
453E65.4Low50.1Low145 Ų145117 Ų11768%0.67865%0.647SS**Hα-helixtrans-64.9-38.2171-62.3174.7131.300113.9S451 L455 A456 T457S451-E453 PolarHBondContact O-N 3.21Å; S451-E453 VanDerWaalsContact O-N 3.11Å; E453-L455 VanDerWaalsContact C-N 3.34Å; E453-A456 PolarHBondContact O-N 2.95Å; E453-T457 VanDerWaalsContact O-CB 3.32Å; E453-T457 WeakPolarHBondContact O-CB 3.29Å; E453-T457 PolarHBondContact O-N 3.22Å; E453-T457 PolarHBondContact O-OG1 3.05Å
454L64.5Low50.4Low108 Ų108118.9 Ų118.957%0.56565%0.648SS**Hα-helixtrans-64.9-43.7176.4-145.384.1000110.2S451 T457 C458S451-L454 WeakPolarHBondContact O-CB 3.47Å; S451-L454 PolarHBondContact O-N 3.46Å; S451-L454 PolarHBondContact OG-N 3.27Å; L454-T457 PolarHBondContact O-N 2.95Å; L454-C458 PolarHBondContact O-N 3.12Å; L454-C458 PolarHBondContact O-SG 3.07Å; L454-C458 VanDerWaalsContact O-SG 3.39Å
455L68.4Low50.4Low97 Ų97123.5 Ų123.551%0.50866%0.656SS.*Hα-helixtrans-63.4-45174.5-115.3166.5000111.5S451 M452 E453 T457 C458 L459S451-L455 PolarHBondContact O-N 3.42Å; M452-L455 PolarHBondContact O-N 3.35Å; E453-L455 VanDerWaalsContact C-N 3.34Å; L455-T457 VanDerWaalsContact C-N 3.3Å; L455-T457 PolarHBondContact O-N 3.43Å; L455-C458 PolarHBondContact O-N 3.17Å; L455-L459 HydrophobicContact CD2-CD1 4.21Å; L455-L459 HydrophobicContact CD2-CG 4.49Å; L455-L459 WeakPolarHBondContact O-CB 3.45Å; L455-L459 VanDerWaalsContact O-CG 3.27Å; L455-L459 WeakPolarHBondContact O-CG 3.41Å; L455-L459 PolarHBondContact O-N 3.11Å
456A66.4Low50.5Low42 Ų42120.4 Ų120.435%0.34766%0.655SS.*Hα-helixtrans-63.5-33.9176.200000112.5M452 E453 S460M452-A456 VanDerWaalsContact O-CB 3.3Å; M452-A456 WeakPolarHBondContact O-CB 3.35Å; M452-A456 PolarHBondContact O-N 3.15Å; E453-A456 PolarHBondContact O-N 2.95Å; A456-S460 VanDerWaalsContact O-CB 3.3Å; A456-S460 WeakPolarHBondContact O-CB 3.45Å; A456-S460 PolarHBondContact O-N 3.31Å; A456-S460 PolarHBondContact O-OG 3.4Å
457T67.9Low50.5Low81 Ų81118.4 Ų118.450%0.49765%0.653SS.*Hα-helixtrans-69-47.6176-58.80000110.8E453 L454 L455 L459 S460 L461E453-T457 VanDerWaalsContact O-CB 3.32Å; E453-T457 WeakPolarHBondContact O-CB 3.29Å; E453-T457 PolarHBondContact O-N 3.22Å; E453-T457 PolarHBondContact O-OG1 3.05Å; L454-T457 PolarHBondContact O-N 2.95Å; L455-T457 VanDerWaalsContact C-N 3.3Å; L455-T457 PolarHBondContact O-N 3.43Å; T457-L459 VanDerWaalsContact C-N 3.34Å; T457-L459 PolarHBondContact O-N 2.99Å; T457-S460 PolarHBondContact O-N 3.1Å; T457-L461 HydrophobicContact CG2-CD1 4.45Å; T457-L461 WeakPolarHBondContact O-CG 3.49Å; T457-L461 PolarHBondContact O-N 3.14Å
458C59.9Low50.4Low73 Ų73125 Ų12549%0.49366%0.663SS.*Hα-helixtrans-59.6-42.3173.6-680000112.3L454 L455 S460 L461 W462L454-C458 PolarHBondContact O-N 3.12Å; L454-C458 PolarHBondContact O-SG 3.07Å; L454-C458 VanDerWaalsContact O-SG 3.39Å; L455-C458 PolarHBondContact O-N 3.17Å; C458-S460 VanDerWaalsContact C-N 3.35Å; C458-L461 PolarHBondContact O-N 3.14Å; C458-W462 PolarHBondContact O-N 3.09Å
459L63.7Low49.6Very low112 Ų112124.1 Ų124.159%0.58666%0.664SS**Hα-helixtrans-68.5-31.7176.6-71168.3000112.8L455 T457 W462L455-L459 HydrophobicContact CD2-CD1 4.21Å; L455-L459 HydrophobicContact CD2-CG 4.49Å; L455-L459 WeakPolarHBondContact O-CB 3.45Å; L455-L459 VanDerWaalsContact O-CG 3.27Å; L455-L459 WeakPolarHBondContact O-CG 3.41Å; L455-L459 PolarHBondContact O-N 3.11Å; T457-L459 VanDerWaalsContact C-N 3.34Å; T457-L459 PolarHBondContact O-N 2.99Å; L459-W462 PolarHBondContact O-N 2.95Å
460S56.4Low49Very low83 Ų83122.9 Ų122.958%0.5866%0.661SS**Hα-helixtrans-69.7-39.8175.4-61.50000111.7A456 T457 C458 W462 K463A456-S460 VanDerWaalsContact O-CB 3.3Å; A456-S460 WeakPolarHBondContact O-CB 3.45Å; A456-S460 PolarHBondContact O-N 3.31Å; A456-S460 PolarHBondContact O-OG 3.4Å; T457-S460 PolarHBondContact O-N 3.1Å; C458-S460 VanDerWaalsContact C-N 3.35Å; S460-W462 PolarHBondContact O-N 3.3Å; S460-K463 PolarHBondContact O-N 2.85Å; S460-K463 VanDerWaalsContact O-N 3.14Å
461L54.9Low48.7Very low129 Ų129127 Ų12768%0.67567%0.671SS**Hα-helixtrans-65.3-18.7174.8-71.4168.2000113.6T457 C458T457-L461 HydrophobicContact CG2-CD1 4.45Å; T457-L461 WeakPolarHBondContact O-CG 3.49Å; T457-L461 PolarHBondContact O-N 3.14Å; C458-L461 PolarHBondContact O-N 3.14Å
462W43Very low47.3Very low230 Ų230132.3 Ų132.387%0.87169%0.69SS**THydrogen-bonded Turntrans-91.7-3.2175.5-80.322000113.7C458 L459 S460 N464C458-W462 PolarHBondContact O-N 3.09Å; L459-W462 PolarHBondContact O-N 2.95Å; S460-W462 PolarHBondContact O-N 3.3Å; W462-N464 PolarHBondContact O-N 3.14Å
463K37.7Very low45.5Very low173 Ų173131.5 Ų131.575%0.75269%0.689SS**  trans-99.553.8-171.2-159-159.9171.6-169.90114S460 Q465S460-K463 PolarHBondContact O-N 2.85Å; S460-K463 VanDerWaalsContact O-N 3.14Å; K463-Q465 PolarHBondContact O-N 2.98Å
464N35.2Very low44.1Very low150 Ų150131 Ų13180%0.80270%0.695SS**  trans-87.9101.1173.7-72.6-16000111.5W462W462-N464 PolarHBondContact O-N 3.14Å
465Q29.9Very low42.5Very low178 Ų178131.6 Ų131.683%0.83271%0.706SS**  trans-111.8129.2157.5-85.9-169.5-17.500109.1K463 S467K463-Q465 PolarHBondContact O-N 2.98Å; Q465-S467 PolarHBondContact O-N 2.78Å
466P34.7Very low40.6Very low127 Ų127136.4 Ų136.483%0.82572%0.723SS**  trans-80.1102.3172.731.4-31.7000110.3K468P466-K468 PolarHBondContact O-N 3.08Å
467S31.4Very low39.1Very low107 Ų107140 Ų14075%0.74874%0.743SS**  trans-76115.1171.4530000110.6Q465Q465-S467 PolarHBondContact O-N 2.78Å
468K31.6Very low37.1Very low201 Ų201142.8 Ų142.887%0.87475%0.754SS**  trans-59142.1172.5-63178.3178.8-1790111.1P466P466-K468 PolarHBondContact O-N 3.08Å
469T28.3Very low35.4Very low132 Ų132147.2 Ų147.281%0.8177%0.767SS**  trans-139.9115.6163.150.80000109.2
470T29Very low33.7Very low111 Ų111148.6 Ų148.668%0.68177%0.771SS**  trans-131.7121176.5-63.20000107.9
471E32.3Very low32.3Very low185 Ų185152.8 Ų152.886%0.86478%0.778SS**  trans60.8160166.2-70.1151.7-169.900116.1
472E27.4Very low30.8Very low159 Ų159154.6 Ų154.674%0.74378%0.784SS**  cis-142.8147.45.4-163.2-167.4166.200110.1
473N27.9Very low29.9Very low139 Ų139149.3 Ų149.374%0.74378%0.78SS**  trans156.4131.3132-91.5-90.3000112.4
474V34.9Very low29.3Very low133 Ų133146.9 Ų146.981%0.80678%0.776SS**  trans-130.9135.5-177.7168.90000108.6
475P32.4Very low28.8Very low121 Ų121146 Ų14679%0.78678%0.776SS**  -145.2144121.630.8-13.1000116
476K27.4Very low28.7Very low198 Ų198142.5 Ų142.586%0.86177%0.771SS**  trans-107.4144.9146.6-68.9178.5177.8175.30107.1
477P35.1Very low28.4Very low118 Ų118147.1 Ų147.177%0.76677%0.772SS**  -128.3152.593419.1000111.7
478L25.4Very low28.2Very low139 Ų139148.8 Ų148.873%0.72877%0.771SS**  79.4110.160-167.174.3000114
479E25.7Very low28.1Very low166 Ų166144.3 Ų144.378%0.77677%0.765SS**  trans58.6140.8159.6-64.516917000117.6
480E26.4Very low28Very low142 Ų142143.9 Ų143.966%0.66476%0.762SS**  -166.9171.757.7-109-158.1111.100114.4
481K27.6Very low27.9Very low170 Ų170144.3 Ų144.374%0.73977%0.765SS**  trans78.1115.4147.9-80.7159.5176.6130.90122.3
482Q24.2Very low27.5Very low168 Ų168142 Ų14279%0.78576%0.763SS**  trans-72.2158.1171.3-51.5155.4-26.400113.6
483C22.6Very low27.3Very low119 Ų119141 Ų14180%0.80477%0.767SS**  -167.8119.3123.3-950000109.1
484N25.5Very low27.1Very low122 Ų122137.7 Ų137.765%0.65277%0.766SS**  75.1111.670.2-71.2-35.1000114.9
485T25.9Very low26.4Very low132 Ų132136.9 Ų136.981%0.8177%0.766SS**  178102.3111.5-68.60000113.7
486S27.1Very low25.9Very low103 Ų103135.4 Ų135.472%0.7277%0.765SS**  31.4135128-51.70000125.1
487R28.8Very low25.9Very low224 Ų224133.3 Ų133.385%0.84576%0.763SS**  128.8112.8116.6-98.1164.4177.5174.10.8116.9
488I27.3Very low26.2Very low143 Ų143133 Ų13373%0.73376%0.761SS**  55.5118.188.5-50.5169.7000113.8
489S28.1Very low26.1Very low106 Ų106131.9 Ų131.974%0.74176%0.76SS**  -179165.296.8-54.20000108.5
490T27.9Very low26.1Very low123 Ų123130 Ų13076%0.75576%0.755SS**  cis-147.1148.115.839.40000108
491T25.4Very low26.1Very low121 Ų121130.8 Ų130.874%0.74276%0.759SS**  cis73.1121.740.666.70000117.2
492V23.7Very low26Very low135 Ų135127.5 Ų127.582%0.81875%0.753SS**  trans-176.6128.5135.3137.20000113
493V24.1Very low26Very low139 Ų139127.3 Ų127.384%0.84275%0.751SS**  trans46.2138.3151.5-177.80000121.1
494G22.8Very low26.2Very low69 Ų69127.1 Ų127.171%0.71175%0.746SS**  cis152.8172.9-10.500000115.8
495S20.5Very low26.6Very low116 Ų116130.7 Ų130.781%0.81176%0.756SS**  trans72.2115147.2-162.40000123.5
496A22.4Very low26.4Very low91 Ų91129.1 Ų129.175%0.75275%0.751SS**  trans73.6118.1134.700000123.6
497N26.7Very low26.3Very low154 Ų154131.5 Ų131.582%0.82475%0.754SS**  trans-66.6175.5145.2-70.4-27.6000110.2
498P41.4Very low26.1Very low111 Ų111125.6 Ų125.672%0.72175%0.746SS**  cis-157-17032.337.2-10.3000120.3
499T24Very low26.2Very low115 Ų115124.8 Ų124.871%0.70675%0.753SS**  trans93.6141.914022.40000123.6
500N26.3Very low26Very low126 Ų126122.2 Ų122.267%0.67474%0.743SS**  trans70.1140.9162.8-62.724.2000117.4
501E25Very low25.7Very low160 Ų160122.8 Ų122.875%0.74875%0.747SS**  cis-168.2164.2-5.1-110.8178.2102.600107.6
502V26.6Very low25.5Very low101 Ų101120 Ų12061%0.61274%0.742SS**  cis-162.5168.5-6.964.70000109.5
503H24.8Very low25.5Very low164 Ų164121.1 Ų121.176%0.75974%0.743SS**  trans68.4156.6166.8-69.6-45.2000120.2
504V25.1Very low25.5Very low115 Ų115118.9 Ų118.970%0.69773%0.734SS**  cis-172131.7-49.6129.50000109.5
505K35.1Very low25.6Very low197 Ų197123.6 Ų123.686%0.85774%0.737SS**  trans142.6103.1168.5-86160.4-177.3177.40107.5
506S21.5Very low25.9Very low99 Ų99126.1 Ų126.169%0.69273%0.734SS**  cis68117.731.6-149.80000111.9
507L24.3Very low26Very low153 Ų153128 Ų12880%0.80173%0.729SS**  cis-122.4-171.2-2.1-60.584000109
508C25.8Very low25.9Very low100 Ų100128.2 Ų128.268%0.67673%0.727SS**  cis-158.5174.84.9-149.30000112.1G510C508-G510 PolarHBondContact SG-O 3.16Å
509S29.2Very low25Very low125 Ų125127.1 Ų127.187%0.87472%0.722SS**SBendtrans-144.1141.4148.7-175.40000108
510G23.2Very low25.1Very low52 Ų52126.9 Ų126.954%0.53673%0.725SS.*  trans69.2166.4-151.700000111.4C508C508-G510 PolarHBondContact SG-O 3.16Å
511V21.3Very low25.2Very low136 Ų136125.5 Ų125.582%0.82473%0.725SS**  cis-143.9145.901760000104.5
512G22.9Very low25.3Very low63 Ų63125.6 Ų125.665%0.64973%0.725SS**  cis138.9-175.710.500000108.7
513N22.3Very low25.2Very low157 Ų157126 Ų12684%0.8473%0.728SS**  trans65140.9166.2-60-9.7000120.4
514S25.1Very low25.2Very low93 Ų93124.5 Ų124.565%0.6573%0.73SS**  trans92.7123.9142.4-136.50000120.5
515Q25.5Very low25.2Very low168 Ų168126.1 Ų126.179%0.78573%0.734SS**  trans72.6110.6131.9-85.1170.8-30.100121.5
516K26.2Very low25.1Very low169 Ų169122.3 Ų122.374%0.73573%0.729SS**  72.2119.7115.1-109.7-160.4179.3-163.50119.5
517M23.3Very low25.2Very low131 Ų131122.8 Ų122.865%0.64573%0.728SS**  68.6140.1121.8-85.2177.882.900121.4
518M24.4Very low25.2Very low158 Ų158122.6 Ų122.678%0.77873%0.727SS**  trans77.1143.6151.6-69171.680.600118.2
519S24.3Very low25.6Very low88 Ų88125 Ų12562%0.61573%0.732SS**  cis-177.7153.2-19.251.80000111.1
520S25.8Very low26.1Very low110 Ų110124.4 Ų124.477%0.76972%0.724SS**  trans68.4166.5148.3-136.80000115.8
521S28.8Very low26.1Very low96 Ų96127.7 Ų127.767%0.67174%0.739SS**  cis-145.3152.1-1.4-43.70000111.8
522Q26.4Very low26.4Very low162 Ų162127.1 Ų127.176%0.75774%0.74SS**  trans33.5118.3130.5-71.8-171.9-15.300122.7
523T23.6Very low26.4Very low111 Ų111133.1 Ų133.168%0.68175%0.751SS**  87.2160114.4-50.70000120.7
524V25.2Very low26.8Very low131 Ų131131 Ų13179%0.79475%0.748SS**  trans74.8107.3167-95.70000122.2
525L25.3Very low27.3Very low149 Ų149132.1 Ų132.178%0.7876%0.756SS**  trans-45.1147.5134-86.9157.6000112.3
526P32.8Very low27.4Very low117 Ų117127.7 Ų127.776%0.7676%0.756SS**  -131.8143.696.97.814.7000112.6
527V24.2Very low27.9Very low109 Ų109126.1 Ų126.166%0.66176%0.76SS**  94.2133.951.91670000113.6
528L24.5Very low28.2Very low150 Ų150124.7 Ų124.779%0.78577%0.769SS**  trans68.6131.4176.4-102.566.6000116.1
529I32.7Very low28.8Very low151 Ų151123.6 Ų123.677%0.77477%0.771SS**  cis64.4132.433.8-54.5178.3000112.5
530P40.8Very low29.3Very low111 Ų111123 Ų12372%0.72178%0.778SS**  cis-126.7-178.5-1.640-24.8000114.8
531S23.2Very low30Very low122 Ų122127.4 Ų127.485%0.85378%0.784SS**  -179.2158129.4-800000112.7
532C27Very low30.3Very low123 Ų123126.4 Ų126.483%0.83179%0.789SS**  trans-106.9158.4178.1-60.30000111.9
533E22.6Very low30.9Very low190 Ų190125.2 Ų125.289%0.88879%0.793SS**  177.7119.2116.6-96.7-172.1155.300116
534S31.1Very low31.7Very low112 Ų112128 Ų12878%0.78380%0.798SS**  trans36.9121.9132.9-142.50000125.2
535S35.3Very low32.2Very low116 Ų116129.5 Ų129.581%0.81180%0.801SS**  trans79135.5130-162.20000123.2
536G27.5Very low33.1Very low75 Ų75130.6 Ų130.677%0.77380%0.802SS**  trans-178.6135.5166.100000111.8
537V37Very low33.3Very low137 Ų137132.2 Ų132.283%0.8380%0.802SS**  trans-121.8135.6-166.4173.90000113.6
538A29.5Very low33.7Very low101 Ų101130.9 Ų130.984%0.83580%0.803SS**  trans-156147.715300000111.6
539V37.7Very low34.3Very low134 Ų134130.1 Ų130.181%0.81281%0.805SS**  trans-122134.3178.3171.70000110.2
540G33.6Very low34.6Very low75 Ų75128.9 Ų128.977%0.77380%0.804SS**  trans-129.9140.9168.600000110.4
541K41.4Very low34.2Very low203 Ų203128.2 Ų128.288%0.88380%0.801SS**  trans-99.4133.5-173.1-65.3-171.2178.1-170.90112.9
542G35.1Very low34.8Very low76 Ų76127.9 Ų127.978%0.78480%0.797SS**  trans-136.6129.2153.800000108
543T40Very low35Very low136 Ų136129.8 Ų129.883%0.83480%0.798SS**  trans-102.9100.8-174.449.20000111.2
544E38.5Very low35.5Very low171 Ų171127 Ų12780%0.79979%0.794SS**  trans-81142.8165-174171.7-160.900110.4Q546E544-Q546 PolarHBondContact O-N 3Å
545L36.3Very low35.5Very low162 Ų162128.9 Ų128.985%0.84879%0.794SS**  trans-94.384.9-177.6-104.5165.7000110.7I547L545-I547 PolarHBondContact O-N 3.23Å
546Q44.2Very low35.3Very low171 Ų171128 Ų12880%0.79979%0.788SS**  trans-69.4112.7172.4-66.7179.4-10.200110.4E544 A548E544-Q546 PolarHBondContact O-N 3Å; Q546-A548 PolarHBondContact O-N 3.19Å
547I38.3Very low35.5Very low151 Ų151131.5 Ų131.577%0.77479%0.789SS**  trans-89.595.8174.2-58.8178.1000108.6L545 V549L545-I547 PolarHBondContact O-N 3.23Å; I547-V549 PolarHBondContact O-N 3.29Å
548A32.2Very low35.4Very low82 Ų82130.8 Ų130.868%0.67879%0.785SS**  trans-74.2116.1170.100000110.3Q546 V550Q546-A548 PolarHBondContact O-N 3.19Å; A548-V550 HydrophobicContact CB-CG2 4.42Å; A548-V550 PolarHBondContact O-N 3.43Å; A548-V550 VanDerWaalsContact O-N 3.13Å
549V36.4Very low35.5Very low134 Ų134133.5 Ų133.581%0.81279%0.785SS**  trans-79.992.2172.7-178.50000108.8I547I547-V549 PolarHBondContact O-N 3.29Å
550V38.6Very low35.3Very low125 Ų125133.4 Ų133.476%0.75879%0.785SS**  trans-86.2112.5175.8-178.20000109.7A548A548-V550 HydrophobicContact CB-CG2 4.42Å; A548-V550 PolarHBondContact O-N 3.43Å; A548-V550 VanDerWaalsContact O-N 3.13Å
551S33.4Very low35.1Very low96 Ų96137.7 Ų137.767%0.67179%0.789SS**  trans-63.5128.9170.6-62.70000110.7L553S551-L553 PolarHBondContact O-N 2.99Å
552P35.1Very low35Very low116 Ų116133.8 Ų133.875%0.75379%0.785SS**  trans-72116.1177.628.3-33000110.7V554P552-V554 PolarHBondContact O-N 3.04Å; P552-V554 VanDerWaalsContact O-N 3.09Å
553L31.3Very low34.7Very low163 Ų163133.9 Ų133.985%0.85379%0.786SS**  trans-60.7107.5167.9-82.9146000109.8S551 L555S551-L553 PolarHBondContact O-N 2.99Å; L553-L555 PolarHBondContact O-N 3.06Å
554V33.2Very low34.3Very low132 Ų132136.1 Ų136.180%0.878%0.784SS**  trans-82.897168.7-179.90000107.9P552 S556P552-V554 PolarHBondContact O-N 3.04Å; P552-V554 VanDerWaalsContact O-N 3.09Å; V554-S556 PolarHBondContact O-N 2.92Å
555L30.8Very low33.8Very low150 Ų150134.6 Ų134.679%0.78578%0.781SS**  trans-67.3122.1164.7-65.9173.8000108.4L553L553-L555 PolarHBondContact O-N 3.06Å
556S32.1Very low33.6Very low98 Ų98131.8 Ų131.869%0.68578%0.776SS**  trans-93.6101175.256.70000110V554 T558V554-S556 PolarHBondContact O-N 2.92Å; S556-T558 PolarHBondContact O-N 2.86Å
557D32Very low32.7Very low149 Ų149129.7 Ų129.780%0.79777%0.774SS**  trans-63.3105176.3-68.3-42.5000111.4N559D557-N559 PolarHBondContact O-N 2.86Å
558T33.9Very low32.5Very low122 Ų122128.5 Ų128.575%0.74878%0.776SS**  trans-86.295.8174.138.60000110.8S556 T560S556-T558 PolarHBondContact O-N 2.86Å; T558-T560 PolarHBondContact O-N 3.15Å; T558-T560 VanDerWaalsContact O-N 3.09Å
559N31.2Very low32.1Very low157 Ų157133 Ų13384%0.8478%0.783SS**  trans-64.7107174.5-78.5-60.1000112D557D557-N559 PolarHBondContact O-N 2.86Å
560T33.8Very low31.8Very low132 Ų132132.4 Ų132.481%0.8178%0.78SS**  trans-105.3138.5161.448.60000110.3T558T558-T560 PolarHBondContact O-N 3.15Å; T558-T560 VanDerWaalsContact O-N 3.09Å
561L28.5Very low31.2Very low165 Ų165133.8 Ų133.886%0.86478%0.782SS**  trans-79.3158.8177.9-112.174.2000111.6
562P40.8Very low31.6Very low122 Ų122133.9 Ų133.979%0.79278%0.78SS**  trans-88.5140.6-156.833.4-36.4000115.2
563G27.7Very low31.4Very low78 Ų78137.1 Ų137.180%0.80479%0.786SS**  trans-106.7151.9156.700000110.6
564K32.3Very low31.5Very low182 Ų182135 Ų13579%0.79178%0.779SS**  trans-106.1146.2-174.9-91.4-170.4168.5-157.10112.6
565D27.9Very low31.3Very low139 Ų139136.5 Ų136.574%0.74378%0.782SS**  trans58.1134.2147.2-50.3-25000117
566S31.1Very low31.3Very low104 Ų104139.8 Ų139.873%0.72779%0.785SS**  cis-168.2177.112.448.80000112
567V27.1Very low31.6Very low127 Ų127140.5 Ų140.577%0.7779%0.788SS**  trans75.9121.2168.2-169.20000117.5
568P34.2Very low31.7Very low126 Ų126139.7 Ų139.782%0.81879%0.788SS**  trans-113.1128.9168.836.2-24.9000113.5
569E23.7Very low31.8Very low175 Ų175140.4 Ų140.482%0.81879%0.792SS**  trans-146.1100.4171.2-165168.1-177.600113.9
570V28.6Very low31.9Very low123 Ų123141.6 Ų141.675%0.74579%0.79SS**  trans69.9145.2141.3178.60000121.4
571L27Very low31.9Very low153 Ų153145 Ų14580%0.80180%0.797SS**  trans78.5150.8165-11999.1000118.9
572P42.3Very low32.4Very low99 Ų99140.8 Ų140.864%0.64379%0.793SS**  cis-116.8167-35.936.8-25.7000113.4
573E31.2Very low31.9Very low184 Ų184140.7 Ų140.786%0.8680%0.795SS**  trans-86.4131166.7-179.8176.9-159.500110.3
574T32.9Very low32.3Very low118 Ų118143.5 Ų143.572%0.72480%0.796SS**  trans-124.7127175.945.20000112.2
575L29.2Very low32Very low164 Ų164140.3 Ų140.386%0.85980%0.795SS**PPolyproline II helixtrans-82.7133.1-176.4-72.4147.1000111.5
576Y29.1Very low32.3Very low218 Ų218139 Ų13986%0.85580%0.797SS**PPolyproline II helixtrans-75.9131.3168.8-71.8-89.2000110.9V578Y576-V578 PolarHBondContact O-N 3.38Å
577P38.3Very low32.1Very low113 Ų113142.3 Ų142.373%0.73481%0.806SS**PPolyproline II helixtrans-74.1123.8175.629.2-33.1000111.3V579P577-V579 PolarHBondContact O-N 3.14Å
578V34.9Very low32.2Very low133 Ų133145.4 Ų145.481%0.80681%0.812SS**  trans-74.7105.1173.4177.60000109.6Y576Y576-V578 PolarHBondContact O-N 3.38Å
579V36.2Very low31.8Very low136 Ų136145.4 Ų145.482%0.82481%0.81SS**PPolyproline II helixtrans-77.2128.3169.3-174.40000108.8P577P577-V579 PolarHBondContact O-N 3.14Å
580K32.5Very low32.1Very low183 Ų183146.3 Ų146.380%0.79681%0.814SS**PPolyproline II helixtrans-93.8142.2172.4-74.5-172.5176.3-177.40110.9
581E34.5Very low32.7Very low204 Ų204146 Ų14695%0.95381%0.814SS**SBendtrans-60.1140.9173.4-172.7174.2-160.300111.8
582G38.7Very low32.7Very low76 Ų76144.8 Ų144.878%0.78481%0.813SS**  trans111.563.1172.100000116.7
583S31.3Very low32Very low120 Ų120148.1 Ų148.184%0.83982%0.821SS**  trans-153.1139.5156.8-169.80000110.7
584V34.7Very low31.8Very low136 Ų136145.1 Ų145.182%0.82482%0.815SS**  trans-139.2120.7179.8-175.70000108.8
585C27.4Very low31.5Very low115 Ų115145.8 Ų145.878%0.77782%0.819SS**  trans174.7133.4138.4-100.30000112.6
586S33Very low31.4Very low112 Ų112142.4 Ų142.478%0.78381%0.814SS**  trans39.7111.9142.4-50.70000120.5
587L27.5Very low31.4Very low174 Ų174139.9 Ų139.991%0.91182%0.815SS**  trans-114.8119.6146.4-93.3170.7000110
588Q29.2Very low31.4Very low192 Ų192139.2 Ų139.290%0.89781%0.81SS**  trans-101.2127.7176.6177.7179.52.600108.3
589T26.7Very low31Very low126 Ų126141.6 Ų141.677%0.77381%0.81SS**  trans-113.9113.3-174.2510000112.9
590Q29.2Very low30.4Very low194 Ų194141.8 Ų141.891%0.90781%0.806SS**  trans-134.9151.7143.8-92-160.6-3.100109.6
591P41.7Very low30.1Very low116 Ų116138.7 Ų138.775%0.75380%0.802SS**  trans-100.9153-167.637.4-33.3000113.8
592T26.6Very low29.8Very low127 Ų127137.1 Ų137.178%0.77980%0.799SS**  trans-154.4122.9158.2-28.20000111.8
593E26.9Very low29.3Very low170 Ų170137.1 Ų137.179%0.79480%0.799SS**  trans36.6117.9145.4-62.2-173.4125.400123.6
594T26.6Very low28.9Very low120 Ų120135.9 Ų135.974%0.73680%0.796SS**  71.2151.3113.2-40.70000121.3
595V26.5Very low28.5Very low133 Ų133136.6 Ų136.681%0.80680%0.8SS**  trans102.6123.4158.1-172.70000118.6
596A27.1Very low28.5Very low92 Ų92135.2 Ų135.276%0.7680%0.797SS**  trans74.7108.6150.500000123.2
597L30.6Very low28.2Very low166 Ų166135 Ų13587%0.86980%0.796SS**  trans-52.7165.9134.4-72166.9000111.4
598P38.1Very low28.3Very low99 Ų99133.5 Ų133.564%0.64379%0.789SS**  cis-153.5-158.939.739.1-13.5000117.1
599F26.4Very low28.3Very low182 Ų182130.6 Ų130.680%0.79878%0.779SS**  trans76.7138.2174-60.5-76.6000118.1
600D23.8Very low28.3Very low140 Ų140132.3 Ų132.375%0.74978%0.782SS**  cis-159.5152-38.7-133.1-28.1000109.4
601V26.2Very low28.1Very low118 Ų118128 Ų12872%0.71577%0.773SS**  trans-133.1114.9-170.7175.30000112.8
602I28.3Very low27.4Very low171 Ų171126.7 Ų126.788%0.87777%0.772SS**  trans71.4130.9165.2-62.5164.4000116.7
603G27Very low27.3Very low76 Ų76129.6 Ų129.678%0.78478%0.777SS**  trans17089.7162.700000115.3
604A23.3Very low27.5Very low94 Ų94128.6 Ų128.678%0.77778%0.776SS**  trans-156.5152.7165.100000111.5
605V25.7Very low27.9Very low151 Ų151128.6 Ų128.692%0.91578%0.778SS**  trans71.9113.9-178.5-171.30000113.1
606A28.8Very low27.7Very low86 Ų86129.8 Ų129.871%0.71178%0.779SS**  cis-160.8-179.9-1.400000113.7
607S26.6Very low28.2Very low108 Ų108130.5 Ų130.576%0.75578%0.776SS**  trans86.182.9160.664.10000121.1
608N29.1Very low28Very low143 Ų143128.7 Ų128.777%0.76577%0.771SS**  60.9113.8120.9-58.47.4000122.8
609N28.7Very low27.4Very low131 Ų131129.7 Ų129.770%0.70177%0.771SS**  trans79.9110.5130.3-59.8-5000122.2
610I27.4Very low27.5Very low161 Ų161128.6 Ų128.683%0.82677%0.766SS**  56.1134.1116.9-61.5163.1000118.7
611S25.4Very low27.8Very low104 Ų104128.6 Ų128.673%0.72776%0.762SS**  cis-178.1151.2-13.1179.40000109.7
612A26.3Very low28Very low89 Ų89130.7 Ų130.774%0.73676%0.761SS**  trans64.4164.4167.200000116.6
613E24.9Very low28Very low187 Ų187130 Ų13087%0.87475%0.754SS**  cis-144.7174.57.9-154.5163.7-177.700112.8
614I31.1Very low28Very low149 Ų149134.2 Ų134.276%0.76475%0.753SS**  trans-98.1139.3-171.7-71.8163.8000109.2
615P34.3Very low28.5Very low121 Ų121138.3 Ų138.379%0.78675%0.753SS**  -158.1164.389.941.7-20.1000121.5
616L23.1Very low28.9Very low157 Ų157136.8 Ų136.882%0.82275%0.747SS**  trans-35.2174.2145.6-69.7159.2000116
617P36.3Very low28.8Very low108 Ų108139.1 Ų139.170%0.70175%0.746SS**  cis-143.6-165.112.235.2-10.6000116.6
618V25.8Very low28.8Very low128 Ų128143.4 Ų143.478%0.77675%0.754SS**  trans77.1105138.6148.60000121.8
619D26.5Very low28.7Very low119 Ų119140.5 Ų140.564%0.63676%0.757SS**  54.1150.1111.1-152.721.5000123.1
620K29.3Very low28.5Very low159 Ų159141.8 Ų141.869%0.69176%0.764SS**  trans79.9121.4155.1-85.9170.4-172.4106.10124.8
621E28.5Very low29.5Very low141 Ų141138.7 Ų138.766%0.65976%0.755SS**  96.7104.3115.5-161.6144.5-141.400123.4
622K31.8Very low29.6Very low161 Ų161140.6 Ų140.670%0.776%0.757SS**  trans31.4134.2135.7-57.3175.4-174.2156.60123.7
623Q26.8Very low29.7Very low156 Ų156143.5 Ų143.573%0.72976%0.758SS**  90.6136.4124.6-87.2179.9-7.600124.5
624H27.3Very low29.9Very low165 Ų165139 Ų13976%0.76475%0.753SS**  trans85.6152.8143.9-79.8-59000123.7
625K34Very low29.7Very low180 Ų180139 Ų13978%0.78376%0.755SS**  trans-82.5160.2-174.8-62.2-179.6172.9-176.70112.1
626P34Very low29.3Very low120 Ų120138 Ų13878%0.77975%0.751SS**  -128-169.793.95.317.2000111.8
627I27.3Very low29.6Very low134 Ų134135.4 Ų135.469%0.68775%0.746SS**  cis170.5140.5-47.6-91.2166.2000107.2
628Q27.3Very low29.3Very low199 Ų199138.2 Ų138.293%0.9375%0.754SS**  trans71.8138.6166.8-84.8173.6-57.600122.1
629G26.5Very low29.3Very low81 Ų81135.3 Ų135.384%0.83575%0.75SS**  trans154.379.4173.500000112.9
630D23.6Very low29.4Very low158 Ų158138.1 Ų138.185%0.84576%0.756SS**  trans-132.7170.6-178.2-146.535.2000107.5
631P49.3Very low29.3Very low97 Ų97139.2 Ų139.263%0.6376%0.764SS**  cis-128.6-156.913.236.2-10.7000112.3
632D27.3Very low29.5Very low143 Ų143137.8 Ų137.877%0.76577%0.769SS**  cis-16917528.3-149-18.3000115.2
633I29.4Very low29.6Very low150 Ų150136 Ų13677%0.76977%0.774SS**  trans8588.9167.3-44.1-174.1000118.8
634A28.5Very low29.7Very low93 Ų93136.6 Ų136.677%0.76978%0.782SS**  45.1147.3127.400000122.5
635D25.7Very low29.7Very low148 Ų148131.2 Ų131.279%0.79177%0.771SS**  cis-146.61713.9-150.9-30.7000112
636S27.6Very low29.5Very low101 Ų101127.4 Ų127.471%0.70676%0.762SS**  trans-67.6176.2175.465.50000114.2
637S29Very low29.5Very low102 Ų102130 Ų13071%0.71376%0.764SS**  cis-161.1140.825.863.20000109.7
638L29Very low29.5Very low168 Ų168129.9 Ų129.988%0.8877%0.77SS**  98.6129.783.9-177.770.8000114.4
639G27.3Very low30.1Very low67 Ų67127.6 Ų127.669%0.69176%0.763SS**  trans130.876.917300000113.1
640K28.1Very low30.4Very low177 Ų177128.9 Ų128.977%0.7776%0.757SS**  38.4109.484.1-70.4-166.9176.3-174.80114.2
641H27.5Very low30.7Very low182 Ų182129.8 Ų129.884%0.84375%0.753SS**  -177.2142.2103-94.8-75.3000111.4
642S32.5Very low29.6Very low111 Ų111131.2 Ų131.278%0.77676%0.762SS**  trans-132.7151166.5-51.80000108.4
643P32.7Very low29.5Very low123 Ų123131.7 Ų131.780%0.79976%0.762SS**  -127.5156.5105.736-29.4000112
644L30Very low29.4Very low170 Ų170131.1 Ų131.189%0.8976%0.76SS**  cis95.8128.221.3-169.971.8000114.2
645G26.8Very low29.4Very low52 Ų52131.7 Ų131.754%0.53676%0.758SS.*  trans110.2117.9-176.400000112
646T30.5Very low29.6Very low99 Ų99130.6 Ų130.661%0.60776%0.757SS**  cis114.594.5-2.5-51.20000115.6
647E34.3Very low30Very low176 Ų176133.2 Ų133.282%0.82276%0.762SS**  trans34.7126.2143.4-57.9176.7107.600121.8
648V27.2Very low30Very low131 Ų131134 Ų13479%0.79476%0.762SS**  -143.4137123.4176.30000109.9P650V648-P650 HydrophobicContact CG1-CG 4.38Å
649L38.8Very low30.3Very low151 Ų151131.4 Ų131.479%0.79176%0.758SS**  trans-115.6136.2163168.568.8000108.9
650P32.9Very low30.5Very low108 Ų108130.9 Ų130.970%0.70175%0.752SS**  trans-125.7152.3142.7418.7000112.8V648V648-P650 HydrophobicContact CG1-CG 4.38Å
651K30.8Very low30.9Very low177 Ų177127 Ų12777%0.7775%0.745SS**PPolyproline II helixtrans-74.3162.7177.2-52178.9179.7-175.90112.2
652P26.4Very low31.4Very low127 Ų127127.1 Ų127.183%0.82575%0.748SS**PPolyproline II helix-102.3157.6124.832.6-32.9000111.2
653M25.4Very low31.6Very low153 Ų153127.5 Ų127.575%0.75474%0.741SS**PPolyproline II helixtrans-79.3146.9-174.8-66.5-177.666.200113.5S655M653-S655 PolarHBondContact O-N 3.45Å
654D26.9Very low32Very low138 Ų138130 Ų13074%0.73874%0.742SS**  trans18.197.5134.4-44.8-41.8000116.7
655S28Very low32.5Very low104 Ų104127.5 Ų127.573%0.72773%0.729SS**  trans-111.3118149.8590000108.9M653 I657M653-S655 PolarHBondContact O-N 3.45Å; S655-I657 PolarHBondContact O-N 3.13Å
656T30.9Very low33Very low126 Ų126133.9 Ų133.977%0.77375%0.745SS**  trans-7391-170.5-48.50000111.7V658T656-V658 HydrophobicContact CG2-CG2 4.21Å; T656-V658 PolarHBondContact O-N 3.23Å; T656-V658 VanDerWaalsContact O-N 3.15Å
657I34.1Very low33.4Very low156 Ų156132.2 Ų132.280%0.874%0.737SS**  trans-76.998.4163.4-58-177.7000107.7S655 S659S655-I657 PolarHBondContact O-N 3.13Å; I657-S659 PolarHBondContact O-N 3.45Å
658V30.5Very low34.1Very low117 Ų117131.2 Ų131.271%0.70974%0.736SS**  trans-58.8131174.5174.30000109.5T656 G660T656-V658 HydrophobicContact CG2-CG2 4.21Å; T656-V658 PolarHBondContact O-N 3.23Å; T656-V658 VanDerWaalsContact O-N 3.15Å; V658-G660 PolarHBondContact O-N 3.13Å; V658-G660 VanDerWaalsContact O-N 3.11Å
659S35.3Very low34.7Very low114 Ų114130.4 Ų130.480%0.79773%0.734SS**  trans-64.8110.9174.4-54.30000110.8I657I657-S659 PolarHBondContact O-N 3.45Å
660G31.8Very low34.9Very low56 Ų56128.3 Ų128.358%0.57773%0.732SS**  trans-63.6150.3159.100000110.4V658 M662V658-G660 PolarHBondContact O-N 3.13Å; V658-G660 VanDerWaalsContact O-N 3.11Å; G660-M662 PolarHBondContact O-N 3.1Å; G660-M662 VanDerWaalsContact O-N 3.07Å
661P35.5Very low35.6Very low96 Ų96128.9 Ų128.962%0.62373%0.729SS**  trans-71.2105.5-173.128.1-34.5000111.9L663P661-L663 PolarHBondContact O-N 3.04Å
662M38.4Very low36.6Very low184 Ų184125.1 Ų125.191%0.90673%0.73SS**  trans-69.798.2162.4-72.7-172.778.100109.3G660 Q664G660-M662 PolarHBondContact O-N 3.1Å; G660-M662 VanDerWaalsContact O-N 3.07Å; M662-Q664 PolarHBondContact O-N 3.43Å
663L36.3Very low37.1Very low119 Ų119128.5 Ų128.562%0.62374%0.735SS**  trans-70.9108.4169.4-65.8176.2000109.4P661 I665P661-L663 PolarHBondContact O-N 3.04Å; L663-I665 PolarHBondContact O-N 3.48Å; L663-I665 VanDerWaalsContact O-N 3.17Å
664Q41.4Very low37.7Very low176 Ų176124.3 Ų124.382%0.82273%0.732SS**  trans-69.8106.5167.1-74.4-176.8-77.300109.3M662 E666M662-Q664 PolarHBondContact O-N 3.43Å; Q664-E666 PolarHBondContact O-N 2.84Å
665I40.4Very low38.2Very low118 Ų118125.4 Ų125.461%0.60574%0.738SS**  trans-84.287.5172.7-56177.3000107.9L663 S667L663-I665 PolarHBondContact O-N 3.48Å; L663-I665 VanDerWaalsContact O-N 3.17Å; I665-S667 WeakPolarHBondContact CG2-O 3.43Å; I665-S667 PolarHBondContact O-N 2.96Å
666E38.2Very low39.4Very low186 Ų186127.7 Ų127.787%0.86975%0.747SS**  trans-68.9-15.4-179.1-71.1-169120.900114Q664Q664-E666 PolarHBondContact O-N 2.84Å
667S38.6Very low40.3Very low63 Ų63127.3 Ų127.344%0.44175%0.749SS.*  trans-151.7140.4171.3-176.90000112.4I665 C669I665-S667 WeakPolarHBondContact CG2-O 3.43Å; I665-S667 PolarHBondContact O-N 2.96Å; S667-C669 PolarHBondContact O-N 3.4Å; S667-C669 PolarHBondContact OG-N 3.22Å
668I48.2Very low40.8Very low156 Ų156128.8 Ų128.880%0.875%0.746SS**G310 helixtrans-75.7-11.8-179.1-46.6178.3000111.4S670I668-S670 PolarHBondContact O-N 3.42Å
669C40.3Very low42.1Very low114 Ų114127 Ų12777%0.7773%0.733SS**G310 helixtrans-82.6-2.6-170.1-61.30000115.8S667S667-C669 PolarHBondContact O-N 3.4Å; S667-C669 PolarHBondContact OG-N 3.22Å
670S43.4Very low42.6Very low106 Ų106124.9 Ų124.974%0.74172%0.717SS**G310 helixtrans-102.123-173.1-50.90000114.5I668I668-S670 PolarHBondContact O-N 3.42Å
671L47.4Very low43.3Very low120 Ų120126.3 Ų126.363%0.62871%0.709SS**SBendtrans-126.628.5-169.8-104163.9000113.5I682L671-I682 HydrophobicContact CD2-CD1 4.4Å
672A51.6Low44.2Very low98 Ų98125.3 Ų125.381%0.8170%0.698SS**  trans-137.927.2-170.600000115.1
673E37.1Very low44.9Very low198 Ų198117.6 Ų117.693%0.92566%0.663SS**  trans-160.7132.7174.6-164.7168.4-13300106.5
674G37.7Very low45.3Very low66 Ų66118.2 Ų118.268%0.6866%0.663SS**  cis-168.5165-8.300000108.6
675D37.4Very low45.8Very low161 Ų161115.7 Ų115.786%0.86165%0.654SS**SBendtrans63.3170.1179.1-67.1-19000118.8S677D675-S677 PolarHBondContact O-N 3.28Å
676V52.3Low46.4Very low152 Ų152117.9 Ų117.992%0.92166%0.659SS**SBendtrans-90.791.7-148.6-171.60000113.1
677S50.4Low46.7Very low117 Ų117114.9 Ų114.982%0.81865%0.649SS**  trans-147.2143.1160.665.20000112.6D675D675-S677 PolarHBondContact O-N 3.28Å
678Y44.1Very low46.7Very low187 Ų187116.9 Ų116.973%0.73366%0.663SS**  trans-97.5112.5-177.7177.6-94.7000110.2S680 A683Y678-S680 PolarHBondContact O-N 2.86Å; Y678-A683 HydrophobicContact CE1-CB 4.21Å; Y678-A683 WeakPolarHBondContact OH-CB 3.45Å
679N58.2Low46.2Very low81 Ų81115.1 Ų115.143%0.43366%0.659SS.*  trans-78.8100.2174.6-173.9-13.9000110.4Q681 I682N679-Q681 VanDerWaalsContact C-N 3.28Å; N679-Q681 PolarHBondContact O-N 3.33Å; N679-Q681 WeakPolarHBondContact OD1-CB 3.37Å; N679-Q681 PolarHBondContact OD1-N 3.4Å; N679-Q681 VanDerWaalsContact OD1-N 3.17Å; N679-I682 HydrophobicContact CB-CD1 4.2Å; N679-I682 HydrophobicContact CB-CG1 4.41Å; N679-I682 PolarHBondContact O-N 3.12Å
680S46.8Very low45.9Very low68 Ų68118.6 Ų118.648%0.47666%0.664SS.*Hα-helixtrans-60.9-30.4-177.650.30000114.2Y678 I682 A683 E684Y678-S680 PolarHBondContact O-N 2.86Å; S680-I682 PolarHBondContact O-N 3.47Å; S680-A683 WeakPolarHBondContact O-CB 3.1Å; S680-A683 PolarHBondContact O-N 3.43Å; S680-E684 PolarHBondContact O-N 3.33Å; S680-E684 VanDerWaalsContact O-N 3.16Å
681Q46.5Very low45.4Very low86 Ų86119.7 Ų119.740%0.40267%0.666SS.*Hα-helixtrans-63.9-30.5-177.6-64.8-179.5-24.800112.4N679 A683N679-Q681 VanDerWaalsContact C-N 3.28Å; N679-Q681 PolarHBondContact O-N 3.33Å; N679-Q681 WeakPolarHBondContact OD1-CB 3.37Å; N679-Q681 PolarHBondContact OD1-N 3.4Å; N679-Q681 VanDerWaalsContact OD1-N 3.17Å; Q681-A683 VanDerWaalsContact C-N 3.33Å
682I54.3Low44.5Very low76 Ų76121.9 Ų121.939%0.3967%0.673SS.*Hα-helixtrans-70.1-35.2175.2-58.1178.3000110.3L671 N679 S680 F686L671-I682 HydrophobicContact CD2-CD1 4.4Å; N679-I682 HydrophobicContact CB-CD1 4.2Å; N679-I682 HydrophobicContact CB-CG1 4.41Å; N679-I682 PolarHBondContact O-N 3.12Å; S680-I682 PolarHBondContact O-N 3.47Å; I682-F686 HydrophobicContact CG2-CE2 4.24Å; I682-F686 VanDerWaalsContact O-CD2 3.29Å; I682-F686 WeakPolarHBondContact O-CD2 3.49Å
683A51.5Low43.6Very low21 Ų21123 Ų12317%0.17467%0.672CS.*Hα-helixtrans-75.6-31.8-177.400000113.4Y678 S680 Q681 I685 F686 N687Y678-A683 HydrophobicContact CE1-CB 4.21Å; Y678-A683 WeakPolarHBondContact OH-CB 3.45Å; S680-A683 WeakPolarHBondContact O-CB 3.1Å; S680-A683 PolarHBondContact O-N 3.43Å; Q681-A683 VanDerWaalsContact C-N 3.33Å; A683-I685 VanDerWaalsContact C-N 3.33Å; A683-I685 PolarHBondContact O-N 3.3Å; A683-F686 PolarHBondContact O-N 3.07Å; A683-N687 PolarHBondContact O-ND2 3.43Å
684E45.1Very low43.2Very low133 Ų133122 Ų12262%0.62167%0.668SS**Hα-helixtrans-62.3-40.5177.2-70.1-178126.100111.7S680 F686 N687S680-E684 PolarHBondContact O-N 3.33Å; S680-E684 VanDerWaalsContact O-N 3.16Å; E684-F686 VanDerWaalsContact C-N 3.27Å; E684-F686 PolarHBondContact O-N 3.36Å; E684-N687 PolarHBondContact O-N 3.49Å; E684-N687 VanDerWaalsContact O-N 3.08Å
685I52.7Low42.7Very low122 Ų122128 Ų12863%0.62668%0.675SS**Hα-helixtrans-55.7-39.1-179.9-63.2162.3000112.3A683A683-I685 VanDerWaalsContact C-N 3.33Å; A683-I685 PolarHBondContact O-N 3.3Å
686F53Low42.1Very low165 Ų165126.3 Ų126.372%0.72467%0.673SS**Hα-helixtrans-84.6-9.7-177.8-68-73.5000114.5I682 A683 E684I682-F686 HydrophobicContact CG2-CE2 4.24Å; I682-F686 VanDerWaalsContact O-CD2 3.29Å; I682-F686 WeakPolarHBondContact O-CD2 3.49Å; A683-F686 PolarHBondContact O-N 3.07Å; E684-F686 VanDerWaalsContact C-N 3.27Å; E684-F686 PolarHBondContact O-N 3.36Å
687N43.4Very low40.8Very low122 Ų122124.3 Ų124.365%0.65267%0.666SS**Hα-helixtrans-94.7-12-179-78.4-69.8000113.9A683 E684 V689A683-N687 PolarHBondContact O-ND2 3.43Å; E684-N687 PolarHBondContact O-N 3.49Å; E684-N687 VanDerWaalsContact O-N 3.08Å; N687-V689 VanDerWaalsContact C-N 3.31Å; N687-V689 PolarHBondContact O-N 3.21Å
688S39.5Very low40.2Very low105 Ų105124.1 Ų124.173%0.73466%0.662SS**SBendtrans-8517.9-176.5-58.40000115.7
689V38.1Very low39.4Very low120 Ų120121.7 Ų121.773%0.72766%0.662SS**  trans-123.181.7175.9-171.20000110.7N687N687-V689 VanDerWaalsContact C-N 3.31Å; N687-V689 PolarHBondContact O-N 3.21Å
690Q33.8Very low37.9Very low187 Ų187125.6 Ų125.687%0.87468%0.677SS**PPolyproline II helixtrans-99.6118.4162.7-68.9-169.410.500109.7
691T31.8Very low36.9Very low128 Ų128128 Ų12879%0.78569%0.689SS**PPolyproline II helixtrans-89.9118.9166.449.10000109.9P693T691-P693 WeakPolarHBondContact O-CD 3.15Å
692E29.5Very low36Very low166 Ų166131.7 Ų131.778%0.77671%0.71SS**PPolyproline II helixtrans-62125-177.7-176.8-173.417100113.5Q694E692-Q694 PolarHBondContact O-N 3.45Å
693P31.6Very low34.7Very low121 Ų121134.5 Ų134.579%0.78673%0.725SS**  trans-77.5109.7165.6-11.628.6000110.2T691 K695T691-P693 WeakPolarHBondContact O-CD 3.15Å; P693-K695 PolarHBondContact O-N 3.13Å
694Q29.1Very low33.6Very low177 Ų177138 Ų13883%0.82775%0.749SS**  trans-60.1135.7179.6-76.1-169-26.400112.7E692E692-Q694 PolarHBondContact O-N 3.45Å
695K26.8Very low32.8Very low193 Ų193139.6 Ų139.684%0.83976%0.756SS**  trans-11699.9-179.2-174.2-179.2-175.2178.40110.4P693P693-K695 PolarHBondContact O-N 3.13Å
696P26.1Very low31.7Very low126 Ų126140.9 Ų140.982%0.81876%0.759SS**  trans-70137.417329-32.9000110.4
697S24.3Very low30.4Very low109 Ų109139.3 Ų139.376%0.76275%0.754SS**  trans-123.5173.4-179.676.10000110.4
698P37.3Very low29.6Very low114 Ų114140.7 Ų140.774%0.7476%0.757SS**  trans-91.5171.6-139.836.5-40.4000115.7
699N28Very low29Very low136 Ų136140.7 Ų140.773%0.72775%0.752SS**  trans-140.2118.2158.5-98.2-53.6000112.3
700Q27.1Very low28.5Very low163 Ų163144.8 Ų144.876%0.76276%0.756SS**  trans51.3107.2141.7-58.7171.464.900117.6
701V26.3Very low28.3Very low119 Ų119142.8 Ų142.872%0.72175%0.751SS**  cis7011848.4-1740000113.9
702I27.3Very low28.1Very low163 Ų163141.5 Ų141.584%0.83674%0.743SS**  -171.1121.3126.5-92.3154.6000108.3
703D25.7Very low28.2Very low135 Ų135139.4 Ų139.472%0.72274%0.742SS**  trans-78.1160.7169.5-57.7-84.2000110.2
704S29.2Very low28.1Very low95 Ų95141 Ų14166%0.66474%0.739SS**  179.1153.671.8-70.80000114.3
705Q28.9Very low28.1Very low166 Ų166137.4 Ų137.478%0.77673%0.726SS**  trans68.4108139.2-75.7173.128.400121.8
706Q28.7Very low28.4Very low148 Ų148135.5 Ų135.569%0.69272%0.717SS**  99.1145.8103.4-171.5165.1-24.100120.6
707E26.6Very low28.5Very low132 Ų132133.6 Ų133.662%0.61770%0.7SS**  trans81.899.4159.7-91174.6130.200123
708Q26.3Very low28.7Very low151 Ų151137 Ų13771%0.70670%0.702SS**  71126.8114.9-80.4-163.986.400122.5
709V27.2Very low28.2Very low106 Ų106137.1 Ų137.164%0.64271%0.705SS**  trans72.7116.6130.4173.70000118.9
710Y27.3Very low28.9Very low206 Ų206139 Ų13981%0.80871%0.714SS**  trans26.3128.5146.5-69.7-101.9000119.6
711D28.1Very low28.9Very low145 Ų145140.5 Ų140.578%0.77572%0.721SS**  -141.5148.7103-143.5-17000114.2
712T29.2Very low29.4Very low100 Ų100143.3 Ų143.361%0.61372%0.724SS**  trans-59.5168.4162.210000111
713T31.3Very low29.6Very low122 Ų122142.1 Ų142.175%0.74872%0.719SS**  -165.3156.463.2-52.30000111.5
714E28.4Very low29.6Very low155 Ų155145.8 Ų145.872%0.72473%0.729SS**  trans-60.2-174.8167.5-49.2174.1118.200112.1
715N31.1Very low29.6Very low102 Ų102146.9 Ų146.955%0.54574%0.735SS.*  cis-175.4-176.335.8-149.9-55.8000112.3
716K32.1Very low29.8Very low152 Ų152144.7 Ų144.766%0.66173%0.733SS**  trans87.285.4158.9-62.7-68.2120.6-1590120.3
717D27.3Very low29.7Very low87 Ų87146.4 Ų146.447%0.46574%0.741SS.*  68.1127.3106.1-70.9-6000124.3
718F29.1Very low29.7Very low181 Ų181144.9 Ų144.979%0.79474%0.743SS**  trans53.3133.8140.2-48.1-48000119.9
719S26.2Very low29.7Very low115 Ų115143.3 Ų143.380%0.80474%0.744SS**  cis-173.2171.144.644.20000112.5
720L43.3Very low29.6Very low177 Ų177145.6 Ų145.693%0.92775%0.753SS**  trans-86.9126.3170.8-79.5158.4000111.7
721Q27.5Very low29.6Very low194 Ų194140.8 Ų140.891%0.90775%0.745SS**  trans-150.7154.8154.7-159.9159.39.800112.4
722K36Very low30.3Very low178 Ų178139.6 Ų139.677%0.77475%0.745SS**  trans-94.8164.2-178.5-60.4-175.1171.7-172.40113.6
723D31.9Very low30.3Very low137 Ų137141.9 Ų141.973%0.73375%0.748SS**  trans56.2113.1147.1-53.7-29.8000119.8
724K26.8Very low30.1Very low213 Ų213143.7 Ų143.793%0.92675%0.748SS**  trans-158.6152.1131.9-115.7168.8-174.8177.90112.6
725C29.4Very low30.2Very low118 Ų118142.2 Ų142.280%0.79775%0.75SS**  trans-127.5179.5-177-61.30000111.5
726V32.5Very low30.7Very low120 Ų120142.4 Ų142.473%0.72776%0.756SS**  trans85.6111.9158.5-171.20000118.4
727Q25.8Very low30.4Very low184 Ų184144 Ų14486%0.8677%0.766SS**  -158.5122.2114.9-98.8169.1-21.800107.3
728C26.6Very low30.5Very low100 Ų100146.5 Ų146.568%0.67678%0.775SS**  69.8130.775.5-60.40000112.8
729T27.6Very low31Very low117 Ų117143.6 Ų143.672%0.71877%0.774SS**  cis-155.7165.4-2.2-5.90000107.9
730D23.8Very low31.2Very low154 Ų154144.6 Ų144.682%0.82477%0.766SS**  -171.3-178.171-99.6-40.6000113.4
731V27.7Very low30.9Very low106 Ų106141.3 Ų141.364%0.64276%0.756SS**  trans-139143.9-159.4163.10000112.1
732P43Very low30.8Very low119 Ų119138.8 Ų138.877%0.77375%0.747SS**  -136.7154.993.11411.1000114.3
733H28.8Very low30.2Very low149 Ų149138.5 Ų138.569%0.6975%0.749SS**  72.5138.356.1-7233000113.7
734E27.2Very low30.4Very low159 Ų159136.6 Ų136.674%0.74374%0.744SS**  cis-155.1146.89.4-112.7164.3119.200109.5
735V31.5Very low30.3Very low125 Ų125135.9 Ų135.976%0.75874%0.744SS**  64.714590.1174.20000114.6
736P40.9Very low30Very low106 Ų106138.9 Ų138.969%0.68875%0.746SS**  cis-118-164.65.742.1-25.1000113.6
737E26.5Very low30.3Very low186 Ų186138.1 Ų138.187%0.86974%0.744SS**  cis-151.8170.712.4-154154.5-121.800113.3
738Q29Very low30.3Very low139 Ų139133.6 Ų133.665%0.6574%0.738SS**  trans-102.7-171.7-176.4-126.1-150.1-1700111.7E740Q738-E740 PolarHBondContact NE2-OE2 3.27Å
739P39.1Very low30.3Very low119 Ų119134.9 Ų134.977%0.77375%0.748SS**  cis-137.6178.923.341.5-20000119.3
740E30.5Very low30.1Very low136 Ų136134.2 Ų134.264%0.63675%0.748SS**  trans-74.3-172.4173-99.7176.8103.100114.6Q738Q738-E740 PolarHBondContact NE2-OE2 3.27Å
741P36.4Very low30.1Very low109 Ų109135.9 Ų135.971%0.70875%0.751SS**  cis-144.6161.719.528.3-1.6000121.9
742L25.2Very low29.9Very low140 Ų140140.4 Ų140.473%0.73376%0.758SS**  trans54.5115.8136.8-58.5168.8000125.4
743Q23.4Very low29.1Very low173 Ų173140.2 Ų140.281%0.80876%0.755SS**  33.3167.1111.8-85.4-167.91.300124.2
744P36.7Very low28.9Very low97 Ų97140.2 Ų140.263%0.6376%0.755SS**  cis-144.2-169-21.738-16.2000116.8
745E24.3Very low28.9Very low197 Ų197137.4 Ų137.492%0.92176%0.759SS**  trans85.4170.3144-92.2175.8-17400125.6
746E24.3Very low28.8Very low182 Ų182137.8 Ų137.885%0.8576%0.757SS**  trans-97.3-165.2-166.5-121-174.1-17900112.4
747P39.1Very low28.3Very low104 Ų104142.8 Ų142.868%0.67576%0.762SS**  cis-136.3-177.5-30.438.4-19.7000115
748A24.3Very low28.3Very low89 Ų89141.3 Ų141.374%0.73676%0.755SS**  trans51.2155.9140.300000126.5
749S26.5Very low28.2Very low126 Ų126138.5 Ų138.588%0.88176%0.756SS**  trans93.1179.3150.181.80000120.7
750S24.9Very low27.6Very low104 Ų104138.2 Ų138.273%0.72775%0.752SS**  trans-155.8149.9-150.857.80000113.4
751E23.7Very low27.5Very low188 Ų188140.1 Ų140.188%0.87976%0.761SS**  trans-176129.9140.3-107.6-174.5128.100116.2
752Y23Very low27Very low201 Ų201142.5 Ų142.579%0.78876%0.762SS**  57.6173.4125.4-141.1-114.8000125.7
753V26.8Very low26.9Very low116 Ų116140.2 Ų140.270%0.70376%0.758SS**  trans88.282.6169.8-164.10000119.9
754E24.4Very low27Very low148 Ų148137.7 Ų137.769%0.69276%0.758SS**  33.6126.1117.3-169179.1-17100122.9
755A26.5Very low26.7Very low101 Ų101145.3 Ų145.384%0.83577%0.774SS**  trans-159.3157.7143.700000112
756N30Very low26.9Very low133 Ų133143.2 Ų143.271%0.71176%0.764SS**  trans-114.8172.8-165.7-75.1-84.7000115.2
757R29Very low26.9Very low210 Ų210143.6 Ų143.679%0.79276%0.759SS**  trans107.5124161.5-65-172.4-172.6-86.8-0.5116.4
758E26.7Very low26.9Very low155 Ų155144.6 Ų144.672%0.72476%0.764SS**  85.612653.8176.6-168.8-13800111.7
759A27.4Very low27Very low81 Ų81144.2 Ų144.267%0.66977%0.769SS**  cis-168.7-168.1-10.200000111
760T27.5Very low27.3Very low112 Ų112148 Ų14869%0.68776%0.764SS**  trans96.8120.9142.2-48.30000121.4
761E27.5Very low27.7Very low176 Ų176151.8 Ų151.882%0.82277%0.767SS**  trans62.4155.9145.6-73.4168.5-168.600123
762E25.2Very low27.9Very low159 Ų159149.2 Ų149.274%0.74376%0.755SS**  cis-164.5174-29.4-150.6-131.1122.600111.2
763S24.2Very low27.9Very low93 Ų93145.5 Ų145.565%0.6576%0.758SS**  trans67118.6148.7-119.50000122.7
764C25.9Very low28Very low119 Ų119146.5 Ų146.580%0.80477%0.765SS**  trans-112.5141.6163.1-59.40000110
765R30.3Very low28.1Very low258 Ų258143.3 Ų143.397%0.97476%0.764SS**  trans-170.8-176.2135.3-111.5168.2-171-116.7-1.9117.8
766E27.1Very low28.2Very low152 Ų152147.6 Ų147.671%0.7176%0.764SS**  trans-134.1141.9-153.1-175.6-178.5-17200112.3K1149E766-K1149 VanDerWaalsContact CD-NZ 3.32Å; E766-K1149 WeakPolarHBondContact OE1-CE 3.41Å; E766-K1149 IonicContact OE1-NZ 3.53Å; E766-K1149 PolarHBondContact OE1-NZ 2.91Å
767Y25.5Very low27.9Very low190 Ų190147.4 Ų147.475%0.74576%0.763SS**  trans-102.6155.9179.5-89.2-116.9000112.7K1149Y767-K1149 PolarHBondContact O-NZ 3.28Å
768T37.7Very low27.8Very low125 Ų125143.7 Ų143.777%0.76776%0.763SS**  cis-173.3164.7-17.726.90000108.3
769G27.4Very low27.8Very low82 Ų82141.7 Ų141.785%0.84577%0.765SS**  trans-124.2157166.300000112.9
770R32.3Very low28Very low205 Ų205145.4 Ų145.477%0.77477%0.773SS**  trans-121.5136.1-161.9-174.4-158.9-142.8-112.68.5114E772R770-E772 IonicContact NH1-OE1 2.65Å; R770-E772 PolarHBondContact NH1-OE1 3.38Å; R770-E772 IonicContact NH1-OE2 3.3Å
771K32.9Very low29Very low183 Ų183145.9 Ų145.980%0.79678%0.778SS**  trans162.1159.5132.9-91.4-179174.2-173.10111.6
772E27.6Very low29.1Very low135 Ų135141.8 Ų141.863%0.63177%0.774SS**  cis170114.4-30171.8161.7-13800108.1R770R770-E772 IonicContact NH1-OE1 2.65Å; R770-E772 PolarHBondContact NH1-OE1 3.38Å; R770-E772 IonicContact NH1-OE2 3.3Å
773S23.9Very low29.5Very low122 Ų122138.5 Ų138.585%0.85377%0.774SS**  trans-164.6177.3167.3640000111.2
774T28.1Very low29.7Very low138 Ų138142 Ų14285%0.84778%0.784SS**  trans-140.4142.7-144.6-45.20000114.8
775A27Very low29.9Very low81 Ų81143.5 Ų143.567%0.66978%0.779SS**  139.2124.4129.600000117.8
776K30Very low29.7Very low190 Ų190139.3 Ų139.383%0.82677%0.771SS**  trans68151.8152.9-63-177.5179.4-165.20118.5
777D22.2Very low29.5Very low129 Ų129138.8 Ų138.869%0.6977%0.773SS**  cis-156.6155.9-3.2-120.9-25000110.6
778V28.2Very low30.4Very low133 Ų133134.5 Ų134.581%0.80677%0.768SS**  trans67149159.7170.10000117.6
779C25.7Very low29.7Very low112 Ų112136.1 Ų136.176%0.75777%0.767SS**  cis-161.3-158.2-24.9-96.90000110.2
780L31.5Very low30.2Very low159 Ų159138.1 Ų138.183%0.83277%0.765SS**  trans-137.3164.6-177.7-70.6171.6000112.4
781P47.9Very low30.2Very low122 Ų122138.7 Ų138.779%0.79277%0.767SS**  -134.5147.784.925.8-6.3000113.7
782A31.3Very low29.8Very low91 Ų91138.6 Ų138.675%0.75277%0.769SS**  cis77.8135.940.400000114.1
783A32.8Very low30Very low90 Ų90137.8 Ų137.874%0.74477%0.774SS**  cis-165.9-171.1-8.200000109.1
784I27.6Very low30.1Very low167 Ų167138.4 Ų138.486%0.85677%0.767SS**  trans179.4-141.3152-89.7154.5000113.4
785Q30.7Very low30Very low150 Ų150137.4 Ų137.470%0.70175%0.754SS**  trans-158.9170.5-147.7-75.2-176.7-30.800112.3
786Q27.2Very low30.1Very low169 Ų169140.5 Ų140.579%0.7975%0.753SS**  cis-161-179.2-9.3-115.9172-4.600114.1
787D21.9Very low30Very low142 Ų142133.8 Ų133.876%0.75973%0.73SS**  trans-108.5-159.3178.7-154.733.7000109.7
788P45.5Very low30.3Very low99 Ų99135.8 Ų135.864%0.64373%0.733SS**  cis-145.3169.8-445-25.3000120.1
789H22.9Very low30.3Very low160 Ų160134.3 Ų134.374%0.74173%0.728SS**  trans65.7176.2147.2-101.6-119.8000120.2
790P37.7Very low30.3Very low123 Ų123134.6 Ų134.680%0.79972%0.722SS**  cis-125.9-144.96.443.5-25.2000116.9
791R30.9Very low30.1Very low217 Ų217136 Ų13682%0.81972%0.724SS**  trans-161.8139.2-151.6173.1-158.1-167.4-161.27113.9
792E26.3Very low29.8Very low181 Ų181134.8 Ų134.885%0.84672%0.719SS**  trans-175.4132.6154.4-102.4149-142.300109.1
793T30.6Very low30.1Very low118 Ų118138.6 Ų138.672%0.72473%0.726SS**  85.3132.676.4-51.60000111.5
794D25.9Very low30Very low135 Ų135140.3 Ų140.372%0.72273%0.729SS**  cis-157.3-171.529.9-145.8-21.9000116
795M25.4Very low30Very low117 Ų117136.4 Ų136.458%0.57672%0.722SS**  trans94.1150.3162.7-57.9-151.180.100121.6P299P299-M795 HydrophobicContact CB-CB 4.36Å; P299-M795 HydrophobicContact CB-CE 3.54Å; P299-M795 HydrophobicContact CB-SD 3.74Å; P299-M795 HydrophobicContact CG-CE 3.9Å; P299-M795 HydrophobicContact CG-SD 3.67Å
796F29.8Very low29.9Very low146 Ų146135.8 Ų135.864%0.6472%0.722SS**  trans-134.4-176.5-168.3-78.2-99.3000110.9Q300Q300-F796 VanDerWaalsContact OE1-C 3.25Å; Q300-F796 PolarHBondContact OE1-O 3.46Å
797S27.4Very low30Very low49 Ų49135 Ų13534%0.34372%0.723SS.*  cis-160.5153.614.968.90000114.1Q300Q300-S797 VanDerWaalsContact CD-CB 3.47Å; Q300-S797 WeakPolarHBondContact CG-OG 3.34Å; Q300-S797 PolarHBondContact NE2-OG 3.05Å; Q300-S797 VanDerWaalsContact OE1-CB 3.25Å; Q300-S797 PolarHBondContact OE1-OG 3.12Å
798K30.2Very low30.3Very low171 Ų171136 Ų13674%0.74372%0.723SS**  50.4164.7128.7-66.1-169.8179.4-167.50121
799S27.6Very low29.7Very low102 Ų102139.4 Ų139.471%0.71373%0.734SS**  cis-165.7170817.80000109.6
800D25.8Very low30.4Very low118 Ų118138.9 Ų138.963%0.63174%0.737SS**  cis-173.3145.1-30.1-88.5-26.7000108.8
801H27.7Very low30.1Very low188 Ų188140.8 Ų140.887%0.8774%0.74SS**  trans70.2-173.5162.1-69.5-63.7000121.7
802S41.5Very low30.8Very low98 Ų98139.6 Ų139.669%0.68574%0.744SS**  trans-143142-140.158.10000117.4
803L37.7Very low31.4Very low171 Ų171136.7 Ų136.790%0.89574%0.743SS**  trans64.8133.3173-62.6177.5000115.6
804P30.8Very low32Very low126 Ų126139.5 Ų139.582%0.81875%0.749SS**  -149.7-171.179.340.6-21.3000115.9
805A27.6Very low32.9Very low84 Ų84137.1 Ų137.169%0.69474%0.74SS**  trans-83.9-178156.700000109.7
806I26.6Very low33.8Very low138 Ų138138 Ų13871%0.70875%0.746SS**  cis-157.9163.940-67.4171.5000108.4E808I806-E808 HydrophobicContact CG2-CB 4.4Å
807N29.8Very low34.7Very low151 Ų151135.8 Ų135.881%0.80775%0.749SS**  trans161.595.4141.9-81-3.7000107.9
808E29.1Very low35.2Very low165 Ų165141.9 Ų141.977%0.77177%0.765SS**  70.783.265.3-163.6174.6-117.400114.2I806I806-E808 HydrophobicContact CG2-CB 4.4Å
809I33.1Very low35.9Very low169 Ų169138.9 Ų138.987%0.86776%0.757SS**  trans-137.4142.7144.3-54.9-178.4000105.9
810N37Very low36.9Very low150 Ų150140 Ų14080%0.80275%0.75SS**  trans-65.6144.9-170.5-50.5-34.8000114
811D30.4Very low38.3Very low163 Ų163139.7 Ų139.787%0.87275%0.749SS**  -155.6153.8127.9-135.9-23.8000111.6
812E47Very low39.7Very low192 Ų192136.2 Ų136.290%0.89773%0.733SS**  trans-94.2108.3-174-68.2-172.613500112.8
813S37.8Very low40.4Very low119 Ų119136.2 Ų136.283%0.83273%0.725SS**  trans-156.8136.5159.750.10000113.5
814E43.5Very low41.7Very low178 Ų178130.3 Ų130.383%0.83270%0.698SS**  trans-114.7-171.6175.6-138.6-159.9-168.700110.2
815P45.9Very low43.5Very low85 Ų85130.8 Ų130.855%0.55269%0.69SS**  -104.6135.4-120.736-22.6000115.2
816I44.1Very low45.3Very low134 Ų134131 Ų13169%0.68768%0.679SS**SBendtrans-86.7-25.1179.6-63.8172.9000112.9Y818 L819I816-Y818 VanDerWaalsContact C-N 3.33Å; I816-Y818 PolarHBondContact O-N 3.36Å; I816-L819 PolarHBondContact O-N 3.21Å
817S47.3Very low47.1Very low100 Ų100128.4 Ų128.470%0.69967%0.666SS**THydrogen-bonded Turntrans-68.5-19.4-165.951.60000116.3
818Y38.6Very low48.8Very low177 Ų177129 Ų12969%0.69466%0.661SS**THydrogen-bonded Turntrans-84.1-15.8-176.5-165.7-104.1000114.2I816I816-Y818 VanDerWaalsContact C-N 3.33Å; I816-Y818 PolarHBondContact O-N 3.36Å
819L44.4Very low50.9Low109 Ų109128 Ų12857%0.57166%0.657SS**Hα-helixtrans-82.3-24.5-179.5-79.1165.6000113.7I816 L823I816-L819 PolarHBondContact O-N 3.21Å; L819-L823 PolarHBondContact O-N 3.41Å
820H48.3Very low52.4Low124 Ų124126 Ų12657%0.57464%0.642SS**Hα-helixtrans-68.8-34.8-175.1-85.8-78.9000113.7S824H820-S824 WeakPolarHBondContact O-CB 3.42Å; H820-S824 PolarHBondContact O-N 2.92Å; H820-S824 PolarHBondContact O-OG 3.01Å
821D55.2Low53.3Low113 Ų113123.1 Ų123.160%0.60463%0.631SS**Hα-helixtrans-63.5-47.8177.9-78.1-6.5000111L823 S824 E825D821-L823 PolarHBondContact O-N 3.45Å; D821-S824 PolarHBondContact O-N 3.37Å; D821-S824 VanDerWaalsContact O-N 3.14Å; D821-S824 PolarHBondContact O-OG 3Å; D821-E825 PolarHBondContact O-N 2.79Å
822Q59Low54.3Low115 Ų115126 Ų12654%0.53763%0.631SS.*Hα-helixtrans-63.9-39.1-179.3-64.3-169.6-8.800112.8L826Q822-L826 WeakPolarHBondContact O-CB 3.23Å; Q822-L826 PolarHBondContact O-N 2.92Å
823L55.3Low54.5Low97 Ų97120.4 Ų120.451%0.50863%0.625SS.*Hα-helixtrans-69.1-34.6175-69172.3000112.2L819 D821 L826 L827L819-L823 PolarHBondContact O-N 3.41Å; D821-L823 PolarHBondContact O-N 3.45Å; L823-L826 PolarHBondContact O-N 3.34Å; L823-L827 WeakPolarHBondContact O-CB 3.31Å; L823-L827 WeakPolarHBondContact O-CG 3.46Å; L823-L827 PolarHBondContact O-N 2.93Å
824S65.3Low54.9Low48 Ų48120.5 Ų120.534%0.33662%0.615SS.*Hα-helixtrans-78.1-23178.177.90000114H820 D821 K828H820-S824 WeakPolarHBondContact O-CB 3.42Å; H820-S824 PolarHBondContact O-N 2.92Å; H820-S824 PolarHBondContact O-OG 3.01Å; D821-S824 PolarHBondContact O-N 3.37Å; D821-S824 VanDerWaalsContact O-N 3.14Å; D821-S824 PolarHBondContact O-OG 3Å; S824-K828 WeakPolarHBondContact O-CD 3.28Å; S824-K828 WeakPolarHBondContact O-CG 3.45Å; S824-K828 PolarHBondContact O-N 3.41Å
825E69Low54.9Low136 Ų136121 Ų12164%0.63662%0.617SS**Hα-helixtrans-71.5-44.2163.6-70.9-167.5145.400110.9D821 L827 K828 E829D821-E825 PolarHBondContact O-N 2.79Å; E825-L827 VanDerWaalsContact C-N 3.34Å; E825-L827 PolarHBondContact O-N 2.86Å; E825-K828 WeakPolarHBondContact O-CA 3.42Å; E825-K828 WeakPolarHBondContact O-CB 3.25Å; E825-K828 PolarHBondContact O-N 2.69Å; E825-E829 PolarHBondContact O-N 3.04Å
826L65.1Low54.5Low89 Ų89122.1 Ų122.147%0.46662%0.623SS.*Hα-helixtrans-60.9-40.7177.8-151.376000112.3Q822 L823 K828 E829 F830Q822-L826 WeakPolarHBondContact O-CB 3.23Å; Q822-L826 PolarHBondContact O-N 2.92Å; L823-L826 PolarHBondContact O-N 3.34Å; L826-K828 VanDerWaalsContact C-N 3.26Å; L826-K828 PolarHBondContact O-N 3.42Å; L826-E829 PolarHBondContact O-N 3.36Å; L826-F830 HydrophobicContact CD1-CD2 4.28Å; L826-F830 HydrophobicContact CD1-CE2 4.09Å; L826-F830 HydrophobicContact CG-CD2 4.12Å; L826-F830 HydrophobicContact CG-CE2 4.41Å; L826-F830 WeakPolarHBondContact O-CD2 3.45Å; L826-F830 PolarHBondContact O-N 3.28Å
827L65Low54.1Low83 Ų83125 Ų12544%0.43563%0.631SS.*Hα-helixtrans-66.3-22.6174.1-76.5164000113.7L823 E825 I834L823-L827 WeakPolarHBondContact O-CB 3.31Å; L823-L827 WeakPolarHBondContact O-CG 3.46Å; L823-L827 PolarHBondContact O-N 2.93Å; E825-L827 VanDerWaalsContact C-N 3.34Å; E825-L827 PolarHBondContact O-N 2.86Å; L827-I834 HydrophobicContact CD2-CB 4.15Å; L827-I834 HydrophobicContact CD2-CD1 3.91Å; L827-I834 HydrophobicContact CD2-CG1 4.46Å
828K64.7Low53.5Low162 Ų162126.8 Ų126.870%0.70463%0.633SS**Hα-helixtrans-83.2-32.2171.8-73.8166.7-176158.80112.4S824 E825 L826S824-K828 WeakPolarHBondContact O-CD 3.28Å; S824-K828 WeakPolarHBondContact O-CG 3.45Å; S824-K828 PolarHBondContact O-N 3.41Å; E825-K828 WeakPolarHBondContact O-CA 3.42Å; E825-K828 WeakPolarHBondContact O-CB 3.25Å; E825-K828 PolarHBondContact O-N 2.69Å; L826-K828 VanDerWaalsContact C-N 3.26Å; L826-K828 PolarHBondContact O-N 3.42Å
829E72.1Confident53.3Low146 Ų146129.4 Ų129.468%0.68264%0.641SS**Hα-helixtrans-77.3-28.5177.1-163.6164.7-149.800111.9E825 L826 P831E825-E829 PolarHBondContact O-N 3.04Å; L826-E829 PolarHBondContact O-N 3.36Å; E829-P831 VanDerWaalsContact C-CD 3.49Å; E829-P831 WeakPolarHBondContact O-CD 3.39Å
830F64.9Low52.6Low126 Ų126132.7 Ų132.755%0.55365%0.653SS**  trans-122.970.2177.3-59-82.2000112.8L826 Y832L826-F830 HydrophobicContact CD1-CD2 4.28Å; L826-F830 HydrophobicContact CD1-CE2 4.09Å; L826-F830 HydrophobicContact CG-CD2 4.12Å; L826-F830 HydrophobicContact CG-CE2 4.41Å; L826-F830 WeakPolarHBondContact O-CD2 3.45Å; L826-F830 PolarHBondContact O-N 3.28Å; F830-Y832 PolarHBondContact O-N 3.21Å
831P55.6Low51.8Low90 Ų90135.3 Ų135.358%0.58467%0.666SS**SBendtrans-71.42.1-176.630.3-37.1000115.2E829E829-P831 VanDerWaalsContact C-CD 3.49Å; E829-P831 WeakPolarHBondContact O-CD 3.39Å
832Y52.9Low50.5Low222 Ų222136 Ų13687%0.87167%0.674SS**SBendtrans-135103.2174.9-60.9-72.6000109F830F830-Y832 PolarHBondContact O-N 3.21Å
833G50.1Low49.3Very low75 Ų75135.3 Ų135.377%0.77368%0.682SS**SBendtrans161.3-13.8178.500000116.7
834I46.8Very low47.9Very low121 Ų121138.2 Ų138.262%0.62170%0.697SS**  trans-133.4106.7179.1-53.8179.7000109.3L827L827-I834 HydrophobicContact CD2-CB 4.15Å; L827-I834 HydrophobicContact CD2-CD1 3.91Å; L827-I834 HydrophobicContact CD2-CG1 4.46Å
835E43.6Very low46.1Very low188 Ų188143.3 Ų143.388%0.87972%0.721SS**  trans-78.3123.3169.3-66.7-175.9157.300109.4F837E835-F837 PolarHBondContact O-N 3.42Å
836T37.6Very low44.4Very low110 Ų110145 Ų14568%0.67573%0.729SS**  trans-7894.3-176.551.60000111N838T836-N838 PolarHBondContact O-N 3.11Å
837F36.5Very low42.6Very low193 Ų193149 Ų14985%0.84675%0.745SS**  trans-73.690.2178.3-145.6-79.2000111.1E835 R839E835-F837 PolarHBondContact O-N 3.42Å; F837-R839 PolarHBondContact O-N 3.35Å
838N34.3Very low40.7Very low138 Ų138154 Ų15474%0.73876%0.763SS**  trans-62.7105.7177.2-77.9-12.6000110.9T836T836-N838 PolarHBondContact O-N 3.11Å
839R33.8Very low39Very low233 Ų233152.3 Ų152.388%0.87977%0.766SS**  trans-78.1121.5160.4-77.2-170.7173.7-169.8-1.6109.1F837 E841F837-R839 PolarHBondContact O-N 3.35Å; R839-E841 PolarHBondContact O-N 3Å
840H29.9Very low36.9Very low177 Ų177154.4 Ų154.482%0.81978%0.776SS**  trans-68.9116.2160.7-89.3-85.2000109V842H840-V842 PolarHBondContact O-N 3.18Å
841E31.6Very low35.4Very low180 Ų180157.4 Ų157.484%0.84179%0.788SS**  trans-80.9107.4172.5-170.3164.3-122.400108.7R839R839-E841 PolarHBondContact O-N 3Å
842V27.4Very low34Very low126 Ų126160.6 Ų160.676%0.76480%0.799SS**  trans-10398.1176.7-179.80000108.4H840H840-V842 PolarHBondContact O-N 3.18Å
843S34Very low32.8Very low102 Ų102156.3 Ų156.371%0.71380%0.796SS**  trans-77.7129.8178-38.80000111
844L26.6Very low31.8Very low157 Ų157160.9 Ų160.982%0.82280%0.797SS**  trans-152.491.5166.5-118.4169.5000112.7
845D26.3Very low30.9Very low156 Ų156163 Ų16383%0.83481%0.809SS**  trans48.9155.5152-118.2-31.4000124.1
846Q33.9Very low30.4Very low172 Ų172162.5 Ų162.580%0.80481%0.807SS**  trans-89.6137.5175.4-58.4176.8-2.100111.6
847Q26.9Very low29.9Very low171 Ų171164.3 Ų164.380%0.79982%0.818SS**  trans-163.2128.8132.9-119.3178.389.900117.9
848K25.8Very low29.5Very low190 Ų190158.8 Ų158.883%0.82682%0.815SS**  trans70.1138138-111.1171.2-176.2167.40122.6
849T28.4Very low29Very low126 Ų126156.1 Ų156.177%0.77382%0.821SS**  trans-77.5146178.8-37.70000113.7
850H27.4Very low29.4Very low189 Ų189154.9 Ų154.988%0.87582%0.822SS**  trans-159.7153.5135.5-119.3-86.2000112.6
851K34.1Very low29.3Very low189 Ų189152.9 Ų152.982%0.82282%0.822SS**  trans-96144.4171.9-70.5-179.8175.4-179.80111.2
852I26Very low29.2Very low158 Ų158148.9 Ų148.981%0.8181%0.814SS**  trans-173.8110.3154.4-99.3145.8000105.8
853V27.2Very low29.3Very low132 Ų132150.3 Ų150.380%0.882%0.817SS**  79.9141.287.61700000113.7
854E29.3Very low29.6Very low171 Ų171152.5 Ų152.580%0.79983%0.826SS**  trans-65.2157.2-172.4-58.7159.299.800114.3
855N28.4Very low30.1Very low164 Ų164150.7 Ų150.788%0.87783%0.826SS**  -171.5160.8110.3-101.6-68.1000113.1
856Q33.5Very low30.9Very low179 Ų179146.7 Ų146.784%0.83682%0.822SS**  trans-92.7150.1173.2-55.217631.400110.9
857T26.2Very low31Very low148 Ų148146 Ų14691%0.90882%0.824SS**  trans173.6141.8137.3-74.70000109
858G28.3Very low31.8Very low76 Ų76143.3 Ų143.378%0.78482%0.824SS**  trans-98.3160.8-176.300000114.8
859G24.5Very low32.5Very low82 Ų82139.6 Ų139.685%0.84582%0.818SS**  trans-166.5139.6171.900000111.6
860K41.4Very low33.5Very low207 Ų207141.1 Ų141.190%0.982%0.821SS**  trans-95.4129.8177.8-77-179.9175.9176.70111.6
861T28.7Very low34.4Very low136 Ų136140.3 Ų140.383%0.83482%0.818SS**  trans-165124.2135.618.30000107.7
862S28.6Very low35.4Very low96 Ų96138.8 Ų138.867%0.67182%0.817SS**  54.3102.591.8-164.80000114.2
863N30.4Very low36.3Very low155 Ų155139.5 Ų139.583%0.82981%0.814SS**  -167.2161.2106.1-88.2-13.7000111.7
864V39.1Very low38Very low148 Ų148140.4 Ų140.490%0.89781%0.813SS**  trans-88.8130.8178.6174.60000109.9
865S36.9Very low39.8Very low119 Ų119136.6 Ų136.683%0.83280%0.801SS**  trans-138.7136.2149.1-1680000107.3
866G43.9Very low41.8Very low72 Ų72135.2 Ų135.274%0.74280%0.799SS**  trans-94.2129.7-175.400000111.6
867D37Very low44Very low157 Ų157130.1 Ų130.184%0.8478%0.777SS**  trans-143.1105.4156.1-133.5-22.9000107.9T869D867-T869 VanDerWaalsContact C-N 3.33Å; D867-T869 PolarHBondContact O-N 2.93Å
868S41.7Very low46.4Very low115 Ų115126.2 Ų126.280%0.80475%0.75SS**  trans-84.673.9-169.358.40000111.4
869T41.2Very low48.3Very low113 Ų113126.7 Ų126.769%0.69374%0.742SS**  trans-76.2130.3161-58.60000109.1D867 Q871D867-T869 VanDerWaalsContact C-N 3.33Å; D867-T869 PolarHBondContact O-N 2.93Å; T869-Q871 VanDerWaalsContact C-N 3.32Å; T869-Q871 PolarHBondContact O-N 3.25Å
870D49.9Very low50.9Low158 Ų158129.2 Ų129.285%0.84573%0.731SS**  trans-67.479.9-176.4-68.7-57.7000113.4I872D870-I872 PolarHBondContact O-N 3.03Å
871Q45.6Very low52.9Low172 Ų172123.4 Ų123.480%0.80471%0.708SS**  trans-78.3112.2169.3-67.6-170.611.700110.3T869 K873T869-Q871 VanDerWaalsContact C-N 3.32Å; T869-Q871 PolarHBondContact O-N 3.25Å; Q871-K873 VanDerWaalsContact C-N 3.35Å; Q871-K873 PolarHBondContact O-N 2.9Å
872I55.9Low55.3Low157 Ų157120.9 Ų120.981%0.80569%0.688SS**  trans-65.793.8171-57.5177000108.9D870 I874D870-I872 PolarHBondContact O-N 3.03Å; I872-I874 HydrophobicContact CG2-CG1 4.23Å; I872-I874 PolarHBondContact O-N 2.73Å; I872-I874 VanDerWaalsContact O-N 3.12Å
873K45Very low57.6Low173 Ų173122 Ų12275%0.75268%0.681SS**  trans-80.690.4-178.7-171.6-177178.1-178.10110.8Q871 T875Q871-K873 VanDerWaalsContact C-N 3.35Å; Q871-K873 PolarHBondContact O-N 2.9Å; K873-T875 HydrophobicContact CD-CG2 4.46Å; K873-T875 HydrophobicContact CG-CG2 4.37Å; K873-T875 PolarHBondContact O-N 3.39Å
874I62.5Low59.6Low150 Ų150122.2 Ų122.277%0.76968%0.677SS**  trans-72.595.5172.2-55178.1000109.2I872I872-I874 HydrophobicContact CG2-CG1 4.23Å; I872-I874 PolarHBondContact O-N 2.73Å; I872-I874 VanDerWaalsContact O-N 3.12Å
875T67.6Low61.3Low91 Ų91120.6 Ų120.656%0.55866%0.663SS**  trans-83.5111.6166.939.70000110.4K873 L877K873-T875 HydrophobicContact CD-CG2 4.46Å; K873-T875 HydrophobicContact CG-CG2 4.37Å; K873-T875 PolarHBondContact O-N 3.39Å; T875-L877 PolarHBondContact O-N 3.14Å
876V70.8Confident63Low136 Ų136122 Ų12282%0.82465%0.654SS**  trans-72.4113.4163.7-178.40000107.7
877L78.9Confident63.9Low71 Ų71123.2 Ų123.237%0.37265%0.649SS.*  trans-79.3148.1173.7-60-179.4000110.1T875 Q881 I882 L885T875-L877 PolarHBondContact O-N 3.14Å; L877-Q881 HydrophobicContact CB-CB 4.15Å; L877-Q881 HydrophobicContact CD2-CB 4.43Å; L877-I882 HydrophobicContact CB-CD1 4.43Å; L877-I882 HydrophobicContact CB-CG1 4.05Å; L877-L885 HydrophobicContact CD1-CD1 3.63Å
878N75.9Confident64.9Low67 Ų67121.7 Ų121.736%0.35864%0.637SS.*  trans-81.5171.1169.987.8-9.1000111.3E880 Q881 I882N878-E880 PolarHBondContact ND2-OE2 3.32Å; N878-E880 PolarHBondContact O-N 3.12Å; N878-E880 WeakPolarHBondContact OD1-CB 3.42Å; N878-E880 PolarHBondContact OD1-N 2.02Å; N878-Q881 PolarHBondContact O-N 3.25Å; N878-Q881 WeakPolarHBondContact OD1-CG 3.46Å; N878-Q881 PolarHBondContact OD1-N 3.42Å; N878-I882 WeakPolarHBondContact O-CG1 3.03Å; N878-I882 PolarHBondContact O-N 3.28Å; N878-I882 VanDerWaalsContact O-N 3.14Å
879S69.6Low65.3Low86 Ų86123.9 Ų123.960%0.60164%0.639SS**Hα-helixtrans-64-22.7-178.846.30000114.5K883S879-K883 WeakPolarHBondContact O-CG 3.45Å; S879-K883 PolarHBondContact O-N 3.34Å
880E79.1Confident65.6Low134 Ų134125.7 Ų125.763%0.62664%0.644SS**Hα-helixtrans-79.3-45179.7-60.4152.2172.200109.9N878 I882 K883 E884N878-E880 PolarHBondContact ND2-OE2 3.32Å; N878-E880 PolarHBondContact O-N 3.12Å; N878-E880 WeakPolarHBondContact OD1-CB 3.42Å; N878-E880 PolarHBondContact OD1-N 2.02Å; E880-I882 PolarHBondContact O-N 2.81Å; E880-K883 CarbonylContact O-C 3.56Å; E880-K883 PolarHBondContact O-N 2.93Å; E880-K883 VanDerWaalsContact O-N 3.08Å; E880-E884 PolarHBondContact O-N 3.29Å
881Q82.1Confident65Low86 Ų86126.8 Ų126.840%0.40265%0.645SS.*Hα-helixtrans-60.9-32.9172.9-70170.6-27.400112.4L877 N878 L885L877-Q881 HydrophobicContact CB-CB 4.15Å; L877-Q881 HydrophobicContact CD2-CB 4.43Å; N878-Q881 PolarHBondContact O-N 3.25Å; N878-Q881 WeakPolarHBondContact OD1-CG 3.46Å; N878-Q881 PolarHBondContact OD1-N 3.42Å; Q881-L885 VanDerWaalsContact O-CG 3.31Å; Q881-L885 WeakPolarHBondContact O-CG 3.03Å; Q881-L885 PolarHBondContact O-N 2.92Å; Q881-L885 VanDerWaalsContact O-N 3.17Å
882I80.4Confident64.7Low83 Ų83124.2 Ų124.243%0.42664%0.643SS.*Hα-helixtrans-70.1-39.6173.8-67.2167.7000110.9L877 N878 E880 L885 F886L877-I882 HydrophobicContact CB-CD1 4.43Å; L877-I882 HydrophobicContact CB-CG1 4.05Å; N878-I882 WeakPolarHBondContact O-CG1 3.03Å; N878-I882 PolarHBondContact O-N 3.28Å; N878-I882 VanDerWaalsContact O-N 3.14Å; E880-I882 PolarHBondContact O-N 2.81Å; I882-L885 PolarHBondContact O-N 2.84Å; I882-F886 HydrophobicContact CG2-CD2 4.34Å; I882-F886 WeakPolarHBondContact O-CD2 3.44Å; I882-F886 PolarHBondContact O-N 2.86Å
883K75.9Confident63.4Low118 Ų118123.2 Ų123.251%0.51365%0.648SS.*Hα-helixtrans-70-27.8174.1-77.1171.6171.5-77.90113.5S879 E880 F886 E888S879-K883 WeakPolarHBondContact O-CG 3.45Å; S879-K883 PolarHBondContact O-N 3.34Å; E880-K883 CarbonylContact O-C 3.56Å; E880-K883 PolarHBondContact O-N 2.93Å; E880-K883 VanDerWaalsContact O-N 3.08Å; K883-F886 CarbonylContact O-C 3.16Å; K883-F886 VanDerWaalsContact O-O 3.12Å; K883-E888 IonicContact NZ-OE2 3.54Å; K883-E888 PolarHBondContact NZ-OE2 3.35Å
884E72.4Confident62.7Low161 Ų161120.4 Ų120.475%0.75264%0.642SS**Hα-helixtrans-71.6-34.6172.6-170.1176.6-166.300111.9E880E880-E884 PolarHBondContact O-N 3.29Å
885L75.1Confident61.6Low114 Ų114121 Ų12160%0.59764%0.638SS**Hα-helixtrans-78.5-25.5174.5-69.6170.8000113.6L877 Q881 I882L877-L885 HydrophobicContact CD1-CD1 3.63Å; Q881-L885 VanDerWaalsContact O-CG 3.31Å; Q881-L885 WeakPolarHBondContact O-CG 3.03Å; Q881-L885 PolarHBondContact O-N 2.92Å; Q881-L885 VanDerWaalsContact O-N 3.17Å; I882-L885 PolarHBondContact O-N 2.84Å
886F72.9Confident59.7Low149 Ų149124.8 Ų124.865%0.65465%0.654SS**SBendtrans-13182175.6-59.6-77.8000110.1I882 K883 E888I882-F886 HydrophobicContact CG2-CD2 4.34Å; I882-F886 WeakPolarHBondContact O-CD2 3.44Å; I882-F886 PolarHBondContact O-N 2.86Å; K883-F886 CarbonylContact O-C 3.16Å; K883-F886 VanDerWaalsContact O-O 3.12Å; F886-E888 PolarHBondContact O-N 3.22Å
887P61.8Low57.6Low96 Ų96122.6 Ų122.662%0.62365%0.651SS**  trans-58125.7172.7-23.334.4000110.4
888E59.1Low55.5Low126 Ų126128.1 Ų128.159%0.58968%0.675SS**  trans-83.9114.2171.3-72.7162.4129.900108K883 F886 D890K883-E888 IonicContact NZ-OE2 3.54Å; K883-E888 PolarHBondContact NZ-OE2 3.35Å; F886-E888 PolarHBondContact O-N 3.22Å; E888-D890 PolarHBondContact O-N 3.17Å
889D49.1Very low53.2Low160 Ų160130.4 Ų130.486%0.85669%0.693SS**  trans-72.759.2-179.1-76.9-40.1000112.2Q891D889-Q891 VanDerWaalsContact C-N 3.28Å; D889-Q891 PolarHBondContact O-N 2.87Å
890D48.6Very low51.1Low151 Ų151133.5 Ų133.581%0.80770%0.698SS**  trans-72.677.5172.1-86.2-25.9000110.5E888 P892E888-D890 PolarHBondContact O-N 3.17Å; D890-P892 VanDerWaalsContact O-CD 3.23Å; D890-P892 WeakPolarHBondContact O-CD 3.38Å
891Q36.2Very low48.7Very low181 Ų181133.9 Ų133.985%0.84670%0.704SS**  trans-92.4106.7170.4-172170.2200111.3D889D889-Q891 VanDerWaalsContact C-N 3.28Å; D889-Q891 PolarHBondContact O-N 2.87Å
892P40.2Very low46.1Very low118 Ų118137.4 Ų137.477%0.76672%0.718SS**  trans-76.5131.9176.231.3-34.6000111D890D890-P892 VanDerWaalsContact O-CD 3.23Å; D890-P892 WeakPolarHBondContact O-CD 3.38Å
893C28Very low43.6Very low137 Ų137141 Ų14193%0.92673%0.733SS**  trans-120.397.6174.4-168.20000109.8
894D31.4Very low41.3Very low114 Ų114143 Ų14361%0.6175%0.748SS**  trans-124.3114.4-170.6-171.928.9000112
895K38Very low39Very low161 Ų161141.2 Ų141.270%0.775%0.748SS**  trans64.8139.6171.3-60.5139.5-171.9141.90116.3
896L29.3Very low36.7Very low171 Ų171139.9 Ų139.990%0.89575%0.753SS**  -165-179.163.9-129.3112.2000113.7
897A25Very low34.4Very low90 Ų90140.4 Ų140.474%0.74476%0.758SS**  trans79.179.8162.800000119.2
898E34.9Very low32.6Very low187 Ų187140.3 Ų140.387%0.87476%0.755SS**  trans-84141.1150.5174.4-174-119.200110.2
899P29.1Very low31Very low115 Ų115143 Ų14375%0.74777%0.765SS**  trans-120.2112.8167.535.1-22.8000114.9
900E25.4Very low29.9Very low152 Ų152140.2 Ų140.271%0.7176%0.758SS**  trans54.299.1149.5-58.2-153.4161.900122.6K902E900-K902 IonicContact OE2-NZ 3.1Å; E900-K902 PolarHBondContact OE2-NZ 2.96Å; E900-K902 VanDerWaalsContact OE2-NZ 3.1Å
901N27.9Very low29.4Very low141 Ų141138.8 Ų138.875%0.75476%0.757SS**  16122.3113.9-67.7-57.8000119.9
902K27.6Very low29Very low161 Ų161135.6 Ų135.670%0.775%0.754SS**  -163.9113115.2-87.7127.7-156.7132.40108.3E900E900-K902 IonicContact OE2-NZ 3.1Å; E900-K902 PolarHBondContact OE2-NZ 2.96Å; E900-K902 VanDerWaalsContact OE2-NZ 3.1Å
903E28.5Very low28.3Very low158 Ų158136.8 Ų136.874%0.73875%0.754SS**  84.9114.870.5-169.9-172.7-176.500113
904I26.8Very low28.4Very low161 Ų161135.2 Ų135.283%0.82674%0.744SS**  179.498.9127.1-85.1155000110.4
905V24.9Very low28.2Very low122 Ų122137.8 Ų137.874%0.73975%0.752SS**  trans-9.5145.1145.2179.10000120.3
906A25.2Very low27.9Very low86 Ų86137.2 Ų137.271%0.71176%0.755SS**  trans74152.7153.500000120.3
907E25.3Very low28Very low161 Ų161134.7 Ų134.775%0.75275%0.749SS**  cis-153.2134.1-5.9-128-159102.700113.6
908V23.7Very low27.9Very low94 Ų94139.5 Ų139.557%0.5775%0.748SS**  63.9136.9126.3156.80000124.4
909K26.5Very low28.2Very low181 Ų181140.1 Ų140.179%0.78775%0.751SS**  trans70.8112.2165.3-74.7150.8-157.5145.50117.5
910S26.2Very low28.1Very low103 Ų103140 Ų14072%0.7274%0.74SS**  cis96.7152.649.969.80000113.3
911P36.3Very low28.7Very low120 Ų120137.4 Ų137.478%0.77974%0.739SS**  cis-131.1-159.2-0.442.3-23.6000114.2
912C28.7Very low28.7Very low115 Ų115140 Ų14078%0.77775%0.747SS**  trans-65.2178.4175.3-43.40000113.6
913D25.4Very low28.7Very low143 Ų143138.9 Ų138.977%0.76575%0.748SS**  cis-164-17720.7-156.6-11.7000111.6
914S29.3Very low29.1Very low103 Ų103138.1 Ų138.172%0.7275%0.748SS**  trans106.783.1159.2-460000119.2
915Q27.2Very low29.2Very low168 Ų168133.6 Ų133.679%0.78574%0.741SS**  trans29.3121.6131-57.8-178.722.200121.6
916I31.7Very low29.9Very low150 Ų150135.4 Ų135.477%0.76974%0.744SS**  65.7137.2127.9-61.5170.5000117.8
917P31.7Very low30.9Very low118 Ų118138 Ų13877%0.76675%0.745SS**  cis-121.5158.715.338.9-26.4000115.3
918R24Very low31.5Very low191 Ų191133.6 Ų133.672%0.72173%0.726SS**  trans-145.5117.7151.5-141.4166.4-179.1-137.9-4.4113E920R918-E920 WeakPolarHBondContact CD-OE2 3.31Å; R918-E920 HydrophobicContact CG-CB 4.4Å; R918-E920 IonicContact CZ-OE1 2.74Å; R918-E920 VanDerWaalsContact CZ-OE1 3.29Å; R918-E920 IonicContact CZ-OE2 2.63Å; R918-E920 IonicContact NE-OE2 3.29Å; R918-E920 IonicContact NH1-OE1 2.62Å; R918-E920 PolarHBondContact NH1-OE1 2.99Å; R918-E920 IonicContact NH1-OE2 2.57Å; R918-E920 PolarHBondContact NH1-OE2 3.33Å; R918-E920 IonicContact NH2-OE1 3.79Å; R918-E920 PolarHBondContact O-N 3.08Å
919E41.4Very low32.8Very low199 Ų199133 Ų13393%0.9373%0.725SS**  trans-61.2105.5152.7171.6-179.2-15100107.4
920E25.6Very low34Very low112 Ų112131 Ų13152%0.52372%0.718SS.*  trans-143.9106.8-178.9-166.2137.5-130.100112.4R918 H922R918-E920 WeakPolarHBondContact CD-OE2 3.31Å; R918-E920 HydrophobicContact CG-CB 4.4Å; R918-E920 IonicContact CZ-OE1 2.74Å; R918-E920 VanDerWaalsContact CZ-OE1 3.29Å; R918-E920 IonicContact CZ-OE2 2.63Å; R918-E920 IonicContact NE-OE2 3.29Å; R918-E920 IonicContact NH1-OE1 2.62Å; R918-E920 PolarHBondContact NH1-OE1 2.99Å; R918-E920 IonicContact NH1-OE2 2.57Å; R918-E920 PolarHBondContact NH1-OE2 3.33Å; R918-E920 IonicContact NH2-OE1 3.79Å; R918-E920 PolarHBondContact O-N 3.08Å; E920-H922 PolarHBondContact O-N 3.4Å
921S39.4Very low35.3Very low99 Ų99131.8 Ų131.869%0.69271%0.709SS**  trans14.8104.5136178.30000117.5
922H27.1Very low36Very low196 Ų196131.2 Ų131.291%0.90770%0.699SS**  trans-99.6102.8150.1-77.6-58000109.5E920E920-H922 PolarHBondContact O-N 3.4Å
923D27.6Very low37.3Very low137 Ų137132 Ų13273%0.73369%0.689SS**  trans-79.1163173.7-162.610.7000111.2G925D923-G925 PolarHBondContact O-N 3.28Å
924L36.4Very low38.9Very low141 Ų141130.8 Ų130.874%0.73868%0.682SS**  trans-44.9118.3-162.7-67.3157.4000116.7
925G28.9Very low40.1Very low66 Ų66131.9 Ų131.968%0.6868%0.675SS**  trans-71.8120.4140.400000108.9D923 L927D923-G925 PolarHBondContact O-N 3.28Å; G925-L927 PolarHBondContact O-N 3.39Å
926M40.4Very low41.9Very low160 Ų160125.1 Ų125.179%0.78865%0.646SS**  trans-56.8104.6-171.8-84.5-62-50.500113.7
927L45.4Very low43.8Very low142 Ų142122 Ų12274%0.74364%0.637SS**  trans-109.6146.6162.9-78.9172.1000110.4G925 P929G925-L927 PolarHBondContact O-N 3.39Å; L927-P929 VanDerWaalsContact O-CD 3.28Å; L927-P929 WeakPolarHBondContact O-CD 3.27Å
928D39.3Very low45.7Very low67 Ų67118.8 Ų118.836%0.35862%0.62SS.*  trans-72.5108.6-172.1173.57.4000112.1E930 K931D928-E930 PolarHBondContact O-N 3.37Å; D928-E930 WeakPolarHBondContact OD1-CB 3.47Å; D928-E930 PolarHBondContact OD1-N 2.57Å; D928-E930 VanDerWaalsContact OD1-N 3.13Å; D928-K931 HydrophobicContact CB-CG 4.49Å; D928-K931 PolarHBondContact O-N 3.39Å; D928-K931 IonicContact OD2-NZ 3.73Å; D928-K931 PolarHBondContact OD2-NZ 3.23Å
929P50.1Low47.9Very low83 Ų83114 Ų11454%0.53961%0.608SS.*THydrogen-bonded Turntrans-77.18.9-171.935.2-37.8000113.7L927 K933L927-P929 VanDerWaalsContact O-CD 3.28Å; L927-P929 WeakPolarHBondContact O-CD 3.27Å; P929-K933 WeakPolarHBondContact O-CD 3.21Å; P929-K933 WeakPolarHBondContact O-CE 3.49Å; P929-K933 PolarHBondContact O-NZ 3.43Å
930E51.6Low49.6Very low138 Ų138105.1 Ų105.165%0.64557%0.57SS**THydrogen-bonded Turntrans-83.7-31.5167.7-169.1145.8-123.600112D928D928-E930 PolarHBondContact O-N 3.37Å; D928-E930 WeakPolarHBondContact OD1-CB 3.47Å; D928-E930 PolarHBondContact OD1-N 2.57Å; D928-E930 VanDerWaalsContact OD1-N 3.13Å
931K53.2Low52Low120 Ų120108 Ų10852%0.52258%0.576SS.*Hα-helixtrans-71.9-45.8-174.7-64.7-173.8172.980.40113.3D928 K933 I934 H935D928-K931 HydrophobicContact CB-CG 4.49Å; D928-K931 PolarHBondContact O-N 3.39Å; D928-K931 IonicContact OD2-NZ 3.73Å; D928-K931 PolarHBondContact OD2-NZ 3.23Å; K931-K933 VanDerWaalsContact C-N 3.26Å; K931-K933 PolarHBondContact O-N 3.1Å; K931-I934 WeakPolarHBondContact O-CB 3.36Å; K931-I934 PolarHBondContact O-N 3.19Å; K931-I934 VanDerWaalsContact O-N 3.1Å; K931-H935 PolarHBondContact O-CD2 2.9Å
932D52.7Low53.7Low108 Ų108106.3 Ų106.358%0.57856%0.559SS**Hα-helixtrans-66.3-25.2-175.7-69.4-27.8000114.1I934 H935 C936D932-I934 VanDerWaalsContact C-N 3.27Å; D932-I934 PolarHBondContact O-N 2.9Å; D932-H935 PolarHBondContact O-N 2.88Å; D932-C936 PolarHBondContact O-N 2.98Å
933K55.4Low56.2Low130 Ų13098.2 Ų98.257%0.56552%0.524SS*.Hα-helixtrans-61.7-37.3174.2-68.5169.5-175.3139.40111.7P929 K931 C937P929-K933 WeakPolarHBondContact O-CD 3.21Å; P929-K933 WeakPolarHBondContact O-CE 3.49Å; P929-K933 PolarHBondContact O-NZ 3.43Å; K931-K933 VanDerWaalsContact C-N 3.26Å; K931-K933 PolarHBondContact O-N 3.1Å; K933-C937 WeakPolarHBondContact O-CB 3.41Å; K933-C937 PolarHBondContact O-N 3.49Å; K933-C937 VanDerWaalsContact O-N 3.12Å; K933-C937 PolarHBondContact O-SG 2.74Å
934I59.2Low58.4Low119 Ų11999.4 Ų99.461%0.6153%0.528SS*.Hα-helixtrans-67.8-45.7178.9-55.1175.5000109.7K931 D932 C937 A938K931-I934 WeakPolarHBondContact O-CB 3.36Å; K931-I934 PolarHBondContact O-N 3.19Å; K931-I934 VanDerWaalsContact O-N 3.1Å; D932-I934 VanDerWaalsContact C-N 3.27Å; D932-I934 PolarHBondContact O-N 2.9Å; I934-C937 PolarHBondContact O-N 3.05Å; I934-A938 PolarHBondContact O-N 3.41Å; I934-A938 VanDerWaalsContact O-N 3.11Å
935H53.3Low60.3Low125 Ų12596.2 Ų96.258%0.57951%0.513SS*.Hα-helixtrans-65-39.1178.5-64.4-61.5000112.7K931 D932 A938 L939K931-H935 PolarHBondContact O-CD2 2.9Å; D932-H935 PolarHBondContact O-N 2.88Å; H935-A938 PolarHBondContact O-N 2.92Å; H935-L939 PolarHBondContact O-N 3.44Å
936C66.3Low62.4Low27 Ų27100 Ų10018%0.18251%0.508CS..Hα-helixtrans-64.8-45.7175.9-159.70000112.4D932 A938 L939 G940 C954D932-C936 PolarHBondContact O-N 2.98Å; C936-A938 VanDerWaalsContact C-N 3.28Å; C936-A938 PolarHBondContact O-N 3.11Å; C936-L939 PolarHBondContact O-N 2.86Å; C936-G940 PolarHBondContact O-N 3.38Å; C936-C954 HydrophobicContact CB-CB 4.15Å; C936-C954 WeakPolarHBondContact CB-SG 3.44Å; C936-C954 WeakPolarHBondContact SG-CB 3.3Å; C936-C954 CovalentContact SG-SG 2.02Å; C936-C954 PolarHBondContact SG-SG 3.43Å
937C70.1Confident63.3Low85 Ų85102.4 Ų102.457%0.57452%0.518SS*.Hα-helixtrans-62.7-32.8178.1-72.70000112.9K933 I934 G940 W941K933-C937 WeakPolarHBondContact O-CB 3.41Å; K933-C937 PolarHBondContact O-N 3.49Å; K933-C937 VanDerWaalsContact O-N 3.12Å; K933-C937 PolarHBondContact O-SG 2.74Å; I934-C937 PolarHBondContact O-N 3.05Å; C937-G940 PolarHBondContact O-N 2.65Å; C937-W941 WeakPolarHBondContact O-CB 3.43Å; C937-W941 PolarHBondContact O-N 3.4Å
938A71.9Confident64.5Low49 Ų4999.4 Ų99.441%0.40552%0.521SS..Hα-helixtrans-63.1-44.9174.100000112.1I934 H935 C936 W941 L942I934-A938 PolarHBondContact O-N 3.41Å; I934-A938 VanDerWaalsContact O-N 3.11Å; H935-A938 PolarHBondContact O-N 2.92Å; C936-A938 VanDerWaalsContact C-N 3.28Å; C936-A938 PolarHBondContact O-N 3.11Å; A938-W941 PolarHBondContact O-N 2.91Å; A938-L942 WeakPolarHBondContact O-CB 3.32Å; A938-L942 VanDerWaalsContact O-CG 3.25Å; A938-L942 WeakPolarHBondContact O-CG 3.3Å; A938-L942 PolarHBondContact O-N 3.47Å
939L71.2Confident66.4Low91 Ų9198.4 Ų98.448%0.47652%0.517SS..Hα-helixtrans-66.1-39.3175.4-69.9173.1000112.1H935 C936 L942 S943H935-L939 PolarHBondContact O-N 3.44Å; C936-L939 PolarHBondContact O-N 2.86Å; L939-L942 PolarHBondContact O-N 3Å; L939-S943 PolarHBondContact O-N 2.73Å
940G76.6Confident67.4Low12 Ų1299.3 Ų99.312%0.12452%0.523CS..Hα-helixtrans-57.1-50.1172.200000112.5C936 C937 S943 M944 C952C936-G940 PolarHBondContact O-N 3.38Å; C937-G940 PolarHBondContact O-N 2.65Å; G940-S943 PolarHBondContact O-N 3.02Å; G940-S943 PolarHBondContact O-OG 3.37Å; G940-M944 PolarHBondContact O-N 3.44Å; G940-C952 WeakPolarHBondContact CA-SG 3.23Å
941W76.6Confident68.1Low174 Ų174100.1 Ų100.166%0.65953%0.527SS*.Hα-helixtrans-63.3-42.6177.4-168.681.6000112.2C937 A938 S943 M944 V945C937-W941 WeakPolarHBondContact O-CB 3.43Å; C937-W941 PolarHBondContact O-N 3.4Å; A938-W941 PolarHBondContact O-N 2.91Å; W941-S943 VanDerWaalsContact C-N 3.29Å; W941-S943 PolarHBondContact O-N 3.2Å; W941-M944 WeakPolarHBondContact O-CB 3.43Å; W941-M944 PolarHBondContact O-N 3.32Å; W941-V945 HydrophobicContact CD2-CG2 4.2Å; W941-V945 HydrophobicContact CE3-CG2 4.19Å; W941-V945 HydrophobicContact CH2-CG2 4.13Å; W941-V945 HydrophobicContact CZ2-CG2 4.12Å; W941-V945 HydrophobicContact CZ3-CG2 4.16Å; W941-V945 WeakPolarHBondContact O-CG2 3.28Å; W941-V945 PolarHBondContact O-N 2.68Å
942L75.4Confident69.4Low62 Ų6296 Ų9633%0.32551%0.513SS..Hα-helixtrans-61.1-35.9174.8-72.6167.9000112.4A938 L939 M944 V945 Y946 V949A938-L942 WeakPolarHBondContact O-CB 3.32Å; A938-L942 VanDerWaalsContact O-CG 3.25Å; A938-L942 WeakPolarHBondContact O-CG 3.3Å; A938-L942 PolarHBondContact O-N 3.47Å; L939-L942 PolarHBondContact O-N 3Å; L942-M944 VanDerWaalsContact C-N 3.27Å; L942-M944 PolarHBondContact O-N 2.83Å; L942-V945 PolarHBondContact O-N 2.88Å; L942-V945 VanDerWaalsContact O-N 3.13Å; L942-Y946 HydrophobicContact CD2-CD2 3.98Å; L942-Y946 HydrophobicContact CD2-CE2 3.94Å; L942-Y946 PolarHBondContact O-N 3.26Å; L942-V949 HydrophobicContact CB-CG1 4.11Å
943S79.3Confident69.4Low27 Ų2799.8 Ų99.819%0.18953%0.527CS..Hα-helixtrans-68.7-19.417476.70000114.5L939 G940 W941L939-S943 PolarHBondContact O-N 2.73Å; G940-S943 PolarHBondContact O-N 3.02Å; G940-S943 PolarHBondContact O-OG 3.37Å; W941-S943 VanDerWaalsContact C-N 3.29Å; W941-S943 PolarHBondContact O-N 3.2Å
944M72.7Confident70.4Confident162 Ų16296.9 Ų96.980%0.79852%0.522SS*.Hα-helixtrans-83.1-21.4170.1-65.318064.500113.1G940 W941 L942G940-M944 PolarHBondContact O-N 3.44Å; W941-M944 WeakPolarHBondContact O-CB 3.43Å; W941-M944 PolarHBondContact O-N 3.32Å; L942-M944 VanDerWaalsContact C-N 3.27Å; L942-M944 PolarHBondContact O-N 2.83Å
945V77.4Confident69.5Low73 Ų7396.2 Ų96.244%0.44253%0.528SS..Hα-helixtrans-100.3-31.5-175.5179.70000112.3W941 L942W941-V945 HydrophobicContact CD2-CG2 4.2Å; W941-V945 HydrophobicContact CE3-CG2 4.19Å; W941-V945 HydrophobicContact CH2-CG2 4.13Å; W941-V945 HydrophobicContact CZ2-CG2 4.12Å; W941-V945 HydrophobicContact CZ3-CG2 4.16Å; W941-V945 WeakPolarHBondContact O-CG2 3.28Å; W941-V945 PolarHBondContact O-N 2.68Å; L942-V945 PolarHBondContact O-N 2.88Å; L942-V945 VanDerWaalsContact O-N 3.13Å
946Y72.8Confident69Low146 Ų14695.3 Ų95.357%0.57354%0.536SS*.SBendtrans-128.1119-174.2-62.7-76.4000112.8L942 G948 V949L942-Y946 HydrophobicContact CD2-CD2 3.98Å; L942-Y946 HydrophobicContact CD2-CE2 3.94Å; L942-Y946 PolarHBondContact O-N 3.26Å; Y946-G948 PolarHBondContact O-N 3.38Å; Y946-V949 PolarHBondContact O-N 3.14Å
947E59.3Low67.6Low210 Ų210100 Ų10098%0.98156%0.564SS**THydrogen-bonded Turntrans-65.4117173.4-171170.3-155.700110.1
948G69.3Low66.1Low80 Ų80104 Ų10483%0.82557%0.574SS**THydrogen-bonded Turntrans113.8-7.8-178.600000115.8Y946Y946-G948 PolarHBondContact O-N 3.38Å
949V79.2Confident64.3Low45 Ų45110.7 Ų110.727%0.27359%0.594SS.*SBendtrans-77.7131.3169.5176.20000109.3L942 Y946 Q951L942-V949 HydrophobicContact CB-CG1 4.11Å; Y946-V949 PolarHBondContact O-N 3.14Å; V949-Q951 PolarHBondContact O-N 3.43Å
950P72.7Confident62.8Low103 Ų103115.4 Ų115.467%0.66961%0.611SS**PPolyproline II helixtrans-63.1127.2178.625.6-34.1000111C952P950-C952 PolarHBondContact O-N 3.36Å
951Q65.6Low60.7Low154 Ų154122.3 Ų122.372%0.7264%0.64SS**PPolyproline II helixtrans-67.1127-179.7-170.417422.300110.2V949 H953V949-Q951 PolarHBondContact O-N 3.43Å; Q951-H953 PolarHBondContact O-N 2.82Å
952C81.4Confident58.7Low34 Ų34123 Ų12323%0.2365%0.647CS.*PPolyproline II helixtrans-69.2132.7179.670.10000111.2G940 P950 C954G940-C952 WeakPolarHBondContact CA-SG 3.23Å; P950-C952 PolarHBondContact O-N 3.36Å; C952-C954 PolarHBondContact O-N 3.37Å
953H52.7Low56.5Low188 Ų188126.8 Ų126.887%0.8767%0.668SS**  trans-80.118.5172.9-79.1-62.8000113.8Q951 S955Q951-H953 PolarHBondContact O-N 2.82Å; H953-S955 VanDerWaalsContact C-N 3.33Å; H953-S955 PolarHBondContact O-N 2.62Å
954C76.3Confident54Low68 Ų68132.9 Ų132.946%0.45969%0.694SS.*  trans-66.594.9169.8-790000110C936 C952 S956C936-C954 HydrophobicContact CB-CB 4.15Å; C936-C954 WeakPolarHBondContact CB-SG 3.44Å; C936-C954 WeakPolarHBondContact SG-CB 3.3Å; C936-C954 CovalentContact SG-SG 2.02Å; C936-C954 PolarHBondContact SG-SG 3.43Å; C952-C954 PolarHBondContact O-N 3.37Å; C954-S956 PolarHBondContact O-N 2.91Å
955S40.2Very low51.8Low105 Ų105130.9 Ų130.973%0.73469%0.694SS**  trans-64.183165.845.30000109.3H953 T957H953-S955 VanDerWaalsContact C-N 3.33Å; H953-S955 PolarHBondContact O-N 2.62Å; S955-T957 VanDerWaalsContact C-N 3.34Å; S955-T957 PolarHBondContact O-N 2.72Å
956S42.1Very low49.5Very low107 Ų107133.2 Ų133.275%0.74870%0.703SS**  trans-50.6107.5154.4-177.80000106.5C954 E958C954-S956 PolarHBondContact O-N 2.91Å; S956-E958 VanDerWaalsContact C-N 3.26Å; S956-E958 PolarHBondContact O-N 3.13Å
957T37.5Very low47.4Very low124 Ų124134.3 Ų134.376%0.76172%0.719SS**  trans-69.695.6173.135.70000106.4S955 K959S955-T957 VanDerWaalsContact C-N 3.34Å; S955-T957 PolarHBondContact O-N 2.72Å; T957-K959 VanDerWaalsContact C-N 3.31Å; T957-K959 PolarHBondContact O-N 3.02Å
958E37.7Very low45.9Very low170 Ų170130.6 Ų130.679%0.79471%0.705SS**  trans-47.3101.7164.5-70.8-176.5165.900107.5S956 K960S956-E958 VanDerWaalsContact C-N 3.26Å; S956-E958 PolarHBondContact O-N 3.13Å; E958-K960 PolarHBondContact O-N 2.77Å
959K35.1Very low43.8Very low190 Ų190134.3 Ų134.383%0.82671%0.705SS**  trans-56.2117.1161.5-73.1-178.6179.5176.30104.2T957 E961T957-K959 VanDerWaalsContact C-N 3.31Å; T957-K959 PolarHBondContact O-N 3.02Å; K959-E961 PolarHBondContact O-N 3.28Å
960K38.9Very low41.4Very low189 Ų189137.9 Ų137.982%0.82273%0.732SS**  trans-71.370.4172.5-72.6-173.3175.4-179.90108.8E958 K962E958-K960 PolarHBondContact O-N 2.77Å; K960-K962 PolarHBondContact O-N 3.41Å
961E32.2Very low39.3Very low157 Ų157137.9 Ų137.973%0.73474%0.735SS**  trans-58.6104166.8-167.1126.5-113.800106.3K959 D963K959-E961 PolarHBondContact O-N 3.28Å; E961-D963 PolarHBondContact O-N 2.92Å
962K34.6Very low37.8Very low189 Ų189140 Ų14082%0.82274%0.742SS**  trans-76.973.9175.3-78.3-174.9172.3-177.30108.1K960 Q964K960-K962 PolarHBondContact O-N 3.41Å; K962-Q964 PolarHBondContact O-N 2.99Å
963D29.5Very low35.2Very low142 Ų142147.8 Ų147.876%0.75978%0.775SS**  trans-7266.5162.9-91.72.3000109.7E961 C965E961-D963 PolarHBondContact O-N 2.92Å; D963-C965 PolarHBondContact O-N 3.01Å
964Q26.6Very low34Very low155 Ų155142.2 Ų142.272%0.72477%0.769SS**  trans-7464.4160.1-171.5169.427.900107.7K962 L966K962-Q964 PolarHBondContact O-N 2.99Å; Q964-L966 PolarHBondContact O-N 2.76Å
965C26.8Very low31.7Very low120 Ų120148.6 Ų148.681%0.81179%0.792SS**  trans-63.8106.3170.2-164.40000107.4D963 D967D963-C965 PolarHBondContact O-N 3.01Å; C965-D967 PolarHBondContact O-N 2.93Å
966L28.5Very low31Very low122 Ų122151.7 Ų151.764%0.63980%0.795SS**  trans-76.2117.6-177.2-84167.1000110.3Q964 I968Q964-L966 PolarHBondContact O-N 2.76Å; L966-I968 HydrophobicContact CB-CG1 4.23Å; L966-I968 PolarHBondContact O-N 3.02Å
967D28.9Very low30.7Very low168 Ų168152 Ų15290%0.89879%0.794SS**  trans-54.5105.1159.3-89.6-51000109.8C965C965-D967 PolarHBondContact O-N 2.93Å
968I28.1Very low30.1Very low133 Ų133150.3 Ų150.368%0.68279%0.786SS**  trans-118.188.1168.2-56.6-178.5000108.4L966L966-I968 HydrophobicContact CB-CG1 4.23Å; L966-I968 PolarHBondContact O-N 3.02Å
969N26.1Very low29.6Very low157 Ų157149.7 Ų149.784%0.8479%0.789SS**  trans-167.666.1136.6-96.6-41.9000112.1
970S28.1Very low29.3Very low120 Ų120146.3 Ų146.384%0.83979%0.789SS**  trans-125117.515175.60000109.5
971S28.8Very low28.8Very low104 Ų104141.1 Ų141.173%0.72779%0.788SS**  trans-127.4101.7-177.5-80.50000110.1
972K33.5Very low28.7Very low199 Ų199141.4 Ų141.487%0.86579%0.794SS**  trans178.690.4136.3-95.7154.7-173.1-179.50112.4
973Q26.9Very low28.4Very low196 Ų196139.2 Ų139.292%0.91680%0.796SS**  40.2116118.8-168.717412.400118.1
974G26.9Very low28.4Very low72 Ų72138.6 Ų138.674%0.74279%0.791SS**  trans-169.358.217800000115.3
975E28Very low28.5Very low201 Ų201139.8 Ų139.894%0.93980%0.795SS**  trans53136.3154.6-60.3-179.6173.200121.6
976Q26.6Very low28.5Very low171 Ų171141.4 Ų141.480%0.79979%0.79SS**  trans-127.5150.1171-160.7-162.3-14.800108
977P35.1Very low28.8Very low114 Ų114141.6 Ų141.674%0.7479%0.79SS**  -146.9140.1110.233.8-16.9000116.4
978C25.2Very low28.7Very low88 Ų88140.9 Ų140.960%0.59579%0.787SS**  trans43.1129.5136.2-51.60000122.1
979N27.9Very low29.1Very low157 Ų157139.4 Ų139.484%0.8479%0.786SS**  -171.4160.895.1-95.7-39.1000116.1
980S29.3Very low29.2Very low119 Ų119138.4 Ų138.483%0.83279%0.785SS**  trans-33.5157.4177.7-470000121.3
981G27.3Very low29.1Very low79 Ų79137.8 Ų137.881%0.81478%0.781SS**  trans161.6106.2152.500000115.9
982I30.7Very low29.1Very low164 Ų164139.7 Ų139.784%0.84178%0.783SS**  trans-111132.6168.8-60.2167.2000108.7
983T28.3Very low29Very low143 Ų143137.6 Ų137.688%0.87778%0.781SS**  trans-178.3168.8138.618.40000112.6
984I28.4Very low29.1Very low128 Ų128133.7 Ų133.766%0.65678%0.775SS**  trans-119.6161.2-175.9-69173.1000109.4I228I228-I984 HydrophobicContact CD1-CD1 3.66Å
985F29.3Very low29.1Very low181 Ų181139.5 Ų139.579%0.79478%0.78SS**  trans-31.1154.1160-65-102.4000114.4
986E27.8Very low29.1Very low153 Ų153135.8 Ų135.872%0.71577%0.772SS**  cis-161.1153.918.3-145.1166.3150.700114
987I33.1Very low29.5Very low126 Ų126133.4 Ų133.465%0.64677%0.771SS**  trans24.6135.3149.1-66.1168.4000120.9
988N27.9Very low28.9Very low154 Ų154135 Ų13582%0.82477%0.772SS**  -174.1163.2120.9-96.9-67.2000111.9
989P36.5Very low29Very low102 Ų102135.4 Ų135.466%0.66277%0.772SS**  trans-123.5157.4-149.725.3-3.3000118.4
990V26.8Very low28.9Very low135 Ų135136.8 Ų136.882%0.81877%0.773SS**  trans54.8112149.2179.60000119.6
991S26.8Very low28.8Very low108 Ų108135.1 Ų135.176%0.75577%0.767SS**  179.4134.4115.441.10000116.2
992N27.8Very low28.8Very low143 Ų143136.6 Ų136.677%0.76576%0.76SS**  trans41.698143.8-57.1-16.8000123
993N32.1Very low28.6Very low155 Ų155137.5 Ų137.583%0.82976%0.761SS**  33.4116.8124.5-50.4-13.6000118.5
994S28.3Very low28.9Very low114 Ų114140.1 Ų140.180%0.79776%0.763SS**  179.6-169.273.251.30000109.8
995K27.2Very low28.7Very low195 Ų195137.3 Ų137.385%0.84877%0.766SS**  cis-160.417217.8-157172.3178.1-179.90111.7
996T28.6Very low28.5Very low123 Ų123136.4 Ų136.476%0.75576%0.764SS**  trans-90.7167.8-172.7-3.20000115.3
997P35.8Very low28.4Very low120 Ų120138 Ų13878%0.77977%0.769SS**  -128.1145.594.36.714.7000116
998L22.7Very low28.2Very low148 Ų148136.9 Ų136.978%0.77577%0.772SS**  41.3138.8130-115.665.6000120.7
999T26.3Very low28Very low96 Ų96134.2 Ų134.259%0.58977%0.772SS**  cis-16314827.2-35.50000111.6
1000Q26.8Very low27.6Very low186 Ų186135.1 Ų135.187%0.86978%0.775SS**  trans62.8162.8159.6-75.31605.900116.9
1001A26Very low27.7Very low84 Ų84136.8 Ų136.869%0.69477%0.774SS**  cis-170.8167.1-22.400000109.1
1002T27.2Very low27.8Very low111 Ų111134.4 Ų134.468%0.68177%0.766SS**  cis-172152.8-29.1-81.50000108.5
1003E27.9Very low28.1Very low183 Ų183134.1 Ų134.186%0.85576%0.76SS**  trans72.9137.6159.7-87.1150.6-144.100124
1004E32.7Very low28.2Very low197 Ų197133.7 Ų133.792%0.92175%0.75SS**  trans-79.7143.7149.1-54.5172.6114.100108.9
1005G26.1Very low28.5Very low69 Ų69133.7 Ų133.771%0.71175%0.746SS**  trans-176.587.5179.100000117.9
1006H24.9Very low28.9Very low163 Ų163133.2 Ų133.276%0.75574%0.744SS**  trans27.2150.3144.4-76.2-93.6000124.1
1007F25Very low28.9Very low186 Ų186131.6 Ų131.682%0.81674%0.743SS**  trans71.1149164.6-51.8-61.4000115.8
1008S28.9Very low28.7Very low102 Ų102130.5 Ų130.571%0.71374%0.738SS**  cis159.7149.6-22.1-91.60000105.1
1009A23Very low29.1Very low99 Ų99132.7 Ų132.782%0.81874%0.741SS**  trans71156.4165.500000115.7
1010V28.9Very low29.2Very low120 Ų120133.4 Ų133.473%0.72775%0.745SS**  cis-157.9153.1-12.9111.90000111
1011H28.7Very low29.3Very low171 Ų171133.1 Ų133.179%0.79274%0.741SS**  trans59.3161.5167.4-79.8-19.3000118.8
1012G29.9Very low29.4Very low57 Ų57134.2 Ų134.259%0.58874%0.735SS**  cis-153.3139.7-4.400000110.3
1013E33.9Very low29.6Very low137 Ų137135.7 Ų135.764%0.6474%0.739SS**  77.8143.7104.8-72.6-151.8121.200114.5
1014K34.6Very low29.7Very low146 Ų146136.8 Ų136.864%0.63574%0.736SS**  cis-159.415915.2-134.3161.5-179.3129.70111.7
1015T33.3Very low29.5Very low114 Ų114135 Ų13570%0.69973%0.727SS**  trans65.8148.215959.40000118.8
1016K35.3Very low29.6Very low186 Ų186135.4 Ų135.481%0.80973%0.731SS**  cis-155.9148.7-2.8-120.9160.3-170.6173.70111
1017A29.2Very low29.7Very low89 Ų89135.8 Ų135.874%0.73673%0.733SS**  trans30.2145.2134.200000121.9
1018S31.8Very low29.8Very low96 Ų96134 Ų13467%0.67173%0.727SS**  cis177.8152.4-4.1510000112.6
1019K30.3Very low29.7Very low195 Ų195135.3 Ų135.385%0.84873%0.726SS**  trans58.8164.1142.1-71.7-179.9177.9-178.60119.6
1020T28.8Very low29.8Very low110 Ų110132.4 Ų132.468%0.67570%0.702SS**  cis178.4144.2-31.3-83.40000106.8
1021K29.8Very low29.5Very low181 Ų181130.2 Ų130.279%0.78769%0.691SS**  trans70.2159.9162.5-89.1-171.7174.4-167.70118
1022D27.5Very low29.3Very low106 Ų106127.8 Ų127.857%0.56768%0.68SS**  cis-166.7152.3-22.1-139.6-18.4000110.4
1023N30.9Very low29.1Very low143 Ų143135 Ų13577%0.76570%0.695SS**  trans59.9162168.3-51.9-68.8000116.3
1024R30.9Very low28.8Very low206 Ų206133.9 Ų133.978%0.77770%0.703SS**  cis-160.114918.8-165.3170.9171.7165.72.3112.3
1025E28.5Very low28.4Very low159 Ų159130.9 Ų130.974%0.74371%0.705SS**  trans13.8127.9157.7-58165.714300121.1
1026G28Very low28Very low77 Ų77134.5 Ų134.579%0.79471%0.711SS**  trans173.262.8169.900000120.4
1027Q27.7Very low27.7Very low171 Ų171130.9 Ų130.980%0.79971%0.708SS**  trans46.7135146.9-160.815513.800123.8
1028E25.6Very low27.7Very low148 Ų148137.4 Ų137.469%0.69272%0.715SS**  trans8.7143.9150.8-61.4176108.900121
1029L27.9Very low27.7Very low130 Ų130141.6 Ų141.668%0.68172%0.721SS**  cis-172.2169.36.7-109.6172.2000107.4
1030A24.1Very low27.8Very low38 Ų38141 Ų14131%0.31472%0.719SS.*  cis-154.71735.600000112.3S22S22-A1030 PolarHBondContact O-N 3.38Å
1031C22.5Very low27.9Very low74 Ų74140.3 Ų140.350%0.571%0.711SS.*  trans61.9147.3158.9-75.10000119.4
1032H24.3Very low28.1Very low121 Ų121140.3 Ų140.356%0.5671%0.711SS**  cis-148.7139.2-0.2-115.2-55.6000109
1033F26.2Very low28.2Very low208 Ų208144.7 Ų144.791%0.91273%0.725SS**  -179.5167.7126-107-73.9000111.4
1034S27.8Very low28.1Very low114 Ų114141.2 Ų141.280%0.79772%0.723SS**  trans-96.5137-165.6178.40000114.2
1035A25.9Very low28.1Very low83 Ų83138 Ų13869%0.68672%0.721SS**  trans-167133.3137.600000114.6
1036K26.2Very low28.3Very low190 Ų190137.8 Ų137.883%0.82672%0.718SS**  trans52.6113.4141.6-63.9171.7-178.9171.10120.6
1037C27.3Very low28.3Very low109 Ų109142.9 Ų142.974%0.73672%0.719SS**  42.6128.7125.1-54.10000120.7
1038Y29.5Very low28.5Very low226 Ų226142.7 Ų142.789%0.88672%0.721SS**  -159.9171.597.2-110.3-73.7000112.8
1039K32.7Very low28.6Very low185 Ų185145 Ų14580%0.80472%0.724SS**  trans-91.9144.2-175.7-50.1167.1-176.2173.50110.4
1040K31Very low28.8Very low181 Ų181148 Ų14879%0.78773%0.734SS**  -178134.4113.1-105.2-173.6168.91750116.3
1041D31.9Very low28.9Very low97 Ų97152 Ų15252%0.51975%0.75SS.*  trans57.4128.8131.9-67.412.3000124.1
1042K33.4Very low29.4Very low181 Ų181155 Ų15579%0.78777%0.766SS**  trans79.7144.7139-69.5161.8-171.5132.90118.2
1043K30.5Very low29.5Very low197 Ų197154.3 Ų154.386%0.85778%0.775SS**  cis-167.6121.2-10.5167.4-175.2175.3-170.90112.3
1044G29.2Very low29.7Very low71 Ų71151.3 Ų151.373%0.73277%0.768SS**  trans78.5169156.200000117.8
1045N30Very low29.6Very low138 Ų138153.7 Ų153.774%0.73876%0.764SS**  cis-162161.7-12.1-148.14.4000113.9
1046F31.8Very low29.7Very low154 Ų154156.9 Ų156.968%0.67577%0.766SS**  trans90.5117.8163.6-61.9-67000122.4
1047K29.8Very low29.7Very low184 Ų184154.9 Ų154.980%0.876%0.76SS**  trans51.9146.1132.3-62.2173.3179.1176.70119.1
1048I31.4Very low29.6Very low168 Ų168155.6 Ų155.686%0.86275%0.752SS**  cis-127.9170.426.1-69.9173.2000111.3
1049R26.4Very low29.5Very low195 Ų195152.7 Ų152.774%0.73674%0.744SS**  trans-73.4150.1-172.5-49.7-177.3-173.5-152.75.7115D1051R1049-D1051 IonicContact NH1-OD2 3.64Å
1050H32Very low29.2Very low193 Ų193150.1 Ų150.189%0.89474%0.739SS**  -140.5139.9122.2-107.7-87.7000107.8
1051D27.5Very low29.1Very low123 Ų123149.4 Ų149.466%0.65874%0.736SS**  trans-93.7128.9-165.8-73.6-65.6000113.4R1049R1049-D1051 IonicContact NH1-OD2 3.64Å
1052T32.3Very low28.8Very low136 Ų136151.1 Ų151.183%0.83475%0.745SS**  trans-144.9106163-28.90000110.1
1053S27.2Very low28.5Very low107 Ų107149.8 Ų149.875%0.74875%0.745SS**  trans-62.8129.6176.5-167.30000109.9
1054L28.9Very low28.4Very low145 Ų145145.7 Ų145.776%0.75974%0.741SS**  55.7140.363.3-61.9173.1000113.5
1055K26.9Very low28.4Very low164 Ų164146.9 Ų146.971%0.71374%0.738SS**  cis-174.2161.7-22.7-157.9-175174.6-178.10107.9
1056M27.7Very low28.3Very low150 Ų150149 Ų14974%0.73974%0.741SS**  trans73.3142.6146.6-158.1168.3-7200120.3
1057E26.5Very low28.2Very low148 Ų148146.1 Ų146.169%0.69274%0.739SS**  trans-64.4155.6171.5-63.2173.778.100116.2
1058Q25.9Very low28.2Very low124 Ų124144.5 Ų144.558%0.57974%0.739SS**  trans60138.5131.6-77.6-173.54900123.1
1059K26.6Very low28.4Very low166 Ų166144 Ų14472%0.72274%0.736SS**  trans74.7150.5144.1-72.7171.5174.1149.40116
1060L26.1Very low29.1Very low131 Ų131140.2 Ų140.269%0.68674%0.737SS**  cis-160.6178.45.4-130.1172.4000110.6
1061K28.2Very low28.8Very low165 Ų165138.4 Ų138.472%0.71773%0.734SS**  trans74.1140.3158.6-72.7169.8-176.6-1780116.5
1062N26.9Very low29.4Very low133 Ų133137.7 Ų137.771%0.71174%0.736SS**  cis-129.6153.1-5.7-67.7-57.3000107.7
1063I27.5Very low29.3Very low153 Ų153136.2 Ų136.279%0.78573%0.731SS**  cis61.98450-50.4179.8000113.9
1064S28.2Very low29.4Very low112 Ų112141.1 Ų141.178%0.78374%0.739SS**  trans-175.5142.2145.4-173.50000109.5
1065S28.6Very low29.3Very low96 Ų96140.3 Ų140.367%0.67174%0.744SS**  cis-167.3167.5-3252.30000109.3
1066K28.2Very low29.5Very low181 Ų181139.7 Ų139.779%0.78775%0.749SS**  trans75.8118.7142.3-165.1170.1-176.1-178.80120.3
1067C30.3Very low29.6Very low94 Ų94141.4 Ų141.464%0.63575%0.752SS**  trans67.7154.3153-63.10000118.6
1068D29.9Very low29.7Very low150 Ų150141.6 Ų141.680%0.80276%0.756SS**  cis-156.2167.7-21.5-105.2-24.2000111.9
1069I34.4Very low29.8Very low157 Ų157140.2 Ų140.281%0.80577%0.766SS**  trans-88.1135.2171.4-71.9171.5000107.3
1070P40.7Very low30.2Very low117 Ų117136.7 Ų136.776%0.7677%0.768SS**  -153.2160.67442.1-22000120.3
1071N26.1Very low30.9Very low155 Ų155135.8 Ų135.883%0.82977%0.77SS**  trans-69.4159.9156.7-113-20.6000110.6
1072P40.3Very low31Very low108 Ų108136.3 Ų136.370%0.70178%0.775SS**  -157179.695.840.8-21.9000117.5
1073S29.3Very low31.3Very low104 Ų104136.3 Ų136.373%0.72777%0.774SS**  trans63.2122.4165.638.50000117.5
1074K30.5Very low31.4Very low210 Ų210135.7 Ų135.791%0.91377%0.771SS**  cis65.8105.245.5-63.7-171.9174.4-176.70114.9
1075C27.1Very low31.4Very low129 Ų129137.5 Ų137.587%0.87277%0.767SS**  -160.4170.9120.8-1370000111.7
1076N29.7Very low31.2Very low151 Ų151138.3 Ų138.381%0.80777%0.768SS**  trans-115.3168.8177.3-71.9-35.1000110.8
1077K30.8Very low31.2Very low185 Ų185135.2 Ų135.280%0.80476%0.764SS**  trans84.5123.1159.9-63.9-175.7171.7-172.40119.6
1078I28.1Very low31.1Very low153 Ų153136.1 Ų136.179%0.78577%0.766SS**  53.3111.7124.7-52.3163.8000118.2
1079A29.2Very low30.9Very low95 Ų95134 Ų13479%0.78576%0.764SS**  177.9140.6118.800000112.9
1080A34.5Very low30.8Very low92 Ų92134.2 Ų134.276%0.7677%0.766SS**  trans-105.9155142.900000106.3
1081P41.6Very low30.4Very low112 Ų112133.3 Ų133.373%0.72776%0.763SS**  -118.6169.162.50.624.6000113
1082E30.1Very low30.7Very low176 Ų176129.8 Ų129.882%0.82276%0.755SS**  cis85.3156.948.3-148-169.9-150.400114.4
1083I32Very low30.4Very low133 Ų133133.2 Ų133.268%0.68276%0.759SS**  trans8585.1165-56.9-176.3000118.9
1084L29.3Very low30.6Very low139 Ų139135.7 Ų135.773%0.72876%0.764SS**  73.7149.9118-73.9172.6000126
1085H28.2Very low30.7Very low150 Ų150134 Ų13469%0.69476%0.761SS**  trans89.297.1142.9-75.4-40.9000124.1
1086V25Very low31.7Very low114 Ų114132 Ų13269%0.69175%0.747SS**  88.6150.5108.3158.20000122.1
1087T28.4Very low31.7Very low115 Ų115133.6 Ų133.671%0.70675%0.747SS**  trans85.9115.1163.219.90000122.1
1088T28Very low31.7Very low113 Ų113128.8 Ų128.869%0.69374%0.737SS**  trans54.8121.4140.248.30000120.5
1089S25.8Very low31.7Very low106 Ų106130.1 Ų130.174%0.74174%0.737SS**  75.8140.460.4-56.50000114.8
1090N32.2Very low31.8Very low161 Ų161132.8 Ų132.886%0.86173%0.733SS**  trans121.6141.4172.1-74.1-48.2000113.4
1091S32.4Very low31.5Very low99 Ų99132 Ų13269%0.69273%0.727SS**  cis-166.2164.8-15.8-162.20000111.8
1092A32.5Very low30.9Very low81 Ų81131.6 Ų131.667%0.66973%0.726SS**  trans75.6146.2148.200000120.4
1093K34.5Very low30.8Very low179 Ų179130.2 Ų130.278%0.77872%0.72SS**  cis-169.2137-14.7-115172.8-173175.40110.7
1094N32Very low30.6Very low156 Ų156131.2 Ų131.283%0.83472%0.722SS**  156.9152.5120.8-80.5-32.7000114.3
1095M32.8Very low30.5Very low174 Ų174128.3 Ų128.386%0.85771%0.713SS**  trans-129.4-160.5-177.9-111.7-80.9-13200106
1096P49.6Very low30.8Very low87 Ų87128.1 Ų128.157%0.56572%0.716SS**  cis-142.6-175.414.123.85.7000117.8
1097F28.5Very low31Very low185 Ų185129.6 Ų129.681%0.81172%0.716SS**  trans80145.7158.7-54.8-57000119.2
1098S30.1Very low31.1Very low85 Ų85132 Ų13259%0.59472%0.716SS**  cis-172.7155.2-21.361.40000112.8
1099K29.2Very low31.2Very low181 Ų181135 Ų13579%0.78772%0.72SS**  trans68.8159.6150.6-76.4-177.7172.1-172.60117.9
1100Q30.6Very low31.4Very low151 Ų151138.2 Ų138.271%0.70672%0.723SS**  cis-175.5145.3-19.5163.9171.5-9.700110.7
1101A27.7Very low31.2Very low75 Ų75136.2 Ų136.262%0.6272%0.717SS**  trans66.4127.9159.300000117.6
1102S29.7Very low31.1Very low103 Ų103136 Ų13672%0.7272%0.715SS**  91.413494.3-75.60000112.3
1103Q28.6Very low30.9Very low148 Ų148140.1 Ų140.169%0.69272%0.721SS**  cis115.7132.428.1167.3-175.7-13.900107.9
1104E27.2Very low30.7Very low154 Ų154137.7 Ų137.772%0.7272%0.716SS**  trans62.4170.3169-76.5-178.185.600117.6
1105S28.3Very low30.5Very low77 Ų77137.7 Ų137.754%0.53872%0.715SS.*  cis-170.2-169.2-40.264.60000107.6
1106L33.6Very low30.4Very low147 Ų147132.2 Ų132.277%0.7770%0.703SS**  trans60.2105.4166.7-61.7163.2000116.7
1107Q28.6Very low30.2Very low144 Ų144133.9 Ų133.967%0.67371%0.714SS**  73.1110.665.1-68.7-157.946.800117.8
1108K30.6Very low30.3Very low166 Ų166131.3 Ų131.372%0.72271%0.713SS**  79.6150129-74.9-179.4-179.8149.40122.2
1109K30.7Very low30.4Very low176 Ų176137.1 Ų137.177%0.76573%0.728SS**  trans78.5120.9165.4-69.6169-179.2-171.50114.8
1110H29.6Very low30.4Very low173 Ų173132.8 Ų132.880%0.80173%0.726SS**  65.2133.765.5-61.2-72.5000110.4
1111T29.3Very low30.9Very low120 Ų120131 Ų13174%0.73673%0.727SS**  cis-160.5164.932.9-270000113
1112S28.7Very low31.1Very low94 Ų94134.4 Ų134.466%0.65773%0.734SS**  trans73.1152.3138.266.90000124.1
1113Q29.6Very low31Very low168 Ų168136.8 Ų136.879%0.78573%0.733SS**  trans104.9138140.8-92.4169.5-19.100121
1114D28.9Very low31Very low128 Ų128136.6 Ų136.668%0.68474%0.736SS**  trans63.2153.7153.8-72.220.8000121.2
1115L28.9Very low31Very low156 Ų156134.1 Ų134.182%0.81774%0.736SS**  cis-162169.2-37.9-118.5176.3000107.1
1116G31Very low30.9Very low59 Ų59134.7 Ų134.761%0.60874%0.74SS**  trans-69.4176176.500000114.1
1117P45.8Very low30.6Very low121 Ų121134.5 Ų134.579%0.78674%0.74SS**  -150.7141.378.537.6-18.9000118.8
1118V30.5Very low30.6Very low132 Ų132133.7 Ų133.780%0.875%0.745SS**  35.6119.6127-165.50000120.2
1119K30.5Very low30.5Very low207 Ų207131.4 Ų131.490%0.974%0.741SS**  -177.6152.5120.8-101.2168.7-168.9179.70114.4
1120A31.1Very low30.8Very low90 Ų90128.6 Ų128.674%0.74474%0.74SS**  trans-128.4153.5161.300000108.6
1121P40.3Very low30.7Very low113 Ų113125.1 Ų125.173%0.73473%0.734SS**  -133.5167.5103.522.5-0.5000111.5
1122I32Very low30.5Very low147 Ų147130.5 Ų130.575%0.75474%0.741SS**  62.6124.254.9-73.1170.1000110.1
1123E26.5Very low30.4Very low152 Ų152129.9 Ų129.971%0.7174%0.737SS**  cis-161.6172.611.6-131.4179.9153.800112.5
1124L29.2Very low30.1Very low144 Ų144128.6 Ų128.675%0.75474%0.735SS**  trans50.7141.2149.5-71.7161.5000120.4
1125S26.4Very low30.1Very low103 Ų103128 Ų12872%0.7274%0.736SS**  cis-166.7-170.11.660.70000108.2
1126S28Very low30Very low89 Ų89125.4 Ų125.462%0.62273%0.731SS**  cis-157.9-179.65.363.50000110.2
1127N26.3Very low29.7Very low142 Ų142127.8 Ų127.876%0.75974%0.739SS**  trans36.7136.7141.7-60.6-14.5000121.3
1128T28.6Very low28.9Very low127 Ų127128.3 Ų128.378%0.77974%0.739SS**  cis-154.9140.614-8.60000111.5
1129D28.6Very low28.9Very low119 Ų119131.5 Ų131.564%0.63675%0.745SS**  trans-78.5150.5150.6-16310.7000107.6C1131D1129-C1131 PolarHBondContact OD1-N 3.17Å; D1129-C1131 PolarHBondContact OD2-SG 3.1Å
1130P38.2Very low28.7Very low117 Ų117126.2 Ų126.276%0.7674%0.735SS**  -146.712192.334.6-16000115.2
1131C26Very low28.5Very low99 Ų99129.3 Ų129.367%0.66974%0.744SS**  43.4138.5108.4-84.20000120.3D1129D1129-C1131 PolarHBondContact OD1-N 3.17Å; D1129-C1131 PolarHBondContact OD2-SG 3.1Å
1132R25.3Very low27.8Very low233 Ų233128.8 Ų128.888%0.87974%0.743SS**  trans89.1101.9151.8-112-171.9173.8177.1-2.7119.5
1133S26.2Very low28.5Very low82 Ų82126.7 Ų126.757%0.57374%0.739SS**  49.7122.1127.863.80000120.6
1134N24.7Very low28.5Very low141 Ų141128.6 Ų128.675%0.75475%0.748SS**  -178170.5104.9-91.1-23.8000112.6
1135T28.8Very low28.6Very low115 Ų115131 Ų13171%0.70675%0.752SS**  trans36.1120.8150.953.30000119.3
1136S25.5Very low29Very low102 Ų102135.9 Ų135.971%0.71376%0.761SS**  64.814959.486.40000115.1
1137S26.1Very low29.3Very low109 Ų109141.5 Ų141.576%0.76277%0.774SS**  trans66.3118.2-169.7-68.30000114.5
1138V28.4Very low29.5Very low131 Ų131142 Ų14279%0.79478%0.775SS**  69.4108.166.8175.50000112.2
1139Q29.7Very low29.6Very low199 Ų199142.2 Ų142.293%0.9377%0.765SS**  trans-142.5122133.3-142.2170.518.900110.6
1140S26.8Very low29.8Very low96 Ų96145.6 Ų145.667%0.67178%0.775SS**  trans-94.7146.1179.147.30000110.9
1141V26.2Very low29.4Very low156 Ų156149.7 Ų149.795%0.94578%0.781SS**  trans-132.2135.4154.2-176.60000108.2
1142S27.1Very low29.8Very low102 Ų102149.9 Ų149.971%0.71379%0.79SS**  trans-169.7158.6-168.3178.30000107.9
1143P45.3Very low29.9Very low102 Ų102143 Ų14366%0.66279%0.79SS**  cis-126.4175.7-35.635.6-22.3000111.4
1144E27.6Very low30Very low192 Ų192142.9 Ų142.990%0.89780%0.803SS**  trans-122.1144.2155.9-95.2-148.913200112.7
1145K31.5Very low30.2Very low194 Ų194142 Ų14284%0.84381%0.807SS**  trans-97.6124.7-166.8-59.8167.9-176.1170.90110.5
1146K33.9Very low30.4Very low207 Ų207147.9 Ų147.990%0.982%0.817SS**  trans-121.7115.3164.5-78.3179.2178.1168.20110.7
1147K33.6Very low30.7Very low207 Ų207151.2 Ų151.290%0.983%0.826SS**  trans-76140.8179.2-68.5-176.6175.5-176.80110.8
1148L30.7Very low31.1Very low152 Ų152155.2 Ų155.280%0.79683%0.829SS**  trans-69.2145.7162.7-77.8159.9000110.7
1149K32.3Very low31.4Very low131 Ų131159.4 Ų159.457%0.5783%0.832SS**  trans-145.3134.9156-81.6-159.4173.8-167.30110.1E766 Y767E766-K1149 VanDerWaalsContact CD-NZ 3.32Å; E766-K1149 WeakPolarHBondContact OE1-CE 3.41Å; E766-K1149 IonicContact OE1-NZ 3.53Å; E766-K1149 PolarHBondContact OE1-NZ 2.91Å; Y767-K1149 PolarHBondContact O-NZ 3.28Å
1150F31.8Very low31.5Very low190 Ų190159.2 Ų159.283%0.83383%0.829SS**  trans-107.3134.5169-80.7-97.5000109.5
1151K30.9Very low31.8Very low204 Ų204160.8 Ų160.889%0.88783%0.826SS**  -172.7147.1109.7-112.8-180177.1176.90114.3
1152A32.7Very low32.3Very low103 Ų103161.1 Ų161.185%0.85181%0.814SS**  trans44.3105.6145.800000120.1
1153G27.8Very low32.6Very low87 Ų87167.4 Ų167.490%0.89782%0.822SS**  trans-154.7110.2152.700000109.1
1154G28.6Very low32.1Very low81 Ų81171.7 Ų171.784%0.83583%0.83SS**  trans-114.5143.9-173.800000112.9
1155S28.8Very low32.4Very low121 Ų121167.2 Ų167.285%0.84682%0.817SS**  trans-153.5145.3163.969.10000114.7
1156R32.9Very low32.1Very low240 Ų240165.6 Ų165.691%0.90682%0.817SS**  trans-27.5150.3166.5-60.1163.5166.4-170.9-5.7117.1
1157L32.6Very low32.1Very low172 Ų172164 Ų16490%0.90181%0.812SS**  trans-139151.4153.2-109153.7000111.5
1158K32.9Very low31.8Very low192 Ų192160.2 Ų160.284%0.83581%0.806SS**  trans-133.6148.9175.8-81.3-171.7173.5-173.20109.6
1159Y34.8Very low31.7Very low220 Ų220159.7 Ų159.786%0.86380%0.803SS**  trans0125.6155.1-76.7-96.3000119.6
1160F33.4Very low31.9Very low195 Ų195160.6 Ų160.686%0.85581%0.813SS**  trans171.5156.4144-85.4-41.5000109.5
1161E32.2Very low32.6Very low129 Ų129156.6 Ų156.660%0.60381%0.805SS**  cis-171.3170.7-30.2-147.5-157.6123.400110
1162K37.4Very low32.7Very low163 Ų163153.9 Ų153.971%0.70980%0.801SS**  trans74.4161.2160.5-60.1168.2-159.8-179.70116
1163R33.7Very low32.7Very low234 Ų234159.4 Ų159.488%0.88382%0.823SS**  cis-147.816333.3-79.7176.6-83.3-178.3-5.2116
1164K34.5Very low33Very low191 Ų191163 Ų16383%0.8382%0.82SS**  trans-119.8175.1145.6-64-169.4175.6-173.20107.2
1165T32.4Very low33.2Very low99 Ų99167.3 Ų167.361%0.60782%0.819SS**  cis-150.3-179.110.9-29.40000108.3
1166D26.6Very low33.5Very low159 Ų159169.9 Ų169.985%0.8582%0.817SS**  -170173.6116.3-90.2-20.3000111.5
1167H33.6Very low33.5Very low173 Ų173165.8 Ų165.880%0.80181%0.812SS**  trans-110.9162.4-170.5-69.6-80.2000113.2
1168V26.2Very low33.6Very low128 Ų128165.4 Ų165.478%0.77681%0.806SS**  -177.9117.9126.21450000113.4
1169I29Very low33.6Very low141 Ų141163.6 Ų163.672%0.72381%0.805SS**  trans40.6107.7137-40.9177.7000121.3
1170I37.4Very low33.5Very low151 Ų151159.6 Ų159.677%0.77480%0.8SS**  38.5142.3106.2-76.2167.5000118.5
1171P45.3Very low33.5Very low105 Ų105156.8 Ų156.868%0.68280%0.796SS**  cis-140.517236.931.1-7.3000119.6
1172D33.9Very low33.6Very low148 Ų148159.2 Ų159.279%0.79181%0.812SS**  trans28.5121.9144.9-48.3-10.5000121.4
1173V33.6Very low33.3Very low218 Ų218158.8 Ų158.8100%1.32182%0.822SS**  -145.8085.8157.20000109.1

Retrieved 1,173 of 1,173 residues in 513.2 ms (Link to these results)