A0A3Q0KHN2_SCHMA Loading...

Retinoid-x-receptor (RXR)

AlphaFold DB , UniProt , Accession A0A3Q0KHN2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,501 aa.

>A0A3Q0KHN2_SCHMA|A0A3Q0KHN2
MIPVSIVTPQSVSSAEQIGEHSSSLSLQNVPVQQDSVSYLNSHTTVHMNDGQNEPSSIYLTDQELRLDSSFPNSPLGITRDPHCDDNGEEQNRISSFELISRLIDAEGLIELGYIPSSCNSAPAIDVASLSDLEEVTSKTLLWSSNCDDVDSFNFDDLSNKINESNTNNADTKLRSDNKTLEHRSALTTEYISVDFNPLNSTNALVPIISLPSDTNLQTIPSLESNEYENFQAHYKTNTVLENVQSLPSNTVPDDLGPLNITSYPMGLVEADIPSITRPSIHQSPVDHHALHPTIKPNHIPYSYSPLTPLSSVQIRSSIHESSFVIDNQVCPIDNICNQQLQTGSFVKNKYSSDYQEYSGAPECFPTVHTLELFTSHSSDLPHSSSHPSKNVGESPKHLSNDTKPIKYPELLQKIGENCNSNISGPNLPFISHSTYCSRTQSSSSCSIRQQLATAPSHPQLHVSIPQSPQSIYSVFSCSPNQKVAVSSTVNLPSSDSTSATLIFNGDFPSRPIISSTDNSFWSHPSIPSGSAVNTQMITNWEHSVPYPAYVPNSQITGFLPENISVTDKAAIYVKDGNSTAIQPVLGSGLVGSFQYLTPTTVLSKPNYTILNDQLTFNHPQETLIQPFLPQMSDPIKTTQNLRIPFCQGTQYTLTPGISIPINPEHSFGRLEMNTHRYSSESSKTNPALTSRSSSSRPFNSPVRRNSAPFQSTYQNCMNFSETAAHQSECSIVVSQLSTKKLTTPVLCCISSNSNNIPIISQQSPNNNNNNNNNNNVVFKTDNTKQHIIDQNILTKTATTTSIVQPSELCHIQPILISSPVKNNNNNTHNLGTGSYIDSNCLSNQSNNDKSHSITPSSPLLTNCNSPSTTLQSSTVCCLLRPSGRSTSTSSGSSCGSSCSGTGGGVSVSSGQYICSICSDRASGKHYGVFSCEGCKGFFKRTVRKELTYICRDSQECQIDKRLRNRCQYCRYQKCLRAGMRREAVQEERQQQQLQSEVQRSPTPPEQNCDLSVNSMIMSDTKITNAMNHSCLAEKQEIMLKTTNCTSSSSPHLLSNCSDSSINYFYSASNEKSQQPSINDNFNLTVNDAATYPPQELSLIGNKDSNNVTLPLADIHALKLPTTTSAAIPPPPDALEFIRTAESTISSRRKQWLSAFNKQQCHAEIAKCFQDSMENLKWLENNFEKCTTNHLPLFDLVIWSSKLPYICQLSCGVHLDLLKSACMQLIIVNLVYWLANDHKPRSLSTSNSTSKLPDTTPTINSTDISNITDDPPENSISDISKDCTIQMKKINKSVPLDEKMDYYYSNFPEFHLLNNLTKPMDNNNNDSISSKPTNINDNSVDDDMIRKRNTNVYKLIYNLAIKLRMLNLDPVELGCLKLILLLNPDSMTCLNNIRSLIELLRDQVYAGLEYYCNQVWPNAPHGRMGRLLLKLSNFQSVAARIEKLICSNELNNLLNNLESIFSYLSKKKVDHSNYISTTTTTTTTMSSTTTSTSNSIHLEFS
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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
1M28.9Very low31.4Very low212 Ų212132.6 Ų132.6100%1.04477%0.765SS**  01290-59.3176.487.800108.8F97M1-F97 HydrophobicContact CE-CE1 4.35Å
2I27.5Very low31.4Very low151 Ų151133.4 Ų133.477%0.77477%0.773SS**  trans-103.1132.3162.1-63.3173.7000105.8V4I2-V4 PolarHBondContact O-N 2.9Å; I2-V4 VanDerWaalsContact O-N 3.16Å
3P32.4Very low31.4Very low113 Ų113131.8 Ų131.873%0.73477%0.774SS**  trans-76.5101.7178.130.2-32.5000110.2S5P3-S5 PolarHBondContact O-N 2.76Å; P3-S5 VanDerWaalsContact O-N 3.08Å
4V31.7Very low31.2Very low121 Ų121130.7 Ų130.773%0.73378%0.777SS**  trans-7791.4169.2-176.40000108.4I2 I6I2-V4 PolarHBondContact O-N 2.9Å; I2-V4 VanDerWaalsContact O-N 3.16Å; V4-I6 HydrophobicContact CG1-CG1 4.03Å; V4-I6 PolarHBondContact O-N 2.9Å
5S30.4Very low31.2Very low103 Ų103128.7 Ų128.772%0.7278%0.781SS**  trans-72.887.2173.4-64.20000110.4P3 V7P3-S5 PolarHBondContact O-N 2.76Å; P3-S5 VanDerWaalsContact O-N 3.08Å; S5-V7 PolarHBondContact O-N 2.94Å
6I32.1Very low31Very low112 Ų112126.1 Ų126.157%0.57476%0.757SS**  trans-68.6102.4170.4-55.6-179.7000108.2V4 T8V4-I6 HydrophobicContact CG1-CG1 4.03Å; V4-I6 PolarHBondContact O-N 2.9Å; I6-T8 HydrophobicContact CG2-CG2 4.1Å
7V31Very low31.1Very low129 Ų129123.8 Ų123.878%0.78274%0.736SS**  trans-90.9104.5170.3177.90000107.6S5 P9S5-V7 PolarHBondContact O-N 2.94Å; V7-P9 WeakPolarHBondContact O-CD 3.41Å
8T32.5Very low31.1Very low94 Ų94123.3 Ų123.358%0.57773%0.728SS**  trans-80123176.944.70000111.1I6 Q10I6-T8 HydrophobicContact CG2-CG2 4.1Å; T8-Q10 PolarHBondContact O-N 2.85Å
9P32.4Very low31.1Very low122 Ų122120.3 Ų120.379%0.79273%0.726SS**  trans-78.1113.9165.630.8-30000108.8V7 S11V7-P9 WeakPolarHBondContact O-CD 3.41Å; P9-S11 PolarHBondContact O-N 2.88Å
10Q33.8Very low31.1Very low186 Ų186122.8 Ų122.887%0.86973%0.73SS**  trans-69123.2173.6-76.6-174.8-32.100110.5T8T8-Q10 PolarHBondContact O-N 2.85Å
11S32.4Very low31.2Very low116 Ų116124.5 Ų124.581%0.81173%0.73SS**  trans-78.1133.6167.743.30000110.4P9P9-S11 PolarHBondContact O-N 2.88Å
12V31.9Very low31.2Very low142 Ų142119.8 Ų119.886%0.86172%0.718SS**  trans-113.1109.8165179.80000106.8
13S31.2Very low31.3Very low113 Ų113117.5 Ų117.579%0.7972%0.715SS**  trans-82.6157.1177.443.40000111.9
14S28.1Very low31.2Very low116 Ų116116.6 Ų116.681%0.81171%0.712SS**  trans-68.1132.4-169-49.50000114.1
15A31Very low31Very low101 Ų101118.4 Ų118.484%0.83572%0.716SS**  trans-111.8104149.700000107.6
16E29.2Very low30.9Very low87 Ų87118.1 Ų118.141%0.40771%0.714SS.*  trans-71.3157.1173.6-51.4-175.690.200110.3N1070 K1072E16-N1070 PolarHBondContact OE2-ND2 3.5Å; E16-K1072 VanDerWaalsContact CD-NZ 3.32Å; E16-K1072 WeakPolarHBondContact OE1-CE 3.33Å; E16-K1072 IonicContact OE1-NZ 3.03Å; E16-K1072 PolarHBondContact OE1-NZ 3.22Å; E16-K1072 WeakPolarHBondContact OE2-CE 3.31Å; E16-K1072 IonicContact OE2-NZ 3.46Å
17Q32.4Very low30.8Very low86 Ų86119.7 Ų119.740%0.40272%0.723SS.*  166.6151.9113.1-91.3-160.1-95.800119.9K1072 S1073Q17-K1072 HydrophobicContact CG-CB 4.03Å; Q17-K1072 HydrophobicContact CG-CD 4.21Å; Q17-K1072 HydrophobicContact CG-CG 3.65Å; Q17-K1072 VanDerWaalsContact NE2-CB 3.28Å; Q17-K1072 PolarHBondContact NE2-O 3.03Å; Q17-K1072 VanDerWaalsContact OE1-CA 3.27Å; Q17-S1073 VanDerWaalsContact CD-CB 3.47Å; Q17-S1073 PolarHBondContact NE2-OG 3.26Å
18I31.6Very low30.8Very low115 Ų115120.9 Ų120.959%0.5972%0.72SS**  trans58.5145158.9-57.2150.8000116.7
19G30.9Very low30.6Very low67 Ų67122.7 Ų122.769%0.69173%0.726SS**  trans141.542.6160.400000118.2
20E30.7Very low30.5Very low170 Ų170122.4 Ų122.479%0.79472%0.722SS**  trans32.7131.1148.3-73.9-174.7-173.700123.4
21H32.4Very low30.4Very low159 Ų159119.4 Ų119.474%0.73672%0.719SS**  trans67.3119.1138.3-71.7-58.9000123
22S30.1Very low30.3Very low113 Ų113120.4 Ų120.479%0.7972%0.719SS**  trans80.1145.7133.776.10000119.9
23S28.9Very low30.1Very low102 Ų102121.1 Ų121.171%0.71371%0.713SS**  cis-167.5160.7-21.652.80000112.7
24S29.6Very low30Very low95 Ų95122.4 Ų122.466%0.66471%0.707SS**  trans84.5140.3142.783.10000121.3
25L29Very low30Very low158 Ų158123 Ų12383%0.82770%0.701SS**  trans69.2134.2152.8-62.4160.1000119.3
26S27.7Very low29.8Very low97 Ų97122.4 Ų122.468%0.67869%0.691SS**  cis154.4165.9-31.1-84.20000109.2
27L31Very low29.7Very low145 Ų145124.3 Ų124.376%0.75971%0.708SS**  trans94.1106.3174-53.5170.1000114.1
28Q29.4Very low29.3Very low155 Ų155124.9 Ų124.972%0.72472%0.721SS**  77.1132.164.9-75.8-174.1-19.200112.1
29N29.2Very low28.9Very low132 Ų132129.9 Ų129.971%0.70674%0.735SS**  cis-177.9166.537.8-121.1-10.3000113.2
30V30.4Very low28.8Very low115 Ų115134.6 Ų134.670%0.69774%0.743SS**  trans73.5117.6154.5175.90000121.3V32V30-V32 HydrophobicContact CG1-CG2 4.23Å
31P30.9Very low28.5Very low124 Ų124133.6 Ų133.681%0.80574%0.743SS**  trans-106.5160.9156.438.9-30.6000113.2
32V31.6Very low28.4Very low136 Ų136131.8 Ų131.882%0.82475%0.748SS**  trans-141.8160.7171.6-176.60000110.3V30V30-V32 HydrophobicContact CG1-CG2 4.23Å
33Q27.6Very low28.2Very low157 Ų157135.2 Ų135.273%0.73475%0.752SS**  trans-106.4174.8-159.7-56.7159.5-103.500115.4
34Q27.3Very low28.3Very low141 Ų141136.7 Ų136.766%0.65976%0.757SS**  101.8144128.9-100.9164.9-6900123.2
35D29.9Very low28.1Very low127 Ų127138.6 Ų138.668%0.67976%0.764SS**  trans67.3133.3151.5-65.2-42.7000122.7
36S25.3Very low28.2Very low90 Ų90137.5 Ų137.563%0.62976%0.764SS**  cis163.7170-26.247.10000107.6
37V26.8Very low28.1Very low126 Ų126140.7 Ų140.776%0.76477%0.768SS**  trans79127.6158.5-134.80000123.7
38S25.5Very low28.1Very low98 Ų98142.1 Ų142.169%0.68577%0.773SS**  trans76.7109.9141.346.40000125.6
39Y23.5Very low28Very low221 Ų221140.4 Ų140.487%0.86777%0.768SS**  30.7131.4117.2-76.5-87.3000122.5
40L28.6Very low28.1Very low166 Ų166141.6 Ų141.687%0.86978%0.775SS**  -173.1154.6107.1-104.2163.4000114.1
41N24.6Very low27.9Very low149 Ų149139.3 Ų139.380%0.79777%0.774SS**  trans-100.2154176.9-78.4-30.1000112.1
42S30Very low27.8Very low121 Ų121141.9 Ų141.985%0.84678%0.775SS**  trans-165.6147.2143.641.20000113.2
43H26.5Very low27.7Very low185 Ų185142.3 Ų142.386%0.85677%0.773SS**  trans-93.2150.3171.5-82.7-109.4000111
44T29.8Very low27.6Very low133 Ų133143.5 Ų143.582%0.81678%0.779SS**  trans-149.3129.6146.8-38.90000110.8
45T25.5Very low27.9Very low134 Ų134141.6 Ų141.682%0.82278%0.779SS**  trans-108145.2168.338.20000109.7
46V30.9Very low27.8Very low136 Ų136141.4 Ų141.482%0.82479%0.787SS**  trans-132.1128.4171-179.70000108.7
47H26.2Very low27.7Very low164 Ų164142.1 Ų142.176%0.75979%0.792SS**  trans-107.6133.5178.8-132.5-85.6000108
48M30.6Very low27.7Very low175 Ų175143.8 Ų143.886%0.86280%0.795SS**  trans-149.3158.3154.5-87.4-49.9152.400111.2
49N26.4Very low27.7Very low119 Ų119149.2 Ų149.264%0.63680%0.802SS**  trans-92.3-174.8-158.5-59.8-24.4000114.7
50D31.6Very low28Very low157 Ų157146.2 Ų146.284%0.8480%0.8SS**  trans78.3113.9147.2-57.7-38.4000119.9
51G27.3Very low27.9Very low66 Ų66143.6 Ų143.668%0.6879%0.791SS**  108.6101.7103.400000119.1
52Q27.5Very low28.3Very low178 Ų178142.1 Ų142.183%0.83278%0.783SS**  trans75.9158.5146.9-51.2-173.2-6.800120.2
53N30.6Very low28.3Very low145 Ų145143.5 Ų143.578%0.77578%0.776SS**  trans78.395.2158.1-55.4-33.1000120.3
54E24.8Very low28.2Very low183 Ų183142.4 Ų142.486%0.85577%0.771SS**  trans-57.2171.3137.4-98.1-162.3-147.200112.5
55P33.1Very low28.2Very low101 Ų101144.5 Ų144.566%0.65678%0.777SS**  cis-139.3-145.1-27.338.8-19.2000111
56S28.2Very low28.1Very low123 Ų123147.7 Ų147.786%0.8677%0.774SS**  trans96.5161.4156.282.40000118.5
57S23.4Very low28Very low105 Ų105148.4 Ų148.473%0.73477%0.772SS**  trans-118.3150.1-160.250.70000112.8
58I27.8Very low28Very low160 Ų160147.3 Ų147.382%0.82177%0.772SS**  trans-125117.7168.1-60.2179.4000108.8
59Y24.3Very low27.9Very low213 Ų213143.6 Ų143.684%0.83576%0.763SS**  trans-94.2150.1158.3-97.3-95.9000108.1
60L30.7Very low28Very low158 Ų158142.7 Ų142.783%0.82777%0.766SS**  trans-132.3139.8159.3-91.8167.5000109.6
61T25.9Very low27.8Very low110 Ų110144 Ų14468%0.67576%0.764SS**  trans-107170.1174.6480000109.3
62D32.1Very low28.1Very low118 Ų118146.5 Ų146.563%0.63177%0.769SS**  177.1140.8112.9-88.3-14000114.8
63Q30.7Very low28.2Very low151 Ų151144.1 Ų144.171%0.70676%0.762SS**  trans54.3108.1130.9-59.6167.740.800118.6
64E25.1Very low28.1Very low161 Ų161142 Ų14275%0.75276%0.759SS**  71.7114.782.9-80.4-151.5123.900114.7
65L29.3Very low28.1Very low177 Ų177139.4 Ų139.493%0.92776%0.757SS**  trans-158.1162135.6-108.9166000110.2
66R24.2Very low27.7Very low201 Ų201143.1 Ų143.176%0.75877%0.771SS**  trans-110-175.9-166.4-77.4173.8142.9104.4-8.4112.6
67L29.2Very low27.6Very low152 Ų152140.2 Ų140.280%0.79676%0.761SS**  trans92.8141161.1-51.2166.5000115.6
68D26Very low27.7Very low140 Ų140143 Ų14375%0.74977%0.766SS**  cis-162.5170.6-36-136.3-43000111.1
69S28Very low27.7Very low98 Ų98141 Ų14169%0.68576%0.761SS**  trans59.3137.4163.569.80000123
70S27.6Very low27.8Very low99 Ų99140.9 Ų140.969%0.69276%0.759SS**  trans7096.8151.440.20000121.3
71F27.3Very low27.5Very low184 Ų184139.8 Ų139.881%0.80775%0.754SS**  16.3150.4124.5-59-74.6000120.7
72P34.4Very low27.9Very low120 Ų120139.6 Ų139.678%0.77976%0.755SS**  cis-129.3-144.115.827.4-2.5000112.5
73N29.5Very low27.6Very low127 Ų127142 Ų14268%0.67976%0.762SS**  -152.3148.9-81.2-83.8-3.5000107.9
74S28Very low27.4Very low101 Ų101138.9 Ų138.971%0.70676%0.756SS**  cis-150.9130.4-11.5-78.70000109
75P26.1Very low27.5Very low128 Ų128137.7 Ų137.783%0.83175%0.754SS**  trans-96.9177.3-175.338.3-37.1000114.6
76L24.5Very low27.5Very low179 Ų179135.5 Ų135.594%0.93774%0.744SS**  trans-33.5143.1161.7-69.2143.9000115.1
77G25.6Very low27.7Very low63 Ų63133 Ų13365%0.64975%0.745SS**  trans-178.7147.8160.100000116
78I25.3Very low27.7Very low163 Ų163129.4 Ų129.484%0.83675%0.745SS**  trans72.4124.8144-59165.4000116.8
79T27.7Very low27.8Very low118 Ų118131.1 Ų131.172%0.72475%0.749SS**  cis-159.8151.9-13.921.40000110.6
80R26.4Very low28Very low211 Ų211134.6 Ų134.680%0.79675%0.754SS**  trans8.4132.3141-78.8-172.7166.3117.9-0.5120.6
81D25.5Very low28.2Very low134 Ų134136.4 Ų136.472%0.71775%0.752SS**  62.3153.2127.7-56.9-38.4000120.9
82P32.8Very low28.4Very low107 Ų107134 Ų13470%0.69575%0.748SS**  cis-139.3-165.6-37.439.4-22000112.5
83H27.4Very low28.3Very low169 Ų169139 Ų13978%0.78275%0.751SS**  trans81.1128.5153.5-108.9-76000120.5
84C25.1Very low28.6Very low85 Ų85137.6 Ų137.657%0.57474%0.742SS**  trans77.1123.3140.5-90.40000122.6
85D28Very low29.1Very low135 Ų135135.8 Ų135.872%0.72273%0.729SS**  trans91.1126.6131.4-51.4-16.2000121.7
86D29.1Very low29.5Very low131 Ų131134.2 Ų134.270%0.70172%0.721SS**  trans73.9116.1141.2-76.424.8000124.1
87N28.4Very low30.1Very low149 Ų149133 Ų13380%0.79771%0.709SS**  trans64.4112.7131.2-52.2-30.9000119.5
88G29.4Very low31Very low77 Ų77133.1 Ų133.179%0.79469%0.693SS**  trans175.8130167.600000112.4
89E28.3Very low31.6Very low175 Ų175129.6 Ų129.682%0.81868%0.675SS**  trans-56.4134.5-175.9-59.2151.5124.600114.5
90E30.8Very low32.3Very low172 Ų172128.3 Ų128.380%0.80466%0.663SS**  trans-139.388.1150.8-163.2169.5-157.200109.6
91Q32.9Very low33Very low137 Ų137120.9 Ų120.964%0.6464%0.643SS**  trans-82.3150.6173.9-66.9179.7-3.600111
92N30.6Very low33.7Very low134 Ų134117.5 Ų117.572%0.71762%0.621SS**  trans54.767156.3-61.1-19000117.5
93R33.7Very low34Very low224 Ų224116.2 Ų116.285%0.84561%0.607SS**  trans-117.388.8146.6-77.1-171.2169.3-170-2.5110.8S95R93-S95 PolarHBondContact O-N 2.91Å
94I35.7Very low34.8Very low97 Ų97113.6 Ų113.650%0.49760%0.598SS.*  trans-57126.5165.9-55.3175.8000107.1E98 L99I94-E98 HydrophobicContact CG2-CB 3.95Å; I94-E98 HydrophobicContact CG2-CG 4.21Å; I94-L99 HydrophobicContact CG2-CB 4.02Å; I94-L99 HydrophobicContact CG2-CD1 4.47Å
95S38Very low35.4Very low63 Ų63115.3 Ų115.344%0.44160%0.601SS.*  trans-64.4148.7176.473.30000110.1R93 F97 E98 L99R93-S95 PolarHBondContact O-N 2.91Å; S95-F97 PolarHBondContact O-N 3.23Å; S95-E98 PolarHBondContact O-N 3.17Å; S95-E98 PolarHBondContact OG-N 3.44Å; S95-E98 VanDerWaalsContact OG-N 3.09Å; S95-L99 PolarHBondContact O-N 3.2Å
96S35Very low36.1Very low95 Ų95111.7 Ų111.766%0.66459%0.59SS**Hα-helixtrans-53.1-31.2175.8-38.90000112I100S96-I100 WeakPolarHBondContact O-CB 3.37Å; S96-I100 WeakPolarHBondContact O-CD1 3.47Å; S96-I100 WeakPolarHBondContact O-CG1 3.43Å; S96-I100 PolarHBondContact O-N 3.12Å
97F37Very low36.5Very low153 Ų153111.7 Ų111.767%0.67159%0.586SS**Hα-helixtrans-69.7-42.5176.9-126.6-85.7000113.4M1 S95 I100 S101M1-F97 HydrophobicContact CE-CE1 4.35Å; S95-F97 PolarHBondContact O-N 3.23Å; F97-I100 PolarHBondContact O-N 2.92Å; F97-S101 PolarHBondContact O-N 3.04Å
98E45Very low36.6Very low67 Ų67107.2 Ų107.231%0.31358%0.575SS.*Hα-helixtrans-75.6-31.4176.7-173.6170.6178.100111.8I94 S95 S101 R102I94-E98 HydrophobicContact CG2-CB 3.95Å; I94-E98 HydrophobicContact CG2-CG 4.21Å; S95-E98 PolarHBondContact O-N 3.17Å; S95-E98 PolarHBondContact OG-N 3.44Å; S95-E98 VanDerWaalsContact OG-N 3.09Å; E98-S101 PolarHBondContact O-N 2.95Å; E98-R102 WeakPolarHBondContact O-CB 3.49Å; E98-R102 WeakPolarHBondContact O-CG 3.25Å; E98-R102 PolarHBondContact O-N 3.1Å; E98-R102 IonicContact OE1-CZ 3.54Å; E98-R102 IonicContact OE1-NE 3.16Å; E98-R102 PolarHBondContact OE1-NE 2.89Å; E98-R102 VanDerWaalsContact OE1-NE 3.16Å; E98-R102 IonicContact OE1-NH2 3.05Å; E98-R102 PolarHBondContact OE1-NH2 3.16Å
99L37.4Very low36.6Very low88 Ų88111 Ų11146%0.46158%0.576SS.*Hα-helixtrans-63.3-45.6169.9-165.5114.3000110.8I94 S95 R102 L103I94-L99 HydrophobicContact CG2-CB 4.02Å; I94-L99 HydrophobicContact CG2-CD1 4.47Å; S95-L99 PolarHBondContact O-N 3.2Å; L99-R102 PolarHBondContact O-N 3.15Å; L99-L103 HydrophobicContact CD2-CD1 3.77Å; L99-L103 HydrophobicContact CG-CD1 4.22Å; L99-L103 WeakPolarHBondContact O-CB 3.15Å; L99-L103 VanDerWaalsContact O-CG 3.25Å; L99-L103 WeakPolarHBondContact O-CG 3.06Å; L99-L103 PolarHBondContact O-N 2.9Å
100I42.9Very low36.7Very low91 Ų91108.3 Ų108.347%0.46757%0.566SS.*Hα-helixtrans-61.6-44.3173.2-74.2164.6000111.2S96 F97 R102 L103 I104S96-I100 WeakPolarHBondContact O-CB 3.37Å; S96-I100 WeakPolarHBondContact O-CD1 3.47Å; S96-I100 WeakPolarHBondContact O-CG1 3.43Å; S96-I100 PolarHBondContact O-N 3.12Å; F97-I100 PolarHBondContact O-N 2.92Å; I100-R102 PolarHBondContact O-N 3.13Å; I100-L103 CarbonylContact O-C 3.57Å; I100-L103 PolarHBondContact O-N 3.11Å; I100-I104 HydrophobicContact CG2-CD1 3.7Å; I100-I104 HydrophobicContact CG2-CG1 4.42Å; I100-I104 VanDerWaalsContact O-CG1 3.3Å; I100-I104 WeakPolarHBondContact O-CG1 3.18Å; I100-I104 PolarHBondContact O-N 3.19Å
101S39.6Very low36.8Very low56 Ų56108.2 Ų108.239%0.39257%0.566SS.*Hα-helixtrans-60.4-45.7178.1-159.70000111.6F97 E98 L103 I104 D105F97-S101 PolarHBondContact O-N 3.04Å; E98-S101 PolarHBondContact O-N 2.95Å; S101-L103 VanDerWaalsContact C-N 3.33Å; S101-L103 PolarHBondContact O-N 3.23Å; S101-I104 PolarHBondContact O-N 3.07Å; S101-I104 VanDerWaalsContact O-N 3.12Å; S101-D105 PolarHBondContact O-N 3.27Å
102R40.5Very low36.6Very low63 Ų63109.7 Ų109.724%0.23858%0.577CS.*Hα-helixtrans-68.2-29.5177.6-70.1175.4-178-97.7-10.4113E98 L99 I100 A106 L816 I817E98-R102 WeakPolarHBondContact O-CB 3.49Å; E98-R102 WeakPolarHBondContact O-CG 3.25Å; E98-R102 PolarHBondContact O-N 3.1Å; E98-R102 IonicContact OE1-CZ 3.54Å; E98-R102 IonicContact OE1-NE 3.16Å; E98-R102 PolarHBondContact OE1-NE 2.89Å; E98-R102 VanDerWaalsContact OE1-NE 3.16Å; E98-R102 IonicContact OE1-NH2 3.05Å; E98-R102 PolarHBondContact OE1-NH2 3.16Å; L99-R102 PolarHBondContact O-N 3.15Å; I100-R102 PolarHBondContact O-N 3.13Å; R102-A106 WeakPolarHBondContact O-CB 3.24Å; R102-A106 PolarHBondContact O-N 3.48Å; R102-L816 PolarHBondContact NH1-O 2.97Å; R102-L816 PolarHBondContact NH2-O 2.79Å; R102-I817 VanDerWaalsContact NH1-CD1 3.3Å
103L39Very low36.4Very low79 Ų79106.6 Ų106.641%0.41458%0.577SS.*Hα-helixtrans-76.9-18.1171.1-71.9169.7000113.6L99 I100 S101 I110L99-L103 HydrophobicContact CD2-CD1 3.77Å; L99-L103 HydrophobicContact CG-CD1 4.22Å; L99-L103 WeakPolarHBondContact O-CB 3.15Å; L99-L103 VanDerWaalsContact O-CG 3.25Å; L99-L103 WeakPolarHBondContact O-CG 3.06Å; L99-L103 PolarHBondContact O-N 2.9Å; I100-L103 CarbonylContact O-C 3.57Å; I100-L103 PolarHBondContact O-N 3.11Å; S101-L103 VanDerWaalsContact C-N 3.33Å; S101-L103 PolarHBondContact O-N 3.23Å; L103-I110 HydrophobicContact CD2-CD1 4.37Å
104I43.7Very low36.1Very low114 Ų114104.2 Ų104.259%0.58557%0.569SS**Hα-helixtrans-82-36.6170.7-71.8165.8000110.3I100 S101 A106I100-I104 HydrophobicContact CG2-CD1 3.7Å; I100-I104 HydrophobicContact CG2-CG1 4.42Å; I100-I104 VanDerWaalsContact O-CG1 3.3Å; I100-I104 WeakPolarHBondContact O-CG1 3.18Å; I100-I104 PolarHBondContact O-N 3.19Å; S101-I104 PolarHBondContact O-N 3.07Å; S101-I104 VanDerWaalsContact O-N 3.12Å; I104-A106 VanDerWaalsContact C-N 3.34Å
105D39.4Very low35.6Very low122 Ų122107.2 Ų107.265%0.65258%0.584SS**Hα-helixtrans-73.3-24.2173.4-67-39000112.9S101S101-D105 PolarHBondContact O-N 3.27Å
106A41.6Very low35Very low58 Ų58109.3 Ų109.348%0.47960%0.597SS.*SBendtrans-113.891.3-18000000113R102 I104R102-A106 WeakPolarHBondContact O-CB 3.24Å; R102-A106 PolarHBondContact O-N 3.48Å; I104-A106 VanDerWaalsContact C-N 3.34Å
107E38.4Very low34.5Very low131 Ų131110.2 Ų110.261%0.61260%0.603SS**  trans69.6120.2168.5-51.8-156136.700118.3L109E107-L109 VanDerWaalsContact C-N 3.29Å; E107-L109 PolarHBondContact O-N 2.69Å
108G30Very low34Very low56 Ų56107.7 Ų107.758%0.57760%0.604SS**SBendtrans-80.352.2-171.300000116.3K1362G108-K1362 PolarHBondContact O-NZ 2.97Å
109L28.8Very low33.2Very low155 Ų155109.1 Ų109.181%0.81262%0.621SS**  trans-123.711-173.6-85.4175.9000116.8E107E107-L109 VanDerWaalsContact C-N 3.29Å; E107-L109 PolarHBondContact O-N 2.69Å
110I31Very low32.6Very low119 Ų119113.1 Ų113.161%0.6164%0.642SS**  trans-122.198.5174.7-52178.3000112.4L103 L112L103-I110 HydrophobicContact CD2-CD1 4.37Å; I110-L112 HydrophobicContact CG2-CG 4.4Å
111E31.7Very low32Very low171 Ų171114 Ų11480%0.79966%0.656SS**  trans-122.590148.2-90.7-174.1169.500108
112L29.6Very low31.5Very low168 Ų168116 Ų11688%0.8868%0.677SS**  trans-74.3121.7162.7-76167.1000107.8I110I110-L112 HydrophobicContact CG2-CG 4.4Å
113G27.2Very low31Very low68 Ų68118.9 Ų118.970%0.70170%0.703SS**  trans178-15.2179.100000120.3
114Y26Very low30.4Very low175 Ų175119.7 Ų119.769%0.68672%0.722SS**  trans-145.6120.6171.1-117.2-88.4000112.5H1421Y114-H1421 AromaticContact CE2-CE1 3.34Å; Y114-H1421 WeakPolarHBondContact CE2-CE1 3.45Å; Y114-H1421 AromaticContact CE2-NE2 3.51Å; Y114-H1421 AromaticContact CZ-CE1 3.67Å; Y114-H1421 AromaticContact CZ-NE2 3.75Å; Y114-H1421 PolarHBondContact OH-CE1 3.16Å
115I24.8Very low29.6Very low160 Ų160121.1 Ų121.182%0.82173%0.729SS**  trans-115.998.8172.4-59.3175000107.8S117I115-S117 PolarHBondContact O-N 2.96Å
116P26.6Very low29.1Very low107 Ų107121.7 Ų121.770%0.69573%0.732SS**  trans-73.7114.7163.5-8.526000108.4S118P116-S118 PolarHBondContact O-N 3.22Å; P116-S118 VanDerWaalsContact O-N 3.07Å
117S23.4Very low28.4Very low114 Ų114125 Ų12580%0.79775%0.746SS**  trans-76.290-175.444.10000113.1I115I115-S117 PolarHBondContact O-N 2.96Å
118S26.5Very low27.8Very low99 Ų99121.8 Ų121.869%0.69274%0.742SS**  trans-174.9164.5156.238.30000113.4P116P116-S118 PolarHBondContact O-N 3.22Å; P116-S118 VanDerWaalsContact O-N 3.07Å
119C28.3Very low27.8Very low98 Ų98124.5 Ų124.566%0.66275%0.752SS**  trans73.268.9170.9-58.60000117.9S121C119-S121 PolarHBondContact O-N 3.39Å
120N25.1Very low27.9Very low172 Ų172123.4 Ų123.492%0.9275%0.746SS**  trans-73.7113.2157-74.6-25.7000110.9
121S30.8Very low27.9Very low108 Ų108122 Ų12276%0.75575%0.747SS**  trans-171.482.915860.10000115.5C119C119-S121 PolarHBondContact O-N 3.39Å
122A30.1Very low27.9Very low100 Ų100120.9 Ų120.983%0.82675%0.746SS**  trans57.2174.7147.400000120.3
123P29.8Very low28Very low122 Ų122117.3 Ų117.379%0.79273%0.728SS**  cis-112.4177.2-19.518.83.9000112.9
124A25.6Very low28.2Very low97 Ų97122 Ų12280%0.80273%0.731SS**  trans-69.3158177.400000113.6
125I27.3Very low28.5Very low143 Ų143122.3 Ų122.373%0.73374%0.739SS**  trans-124.6152.6160.7-68.6180000107.1
126D27.9Very low28.7Very low135 Ų135119.9 Ų119.972%0.72273%0.731SS**  trans-59.8150.9-161.5-152.5-11.1000115.7A128D126-A128 VanDerWaalsContact C-N 3.33Å; D126-A128 HydrophobicContact CB-CB 4.48Å
127V26.8Very low28.8Very low126 Ų126120.3 Ų120.376%0.76473%0.732SS**SBendtrans-102.233.6-179.5-163.60000110.1
128A27.5Very low28.9Very low65 Ų65119.6 Ų119.654%0.53773%0.728SS.*  trans-116.828.8-168.600000113.7D126D126-A128 VanDerWaalsContact C-N 3.33Å; D126-A128 HydrophobicContact CB-CB 4.48Å
129S29.4Very low29Very low113 Ų113122 Ų12279%0.7973%0.725SS**SBendtrans-143.629.5177.9-51.60000113.1
130L31.2Very low28.9Very low132 Ų132122.3 Ų122.369%0.69173%0.725SS**  trans-11410.5176.8-81.7163.3000112.6D132L130-D132 VanDerWaalsContact C-N 3.32Å; L130-D132 PolarHBondContact O-N 3.06Å
131S31.1Very low28.9Very low88 Ų88121.8 Ų121.862%0.61572%0.721SS**THydrogen-bonded Turntrans-72.7-19.2-179.448.90000114.6
132D32.1Very low28.6Very low148 Ų148124 Ų12479%0.79172%0.724SS**THydrogen-bonded Turntrans-101.524.9-168-6110.7000112.2L130L130-D132 VanDerWaalsContact C-N 3.32Å; L130-D132 PolarHBondContact O-N 3.06Å
133L30.8Very low28.3Very low93 Ų93129.4 Ų129.449%0.48772%0.723SS.*  trans-121.910.1-172.2-130.581.9000115.9E135L133-E135 PolarHBondContact O-N 3.4Å; L133-E135 VanDerWaalsContact O-N 3.09Å
134E30.3Very low28.1Very low166 Ų166126.7 Ų126.778%0.77671%0.706SS**THydrogen-bonded Turntrans-64-11.8178-67.7-164.5125.500114.2V136 T137E134-V136 VanDerWaalsContact C-N 3.33Å; E134-V136 PolarHBondContact O-N 3.26Å; E134-T137 PolarHBondContact O-OG1 3.32Å
135E32.5Very low28.1Very low182 Ų182126.2 Ų126.285%0.8570%0.697SS**THydrogen-bonded Turntrans-79.2-7.8-176.2-143.7-174.8168.400114.6L133L133-E135 PolarHBondContact O-N 3.4Å; L133-E135 VanDerWaalsContact O-N 3.09Å
136V30.8Very low28Very low109 Ų109124.6 Ų124.666%0.66169%0.69SS**THydrogen-bonded Turntrans-106.9-22.6-178.3-174.50000113.1E134 S138E134-V136 VanDerWaalsContact C-N 3.33Å; E134-V136 PolarHBondContact O-N 3.26Å; V136-S138 PolarHBondContact O-N 3.09Å
137T28.2Very low27.9Very low116 Ų116123 Ų12371%0.71269%0.689SS**SBendtrans-76.52.8179.938.80000114.8E134E134-T137 PolarHBondContact O-OG1 3.32Å
138S25.9Very low27.7Very low100 Ų100123.7 Ų123.770%0.69969%0.688SS**SBendtrans-104.636.3-176.3-65.80000114.7V136V136-S138 PolarHBondContact O-N 3.09Å
139K27.2Very low27.6Very low148 Ų148127.9 Ų127.964%0.64370%0.701SS**SBendtrans-161.2129.1159.5-106.4149.8-173.4172.60110.8
140T25.8Very low27.4Very low106 Ų106129.4 Ų129.465%0.6571%0.705SS**SBendtrans87.532.5-179.2-27.30000117.1
141L25.2Very low27.1Very low160 Ų160130.4 Ų130.484%0.83871%0.712SS**SBendtrans-133.9151.9140-86.3178.1000108.8
142L25.8Very low26.8Very low156 Ų156130.6 Ų130.682%0.81771%0.713SS**  trans53.987175-70.9148.7000116.7
143W23.8Very low26.5Very low212 Ų212132.5 Ų132.580%0.80372%0.715SS**  -156.177.4116.2-130.8-24.1000111.9N146W143-N146 WeakPolarHBondContact CZ2-OD1 3.19Å; W143-N146 PolarHBondContact NE1-OD1 3.33Å
144S24Very low26.3Very low65 Ų65133.6 Ų133.646%0.45572%0.721SS.*SBendtrans-92.3160.7134.256.50000107.6
145S26.5Very low26.2Very low87 Ų87134.9 Ų134.961%0.60872%0.724SS**  trans47.783.3172.557.50000115.7C147S145-C147 PolarHBondContact O-N 3.37Å
146N25.2Very low25.8Very low110 Ų110132 Ų13259%0.58871%0.714SS**  -63.9102.3113.9-9840.9000105.8W143W143-N146 WeakPolarHBondContact CZ2-OD1 3.19Å; W143-N146 PolarHBondContact NE1-OD1 3.33Å
147C25.2Very low25.6Very low102 Ų102133.3 Ų133.369%0.68972%0.718SS**  trans-80.9123.1143.7-70.80000104.9S145 D149S145-C147 PolarHBondContact O-N 3.37Å; C147-D149 PolarHBondContact O-N 2.87Å
148D24.2Very low25.7Very low139 Ų139136 Ų13674%0.74373%0.727SS**  trans-69.7107.5160.2-55.3-59000106.2
149D25.2Very low25.7Very low154 Ų154136.8 Ų136.882%0.82473%0.732SS**  trans175.781.8161.8-93.5-20.9000109.4C147C147-D149 PolarHBondContact O-N 2.87Å
150V25Very low25.7Very low144 Ų144136.4 Ų136.487%0.87374%0.738SS**  trans-135.364.7163.5-168.40000108.9
151D25Very low26.1Very low154 Ų154140.3 Ų140.382%0.82475%0.746SS**  trans-115.9116.1169.6-122.7-26.6000108.2
152S24.5Very low26.4Very low91 Ų91139.2 Ų139.264%0.63674%0.739SS**  trans62.1142.6-164.376.30000114.2
153F25.9Very low26.5Very low189 Ų189138.5 Ų138.583%0.82974%0.736SS**  cis-125.6141.331.5-93.4-99.5000114.7
154N25.1Very low27Very low116 Ų116136.9 Ų136.962%0.6274%0.738SS**  trans-76.5136159.4-17845000109.9D156N154-D156 PolarHBondContact ND2-OD2 3.09Å
155F28.2Very low27.4Very low192 Ų192138.7 Ų138.784%0.84275%0.75SS**  trans-146114.4154.3-117.4-79.2000108.9
156D25.2Very low27.6Very low121 Ų121141.1 Ų141.165%0.64776%0.756SS**  trans-68.1-174.5176.3-60.2-92.2000112.3N154N154-D156 PolarHBondContact ND2-OD2 3.09Å
157D27.2Very low27.9Very low138 Ų138140.9 Ų140.974%0.73876%0.759SS**  trans69.377.2177.6-71.3-26.4000117.7
158L29.1Very low28.3Very low172 Ų172142.7 Ų142.790%0.90176%0.762SS**  -145.713.1116.8-137.973.2000116.3N160L158-N160 PolarHBondContact O-N 2.86Å
159S26.2Very low28.8Very low116 Ų116142.8 Ų142.881%0.81176%0.762SS**  trans-76.759.3171.5178.70000112.2
160N27Very low29.1Very low141 Ų141139.2 Ų139.275%0.75475%0.754SS**  trans-157.849.9175.8-104.5-36000115L158L158-N160 PolarHBondContact O-N 2.86Å
161K34.6Very low29.6Very low188 Ų188138.7 Ų138.782%0.81775%0.747SS**SBendtrans-131.696.1150.6-72.5-167.4176.3178.10108.9
162I31.8Very low29.9Very low136 Ų136136.7 Ų136.770%0.69774%0.74SS**  65.884.5107.2-62.6158.5000109.5
163N28.3Very low30.2Very low142 Ų142140.6 Ų140.676%0.75975%0.745SS**  58.2117.677.2-60.1-17.7000112.7
164E32.8Very low30.5Very low178 Ų178138.1 Ų138.183%0.83274%0.74SS**  178.2139.9104.2-96.5175.6-169.200112.9
165S32.6Very low30.6Very low103 Ų103143.1 Ų143.172%0.7275%0.75SS**  trans62.5146.2158.469.20000119.9
166N31.9Very low30.7Very low138 Ų138137.7 Ų137.774%0.73874%0.736SS**  cis-153128.7-17.9-90.1-24.2000105.3
167T30.6Very low31.1Very low105 Ų105138.5 Ų138.564%0.64474%0.741SS**  71.2142.563.565.70000116.1
168N34.3Very low31.2Very low139 Ų139139 Ų13974%0.74374%0.743SS**  trans81.9136.1172.3-45.2-36.4000115.7
169N34.5Very low31.4Very low141 Ų141140 Ų14075%0.75474%0.74SS**  cis-150.8144.7-1.7-97-14.8000109.4
170A31.8Very low31.6Very low79 Ų79140.1 Ų140.165%0.65374%0.736SS**  59.9139.492.300000115
171D34.3Very low31.7Very low134 Ų134138 Ų13872%0.71772%0.724SS**  cis-142141.120.4-100.9-68.1000111.5
172T31.4Very low31.4Very low111 Ų111134.6 Ų134.668%0.68171%0.711SS**  53.6136.59185.60000116.1
173K32.4Very low31.2Very low174 Ų174134.7 Ų134.776%0.75771%0.708SS**  cis-158.2150.639.3-87179.7177.7166.10115.6
174L30.6Very low31.1Very low136 Ų136136.5 Ų136.571%0.71271%0.705SS**  trans60.4129.1140.5-59.7168.9000119.8
175R27.8Very low30.9Very low221 Ų221130 Ų13083%0.83468%0.679SS**  cis81128.447.5-176-167.4-175.7168.33.6112.1
176S31Very low30.6Very low79 Ų79129.8 Ų129.855%0.55268%0.683SS**  cis-150.2-173.8-2.945.50000108.7
177D33.3Very low30.4Very low138 Ų138130.4 Ų130.474%0.73869%0.686SS**  cis-145.2131.535.3-67.8-49.1000111.2
178N29.2Very low30Very low147 Ų147129.7 Ų129.779%0.78668%0.681SS**  65.681.374.6-84.1-10.5000116.3
179K32.3Very low29.8Very low195 Ų195128 Ų12885%0.84868%0.676SS**  trans-159.5118.6136.6-109.8167.1-174.8177.40111.5
180T30.3Very low29.3Very low117 Ų117128.7 Ų128.772%0.71868%0.675SS**  trans31128.6139580000119.5
181L28.8Very low29Very low96 Ų96135.7 Ų135.750%0.50369%0.686SS.*  cis-169.7167.52.1-151.569.6000110.8N827 T828L181-N827 WeakPolarHBondContact CD1-O 3.38Å; L181-N827 WeakPolarHBondContact CD2-O 3.1Å; L181-N827 WeakPolarHBondContact CG-O 3.27Å; L181-T828 WeakPolarHBondContact CD1-O 3.36Å; L181-T828 VanDerWaalsContact CD2-O 3.25Å; L181-T828 WeakPolarHBondContact CD2-O 3.36Å
182E28.4Very low28.5Very low117 Ų117134.7 Ų134.755%0.54768%0.679SS.*  trans4690.8166.6-38.4-151.2117.400116.2N826 N827E182-N826 VanDerWaalsContact OE1-C 3.24Å; E182-N827 WeakPolarHBondContact OE1-CA 3.36Å; E182-N827 PolarHBondContact OE1-N 2.96Å
183H28.9Very low28.2Very low138 Ų138134.6 Ų134.664%0.63968%0.683SS**  58.9108.866.1-127.8-29.7000116.9N825 N826H183-N825 WeakPolarHBondContact O-CB 3.48Å; H183-N826 WeakPolarHBondContact CB-O 3.29Å
184R25.6Very low27.8Very low181 Ų181130.8 Ų130.868%0.68367%0.674SS**  trans74.2154.2156.9-92.7149.2142.8-157.35.9119.3N825R184-N825 HydrophobicContact CB-CB 3.71Å; R184-N825 WeakPolarHBondContact CB-ND2 3.5Å; R184-N825 WeakPolarHBondContact CD-ND2 3.38Å; R184-N825 WeakPolarHBondContact CD-OD1 3.27Å; R184-N825 PolarHBondContact NH1-OD1 2.88Å
185S28.1Very low27.4Very low42 Ų42130.7 Ų130.729%0.29468%0.675SS.*  trans68.658.6162.838.10000119.7N823S185-N823 VanDerWaalsContact CB-ND2 3.29Å; S185-N823 WeakPolarHBondContact CB-ND2 3.41Å
186A26.7Very low27.2Very low98 Ų98129.1 Ų129.181%0.8167%0.674SS**  trans-76.7139.3140.100000108.7
187L28.2Very low26.8Very low150 Ų150130.2 Ų130.279%0.78567%0.674SS**  cis-116.9117.9-4.1-75.7162.9000110.6
188T22.8Very low26.6Very low90 Ų90130 Ų13055%0.55268%0.68SS**  trans-118.390.3154.547.70000109.3N823T188-N823 HydrophobicContact CG2-CB 4.17Å
189T29Very low26.4Very low104 Ų104128.4 Ų128.464%0.63867%0.671SS**  trans-125.9105.8166.138.50000106.2
190E23.5Very low26Very low155 Ų155125.5 Ų125.572%0.72466%0.664SS**  57.567.586.4-66.4-155.5157.900113I192E190-I192 PolarHBondContact O-N 3.3Å
191Y25.5Very low25.8Very low227 Ų227125 Ų12589%0.8967%0.666SS**  trans-79.982.4135.1-80.9-76.7000108.7
192I25.4Very low25.6Very low112 Ų112126.2 Ų126.257%0.57468%0.678SS**  trans-43.6138145.3-69.2168.2000106.9E190 V194E190-I192 PolarHBondContact O-N 3.3Å; I192-V194 PolarHBondContact O-N 2.88Å
193S23.4Very low25.5Very low109 Ų109128.1 Ų128.176%0.76269%0.691SS**  trans-66.184.9170.3-57.20000109.1D195S193-D195 PolarHBondContact O-N 3.48Å
194V24Very low25.3Very low94 Ų94125.4 Ų125.457%0.5769%0.693SS**  trans-67.7103172.1177.40000106.6I192 F196I192-V194 PolarHBondContact O-N 2.88Å; V194-F196 VanDerWaalsContact C-N 3.27Å; V194-F196 HydrophobicContact CB-CE2 4.46Å; V194-F196 HydrophobicContact CG1-CD2 3.99Å; V194-F196 HydrophobicContact CG1-CE2 3.82Å; V194-F196 HydrophobicContact CG1-CZ 4.43Å; V194-F196 PolarHBondContact O-N 3.09Å
195D22.6Very low25.4Very low135 Ų135124.7 Ų124.772%0.72270%0.702SS**  trans-6088.7172.4-80.4-42.8000109.8S193 N197S193-D195 PolarHBondContact O-N 3.48Å; D195-N197 PolarHBondContact O-N 3.36Å
196F24.2Very low25.3Very low188 Ų188127.9 Ų127.983%0.82572%0.719SS**  trans-70.173.2162.1-86.6-75.4000109.3V194 P198V194-F196 VanDerWaalsContact C-N 3.27Å; V194-F196 HydrophobicContact CB-CE2 4.46Å; V194-F196 HydrophobicContact CG1-CD2 3.99Å; V194-F196 HydrophobicContact CG1-CE2 3.82Å; V194-F196 HydrophobicContact CG1-CZ 4.43Å; V194-F196 PolarHBondContact O-N 3.09Å; F196-P198 WeakPolarHBondContact O-CD 3.23Å
197N23.4Very low25.4Very low101 Ų101128.5 Ų128.554%0.5472%0.715SS.*  trans-70.9110162.3-91.2-66000109.3D195 L199D195-N197 PolarHBondContact O-N 3.36Å; N197-L199 HydrophobicContact CB-CB 4.12Å; N197-L199 HydrophobicContact CB-CD1 3.9Å; N197-L199 HydrophobicContact CB-CG 3.88Å; N197-L199 PolarHBondContact O-N 3.45Å
198P29Very low25.1Very low133 Ų133127.7 Ų127.786%0.86471%0.71SS**  trans-74.264151.734.3-36000108.9F196 N200F196-P198 WeakPolarHBondContact O-CD 3.23Å; P198-N200 PolarHBondContact O-N 3.24Å
199L24.6Very low25.1Very low114 Ų114130.7 Ų130.760%0.59772%0.721SS**  trans-75.3124.1177.6-98.5168.8000110.5N197N197-L199 HydrophobicContact CB-CB 4.12Å; N197-L199 HydrophobicContact CB-CD1 3.9Å; N197-L199 HydrophobicContact CB-CG 3.88Å; N197-L199 PolarHBondContact O-N 3.45Å
200N24.3Very low24.8Very low134 Ų134131.1 Ų131.172%0.71773%0.728SS**  trans56.484.7152.7-61-19.7000119.2P198P198-N200 PolarHBondContact O-N 3.24Å
201S25.4Very low25Very low108 Ų108131.2 Ų131.276%0.75573%0.733SS**  -165.293120.754.60000110.7
202T24.4Very low25.3Very low121 Ų121125.5 Ų125.574%0.74272%0.724SS**  56.279.187.866.80000115.5
203N26.4Very low25.3Very low156 Ų156124.4 Ų124.483%0.83473%0.726SS**  trans-158.7121.1131.7-92.1-31.3000107
204A25.6Very low25.3Very low81 Ų81125.7 Ų125.767%0.66972%0.724SS**  70.911776.700000111
205L25.8Very low25.4Very low167 Ų167126.7 Ų126.787%0.87473%0.731SS**  cis-151.4155.115.8-101.1149.8000114.2
206V26.3Very low25.6Very low109 Ų109127 Ų12766%0.66173%0.732SS**  trans-91.1131.3158.2167.30000106.9I208V206-I208 HydrophobicContact CG1-CD1 3.56Å; V206-I208 HydrophobicContact CG1-CG1 3.83Å
207P29.2Very low25.6Very low111 Ų111121 Ų12172%0.72171%0.709SS**  -139158.789.414.510.7000113.8
208I22.7Very low25.7Very low132 Ų132120.6 Ų120.668%0.67770%0.704SS**  cis91.311841.2-63.9167.6000114.2V206V206-I208 HydrophobicContact CG1-CD1 3.56Å; V206-I208 HydrophobicContact CG1-CG1 3.83Å
209I23.1Very low25.4Very low154 Ų154117.8 Ų117.879%0.7968%0.684SS**  trans85.7141.8155-79166.9000121.7
210S22.7Very low25.6Very low112 Ų112115.1 Ų115.178%0.78367%0.67SS**  trans78.4107.3159-76.90000123.3
211L27.9Very low25.8Very low158 Ų158113.3 Ų113.383%0.82767%0.665SS**  trans-52.4171.9135.3-80.7121000112.5
212P31.5Very low25.8Very low107 Ų107112.9 Ų112.970%0.69566%0.662SS**  cis-140.5-176.818.141-21.3000117.4
213S24.6Very low25.9Very low89 Ų89114.1 Ų114.162%0.62266%0.663SS**  trans66.6133.2136.9-89.60000123.3
214D23.6Very low25.8Very low136 Ų136114.4 Ų114.473%0.72766%0.66SS**  trans54.7111.7134.5-47.4-42.4000117.7
215T26Very low25.7Very low114 Ų114114.5 Ų114.570%0.69966%0.656SS**  -158.5147.267.522.40000112.8I319T215-I319 HydrophobicContact CG2-CD1 3.91Å
216N26.2Very low25.6Very low141 Ų141113.6 Ų113.675%0.75465%0.652SS**  trans-60.9154.4154.7-81.7-74.7000109.1
217L25.1Very low25.7Very low64 Ų64116.7 Ų116.734%0.33566%0.659SS.*  169111.5106-80144.5000112.2S317 I319L217-S317 VanDerWaalsContact CB-OG 3.23Å; L217-S317 WeakPolarHBondContact CB-OG 3.4Å; L217-I319 HydrophobicContact CD1-CD1 3.84Å; L217-I319 HydrophobicContact CD1-CG1 3.6Å
218Q24.8Very low25.5Very low92 Ų92121.9 Ų121.943%0.4367%0.665SS.*  68.2118.7121.9-59.4-157.5-28.300119I315 R316Q218-I315 VanDerWaalsContact CA-CG2 3.41Å; Q218-I315 HydrophobicContact CB-CB 4.33Å; Q218-I315 HydrophobicContact CB-CG2 3.2Å; Q218-I315 HydrophobicContact CG-CB 4.39Å; Q218-I315 HydrophobicContact CG-CG2 3.45Å; Q218-I315 VanDerWaalsContact CG-CG2 3.45Å; Q218-R316 PolarHBondContact OE1-O 3.07Å
219T23.7Very low25.5Very low74 Ų74123.6 Ų123.645%0.45467%0.671SS.*  176.7145.893.9-59.40000116.8Q314 I315 R316T219-Q314 HydrophobicContact CG2-CG 4.04Å; T219-I315 VanDerWaalsContact CB-O 3.32Å; T219-I315 WeakPolarHBondContact CB-O 3.42Å; T219-I315 WeakPolarHBondContact CG2-O 3.48Å; T219-I315 PolarHBondContact OG1-O 3.15Å; T219-R316 WeakPolarHBondContact OG1-CA 3.32Å; T219-R316 VanDerWaalsContact OG1-CB 3.32Å; T219-R316 WeakPolarHBondContact OG1-CB 3.29Å; T219-R316 WeakPolarHBondContact OG1-CD 3.26Å; T219-R316 VanDerWaalsContact OG1-CG 3.27Å; T219-R316 WeakPolarHBondContact OG1-CG 3.47Å
220I28.2Very low25.7Very low58 Ų58122.6 Ų122.630%0.29767%0.667SS.*  trans-73.5173.4173-72.8118.8000113.2V313 Q314 I315I220-V313 HydrophobicContact CD1-CB 3.75Å; I220-V313 HydrophobicContact CD1-CG1 3.76Å; I220-V313 WeakPolarHBondContact CG2-O 3.43Å; I220-Q314 HydrophobicContact CB-CG 3.79Å; I220-Q314 HydrophobicContact CG2-CG 3.88Å; I220-Q314 PolarHBondContact O-NE2 3.2Å; I220-I315 HydrophobicContact CD1-CB 3.82Å; I220-I315 HydrophobicContact CD1-CD1 3.64Å; I220-I315 HydrophobicContact CD1-CG1 3.99Å; I220-I315 HydrophobicContact CD1-CG2 4.03Å
221P29.2Very low25.9Very low96 Ų96127.2 Ų127.262%0.62367%0.673SS**  cis-119.2175.114.212.615.3000115.9
222S25.9Very low25.7Very low98 Ų98128.7 Ų128.769%0.68568%0.676SS**  cis91.7123.432.2-43.70000116
223L25.2Very low25.4Very low147 Ų147127.2 Ų127.277%0.7767%0.673SS**  trans178.7128.7143.1-113.973.9000106.3
224E25.5Very low25.4Very low163 Ų163130.9 Ų130.976%0.76268%0.68SS**  63.9147.687.4-66.3-177.8-177.800115.9
225S23.7Very low25.5Very low83 Ų83135 Ų13558%0.5869%0.687SS**  cis-168.7168.3-25.658.70000108.8
226N23.2Very low25.5Very low148 Ų148138 Ų13879%0.79169%0.69SS**  trans66.7120171.2-48.8-38.1000118.3
227E28.3Very low25.5Very low173 Ų173136.1 Ų136.181%0.80868%0.684SS**  -17177.5117.1-103.5179.5-162.200109.6
228Y24Very low25.5Very low220 Ų220140.3 Ų140.386%0.86371%0.706SS**  trans-77.7149.8156.4-169-100.8000107
229E23.6Very low25.7Very low169 Ų169140.5 Ų140.579%0.7971%0.714SS**SBendtrans72.352.8-172.9-47.4-165.114300117.6
230N27.1Very low25.8Very low133 Ų133143.9 Ų143.971%0.71173%0.734SS**  trans-16066.9154.3-106.3-31.6000115.3
231F26.7Very low25.8Very low208 Ų208146.8 Ų146.891%0.91275%0.75SS**  trans-164.253148.2-115.6-68.7000112.8
232Q24.6Very low25.8Very low190 Ų190147.3 Ų147.389%0.88874%0.744SS**  trans-80.7155.6156.4-89.3-170.8-3.400110.2
233A24.5Very low26Very low76 Ų76145.8 Ų145.863%0.62873%0.728SS**  trans75.4143.9175.400000117.4
234H24.9Very low26.1Very low165 Ų165140.8 Ų140.876%0.76470%0.704SS**  trans60118.8-176.4-58.9-92.4000115.1
235Y26.2Very low26.3Very low222 Ų222140.8 Ų140.887%0.87170%0.704SS**  cis-116.8148.619.5-96.9-98.8000115.4
236K25.4Very low26.6Very low179 Ų179140.6 Ų140.678%0.77870%0.702SS**  trans-124.1160.6167-140.9-179.3-173.9178.90107.1
237T25.7Very low26.9Very low101 Ų101141 Ų14162%0.6270%0.703SS**  trans54112.9160.452.80000119.1
238N25.8Very low27.2Very low151 Ų151138.5 Ų138.581%0.80770%0.702SS**  -174123.9103.5-80.4-21000107.6
239T28.5Very low27.5Very low96 Ų96132.2 Ų132.259%0.58969%0.691SS**  cis72.293.532.274.70000116.8
240V25.2Very low27.6Very low146 Ų146130.8 Ų130.889%0.88569%0.688SS**  trans-141.999.4142.8-178.50000103.9
241L29.8Very low27.9Very low118 Ų118131.2 Ų131.262%0.61870%0.696SS**  cis70.7122.930.4-148.987.1000113.5
242E27.6Very low28.3Very low108 Ų108126.8 Ų126.851%0.50569%0.686SS.*  159145.4126.6-80.5-92.7113.100112.6Q583E242-Q583 PolarHBondContact OE1-NE2 3.21Å; E242-Q583 PolarHBondContact OE2-NE2 2.94Å
243N30.1Very low28.8Very low66 Ų66123.2 Ų123.235%0.35368%0.679SS.*  cis-166.8174.1-34-150.1-18.8000110.9
244V27.2Very low29.1Very low42 Ų42126.1 Ų126.126%0.25568%0.684SS.*  trans73.1134.9162.3171.50000116T580 A581 I582V244-T580 VanDerWaalsContact CG1-O 3.24Å; V244-T580 WeakPolarHBondContact CG1-O 3.45Å; V244-A581 HydrophobicContact CB-CB 3.99Å; V244-A581 HydrophobicContact CG2-CB 4.05Å; V244-I582 WeakPolarHBondContact CG2-O 3.38Å
245Q31.4Very low29.5Very low163 Ų163125.2 Ų125.276%0.76269%0.685SS**  cis86.9174.125.1-52.7172.1-24.600113.4
246S29.1Very low29.6Very low79 Ų79122.7 Ų122.755%0.55269%0.685SS**  cis-160.9146.78.3-4.60000113.7
247L30.4Very low29.7Very low155 Ų155117.6 Ų117.681%0.81268%0.684SS**  trans63.3175.5141.5-91.873.9000119.2
248P33.7Very low30.4Very low121 Ų121118.3 Ų118.379%0.78669%0.69SS**  cis-123171.21.721.13.3000117.4
249S29.6Very low30.4Very low89 Ų89118.2 Ų118.262%0.62269%0.689SS**  trans-89.4175.6172.251.40000113.4
250N26.5Very low30.2Very low138 Ų138119.4 Ų119.474%0.73869%0.692SS**  172.2170.4118.6-85.5-8000115.7
251T33.9Very low30.2Very low142 Ų142119.1 Ų119.187%0.87168%0.684SS**  trans88.3126163.358.80000120.7
252V33.8Very low29.9Very low115 Ų115119.5 Ų119.570%0.69769%0.691SS**  trans-111.3164.5166.9-151.60000106.8
253P35.5Very low29.7Very low115 Ų115118.2 Ų118.275%0.74769%0.694SS**  -133.4158.988.413.310.4000111.8
254D30.6Very low29.5Very low138 Ų138125.3 Ų125.374%0.73872%0.717SS**  cis74.1104.445.2-68.7-40.8000115.4
255D33.2Very low29.7Very low146 Ų146128.8 Ų128.878%0.78174%0.741SS**  trans-178.3114.9137.9-101-7.4000108.4
256L28.4Very low29.6Very low168 Ų168129.4 Ų129.488%0.8875%0.746SS**  85.6127.973.5-80.1-170.4000114.4
257G28.5Very low29.4Very low72 Ų72128.8 Ų128.874%0.74275%0.752SS**  trans13359.4162.200000118.9
258P40.3Very low29.1Very low116 Ų116129.1 Ų129.175%0.75375%0.753SS**  trans-74.8168.6159.436.3-35.7000110.9
259L24.9Very low28.7Very low149 Ų149129.9 Ų129.978%0.7876%0.756SS**  trans178.7150.8136.1-99162.6000114.4
260N24.7Very low28.4Very low122 Ų122134.1 Ų134.165%0.65277%0.766SS**  trans61.9121.6158-61.6-24.3000119.5
261I25Very low28.2Very low139 Ų139131.5 Ų131.571%0.71376%0.763SS**  cis72.5103.338.3-50.2164.2000113.5
262T24.7Very low27.7Very low127 Ų127131.3 Ų131.378%0.77976%0.757SS**  -175.4113.6127.931.60000106.1
263S23.4Very low27.3Very low81 Ų81132 Ų13257%0.56676%0.755SS**  81.314754.878.30000114.5
264Y24.9Very low27Very low214 Ų214132 Ų13284%0.83976%0.755SS**  trans81.8147.7178.6-55.6-74000117.4
265P31Very low26.7Very low115 Ų115130 Ų13075%0.74775%0.752SS**  cis-139.8177.6-36.338.6-22.9000115.4
266M29.1Very low26.4Very low177 Ų177129.9 Ų129.987%0.87275%0.75SS**  trans-62.1149.5161.2-71.9-103.8-69.500113.6
267G25Very low26.2Very low65 Ų65127.2 Ų127.267%0.6774%0.741SS**  trans-177.5127.2164.100000106.6
268L25.5Very low26.2Very low162 Ų162134.7 Ų134.785%0.84875%0.747SS**  cis57.267.225.9-83.6178.1000113.6
269V24.2Very low25.6Very low138 Ų138134 Ų13484%0.83674%0.742SS**  trans-133.8112.5157.2173.70000107.1
270E23.3Very low25.6Very low178 Ų178131.7 Ų131.783%0.83274%0.738SS**  trans-75.4-179.8161.9-63.9168.5103.700109.7
271A22.8Very low25.6Very low83 Ų83132.1 Ų132.169%0.68674%0.739SS**  trans99117.9168.100000118.4
272D22.9Very low25.6Very low137 Ų137132.5 Ų132.573%0.73374%0.738SS**  8194.8125.3-59.8-4.4000122.5
273I25.9Very low25.6Very low129 Ų129133.9 Ų133.966%0.66274%0.735SS**  58.4116.7101.7-68.3167.3000115.7
274P28.4Very low25.9Very low115 Ų115134.1 Ų134.175%0.74774%0.737SS**  -120.2106.19234.4-33000114.7I276P274-I276 PolarHBondContact O-N 2.95Å; P274-I276 VanDerWaalsContact O-N 3.07Å
275S25.2Very low26.1Very low96 Ų96129.2 Ų129.267%0.67173%0.731SS**  trans-60.5100.4158-54.20000110.4
276I26.8Very low25.9Very low145 Ų145129 Ų12974%0.74473%0.728SS**  trans-107.393.7163.8-63.2-174.6000108.8P274P274-I276 PolarHBondContact O-N 2.95Å; P274-I276 VanDerWaalsContact O-N 3.07Å
277T24.8Very low25.7Very low111 Ų111125.8 Ų125.868%0.68171%0.714SS**  trans15.6142.6138.963.40000118.5
278R27.2Very low25.9Very low230 Ų230129.6 Ų129.687%0.86871%0.714SS**  cis-158.6136.433.9-153.7172.2-175168.20.7112.5
279P28.9Very low26Very low102 Ų102130.1 Ų130.166%0.66271%0.712SS**  trans-80.4157.6164.135.6-34.7000111
280S24.7Very low26.2Very low99 Ų99127.1 Ų127.169%0.69270%0.701SS**  trans-174.3128.7139.6-98.70000106.8
281I24.5Very low26.3Very low131 Ų131126.1 Ų126.167%0.67270%0.701SS**  65.6129.458.3-54.8165.3000110.7
282H25.3Very low26.7Very low148 Ų148129.6 Ų129.669%0.68570%0.703SS**  trans94.7126.6-177.5-57.8-73000113.6
283Q24.7Very low27.1Very low155 Ų155127.6 Ų127.672%0.72470%0.697SS**  cis-177.7159.9-11.6-127167.4-21.300106.2
284S28.8Very low27Very low86 Ų86126.2 Ų126.260%0.60170%0.695SS**  trans-24.6150.6143.353.40000115.4
285P29.6Very low26.9Very low112 Ų112127.5 Ų127.573%0.72769%0.694SS**  cis-121.2167.739.332.4-13.2000114.1
286V26.2Very low27.1Very low111 Ų111131.7 Ų131.767%0.67370%0.7SS**  47.3130.965.8-116.40000109.2
287D25.8Very low27.3Very low108 Ų108129.5 Ų129.558%0.57870%0.696SS**  cis-160.7170.747.2-129.5-48.5000116.4
288H28.8Very low27.5Very low146 Ų146130.4 Ų130.468%0.67670%0.696SS**  trans66109.5162.4-59.1-14.7000116.3
289H28.1Very low27.6Very low172 Ų172126.4 Ų126.480%0.79669%0.687SS**  67.914170.3-65.4-145000111.5
290A27.5Very low27.6Very low75 Ų75127.9 Ų127.962%0.6269%0.688SS**  cis-154.8161.826.600000113.6
291L26.4Very low27.8Very low157 Ų157127.3 Ų127.382%0.82268%0.682SS**  trans60.2109.5139.9-68.5166.6000116.9
292H29.5Very low27.9Very low157 Ų157131 Ų13173%0.72769%0.689SS**  cis51.8136.947.5-124.3-92.8000110.8
293P31.5Very low27.9Very low95 Ų95128.4 Ų128.462%0.61769%0.687SS**  cis-153.4141.732.142.3-20.1000118.8
294T24.9Very low27.8Very low99 Ų99131 Ų13161%0.60769%0.692SS**  66168128.168.30000123.6
295I26.6Very low27.8Very low142 Ų142131.6 Ų131.673%0.72870%0.696SS**  trans74.6123.4149.6-76.9159.6000115.3
296K28Very low27.8Very low184 Ų184131.1 Ų131.180%0.869%0.693SS**  cis-152.1175.12-114.6175.5-176.5179.60110
297P31.3Very low27.7Very low100 Ų100133.4 Ų133.465%0.64970%0.7SS**  trans-103.4-179.6-158.340.4-36.9000113.7
298N28.3Very low27.7Very low130 Ų130134 Ų13470%0.69571%0.708SS**  -169.3147112.4-99.6-13.7000114.8
299H30.5Very low27.7Very low146 Ų146132.2 Ų132.268%0.67671%0.709SS**  trans43.5124.7165-58-68.4000121.6
300I27.9Very low27.5Very low133 Ų133131.7 Ų131.768%0.68271%0.711SS**  cis77.5126.137.3-59.7169.2000111.4
301P29.8Very low27.4Very low86 Ų86132.9 Ų132.956%0.55872%0.715SS**  cis-158.6-168.7-16.646.8-27.8000118.4
302Y26.4Very low27.3Very low210 Ų210130.7 Ų130.782%0.82471%0.713SS**  trans58154.3140.5-58.3-30.8000121.2
303S25.3Very low27.1Very low92 Ų92128 Ų12864%0.64371%0.707SS**  cis-162.4136-21.447.30000107.4
304Y23.9Very low26.8Very low210 Ų210129.4 Ų129.482%0.82471%0.706SS**  40.6100.291-88.8-89.7000115.6
305S26.9Very low26.7Very low99 Ų99127.9 Ų127.969%0.69269%0.693SS**  67.8-178.3122-55.60000118.5
306P30.6Very low26.5Very low102 Ų102130.4 Ų130.466%0.66269%0.694SS**  -134.4-179.5-60.640.3-26.7000113.2
307L23.7Very low26.4Very low158 Ų158124.6 Ų124.683%0.82768%0.676SS**  trans66.6157.2164.7-55.9167.9000115
308T25.4Very low26Very low122 Ų122124.7 Ų124.775%0.74868%0.679SS**  cis-135.4-121.7-17.124.30000111.3
309P29.6Very low25.9Very low107 Ų107122.8 Ų122.870%0.69567%0.668SS**  -121.9-171.3-12838.5-18.3000115.3
310L23.9Very low25.6Very low161 Ų161123.2 Ų123.284%0.84367%0.67SS**  trans-2.5135.4164.9-74.572000116.7
311S25.1Very low25.5Very low100 Ų100123.5 Ų123.570%0.69967%0.669SS**  -177.5-178.667.859.30000113.5
312S24.2Very low25.4Very low111 Ų111124.3 Ų124.378%0.77668%0.676SS**  trans72.294.2151.1-50.60000118.2
313V26.1Very low25.3Very low100 Ų100118.4 Ų118.461%0.60667%0.666SS**  trans-74.5123.3172.7-140.80000111.1I220 I315I220-V313 HydrophobicContact CD1-CB 3.75Å; I220-V313 HydrophobicContact CD1-CG1 3.76Å; I220-V313 WeakPolarHBondContact CG2-O 3.43Å; V313-I315 HydrophobicContact CG1-CD1 3.71Å; V313-I315 HydrophobicContact CG1-CG1 3.98Å
314Q23.9Very low25.3Very low125 Ų125121.9 Ų121.958%0.58467%0.669SS**  trans-168.860.9161.3-112.2-167.3-22.600113.4T219 I220T219-Q314 HydrophobicContact CG2-CG 4.04Å; I220-Q314 HydrophobicContact CB-CG 3.79Å; I220-Q314 HydrophobicContact CG2-CG 3.88Å; I220-Q314 PolarHBondContact O-NE2 3.2Å
315I24.4Very low25.7Very low67 Ų67118.1 Ų118.134%0.34467%0.668SS.*  44.8102.989.1-70-162.9000113.2Q218 T219 I220 V313Q218-I315 VanDerWaalsContact CA-CG2 3.41Å; Q218-I315 HydrophobicContact CB-CB 4.33Å; Q218-I315 HydrophobicContact CB-CG2 3.2Å; Q218-I315 HydrophobicContact CG-CB 4.39Å; Q218-I315 HydrophobicContact CG-CG2 3.45Å; Q218-I315 VanDerWaalsContact CG-CG2 3.45Å; T219-I315 VanDerWaalsContact CB-O 3.32Å; T219-I315 WeakPolarHBondContact CB-O 3.42Å; T219-I315 WeakPolarHBondContact CG2-O 3.48Å; T219-I315 PolarHBondContact OG1-O 3.15Å; I220-I315 HydrophobicContact CD1-CB 3.82Å; I220-I315 HydrophobicContact CD1-CD1 3.64Å; I220-I315 HydrophobicContact CD1-CG1 3.99Å; I220-I315 HydrophobicContact CD1-CG2 4.03Å; V313-I315 HydrophobicContact CG1-CD1 3.71Å; V313-I315 HydrophobicContact CG1-CG1 3.98Å
316R21.7Very low25.7Very low196 Ų196118.3 Ų118.374%0.7466%0.66SS**  trans-162.8151.4148.4-155.4155.3-156.7-152.52.7114.1Q218 T219Q218-R316 PolarHBondContact OE1-O 3.07Å; T219-R316 WeakPolarHBondContact OG1-CA 3.32Å; T219-R316 VanDerWaalsContact OG1-CB 3.32Å; T219-R316 WeakPolarHBondContact OG1-CB 3.29Å; T219-R316 WeakPolarHBondContact OG1-CD 3.26Å; T219-R316 VanDerWaalsContact OG1-CG 3.27Å; T219-R316 WeakPolarHBondContact OG1-CG 3.47Å
317S25.5Very low25.5Very low61 Ų61119.9 Ų119.943%0.42766%0.663SS.*  trans-47.1146.1177.4-26.20000114.6L217L217-S317 VanDerWaalsContact CB-OG 3.23Å; L217-S317 WeakPolarHBondContact CB-OG 3.4Å
318S23Very low25.7Very low102 Ų102116.8 Ų116.871%0.71365%0.647SS**  -150.7149.750.951.10000112.1
319I25.6Very low25.8Very low91 Ų91119.9 Ų119.947%0.46765%0.653SS.*  51.4107.274.6-55.2169.6000114.6T215 L217T215-I319 HydrophobicContact CG2-CD1 3.91Å; L217-I319 HydrophobicContact CD1-CD1 3.84Å; L217-I319 HydrophobicContact CD1-CG1 3.6Å
320H25.1Very low25.7Very low155 Ų155120.3 Ų120.372%0.71865%0.654SS**  -149.4120.7120.6-103.3-86.1000105.5
321E25.1Very low25.7Very low139 Ų139118.1 Ų118.165%0.6565%0.65SS**  61.9132.691.6-65.4-177.1177.100113.5
322S27.7Very low25.8Very low103 Ų103118.3 Ų118.372%0.7265%0.649SS**  cis-139.1147.431.332.90000111.7
323S25.7Very low25.9Very low86 Ų86119.2 Ų119.260%0.60164%0.644SS**  cis78.9156.332.7-52.30000114.1
324F24.7Very low25.8Very low164 Ų164120.8 Ų120.872%0.71965%0.649SS**  trans80.699.6-165.9-57.2-72.1000114I326F324-I326 HydrophobicContact CD1-CD1 3.72Å; F324-I326 HydrophobicContact CD1-CG1 4.16Å; F324-I326 HydrophobicContact CE1-CD1 3.69Å
325V31.2Very low25.9Very low131 Ų131120.7 Ų120.779%0.79465%0.653SS**  cis63.5158.815.1-166.90000113.2
326I27.1Very low26Very low103 Ų103125 Ų12553%0.52868%0.675SS.*  trans91.5134.1179-60.8-175000112.9F324F324-I326 HydrophobicContact CD1-CD1 3.72Å; F324-I326 HydrophobicContact CD1-CG1 4.16Å; F324-I326 HydrophobicContact CE1-CD1 3.69Å
327D27.1Very low26Very low135 Ų135120.8 Ų120.872%0.72267%0.674SS**  cis-109.7143.28.1-85.1-67.5000112.5
328N26.8Very low26.1Very low93 Ų93124.9 Ų124.950%0.49769%0.691SS.*  75.6111.153.3-60.9-33000115.7
329Q28.4Very low26.2Very low187 Ų187127.4 Ų127.487%0.87469%0.692SS**  -172.7119.1112.8-95.9159.639.200107.1
330V26.6Very low26.1Very low117 Ų117130.2 Ų130.271%0.70970%0.703SS**  cis71.3105.837.9-171.20000113
331C25.8Very low26Very low114 Ų114129 Ų12977%0.7770%0.701SS**  trans159.7160.4151.6-94.20000109.7
332P27.1Very low25.9Very low104 Ų104129.8 Ų129.868%0.67571%0.705SS**  cis-127.6147.8-3037.4-21.4000112
333I24.7Very low25.7Very low131 Ų131131.4 Ų131.467%0.67271%0.71SS**  56.8102.897.3-46.7164.6000115.2
334D25.2Very low25.6Very low132 Ų132130.7 Ų130.771%0.70672%0.717SS**  177.6127.6115.2-93.2-37.9000108.1
335N25Very low25.6Very low123 Ų123127.5 Ų127.566%0.65872%0.715SS**  74.9147.958.9-67.1-44.6000114.2
336I26Very low25.2Very low157 Ų157130 Ų13081%0.80572%0.715SS**  trans70.4121.2168.1-56.9147.2000113.8
337C23.3Very low25.3Very low109 Ų109131.2 Ų131.274%0.73673%0.727SS**  cis-154.7151.8-5.8-132.90000112.9
338N26.8Very low25.3Very low146 Ų146133.4 Ų133.478%0.78173%0.731SS**  trans-57.6133.1141-81.1-57.5000108.4
339Q24.8Very low25.3Very low155 Ų155135.6 Ų135.672%0.72474%0.742SS**  174.3137116.9-95.7172.924.900113.8
340Q23.7Very low25.1Very low150 Ų150133.7 Ų133.770%0.70173%0.731SS**  trans72.4154.4134.8-72.3176.31.500121.3
341L23.6Very low25.3Very low130 Ų130137 Ų13768%0.68173%0.732SS**  trans61.999.4159.4-63.9156.8000115.2
342Q22.9Very low25.3Very low156 Ų156135.2 Ų135.273%0.72972%0.721SS**  65132.177.9-70.7-173.6-11.100113.8
343T23.5Very low25.2Very low136 Ų136134.4 Ų134.483%0.83472%0.718SS**  trans48.2118.214958.20000118.2
344G23.9Very low25.2Very low72 Ų72134.2 Ų134.274%0.74272%0.718SS**  trans-158.1-28.417800000121.3
345S24.3Very low25.1Very low96 Ų96136.7 Ų136.767%0.67172%0.719SS**  trans63.1165.3172-166.60000116.9
346F23.3Very low25Very low184 Ų184136.6 Ų136.681%0.80772%0.715SS**  trans63.7136.2175-49.2-74.6000115.4
347V28.3Very low24.9Very low129 Ų129135.1 Ų135.178%0.78270%0.704SS**SBendcis-117.6127.619.3171.50000112.6
348K27.1Very low24.9Very low181 Ų181139.1 Ų139.179%0.78771%0.705SS**  trans39.190.1152.5-64.2176-179.8174.80118.2
349N27Very low24.8Very low139 Ų139137.5 Ų137.574%0.74371%0.705SS**  -22.4152.6118.4-166.79.6000114.8
350K25.1Very low24.9Very low147 Ų147133.9 Ų133.964%0.63971%0.71SS**  trans90123.3-170.1-64.5-175.2163.5-151.20114.8
351Y29.8Very low25.1Very low185 Ų185131.4 Ų131.473%0.72572%0.715SS**  cis-124.4124.1-5.1-76-91.2000106.5
352S25.4Very low25.5Very low78 Ų78131 Ų13155%0.54572%0.72SS.*  cis54.1109.927.8-177.20000113.5
353S26Very low25.7Very low87 Ų87131.9 Ų131.961%0.60872%0.724SS**  trans55.3132.1162.7780000115.1
354D24.5Very low25.8Very low127 Ų127131 Ų13168%0.67972%0.722SS**  -149.616254.3-65.1-32.2000109.8
355Y23.1Very low25.9Very low183 Ų183135.4 Ų135.472%0.71872%0.722SS**  cis-157.7-175.5-1.1-129.5-151.4000111.2
356Q23Very low26.1Very low122 Ų122137.1 Ų137.157%0.5773%0.73SS**  trans-11.3151.4139.1-61.7-175.5-6100117.2
357E23Very low26.3Very low126 Ų126133.6 Ų133.659%0.58972%0.724SS**  cis-176.3-166.6-0.1-111.1162.3-170.200108.6
358Y23.9Very low26.3Very low193 Ų193134.3 Ų134.376%0.75773%0.728SS**  trans58.795.4149.9-71.9-61.6000120.1
359S24.9Very low26.3Very low111 Ų111133.7 Ų133.778%0.77673%0.728SS**  40.6116.6119.5640000120.3
360G27.2Very low26.3Very low80 Ų80132.8 Ų132.883%0.82573%0.728SS**  trans165.6112.3157.100000114
361A26.9Very low26.2Very low98 Ų98133 Ų13381%0.8174%0.735SS**  trans-79.9157.715300000107.9
362P32.4Very low25.9Very low121 Ų121131.7 Ų131.779%0.78674%0.735SS**  -144.1-165.262.241.2-21.6000115.6
363E27.6Very low25.9Very low174 Ų174133.7 Ų133.781%0.81374%0.739SS**  trans-58.8157-177.8-49.9144135.700114.9
364C25.4Very low25.8Very low118 Ų118138 Ų13880%0.79775%0.747SS**  -178.5160.3119.5-96.90000116.4
365F25Very low25.8Very low165 Ų165137.4 Ų137.472%0.72475%0.748SS**  trans-41.8157.8175.7-65.8-101.6000119.7T367F365-T367 PolarHBondContact O-N 3.43Å
366P29.7Very low25.8Very low132 Ų132132.9 Ų132.986%0.85774%0.744SS**SBendtrans-85.271146.137.3-31.2000111.3
367T27.2Very low26.1Very low110 Ų110135 Ų13568%0.67575%0.753SS**  trans-119.693.2167.9-53.70000108.2F365F365-T367 PolarHBondContact O-N 3.43Å
368V27.4Very low26.2Very low143 Ų143133.2 Ų133.287%0.86776%0.755SS**  trans-124.8124-179.9-176.30000109.9
369H27.8Very low26.3Very low169 Ų169128 Ų12878%0.78275%0.746SS**  trans-132.3170.5-175.3-159.9-83000107.4
370T27Very low26.6Very low120 Ų120129.2 Ų129.274%0.73674%0.744SS**  trans86.5166.9161.9-25.70000117.4
371L23.7Very low26.5Very low150 Ų150132.9 Ų132.979%0.78574%0.744SS**  trans73.1121.5-162.4-48.8178.4000111.5
372E23.7Very low26.6Very low158 Ų158132.6 Ų132.674%0.73873%0.734SS**  cis-165.9164.70.9-132.2179.2-147.100107.9
373L24.7Very low26.4Very low120 Ų120135 Ų13563%0.62873%0.734SS**  cis-146.6155.216-87.6163.5000111.5
374F23.7Very low26.3Very low178 Ų178131.2 Ų131.278%0.78173%0.727SS**  trans52.5143.3149.5-78.1-62.4000126.2
375T24.6Very low26.2Very low114 Ų114130.3 Ų130.370%0.69972%0.722SS**  trans60106.2155.649.10000117.7
376S23.8Very low26.4Very low89 Ų89127.7 Ų127.762%0.62272%0.724SS**  64.6133.770.4820000113
377H28.5Very low26.3Very low165 Ų165130 Ų13076%0.76472%0.723SS**  cis-146.6162.435.8-105.8-81.5000114.7
378S25.5Very low26.4Very low89 Ų89130.2 Ų130.262%0.62273%0.727SS**  trans-13157.2136.259.70000117.8
379S25.6Very low26.3Very low84 Ų84128.2 Ų128.259%0.58772%0.719SS**  cis-165.6-157.912.322.80000110
380D30.4Very low26.2Very low137 Ų137128.9 Ų128.973%0.73372%0.719SS**  trans72.998.6150.4-47.5-48000115.4
381L26.3Very low26.2Very low157 Ų157129.6 Ų129.682%0.82272%0.719SS**  cis44.3129.841.5-93169.9000111.9
382P29.5Very low26.3Very low91 Ų91129.2 Ų129.259%0.59172%0.722SS**  cis-147.4-154.825.940-15.5000114.1
383H26.8Very low26.4Very low171 Ų171124.7 Ų124.779%0.79272%0.719SS**  trans35.3138139-59.3-26.1000120.7
384S25.4Very low26.7Very low95 Ų95127.8 Ų127.866%0.66473%0.73SS**  cis-174.5-179.95.6450000110
385S25.1Very low26.8Very low99 Ų99124.4 Ų124.469%0.69273%0.728SS**  trans46.7123.5142.263.90000118.6
386S28.1Very low27.2Very low110 Ų110124.7 Ų124.777%0.76973%0.732SS**  -168.6141.953.345.70000114.2
387H27.5Very low27.4Very low180 Ų180128.3 Ų128.383%0.83374%0.736SS**  trans-57.8145.4148-79.8-59.2000109.1
388P29.1Very low27.4Very low116 Ų116128.3 Ų128.375%0.75374%0.736SS**  -141.41417636.6-20.1000116.3
389S25.8Very low27.7Very low100 Ų100131.4 Ų131.470%0.69975%0.745SS**  trans-62.614014844.50000110.3
390K26.2Very low27.7Very low183 Ų183131.2 Ų131.280%0.79674%0.744SS**  trans-169.9126.4145.1-110.3159.7-173.4175.70114.3
391N25.6Very low27.7Very low135 Ų135131.3 Ų131.372%0.72274%0.744SS**  trans64.1137130.2-71.813.9000122.4
392V26.6Very low27.8Very low142 Ų142130.3 Ų130.386%0.86174%0.74SS**  trans69.1126.7138.1171.30000117.3
393G26Very low27.8Very low64 Ų64132.8 Ų132.866%0.6675%0.753SS**  trans167.493.8155.900000115.1
394E29.9Very low27.9Very low185 Ų185134.1 Ų134.186%0.86476%0.757SS**  trans39.1115131.4-55.4-171.9148.800119.8
395S27.6Very low28Very low107 Ų107134.9 Ų134.975%0.74876%0.76SS**  trans-75.1140.7155.152.30000111.2
396P32.7Very low28.1Very low119 Ų119137.2 Ų137.277%0.77376%0.763SS**  trans-115.4127.4132.7-4.424.6000109.3
397K26.8Very low28.1Very low165 Ų165141 Ų14172%0.71777%0.766SS**  82.3122.853.3-79.4-172.4175.6178.70114.2
398H28.8Very low28.1Very low165 Ų165142.6 Ų142.676%0.76477%0.766SS**  trans72.7157.9154.9-63.7-147.3000115
399L31Very low28.4Very low154 Ų154142.8 Ų142.881%0.80677%0.767SS**  cis-133.8171.79.3-16163.2000112.3
400S26Very low28.4Very low80 Ų80145.7 Ų145.756%0.55977%0.769SS**  trans-79.9161.9-176.654.50000115.1
401N32Very low28.6Very low139 Ų139143.5 Ų143.574%0.74377%0.766SS**  174.3119.8115.2-80.1-2.9000107.8
402D26.7Very low28.7Very low137 Ų137144 Ų14473%0.73377%0.767SS**  61.595.179.6-77.2-44000115.1
403T30.8Very low28.8Very low142 Ų142144.6 Ų144.687%0.87176%0.761SS**  178.7147.7109.228.40000113.6
404K27.6Very low29Very low199 Ų199149.4 Ų149.487%0.86576%0.764SS**  trans-96.2142155.5-67.9176.7177.6175.80108.4
405P28.7Very low28.9Very low112 Ų112147.9 Ų147.973%0.72776%0.76SS**  -140.6136.5120.415.17.4000112.5
406I26.2Very low28.9Very low147 Ų147146 Ų14675%0.75476%0.758SS**  98.6111.363.4-75.5165.5000113.9
407K28.3Very low28.7Very low191 Ų191146.3 Ų146.383%0.8375%0.749SS**  trans56.9146.4143.6-63.9179.3-177.2-176.80124.4
408Y27.7Very low28.7Very low213 Ų213144 Ų14484%0.83574%0.744SS**  trans-44.9161.9155.2-55.2-92.8000114.9
409P34.9Very low28.5Very low120 Ų120141 Ų14178%0.77974%0.741SS**  -115160.178.5-3.224.3000113.4
410E27.3Very low28.2Very low160 Ų160140.8 Ų140.875%0.74874%0.74SS**  cis91.4130.435-114.1-163.2151.900116.7
411L28.4Very low28.4Very low138 Ų138141.8 Ų141.872%0.72375%0.748SS**  trans84.8144.1145.3-75168.3000124.9
412L29.4Very low28.1Very low144 Ų144142.5 Ų142.575%0.75475%0.752SS**  trans8475.4151.2-70.6159.9000122.6
413Q27.6Very low28.3Very low156 Ų156143.3 Ų143.373%0.72975%0.754SS**  4.5119.2115.9-170.1-15668.400117.9
414K30.6Very low28.2Very low165 Ų165141.8 Ų141.872%0.71775%0.749SS**  173.9128.1117.1-95.9-179.7-175.9177.30115.7
415I26.9Very low28.3Very low152 Ų152135.1 Ų135.178%0.77974%0.737SS**  43.9125129.7-54.1170.5000120.3
416G28.8Very low28.7Very low69 Ų69136.2 Ų136.271%0.71174%0.744SS**  trans86.2162.7149.700000116.4
417E27.3Very low28.9Very low125 Ų125136 Ų13658%0.58475%0.745SS**  cis-166.4166.4-23.4-141.1178.2-117.100107.5
418N27.9Very low28.9Very low116 Ų116132.6 Ų132.662%0.6274%0.735SS**  trans60.8108156.8-56.3-34.1000121.8
419C24.7Very low28.9Very low101 Ų101128.3 Ų128.368%0.68273%0.733SS**  72.5132.9116.7-63.10000123.1
420N25Very low28.4Very low150 Ų150131.4 Ų131.480%0.80274%0.735SS**  trans52103.7133.3-55.7-13.8000119.4
421S28.8Very low28.4Very low102 Ų102131.1 Ų131.171%0.71374%0.737SS**  -170.2117.6108.843.80000115
422N26.4Very low28.4Very low154 Ų154128.7 Ų128.782%0.82473%0.731SS**  60.2-176.6129.6-56.2-26.5000120.8
423I30.2Very low28.4Very low154 Ų154129.2 Ų129.279%0.7973%0.73SS**  trans75.671.3164.9-44.5-172.2000115.9
424S29.7Very low28.5Very low109 Ų109125.5 Ų125.576%0.76272%0.721SS**  trans43116.1130.660.30000120.4
425G29Very low28.3Very low60 Ų60123.4 Ų123.462%0.61972%0.722SS**  trans-85.8178.1156.700000113.5
426P38.2Very low28.4Very low135 Ų135126.9 Ų126.988%0.87773%0.727SS**  trans-80.4142.1169.933.1-32.6000111.5
427N29.9Very low28.2Very low142 Ų142128.2 Ų128.276%0.75972%0.724SS**  trans-95.1144.4177.8-80.3-71.7000111.7
428L28.2Very low28.2Very low119 Ų119126.8 Ų126.862%0.62373%0.728SS**  trans57.3147.7142.5-84.961.3000119.1F430L428-F430 HydrophobicContact CD2-CB 4.01Å; L428-F430 HydrophobicContact CD2-CD2 3.68Å; L428-F430 HydrophobicContact CD2-CG 4.2Å; L428-F430 HydrophobicContact CG-CD2 3.95Å
429P27.5Very low28.1Very low124 Ų124132.7 Ų132.781%0.80574%0.742SS**  -116.6134.98733.4-33.8000114.2
430F25.3Very low28.2Very low185 Ų185133.6 Ų133.681%0.81174%0.744SS**  trans-91.6120158.6-114.5-115.2000108.1L428L428-F430 HydrophobicContact CD2-CB 4.01Å; L428-F430 HydrophobicContact CD2-CD2 3.68Å; L428-F430 HydrophobicContact CD2-CG 4.2Å; L428-F430 HydrophobicContact CG-CD2 3.95Å
431I27.2Very low28.3Very low154 Ų154135.2 Ų135.279%0.7975%0.747SS**  trans-146.7128.1163.1-60.7-176.5000106
432S28.8Very low28.2Very low87 Ų87135.3 Ų135.361%0.60875%0.747SS**  cis-157.7140.7-17.348.90000108
433H28Very low28.3Very low154 Ų154132.6 Ų132.671%0.71374%0.741SS**  -155.6142.997.5-110.3-87000112.5
434S29.9Very low28.2Very low79 Ų79130.3 Ų130.355%0.55274%0.738SS**  trans13.7119.7150.350.40000118
435T26.3Very low28.2Very low120 Ų120129.7 Ų129.774%0.73673%0.734SS**  cis51.8145.718.954.80000117.5
436Y29Very low28.2Very low226 Ų226132.2 Ų132.289%0.88674%0.741SS**  trans66.5155.1-177.1-76.8-106.7000116.8
437C25.7Very low27.7Very low97 Ų97129.8 Ų129.866%0.65573%0.727SS**  cis-170.5174.5-35.1-160.80000109
438S27.4Very low27.5Very low94 Ų94129.4 Ų129.466%0.65772%0.724SS**  trans34.9108.3154.1-65.50000119.4
439R24.8Very low27.4Very low240 Ų240133.2 Ų133.291%0.90673%0.73SS**  67.873.679.7-167.4-155.1-167.1-171.65.8115.2
440T27.5Very low27.4Very low120 Ų120133 Ų13374%0.73672%0.718SS**  trans-150130.614315.20000107.7
441Q25.9Very low27.5Very low185 Ų185131.1 Ų131.186%0.86471%0.712SS**  50.2122.5104.2-60.6-173.912.300113.6
442S27.3Very low27.4Very low103 Ų103130.7 Ų130.772%0.7271%0.71SS**  cis-151.9166.617.8560000113.3
443S28.3Very low27.3Very low98 Ų98130.5 Ų130.569%0.68571%0.714SS**  trans33.1134.1146.357.60000120.1
444S29.3Very low27.3Very low106 Ų106129.9 Ų129.974%0.74172%0.721SS**  cis174.1154.68.539.90000108
445S29.7Very low27.2Very low96 Ų96130.6 Ų130.667%0.67173%0.732SS**  cis179.2158.8-11.251.30000107.8
446C27.3Very low27.4Very low113 Ų113130.5 Ų130.576%0.76473%0.733SS**  trans67.3145.5153.5-71.70000116.8
447S28.3Very low27.3Very low84 Ų84124.7 Ų124.759%0.58773%0.726SS**  cis-155.7142.4-3.5-106.70000107.5
448I26Very low27.6Very low134 Ų134128.3 Ų128.369%0.68773%0.732SS**  53.1107.676.7-58.8173.3000107.3
449R26.7Very low27.8Very low199 Ų199129.1 Ų129.175%0.75174%0.736SS**  cis-171.517348.9-131.5162.7-170.3-133.915.1112.2
450Q27.7Very low27.9Very low120 Ų120125 Ų12556%0.56173%0.727SS**  trans26.7146.2133.8-74.6174.4-50.700120.8
451Q26.4Very low28Very low145 Ų145126 Ų12668%0.67873%0.727SS**  cis-173.5173.3-7.6-124.3169.9-24.500109
452L26Very low28.1Very low145 Ų145124.9 Ų124.976%0.75972%0.721SS**  trans55.1108.1152.6-92.669.1000120.5
453A25.7Very low28.3Very low83 Ų83126.1 Ų126.169%0.68672%0.724SS**  82.9163.5112.500000122.3
454T28.7Very low28.4Very low141 Ų141126.6 Ų126.687%0.86573%0.728SS**  trans63.9112168.745.60000119.1
455A27.6Very low28.2Very low93 Ų93128.4 Ų128.477%0.76973%0.728SS**  trans-78169.7156.900000110.8
456P30Very low28.2Very low118 Ų118129.6 Ų129.677%0.76673%0.733SS**  -150.2164.298.140.1-23.7000117.7
457S28Very low28.5Very low104 Ų104133 Ų13373%0.72774%0.738SS**  trans14.3132.3153.860.30000124.4
458H30.4Very low28.7Very low173 Ų173132.9 Ų132.980%0.80174%0.737SS**  12.2143.3125.3-92.7-64.2000120.9
459P31.6Very low29.1Very low112 Ų112132.1 Ų132.173%0.72774%0.741SS**  -141142.779.938.1-22.1000115.6
460Q28.1Very low29.3Very low154 Ų154131 Ų13172%0.7274%0.744SS**  68.4127.898-61-168.1-17.200118.6
461L28.2Very low29.3Very low141 Ų141129.9 Ų129.974%0.73875%0.749SS**  169117.4115.5-86.4167.4000108.6
462H28.9Very low29.4Very low160 Ų160129.2 Ų129.274%0.74175%0.749SS**  64.1133.396-80.2-147000113.9
463V30.4Very low29.6Very low129 Ų129132 Ų13278%0.78275%0.751SS**  cis-151.8175.811.2-109.10000108.8
464S30.5Very low29.5Very low109 Ų109132.8 Ų132.876%0.76275%0.751SS**  cis-153.5175.411.2-1470000112.4
465I26.2Very low29.5Very low144 Ų144132.2 Ų132.274%0.73875%0.747SS**  trans-145.2155176.9-62.5171.1000109.5
466P30.5Very low29.5Very low120 Ų120137 Ų13778%0.77975%0.751SS**  trans-131.9146.1144.437.6-26.8000113.4
467Q32.2Very low29.3Very low185 Ų185136.6 Ų136.686%0.86475%0.751SS**  cis-160.5157.8-28.8-134.81700.700108.2
468S32.1Very low29.2Very low81 Ų81137.8 Ų137.857%0.56676%0.758SS**  trans-96.3-179.8-179.360.90000112.2
469P34.9Very low29.1Very low119 Ų119134.9 Ų134.977%0.77376%0.757SS**  -135.7160.370.544.6-30.7000112.5
470Q31.1Very low29.3Very low174 Ų174134.9 Ų134.981%0.81376%0.757SS**  cis65151.835.5-62.7-166.2-3.400113.6
471S28.9Very low29.2Very low97 Ų97135 Ų13568%0.67876%0.763SS**  cis-131.1-174.4-5.458.70000107.6
472I28.6Very low29.3Very low131 Ų131138 Ų13867%0.67277%0.773SS**  cis-145.8-179.917.37.8173.2000107
473Y28.3Very low29.1Very low205 Ų205139.7 Ų139.780%0.80478%0.778SS**  cis-144.2-154.410.4-134.3-40.7000110.6
474S25.2Very low29Very low98 Ų98140.2 Ų140.269%0.68578%0.781SS**  trans-159.5159.3179.757.90000110.6
475V27.3Very low28.6Very low130 Ų130139.2 Ų139.279%0.78878%0.78SS**  trans-163.3122.6154.9133.50000110.8
476F27.7Very low28.7Very low194 Ų194138.4 Ų138.485%0.85178%0.781SS**  trans42.7118.8157.2-70.8-94.6000123.4
477S25.5Very low28.4Very low108 Ų108138 Ų13876%0.75578%0.781SS**  trans-86.8155.6149.352.20000111.9
478C27.1Very low28.3Very low129 Ų129133.7 Ų133.787%0.87277%0.771SS**  trans-158.1159.8149.4-119.10000112.1
479S27.7Very low28Very low112 Ų112136 Ų13678%0.78378%0.782SS**  trans-131-160.8179.4-54.10000109.8
480P35.7Very low27.8Very low112 Ų112135.8 Ų135.873%0.72778%0.779SS**  -117.6174.5-97.538.2-24.5000114.1
481N26Very low27.8Very low158 Ų158134.3 Ų134.385%0.84578%0.776SS**  trans40.8102.3155.1-75.5-24.5000118.7
482Q29.8Very low27.6Very low203 Ų203137.6 Ų137.695%0.94979%0.785SS**  trans-146.3154.2145.2-124.1175.345.800114.8
483K24.9Very low27.6Very low196 Ų196136.3 Ų136.385%0.85279%0.785SS**  trans-84.4141.3-173.3-47.1162.8-177.8174.50111
484V27.9Very low27.6Very low140 Ų140131.1 Ų131.185%0.84878%0.779SS**  trans-141.9143.1134.8-178.40000107.6V486V484-V486 HydrophobicContact CG1-CG2 4.42Å
485A22.5Very low27.7Very low88 Ų88130.9 Ų130.973%0.72778%0.777SS**  trans-116.4124.1174.800000110.8
486V29.2Very low27.9Very low126 Ų126131 Ų13176%0.76477%0.774SS**  trans-142.9112.8164.9-1760000104.4V484V484-V486 HydrophobicContact CG1-CG2 4.42Å
487S22.8Very low27.8Very low111 Ų111125.8 Ų125.878%0.77676%0.761SS**  cis72.663.140-56.40000115.5
488S30.7Very low27.9Very low95 Ų95125.4 Ų125.466%0.66476%0.755SS**  trans-150105.4145.655.60000107.1
489T25.9Very low27.8Very low129 Ų129124.1 Ų124.179%0.79175%0.747SS**  51.512585.466.10000111.7
490V30.9Very low27.7Very low116 Ų116122.9 Ų122.970%0.70374%0.744SS**  -155.814066.11560000111.4
491N30.2Very low27.3Very low143 Ų143123.2 Ų123.277%0.76574%0.744SS**  trans51.6121160.5-57.3-4.8000118.4
492L25.9Very low27.3Very low166 Ų166122.5 Ų122.587%0.86974%0.739SS**  cis55.1146.149-94.778.4000114.8
493P29.3Very low27.2Very low103 Ų103118.2 Ų118.267%0.66972%0.721SS**  cis-133.5172.710.143.2-26.9000116.9
494S27.6Very low27.5Very low96 Ų96117.9 Ų117.967%0.67172%0.72SS**  trans41.2117.4141.165.60000123.2
495S27.9Very low27.5Very low93 Ų93117.1 Ų117.165%0.6571%0.712SS**  78.5151.8117.882.50000123.1
496D29.7Very low27.9Very low133 Ų133116.2 Ų116.271%0.71171%0.711SS**  trans72.284.3150.7-49.1-34.2000122
497S25.7Very low27.8Very low85 Ų85116.6 Ų116.659%0.59471%0.708SS**  73.5173121.577.40000120.8
498T29.4Very low28.2Very low100 Ų100119.1 Ų119.161%0.61371%0.706SS**  trans61.492.1168.158.30000118.2
499S24.7Very low28.3Very low101 Ų101119 Ų11971%0.70670%0.702SS**  41.6135.1123.467.50000122.2
500A26.1Very low28.3Very low87 Ų87116.5 Ų116.572%0.71969%0.691SS**  117.3131.3129.300000118.9
501T26.8Very low28.2Very low119 Ų119120.7 Ų120.773%0.7369%0.694SS**  trans89.186.8140.9-51.70000120.5
502L26.3Very low28.1Very low142 Ų142118.1 Ų118.174%0.74369%0.685SS**  81.7128.8126-64.5-179.7000123.9
503I26.6Very low27.9Very low113 Ų113112.6 Ų112.658%0.57966%0.656SS**  trans72.3110.6136.7-63.6164.1000119.1
504F30.8Very low27.9Very low189 Ų189115.2 Ų115.283%0.82966%0.663SS**  -173.590.1115-92-68.3000107
505N29.5Very low27.7Very low125 Ų125115.7 Ų115.767%0.66867%0.666SS**  90.9110.389.7-77.412.4000114.7
506G29.7Very low27.8Very low69 Ų69116.9 Ų116.971%0.71167%0.674SS**  trans106.682.1164.300000114.1
507D28.3Very low27.7Very low133 Ų133116 Ų11671%0.71167%0.674SS**  cis65.714024.9-54.8-64.6000113.2
508F30.5Very low27.9Very low165 Ų165117.9 Ų117.972%0.72468%0.677SS**  cis-162.7167.69.4-151.5-127000110S510F508-S510 WeakPolarHBondContact CE2-OG 3.36Å; F508-S510 WeakPolarHBondContact CZ-OG 3.22Å
509P31.8Very low27.7Very low91 Ų91119.6 Ų119.659%0.59168%0.682SS**  cis-107.7169.4-24.837.6-26.9000112.5
510S26.4Very low27.8Very low78 Ų78119.4 Ų119.455%0.54568%0.681SS.*  cis95.808.390.70000120.5F508 P512F508-S510 WeakPolarHBondContact CE2-OG 3.36Å; F508-S510 WeakPolarHBondContact CZ-OG 3.22Å; S510-P512 WeakPolarHBondContact O-CD 3.34Å
511R28.9Very low27.8Very low204 Ų204123.5 Ų123.577%0.7768%0.683SS**  trans91.5-100.6-178.9-59.8169.8164.7173.2-3.5117.9
512P27.7Very low27.8Very low89 Ų89128.1 Ų128.158%0.57869%0.687SS**  -109.2174.1-10838.9-33.9000115S510S510-P512 WeakPolarHBondContact O-CD 3.34Å
513I23.3Very low27.9Very low50 Ų50125.7 Ų125.726%0.25668%0.682SS.*  trans-90.4114.5161-40178.6000109.1K1281 D1282 I1285I513-K1281 HydrophobicContact CD1-CB 3.41Å; I513-K1281 VanDerWaalsContact CD1-CB 3.41Å; I513-K1281 VanDerWaalsContact CD1-O 3.27Å; I513-K1281 WeakPolarHBondContact CD1-O 3.18Å; I513-K1281 HydrophobicContact CG1-CB 3.64Å; I513-K1281 HydrophobicContact CG1-CD 4.44Å; I513-D1282 HydrophobicContact CD1-CB 4.27Å; I513-I1285 HydrophobicContact CB-CD1 4.22Å; I513-I1285 HydrophobicContact CD1-CB 4.42Å; I513-I1285 HydrophobicContact CD1-CD1 3.58Å; I513-I1285 HydrophobicContact CD1-CG1 3.77Å; I513-I1285 HydrophobicContact CG1-CD1 4.09Å
514I27.5Very low28Very low158 Ų158129.2 Ų129.281%0.8170%0.696SS**  trans-143.1136.7148.3-60.6-172.9000106.7
515S24.3Very low28Very low106 Ų106125.7 Ų125.774%0.74169%0.692SS**  trans-86.5142.3-179.855.60000113.5
516S30.9Very low28Very low118 Ų118125 Ų12583%0.82570%0.697SS**  trans-164.1145.3131.857.10000111.9
517T26.9Very low28Very low114 Ų114129.1 Ų129.170%0.69970%0.701SS**  trans-63167.4165530000110.2
518D29.2Very low28.2Very low125 Ų125128.3 Ų128.367%0.66870%0.703SS**  cis-161.1148.845.3-109-65.4000115.3
519N26.1Very low28Very low135 Ų135125.6 Ų125.672%0.72270%0.704SS**  trans37.7128.3141.3-82.8-57.8000123.6
520S27.2Very low27.9Very low98 Ų98124.4 Ų124.469%0.68571%0.709SS**  108.9113.5122.872.70000121.8
521F25.3Very low27.9Very low173 Ų173126.5 Ų126.576%0.75972%0.724SS**  99.1111.2120.8-92.5-133.5000122.5
522W26.1Very low27.9Very low215 Ų215121.2 Ų121.281%0.81472%0.723SS**  trans65.9147.1139.3-69.156.4000118
523S28.1Very low28Very low92 Ų92123.1 Ų123.164%0.64373%0.733SS**  cis-163.3153.1-2.540.40000111.9
524H30.2Very low28.1Very low187 Ų187127.6 Ų127.687%0.86676%0.758SS**  trans-63148.9161.7-73.7-81.5000111.7
525P30.7Very low28.2Very low115 Ų115126.6 Ų126.675%0.74776%0.759SS**  -146.6176.410136.6-19.4000112.7
526S28.3Very low28.3Very low111 Ų111130 Ų13078%0.77676%0.763SS**  cis-164.9162-15.342.80000110.2
527I30.1Very low28Very low155 Ų155132.6 Ų132.680%0.79577%0.765SS**  trans-81.8153179.3-62155.9000112
528P32.3Very low27.9Very low115 Ų115133.9 Ų133.975%0.74777%0.766SS**  -129.3130.8129.535.4-26.8000111.4
529S26.1Very low27.8Very low108 Ų108133.6 Ų133.676%0.75577%0.769SS**  cis99.811226.876.80000114.2
530G29.4Very low27.9Very low67 Ų67133.6 Ų133.669%0.69177%0.769SS**  trans148.995.9173.900000110.9
531S27.3Very low27.7Very low122 Ų122139.3 Ų139.385%0.85378%0.776SS**  69.6122.584.870.20000113.7
532A28.2Very low27.7Very low92 Ų92138.1 Ų138.176%0.7677%0.772SS**  cis-152.9-152.7-2.900000107.9
533V29.6Very low27.7Very low130 Ų130136.1 Ų136.179%0.78877%0.772SS**  cis-153.1162.122.2178.30000109.6
534N25.5Very low27.5Very low143 Ų143137 Ų13777%0.76578%0.778SS**  trans-28.6149.8162.4-61-11000115.8
535T30.6Very low27.3Very low138 Ų138133.7 Ų133.785%0.84777%0.77SS**  -155.6147.158.5-56.80000114
536Q25.3Very low27.3Very low176 Ų176134.1 Ų134.182%0.82277%0.773SS**  trans-88150.1-179.6-57.7161.5-46.500112.3
537M24.6Very low27.2Very low173 Ų173139.1 Ų139.185%0.85278%0.777SS**  -172.6110.1123-99.5-179.9-176.800109.6
538I24.7Very low27.1Very low141 Ų141137.3 Ų137.372%0.72378%0.775SS**  63.597.7101.7-58.8173.3000114
539T28.2Very low26.7Very low119 Ų119135.7 Ų135.773%0.7377%0.771SS**  -166.4130.5114.7250000111.9
540N27.9Very low26.6Very low136 Ų136140.8 Ų140.873%0.72778%0.775SS**  trans51.9126.2150-46.5-6.6000119.6
541W24.2Very low26.4Very low218 Ų218142.5 Ų142.583%0.82677%0.772SS**  cis67.3130.948.1-65.243.3000112.8
542E24.3Very low26.5Very low147 Ų147141.4 Ų141.469%0.68776%0.762SS**  cis-158.2-174.21.2-131.2-178.9168.200113.1
543H25.8Very low26.4Very low174 Ų174144.3 Ų144.381%0.80677%0.765SS**  trans-76.7154.8-175-58.5-20.1000116.2
544S24.9Very low26.3Very low111 Ų111143.3 Ų143.378%0.77676%0.764SS**  trans-179.5132.8147.420.80000108
545V26.1Very low26.3Very low116 Ų116144.5 Ų144.570%0.70377%0.765SS**  cis64.6107.122.5-160.60000113.2Y547V545-Y547 WeakPolarHBondContact CG1-O 3.22Å
546P29.2Very low26.1Very low124 Ų124144.8 Ų144.881%0.80576%0.759SS**  -117.5163.911034.9-35000111.4
547Y26.7Very low26.1Very low217 Ų217142.7 Ų142.785%0.85176%0.759SS**  cis-12.6136.6-10.3-72.2-76.9000118.9V545V545-Y547 WeakPolarHBondContact CG1-O 3.22Å
548P28.3Very low26.2Very low117 Ų117137.5 Ų137.576%0.7675%0.75SS**  -146.3-176.768.342.1-25.4000116
549A23.2Very low26.2Very low81 Ų81140.5 Ų140.567%0.66976%0.758SS**  trans-82.7150.8156.300000110.2
550Y24.3Very low26.2Very low214 Ų214142.4 Ų142.484%0.83976%0.763SS**  trans-171.3127142.1-115.6-135.2000108.3
551V25.9Very low26.3Very low103 Ų103141.5 Ų141.562%0.62476%0.764SS**  82.6130.878.6164.80000112.7
552P28.8Very low26.5Very low100 Ų100139.3 Ų139.365%0.64976%0.763SS**  trans-83.6177.4-179.336.3-38.8000113.5
553N26.5Very low26.7Very low153 Ų153137.8 Ų137.882%0.81876%0.76SS**  trans76.9119.4168.4-52.9-25.1000116.9
554S27Very low26.7Very low109 Ų109137 Ų13776%0.76276%0.76SS**  -169.4138.898.2500000112.4
555Q26.8Very low26.9Very low168 Ų168137.4 Ų137.479%0.78576%0.763SS**  177.1136.5126.9-97.8171.841.900110.1
556I25.9Very low27Very low143 Ų143138.2 Ų138.273%0.73377%0.768SS**  trans62.6117.2152.2-59.7163.6000115.7
557T26Very low27Very low133 Ų133139 Ų13982%0.81677%0.771SS**  cis-166.7159.74.715.50000109.8
558G25.7Very low27Very low64 Ų64135.8 Ų135.866%0.6677%0.768SS**  trans100.995.313700000120.4
559F24.8Very low27Very low204 Ų204140 Ų14090%0.89577%0.774SS**  trans59.1140.6132.9-78.6-78.3000124.2
560L28.2Very low27.1Very low159 Ų159140 Ų14083%0.83278%0.775SS**  trans77.1115.1154.8-67.1161.9000119.7
561P29.6Very low27.1Very low116 Ų116134.7 Ų134.775%0.75378%0.775SS**  trans-101.5153.6161.537.8-30.3000112.3
562E29.2Very low27.1Very low173 Ų173137.4 Ų137.481%0.80878%0.784SS**  trans-165.3152.3153.6-118.5178.3-130.200114.9
563N29.1Very low26.8Very low115 Ų115143.2 Ų143.262%0.61580%0.795SS**  trans6187.1151.3-54.7-28.8000122.9
564I25.6Very low26.8Very low158 Ų158142.9 Ų142.981%0.8180%0.798SS**  33.4122.3106-55.9166.1000118.3
565S28.5Very low26.7Very low119 Ų119145.5 Ų145.583%0.83280%0.795SS**  -165.8160.1125.447.30000112.5
566V27.7Very low26.8Very low132 Ų132144 Ų14480%0.879%0.793SS**  trans-141.3134.5-171.5172.40000110.1
567T30.4Very low26.7Very low142 Ų142140.2 Ų140.287%0.87179%0.789SS**  trans-156.9120.8154.141.70000112.9
568D26.6Very low26.8Very low148 Ų148142.4 Ų142.479%0.79180%0.796SS**  trans-77.7147.9155.4-89.1-52.5000111.5
569K27.6Very low26.7Very low205 Ų205144.5 Ų144.589%0.89180%0.8SS**  trans152.9160.4146.2-86.3153.5-169.8169.80111.5
570A24.7Very low26.8Very low82 Ų82140.9 Ų140.968%0.67880%0.796SS**  cis177.6132.5-32.800000108.2
571A24.4Very low26.7Very low102 Ų102135.7 Ų135.784%0.84378%0.776SS**  trans60.5179.6173.800000113.9
572I25.7Very low26.5Very low160 Ų160137.6 Ų137.682%0.82178%0.778SS**  cis-137.9154.19.9-49.6167.2000109.2
573Y23.5Very low26.4Very low222 Ų222135.3 Ų135.387%0.87177%0.767SS**  trans-56.9149.1164-85.4-107.1000112.4
574V26.9Very low26.5Very low146 Ų146134.9 Ų134.989%0.88577%0.771SS**  trans-159.8166.5135128.40000109.7
575K24Very low26.5Very low164 Ų164133.8 Ų133.871%0.71377%0.771SS**  trans-125.4172.4-170.4-159.4-165.8168.3-139.70109.4
576D28.4Very low26.3Very low137 Ų137136.3 Ų136.373%0.73377%0.774SS**  trans70.7149.7172-38.4-43000113.3
577G24.7Very low26.3Very low64 Ų64133 Ų13366%0.6677%0.767SS**  cis138.696.3-700000112.6
578N26.7Very low26Very low178 Ų178132.4 Ų132.495%0.95277%0.768SS**  trans177.6159.2147.5-93.1-28000111.6
579S24.4Very low26Very low108 Ų108128.7 Ų128.776%0.75577%0.765SS**  trans-97.3154.1179.857.30000113.3
580T27.7Very low25.9Very low129 Ų129126.8 Ų126.879%0.79176%0.764SS**  trans-153.412414031.10000109.7V244V244-T580 VanDerWaalsContact CG1-O 3.24Å; V244-T580 WeakPolarHBondContact CG1-O 3.45Å
581A24.6Very low25.9Very low50 Ų50129.7 Ų129.741%0.41377%0.773SS.*  trans-89.3150168.400000111.6V244V244-A581 HydrophobicContact CB-CB 3.99Å; V244-A581 HydrophobicContact CG2-CB 4.05Å
582I26.4Very low25.9Very low155 Ų155128.5 Ų128.580%0.79577%0.771SS**  trans-152142152.3-100.4146000108.2V244V244-I582 WeakPolarHBondContact CG2-O 3.38Å
583Q26.3Very low25.9Very low126 Ų126126.1 Ų126.159%0.58977%0.768SS**  trans-90.3167.8-162.3-96-167.8-20.600115.4E242E242-Q583 PolarHBondContact OE1-NE2 3.21Å; E242-Q583 PolarHBondContact OE2-NE2 2.94Å
584P31.2Very low25.9Very low106 Ų106125 Ų12569%0.68877%0.769SS**  trans-88.3169.3-177.337-37.6000114.7
585V26.2Very low25.8Very low134 Ų134124.4 Ų124.481%0.81276%0.756SS**  trans-131.9112.1168.4178.10000106.5
586L25.2Very low26Very low172 Ų172127.9 Ų127.990%0.90177%0.766SS**  68.512979.9-96.5164.7000114.7
587G25.9Very low25.8Very low64 Ų64127.5 Ų127.566%0.6676%0.764SS**  trans107.491.7175.700000112.9
588S25.5Very low25.9Very low128 Ų128128.9 Ų128.990%0.89576%0.759SS**  79.9114.360.678.70000114.7
589G25.2Very low26.1Very low70 Ų70126.8 Ų126.872%0.72276%0.755SS**  trans138.6129.2154.500000117.5
590L25.5Very low26.3Very low165 Ų165126.6 Ų126.686%0.86475%0.75SS**  trans71.1113.8145.9-56.6173000121.1
591V24.7Very low26.4Very low143 Ų143127.1 Ų127.187%0.86775%0.753SS**  43.9107.7125.9-171.50000118.1
592G25.8Very low26.5Very low78 Ų78130.8 Ų130.880%0.80477%0.77SS**  trans-174.3115.5164.900000113.7
593S24.1Very low26.5Very low110 Ų110131.3 Ų131.377%0.76977%0.774SS**  trans-66.6148.3174.5-43.80000112.6
594F24.7Very low26.7Very low199 Ų199130.2 Ų130.287%0.87378%0.78SS**  -174.4167.1111.7-108.9-75.4000112.6
595Q24.4Very low26.8Very low133 Ų133133.2 Ų133.262%0.62178%0.782SS**  trans-122.2150-173.9-56.1154.5-79.100111.1L597Q595-L597 HydrophobicContact CB-CD1 4.08Å; Q595-L597 HydrophobicContact CB-CG 4.33Å
596Y27.4Very low27.1Very low236 Ų236132.8 Ų132.893%0.92578%0.782SS**  trans-153.4101.3143.5-90.1-73.2000105.8
597L24.9Very low27.2Very low130 Ų130129.9 Ų129.968%0.68177%0.767SS**  cis75.4134.747.9-82.3169.1000116.1Q595Q595-L597 HydrophobicContact CB-CD1 4.08Å; Q595-L597 HydrophobicContact CB-CG 4.33Å
598T26.6Very low27.4Very low93 Ų93137.3 Ų137.357%0.57178%0.777SS**  trans-94.6163.2-170.945.40000113.2T600T598-T600 PolarHBondContact OG1-OG1 3.38Å
599P30.9Very low27.5Very low133 Ų133136.2 Ų136.286%0.86477%0.765SS**  trans-78.7111154.631.8-29.3000110.2
600T29.3Very low27.5Very low105 Ų105139.9 Ų139.964%0.64477%0.766SS**  trans-148.3108.1175.9410000112.3T598T598-T600 PolarHBondContact OG1-OG1 3.38Å
601T29.8Very low27.6Very low140 Ų140140 Ų14086%0.85977%0.767SS**  trans-154.4131.2159.129.30000107.4
602V27.1Very low27.6Very low126 Ų126139.6 Ų139.676%0.76476%0.76SS**  cis98.8114.125.31740000113.4
603L26.1Very low27.7Very low167 Ų167142.4 Ų142.487%0.87476%0.757SS**  trans168.2142.7147.1-89.6157.4000107.2
604S29.6Very low27.8Very low103 Ų103143.6 Ų143.672%0.7275%0.75SS**  cis-153.5154-3.151.30000111.2
605K33.8Very low27.8Very low168 Ų168141 Ų14173%0.7374%0.744SS**  trans-80.6178169.2-68.4-172.2177.6-176.30112.2N607K605-N607 VanDerWaalsContact CD-OD1 3.23Å; K605-N607 WeakPolarHBondContact CD-OD1 3.19Å
606P33.2Very low27.8Very low126 Ų126139.4 Ų139.482%0.81874%0.744SS**  -117.2160.5109.934.3-34.9000114.3
607N26.9Very low27.6Very low110 Ų110136.2 Ų136.259%0.58874%0.736SS**  trans-102.3178.1175.5-52.2-66.5000110.1K605K605-N607 VanDerWaalsContact CD-OD1 3.23Å; K605-N607 WeakPolarHBondContact CD-OD1 3.19Å
608Y30.9Very low27.6Very low221 Ų221136.2 Ų136.287%0.86774%0.736SS**  -162127.3116.2-99.6-67.5000112.7
609T26.7Very low27.6Very low104 Ų104140.5 Ų140.564%0.63875%0.749SS**  trans7.1132.1151.452.80000120.1
610I25.1Very low27.7Very low147 Ų147138.5 Ų138.575%0.75474%0.736SS**  66.4113.653.8-57.1170000114.2
611L27.4Very low27.5Very low167 Ų167141 Ų14187%0.87474%0.741SS**  trans-151.8151.2131.1-141.880.9000109.9
612N24.6Very low27.2Very low135 Ų135141.8 Ų141.872%0.72274%0.735SS**  trans-92.3163.1174.6-55-37.5000110.2
613D28.5Very low27Very low137 Ų137141.3 Ų141.373%0.73373%0.732SS**  -170144.7115-114-25.9000117.5
614Q26.5Very low26.8Very low135 Ų135141 Ų14163%0.63173%0.73SS**  trans57.2112.2151.7-54.2-52.3-54.700124.3
615L24.4Very low26.6Very low144 Ų144143.7 Ų143.775%0.75474%0.735SS**  trans68.5167.8135.8-53.9174.7000118.6
616T23.5Very low26.3Very low101 Ų101144 Ų14462%0.6274%0.739SS**  cis-170.9166.6-25.9340000107.9
617F23Very low26.3Very low169 Ų169142.7 Ų142.774%0.74173%0.731SS**  cis-163.5162.7-2.3-115.8-39.1000111.2
618N25.4Very low26.3Very low129 Ų129146.9 Ų146.969%0.6974%0.744SS**  trans52.6112.7146.3-58.1-17000124.6
619H27.2Very low26.1Very low184 Ų184143.4 Ų143.485%0.85274%0.74SS**  -0.4171.8116.4-95.5-29000121.5
620P33.2Very low26.4Very low90 Ų90143.3 Ų143.358%0.58474%0.741SS**  cis-143.5-176.8-17.439.1-19000116.6
621Q24.3Very low26.4Very low159 Ų159144.3 Ų144.374%0.74374%0.742SS**  trans57.6138.8141.4-82.2172.6-63.200126.1
622E23.3Very low26.1Very low156 Ų156144.6 Ų144.673%0.72974%0.741SS**  trans85152.6137.4-82.8-175.8-154.200125.9
623T24Very low26.1Very low116 Ų116142.5 Ų142.571%0.71274%0.737SS**  trans72.3109.5161.745.30000123.2
624L21.5Very low26Very low160 Ų160143.4 Ų143.484%0.83874%0.742SS**  46.4143.5114.8-89.7161.5000122.4
625I25.3Very low26.4Very low160 Ų160142.2 Ų142.282%0.82175%0.746SS**  trans128.3110.9151.3-68.3163.9000115.4
626Q28.5Very low26.4Very low175 Ų175143.5 Ų143.582%0.81875%0.752SS**  trans-74.9166.3152.2-71.7-173.7-1300109.3
627P32.9Very low26.4Very low98 Ų98147.7 Ų147.764%0.63676%0.761SS**  cis-156.1-162.937.9265.1000117.4
628F25.5Very low26.6Very low197 Ų197146.5 Ų146.586%0.86477%0.768SS**  trans99.4126.6149-78.1-63.2000123.8
629L28.6Very low26.6Very low149 Ų149146 Ų14678%0.7877%0.77SS**  trans-68.9177.6153.7-79.2105.7000111.2
630P31.8Very low26.7Very low102 Ų102145 Ų14566%0.66277%0.766SS**  cis-148.6174.424.544.3-23.5000120
631Q24.3Very low26.3Very low167 Ų167146.7 Ų146.778%0.7877%0.77SS**  trans25.6133.1138-58.4166.6-3.400122.1
632M22.9Very low26.3Very low173 Ų173146.1 Ų146.185%0.85277%0.771SS**  176.2117.7120.5-95.5-177.5177.500109.3
633S24.5Very low26.4Very low91 Ų91149.4 Ų149.464%0.63678%0.777SS**  56.5132.989.871.50000114.8
634D25.7Very low26.6Very low157 Ų157149.8 Ų149.884%0.8477%0.773SS**  cis-161170.22.4-115.4-23.9000110.5
635P34.8Very low27Very low109 Ų109147.9 Ų147.971%0.70877%0.77SS**  trans-89.7159.1-171.136.1-36.7000114.4
636I24.4Very low27.1Very low171 Ų171147.1 Ų147.188%0.87776%0.761SS**  trans-144144.6160-104.1146.6000112.6
637K23.7Very low27.1Very low189 Ų189144.7 Ų144.782%0.82276%0.762SS**  trans-78.7149.6-177.5-40.9119.2177.7178.20111.4
638T27.3Very low26.8Very low145 Ų145147.8 Ų147.889%0.8977%0.768SS**  -148.3145.4128.4-1.80000112.4
639T25.6Very low27Very low117 Ų117141.2 Ų141.272%0.71876%0.756SS**  trans-98.6-172.7178.550.10000111.2
640Q28.5Very low27.1Very low165 Ų165139.1 Ų139.177%0.77175%0.75SS**  trans93.4142.8165.3-50.3-161.629.400115.9
641N25.7Very low26.9Very low125 Ų125141.9 Ų141.967%0.66875%0.754SS**  cis-173.2-178.8-20.3-103.1-32.6000107
642L24.7Very low27Very low146 Ų146141.9 Ų141.976%0.76475%0.747SS**  trans77.8140.6163.4-52.6167.8000116.7
643R24.7Very low27.3Very low226 Ų226140 Ų14085%0.85375%0.746SS**  cis-159.9149-30.5-136179.7-162.71653.4109.8
644I28.9Very low27.3Very low124 Ų124142.1 Ų142.164%0.63675%0.749SS**  trans-79.6157.7171.8-20.1179.6000110.1F646I644-F646 HydrophobicContact CB-CD2 4.17Å; I644-F646 HydrophobicContact CD1-CD2 4.11Å; I644-F646 HydrophobicContact CD1-CE2 3.91Å; I644-F646 HydrophobicContact CG2-CD2 4.37Å
645P29.3Very low27.5Very low120 Ų120141.6 Ų141.678%0.77975%0.752SS**  -133.8139.397.437.5-28.3000113.1
646F26.5Very low27.2Very low143 Ų143142 Ų14263%0.62776%0.755SS**  cis84.8105.448.1-101-59.8000116.2I644 Q648I644-F646 HydrophobicContact CB-CD2 4.17Å; I644-F646 HydrophobicContact CD1-CD2 4.11Å; I644-F646 HydrophobicContact CD1-CE2 3.91Å; I644-F646 HydrophobicContact CG2-CD2 4.37Å; F646-Q648 HydrophobicContact CD1-CG 3.89Å; F646-Q648 HydrophobicContact CE1-CG 4.23Å
647C29.1Very low27.4Very low124 Ų124137 Ų13784%0.83875%0.745SS**  trans-151.2113.4131.4-82.60000104.7
648Q27.4Very low27.4Very low164 Ų164135.9 Ų135.977%0.76675%0.747SS**  57.6125.868.2-59.7-168.3-0.600112.8F646F646-Q648 HydrophobicContact CD1-CG 3.89Å; F646-Q648 HydrophobicContact CE1-CG 4.23Å
649G27.9Very low27.4Very low59 Ų59134.1 Ų134.161%0.60874%0.74SS**  cis-161.6152-6.600000108.7
650T30.7Very low27.3Very low105 Ų105135.9 Ų135.964%0.64474%0.744SS**  58.7139.161.471.50000112.5Y652T650-Y652 HydrophobicContact CG2-CE2 3.87Å
651Q27.9Very low27.3Very low160 Ų160133.1 Ų133.175%0.74874%0.74SS**  -152.7138.954.4-67.9-145.2-8.700111.4
652Y27.9Very low27.2Very low166 Ų166134.4 Ų134.465%0.65175%0.745SS**  69.9146.982.7-58.4-55.5000114.2T650 L654T650-Y652 HydrophobicContact CG2-CE2 3.87Å; Y652-L654 HydrophobicContact CD1-CD1 4.24Å
653T28.5Very low27.6Very low134 Ų134133.9 Ų133.982%0.82274%0.743SS**  -147.3149.850.636.30000116.8
654L24.7Very low28Very low135 Ų135128.2 Ų128.271%0.70774%0.736SS**  trans-97.3160.9163.3-55.988.2000109.6Y652Y652-L654 HydrophobicContact CD1-CD1 4.24Å
655T29.2Very low28Very low146 Ų146129.7 Ų129.790%0.89674%0.74SS**  trans-141.796.6157.131.30000111.7
656P29.6Very low28.1Very low119 Ų119131.7 Ų131.777%0.77374%0.738SS**  trans-87142.3159.233.9-29.9000110.4
657G27.4Very low28.1Very low65 Ų65129.9 Ų129.967%0.6774%0.743SS**  trans-176.191.7-179.500000118.8
658I25Very low27.9Very low166 Ų166134.2 Ų134.285%0.85175%0.749SS**  trans68.1149.5131.3-57.6157.2000119.6
659S26Very low28Very low107 Ų107130.3 Ų130.375%0.74875%0.752SS**  trans71.398.516342.50000122
660I24.7Very low27.8Very low155 Ų155138.1 Ų138.180%0.79576%0.763SS**  2138.1120.3-68.6165.4000115.6
661P27.2Very low27.6Very low107 Ų107139.3 Ų139.370%0.69577%0.765SS**  cis-143.6153.341.6250.5000121.2
662I25.1Very low27.5Very low152 Ų152138.9 Ų138.978%0.77976%0.763SS**  50.2110128.4-51.2171.6000121.2
663N31.5Very low27.6Very low134 Ų134137.8 Ų137.872%0.71777%0.765SS**  45.2151.6121.7-118.723000122.2
664P33.2Very low27.6Very low108 Ų108137.4 Ų137.470%0.70176%0.758SS**  -123.7-17264.929.2-10.1000112.4
665E30.2Very low27.9Very low154 Ų154136.3 Ų136.372%0.7276%0.757SS**  cis-149.5-167.326.1-43.6171.7137.400110.1
666H30.2Very low28.1Very low162 Ų162135.5 Ų135.575%0.7574%0.743SS**  cis-158.6102.8-6.8-146.7-48.5000110.1
667S26.2Very low28Very low105 Ų105137.7 Ų137.773%0.73474%0.736SS**  trans-171114.1164.353.80000116.3
668F25.7Very low28.3Very low216 Ų216143.2 Ų143.295%0.94774%0.738SS**  trans53.9108.9151.5-73.2-83.9000123.6
669G28.8Very low28.4Very low81 Ų81140 Ų14084%0.83573%0.73SS**  trans89.7155.7146.500000117.6
670R24.2Very low28.5Very low224 Ų224138.9 Ų138.985%0.84572%0.722SS**  cis-167.4145.1-19.6-165.7-163.2172.9-178.4-1.8107.7
671L25.9Very low28.6Very low129 Ų129140 Ų14068%0.67572%0.724SS**  trans68.3150.3173.5-62.6143.4000115.5
672E26.4Very low28.8Very low152 Ų152140 Ų14071%0.7173%0.727SS**  cis-162.5172.8-28.5-153.7167.6-12000110.5
673M30.5Very low28.8Very low142 Ų142137.4 Ų137.470%0.772%0.722SS**  trans74.6108.4161.6-64.2-124.9177.900121.7
674N28.8Very low28.8Very low127 Ų127139.8 Ų139.868%0.67973%0.726SS**  52.4139.2110.7-56.8-25.5000120.6
675T31.1Very low28.7Very low111 Ų111140.3 Ų140.368%0.68173%0.728SS**  cis-175.1-178.81.623.10000107.8
676H33.3Very low28.6Very low129 Ų129140.2 Ų140.260%0.59773%0.732SS**  cis-164.9142.33.8-128.5-5.8000112
677R27.5Very low28.9Very low166 Ų166137.7 Ų137.763%0.62673%0.73SS**  trans63170.2151.8-49.6172.2-166.5174.84.9117.4
678Y32.3Very low28.8Very low181 Ų181136.1 Ų136.171%0.7172%0.723SS**  cis-123.7141.3-0.6-92.3-95.1000107.9
679S27.8Very low28.8Very low98 Ų98132.9 Ų132.969%0.68572%0.715SS**  65.5144.778.2-48.60000114.3
680S27Very low28.7Very low84 Ų84134.8 Ų134.859%0.58771%0.711SS**  cis-169.3174.3-639.10000110.6
681E27.8Very low28.8Very low177 Ų177128.5 Ų128.583%0.82770%0.701SS**  trans69.3155.3148.9-78.5146.1157.200119.1
682S30.6Very low28.9Very low109 Ų109133.1 Ų133.176%0.76271%0.71SS**  cis-144.5163.8-342.40000112.9
683S26.9Very low28.9Very low97 Ų97130.4 Ų130.468%0.67871%0.707SS**  trans-58.9160171.8610000114.5
684K31.4Very low28.7Very low184 Ų184128.2 Ų128.280%0.871%0.706SS**  -167.1126.8117-107.5154.4-170.6169.70115.8
685T31.3Very low28.8Very low119 Ų119127 Ų12773%0.7371%0.708SS**  37.8144.6129.757.30000120.6
686N26.8Very low28.8Very low151 Ų151126.4 Ų126.481%0.80771%0.708SS**  cis-171.7-163.5-14.1-138.5-9000103.3
687P35.7Very low28.7Very low109 Ų109129.4 Ų129.471%0.70871%0.714SS**  trans-114.7-162.2-15035.5-14.1000112.2
688A26Very low29Very low72 Ų72127.2 Ų127.260%0.59572%0.722SS**  140.6155.1111.800000113.9
689L25.8Very low28.8Very low148 Ų148125 Ų12578%0.77572%0.716SS**  trans65.4121148.4-70.1160000119.3
690T26.1Very low29Very low121 Ų121126.8 Ų126.874%0.74272%0.717SS**  trans64.4133.3133.258.50000119.4
691S27.1Very low29.2Very low93 Ų93126 Ų12665%0.6571%0.712SS**  cis-170-154.85.648.70000110.3
692R26Very low29.4Very low225 Ų225123.4 Ų123.485%0.84971%0.71SS**  trans13.1133.7136.6-66.2170.5175.4-177.6-2.3116.3
693S26.4Very low29.3Very low95 Ų95123.5 Ų123.566%0.66471%0.706SS**  cis-174.7-156.85.1430000108.1
694S28.3Very low29.3Very low97 Ų97128.1 Ų128.168%0.67871%0.709SS**  trans47.3123.3139.653.70000119.2
695S29.2Very low29.1Very low101 Ų101128 Ų12871%0.70670%0.704SS**  cis-174.5-17813.546.50000111.4
696S32.1Very low29Very low98 Ų98128.7 Ų128.769%0.68570%0.702SS**  trans60.4109.4152.636.10000116.9
697R29.9Very low29.2Very low192 Ų192126.7 Ų126.773%0.72570%0.7SS**  cis48.6128.948.7-56.3-178.8164.9-170.8-3.9112F699R697-F699 HydrophobicContact CB-CD2 4.12Å; R697-F699 HydrophobicContact CB-CE2 4.42Å
698P34.4Very low28.9Very low121 Ų121124.9 Ų124.979%0.78670%0.695SS**  -89.1159.452.2-20.738.3000114.8
699F28.2Very low29.2Very low134 Ų134126.5 Ų126.559%0.58870%0.699SS**  cis65.314341.2-68.1-63.9000112.6R697R697-F699 HydrophobicContact CB-CD2 4.12Å; R697-F699 HydrophobicContact CB-CE2 4.42Å
700N31.7Very low29.2Very low135 Ų135128 Ų12872%0.72270%0.7SS**  cis-148153.315.6-106.7-28.9000108.3
701S32.1Very low29.3Very low69 Ų69130.6 Ų130.648%0.48370%0.703SS.*  cis58.2112.522.373.10000115.7
702P30.8Very low29.3Very low121 Ų121130.6 Ų130.679%0.78670%0.703SS**  -140.1151.98724.2-3.1000114.1
703V28.4Very low29.3Very low111 Ų111125.3 Ų125.367%0.67370%0.697SS**  cis91.1140.836.7166.40000113.8
704R28.5Very low29.3Very low194 Ų194130.3 Ų130.373%0.73270%0.702SS**  trans87.2146.4170.5-73.9147.2-161.6-134.78.2118.1
705R27.4Very low29.3Very low183 Ų183131.7 Ų131.769%0.69170%0.698SS**  cis-171.5156.8-24.4-119.4-173.8-157159.40111.2
706N28Very low29.2Very low132 Ų132133.1 Ų133.171%0.70670%0.698SS**  trans67.8152.1148.9-62.43.4000121.4
707S31.5Very low28.8Very low109 Ų109132.9 Ų132.976%0.76270%0.695SS**  trans57.7125.3157.132.70000118.5
708A28.8Very low28.7Very low72 Ų72129.8 Ų129.860%0.59569%0.69SS**  cis71.5145.829.100000114.9
709P33.6Very low28.2Very low106 Ų106129.5 Ų129.569%0.68868%0.682SS**  cis-142.4-171-27.840.2-22.1000114.6
710F25.5Very low28.1Very low180 Ų180131.4 Ų131.479%0.78969%0.691SS**  trans69.6140.9153.8-95.4-84.5000121
711Q27.6Very low27.8Very low174 Ų174128.7 Ų128.781%0.81368%0.682SS**  trans65.1149.9158.3-82.5156.3300117
712S28.1Very low27.4Very low93 Ų93132.5 Ų132.565%0.6569%0.692SS**  cis-158.9137.2-3.547.30000112
713T26Very low27.1Very low115 Ų115133.1 Ų133.171%0.70669%0.694SS**  59.3122125.9-48.40000120.1
714Y26.4Very low27.1Very low199 Ų199132.8 Ų132.878%0.7870%0.702SS**  trans71.7155.5151.4-84.2-143.1000117.3
715Q27.1Very low27Very low126 Ų126127.5 Ų127.559%0.58970%0.701SS**  cis-164.2160.7-25-141.9-175.7-1.300107.1
716N26.3Very low27.1Very low132 Ų132126.4 Ų126.471%0.70670%0.703SS**  trans63.4167.1153.2-65.8-19.9000118
717C25.2Very low27Very low92 Ų92127.8 Ų127.862%0.62271%0.705SS**  cis-170.4174-41.5-164.70000105.6
718M26.3Very low26.9Very low127 Ų127126.8 Ų126.863%0.62670%0.698SS**  trans65.8166.6162.8-58.2-60.9175.300116.6
719N24.6Very low26.8Very low116 Ų116131.9 Ų131.962%0.6271%0.71SS**  -170.2164.7-55.9-127-20.2000107.3
720F25.7Very low26.2Very low174 Ų174132.9 Ų132.976%0.76372%0.718SS**  trans63.9166.4154.8-79.2-139.9000116.9
721S25.5Very low26.3Very low77 Ų77129.1 Ų129.154%0.53871%0.714SS.*  cis-157.8160.6-39.161.80000110.4
722E24.5Very low26.2Very low150 Ų150128.2 Ų128.270%0.70171%0.713SS**  trans61.1138.7133.9-79.1168.6134.800124.7
723T25.3Very low26.1Very low134 Ų134130 Ų13082%0.82272%0.719SS**  trans85.4151.9139.657.40000121
724A26.7Very low26Very low103 Ų103130.8 Ų130.885%0.85172%0.724SS**  trans63.1122.9-174.300000115.7
725A27.9Very low26Very low84 Ų84125.9 Ų125.969%0.69472%0.719SS**  cis-161.4170.3-6.300000110.8
726H28.2Very low25.9Very low160 Ų160127.7 Ų127.774%0.74173%0.727SS**  trans14.5135.7136.1-67.6-108.9000118.4
727Q26.7Very low26Very low160 Ų160128.6 Ų128.675%0.74873%0.731SS**  cis-170.9-172.2-0.1-134166.9-26.600109.5
728S28.2Very low25.9Very low89 Ų89129 Ų12962%0.62274%0.735SS**  trans53.997.3152.260.90000119.9
729E26.8Very low26Very low179 Ų179129.2 Ų129.284%0.83674%0.744SS**  77130.8117.4-72160.1-151.400123.1
730C22.8Very low26.1Very low126 Ų126130.5 Ų130.585%0.85174%0.744SS**  trans58.197.7140.6-64.10000120.8
731S27.1Very low26.3Very low102 Ų102131.7 Ų131.771%0.71375%0.749SS**  trans-154.6115.5132.4-1670000113.9
732I24.8Very low26.3Very low155 Ų155133.6 Ų133.680%0.79575%0.752SS**  trans36.8152.1131.3-34.9171.2000120.4
733V27.1Very low26.6Very low129 Ų129131.8 Ų131.878%0.78275%0.752SS**  trans112.2102.1152-171.70000116
734V23Very low26.7Very low132 Ų132130.8 Ų130.880%0.875%0.746SS**  trans-55.7127.9161.8174.10000112.1
735S26.6Very low27Very low97 Ų97131.2 Ų131.268%0.67874%0.74SS**  trans-170.4107.8143.2-87.30000111.3
736Q24.7Very low27.1Very low163 Ų163133.4 Ų133.476%0.76274%0.744SS**  92.915992.1-79.1-155.617.400113.7
737L27.7Very low27Very low151 Ų151132.9 Ų132.979%0.79175%0.746SS**  trans62.2114.4-176.8-74.167000114.3
738S23.3Very low26.8Very low100 Ų100129.6 Ų129.670%0.69974%0.74SS**  cis71.681.939.8-160.60000115.3
739T30.1Very low26.6Very low132 Ų132130.3 Ų130.381%0.8174%0.743SS**  trans-160.2121.9143.825.60000107.4
740K25.7Very low26.5Very low144 Ų144129.5 Ų129.563%0.62674%0.743SS**  60.78961.1-68.5-177.5177.8168.20114.8
741K28.9Very low26.6Very low198 Ų198128.3 Ų128.386%0.86174%0.736SS**  trans-155.8131.7156.4-100.2162-175.7-177.40105.9
742L26.3Very low26.7Very low118 Ų118129.3 Ų129.362%0.61874%0.743SS**  cis61.5114.127.6-145.377.7000109.8
743T30.8Very low26.9Very low111 Ų111128.8 Ų128.868%0.68174%0.742SS**  -154.2153.259.540.30000109.4
744T27.2Very low27.1Very low114 Ų114127.2 Ų127.270%0.69974%0.737SS**  38.5139.979.457.10000113.9
745P33.1Very low27.4Very low112 Ų112127.1 Ų127.173%0.72773%0.732SS**  -156-172.452.242.2-19.6000118.2
746V29.7Very low27.6Very low129 Ų129128.8 Ų128.878%0.78273%0.733SS**  trans66150140.4154.60000120.9
747L25.9Very low27.7Very low149 Ų149128.4 Ų128.478%0.7874%0.735SS**  cis-165.7147.4-43.5-144.978.9000110.4
748C23.3Very low27.9Very low92 Ų92127 Ų12762%0.62274%0.735SS**  trans31.2114.2144.8-158.30000122.4
749C23.2Very low27.9Very low103 Ų103129.8 Ų129.870%0.69674%0.74SS**  83.8168.7116.2-48.20000121.7
750I25.5Very low27.7Very low162 Ų162131.4 Ų131.483%0.83174%0.742SS**  trans74.790174.8-46.5176.4000112.5
751S25.8Very low27.6Very low101 Ų101129.1 Ų129.171%0.70674%0.744SS**  81.9110.354.3-168.30000114.5
752S28.7Very low27.4Very low124 Ų124127.7 Ų127.787%0.86774%0.741SS**  trans-170.995.5161.6-78.70000106.8
753N27.6Very low27.4Very low143 Ų143130.3 Ų130.377%0.76575%0.75SS**  cis102.6147.840.9-16825000111.5
754S32.7Very low27.3Very low96 Ų96130.4 Ų130.467%0.67176%0.755SS**  trans77.8145.9179.881.10000118.8
755N29.4Very low27.5Very low130 Ų130130.1 Ų130.170%0.69576%0.755SS**  cis-167.5147.9-26.4-102.8-19.9000111.7
756N29.8Very low27.1Very low132 Ų132131.1 Ų131.171%0.70675%0.754SS**  trans59.3126.2156.3-51.1-23.5000119.3
757I28.1Very low26.9Very low155 Ų155131 Ų13180%0.79575%0.749SS**  cis68.6130.944.2-57.2175.6000111.5
758P30.5Very low27Very low122 Ų122129.3 Ų129.379%0.79274%0.741SS**  cis-134.8179.626.227.2-2.3000118.9
759I23.3Very low27.2Very low158 Ų158130.4 Ų130.481%0.8174%0.741SS**  trans-78.6151.2168.2-57.9150000111.2
760I25.8Very low27.5Very low166 Ų166131.4 Ų131.485%0.85174%0.739SS**  trans-175149.8132.8-98158.1000112.9
761S23.7Very low27.8Very low97 Ų97129.2 Ų129.268%0.67873%0.729SS**  trans-99.1152.8-173.456.10000114.8
762Q26.1Very low28Very low167 Ų167130.2 Ų130.278%0.7873%0.727SS**  trans-164.5120.7141.9-105.9154.333.400109.9
763Q25.3Very low28.2Very low174 Ų174129.6 Ų129.681%0.81371%0.713SS**  77.4111.197.3-74.4-175.9-17.100115.4
764S29.4Very low28.3Very low113 Ų113127.6 Ų127.679%0.7970%0.703SS**  trans-65.4155.6161.1-169.90000110.2
765P30.4Very low28.4Very low108 Ų108130.3 Ų130.370%0.70171%0.71SS**  -151.3159.298.441.4-25.6000117.2
766N24.9Very low28.3Very low132 Ų132130 Ų13071%0.70671%0.708SS**  trans58.3115.5137.5-75.41.1000122.4
767N26Very low28.2Very low126 Ų126130.4 Ų130.467%0.67472%0.715SS**  95.9140.7112.5-83.62.6000122.3
768N27.2Very low28.1Very low115 Ų115128 Ų12862%0.61571%0.708SS**  trans80.896137.6-70.83.5000119.4
769N28.3Very low27.8Very low115 Ų115130.7 Ų130.762%0.61571%0.707SS**  94.4127.3105-73.2-4.7000118.3
770N29.5Very low28.1Very low124 Ų124131.5 Ų131.566%0.66371%0.705SS**  69.3134.7128.7-60.55000116.7
771N30.4Very low28.1Very low116 Ų116128.4 Ų128.462%0.6269%0.694SS**  cis-176174.111.3-122.4-0.3000109.9
772N31.4Very low28.3Very low122 Ų122129.8 Ų129.865%0.65269%0.693SS**  trans70.4150.3146.6-68.44000117.7
773N32.2Very low28.3Very low110 Ų110128.2 Ų128.259%0.58869%0.69SS**  cis-154.6143.8-0.6-116.3-9.7000112.6
774N30.7Very low28.3Very low101 Ų101125.3 Ų125.354%0.5469%0.685SS.*  trans37.6130.1135.3-50.2-20.4000121.3
775N33.8Very low28.1Very low153 Ų153128.4 Ų128.482%0.81868%0.684SS**  -168.5119.590.5-79.8-40.4000109.1
776N28.1Very low27.9Very low124 Ų124130.1 Ų130.166%0.66368%0.682SS**  68.692.758-75.4-19.5000116.4
777V27.6Very low28Very low140 Ų140130.5 Ų130.585%0.84868%0.68SS**  trans-151.399.7138.61780000105.7
778V25.7Very low27.9Very low106 Ų106130.7 Ų130.764%0.64268%0.679SS**  10796.559.21570000111.9
779F24.5Very low28Very low177 Ų177131.7 Ų131.778%0.77668%0.683SS**  trans58.7149.5130.2-67.3-70.1000122
780K28.4Very low27.9Very low176 Ų176132 Ų13277%0.76569%0.685SS**  cis-130.1153.46.8-88.1120.9174-167.40109.1
781T26Very low27.8Very low101 Ų101133.4 Ų133.462%0.6269%0.688SS**  51.3136.669.689.10000113.6
782D28.7Very low27.6Very low125 Ų125134 Ų13467%0.66869%0.691SS**  cis-149.4148.945.4-76.1-34.9000114.4
783N25.1Very low27.2Very low134 Ų134135.8 Ų135.872%0.71770%0.699SS**  44.4137.9129.6-53.5-39.3000121.3
784T25.9Very low26.8Very low113 Ų113137.8 Ų137.869%0.69371%0.709SS**  cis-169.4159.710.14.50000114.1
785K26.1Very low26.5Very low178 Ų178139.3 Ų139.377%0.77472%0.722SS**  trans78.5123148.1-73.4173.3178.2-179.90121.5
786Q25.6Very low26Very low144 Ų144140.4 Ų140.467%0.67372%0.719SS**  trans56.6129.6145.7-89.255.735.700120
787H26Very low25.8Very low140 Ų140141.5 Ų141.565%0.64873%0.731SS**  cis-168.5135.1-10.6-138.7-140000109.9
788I24.7Very low25.7Very low130 Ų130138.7 Ų138.767%0.66772%0.722SS**  trans46.1129.6132.9-67.4-171.3000119
789I29Very low25.9Very low136 Ų136139.3 Ų139.370%0.69773%0.726SS**  cis-162.4122-1.6-104.8175.2000104
790D27Very low26Very low123 Ų123136.8 Ų136.866%0.65873%0.726SS**  48.9106.784.3-77.6-48.9000116.5
791Q26.8Very low26Very low152 Ų152135 Ų13571%0.7173%0.73SS**  83.2118.480.9-85.7-157.179.900117.2
792N25.3Very low25.8Very low130 Ų130135.6 Ų135.670%0.69574%0.738SS**  trans61.6144.3134.9-74.7-37.9000123
793I23Very low25.7Very low159 Ų159137.2 Ų137.282%0.81575%0.745SS**  trans79106160.5-60.9153.7000118.4
794L23.8Very low25.8Very low151 Ų151137 Ų13779%0.79175%0.748SS**  trans60.980140.8-160.172.6000120.9
795T25Very low25.8Very low134 Ų134139.7 Ų139.782%0.82275%0.753SS**  trans-128.6131.7148.251.80000107.4
796K23.5Very low25.9Very low176 Ų176137 Ų13777%0.76575%0.753SS**  cis66.4114.733.9-89.4-174.1176.8177.80115
797T24Very low26Very low146 Ų146135.5 Ų135.590%0.89676%0.759SS**  trans66.6144.8176.371.30000114.7
798A25.6Very low26.1Very low81 Ų81137.9 Ų137.967%0.66977%0.77SS**  cis-143.5-179.4-11.400000107
799T30.4Very low26.1Very low120 Ų120139 Ų13974%0.73678%0.777SS**  cis-156.5116.136.743.80000109.8
800T25.7Very low26Very low124 Ų124136.6 Ų136.676%0.76177%0.771SS**  64.883.484.863.60000117.5
801T27.9Very low26Very low139 Ų139137.8 Ų137.885%0.85377%0.772SS**  trans-141.699.3148.626.70000110.7
802S23.6Very low26Very low113 Ų113137.1 Ų137.179%0.7977%0.772SS**  trans-23121.5177.655.30000119.2
803I26.4Very low26.1Very low159 Ų159137.7 Ų137.782%0.81577%0.771SS**  trans-119.2122.3140.5-63.4180000106.8Q805I803-Q805 PolarHBondContact O-N 3.27Å
804V25.6Very low26.2Very low128 Ų128136 Ų13678%0.77677%0.77SS**  trans-85.6100.2179.6179.30000108.7P806V804-P806 WeakPolarHBondContact O-CD 3.39Å
805Q26.8Very low26.4Very low171 Ų171134.8 Ų134.880%0.79976%0.763SS**  trans-75.9123.2162.8-73.6-175.4-38.200109I803 S807I803-Q805 PolarHBondContact O-N 3.27Å; Q805-S807 PolarHBondContact O-N 3.49Å
806P29.3Very low26.5Very low121 Ų121133.7 Ų133.779%0.78675%0.752SS**  trans-72.8115167.729.6-30.9000108.8V804V804-P806 WeakPolarHBondContact O-CD 3.39Å
807S27.7Very low26.7Very low113 Ų113130.7 Ų130.779%0.7974%0.743SS**  trans-58.3148.2176.3-48.50000112.1Q805 L809Q805-S807 PolarHBondContact O-N 3.49Å; S807-L809 PolarHBondContact O-N 3.19Å; S807-L809 VanDerWaalsContact O-N 3.12Å
808E26.5Very low26.9Very low189 Ų189128 Ų12888%0.88373%0.73SS**SBendtrans-15.897.7167.6-59.7174.6-177.200116.5
809L26.2Very low27.1Very low155 Ų155129 Ų12981%0.81273%0.732SS**  trans-171.384.5145.5-129.772.2000113.1S807S807-L809 PolarHBondContact O-N 3.19Å; S807-L809 VanDerWaalsContact O-N 3.12Å
810C25.9Very low27.1Very low85 Ų85129.3 Ų129.357%0.57474%0.736SS**  trans-150.137.7169.855.40000115.9
811H26.7Very low27.3Very low147 Ų147128.8 Ų128.868%0.68173%0.733SS**  trans-124.776.7159.8-104.946.2000110.6
812I26.7Very low27.6Very low139 Ų139131 Ų13171%0.71373%0.73SS**  trans-106.877167.6-53.3-179.4000108.1
813Q28.4Very low28Very low141 Ų141129.5 Ų129.566%0.65971%0.714SS**  trans-84.7125150.5-64.9-165.625.700106.9I815Q813-I815 PolarHBondContact O-N 3.4Å
814P24.8Very low28.3Very low123 Ų123127.9 Ų127.980%0.79971%0.706SS**  trans-79.8104-172.230.5-33.8000111.1
815I28.1Very low28.7Very low127 Ų127123.5 Ų123.565%0.65168%0.679SS**  trans-124.7132.4172.4-58.9-177.4000109.6Q813Q813-I815 PolarHBondContact O-N 3.4Å
816L26.6Very low29Very low111 Ų111119.1 Ų119.158%0.58166%0.661SS**  trans-79.1139-169.9-47.995.8000113.9R102R102-L816 PolarHBondContact NH1-O 2.97Å; R102-L816 PolarHBondContact NH2-O 2.79Å
817I27.8Very low29.1Very low112 Ų112117.5 Ų117.557%0.57465%0.645SS**  trans-175.6120.4137.4-90.3144.7000105.3R102R102-I817 VanDerWaalsContact NH1-CD1 3.3Å
818S28.6Very low29.3Very low89 Ų89115.4 Ų115.462%0.62263%0.628SS**  cis97.5114.638.5-65.20000114.1
819S29.9Very low29.7Very low104 Ų104113.6 Ų113.673%0.72762%0.619SS**  trans80.3129.8158.1-550000120.1
820P29.7Very low29.9Very low126 Ų126112.5 Ų112.582%0.81862%0.615SS**  trans-88.8165176.837.7-36.2000112.9
821V30.9Very low30Very low112 Ų112116.2 Ų116.268%0.67963%0.628SS**  trans-107.6123.61681770000109.1
822K33.4Very low30.2Very low185 Ų185112.3 Ų112.380%0.80463%0.627SS**  trans-84.8139.5162.5-67.7-179.4178.2179.30108.7
823N32.4Very low30.4Very low83 Ų83112.8 Ų112.844%0.44464%0.637SS.*  trans-101.9118.3159-116.7-36.9000108.8S185 T188S185-N823 VanDerWaalsContact CB-ND2 3.29Å; S185-N823 WeakPolarHBondContact CB-ND2 3.41Å; T188-N823 HydrophobicContact CG2-CB 4.17Å
824N32Very low30.5Very low124 Ų124109.8 Ų109.866%0.66364%0.643SS**  trans-115.6117172.6-110.840.5000107.4
825N34.6Very low30.7Very low37 Ų37108.6 Ų108.620%0.19864%0.638CS.*  trans-148.2121.4149.7-74.8-78.7000106.9H183 R184H183-N825 WeakPolarHBondContact O-CB 3.48Å; R184-N825 HydrophobicContact CB-CB 3.71Å; R184-N825 WeakPolarHBondContact CB-ND2 3.5Å; R184-N825 WeakPolarHBondContact CD-ND2 3.38Å; R184-N825 WeakPolarHBondContact CD-OD1 3.27Å; R184-N825 PolarHBondContact NH1-OD1 2.88Å
826N33.3Very low30.7Very low78 Ų78112.7 Ų112.742%0.41765%0.647SS.*  71.8120.359.5-62.1-7.6000108.8E182 H183E182-N826 VanDerWaalsContact OE1-C 3.24Å; H183-N826 WeakPolarHBondContact CB-O 3.29Å
827N31.6Very low30.9Very low87 Ų87113.7 Ų113.747%0.46565%0.651SS.*  cis-164.5146.125.1-112.6-14.2000112.9L181 E182L181-N827 WeakPolarHBondContact CD1-O 3.38Å; L181-N827 WeakPolarHBondContact CD2-O 3.1Å; L181-N827 WeakPolarHBondContact CG-O 3.27Å; E182-N827 WeakPolarHBondContact OE1-CA 3.36Å; E182-N827 PolarHBondContact OE1-N 2.96Å
828T31.6Very low30.9Very low70 Ų70114.7 Ų114.743%0.42966%0.658SS.*  trans95.2116.7134.255.30000125L181L181-T828 WeakPolarHBondContact CD1-O 3.36Å; L181-T828 VanDerWaalsContact CD2-O 3.25Å; L181-T828 WeakPolarHBondContact CD2-O 3.36Å
829H34.2Very low31.2Very low150 Ų150115.1 Ų115.169%0.69466%0.661SS**  trans79.9115.5132.5-69.6-47.9000123.4
830N30.6Very low31.3Very low133 Ų133117.3 Ų117.371%0.71166%0.664SS**  77151.2129.5-60.70.8000120.1
831L29Very low31.2Very low163 Ų163116 Ų11685%0.85366%0.658SS**  cis-167.4129.4-28.6-173.271.8000109.9
832G30.4Very low31.1Very low64 Ų64118 Ų11866%0.6666%0.663SS**  trans71.7177167.100000117.3
833T29.6Very low30.9Very low150 Ų150113.6 Ų113.692%0.9266%0.656SS**  cis-175141.1-23.215.10000108.9
834G31Very low30.8Very low77 Ų77115.3 Ų115.379%0.79467%0.665SS**  trans99.8129175.200000113.4
835S29.5Very low30.9Very low99 Ų99117.5 Ų117.569%0.69267%0.671SS**  cis103.6137.316.9-166.40000114.8
836Y28Very low30.9Very low212 Ų212119.8 Ų119.883%0.83169%0.69SS**  trans71.9153.4175.5-60.5-62.9000116.1
837I30.1Very low30.9Very low132 Ų132122.4 Ų122.468%0.67770%0.704SS**  cis-151.8155.93.4-131.5157.8000111.4
838D27.5Very low31Very low133 Ų133124.7 Ų124.771%0.71172%0.716SS**  trans19.5156.2154.2-45.5-22.1000122.2
839S35.1Very low31.2Very low99 Ų99126.4 Ų126.469%0.69272%0.723SS**  cis-170.7156.242.5-44.50000115
840N32.3Very low31.3Very low149 Ų149127.1 Ų127.180%0.79772%0.724SS**  41.5151.3128.9-68.2-28.8000123.5
841C27.7Very low31.5Very low100 Ų100125.1 Ų125.168%0.67672%0.721SS**  cis-171.9154.1-19.8-120.80000112.7
842L28.5Very low31.9Very low152 Ų152126 Ų12680%0.79672%0.72SS**  trans41.7121.2142.2-101.569000123.8
843S30.1Very low32Very low93 Ų93127.8 Ų127.865%0.6572%0.723SS**  127.5150.798.369.70000121.4
844N30.9Very low32.2Very low120 Ų120127.3 Ų127.364%0.64271%0.713SS**  trans91111.9146.2-70.6-42.3000123.8
845Q33.7Very low32.2Very low169 Ų169129.8 Ų129.879%0.7971%0.713SS**  74.9144.8125.4-67.1174.645.500120
846S34.2Very low32.3Very low86 Ų86130 Ų13060%0.60171%0.712SS**  cis-168166.1-8.4560000114.6
847N33.5Very low32.4Very low132 Ų132125.5 Ų125.571%0.70671%0.712SS**  trans78.8124.1144.5-66.8-17000124.1
848N33.4Very low32.8Very low135 Ų135124.6 Ų124.672%0.72272%0.717SS**  trans72.8145.9139.8-57.7-9.2000119.2
849D36.6Very low33.2Very low106 Ų106123.7 Ų123.757%0.56772%0.718SS**  cis-154160.72.2-138.2-12.3000113.8
850K35.4Very low32.9Very low166 Ų166126.3 Ų126.372%0.72272%0.723SS**  trans29.3138.8150.9-71.4161.2-167.580.10120.7
851S35.8Very low32.9Very low91 Ų91126 Ų12664%0.63672%0.721SS**  cis-174151.113.248.90000114
852H35.9Very low33Very low180 Ų180127.2 Ų127.283%0.83373%0.725SS**  trans46.6133.7154.7-54.2-55000120.1
853S32.8Very low33.1Very low103 Ų103127 Ų12772%0.7273%0.725SS**  cis-177.6-171.21.443.70000107.7
854I34.3Very low32.9Very low139 Ų139127.2 Ų127.271%0.71373%0.726SS**  cis-147.992.615.2-44.8162.4000112.1
855T31.3Very low33Very low130 Ų130129.3 Ų129.380%0.79874%0.737SS**  trans71.2178.5148.577.80000118.7
856P31.9Very low32.9Very low104 Ų104126.3 Ų126.368%0.67573%0.734SS**  -119159.9-109.115.411.1000114.7
857S30.2Very low33.1Very low117 Ų117128 Ų12882%0.81874%0.744SS**  71.4130.463.3-37.70000115.9
858S37.8Very low33.2Very low112 Ų112126.1 Ų126.178%0.78374%0.741SS**  trans-79.6163.2-176.6-40.90000114.7
859P35.9Very low33.2Very low114 Ų114125.6 Ų125.674%0.7474%0.743SS**  -124.8137.1128.73.718000110.8
860L28.6Very low33.1Very low154 Ų154126.6 Ų126.681%0.80675%0.753SS**  87.4153.257-73.3168.9000114.5
861L31.8Very low33Very low142 Ų142125.1 Ų125.174%0.74375%0.752SS**  trans83.7108165.6-47.8-174.4000117.4
862T31.4Very low33Very low126 Ų126129.4 Ų129.477%0.77376%0.762SS**  82.6147.699.362.40000115.4
863N30.5Very low32.9Very low147 Ų147125.6 Ų125.679%0.78676%0.755SS**  cis-145.1171.6-1.6-159.39.8000111
864C24.6Very low33.1Very low99 Ų99125.1 Ų125.167%0.66975%0.752SS**  trans-68.5163173.1-49.90000114
865N33.4Very low33.2Very low164 Ų164124.5 Ų124.588%0.87776%0.755SS**  -171.4130.4127.8-94.3-20.1000112.1
866S31.7Very low33.4Very low105 Ų105124.1 Ų124.173%0.73475%0.753SS**  trans-93158.5168.4-53.40000110.5
867P39.2Very low33.2Very low122 Ų122124.4 Ų124.479%0.79276%0.755SS**  -129.6143.1101.313.17.1000111.3
868S35.2Very low33.2Very low92 Ų92123.7 Ų123.764%0.64375%0.75SS**  cis94.111743.2-650000113.9
869T33.1Very low32.8Very low125 Ų125125.8 Ų125.877%0.76775%0.751SS**  trans74.1148.6147.255.80000121.6
870T34.9Very low32.8Very low127 Ų127128.4 Ų128.478%0.77976%0.758SS**  trans70.8145.9172.970.30000117.2
871L33.3Very low33.2Very low135 Ų135132.2 Ų132.271%0.70776%0.762SS**  cis-179.8138.9-42.6-113.5163.7000106.3
872Q34.6Very low33.6Very low180 Ų180130 Ų13084%0.84176%0.756SS**  trans60.9171.4167-61.7156.5-21.600116.3
873S34.6Very low34Very low100 Ų100129.3 Ų129.370%0.69976%0.756SS**  cis-170.5164.4-49.4-167.20000108.7
874S37.6Very low34.2Very low93 Ų93125.8 Ų125.865%0.6575%0.754SS**  trans60.8103.6147.753.20000123.1
875T35.3Very low34.8Very low126 Ų126132.2 Ų132.277%0.77376%0.764SS**  78.8154.2115.4-29.70000122.6
876V35.3Very low35.2Very low123 Ų123128.1 Ų128.175%0.74575%0.749SS**  trans89.692.6158.1-165.90000120.2
877C29.1Very low35.6Very low109 Ų109128.9 Ų128.974%0.73675%0.749SS**  58.1133.7117.5-144.90000123.9
878C29.4Very low35.7Very low103 Ų103127.7 Ų127.770%0.69674%0.744SS**  trans66.3120.5146-880000123.4
879L30.2Very low36Very low156 Ų156129.6 Ų129.682%0.81775%0.752SS**  trans79.3147.5139.3-62.7172.2000121
880L34.8Very low36.5Very low168 Ų168128 Ų12888%0.8875%0.746SS**  trans80.9118.9159-65.8154.5000121.1
881R36.5Very low37Very low235 Ų235127.2 Ų127.289%0.88775%0.745SS**  trans-52.2169.4155.5-82177.8160.4-166.9-0.4113.3
882P41.1Very low37.4Very low96 Ų96124.2 Ų124.262%0.62375%0.747SS**  cis-146.8-177-41.842.9-25000114.5
883S38.7Very low38Very low111 Ų111121 Ų12178%0.77675%0.745SS**  trans75.9138.4149.6-56.40000121.7
884G34.8Very low38.5Very low72 Ų72121.3 Ų121.374%0.74275%0.746SS**  trans132.778167.600000112.7
885R39.1Very low38.4Very low234 Ų234123 Ų12388%0.88376%0.756SS**  74.2133.867.9-164.4-145.2176.7-147.6-0.6113.4
886S41.8Very low38.6Very low79 Ų79120 Ų12055%0.55275%0.752SS**  trans89.5140.5163.7-23.70000114
887T39.2Very low39Very low121 Ų121120.2 Ų120.274%0.74276%0.758SS**  cis-167.6162-5.86.20000110.1
888S41.4Very low39.5Very low97 Ų97120.6 Ų120.668%0.67876%0.762SS**  trans54.2142145.262.90000119.6
889T40.9Very low39.8Very low132 Ų132121.7 Ų121.781%0.8177%0.77SS**  cis-177.61709.813.90000105.9
890S44.8Very low40.2Very low92 Ų92120.3 Ų120.364%0.64377%0.773SS**  cis-167.8173.3-443.30000108.9
891S45.6Very low40.5Very low110 Ų110116 Ų11677%0.76977%0.77SS**  trans38.8115.2147.358.10000118.9
892G41.8Very low40.6Very low72 Ų72111.9 Ų111.974%0.74277%0.77SS**  142.6174.752.600000108
893S47Very low40.4Very low113 Ų113111.1 Ų111.179%0.7978%0.78SS**  cis-156.7176.99.2-660000111.4
894S44.6Very low40.3Very low105 Ų105109.6 Ų109.673%0.73478%0.782SS**  trans-13.5154.315453.90000119
895C34.8Very low40Very low128 Ų128110.2 Ų110.287%0.86579%0.788SS**  cis-173.7171.17.241.40000108.5
896G39.6Very low40.3Very low65 Ų65105.8 Ų105.867%0.6779%0.787SS**  cis156.5159.6-3.900000111.1
897S43.1Very low40.2Very low126 Ų126106.3 Ų106.388%0.88179%0.79SS**  trans53.7136.2161.7-49.60000119.1
898S41Very low40.3Very low118 Ų118108 Ų10883%0.82580%0.8SS**  cis-150.7158.415.3-430000107.9
899C35Very low40.2Very low126 Ų126107.1 Ų107.185%0.85179%0.794SS**  -155161.55956.30000112.8
900S39.1Very low40.4Very low126 Ų126106.4 Ų106.488%0.88179%0.794SS**  trans-120.4132.5-173.8-57.80000112.1
901G40Very low41Very low79 Ų79105 Ų10581%0.81480%0.795SS**  trans-126.2100.9170.200000110.7
902T39.8Very low42.2Very low147 Ų147106.2 Ų106.290%0.90279%0.788SS**  trans-63.5147.7173.846.10000111.8
903G36.2Very low44.4Very low81 Ų81109.2 Ų109.284%0.83578%0.778SS**  cis167.3164-1.700000111
904G35.9Very low46.7Very low78 Ų78109.3 Ų109.380%0.80477%0.769SS**  trans162.996.6179.700000112.1
905G30.3Very low49.2Very low85 Ų85104.4 Ų104.488%0.87673%0.734SS**  trans-80.7120.1-177.800000112.4
906V44.7Very low52.1Low141 Ų141101.6 Ų101.686%0.85572%0.716SS**  trans-88112.4166.4179.70000108.5V908V906-V908 PolarHBondContact O-N 3.2Å
907S38.7Very low54.9Low90 Ų9098.5 Ų98.563%0.62968%0.684SS**  trans-66.1124.3177.551.90000111.5S909S907-S909 VanDerWaalsContact C-N 3.33Å; S907-S909 PolarHBondContact O-N 3.49Å; S907-S909 PolarHBondContact O-OG 2.83Å; S907-S909 PolarHBondContact OG-OG 3.22Å
908V41.3Very low57.5Low157 Ų15792.5 Ų92.595%0.95264%0.642SS**  trans-73.686.8174-179.20000109.4V906V906-V908 PolarHBondContact O-N 3.2Å
909S39.7Very low60.1Low79 Ų7990 Ų9055%0.55263%0.625SS**  trans-153131.1-177.750.50000111.3S907S907-S909 VanDerWaalsContact C-N 3.33Å; S907-S909 PolarHBondContact O-N 3.49Å; S907-S909 PolarHBondContact O-OG 2.83Å; S907-S909 PolarHBondContact OG-OG 3.22Å
910S45.8Very low63Low116 Ų11685 Ų8581%0.81159%0.59SS**SBendtrans73.766.1176.571.30000119.2Q912S910-Q912 PolarHBondContact O-N 3.34Å
911G57.7Low65.7Low63 Ų6387 Ų8765%0.64958%0.578SS**  77.115.9124.600000121.2Y913G911-Y913 WeakPolarHBondContact O-CD2 3.14Å; G911-Y913 PolarHBondContact O-N 2.9Å
912Q69.3Low68.4Low136 Ų13683.8 Ų83.864%0.63654%0.544SS*.  trans-8087.7178.3-61.9-158.839.200113.3S910S910-Q912 PolarHBondContact O-N 3.34Å
913Y88Confident71Confident134 Ų13479.9 Ų79.953%0.52552%0.523SS..  trans-66.9147172.5-63.8-80.8000112.7G911 A922 F930G911-Y913 WeakPolarHBondContact O-CD2 3.14Å; G911-Y913 PolarHBondContact O-N 2.9Å; Y913-A922 WeakPolarHBondContact O-CB 3.04Å; Y913-A922 PolarHBondContact O-N 3.19Å; Y913-F930 AromaticContact CD1-CD1 3.82Å; Y913-F930 HydrophobicContact CD1-CD1 3.82Å; Y913-F930 HydrophobicContact CD1-CD2 4.09Å; Y913-F930 AromaticContact CD1-CE1 3.44Å; Y913-F930 HydrophobicContact CD1-CE1 3.44Å; Y913-F930 VanDerWaalsContact CD1-CE1 3.44Å; Y913-F930 AromaticContact CD1-CE2 3.72Å; Y913-F930 HydrophobicContact CD1-CE2 3.72Å; Y913-F930 HydrophobicContact CD1-CG 4.13Å; Y913-F930 AromaticContact CD1-CZ 3.37Å; Y913-F930 HydrophobicContact CD1-CZ 3.37Å; Y913-F930 HydrophobicContact CD2-CD1 4.19Å; Y913-F930 AromaticContact CD2-CE1 3.66Å; Y913-F930 HydrophobicContact CD2-CE1 3.66Å; Y913-F930 HydrophobicContact CD2-CZ 4.25Å; Y913-F930 HydrophobicContact CE1-CD1 4.49Å; Y913-F930 AromaticContact CE1-CE1 3.68Å; Y913-F930 HydrophobicContact CE1-CE1 3.68Å; Y913-F930 AromaticContact CE1-CE2 3.76Å; Y913-F930 HydrophobicContact CE1-CE2 3.76Å; Y913-F930 AromaticContact CE1-CZ 3.24Å; Y913-F930 HydrophobicContact CE1-CZ 3.24Å; Y913-F930 AromaticContact CE2-CE1 3.88Å; Y913-F930 HydrophobicContact CE2-CE1 3.88Å; Y913-F930 HydrophobicContact CE2-CZ 4.14Å; Y913-F930 AromaticContact CG-CD1 3.64Å; Y913-F930 HydrophobicContact CG-CD1 3.64Å; Y913-F930 AromaticContact CG-CE1 3.42Å; Y913-F930 HydrophobicContact CG-CE1 3.42Å; Y913-F930 VanDerWaalsContact CG-CE1 3.42Å; Y913-F930 HydrophobicContact CG-CG 4.28Å; Y913-F930 AromaticContact CG-CZ 3.89Å; Y913-F930 HydrophobicContact CG-CZ 3.89Å; Y913-F930 AromaticContact CZ-CE1 3.89Å; Y913-F930 AromaticContact CZ-CZ 3.65Å
914I95.8Very high73.8Confident115 Ų11577.1 Ų77.159%0.5949%0.494SS*.BIsolated β-bridgetrans-105146.5178.1-63.3174.2000110.2S916I914-S916 PolarHBondContact O-N 3.44Å
915C98Very high76.6Confident2 Ų280.1 Ų80.11%0.01449%0.485CS..  trans-72.3110.4177.71790000111.3I917 C918 S919 D920 S931 C932C915-I917 PolarHBondContact O-N 3.13Å; C915-C918 PolarHBondContact O-N 3.41Å; C915-S919 PolarHBondContact O-N 3.47Å; C915-D920 HydrophobicContact CB-CB 4.45Å; C915-D920 WeakPolarHBondContact CB-O 3.43Å; C915-D920 PolarHBondContact N-O 2.98Å; C915-S931 VanDerWaalsContact SG-CA 3.59Å; C915-C932 HydrophobicContact CB-CB 4.1Å; C915-C932 PolarHBondContact SG-N 3.04Å; C915-C932 VanDerWaalsContact SG-N 3.36Å
916S95.8Very high79.8Confident70 Ų7077.6 Ų77.649%0.4945%0.45SS..THydrogen-bonded Turntrans-60-15.6-178.2-49.40000114.2I914 F930I914-S916 PolarHBondContact O-N 3.44Å; S916-F930 PolarHBondContact N-O 2.88Å; S916-F930 PolarHBondContact OG-O 3.15Å
917I97.5Very high82.3Confident0 Ų072.9 Ų72.90%042%0.417CS..THydrogen-bonded Turntrans-90.3-42.2180-63.572.7000111.7C915 V929 C935 I959 R971 K974 C975 A978 M980C915-I917 PolarHBondContact O-N 3.13Å; I917-V929 HydrophobicContact CD1-CG2 3.71Å; I917-C935 HydrophobicContact CB-CB 4.37Å; I917-C935 HydrophobicContact CG2-CB 4.49Å; I917-I959 HydrophobicContact CG2-CG2 4.05Å; I917-I959 WeakPolarHBondContact O-CG2 3.3Å; I917-I959 VanDerWaalsContact O-O 3.11Å; I917-R971 HydrophobicContact CG2-CG 4.37Å; I917-K974 HydrophobicContact CG2-CB 4.45Å; I917-K974 HydrophobicContact CG2-CG 4.45Å; I917-K974 WeakPolarHBondContact O-CD 3.42Å; I917-K974 WeakPolarHBondContact O-CE 3.32Å; I917-K974 PolarHBondContact O-NZ 3.25Å; I917-C975 HydrophobicContact CG1-CB 4.38Å; I917-A978 HydrophobicContact CD1-CB 4Å; I917-A978 HydrophobicContact CG1-CB 4.22Å; I917-M980 HydrophobicContact CD1-CE 3.93Å; I917-M980 HydrophobicContact CD1-SD 4.45Å
918C97.9Very high85Confident0 Ų070.9 Ų70.90%041%0.411CS..THydrogen-bonded Turntrans-145.627.9-166.769.10000115.2C915 D920 C935 I959 D960 K961 R964C915-C918 PolarHBondContact O-N 3.41Å; C918-D920 PolarHBondContact O-N 2.97Å; C918-C935 PolarHBondContact SG-SG 3.13Å; C918-I959 HydrophobicContact CB-CG2 4.03Å; C918-D960 CarbonylContact O-C 3.59Å; C918-K961 WeakPolarHBondContact O-CA 3.25Å; C918-K961 PolarHBondContact O-N 3.33Å; C918-R964 HydrophobicContact CB-CB 3.96Å; C918-R964 VanDerWaalsContact SG-CD 3.56Å; C918-R964 PolarHBondContact SG-NH1 3.38Å
919S95.4Very high87.6Confident66 Ų6664 Ų6446%0.46237%0.369SS..SBendtrans57.7-0.6170.953.40000117.1C915 D960C915-S919 PolarHBondContact O-N 3.47Å; S919-D960 PolarHBondContact OG-OD1 2.97Å
920D96.3Very high90.4Very high21 Ų2162.7 Ų62.711%0.11235%0.354CS..SBendtrans-73.4163.4174.4-160.22.7000112.2C915 C918 A922 C932 K961 R964C915-D920 HydrophobicContact CB-CB 4.45Å; C915-D920 WeakPolarHBondContact CB-O 3.43Å; C915-D920 PolarHBondContact N-O 2.98Å; C918-D920 PolarHBondContact O-N 2.97Å; D920-A922 PolarHBondContact O-N 2.99Å; D920-C932 HydrophobicContact CB-CB 4.1Å; D920-K961 HydrophobicContact CB-CB 4.2Å; D920-K961 HydrophobicContact CB-CD 4.07Å; D920-K961 HydrophobicContact CB-CG 4.04Å; D920-K961 WeakPolarHBondContact OD1-CD 3.29Å; D920-K961 WeakPolarHBondContact OD1-CE 3.34Å; D920-K961 IonicContact OD1-NZ 2.71Å; D920-K961 PolarHBondContact OD1-NZ 2.8Å; D920-R964 IonicContact OD2-CZ 3.64Å; D920-R964 IonicContact OD2-NH1 3.83Å; D920-R964 PolarHBondContact OD2-NH1 3.32Å; D920-R964 IonicContact OD2-NH2 2.7Å; D920-R964 PolarHBondContact OD2-NH2 3.09Å
921R96Very high92.8Very high166 Ų16657.2 Ų57.263%0.62632%0.315SS*.BIsolated β-bridgetrans-61.6125.7177.4-176.7171.9173.6178.2-1.5110.1C932R921-C932 WeakPolarHBondContact O-CB 3.38Å
922A96.6Very high94.7Very high12 Ų1254.4 Ų54.410%0.09929%0.286CS..PPolyproline II helixtrans-76.8141.9175.600000110.5Y913 D920 F930 S931Y913-A922 WeakPolarHBondContact O-CB 3.04Å; Y913-A922 PolarHBondContact O-N 3.19Å; D920-A922 PolarHBondContact O-N 2.99Å; A922-F930 HydrophobicContact CB-CB 4.28Å; A922-S931 WeakPolarHBondContact CA-O 3.46Å; A922-S931 WeakPolarHBondContact CB-O 3.49Å
923S94.9Very high96.1Very high66 Ų6652.5 Ų52.546%0.46228%0.277SS..  trans-90.3-12.2171.549.60000112.4H926 S931 E933S923-H926 PolarHBondContact OG-NE2 3.32Å; S923-S931 PolarHBondContact N-O 3.01Å; S923-S931 PolarHBondContact OG-O 3.13Å; S923-E933 WeakPolarHBondContact CB-OE1 3.32Å; S923-E933 PolarHBondContact OG-OE1 3.22Å
924G93.8Very high96.5Very high22 Ų2247.5 Ų47.523%0.22727%0.266CS..EExtended strand (participates in β ladder)trans160.4-166.1178.600000111.9F930 S931G924-F930 WeakPolarHBondContact O-CA 3.35Å; G924-S931 PolarHBondContact O-N 3.48Å; G924-S931 VanDerWaalsContact O-N 3.08Å
925K95.9Very high96.7Very high141 Ų14142 Ų4261%0.61324%0.238SC*.EExtended strand (participates in β ladder)trans-84121.4165.8-67.9-171.4-178.8-177.60109.5V929 F930K925-V929 CarbonylContact C-O 3.39Å; K925-V929 VanDerWaalsContact CA-O 3.28Å; K925-V929 WeakPolarHBondContact CA-O 3.4Å; K925-F930 HydrophobicContact CD-CE1 4.37Å; K925-F930 HydrophobicContact CD-CE2 4.44Å; K925-F930 HydrophobicContact CD-CZ 4.17Å; K925-F930 VanDerWaalsContact CE-CE2 3.41Å; K925-F930 HydrophobicContact CG-CD1 3.71Å; K925-F930 HydrophobicContact CG-CD2 4.37Å; K925-F930 HydrophobicContact CG-CE1 3.53Å; K925-F930 HydrophobicContact CG-CE2 4.22Å; K925-F930 HydrophobicContact CG-CG 4.14Å; K925-F930 HydrophobicContact CG-CZ 3.81Å
926H97.2Very high96.6Very high32 Ų3244.6 Ų44.615%0.14825%0.249CC..EExtended strand (participates in β ladder)trans-124.2131.9173.7-52.9-74.2000108.8S923 G928 V929 S931 E933 K936S923-H926 PolarHBondContact OG-NE2 3.32Å; H926-G928 PolarHBondContact O-N 3.05Å; H926-G928 VanDerWaalsContact O-N 3.08Å; H926-V929 PolarHBondContact N-O 2.87Å; H926-V929 PolarHBondContact O-N 3.4Å; H926-V929 VanDerWaalsContact O-N 3.13Å; H926-S931 PolarHBondContact CD2-O 3.1Å; H926-S931 PolarHBondContact CD2-OG 2.97Å; H926-E933 IonicContact CE1-OE1 2.72Å; H926-E933 IonicContact NE2-OE1 2.79Å; H926-K936 HydrophobicContact CB-CB 3.97Å; H926-K936 HydrophobicContact CB-CD 4.47Å; H926-K936 HydrophobicContact CB-CG 3.86Å; H926-K936 VanDerWaalsContact CE1-CE 3.48Å; H926-K936 WeakPolarHBondContact CE1-CE 3.3Å; H926-K936 WeakPolarHBondContact ND1-CD 3.37Å; H926-K936 VanDerWaalsContact ND1-CE 3.31Å; H926-K936 WeakPolarHBondContact ND1-CE 3.47Å
927Y96.9Very high96.7Very high42 Ų4242.2 Ų42.217%0.16524%0.235CC..THydrogen-bonded Turntrans52.730.9-179-45.6-60.9000114K936 F939 K940 M980 R981 A984 V985Y927-K936 HydrophobicContact CE2-CB 4.47Å; Y927-K936 HydrophobicContact CE2-CG 3.99Å; Y927-F939 HydrophobicContact CD1-CD1 4.5Å; Y927-F939 HydrophobicContact CD2-CB 4.34Å; Y927-F939 AromaticContact CD2-CD1 3.53Å; Y927-F939 HydrophobicContact CD2-CD1 3.53Å; Y927-F939 HydrophobicContact CD2-CE1 4.26Å; Y927-F939 HydrophobicContact CD2-CG 4.3Å; Y927-F939 HydrophobicContact CE2-CD1 4.13Å; Y927-F939 AromaticContact CG-CD1 3.75Å; Y927-F939 HydrophobicContact CG-CD1 3.75Å; Y927-F939 HydrophobicContact CG-CE1 4.02Å; Y927-K940 HydrophobicContact CE2-CB 4.42Å; Y927-K940 WeakPolarHBondContact OH-CB 3.23Å; Y927-M980 WeakPolarHBondContact O-CA 3.46Å; Y927-R981 WeakPolarHBondContact O-CB 3.5Å; Y927-R981 PolarHBondContact O-N 3.46Å; Y927-A984 HydrophobicContact CD1-CB 3.95Å; Y927-A984 WeakPolarHBondContact CD1-O 3.46Å; Y927-A984 WeakPolarHBondContact CE1-O 3.37Å; Y927-V985 HydrophobicContact CD1-CG2 3.7Å; Y927-V985 HydrophobicContact CE1-CB 4.34Å; Y927-V985 HydrophobicContact CE1-CG2 3.67Å; Y927-V985 HydrophobicContact CG-CG2 4.27Å
928G95Very high96.7Very high49 Ų4942.6 Ų42.651%0.50524%0.237SC..THydrogen-bonded Turntrans103.4-21.7178.700000115.6H926H926-G928 PolarHBondContact O-N 3.05Å; H926-G928 VanDerWaalsContact O-N 3.08Å
929V96.3Very high96.7Very high12 Ų1242.6 Ų42.67%0.07324%0.237CC..EExtended strand (participates in β ladder)trans-123.2154.6-168.8-44.50000112.6I917 K925 H926 S931 A978 G979 M980I917-V929 HydrophobicContact CD1-CG2 3.71Å; K925-V929 CarbonylContact C-O 3.39Å; K925-V929 VanDerWaalsContact CA-O 3.28Å; K925-V929 WeakPolarHBondContact CA-O 3.4Å; H926-V929 PolarHBondContact N-O 2.87Å; H926-V929 PolarHBondContact O-N 3.4Å; H926-V929 VanDerWaalsContact O-N 3.13Å; V929-S931 PolarHBondContact O-N 2.75Å; V929-A978 WeakPolarHBondContact CG1-O 3.46Å; V929-G979 WeakPolarHBondContact CG1-O 3.21Å; V929-M980 HydrophobicContact CB-CG 4.49Å; V929-M980 HydrophobicContact CG1-CG 4.17Å; V929-M980 HydrophobicContact CG2-CE 3.56Å; V929-M980 HydrophobicContact CG2-CG 3.45Å; V929-M980 VanDerWaalsContact CG2-CG 3.45Å; V929-M980 HydrophobicContact CG2-SD 4.34Å
930F97.6Very high96.8Very high52 Ų5243.3 Ų43.323%0.22823%0.232CC..EExtended strand (participates in β ladder)trans-68.5120.4171.2-72.4-72000110.6Y913 S916 A922 G924 K925Y913-F930 AromaticContact CD1-CD1 3.82Å; Y913-F930 HydrophobicContact CD1-CD1 3.82Å; Y913-F930 HydrophobicContact CD1-CD2 4.09Å; Y913-F930 AromaticContact CD1-CE1 3.44Å; Y913-F930 HydrophobicContact CD1-CE1 3.44Å; Y913-F930 VanDerWaalsContact CD1-CE1 3.44Å; Y913-F930 AromaticContact CD1-CE2 3.72Å; Y913-F930 HydrophobicContact CD1-CE2 3.72Å; Y913-F930 HydrophobicContact CD1-CG 4.13Å; Y913-F930 AromaticContact CD1-CZ 3.37Å; Y913-F930 HydrophobicContact CD1-CZ 3.37Å; Y913-F930 HydrophobicContact CD2-CD1 4.19Å; Y913-F930 AromaticContact CD2-CE1 3.66Å; Y913-F930 HydrophobicContact CD2-CE1 3.66Å; Y913-F930 HydrophobicContact CD2-CZ 4.25Å; Y913-F930 HydrophobicContact CE1-CD1 4.49Å; Y913-F930 AromaticContact CE1-CE1 3.68Å; Y913-F930 HydrophobicContact CE1-CE1 3.68Å; Y913-F930 AromaticContact CE1-CE2 3.76Å; Y913-F930 HydrophobicContact CE1-CE2 3.76Å; Y913-F930 AromaticContact CE1-CZ 3.24Å; Y913-F930 HydrophobicContact CE1-CZ 3.24Å; Y913-F930 AromaticContact CE2-CE1 3.88Å; Y913-F930 HydrophobicContact CE2-CE1 3.88Å; Y913-F930 HydrophobicContact CE2-CZ 4.14Å; Y913-F930 AromaticContact CG-CD1 3.64Å; Y913-F930 HydrophobicContact CG-CD1 3.64Å; Y913-F930 AromaticContact CG-CE1 3.42Å; Y913-F930 HydrophobicContact CG-CE1 3.42Å; Y913-F930 VanDerWaalsContact CG-CE1 3.42Å; Y913-F930 HydrophobicContact CG-CG 4.28Å; Y913-F930 AromaticContact CG-CZ 3.89Å; Y913-F930 HydrophobicContact CG-CZ 3.89Å; Y913-F930 AromaticContact CZ-CE1 3.89Å; Y913-F930 AromaticContact CZ-CZ 3.65Å; S916-F930 PolarHBondContact N-O 2.88Å; S916-F930 PolarHBondContact OG-O 3.15Å; A922-F930 HydrophobicContact CB-CB 4.28Å; G924-F930 WeakPolarHBondContact O-CA 3.35Å; K925-F930 HydrophobicContact CD-CE1 4.37Å; K925-F930 HydrophobicContact CD-CE2 4.44Å; K925-F930 HydrophobicContact CD-CZ 4.17Å; K925-F930 VanDerWaalsContact CE-CE2 3.41Å; K925-F930 HydrophobicContact CG-CD1 3.71Å; K925-F930 HydrophobicContact CG-CD2 4.37Å; K925-F930 HydrophobicContact CG-CE1 3.53Å; K925-F930 HydrophobicContact CG-CE2 4.22Å; K925-F930 HydrophobicContact CG-CG 4.14Å; K925-F930 HydrophobicContact CG-CZ 3.81Å
931S97.5Very high96.7Very high0 Ų049.7 Ų49.70%025%0.254CS..EExtended strand (participates in β ladder)trans-149.4159.3179.861.90000113.7C915 A922 S923 G924 H926 V929 M980C915-S931 VanDerWaalsContact SG-CA 3.59Å; A922-S931 WeakPolarHBondContact CA-O 3.46Å; A922-S931 WeakPolarHBondContact CB-O 3.49Å; S923-S931 PolarHBondContact N-O 3.01Å; S923-S931 PolarHBondContact OG-O 3.13Å; G924-S931 PolarHBondContact O-N 3.48Å; G924-S931 VanDerWaalsContact O-N 3.08Å; H926-S931 PolarHBondContact CD2-O 3.1Å; H926-S931 PolarHBondContact CD2-OG 2.97Å; V929-S931 PolarHBondContact O-N 2.75Å; S931-M980 WeakPolarHBondContact OG-CE 3.42Å
932C98.1Very high96.7Very high4 Ų441.8 Ų41.83%0.02723%0.225CC..  trans-80.3157.6171.1660000110.7C915 D920 R921 G934 C935 K936 R964C915-C932 HydrophobicContact CB-CB 4.1Å; C915-C932 PolarHBondContact SG-N 3.04Å; C915-C932 VanDerWaalsContact SG-N 3.36Å; D920-C932 HydrophobicContact CB-CB 4.1Å; R921-C932 WeakPolarHBondContact O-CB 3.38Å; C932-G934 PolarHBondContact O-N 3.43Å; C932-C935 PolarHBondContact O-N 2.81Å; C932-K936 PolarHBondContact O-N 3.04Å; C932-K936 VanDerWaalsContact O-N 3.08Å; C932-R964 PolarHBondContact SG-NH1 3.41Å
933E97.1Very high96.6Very high96 Ų9642.6 Ų42.645%0.44923%0.229SC..Hα-helixtrans-49.8-36.1174.8-67.2-58.9118.500113S923 H926 C935 K936 G937S923-E933 WeakPolarHBondContact CB-OE1 3.32Å; S923-E933 PolarHBondContact OG-OE1 3.22Å; H926-E933 IonicContact CE1-OE1 2.72Å; H926-E933 IonicContact NE2-OE1 2.79Å; E933-C935 PolarHBondContact O-N 2.93Å; E933-K936 WeakPolarHBondContact OE1-CD 3.46Å; E933-K936 IonicContact OE1-NZ 2.67Å; E933-K936 PolarHBondContact OE1-NZ 3.33Å; E933-K936 VanDerWaalsContact OE2-CD 3.23Å; E933-K936 WeakPolarHBondContact OE2-CD 3.26Å; E933-K936 WeakPolarHBondContact OE2-CE 3.47Å; E933-K936 IonicContact OE2-NZ 3.95Å; E933-K936 PolarHBondContact OE2-NZ 2.83Å; E933-G937 PolarHBondContact O-N 2.88Å
934G97.4Very high96.4Very high29 Ų2942.8 Ų42.830%0.29922%0.219SC..Hα-helixtrans-62.9-32.1176.400000115C932 F938 R971C932-G934 PolarHBondContact O-N 3.43Å; G934-F938 VanDerWaalsContact O-CB 3.31Å; G934-F938 WeakPolarHBondContact O-CB 3.41Å; G934-F938 PolarHBondContact O-N 3.23Å; G934-R971 PolarHBondContact O-NH2 3.44Å
935C98.5Very high96.2Very high0 Ų049.3 Ų49.30%024%0.241CC..Hα-helixtrans-90.1-37.6177.5-72.30000111.9I917 C918 C932 E933 F938 F939I917-C935 HydrophobicContact CB-CB 4.37Å; I917-C935 HydrophobicContact CG2-CB 4.49Å; C918-C935 PolarHBondContact SG-SG 3.13Å; C932-C935 PolarHBondContact O-N 2.81Å; E933-C935 PolarHBondContact O-N 2.93Å; C935-F938 PolarHBondContact O-N 3.24Å; C935-F939 WeakPolarHBondContact O-CB 3.26Å; C935-F939 PolarHBondContact O-N 3.44Å
936K97.7Very high95.9Very high56 Ų5650 Ų5024%0.24325%0.247CC..Hα-helixtrans-50.5-56.4166.1172.4-159-169.1-1780111.7H926 Y927 C932 E933 F938 F939 K940H926-K936 HydrophobicContact CB-CB 3.97Å; H926-K936 HydrophobicContact CB-CD 4.47Å; H926-K936 HydrophobicContact CB-CG 3.86Å; H926-K936 VanDerWaalsContact CE1-CE 3.48Å; H926-K936 WeakPolarHBondContact CE1-CE 3.3Å; H926-K936 WeakPolarHBondContact ND1-CD 3.37Å; H926-K936 VanDerWaalsContact ND1-CE 3.31Å; H926-K936 WeakPolarHBondContact ND1-CE 3.47Å; Y927-K936 HydrophobicContact CE2-CB 4.47Å; Y927-K936 HydrophobicContact CE2-CG 3.99Å; C932-K936 PolarHBondContact O-N 3.04Å; C932-K936 VanDerWaalsContact O-N 3.08Å; E933-K936 WeakPolarHBondContact OE1-CD 3.46Å; E933-K936 IonicContact OE1-NZ 2.67Å; E933-K936 PolarHBondContact OE1-NZ 3.33Å; E933-K936 VanDerWaalsContact OE2-CD 3.23Å; E933-K936 WeakPolarHBondContact OE2-CD 3.26Å; E933-K936 WeakPolarHBondContact OE2-CE 3.47Å; E933-K936 IonicContact OE2-NZ 3.95Å; E933-K936 PolarHBondContact OE2-NZ 2.83Å; K936-F938 VanDerWaalsContact C-N 3.33Å; K936-F938 PolarHBondContact O-N 3.25Å; K936-F939 PolarHBondContact O-N 3.25Å; K936-K940 WeakPolarHBondContact O-CB 3.3Å; K936-K940 PolarHBondContact O-N 3.49Å
937G97.1Very high95.7Very high20 Ų2051.8 Ų51.821%0.20626%0.257CS..Hα-helixtrans-67.3-30.6-178.500000113.8E933 R941E933-G937 PolarHBondContact O-N 2.88Å; G937-R941 WeakPolarHBondContact O-CG 3.37Å; G937-R941 VanDerWaalsContact O-CZ 3.29Å; G937-R941 PolarHBondContact O-N 2.9Å; G937-R941 PolarHBondContact O-NH1 2.79Å
938F98.3Very high95.3Very high8 Ų856.2 Ų56.24%0.03529%0.288CS..Hα-helixtrans-64.9-57171170.4-99.5000111G934 C935 K936 K940 R941 T942 Y949 Q968 R971 Y972G934-F938 VanDerWaalsContact O-CB 3.31Å; G934-F938 WeakPolarHBondContact O-CB 3.41Å; G934-F938 PolarHBondContact O-N 3.23Å; C935-F938 PolarHBondContact O-N 3.24Å; K936-F938 VanDerWaalsContact C-N 3.33Å; K936-F938 PolarHBondContact O-N 3.25Å; F938-K940 VanDerWaalsContact C-N 3.33Å; F938-K940 PolarHBondContact O-N 3.24Å; F938-R941 PolarHBondContact O-N 3.1Å; F938-T942 PolarHBondContact O-N 3.37Å; F938-T942 PolarHBondContact O-OG1 3.31Å; F938-T942 VanDerWaalsContact O-OG1 3.08Å; F938-Y949 AromaticContact CE2-CE2 3.81Å; F938-Y949 HydrophobicContact CE2-CE2 3.81Å; F938-Y949 HydrophobicContact CZ-CD2 4.25Å; F938-Y949 AromaticContact CZ-CE2 3.53Å; F938-Y949 HydrophobicContact CZ-CE2 3.53Å; F938-Q968 HydrophobicContact CE2-CB 4.1Å; F938-Q968 HydrophobicContact CE2-CG 4.15Å; F938-Q968 HydrophobicContact CZ-CB 4.28Å; F938-Q968 WeakPolarHBondContact CZ-O 3.37Å; F938-R971 HydrophobicContact CD1-CG 3.99Å; F938-R971 HydrophobicContact CE1-CB 4.07Å; F938-R971 HydrophobicContact CE1-CG 3.78Å; F938-R971 HydrophobicContact CZ-CB 4.16Å; F938-R971 HydrophobicContact CZ-CG 4.24Å; F938-Y972 HydrophobicContact CE1-CD2 4.37Å
939F98Very high95.3Very high0 Ų055.5 Ų55.50%027%0.271CS..Hα-helixtrans-58.8-42.5-179.5-169.4-96.9000112.3Y927 C935 K936 R941 T942 V943 Y972 C975 L976 M980 R981 R982 V985Y927-F939 HydrophobicContact CD1-CD1 4.5Å; Y927-F939 HydrophobicContact CD2-CB 4.34Å; Y927-F939 AromaticContact CD2-CD1 3.53Å; Y927-F939 HydrophobicContact CD2-CD1 3.53Å; Y927-F939 HydrophobicContact CD2-CE1 4.26Å; Y927-F939 HydrophobicContact CD2-CG 4.3Å; Y927-F939 HydrophobicContact CE2-CD1 4.13Å; Y927-F939 AromaticContact CG-CD1 3.75Å; Y927-F939 HydrophobicContact CG-CD1 3.75Å; Y927-F939 HydrophobicContact CG-CE1 4.02Å; C935-F939 WeakPolarHBondContact O-CB 3.26Å; C935-F939 PolarHBondContact O-N 3.44Å; K936-F939 PolarHBondContact O-N 3.25Å; F939-R941 VanDerWaalsContact C-N 3.28Å; F939-R941 PolarHBondContact O-N 2.87Å; F939-T942 PolarHBondContact O-N 2.89Å; F939-V943 HydrophobicContact CD1-CG2 4.15Å; F939-V943 HydrophobicContact CE1-CG2 3.84Å; F939-V943 HydrophobicContact CE2-CG2 4.29Å; F939-V943 HydrophobicContact CZ-CG2 3.91Å; F939-V943 WeakPolarHBondContact O-CG2 3.1Å; F939-V943 PolarHBondContact O-N 3.07Å; F939-Y972 AromaticContact CD2-CD2 3.96Å; F939-Y972 HydrophobicContact CD2-CD2 3.96Å; F939-Y972 AromaticContact CD2-CE2 3.74Å; F939-Y972 HydrophobicContact CD2-CE2 3.74Å; F939-Y972 HydrophobicContact CE2-CD2 4.16Å; F939-Y972 AromaticContact CE2-CE2 3.61Å; F939-Y972 HydrophobicContact CE2-CE2 3.61Å; F939-C975 HydrophobicContact CD2-CB 3.73Å; F939-C975 HydrophobicContact CE2-CB 4.17Å; F939-L976 HydrophobicContact CE2-CD2 3.95Å; F939-L976 HydrophobicContact CZ-CD2 4.37Å; F939-M980 HydrophobicContact CB-SD 3.71Å; F939-M980 HydrophobicContact CD1-CB 4.33Å; F939-M980 HydrophobicContact CD1-SD 4.19Å; F939-M980 HydrophobicContact CD2-CB 3.84Å; F939-M980 HydrophobicContact CD2-CG 4.42Å; F939-M980 HydrophobicContact CD2-SD 3.72Å; F939-M980 HydrophobicContact CE1-CB 4.01Å; F939-M980 HydrophobicContact CE2-CB 3.49Å; F939-M980 VanDerWaalsContact CE2-CB 3.49Å; F939-M980 HydrophobicContact CE2-SD 4.37Å; F939-M980 HydrophobicContact CG-CB 4.25Å; F939-M980 HydrophobicContact CG-SD 3.61Å; F939-M980 HydrophobicContact CZ-CB 3.58Å; F939-M980 WeakPolarHBondContact CZ-O 3.45Å; F939-R981 WeakPolarHBondContact CE1-O 3.26Å; F939-R982 HydrophobicContact CZ-CB 4.48Å; F939-R982 HydrophobicContact CZ-CG 3.86Å; F939-V985 HydrophobicContact CD1-CG2 3.8Å; F939-V985 HydrophobicContact CE1-CG2 3.67Å
940K96Very high95.2Very high82 Ų8262.2 Ų62.236%0.35730%0.304SS..Hα-helixtrans-53.8-43.4174.6-170.6-171174.6-169.50112.1Y927 K936 F938 R944 V985Y927-K940 HydrophobicContact CE2-CB 4.42Å; Y927-K940 WeakPolarHBondContact OH-CB 3.23Å; K936-K940 WeakPolarHBondContact O-CB 3.3Å; K936-K940 PolarHBondContact O-N 3.49Å; F938-K940 VanDerWaalsContact C-N 3.33Å; F938-K940 PolarHBondContact O-N 3.24Å; K940-R944 VanDerWaalsContact O-CB 3.27Å; K940-R944 WeakPolarHBondContact O-CB 3.42Å; K940-R944 WeakPolarHBondContact O-CG 2.93Å; K940-R944 PolarHBondContact O-N 3.38Å; K940-R944 VanDerWaalsContact O-N 3.14Å; K940-V985 HydrophobicContact CG-CG1 4.37Å
941R95.4Very high95.1Very high154 Ų15460.7 Ų60.758%0.58130%0.3SS*.Hα-helixtrans-75.6-40.1-179.7-72.9-173-59.4-972.4112.5G937 F938 F939 K945G937-R941 WeakPolarHBondContact O-CG 3.37Å; G937-R941 VanDerWaalsContact O-CZ 3.29Å; G937-R941 PolarHBondContact O-N 2.9Å; G937-R941 PolarHBondContact O-NH1 2.79Å; F938-R941 PolarHBondContact O-N 3.1Å; F939-R941 VanDerWaalsContact C-N 3.28Å; F939-R941 PolarHBondContact O-N 2.87Å; R941-K945 PolarHBondContact O-N 2.94Å
942T96.3Very high95Very high1 Ų172.3 Ų72.31%0.00634%0.344CS..Hα-helixtrans-60-46.4177.7-51.20000111.1F938 F939 E946 L947 Y949 Y972F938-T942 PolarHBondContact O-N 3.37Å; F938-T942 PolarHBondContact O-OG1 3.31Å; F938-T942 VanDerWaalsContact O-OG1 3.08Å; F939-T942 PolarHBondContact O-N 2.89Å; T942-E946 WeakPolarHBondContact O-CA 3.3Å; T942-E946 PolarHBondContact O-N 3Å; T942-E946 VanDerWaalsContact O-N 3.16Å; T942-L947 HydrophobicContact CG2-CB 4.31Å; T942-L947 WeakPolarHBondContact CG2-O 3.38Å; T942-L947 PolarHBondContact O-N 3.35Å; T942-Y949 HydrophobicContact CG2-CD2 4.29Å; T942-Y949 HydrophobicContact CG2-CE2 3.46Å; T942-Y949 VanDerWaalsContact CG2-CE2 3.46Å; T942-Y949 WeakPolarHBondContact OG1-CE2 3.44Å; T942-Y949 PolarHBondContact OG1-OH 3.5Å; T942-Y972 HydrophobicContact CG2-CD1 4.02Å; T942-Y972 HydrophobicContact CG2-CD2 3.67Å; T942-Y972 HydrophobicContact CG2-CE1 3.89Å; T942-Y972 HydrophobicContact CG2-CE2 3.55Å; T942-Y972 HydrophobicContact CG2-CG 3.91Å
943V94.7Very high94.7Very high29 Ų2975.7 Ų75.718%0.17636%0.362CS..Hα-helixtrans-73.4-43.8-179.5179.90000112.1F939 K945 E946 Y972 R982 V985F939-V943 HydrophobicContact CD1-CG2 4.15Å; F939-V943 HydrophobicContact CE1-CG2 3.84Å; F939-V943 HydrophobicContact CE2-CG2 4.29Å; F939-V943 HydrophobicContact CZ-CG2 3.91Å; F939-V943 WeakPolarHBondContact O-CG2 3.1Å; F939-V943 PolarHBondContact O-N 3.07Å; V943-K945 PolarHBondContact O-N 2.86Å; V943-E946 PolarHBondContact O-N 2.73Å; V943-Y972 HydrophobicContact CG2-CE2 4.39Å; V943-R982 HydrophobicContact CG1-CB 4.43Å; V943-R982 HydrophobicContact CG2-CB 4.37Å; V943-R982 HydrophobicContact CG2-CG 4.07Å; V943-V985 HydrophobicContact CB-CB 4.19Å; V943-V985 HydrophobicContact CB-CG1 4.2Å; V943-V985 HydrophobicContact CB-CG2 3.98Å; V943-V985 HydrophobicContact CG1-CB 3.86Å; V943-V985 HydrophobicContact CG1-CG1 4.16Å; V943-V985 HydrophobicContact CG1-CG2 4.04Å; V943-V985 HydrophobicContact CG2-CG2 4.14Å
944R90.7Very high94.5Very high69 Ų6975.1 Ų75.126%0.2637%0.369SS..Hα-helixtrans-59.7-28.9178.9-94.8179.8160.949.410115.5K940 V985 Q986 E987 E988K940-R944 VanDerWaalsContact O-CB 3.27Å; K940-R944 WeakPolarHBondContact O-CB 3.42Å; K940-R944 WeakPolarHBondContact O-CG 2.93Å; K940-R944 PolarHBondContact O-N 3.38Å; K940-R944 VanDerWaalsContact O-N 3.14Å; R944-V985 HydrophobicContact CG-CG1 4.42Å; R944-Q986 VanDerWaalsContact CZ-O 3.27Å; R944-Q986 PolarHBondContact NH1-O 2.93Å; R944-Q986 PolarHBondContact NH2-O 3.17Å; R944-E987 PolarHBondContact NH2-O 3.23Å; R944-E988 IonicContact CZ-OE1 3.38Å; R944-E988 IonicContact NE-OE1 3.18Å; R944-E988 PolarHBondContact NE-OE1 3.42Å; R944-E988 IonicContact NE-OE2 3.2Å; R944-E988 PolarHBondContact NE-OE2 3.24Å; R944-E988 IonicContact NH2-OE1 2.78Å; R944-E988 PolarHBondContact NH2-OE1 3.12Å
945K89.5Confident94.3Very high160 Ų16079.2 Ų79.270%0.69638%0.38SS*.THydrogen-bonded Turntrans-115.614.6-175.5-68.1-163.7170.3-146.80112R941 V943 L947R941-K945 PolarHBondContact O-N 2.94Å; V943-K945 PolarHBondContact O-N 2.86Å; K945-L947 HydrophobicContact CB-CD1 4.1Å; K945-L947 HydrophobicContact CB-CD2 3.95Å; K945-L947 HydrophobicContact CB-CG 3.7Å; K945-L947 WeakPolarHBondContact O-CD2 3.2Å; K945-L947 WeakPolarHBondContact O-CG 3.39Å; K945-L947 PolarHBondContact O-N 3.4Å
946E88.5Confident94.1Very high156 Ų15686.1 Ų86.173%0.72941%0.412SS*.THydrogen-bonded Turntrans43.241180-53.9-159138.300114.2T942 V943 T948T942-E946 WeakPolarHBondContact O-CA 3.3Å; T942-E946 PolarHBondContact O-N 3Å; T942-E946 VanDerWaalsContact O-N 3.16Å; V943-E946 PolarHBondContact O-N 2.73Å; E946-T948 PolarHBondContact O-N 3.2Å; E946-T948 VanDerWaalsContact O-N 3.09Å
947L92.5Very high94.1Very high69 Ų6984.3 Ų84.336%0.36141%0.407SS..  trans-76.1104.4-168.2-62.8174.9000111.6T942 K945 Y949T942-L947 HydrophobicContact CG2-CB 4.31Å; T942-L947 WeakPolarHBondContact CG2-O 3.38Å; T942-L947 PolarHBondContact O-N 3.35Å; K945-L947 HydrophobicContact CB-CD1 4.1Å; K945-L947 HydrophobicContact CB-CD2 3.95Å; K945-L947 HydrophobicContact CB-CG 3.7Å; K945-L947 WeakPolarHBondContact O-CD2 3.2Å; K945-L947 WeakPolarHBondContact O-CG 3.39Å; K945-L947 PolarHBondContact O-N 3.4Å; L947-Y949 HydrophobicContact CB-CE1 3.84Å; L947-Y949 HydrophobicContact CD1-CE1 4.33Å
948T89.7Confident94Very high134 Ų13489.8 Ų89.882%0.82243%0.427SS*.  trans-70.9129.1163.7-62.70000110E946E946-T948 PolarHBondContact O-N 3.2Å; E946-T948 VanDerWaalsContact O-N 3.09Å
949Y94.7Very high93.9Very high34 Ų3489.6 Ų89.613%0.13343%0.426CS..  trans-109.1154.3174.5-58.6-50.8000110.4F938 T942 L947 Q968 Y969F938-Y949 AromaticContact CE2-CE2 3.81Å; F938-Y949 HydrophobicContact CE2-CE2 3.81Å; F938-Y949 HydrophobicContact CZ-CD2 4.25Å; F938-Y949 AromaticContact CZ-CE2 3.53Å; F938-Y949 HydrophobicContact CZ-CE2 3.53Å; T942-Y949 HydrophobicContact CG2-CD2 4.29Å; T942-Y949 HydrophobicContact CG2-CE2 3.46Å; T942-Y949 VanDerWaalsContact CG2-CE2 3.46Å; T942-Y949 WeakPolarHBondContact OG1-CE2 3.44Å; T942-Y949 PolarHBondContact OG1-OH 3.5Å; L947-Y949 HydrophobicContact CB-CE1 3.84Å; L947-Y949 HydrophobicContact CD1-CE1 4.33Å; Y949-Q968 HydrophobicContact CD1-CB 3.87Å; Y949-Q968 HydrophobicContact CD2-CB 3.76Å; Y949-Q968 HydrophobicContact CE1-CB 4.1Å; Y949-Q968 HydrophobicContact CE2-CB 3.97Å; Y949-Q968 HydrophobicContact CG-CB 3.71Å; Y949-Y969 VanDerWaalsContact O-CD2 3.25Å; Y949-Y969 WeakPolarHBondContact O-CD2 3.48Å
950I93.3Very high93.8Very high153 Ų15392.8 Ų92.879%0.78544%0.443SS*.  trans-115.2141172.2-59.9175.1000108.2
951C97.1Very high93.8Very high21 Ų2194.5 Ų94.514%0.14245%0.45CS..  trans-85.3141.2172.3-1650000110.7D953 Q955 C967 Y969C951-D953 PolarHBondContact SG-N 3.39Å; C951-D953 PolarHBondContact SG-O 3.19Å; C951-Q955 HydrophobicContact CB-CG 3.97Å; C951-C967 VanDerWaalsContact SG-SG 3.62Å; C951-Y969 HydrophobicContact CB-CD1 3.75Å; C951-Y969 HydrophobicContact CB-CE1 4.49Å; C951-Y969 HydrophobicContact CB-CG 4.03Å
952R93.9Very high93.8Very high244 Ų24498.4 Ų98.492%0.92147%0.465SS*.SBendtrans-95.5-11.7173.5-63.2-176-179.6-177.2-1.5113.6
953D92.5Very high93.7Very high75 Ų75102.7 Ų102.740%0.40149%0.488SS..SBendtrans-116.5-171176.7-38.5-47.2000109C951 Q955 C957C951-D953 PolarHBondContact SG-N 3.39Å; C951-D953 PolarHBondContact SG-O 3.19Å; D953-Q955 PolarHBondContact O-N 2.96Å; D953-C957 PolarHBondContact OD2-SG 3.16Å
954S92.7Very high93.7Very high84 Ų84103.4 Ų103.459%0.58749%0.487SS*.SBendtrans-64.523.6-175.665.10000117.8E956S954-E956 PolarHBondContact O-N 2.91Å; S954-E956 VanDerWaalsContact O-N 3.1Å; S954-E956 PolarHBondContact OG-OE2 2.8Å
955Q93.4Very high94Very high114 Ų114105.9 Ų105.953%0.53351%0.505SS..SBendtrans63.13.8-171.4-57.8-171.418.700115.7C951 D953 Y969 C970C951-Q955 HydrophobicContact CB-CG 3.97Å; D953-Q955 PolarHBondContact O-N 2.96Å; Q955-Y969 HydrophobicContact CB-CD1 4.44Å; Q955-Y969 HydrophobicContact CB-CE1 3.86Å; Q955-Y969 HydrophobicContact CG-CD1 4.36Å; Q955-Y969 HydrophobicContact CG-CE1 3.78Å; Q955-Y969 PolarHBondContact OE1-OH 3.22Å; Q955-C970 PolarHBondContact O-SG 3.37Å
956E94.8Very high94.3Very high145 Ų145106.9 Ų106.968%0.67851%0.505SS*.  trans-107.96.7-174.8-65.6176.6126.500115.2S954 Q958S954-E956 PolarHBondContact O-N 2.91Å; S954-E956 VanDerWaalsContact O-N 3.1Å; S954-E956 PolarHBondContact OG-OE2 2.8Å; E956-Q958 PolarHBondContact O-N 2.79Å
957C96.7Very high94.7Very high19 Ų1999.9 Ų99.913%0.12847%0.473CS..  trans-44.7127.2-174.1-42.80000113.5D953 I959 C967 C970D953-C957 PolarHBondContact OD2-SG 3.16Å; C957-I959 WeakPolarHBondContact O-CG1 3.41Å; C957-I959 PolarHBondContact O-N 2.85Å; C957-C967 HydrophobicContact CB-CB 3.77Å; C957-C967 VanDerWaalsContact SG-CB 3.52Å; C957-C970 HydrophobicContact CB-CB 3.82Å; C957-C970 PolarHBondContact SG-SG 3.35Å
958Q95Very high95Very high135 Ų135101.6 Ų101.663%0.63148%0.479SS*.  trans-63.7133.7-179.9-67.7-64.1-12.400112.6E956E956-Q958 PolarHBondContact O-N 2.79Å
959I97.2Very high95.3Very high3 Ų397.5 Ų97.52%0.01545%0.449CS..  trans-120.596.9-173.7-54.7-58.8000110I917 C918 C957 R964 C970 R971 K974I917-I959 HydrophobicContact CG2-CG2 4.05Å; I917-I959 WeakPolarHBondContact O-CG2 3.3Å; I917-I959 VanDerWaalsContact O-O 3.11Å; C918-I959 HydrophobicContact CB-CG2 4.03Å; C957-I959 WeakPolarHBondContact O-CG1 3.41Å; C957-I959 PolarHBondContact O-N 2.85Å; I959-R964 HydrophobicContact CG2-CB 4.01Å; I959-C970 HydrophobicContact CD1-CB 4.02Å; I959-C970 HydrophobicContact CG1-CB 4.33Å; I959-R971 HydrophobicContact CD1-CB 4.03Å; I959-R971 HydrophobicContact CG2-CB 4.45Å; I959-R971 HydrophobicContact CG2-CG 4.2Å; I959-K974 HydrophobicContact CB-CD 3.7Å; I959-K974 HydrophobicContact CG1-CD 4.12Å; I959-K974 HydrophobicContact CG2-CD 4.12Å; I959-K974 PolarHBondContact O-NZ 3.16Å
960D95.7Very high95.5Very high67 Ų6795.9 Ų95.936%0.35844%0.443SS..  trans-126.4173.1177-74.4-59.3000112C918 S919 R962 L963 R964C918-D960 CarbonylContact O-C 3.59Å; S919-D960 PolarHBondContact OG-OD1 2.97Å; D960-R962 PolarHBondContact O-N 3.36Å; D960-L963 PolarHBondContact O-N 3.06Å; D960-L963 VanDerWaalsContact O-N 3.07Å; D960-R964 VanDerWaalsContact O-CB 3.24Å; D960-R964 WeakPolarHBondContact O-CB 3.47Å; D960-R964 PolarHBondContact O-N 3.37Å
961K95.8Very high95.7Very high118 Ų11889.2 Ų89.251%0.51341%0.408SS..THydrogen-bonded Turntrans-48.2-40.4-177.6-179.7171.2-178.5152.40113.6C918 D920 R964C918-K961 WeakPolarHBondContact O-CA 3.25Å; C918-K961 PolarHBondContact O-N 3.33Å; D920-K961 HydrophobicContact CB-CB 4.2Å; D920-K961 HydrophobicContact CB-CD 4.07Å; D920-K961 HydrophobicContact CB-CG 4.04Å; D920-K961 WeakPolarHBondContact OD1-CD 3.29Å; D920-K961 WeakPolarHBondContact OD1-CE 3.34Å; D920-K961 IonicContact OD1-NZ 2.71Å; D920-K961 PolarHBondContact OD1-NZ 2.8Å; K961-R964 PolarHBondContact O-NE 2.94Å
962R95.5Very high95.8Very high236 Ų23690 Ų9089%0.89141%0.408SS*.THydrogen-bonded Turntrans-78.9-50.1175.7-66.9177.7175.2164.3-3.3112.3D960D960-R962 PolarHBondContact O-N 3.36Å
963L94Very high96Very high92 Ų9281.2 Ų81.248%0.48238%0.378SS..G310 helixtrans-88.2-7.1-168.7-61.4-179.6000115.3D960 N965 R966D960-L963 PolarHBondContact O-N 3.06Å; D960-L963 VanDerWaalsContact O-N 3.07Å; L963-N965 PolarHBondContact O-N 3.1Å; L963-R966 WeakPolarHBondContact O-CB 3.15Å; L963-R966 PolarHBondContact O-N 3.44Å
964R95.7Very high96.2Very high44 Ų4480.5 Ų80.517%0.16637%0.371CS..G310 helixtrans-55.1-17-178.264-175.1-179.1-161.7-5.1115.9C918 D920 C932 I959 D960 K961 R971C918-R964 HydrophobicContact CB-CB 3.96Å; C918-R964 VanDerWaalsContact SG-CD 3.56Å; C918-R964 PolarHBondContact SG-NH1 3.38Å; D920-R964 IonicContact OD2-CZ 3.64Å; D920-R964 IonicContact OD2-NH1 3.83Å; D920-R964 PolarHBondContact OD2-NH1 3.32Å; D920-R964 IonicContact OD2-NH2 2.7Å; D920-R964 PolarHBondContact OD2-NH2 3.09Å; C932-R964 PolarHBondContact SG-NH1 3.41Å; I959-R964 HydrophobicContact CG2-CB 4.01Å; D960-R964 VanDerWaalsContact O-CB 3.24Å; D960-R964 WeakPolarHBondContact O-CB 3.47Å; D960-R964 PolarHBondContact O-N 3.37Å; K961-R964 PolarHBondContact O-NE 2.94Å; R964-R971 VanDerWaalsContact O-CD 3.3Å; R964-R971 WeakPolarHBondContact O-CD 3.39Å; R964-R971 PolarHBondContact O-NH1 2.76Å
965N96.2Very high96.5Very high120 Ų12076.5 Ų76.564%0.64234%0.343SS*.G310 helixtrans-93-9.2175.8-69.1-1.4000113.4L963 R971L963-N965 PolarHBondContact O-N 3.1Å; N965-R971 PolarHBondContact OD1-NH1 2.74Å
966R95.1Very high96.7Very high182 Ų18273 Ų7369%0.68733%0.328SS*.SBendtrans-64.7-42.9-176.8172.961.7-177.6-152.30.2113.2L963L963-R966 WeakPolarHBondContact O-CB 3.15Å; L963-R966 PolarHBondContact O-N 3.44Å
967C97.7Very high96.8Very high9 Ų975 Ų756%0.06133%0.329CS..  trans-137.1118178.7179.50000110.7C951 C957 C970 R971C951-C967 VanDerWaalsContact SG-SG 3.62Å; C957-C967 HydrophobicContact CB-CB 3.77Å; C957-C967 VanDerWaalsContact SG-CB 3.52Å; C967-C970 HydrophobicContact CB-CB 4.22Å; C967-C970 PolarHBondContact SG-N 3Å; C967-C970 VanDerWaalsContact SG-N 3.41Å; C967-C970 PolarHBondContact SG-SG 2.8Å; C967-R971 WeakPolarHBondContact O-CB 3.25Å; C967-R971 PolarHBondContact O-N 3.28Å
968Q97.4Very high96.8Very high105 Ų10575.9 Ų75.949%0.49134%0.338SS..Hα-helixtrans-72.8-38.1179.3-66.4178.2-17.800111.8F938 Y949 R971 Y972F938-Q968 HydrophobicContact CE2-CB 4.1Å; F938-Q968 HydrophobicContact CE2-CG 4.15Å; F938-Q968 HydrophobicContact CZ-CB 4.28Å; F938-Q968 WeakPolarHBondContact CZ-O 3.37Å; Y949-Q968 HydrophobicContact CD1-CB 3.87Å; Y949-Q968 HydrophobicContact CD2-CB 3.76Å; Y949-Q968 HydrophobicContact CE1-CB 4.1Å; Y949-Q968 HydrophobicContact CE2-CB 3.97Å; Y949-Q968 HydrophobicContact CG-CB 3.71Å; Q968-R971 PolarHBondContact O-N 3.31Å; Q968-Y972 WeakPolarHBondContact O-CB 3.3Å; Q968-Y972 PolarHBondContact O-N 3.13Å
969Y98Very high96.9Very high47 Ų4771.3 Ų71.318%0.18433%0.327CS..Hα-helixtrans-56.3-59175.3178.4-91000111.7Y949 C951 Q955 R971 Y972 Q973Y949-Y969 VanDerWaalsContact O-CD2 3.25Å; Y949-Y969 WeakPolarHBondContact O-CD2 3.48Å; C951-Y969 HydrophobicContact CB-CD1 3.75Å; C951-Y969 HydrophobicContact CB-CE1 4.49Å; C951-Y969 HydrophobicContact CB-CG 4.03Å; Q955-Y969 HydrophobicContact CB-CD1 4.44Å; Q955-Y969 HydrophobicContact CB-CE1 3.86Å; Q955-Y969 HydrophobicContact CG-CD1 4.36Å; Q955-Y969 HydrophobicContact CG-CE1 3.78Å; Q955-Y969 PolarHBondContact OE1-OH 3.22Å; Y969-R971 VanDerWaalsContact C-N 3.25Å; Y969-R971 PolarHBondContact O-N 2.89Å; Y969-Y972 PolarHBondContact O-N 3.47Å; Y969-Q973 HydrophobicContact CD1-CG 4.03Å; Y969-Q973 HydrophobicContact CD2-CG 4.45Å; Y969-Q973 HydrophobicContact CE1-CG 3.56Å; Y969-Q973 HydrophobicContact CE2-CG 4.09Å; Y969-Q973 HydrophobicContact CG-CG 4.44Å; Y969-Q973 WeakPolarHBondContact O-CG 3.43Å; Y969-Q973 PolarHBondContact O-N 3.35Å; Y969-Q973 PolarHBondContact OH-NE2 2.87Å
970C98.2Very high96.9Very high1 Ų171.4 Ų71.41%0.00733%0.327CS..Hα-helixtrans-62.4-34-177.2-59.30000112.2Q955 C957 I959 C967 K974Q955-C970 PolarHBondContact O-SG 3.37Å; C957-C970 HydrophobicContact CB-CB 3.82Å; C957-C970 PolarHBondContact SG-SG 3.35Å; I959-C970 HydrophobicContact CD1-CB 4.02Å; I959-C970 HydrophobicContact CG1-CB 4.33Å; C967-C970 HydrophobicContact CB-CB 4.22Å; C967-C970 PolarHBondContact SG-N 3Å; C967-C970 VanDerWaalsContact SG-N 3.41Å; C967-C970 PolarHBondContact SG-SG 2.8Å; C970-K974 VanDerWaalsContact O-CB 3.28Å; C970-K974 WeakPolarHBondContact O-CB 3.42Å; C970-K974 PolarHBondContact O-N 3.46Å
971R98.3Very high96.8Very high13 Ų1370.8 Ų70.85%0.04932%0.32CS..Hα-helixtrans-63.8-45.2172-170.5-167.1-168.9146.7-11.4112I917 G934 F938 I959 R964 N965 C967 Q968 Y969 K974 C975I917-R971 HydrophobicContact CG2-CG 4.37Å; G934-R971 PolarHBondContact O-NH2 3.44Å; F938-R971 HydrophobicContact CD1-CG 3.99Å; F938-R971 HydrophobicContact CE1-CB 4.07Å; F938-R971 HydrophobicContact CE1-CG 3.78Å; F938-R971 HydrophobicContact CZ-CB 4.16Å; F938-R971 HydrophobicContact CZ-CG 4.24Å; I959-R971 HydrophobicContact CD1-CB 4.03Å; I959-R971 HydrophobicContact CG2-CB 4.45Å; I959-R971 HydrophobicContact CG2-CG 4.2Å; R964-R971 VanDerWaalsContact O-CD 3.3Å; R964-R971 WeakPolarHBondContact O-CD 3.39Å; R964-R971 PolarHBondContact O-NH1 2.76Å; N965-R971 PolarHBondContact OD1-NH1 2.74Å; C967-R971 WeakPolarHBondContact O-CB 3.25Å; C967-R971 PolarHBondContact O-N 3.28Å; Q968-R971 PolarHBondContact O-N 3.31Å; Y969-R971 VanDerWaalsContact C-N 3.25Å; Y969-R971 PolarHBondContact O-N 2.89Å; R971-K974 PolarHBondContact O-N 3.48Å; R971-C975 PolarHBondContact O-N 3.14Å; R971-C975 PolarHBondContact O-SG 3.36Å
972Y98.1Very high96.8Very high38 Ų3871.9 Ų71.915%0.14932%0.321CS..Hα-helixtrans-67.3-44.1178.4-174.1-129.9000111.5F938 F939 T942 V943 Q968 Y969 K974 C975 L976 R982F938-Y972 HydrophobicContact CE1-CD2 4.37Å; F939-Y972 AromaticContact CD2-CD2 3.96Å; F939-Y972 HydrophobicContact CD2-CD2 3.96Å; F939-Y972 AromaticContact CD2-CE2 3.74Å; F939-Y972 HydrophobicContact CD2-CE2 3.74Å; F939-Y972 HydrophobicContact CE2-CD2 4.16Å; F939-Y972 AromaticContact CE2-CE2 3.61Å; F939-Y972 HydrophobicContact CE2-CE2 3.61Å; T942-Y972 HydrophobicContact CG2-CD1 4.02Å; T942-Y972 HydrophobicContact CG2-CD2 3.67Å; T942-Y972 HydrophobicContact CG2-CE1 3.89Å; T942-Y972 HydrophobicContact CG2-CE2 3.55Å; T942-Y972 HydrophobicContact CG2-CG 3.91Å; V943-Y972 HydrophobicContact CG2-CE2 4.39Å; Q968-Y972 WeakPolarHBondContact O-CB 3.3Å; Q968-Y972 PolarHBondContact O-N 3.13Å; Y969-Y972 PolarHBondContact O-N 3.47Å; Y972-K974 VanDerWaalsContact C-N 3.27Å; Y972-K974 PolarHBondContact O-N 3.34Å; Y972-C975 WeakPolarHBondContact O-CA 3.23Å; Y972-C975 VanDerWaalsContact O-CB 3.29Å; Y972-C975 WeakPolarHBondContact O-CB 3.11Å; Y972-C975 PolarHBondContact O-N 3.21Å; Y972-L976 HydrophobicContact CD1-CD1 4.21Å; Y972-L976 HydrophobicContact CE1-CD1 3.97Å; Y972-L976 HydrophobicContact CE2-CD1 4.5Å; Y972-L976 HydrophobicContact CE2-CD2 4.44Å; Y972-L976 HydrophobicContact CE2-CG 4.39Å; Y972-L976 WeakPolarHBondContact O-CG 3.38Å; Y972-L976 PolarHBondContact O-N 2.73Å; Y972-R982 WeakPolarHBondContact OH-CD 3.48Å
973Q97.4Very high96.6Very high59 Ų5966.3 Ų66.328%0.27631%0.305SS..Hα-helixtrans-62.4-32.4173-62.4-59.61.200112.6Y969 R977Y969-Q973 HydrophobicContact CD1-CG 4.03Å; Y969-Q973 HydrophobicContact CD2-CG 4.45Å; Y969-Q973 HydrophobicContact CE1-CG 3.56Å; Y969-Q973 HydrophobicContact CE2-CG 4.09Å; Y969-Q973 HydrophobicContact CG-CG 4.44Å; Y969-Q973 WeakPolarHBondContact O-CG 3.43Å; Y969-Q973 PolarHBondContact O-N 3.35Å; Y969-Q973 PolarHBondContact OH-NE2 2.87Å; Q973-R977 VanDerWaalsContact O-CB 3.29Å; Q973-R977 WeakPolarHBondContact O-CB 3.37Å; Q973-R977 VanDerWaalsContact O-CG 3.27Å; Q973-R977 WeakPolarHBondContact O-CG 3.34Å; Q973-R977 PolarHBondContact O-N 3.47Å; Q973-R977 PolarHBondContact O-NE 3.49Å
974K97.8Very high96.5Very high59 Ų5963.8 Ų63.826%0.25730%0.297SS..Hα-helixtrans-74.6-30.6171.8-164.4175.5179-174.60112.7I917 I959 C970 R971 Y972 A978I917-K974 HydrophobicContact CG2-CB 4.45Å; I917-K974 HydrophobicContact CG2-CG 4.45Å; I917-K974 WeakPolarHBondContact O-CD 3.42Å; I917-K974 WeakPolarHBondContact O-CE 3.32Å; I917-K974 PolarHBondContact O-NZ 3.25Å; I959-K974 HydrophobicContact CB-CD 3.7Å; I959-K974 HydrophobicContact CG1-CD 4.12Å; I959-K974 HydrophobicContact CG2-CD 4.12Å; I959-K974 PolarHBondContact O-NZ 3.16Å; C970-K974 VanDerWaalsContact O-CB 3.28Å; C970-K974 WeakPolarHBondContact O-CB 3.42Å; C970-K974 PolarHBondContact O-N 3.46Å; R971-K974 PolarHBondContact O-N 3.48Å; Y972-K974 VanDerWaalsContact C-N 3.27Å; Y972-K974 PolarHBondContact O-N 3.34Å; K974-A978 WeakPolarHBondContact O-CB 3.21Å; K974-A978 PolarHBondContact O-N 3.3Å
975C98.3Very high96.3Very high0 Ų062.7 Ų62.70%030%0.295CS..Hα-helixtrans-61.5-49.3168.8-65.60000110.8I917 F939 R971 Y972 A978 G979 M980I917-C975 HydrophobicContact CG1-CB 4.38Å; F939-C975 HydrophobicContact CD2-CB 3.73Å; F939-C975 HydrophobicContact CE2-CB 4.17Å; R971-C975 PolarHBondContact O-N 3.14Å; R971-C975 PolarHBondContact O-SG 3.36Å; Y972-C975 WeakPolarHBondContact O-CA 3.23Å; Y972-C975 VanDerWaalsContact O-CB 3.29Å; Y972-C975 WeakPolarHBondContact O-CB 3.11Å; Y972-C975 PolarHBondContact O-N 3.21Å; C975-A978 PolarHBondContact O-N 3.34Å; C975-G979 PolarHBondContact O-N 3.02Å; C975-M980 HydrophobicContact CB-CB 4.12Å; C975-M980 HydrophobicContact CB-CG 4.07Å; C975-M980 HydrophobicContact CB-SD 3.61Å; C975-M980 VanDerWaalsContact O-CB 3.27Å; C975-M980 WeakPolarHBondContact O-CB 3.3Å; C975-M980 PolarHBondContact O-N 3.41Å
976L97.4Very high95.8Very high42 Ų4263.8 Ų63.822%0.2230%0.296CS..Hα-helixtrans-63.7-49.4178.7-65.1173.7000111.5F939 Y972 A978 G979 R982F939-L976 HydrophobicContact CE2-CD2 3.95Å; F939-L976 HydrophobicContact CZ-CD2 4.37Å; Y972-L976 HydrophobicContact CD1-CD1 4.21Å; Y972-L976 HydrophobicContact CE1-CD1 3.97Å; Y972-L976 HydrophobicContact CE2-CD1 4.5Å; Y972-L976 HydrophobicContact CE2-CD2 4.44Å; Y972-L976 HydrophobicContact CE2-CG 4.39Å; Y972-L976 WeakPolarHBondContact O-CG 3.38Å; Y972-L976 PolarHBondContact O-N 2.73Å; L976-A978 VanDerWaalsContact C-N 3.27Å; L976-A978 PolarHBondContact O-N 2.88Å; L976-G979 WeakPolarHBondContact O-CA 3.36Å; L976-G979 PolarHBondContact O-N 3.38Å; L976-R982 HydrophobicContact CD2-CG 3.99Å
977R97Very high95Very high185 Ų18561.4 Ų61.470%0.69829%0.293SS*.Hα-helixtrans-60.6-30.8175.8-75.5-176.6-72.3167.9-9.7113.9Q973 G979Q973-R977 VanDerWaalsContact O-CB 3.29Å; Q973-R977 WeakPolarHBondContact O-CB 3.37Å; Q973-R977 VanDerWaalsContact O-CG 3.27Å; Q973-R977 WeakPolarHBondContact O-CG 3.34Å; Q973-R977 PolarHBondContact O-N 3.47Å; Q973-R977 PolarHBondContact O-NE 3.49Å; R977-G979 PolarHBondContact O-N 3.38Å
978A96.5Very high93.9Very high39 Ų3965.3 Ų65.332%0.32231%0.311SS..THydrogen-bonded Turntrans-74.7-10.7173.200000113.5I917 V929 K974 C975 L976I917-A978 HydrophobicContact CD1-CB 4Å; I917-A978 HydrophobicContact CG1-CB 4.22Å; V929-A978 WeakPolarHBondContact CG1-O 3.46Å; K974-A978 WeakPolarHBondContact O-CB 3.21Å; K974-A978 PolarHBondContact O-N 3.3Å; C975-A978 PolarHBondContact O-N 3.34Å; L976-A978 VanDerWaalsContact C-N 3.27Å; L976-A978 PolarHBondContact O-N 2.88Å
979G96.9Very high92.7Very high38 Ų3869.3 Ų69.339%0.39232%0.321SS..THydrogen-bonded Turntrans100.119.9-18000000115.5V929 C975 L976 R977 R981V929-G979 WeakPolarHBondContact CG1-O 3.21Å; C975-G979 PolarHBondContact O-N 3.02Å; L976-G979 WeakPolarHBondContact O-CA 3.36Å; L976-G979 PolarHBondContact O-N 3.38Å; R977-G979 PolarHBondContact O-N 3.38Å; G979-R981 PolarHBondContact O-N 2.81Å
980M97.8Very high91Very high6 Ų673.3 Ų73.33%0.0334%0.342CS..  trans-67.6115.7174-74.1-164.6156.700111.3I917 Y927 V929 S931 F939 C975I917-M980 HydrophobicContact CD1-CE 3.93Å; I917-M980 HydrophobicContact CD1-SD 4.45Å; Y927-M980 WeakPolarHBondContact O-CA 3.46Å; V929-M980 HydrophobicContact CB-CG 4.49Å; V929-M980 HydrophobicContact CG1-CG 4.17Å; V929-M980 HydrophobicContact CG2-CE 3.56Å; V929-M980 HydrophobicContact CG2-CG 3.45Å; V929-M980 VanDerWaalsContact CG2-CG 3.45Å; V929-M980 HydrophobicContact CG2-SD 4.34Å; S931-M980 WeakPolarHBondContact OG-CE 3.42Å; F939-M980 HydrophobicContact CB-SD 3.71Å; F939-M980 HydrophobicContact CD1-CB 4.33Å; F939-M980 HydrophobicContact CD1-SD 4.19Å; F939-M980 HydrophobicContact CD2-CB 3.84Å; F939-M980 HydrophobicContact CD2-CG 4.42Å; F939-M980 HydrophobicContact CD2-SD 3.72Å; F939-M980 HydrophobicContact CE1-CB 4.01Å; F939-M980 HydrophobicContact CE2-CB 3.49Å; F939-M980 VanDerWaalsContact CE2-CB 3.49Å; F939-M980 HydrophobicContact CE2-SD 4.37Å; F939-M980 HydrophobicContact CG-CB 4.25Å; F939-M980 HydrophobicContact CG-SD 3.61Å; F939-M980 HydrophobicContact CZ-CB 3.58Å; F939-M980 WeakPolarHBondContact CZ-O 3.45Å; C975-M980 HydrophobicContact CB-CB 4.12Å; C975-M980 HydrophobicContact CB-CG 4.07Å; C975-M980 HydrophobicContact CB-SD 3.61Å; C975-M980 VanDerWaalsContact O-CB 3.27Å; C975-M980 WeakPolarHBondContact O-CB 3.3Å; C975-M980 PolarHBondContact O-N 3.41Å
981R94.6Very high89.1Confident53 Ų5378.2 Ų78.220%0.237%0.365CS..  trans-78113.7-178.1-75.8175.2174.9-92.87111.8Y927 F939 G979 E983 A984Y927-R981 WeakPolarHBondContact O-CB 3.5Å; Y927-R981 PolarHBondContact O-N 3.46Å; F939-R981 WeakPolarHBondContact CE1-O 3.26Å; G979-R981 PolarHBondContact O-N 2.81Å; R981-E983 VanDerWaalsContact C-N 3.29Å; R981-E983 WeakPolarHBondContact CA-OE2 3.21Å; R981-E983 VanDerWaalsContact CB-OE1 3.32Å; R981-E983 WeakPolarHBondContact CB-OE1 3.4Å; R981-E983 VanDerWaalsContact CB-OE2 3.25Å; R981-E983 WeakPolarHBondContact CB-OE2 3.38Å; R981-E983 WeakPolarHBondContact CD-OE1 3.47Å; R981-E983 WeakPolarHBondContact CG-OE1 3.46Å; R981-E983 IonicContact CZ-OE1 3.64Å; R981-E983 IonicContact NE-OE1 3.92Å; R981-E983 IonicContact NH1-OE1 2.68Å; R981-E983 PolarHBondContact NH1-OE1 3.2Å; R981-E983 PolarHBondContact O-N 2.92Å; R981-A984 HydrophobicContact CB-CB 3.77Å; R981-A984 WeakPolarHBondContact O-CB 3.47Å; R981-A984 PolarHBondContact O-N 2.83Å
982R94.3Very high86.9Confident141 Ų14184.4 Ų84.453%0.53239%0.394SS..G310 helixtrans-62.1-40.1175.8-65.5-171.6-68.8-109.75.9110.9F939 V943 Y972 L976 A984 V985F939-R982 HydrophobicContact CZ-CB 4.48Å; F939-R982 HydrophobicContact CZ-CG 3.86Å; V943-R982 HydrophobicContact CG1-CB 4.43Å; V943-R982 HydrophobicContact CG2-CB 4.37Å; V943-R982 HydrophobicContact CG2-CG 4.07Å; Y972-R982 WeakPolarHBondContact OH-CD 3.48Å; L976-R982 HydrophobicContact CD2-CG 3.99Å; R982-A984 PolarHBondContact O-N 2.92Å; R982-A984 VanDerWaalsContact O-N 3.11Å; R982-V985 WeakPolarHBondContact O-CB 3.46Å; R982-V985 PolarHBondContact O-N 3.38Å
983E92.2Very high84.7Confident120 Ų12088.4 Ų88.456%0.56141%0.414SS*.G310 helixtrans-68.1-7.4178.382.5-67.9174.400114.3R981R981-E983 VanDerWaalsContact C-N 3.29Å; R981-E983 WeakPolarHBondContact CA-OE2 3.21Å; R981-E983 VanDerWaalsContact CB-OE1 3.32Å; R981-E983 WeakPolarHBondContact CB-OE1 3.4Å; R981-E983 VanDerWaalsContact CB-OE2 3.25Å; R981-E983 WeakPolarHBondContact CB-OE2 3.38Å; R981-E983 WeakPolarHBondContact CD-OE1 3.47Å; R981-E983 WeakPolarHBondContact CG-OE1 3.46Å; R981-E983 IonicContact CZ-OE1 3.64Å; R981-E983 IonicContact NE-OE1 3.92Å; R981-E983 IonicContact NH1-OE1 2.68Å; R981-E983 PolarHBondContact NH1-OE1 3.2Å; R981-E983 PolarHBondContact O-N 2.92Å
984A91.9Very high82.8Confident39 Ų3990.8 Ų90.832%0.32243%0.428SS..G310 helixtrans-89.1-1.6171.700000113.3Y927 R981 R982 Q986Y927-A984 HydrophobicContact CD1-CB 3.95Å; Y927-A984 WeakPolarHBondContact CD1-O 3.46Å; Y927-A984 WeakPolarHBondContact CE1-O 3.37Å; R981-A984 HydrophobicContact CB-CB 3.77Å; R981-A984 WeakPolarHBondContact O-CB 3.47Å; R981-A984 PolarHBondContact O-N 2.83Å; R982-A984 PolarHBondContact O-N 2.92Å; R982-A984 VanDerWaalsContact O-N 3.11Å; A984-Q986 PolarHBondContact O-N 3.44Å
985V92.1Very high80.7Confident20 Ų2094.5 Ų94.512%0.12145%0.446CS..SBendtrans-91.996.2175.4-174.60000109.1Y927 F939 K940 V943 R944 R982Y927-V985 HydrophobicContact CD1-CG2 3.7Å; Y927-V985 HydrophobicContact CE1-CB 4.34Å; Y927-V985 HydrophobicContact CE1-CG2 3.67Å; Y927-V985 HydrophobicContact CG-CG2 4.27Å; F939-V985 HydrophobicContact CD1-CG2 3.8Å; F939-V985 HydrophobicContact CE1-CG2 3.67Å; K940-V985 HydrophobicContact CG-CG1 4.37Å; V943-V985 HydrophobicContact CB-CB 4.19Å; V943-V985 HydrophobicContact CB-CG1 4.2Å; V943-V985 HydrophobicContact CB-CG2 3.98Å; V943-V985 HydrophobicContact CG1-CB 3.86Å; V943-V985 HydrophobicContact CG1-CG1 4.16Å; V943-V985 HydrophobicContact CG1-CG2 4.04Å; V943-V985 HydrophobicContact CG2-CG2 4.14Å; R944-V985 HydrophobicContact CG-CG1 4.42Å; R982-V985 WeakPolarHBondContact O-CB 3.46Å; R982-V985 PolarHBondContact O-N 3.38Å
986Q85.7Confident78.3Confident143 Ų14397.2 Ų97.267%0.66847%0.465SS*.  trans-54.2147.4170.4-67.4177.6-14.300111.5R944 A984R944-Q986 VanDerWaalsContact CZ-O 3.27Å; R944-Q986 PolarHBondContact NH1-O 2.93Å; R944-Q986 PolarHBondContact NH2-O 3.17Å; A984-Q986 PolarHBondContact O-N 3.44Å
987E78.2Confident76.1Confident132 Ų132101.9 Ų101.962%0.61749%0.486SS*.  trans-67.6-179.5177.5-160.8161.3179.600113.5R944 Q991R944-E987 PolarHBondContact NH2-O 3.23Å; E987-Q991 PolarHBondContact OE1-NE2 2.94Å; E987-Q991 PolarHBondContact OE1-OE1 3.44Å
988E74.6Confident74.2Confident92 Ų9297.7 Ų97.743%0.4348%0.48SS..  trans-79.6124.4176-150.176.4-83.900111.1R944 Q990R944-E988 IonicContact CZ-OE1 3.38Å; R944-E988 IonicContact NE-OE1 3.18Å; R944-E988 PolarHBondContact NE-OE1 3.42Å; R944-E988 IonicContact NE-OE2 3.2Å; R944-E988 PolarHBondContact NE-OE2 3.24Å; R944-E988 IonicContact NH2-OE1 2.78Å; R944-E988 PolarHBondContact NH2-OE1 3.12Å; E988-Q990 PolarHBondContact O-N 3.45Å; E988-Q990 VanDerWaalsContact O-N 3.08Å
989R71.1Confident72.1Confident189 Ų189102.2 Ų102.271%0.71350%0.495SS*.THydrogen-bonded Turntrans-68.5-9.6-175.2-63.1-175.1-173.3170.21114.7Q991 Q992R989-Q991 PolarHBondContact O-N 2.94Å; R989-Q992 PolarHBondContact O-N 2.91Å
990Q61.8Low69.7Low131 Ų131110.6 Ų110.661%0.61252%0.515SS*.Hα-helixtrans-71.1-26.7-171.6-69.5178.9-15.600113.5E988 Q992 Q993 L994E988-Q990 PolarHBondContact O-N 3.45Å; E988-Q990 VanDerWaalsContact O-N 3.08Å; Q990-Q992 PolarHBondContact O-N 3.1Å; Q990-Q993 PolarHBondContact O-N 3.5Å; Q990-Q993 VanDerWaalsContact O-N 3.1Å; Q990-L994 PolarHBondContact O-N 3.48Å
991Q58.6Low66.5Low104 Ų104114.7 Ų114.749%0.48654%0.544SS..Hα-helixtrans-56.6-36175.5-69171.6-0.300112.5E987 R989 Q995E987-Q991 PolarHBondContact OE1-NE2 2.94Å; E987-Q991 PolarHBondContact OE1-OE1 3.44Å; R989-Q991 PolarHBondContact O-N 2.94Å; Q991-Q995 PolarHBondContact O-N 3.12Å
992Q52.3Low63.5Low143 Ų143118 Ų11867%0.66857%0.572SS**Hα-helixtrans-73.3-26.1-179.7-68.3-178-1900113R989 Q990 S996R989-Q992 PolarHBondContact O-N 2.91Å; Q990-Q992 PolarHBondContact O-N 3.1Å; Q992-S996 WeakPolarHBondContact O-CB 3.5Å; Q992-S996 PolarHBondContact O-N 2.85Å; Q992-S996 PolarHBondContact O-OG 3.46Å
993Q53.1Low60.8Low121 Ų121116.7 Ų116.757%0.56558%0.58SS**Hα-helixtrans-70.8-50.1178.5-64-175.4-78.700110.1Q990 Q995 S996 E997Q990-Q993 PolarHBondContact O-N 3.5Å; Q990-Q993 VanDerWaalsContact O-N 3.1Å; Q993-Q995 VanDerWaalsContact C-N 3.28Å; Q993-Q995 PolarHBondContact O-N 3Å; Q993-S996 PolarHBondContact O-N 3.49Å; Q993-S996 PolarHBondContact O-OG 2.9Å; Q993-E997 PolarHBondContact O-N 3.36Å
994L57.3Low57.8Low110 Ų110117 Ų11758%0.57659%0.593SS**Hα-helixtrans-55.9-38176.2-68.9167.6000113.1Q990 V998Q990-L994 PolarHBondContact O-N 3.48Å; L994-V998 WeakPolarHBondContact O-CG2 3.36Å
995Q53.2Low54.9Low137 Ų137120.7 Ų120.764%0.6461%0.613SS**Hα-helixtrans-72.6-37.8175-70.5179.3-10.800112.8Q991 Q993 E997Q991-Q995 PolarHBondContact O-N 3.12Å; Q993-Q995 VanDerWaalsContact C-N 3.28Å; Q993-Q995 PolarHBondContact O-N 3Å; Q995-E997 VanDerWaalsContact C-N 3.32Å; Q995-E997 PolarHBondContact O-N 3.01Å
996S47.3Very low51.9Low56 Ų56128.4 Ų128.439%0.39265%0.648SS.*Hα-helixtrans-71.8-24.1-179.771.50000114.3Q992 Q993Q992-S996 WeakPolarHBondContact O-CB 3.5Å; Q992-S996 PolarHBondContact O-N 2.85Å; Q992-S996 PolarHBondContact O-OG 3.46Å; Q993-S996 PolarHBondContact O-N 3.49Å; Q993-S996 PolarHBondContact O-OG 2.9Å
997E52.5Low49.2Very low140 Ų140130.1 Ų130.165%0.65466%0.656SS**Hα-helixtrans-76.9-38-178.7-156.8143.9-138.200111Q993 Q995 Q999 R1000Q993-E997 PolarHBondContact O-N 3.36Å; Q995-E997 VanDerWaalsContact C-N 3.32Å; Q995-E997 PolarHBondContact O-N 3.01Å; E997-Q999 PolarHBondContact O-N 2.95Å; E997-R1000 PolarHBondContact O-N 3.03Å
998V57Low46.8Very low97 Ų97131.3 Ų131.359%0.58867%0.667SS**Hα-helixtrans-64-20.4173.6175.40000113.2L994L994-V998 WeakPolarHBondContact O-CG2 3.36Å
999Q51.3Low44.5Very low135 Ų135133.2 Ų133.263%0.63169%0.689SS**THydrogen-bonded Turntrans-102.99.4-177.5-67.9-170.9-42.800114.7E997E997-Q999 PolarHBondContact O-N 2.95Å
1000R46.2Very low42.5Very low213 Ų213131.5 Ų131.580%0.80469%0.694SS**SBendtrans-120.610.3-175.2-76.8-173.7176.1-127.9-2116.1E997 P1002E997-R1000 PolarHBondContact O-N 3.03Å; R1000-P1002 WeakPolarHBondContact O-CD 3.38Å
1001S30.4Very low41.2Very low92 Ų92133.4 Ų133.464%0.64371%0.707SS**  trans-112.287.2179.956.10000113.4T1003S1001-T1003 PolarHBondContact O-N 3.47Å
1002P33.1Very low39.7Very low122 Ų122132.6 Ų132.679%0.79271%0.713SS**  trans-92.871.9-179.637.2-36.4000113.5R1000R1000-P1002 WeakPolarHBondContact O-CD 3.38Å
1003T37.2Very low38.9Very low114 Ų114129.8 Ų129.870%0.69971%0.705SS**SBendtrans-172.8150.4159.926.90000108.6S1001 P1005S1001-T1003 PolarHBondContact O-N 3.47Å; T1003-P1005 VanDerWaalsContact O-CD 3.25Å; T1003-P1005 WeakPolarHBondContact O-CD 3.26Å
1004P28.3Very low37.9Very low127 Ų127128.6 Ų128.683%0.82570%0.703SS**  trans-80.3115.8169.731.4-30.3000110.8
1005P31.5Very low36.7Very low116 Ų116127.4 Ų127.475%0.75370%0.704SS**  trans-96.3129.7175.55.616.7000110.4T1003T1003-P1005 VanDerWaalsContact O-CD 3.25Å; T1003-P1005 WeakPolarHBondContact O-CD 3.26Å
1006E29.2Very low35.9Very low183 Ų183129 Ų12986%0.85571%0.714SS**  trans-76.3129.7169.4-61.9178.6124.700110.4
1007Q29Very low35.4Very low178 Ų178132.6 Ų132.683%0.83273%0.727SS**SBendtrans67.4151.6165.1-55.21780.800117.7
1008N28.1Very low34.5Very low158 Ų158133 Ų13385%0.84573%0.731SS**  trans55.8101.7175.3-68.2-24.9000118.8
1009C26.8Very low33.3Very low132 Ų132132.8 Ų132.889%0.89273%0.733SS**  -169.6147111.944.50000113.4
1010D27.7Very low32.4Very low152 Ų152132.5 Ų132.581%0.81374%0.736SS**  trans-86.5174.7177.9-81.7-69.8000114
1011L34.9Very low31.8Very low171 Ų171127.7 Ų127.790%0.89573%0.731SS**  trans98.9155.2156.1-64.2142.6000119.9
1012S28.3Very low31.8Very low88 Ų88132.3 Ų132.362%0.61574%0.739SS**SBendtrans74.741.7161.4-145.70000120.2
1013V34.4Very low31.8Very low83 Ų83134.5 Ų134.550%0.50374%0.743SS.*SBendtrans-126.7-34.9150.9-175.60000111.8S1015V1013-S1015 PolarHBondContact O-N 3.21Å; V1013-S1015 VanDerWaalsContact O-N 3.1Å
1014N32.2Very low31.5Very low96 Ų96135.6 Ų135.651%0.51375%0.749SS.*G310 helixtrans-68.2-13.4-172.5-59.55000114.6M1016 I1017 M1018N1014-M1016 VanDerWaalsContact C-N 3.32Å; N1014-M1016 PolarHBondContact O-N 3.47Å; N1014-I1017 PolarHBondContact O-N 2.99Å; N1014-M1018 PolarHBondContact O-N 2.87Å
1015S32.7Very low31.4Very low86 Ų86137.8 Ų137.860%0.60175%0.754SS**G310 helixtrans-69-23.3-178.750.60000114.6V1013V1013-S1015 PolarHBondContact O-N 3.21Å; V1013-S1015 VanDerWaalsContact O-N 3.1Å
1016M35.6Very low31.2Very low170 Ų170136.5 Ų136.584%0.83775%0.753SS**G310 helixtrans-81.1-18.6179.5-154.880.8174.400112.8N1014N1014-M1016 VanDerWaalsContact C-N 3.32Å; N1014-M1016 PolarHBondContact O-N 3.47Å
1017I37.3Very low31.3Very low132 Ų132136.2 Ų136.268%0.67775%0.754SS**THydrogen-bonded Turntrans-105.3-23.2-168.9-63.4176.5000112.3N1014 S1019N1014-I1017 PolarHBondContact O-N 2.99Å; I1017-S1019 PolarHBondContact O-N 3.47Å
1018M33.2Very low31.5Very low149 Ų149133.6 Ų133.673%0.73475%0.745SS**SBendtrans-9422.1-178.6-58.3-165.778.700114.9N1014N1014-M1018 PolarHBondContact O-N 2.87Å
1019S32.4Very low31.8Very low91 Ų91133.9 Ų133.964%0.63674%0.741SS**SBendtrans-94.7-30.8-176.4-69.50000115.2I1017I1017-S1019 PolarHBondContact O-N 3.47Å
1020D32.9Very low32.3Very low129 Ų129130.2 Ų130.269%0.6972%0.717SS**SBendtrans-109.78.4-168.8-70.8-37.1000114.5K1022D1020-K1022 PolarHBondContact O-N 3.31Å
1021T32.4Very low32.4Very low113 Ų113126.5 Ų126.569%0.69370%0.702SS**  trans-80.976.1-17855.80000113.1
1022K31.6Very low32.6Very low189 Ų189123.5 Ų123.582%0.82269%0.687SS**  trans-132134.9153.1-71.2-171.2178.5-177.20108.7D1020D1020-K1022 PolarHBondContact O-N 3.31Å
1023I31.7Very low32.8Very low168 Ų168122.4 Ų122.486%0.86268%0.683SS**SBendtrans7978.6-168.2-45.9160.8000113.1
1024T31.2Very low32.9Very low136 Ų136123.2 Ų123.283%0.83468%0.681SS**  trans177.595.6133.738.80000109.5
1025N27.2Very low33.2Very low173 Ų173125.7 Ų125.793%0.92569%0.688SS**  trans-108.185.9173-83.69000110.7
1026A27Very low33.5Very low89 Ų89124.5 Ų124.574%0.73667%0.672SS**  trans-174.5154.6156.900000111.8
1027M30.7Very low33.5Very low178 Ų178121.8 Ų121.888%0.87766%0.658SS**  trans89.488.7164.6-54.5-170.4177.900119.5
1028N32.8Very low33.5Very low122 Ų122121.4 Ų121.465%0.65266%0.656SS**  trans46.4111.4134.7-58.911.1000120.5
1029H34.9Very low33.5Very low164 Ų164118.9 Ų118.976%0.75964%0.643SS**  trans-90.81.9179.2-120.1-86.8000115.6C1031H1029-C1031 PolarHBondContact O-N 3.37Å
1030S36.8Very low33.7Very low55 Ų55117.6 Ų117.639%0.38563%0.629SS.*G310 helixtrans-68.1-33.3-16546.80000115.5L1032S1030-L1032 VanDerWaalsContact C-N 3.3Å; S1030-L1032 PolarHBondContact O-N 2.96Å
1031C30.5Very low33.8Very low74 Ų74118.6 Ų118.650%0.563%0.627SS.*G310 helixtrans-73.3-14.1-168.3-166.20000115H1029H1029-C1031 PolarHBondContact O-N 3.37Å
1032L38.6Very low33.8Very low108 Ų108118.2 Ų118.257%0.56563%0.625SS**G310 helixtrans-85.8-31.8-175-101.5124.4000114.7S1030 Q1036S1030-L1032 VanDerWaalsContact C-N 3.3Å; S1030-L1032 PolarHBondContact O-N 2.96Å; L1032-Q1036 WeakPolarHBondContact O-CG 3.3Å
1033A33.7Very low33.8Very low65 Ų65113.6 Ų113.654%0.53761%0.612SS.*Hα-helixtrans-70.8-47.9-172.600000112.5K1035 Q1036 E1037A1033-K1035 VanDerWaalsContact C-N 3.26Å; A1033-K1035 PolarHBondContact O-N 2.94Å; A1033-Q1036 PolarHBondContact O-N 2.69Å; A1033-E1037 PolarHBondContact O-N 2.94Å
1034E35.8Very low33.5Very low101 Ų101112.7 Ų112.747%0.47261%0.609SS.*Hα-helixtrans-65.4-24.4-169.3-160.9170.6-146.700113.7I1475E1034-I1475 WeakPolarHBondContact OE1-CG2 3.32Å
1035K38.9Very low33.3Very low148 Ų148112.5 Ų112.564%0.64361%0.612SS**Hα-helixtrans-91.1-18.9173.9-70.9-159.1173.1-161.90114.6A1033A1033-K1035 VanDerWaalsContact C-N 3.26Å; A1033-K1035 PolarHBondContact O-N 2.94Å
1036Q38.3Very low33.3Very low60 Ų60111.2 Ų111.228%0.2861%0.611SS.*Hα-helixtrans-73.5-33.6175.9-72.7178.6-19.800111.6L1032 A1033 I1038 M1039 L1040 L1118L1032-Q1036 WeakPolarHBondContact O-CG 3.3Å; A1033-Q1036 PolarHBondContact O-N 2.69Å; Q1036-I1038 PolarHBondContact O-N 3Å; Q1036-M1039 PolarHBondContact O-N 3.43Å; Q1036-M1039 VanDerWaalsContact O-N 3.15Å; Q1036-L1040 WeakPolarHBondContact O-CG 3.31Å; Q1036-L1040 PolarHBondContact O-N 2.99Å; Q1036-L1040 VanDerWaalsContact O-N 3.08Å; Q1036-L1118 HydrophobicContact CB-CD1 4.14Å; Q1036-L1118 HydrophobicContact CG-CD1 3.76Å
1037E35Very low33.6Very low113 Ų113113.2 Ų113.253%0.52862%0.619SS.*Hα-helixtrans-64.7-25.6-178.3-147.5-163.6136.900113.8A1033 K1041A1033-E1037 PolarHBondContact O-N 2.94Å; E1037-K1041 VanDerWaalsContact O-CD 3.31Å; E1037-K1041 WeakPolarHBondContact O-CD 3.29Å; E1037-K1041 VanDerWaalsContact O-CG 3.29Å; E1037-K1041 WeakPolarHBondContact O-CG 3.34Å; E1037-K1041 WeakPolarHBondContact OE1-CE 3.35Å; E1037-K1041 IonicContact OE1-NZ 2.61Å; E1037-K1041 PolarHBondContact OE1-NZ 3.5Å
1038I38.7Very low33.5Very low124 Ų124110.1 Ų110.164%0.63662%0.615SS**Hα-helixtrans-76.3-42.2174.8-59176.4000110.4Q1036 L1040 K1041Q1036-I1038 PolarHBondContact O-N 3Å; I1038-L1040 VanDerWaalsContact C-N 3.31Å; I1038-L1040 PolarHBondContact O-N 3.4Å; I1038-K1041 PolarHBondContact O-N 2.94Å
1039M32.9Very low33.4Very low96 Ų96109.8 Ų109.847%0.47362%0.623SS.*Hα-helixtrans-76-17.9-176.4-155.516873.900113.4Q1036 L1118Q1036-M1039 PolarHBondContact O-N 3.43Å; Q1036-M1039 VanDerWaalsContact O-N 3.15Å; M1039-L1118 HydrophobicContact CE-CD1 3.69Å; M1039-L1118 HydrophobicContact CE-CD2 3.59Å; M1039-L1118 HydrophobicContact CE-CG 4.31Å
1040L36.2Very low33.1Very low64 Ų64107.5 Ų107.534%0.33563%0.625SS.*THydrogen-bonded Turntrans-85.7-15.1173.7-74.9164.3000113.8Q1036 I1038 A1117 L1118Q1036-L1040 WeakPolarHBondContact O-CG 3.31Å; Q1036-L1040 PolarHBondContact O-N 2.99Å; Q1036-L1040 VanDerWaalsContact O-N 3.08Å; I1038-L1040 VanDerWaalsContact C-N 3.31Å; I1038-L1040 PolarHBondContact O-N 3.4Å; L1040-A1117 HydrophobicContact CD1-CB 3.91Å; L1040-A1117 HydrophobicContact CD2-CB 4.08Å; L1040-L1118 HydrophobicContact CD2-CG 4.31Å
1041K34.1Very low32.7Very low150 Ų150110.5 Ų110.565%0.65264%0.643SS**SBendtrans-86.8-11.4-178.3-75.6171.8-173.2171.30114.1E1037 I1038E1037-K1041 VanDerWaalsContact O-CD 3.31Å; E1037-K1041 WeakPolarHBondContact O-CD 3.29Å; E1037-K1041 VanDerWaalsContact O-CG 3.29Å; E1037-K1041 WeakPolarHBondContact O-CG 3.34Å; E1037-K1041 WeakPolarHBondContact OE1-CE 3.35Å; E1037-K1041 IonicContact OE1-NZ 2.61Å; E1037-K1041 PolarHBondContact OE1-NZ 3.5Å; I1038-K1041 PolarHBondContact O-N 2.94Å
1042T34.3Very low32.5Very low105 Ų105115.4 Ų115.464%0.64466%0.659SS**SBendtrans-100-10.517744.20000114.1
1043T30.3Very low32Very low92 Ų92117 Ų11756%0.56467%0.666SS**  trans-104.857.1-171.960.20000113.7
1044N26.7Very low31.6Very low149 Ų149121.2 Ų121.280%0.79768%0.68SS**  trans-154.977.9174.6-100.1-34.6000112.8
1045C25.3Very low31.2Very low132 Ų132120.6 Ų120.689%0.89269%0.686SS**  trans-175.394.5157.2-102.80000111.9
1046T27.4Very low30.5Very low147 Ų147121 Ų12190%0.90270%0.695SS**  trans-144.3104.6162.2490000110.9
1047S33.6Very low29.9Very low130 Ų130124.7 Ų124.791%0.90973%0.726SS**  trans-148.5149.5166.258.40000109.4
1048S28.2Very low29.5Very low114 Ų114124 Ų12480%0.79773%0.734SS**  trans-116.3133.1-165.4500000112.8
1049S30.7Very low29Very low115 Ų115125.1 Ų125.180%0.80474%0.741SS**  trans177139.5136.337.10000114.3
1050S28.2Very low28.7Very low115 Ų115125.5 Ų125.580%0.80475%0.754SS**  trans44119.1143.9-53.20000121.9
1051P29.8Very low28.2Very low119 Ų119128.2 Ų128.277%0.77378%0.778SS**  trans-94.7141.3170.636-31.7000113.6
1052H26.2Very low27.8Very low177 Ų177128.1 Ų128.182%0.81978%0.783SS**  trans-169.8147.4145.9-123.6-84.6000113.6
1053L28Very low27.3Very low140 Ų140130 Ų13073%0.73379%0.789SS**  trans69.1111.8164.1-54.4177.2000119.9
1054L26Very low27.1Very low155 Ų155135.9 Ų135.981%0.81280%0.803SS**  trans53.6145.5141.1-76.670.4000120.7
1055S25.8Very low27Very low88 Ų88137.4 Ų137.462%0.61580%0.802SS**  cis-174.4139-21.448.60000109.5
1056N25.3Very low27Very low155 Ų155141.4 Ų141.483%0.82980%0.8SS**  trans55.6111.3161.2-58.35.4000119.2
1057C24.9Very low26.8Very low138 Ų138139.9 Ų139.993%0.93280%0.796SS**  -162.8163.6100.5-100.40000110.2
1058S28Very low26.4Very low99 Ų99137.8 Ų137.869%0.69279%0.786SS**  trans-120.2-175.2-165.163.90000114.3
1059D27.4Very low26.2Very low147 Ų147138.2 Ų138.279%0.78679%0.789SS**  trans85.8126.7168.3-53.57.4000115.1
1060S27.1Very low25.9Very low105 Ų105138.3 Ų138.373%0.73478%0.781SS**  cis-158.6163.5-6.853.50000112.2
1061S25.6Very low25.7Very low120 Ų120142 Ų14284%0.83979%0.785SS**SBendtrans75.325.7165.1730000120.7
1062I24.7Very low25.4Very low149 Ų149141.3 Ų141.376%0.76477%0.77SS**  trans-127.9128147.9-59.1-179.6000108.9
1063N24.5Very low25.2Very low145 Ų145135.7 Ų135.778%0.77575%0.751SS**  trans-154.186.2166.2-109.8-17.6000110.8
1064Y26.3Very low25Very low215 Ų215136.6 Ų136.684%0.84375%0.751SS**  trans-62.3145.2142.4-83.3-112000107.7
1065F24.2Very low24.8Very low180 Ų180138.2 Ų138.279%0.78976%0.755SS**  trans-150.3126.2146.2-107.5-69.7000113.2
1066Y24.3Very low24.9Very low217 Ų217139.1 Ų139.185%0.85176%0.758SS**  trans-87.6135162.8-129.1-99.9000107.3
1067S23.1Very low24.8Very low115 Ų115136.3 Ų136.380%0.80475%0.751SS**  trans-132.690.7177.1-67.20000110.9
1068A26.7Very low24.8Very low86 Ų86136.8 Ų136.871%0.71174%0.743SS**  trans-126.7110.4170.100000109.1
1069S23Very low24.8Very low122 Ų122138.4 Ų138.485%0.85374%0.743SS**  trans-142.3135.4174.7-68.50000109.3
1070N25.8Very low24.8Very low118 Ų118137 Ų13763%0.63174%0.736SS**  trans-82.6146.3-179.8-55.1-14.2000111.3E16E16-N1070 PolarHBondContact OE2-ND2 3.5Å
1071E23.3Very low24.8Very low191 Ų191138.5 Ų138.589%0.89374%0.735SS**  trans-139.287.9143.1-77.1-149.214100112.7
1072K22.7Very low24.9Very low105 Ų105142.3 Ų142.346%0.45774%0.738SS.*  31.686.1112.7-70.1-173.8138144.70120.5E16 Q17E16-K1072 VanDerWaalsContact CD-NZ 3.32Å; E16-K1072 WeakPolarHBondContact OE1-CE 3.33Å; E16-K1072 IonicContact OE1-NZ 3.03Å; E16-K1072 PolarHBondContact OE1-NZ 3.22Å; E16-K1072 WeakPolarHBondContact OE2-CE 3.31Å; E16-K1072 IonicContact OE2-NZ 3.46Å; Q17-K1072 HydrophobicContact CG-CB 4.03Å; Q17-K1072 HydrophobicContact CG-CD 4.21Å; Q17-K1072 HydrophobicContact CG-CG 3.65Å; Q17-K1072 VanDerWaalsContact NE2-CB 3.28Å; Q17-K1072 PolarHBondContact NE2-O 3.03Å; Q17-K1072 VanDerWaalsContact OE1-CA 3.27Å
1073S23.7Very low25Very low60 Ų60142.5 Ų142.542%0.4274%0.74SS.*  trans56.2171.7154.675.90000122.5Q17Q17-S1073 VanDerWaalsContact CD-CB 3.47Å; Q17-S1073 PolarHBondContact NE2-OG 3.26Å
1074Q23.1Very low25.2Very low158 Ų158143.5 Ų143.574%0.73875%0.745SS**  trans76.1105.3151.2-78.6172.9-9.400114.3
1075Q22Very low25.2Very low190 Ų190139.1 Ų139.189%0.88874%0.74SS**  trans-56.4159.3158.9-49.2171.3-64.400109.6
1076P28.2Very low25.5Very low107 Ų107137.2 Ų137.270%0.69574%0.743SS**  cis-140.816112.140.6-22.6000117.4
1077S23.3Very low25.7Very low96 Ų96133 Ų13367%0.67174%0.735SS**  trans68150.1134.871.10000123.2
1078I25Very low25.9Very low148 Ų148134.9 Ų134.976%0.75974%0.736SS**  trans84.394.8153.7-64.6155000118.2
1079N26.6Very low25.9Very low133 Ų133135.6 Ų135.671%0.71174%0.742SS**  63.1143.3124-82.850.2000126.2
1080D27.5Very low26.1Very low118 Ų118134.1 Ų134.163%0.63174%0.737SS**  trans74.1100140.7-67.3-42.9000122.6
1081N27Very low26Very low135 Ų135134.2 Ų134.272%0.72274%0.742SS**  41.8123117.1-63.1-54.9000120.1
1082F27.8Very low26.2Very low201 Ų201135.5 Ų135.588%0.88274%0.74SS**  -167.5144.9118.2-114.6-76.7000112.8
1083N27.2Very low26.6Very low153 Ų153135.9 Ų135.982%0.81875%0.754SS**  trans-110.9154.8173.5-93.1-25.8000110.8
1084L27.7Very low27.1Very low166 Ų166138.9 Ų138.987%0.86977%0.772SS**  trans-163.6149158.3-111155.2000112.8
1085T27Very low27.5Very low122 Ų122141.1 Ų141.175%0.74878%0.782SS**  trans-144.4146-168.851.60000112
1086V30.5Very low27.6Very low141 Ų141141 Ų14186%0.85578%0.782SS**  trans-147.2151.4168.4-171.80000110.3
1087N28.1Very low27.6Very low129 Ų129144 Ų14469%0.6979%0.791SS**  trans-115.6167.3-173.2-53.3-26.1000113.2
1088D27.6Very low27.8Very low154 Ų154144.4 Ų144.482%0.82479%0.794SS**  152.6124.5114.7-80.5-30.2000117.8
1089A26.6Very low27.9Very low100 Ų100144.4 Ų144.483%0.82680%0.795SS**  trans40.4130.1144.900000125.7
1090A26.8Very low27.9Very low91 Ų91145.5 Ų145.575%0.75280%0.799SS**  146116.1108.800000119.4
1091T24.5Very low27.9Very low121 Ų121143 Ų14374%0.74280%0.8SS**  trans72.8100.3130-52.50000124
1092Y27.2Very low28.3Very low217 Ų217144.6 Ų144.685%0.85181%0.809SS**  trans45.6169.6134-70.2-76000123.7
1093P31.7Very low28.2Very low113 Ų113143.7 Ų143.773%0.73481%0.805SS**  cis-130.9-179.3-33.637.3-19.2000114.2
1094P34.6Very low28.5Very low124 Ų124143.6 Ų143.681%0.80580%0.804SS**  trans-106.9170.7-174.540.3-35.4000117.3
1095Q30.7Very low28.6Very low204 Ų204140 Ų14095%0.95379%0.793SS**  trans-145.8153.3167-77.7-169.1-36.300112.8
1096E24.6Very low28.6Very low188 Ų188141.4 Ų141.488%0.87980%0.796SS**  trans-91.7164.2173.6-58-177.6122.100113.2
1097L28.7Very low28.4Very low169 Ų169142.1 Ų142.189%0.88580%0.795SS**  trans-156.9153.4140.8-139.577.9000112.5
1098S27.3Very low28.2Very low106 Ų106142.8 Ų142.874%0.74180%0.804SS**  trans-140.4153.6175.3620000111
1099L26.6Very low28Very low148 Ų148141.2 Ų141.278%0.77580%0.8SS**  trans174.1159.2168.3-88.8134.1000108.5
1100I26.7Very low27.9Very low156 Ų156143.9 Ų143.980%0.880%0.799SS**  cis-173.2155.5-41.8-121.1172.4000108.8
1101G27.8Very low27.9Very low64 Ų64144.4 Ų144.466%0.6680%0.795SS**  trans98.4150.4160.200000116.9
1102N33.8Very low28Very low170 Ų170147.4 Ų147.491%0.90981%0.806SS**  cis-150174.91.5-125.1-9.3000112.8
1103K27.5Very low27.8Very low181 Ų181140.7 Ų140.779%0.78780%0.795SS**  trans-97164.7-173-56.6171.5-179.4175.10112.9
1104D32.9Very low27.6Very low151 Ų151143.4 Ų143.481%0.80780%0.803SS**  -178.7138.4106.7-91.7-19.7000117.8
1105S29.4Very low27.5Very low91 Ų91144 Ų14464%0.63680%0.799SS**  trans46.3111149.868.30000125.1
1106N26.8Very low27.3Very low152 Ų152141.1 Ų141.181%0.81378%0.784SS**  76.4147.3120.2-57.1-13.4000123.5
1107N25.7Very low27.5Very low156 Ų156135.1 Ų135.183%0.83477%0.767SS**  trans74.774.3162.5-63.3-7.7000120.5
1108V25.5Very low27.5Very low143 Ų143130.6 Ų130.687%0.86774%0.744SS**  trans-143.5152.2141.4174.70000109.2
1109T23.4Very low27.7Very low121 Ų121133.9 Ų133.974%0.74274%0.744SS**  trans-112.8152.3177.4-45.20000110.3
1110L23.8Very low27.9Very low155 Ų155133 Ų13381%0.81274%0.74SS**  trans78.8158.8178.9-50.4168.2000114.7
1111P25.9Very low28Very low103 Ų103129.8 Ų129.867%0.66973%0.729SS**  cis-137.6160.2-42.937.5-22.7000114.7A1113P1111-A1113 PolarHBondContact O-N 3.01Å
1112L26.5Very low28.2Very low184 Ų184133.1 Ų133.196%0.96374%0.737SS**  trans16.872.7146.8-161.778.8000118.7
1113A24.9Very low28Very low75 Ų75129.7 Ų129.762%0.6272%0.722SS**  trans-150.994.3176.500000113.7P1111P1111-A1113 PolarHBondContact O-N 3.01Å
1114D27.3Very low28.2Very low170 Ų170125.9 Ų125.991%0.90971%0.714SS**SBendtrans-149.214.6167.6-102.6-38000113.4
1115I31Very low28Very low138 Ų138125 Ų12571%0.70872%0.72SS**  trans-125.755-180-43.1179.2000109.5
1116H27Very low28Very low142 Ų142124.5 Ų124.566%0.65772%0.721SS**  trans-130.66.6-172.4-108.2-73.3000115.7L1118H1116-L1118 PolarHBondContact O-N 3.04Å
1117A28.4Very low28.3Very low62 Ų62122 Ų12251%0.51272%0.722SS.*  trans-93.583.6176.200000111.9L1040L1040-A1117 HydrophobicContact CD1-CB 3.91Å; L1040-A1117 HydrophobicContact CD2-CB 4.08Å
1118L28.5Very low29Very low75 Ų75119.5 Ų119.539%0.39371%0.707SS.*  trans178.181.7154.5-101161.7000109.8Q1036 M1039 L1040 H1116Q1036-L1118 HydrophobicContact CB-CD1 4.14Å; Q1036-L1118 HydrophobicContact CG-CD1 3.76Å; M1039-L1118 HydrophobicContact CE-CD1 3.69Å; M1039-L1118 HydrophobicContact CE-CD2 3.59Å; M1039-L1118 HydrophobicContact CE-CG 4.31Å; L1040-L1118 HydrophobicContact CD2-CG 4.31Å; H1116-L1118 PolarHBondContact O-N 3.04Å
1119K32.2Very low29.8Very low174 Ų174115.9 Ų115.976%0.75769%0.687SS**  trans-131.488.8179-164.2175.9-175.3-177.70110
1120L32Very low30.9Very low130 Ų130111 Ų11168%0.68166%0.657SS**  trans-58.7139.5176.2-115.369.8000110.3T1122L1120-T1122 PolarHBondContact O-N 3.13Å
1121P28.5Very low32.3Very low88 Ų88107.3 Ų107.357%0.57164%0.642SS**  trans-72.6121.4-174.728.1-33.7000111.3T1123P1121-T1123 HydrophobicContact CB-CG2 4.38Å; P1121-T1123 PolarHBondContact O-N 3.26Å
1122T30.4Very low33.7Very low135 Ų135106.9 Ų106.983%0.82864%0.64SS**  trans-77.469.117252.30000110.8L1120L1120-T1122 PolarHBondContact O-N 3.13Å
1123T30.9Very low35.8Very low97 Ų97101.9 Ų101.960%0.59561%0.614SS**  trans-96.3144.9174.6470000111.8P1121P1121-T1123 HydrophobicContact CB-CG2 4.38Å; P1121-T1123 PolarHBondContact O-N 3.26Å
1124T31.2Very low38.1Very low102 Ų10298.7 Ų98.763%0.62659%0.588SS**SBendtrans-58.9132.2-170.145.10000115.9A1126T1124-A1126 VanDerWaalsContact C-N 3.31Å; T1124-A1126 PolarHBondContact O-N 2.9Å
1125S29.4Very low40.9Very low132 Ų13291.3 Ų91.392%0.92355%0.548SS*.SBendtrans53.433.7138.7-1650000117.8
1126A29.2Very low43.5Very low80 Ų8088.7 Ų88.766%0.66153%0.533SS*.SBendtrans-129.3140.4159.200000107.8T1124 I1128T1124-A1126 VanDerWaalsContact C-N 3.31Å; T1124-A1126 PolarHBondContact O-N 2.9Å; A1126-I1128 PolarHBondContact O-N 3.04Å
1127A33.3Very low46.3Very low100 Ų10086.7 Ų86.783%0.82652%0.523SS*.  trans-68.5102.3-178.400000109.9P1129A1127-P1129 VanDerWaalsContact O-CD 3.24Å; A1127-P1129 WeakPolarHBondContact O-CD 3.29Å
1128I39.6Very low49.2Very low103 Ų10383.8 Ų83.853%0.52850%0.498SS..  trans-68.2111.7162.2-58.7175.8000105.3A1126A1126-I1128 PolarHBondContact O-N 3.04Å
1129P42Very low52.2Low68 Ų6884.8 Ų84.844%0.44250%0.497SS..PPolyproline II helixtrans-62142.3173.628.5-33.9000107.9A1127 Y1410A1127-P1129 VanDerWaalsContact O-CD 3.24Å; A1127-P1129 WeakPolarHBondContact O-CD 3.29Å; P1129-Y1410 HydrophobicContact CB-CD2 4.15Å; P1129-Y1410 HydrophobicContact CB-CE2 4.26Å; P1129-Y1410 HydrophobicContact CB-CG 4.33Å
1130P46.3Very low54.8Low18 Ų1879.5 Ų79.512%0.11748%0.479CS..PPolyproline II helixtrans-58.4146.4173.125.3-31.9000109.2G1407P1130-G1407 VanDerWaalsContact CG-CA 3.43Å
1131P53.1Low57.6Low77 Ų7773.3 Ų73.350%0.545%0.447SS..PPolyproline II helixtrans-54134178.523.3-33.3000109.1D1133 A1134P1131-D1133 PolarHBondContact O-N 3.11Å; P1131-A1134 WeakPolarHBondContact O-CB 3.47Å; P1131-A1134 PolarHBondContact O-N 3.01Å
1132P56.3Low60.6Low95 Ų9569.3 Ų69.362%0.61742%0.421SS*.THydrogen-bonded Turntrans-55.7-33-16920.1-32.1000112.5A1134 L1135 E1136P1132-A1134 PolarHBondContact O-N 3.23Å; P1132-A1134 VanDerWaalsContact O-N 3.12Å; P1132-L1135 PolarHBondContact O-N 3.06Å; P1132-L1135 VanDerWaalsContact O-N 3.1Å; P1132-E1136 PolarHBondContact O-N 3.34Å
1133D69.7Low63.3Low78 Ų7866.4 Ų66.442%0.41741%0.406SS..Hα-helixtrans-41.8-42.5170.1-42.5-8.1000113P1131 L1135 E1136 F1137P1131-D1133 PolarHBondContact O-N 3.11Å; D1133-L1135 VanDerWaalsContact C-N 3.34Å; D1133-L1135 PolarHBondContact O-N 3.03Å; D1133-E1136 PolarHBondContact O-N 3.4Å; D1133-E1136 VanDerWaalsContact O-N 3.09Å; D1133-F1137 HydrophobicContact CB-CE2 4.2Å; D1133-F1137 WeakPolarHBondContact O-CD2 3.41Å; D1133-F1137 PolarHBondContact O-N 2.69Å
1134A74.4Confident65.9Low9 Ų963.4 Ų63.47%0.07439%0.387CS..Hα-helixtrans-65.4-34.6-175.100000113.2P1131 P1132 I1138 Y1205P1131-A1134 WeakPolarHBondContact O-CB 3.47Å; P1131-A1134 PolarHBondContact O-N 3.01Å; P1132-A1134 PolarHBondContact O-N 3.23Å; P1132-A1134 VanDerWaalsContact O-N 3.12Å; A1134-I1138 WeakPolarHBondContact O-CG1 3.46Å; A1134-I1138 PolarHBondContact O-N 2.68Å; A1134-Y1205 HydrophobicContact CB-CE2 4.23Å
1135L85.1Confident68.6Low14 Ų1458.9 Ų58.97%0.07336%0.359CS..Hα-helixtrans-76.2-30.7173.7-65.6175000111.3P1132 D1133 I1138 R1139 V1371 Y1410 Y1411P1132-L1135 PolarHBondContact O-N 3.06Å; P1132-L1135 VanDerWaalsContact O-N 3.1Å; D1133-L1135 VanDerWaalsContact C-N 3.34Å; D1133-L1135 PolarHBondContact O-N 3.03Å; L1135-I1138 HydrophobicContact CD2-CD1 4.43Å; L1135-I1138 WeakPolarHBondContact O-CB 3.39Å; L1135-I1138 PolarHBondContact O-N 3.13Å; L1135-R1139 PolarHBondContact O-N 3.27Å; L1135-V1371 HydrophobicContact CB-CG1 4.37Å; L1135-V1371 HydrophobicContact CD2-CG1 4.05Å; L1135-Y1410 HydrophobicContact CD1-CD1 4.33Å; L1135-Y1411 HydrophobicContact CD1-CD2 4.08Å
1136E85.2Confident71.3Confident83 Ų8353.4 Ų53.439%0.38832%0.321SS..Hα-helixtrans-72.8-33.1176.1-165.254-128.300112.4P1132 D1133 I1138 R1139 T1140P1132-E1136 PolarHBondContact O-N 3.34Å; D1133-E1136 PolarHBondContact O-N 3.4Å; D1133-E1136 VanDerWaalsContact O-N 3.09Å; E1136-I1138 VanDerWaalsContact C-N 3.33Å; E1136-I1138 PolarHBondContact O-N 2.82Å; E1136-R1139 PolarHBondContact O-N 3Å; E1136-R1139 WeakPolarHBondContact OE1-CD 3.47Å; E1136-R1139 IonicContact OE2-CZ 2.73Å; E1136-R1139 IonicContact OE2-NE 3.22Å; E1136-R1139 IonicContact OE2-NH1 2.79Å; E1136-R1139 PolarHBondContact OE2-NH1 3.18Å; E1136-T1140 VanDerWaalsContact O-CB 3.27Å; E1136-T1140 WeakPolarHBondContact O-CB 3.43Å; E1136-T1140 PolarHBondContact O-N 2.91Å; E1136-T1140 PolarHBondContact O-OG1 2.94Å
1137F86.2Confident73.9Confident101 Ų10152.4 Ų52.444%0.44331%0.309SS..Hα-helixtrans-61.8-40.2168-75.3-66.8000112.1D1133 T1140 A1141 P1204D1133-F1137 HydrophobicContact CB-CE2 4.2Å; D1133-F1137 WeakPolarHBondContact O-CD2 3.41Å; D1133-F1137 PolarHBondContact O-N 2.69Å; F1137-T1140 PolarHBondContact O-N 2.95Å; F1137-A1141 WeakPolarHBondContact O-CB 3.1Å; F1137-A1141 PolarHBondContact O-N 3.04Å; F1137-P1204 HydrophobicContact CB-CG 4.03Å; F1137-P1204 HydrophobicContact CD2-CB 4.43Å; F1137-P1204 HydrophobicContact CD2-CG 3.83Å; F1137-P1204 HydrophobicContact CG-CG 4.08Å
1138I90.4Very high76.2Confident1 Ų149.1 Ų49.11%0.00528%0.275CS..Hα-helixtrans-63.4-47.7174.2-67.4171.5000110.3A1134 L1135 E1136 T1140 A1141 E1142 L1203 Y1205 V1371 L1378A1134-I1138 WeakPolarHBondContact O-CG1 3.46Å; A1134-I1138 PolarHBondContact O-N 2.68Å; L1135-I1138 HydrophobicContact CD2-CD1 4.43Å; L1135-I1138 WeakPolarHBondContact O-CB 3.39Å; L1135-I1138 PolarHBondContact O-N 3.13Å; E1136-I1138 VanDerWaalsContact C-N 3.33Å; E1136-I1138 PolarHBondContact O-N 2.82Å; I1138-T1140 VanDerWaalsContact C-N 3.32Å; I1138-T1140 PolarHBondContact O-N 3.05Å; I1138-A1141 PolarHBondContact O-N 3.46Å; I1138-E1142 WeakPolarHBondContact O-CG 3.28Å; I1138-E1142 PolarHBondContact O-N 3.42Å; I1138-L1203 HydrophobicContact CG1-CD2 3.97Å; I1138-Y1205 HydrophobicContact CD1-CE2 4.16Å; I1138-V1371 HydrophobicContact CG2-CG1 4.47Å; I1138-L1378 HydrophobicContact CD1-CD2 4.24Å
1139R91Very high78.1Confident95 Ų9545 Ų4536%0.35825%0.253SS..Hα-helixtrans-56.8-44.4175.5-170.9174.6-74.9148-10.5112.1L1135 E1136 E1142 S1143 V1371 Y1411L1135-R1139 PolarHBondContact O-N 3.27Å; E1136-R1139 PolarHBondContact O-N 3Å; E1136-R1139 WeakPolarHBondContact OE1-CD 3.47Å; E1136-R1139 IonicContact OE2-CZ 2.73Å; E1136-R1139 IonicContact OE2-NE 3.22Å; E1136-R1139 IonicContact OE2-NH1 2.79Å; E1136-R1139 PolarHBondContact OE2-NH1 3.18Å; R1139-E1142 PolarHBondContact O-N 2.87Å; R1139-S1143 VanDerWaalsContact O-CB 3.23Å; R1139-S1143 WeakPolarHBondContact O-CB 3.36Å; R1139-S1143 PolarHBondContact O-N 3.38Å; R1139-V1371 HydrophobicContact CB-CG2 3.86Å; R1139-V1371 HydrophobicContact CG-CG2 4.13Å; R1139-Y1411 PolarHBondContact NH2-OH 3.27Å
1140T87.6Confident79.9Confident63 Ų6348.9 Ų48.939%0.38726%0.263SS..Hα-helixtrans-65.9-40.5179.2-63.20000112.1E1136 F1137 I1138 T1144E1136-T1140 VanDerWaalsContact O-CB 3.27Å; E1136-T1140 WeakPolarHBondContact O-CB 3.43Å; E1136-T1140 PolarHBondContact O-N 2.91Å; E1136-T1140 PolarHBondContact O-OG1 2.94Å; F1137-T1140 PolarHBondContact O-N 2.95Å; I1138-T1140 VanDerWaalsContact C-N 3.32Å; I1138-T1140 PolarHBondContact O-N 3.05Å; T1140-T1144 WeakPolarHBondContact O-CB 3.33Å; T1140-T1144 PolarHBondContact O-N 3.37Å; T1140-T1144 PolarHBondContact O-OG1 3.2Å
1141A89.4Confident81.2Confident1 Ų151.8 Ų51.81%0.00828%0.275CS..Hα-helixtrans-63.6-47.3175.600000111.6F1137 I1138 T1144 I1145 K1202 L1203F1137-A1141 WeakPolarHBondContact O-CB 3.1Å; F1137-A1141 PolarHBondContact O-N 3.04Å; I1138-A1141 PolarHBondContact O-N 3.46Å; A1141-T1144 WeakPolarHBondContact O-CB 3.33Å; A1141-T1144 PolarHBondContact O-N 2.84Å; A1141-I1145 PolarHBondContact O-N 3.37Å; A1141-I1145 VanDerWaalsContact O-N 3.17Å; A1141-K1202 HydrophobicContact CB-CB 4.18Å; A1141-L1203 HydrophobicContact CB-CD2 3.9Å
1142E92.1Very high82.1Confident3 Ų349.1 Ų49.11%0.01426%0.255CS..Hα-helixtrans-67.1-37177.8-67-66.6161.600112.8I1138 R1139 I1145 S1146 W1199 P1370 L1373 G1374 K1377I1138-E1142 WeakPolarHBondContact O-CG 3.28Å; I1138-E1142 PolarHBondContact O-N 3.42Å; R1139-E1142 PolarHBondContact O-N 2.87Å; E1142-I1145 PolarHBondContact O-N 3.49Å; E1142-S1146 VanDerWaalsContact O-CB 3.23Å; E1142-S1146 WeakPolarHBondContact O-CB 3.23Å; E1142-S1146 PolarHBondContact O-N 3.26Å; E1142-S1146 PolarHBondContact O-OG 3.43Å; E1142-W1199 PolarHBondContact OE1-NE1 3.37Å; E1142-P1370 HydrophobicContact CB-CB 4.11Å; E1142-P1370 WeakPolarHBondContact CG-O 3.18Å; E1142-L1373 WeakPolarHBondContact OE2-CD2 3.38Å; E1142-G1374 WeakPolarHBondContact OE1-CA 3.39Å; E1142-K1377 WeakPolarHBondContact OE1-CD 3.4Å; E1142-K1377 WeakPolarHBondContact OE1-CE 3.49Å; E1142-K1377 IonicContact OE1-NZ 3.17Å; E1142-K1377 PolarHBondContact OE1-NZ 3.12Å; E1142-K1377 IonicContact OE2-NZ 2.78Å; E1142-K1377 PolarHBondContact OE2-NZ 2.84Å
1143S87.9Confident82.8Confident74 Ų7446.8 Ų46.852%0.51724%0.237SC..Hα-helixtrans-62.5-41.5172.3-172.40000111.5R1139 I1145 S1146 S1147R1139-S1143 VanDerWaalsContact O-CB 3.23Å; R1139-S1143 WeakPolarHBondContact O-CB 3.36Å; R1139-S1143 PolarHBondContact O-N 3.38Å; S1143-I1145 PolarHBondContact O-N 2.88Å; S1143-S1146 PolarHBondContact O-N 3.25Å; S1143-S1147 WeakPolarHBondContact O-CB 3.27Å; S1143-S1147 PolarHBondContact O-N 2.95Å
1144T85.3Confident82.8Confident34 Ų3446.4 Ų46.421%0.20924%0.241CC..Hα-helixtrans-58.8-50176.1-56.20000111.4T1140 A1141 S1147 R1148 K1202T1140-T1144 WeakPolarHBondContact O-CB 3.33Å; T1140-T1144 PolarHBondContact O-N 3.37Å; T1140-T1144 PolarHBondContact O-OG1 3.2Å; A1141-T1144 WeakPolarHBondContact O-CB 3.33Å; A1141-T1144 PolarHBondContact O-N 2.84Å; T1144-S1147 PolarHBondContact O-N 2.89Å; T1144-R1148 PolarHBondContact O-N 2.72Å; T1144-K1202 PolarHBondContact OG1-NZ 2.9Å
1145I87.7Confident82.4Confident8 Ų846.1 Ų46.14%0.04124%0.238CC..Hα-helixtrans-66.5-40.7178.5-58-52.2000111.1A1141 E1142 S1143 S1147 R1148 R1149 D1195 I1198 W1199A1141-I1145 PolarHBondContact O-N 3.37Å; A1141-I1145 VanDerWaalsContact O-N 3.17Å; E1142-I1145 PolarHBondContact O-N 3.49Å; S1143-I1145 PolarHBondContact O-N 2.88Å; I1145-S1147 VanDerWaalsContact C-N 3.29Å; I1145-S1147 PolarHBondContact O-N 3.41Å; I1145-R1148 PolarHBondContact O-N 3Å; I1145-R1149 PolarHBondContact O-N 3.03Å; I1145-D1195 HydrophobicContact CD1-CB 4.06Å; I1145-D1195 WeakPolarHBondContact CD1-O 3.47Å; I1145-D1195 HydrophobicContact CG2-CB 4.33Å; I1145-I1198 HydrophobicContact CD1-CG2 4.27Å; I1145-W1199 HydrophobicContact CD1-CB 4.2Å; I1145-W1199 HydrophobicContact CG1-CB 3.99Å
1146S86.2Confident81.4Confident17 Ų1748.5 Ų48.512%0.11925%0.248CC..Hα-helixtrans-61.7-35.2176.4-62.50000113E1142 S1143 K1150E1142-S1146 VanDerWaalsContact O-CB 3.23Å; E1142-S1146 WeakPolarHBondContact O-CB 3.23Å; E1142-S1146 PolarHBondContact O-N 3.26Å; E1142-S1146 PolarHBondContact O-OG 3.43Å; S1143-S1146 PolarHBondContact O-N 3.25Å; S1146-K1150 VanDerWaalsContact O-CG 3.3Å; S1146-K1150 WeakPolarHBondContact O-CG 3.49Å; S1146-K1150 PolarHBondContact O-N 3.01Å
1147S82.8Confident80.2Confident58 Ų5849.9 Ų49.941%0.40626%0.258SS..Hα-helixtrans-69.7-49.8174.5-1670000111.3S1143 T1144 I1145 R1149 K1150 Q1151S1143-S1147 WeakPolarHBondContact O-CB 3.27Å; S1143-S1147 PolarHBondContact O-N 2.95Å; T1144-S1147 PolarHBondContact O-N 2.89Å; I1145-S1147 VanDerWaalsContact C-N 3.29Å; I1145-S1147 PolarHBondContact O-N 3.41Å; S1147-R1149 VanDerWaalsContact C-N 3.3Å; S1147-R1149 PolarHBondContact O-N 3.02Å; S1147-K1150 WeakPolarHBondContact O-CB 3.42Å; S1147-K1150 PolarHBondContact O-N 3.39Å; S1147-Q1151 PolarHBondContact O-N 2.81Å
1148R81Confident78.8Confident32 Ų3250.9 Ų50.912%0.12126%0.262CS..Hα-helixtrans-61.3-35.8178.7-73.3177.759.1-104.9-12.1112.6T1144 I1145 Q1151 W1152 D1195T1144-R1148 PolarHBondContact O-N 2.72Å; I1145-R1148 PolarHBondContact O-N 3Å; R1148-Q1151 PolarHBondContact O-N 3.2Å; R1148-W1152 WeakPolarHBondContact O-CB 3.37Å; R1148-W1152 PolarHBondContact O-N 3.43Å; R1148-D1195 IonicContact CZ-OD1 3.81Å; R1148-D1195 VanDerWaalsContact CZ-OD1 3.22Å; R1148-D1195 IonicContact NH1-OD1 2.99Å; R1148-D1195 PolarHBondContact NH1-OD1 3.34Å; R1148-D1195 IonicContact NH2-OD1 2.61Å; R1148-D1195 PolarHBondContact NH2-OD1 3.24Å
1149R80.2Confident76.9Confident17 Ų1759 Ų596%0.06430%0.301CS..Hα-helixtrans-63.1-43.6170.8-166.2-168.9-168.189.12112.6I1145 S1147 W1152 L1153 W1233 E1309I1145-R1149 PolarHBondContact O-N 3.03Å; S1147-R1149 VanDerWaalsContact C-N 3.3Å; S1147-R1149 PolarHBondContact O-N 3.02Å; R1149-W1152 PolarHBondContact O-N 2.93Å; R1149-L1153 HydrophobicContact CG-CD1 4.19Å; R1149-L1153 WeakPolarHBondContact O-CB 3.44Å; R1149-L1153 WeakPolarHBondContact O-CG 3.5Å; R1149-L1153 PolarHBondContact O-N 2.91Å; R1149-W1233 HydrophobicContact CB-CZ2 4.46Å; R1149-W1233 VanDerWaalsContact CD-CD2 3.45Å; R1149-W1233 VanDerWaalsContact CD-CE2 3.43Å; R1149-E1309 IonicContact CZ-OE1 3.7Å; R1149-E1309 IonicContact CZ-OE2 3.45Å; R1149-E1309 IonicContact NH1-OE1 2.69Å; R1149-E1309 PolarHBondContact NH1-OE1 2.99Å; R1149-E1309 IonicContact NH1-OE2 3Å; R1149-E1309 PolarHBondContact NH1-OE2 3.39Å; R1149-E1309 IonicContact NH2-OE1 3.84Å; R1149-E1309 IonicContact NH2-OE2 2.94Å; R1149-E1309 PolarHBondContact NH2-OE2 3.06Å
1150K80Confident74.7Confident148 Ų14860.5 Ų60.564%0.64331%0.312SS*.Hα-helixtrans-62.9-42.2176.9-72.8168.8-177.51780111.5S1146 S1147 L1153 S1154S1146-K1150 VanDerWaalsContact O-CG 3.3Å; S1146-K1150 WeakPolarHBondContact O-CG 3.49Å; S1146-K1150 PolarHBondContact O-N 3.01Å; S1147-K1150 WeakPolarHBondContact O-CB 3.42Å; S1147-K1150 PolarHBondContact O-N 3.39Å; K1150-L1153 PolarHBondContact O-N 3.16Å; K1150-S1154 WeakPolarHBondContact O-CB 3.44Å; K1150-S1154 PolarHBondContact O-N 2.69Å
1151Q74.3Confident72.6Confident80 Ų8060 Ų6037%0.37431%0.31SS..Hα-helixtrans-59.8-51.8174.1-70.1169.8-33.700111S1147 R1148 L1153 S1154 A1155S1147-Q1151 PolarHBondContact O-N 2.81Å; R1148-Q1151 PolarHBondContact O-N 3.2Å; Q1151-L1153 PolarHBondContact O-N 3.39Å; Q1151-S1154 PolarHBondContact O-N 3.09Å; Q1151-S1154 PolarHBondContact O-OG 2.94Å; Q1151-A1155 PolarHBondContact O-N 3.42Å
1152W71.6Confident70.7Confident20 Ų2067.1 Ų67.18%0.07634%0.343CS..Hα-helixtrans-56.5-47.3177.5-178.582.2000112.6R1148 R1149 S1154 A1155 F1156 T1188 L1191 P1308R1148-W1152 WeakPolarHBondContact O-CB 3.37Å; R1148-W1152 PolarHBondContact O-N 3.43Å; R1149-W1152 PolarHBondContact O-N 2.93Å; W1152-S1154 VanDerWaalsContact C-N 3.28Å; W1152-S1154 PolarHBondContact O-N 2.88Å; W1152-A1155 PolarHBondContact O-N 3.01Å; W1152-F1156 HydrophobicContact CH2-CB 4.42Å; W1152-F1156 HydrophobicContact CH2-CD1 4.42Å; W1152-F1156 HydrophobicContact CH2-CD2 4.07Å; W1152-F1156 HydrophobicContact CH2-CE2 4.45Å; W1152-F1156 HydrophobicContact CH2-CG 4.05Å; W1152-F1156 HydrophobicContact CZ2-CB 4.34Å; W1152-F1156 AromaticContact CZ2-CD2 3.69Å; W1152-F1156 HydrophobicContact CZ2-CD2 3.69Å; W1152-F1156 HydrophobicContact CZ2-CE2 4.19Å; W1152-F1156 HydrophobicContact CZ2-CG 4.05Å; W1152-F1156 WeakPolarHBondContact O-CB 3.28Å; W1152-F1156 PolarHBondContact O-N 3.33Å; W1152-T1188 HydrophobicContact CZ2-CG2 4.29Å; W1152-L1191 HydrophobicContact CD2-CD2 4.09Å; W1152-L1191 HydrophobicContact CG-CD2 3.84Å; W1152-P1308 HydrophobicContact CD2-CG 4.21Å; W1152-P1308 HydrophobicContact CE3-CG 3.93Å; W1152-P1308 HydrophobicContact CH2-CG 3.74Å; W1152-P1308 HydrophobicContact CZ2-CG 3.98Å; W1152-P1308 HydrophobicContact CZ3-CG 3.69Å
1153L70.3Confident68.6Low46 Ų4670.5 Ų70.524%0.24137%0.371CS..Hα-helixtrans-60-36.6175.3-74.1168.8000112.3R1149 K1150 Q1151 N1157R1149-L1153 HydrophobicContact CG-CD1 4.19Å; R1149-L1153 WeakPolarHBondContact O-CB 3.44Å; R1149-L1153 WeakPolarHBondContact O-CG 3.5Å; R1149-L1153 PolarHBondContact O-N 2.91Å; K1150-L1153 PolarHBondContact O-N 3.16Å; Q1151-L1153 PolarHBondContact O-N 3.39Å; L1153-N1157 PolarHBondContact O-N 3.29Å; L1153-N1157 PolarHBondContact O-ND2 2.92Å
1154S70.8Confident66.6Low71 Ų7169.4 Ų69.450%0.49736%0.358SS..Hα-helixtrans-71.3-30178.7770000113.7K1150 Q1151 W1152K1150-S1154 WeakPolarHBondContact O-CB 3.44Å; K1150-S1154 PolarHBondContact O-N 2.69Å; Q1151-S1154 PolarHBondContact O-N 3.09Å; Q1151-S1154 PolarHBondContact O-OG 2.94Å; W1152-S1154 VanDerWaalsContact C-N 3.28Å; W1152-S1154 PolarHBondContact O-N 2.88Å
1155A66.4Low64.9Low3 Ų369 Ų693%0.02535%0.354CS..Hα-helixtrans-79.7-44.4173.900000111.9Q1151 W1152 N1157 K1158Q1151-A1155 PolarHBondContact O-N 3.42Å; W1152-A1155 PolarHBondContact O-N 3.01Å; A1155-N1157 VanDerWaalsContact C-N 3.3Å; A1155-N1157 PolarHBondContact O-N 3.05Å; A1155-K1158 PolarHBondContact O-N 2.97Å; A1155-K1158 VanDerWaalsContact O-N 3.14Å
1156F64.2Low63.2Low63 Ų6369.6 Ų69.628%0.27636%0.36SS..Hα-helixtrans-59.7-39.4-178.5-169.4-96.8000112.5W1152 K1158 Q1159 I1165 S1305W1152-F1156 HydrophobicContact CH2-CB 4.42Å; W1152-F1156 HydrophobicContact CH2-CD1 4.42Å; W1152-F1156 HydrophobicContact CH2-CD2 4.07Å; W1152-F1156 HydrophobicContact CH2-CE2 4.45Å; W1152-F1156 HydrophobicContact CH2-CG 4.05Å; W1152-F1156 HydrophobicContact CZ2-CB 4.34Å; W1152-F1156 AromaticContact CZ2-CD2 3.69Å; W1152-F1156 HydrophobicContact CZ2-CD2 3.69Å; W1152-F1156 HydrophobicContact CZ2-CE2 4.19Å; W1152-F1156 HydrophobicContact CZ2-CG 4.05Å; W1152-F1156 WeakPolarHBondContact O-CB 3.28Å; W1152-F1156 PolarHBondContact O-N 3.33Å; F1156-K1158 PolarHBondContact O-N 3.04Å; F1156-K1158 VanDerWaalsContact O-N 3.16Å; F1156-Q1159 PolarHBondContact O-N 3.05Å; F1156-I1165 HydrophobicContact CD2-CD1 4.33Å; F1156-S1305 VanDerWaalsContact CE1-O 3.26Å; F1156-S1305 WeakPolarHBondContact CE1-O 3.47Å
1157N58.9Low61.5Low113 Ų11374.4 Ų74.460%0.60438%0.379SS*.THydrogen-bonded Turntrans-69.3-6.6179.5-82.4-80.6000115.1L1153 A1155L1153-N1157 PolarHBondContact O-N 3.29Å; L1153-N1157 PolarHBondContact O-ND2 2.92Å; A1155-N1157 VanDerWaalsContact C-N 3.3Å; A1155-N1157 PolarHBondContact O-N 3.05Å
1158K56.8Low59.8Low121 Ų12173.6 Ų73.653%0.52637%0.373SS..THydrogen-bonded Turntrans-90.4-3.7178.6-70.9175.1170.9179.80114.7A1155 F1156 Q1160 E1164A1155-K1158 PolarHBondContact O-N 2.97Å; A1155-K1158 VanDerWaalsContact O-N 3.14Å; F1156-K1158 PolarHBondContact O-N 3.04Å; F1156-K1158 VanDerWaalsContact O-N 3.16Å; K1158-Q1160 PolarHBondContact O-N 3.16Å; K1158-E1164 WeakPolarHBondContact CB-OE2 3.19Å; K1158-E1164 WeakPolarHBondContact CD-OE1 3.34Å; K1158-E1164 WeakPolarHBondContact CD-OE2 3.34Å; K1158-E1164 IonicContact NZ-OE1 2.68Å; K1158-E1164 PolarHBondContact NZ-OE1 3.35Å; K1158-E1164 IonicContact NZ-OE2 3.76Å
1159Q50.6Low58.3Low173 Ų17373.7 Ų73.781%0.80837%0.374SS*.SBendtrans61.71.5-174.7-61.3-173.7-26.400116.2F1156 C1161F1156-Q1159 PolarHBondContact O-N 3.05Å; Q1159-C1161 VanDerWaalsContact C-SG 3.51Å; Q1159-C1161 VanDerWaalsContact CA-SG 3.55Å; Q1159-C1161 PolarHBondContact O-N 2.94Å
1160Q44.9Very low57Low126 Ų12676.7 Ų76.759%0.58939%0.389SS*.  trans-7842.6176.6-136.589.87.500112.5K1158 H1162 A1163 E1164K1158-Q1160 PolarHBondContact O-N 3.16Å; Q1160-H1162 VanDerWaalsContact C-N 3.27Å; Q1160-H1162 PolarHBondContact O-N 3.38Å; Q1160-A1163 PolarHBondContact O-N 3.24Å; Q1160-E1164 HydrophobicContact CB-CB 4.13Å; Q1160-E1164 HydrophobicContact CB-CG 3.87Å; Q1160-E1164 WeakPolarHBondContact CB-OE2 3.27Å; Q1160-E1164 HydrophobicContact CG-CG 4.05Å; Q1160-E1164 PolarHBondContact O-N 3.12Å
1161C44.3Very low55.4Low52 Ų5273.9 Ų73.935%0.35138%0.381SS..THydrogen-bonded Turntrans-68.617.9-147.5-69.40000119.6Q1159 I1165Q1159-C1161 VanDerWaalsContact C-SG 3.51Å; Q1159-C1161 VanDerWaalsContact CA-SG 3.55Å; Q1159-C1161 PolarHBondContact O-N 2.94Å; C1161-I1165 WeakPolarHBondContact O-CD1 3.21Å
1162H49.5Very low54.2Low150 Ų15070.9 Ų70.969%0.69437%0.369SS*.THydrogen-bonded Turntrans-133.8-51.2164.4-86.7-93.4000111.7Q1160 I1165 A1166Q1160-H1162 VanDerWaalsContact C-N 3.27Å; Q1160-H1162 PolarHBondContact O-N 3.38Å; H1162-I1165 PolarHBondContact O-N 2.95Å; H1162-A1166 VanDerWaalsContact O-CB 3.3Å; H1162-A1166 WeakPolarHBondContact O-CB 3.45Å; H1162-A1166 PolarHBondContact O-N 3.44Å
1163A48Very low53.2Low75 Ų7570.6 Ų70.662%0.6237%0.369SS*.Hα-helixtrans-66.8-42.6-174.900000113.7Q1160 K1167Q1160-A1163 PolarHBondContact O-N 3.24Å; A1163-K1167 VanDerWaalsContact O-CB 3.31Å; A1163-K1167 WeakPolarHBondContact O-CB 3.28Å; A1163-K1167 PolarHBondContact O-N 3.02Å
1164E45.5Very low51.9Low51 Ų5174.6 Ų74.624%0.23839%0.386CS..Hα-helixtrans-75.1-28.6176.3-78.6-168.6132.500112.9K1158 Q1160 K1167 C1168K1158-E1164 WeakPolarHBondContact CB-OE2 3.19Å; K1158-E1164 WeakPolarHBondContact CD-OE1 3.34Å; K1158-E1164 WeakPolarHBondContact CD-OE2 3.34Å; K1158-E1164 IonicContact NZ-OE1 2.68Å; K1158-E1164 PolarHBondContact NZ-OE1 3.35Å; K1158-E1164 IonicContact NZ-OE2 3.76Å; Q1160-E1164 HydrophobicContact CB-CB 4.13Å; Q1160-E1164 HydrophobicContact CB-CG 3.87Å; Q1160-E1164 WeakPolarHBondContact CB-OE2 3.27Å; Q1160-E1164 HydrophobicContact CG-CG 4.05Å; Q1160-E1164 PolarHBondContact O-N 3.12Å; E1164-K1167 PolarHBondContact O-N 2.99Å; E1164-C1168 PolarHBondContact O-N 2.75Å
1165I49.8Very low50.7Low25 Ų2576.7 Ų76.713%0.12839%0.392CS..Hα-helixtrans-67.6-49173.1-60.2-175.2000109F1156 C1161 H1162 K1167 C1168 F1169F1156-I1165 HydrophobicContact CD2-CD1 4.33Å; C1161-I1165 WeakPolarHBondContact O-CD1 3.21Å; H1162-I1165 PolarHBondContact O-N 2.95Å; I1165-K1167 VanDerWaalsContact C-N 3.29Å; I1165-K1167 PolarHBondContact O-N 3.35Å; I1165-C1168 PolarHBondContact O-N 2.95Å; I1165-C1168 VanDerWaalsContact O-N 3.12Å; I1165-F1169 HydrophobicContact CG2-CD2 4.06Å; I1165-F1169 HydrophobicContact CG2-CE2 3.82Å; I1165-F1169 VanDerWaalsContact O-CD2 3.27Å; I1165-F1169 WeakPolarHBondContact O-CD2 3.47Å; I1165-F1169 PolarHBondContact O-N 2.91Å; I1165-F1169 VanDerWaalsContact O-N 3.13Å
1166A50.5Low49.9Very low20 Ų2077.7 Ų77.717%0.16540%0.396CS..Hα-helixtrans-55.2-46.4173.600000111.4H1162 C1168 F1169 Q1170 F1183H1162-A1166 VanDerWaalsContact O-CB 3.3Å; H1162-A1166 WeakPolarHBondContact O-CB 3.45Å; H1162-A1166 PolarHBondContact O-N 3.44Å; A1166-C1168 PolarHBondContact O-N 2.97Å; A1166-F1169 CarbonylContact O-C 3.52Å; A1166-F1169 PolarHBondContact O-N 3.39Å; A1166-F1169 VanDerWaalsContact O-N 3.11Å; A1166-Q1170 WeakPolarHBondContact O-CB 3.23Å; A1166-Q1170 PolarHBondContact O-N 3.32Å; A1166-F1183 VanDerWaalsContact CA-CZ 3.45Å; A1166-F1183 HydrophobicContact CB-CD1 4.07Å; A1166-F1183 HydrophobicContact CB-CD2 4.42Å; A1166-F1183 HydrophobicContact CB-CE1 3.8Å; A1166-F1183 HydrophobicContact CB-CE2 4.14Å; A1166-F1183 HydrophobicContact CB-CG 4.42Å; A1166-F1183 HydrophobicContact CB-CZ 3.88Å
1167K51Low49Very low119 Ų11982.4 Ų82.452%0.51742%0.417SS..Hα-helixtrans-60.3-42.3175.1-171.7166.6178.8170.60112.9A1163 E1164 I1165 F1169 Q1170 D1171A1163-K1167 VanDerWaalsContact O-CB 3.31Å; A1163-K1167 WeakPolarHBondContact O-CB 3.28Å; A1163-K1167 PolarHBondContact O-N 3.02Å; E1164-K1167 PolarHBondContact O-N 2.99Å; I1165-K1167 VanDerWaalsContact C-N 3.29Å; I1165-K1167 PolarHBondContact O-N 3.35Å; K1167-F1169 VanDerWaalsContact C-N 3.26Å; K1167-F1169 PolarHBondContact O-N 3.1Å; K1167-Q1170 PolarHBondContact O-N 2.95Å; K1167-D1171 VanDerWaalsContact CE-CG 3.41Å; K1167-D1171 WeakPolarHBondContact CE-OD1 3.07Å; K1167-D1171 WeakPolarHBondContact CE-OD2 3.43Å; K1167-D1171 VanDerWaalsContact CG-CG 3.49Å; K1167-D1171 WeakPolarHBondContact CG-OD1 3.4Å; K1167-D1171 WeakPolarHBondContact CG-OD2 3.4Å; K1167-D1171 VanDerWaalsContact O-CB 3.23Å; K1167-D1171 WeakPolarHBondContact O-CB 2.96Å; K1167-D1171 VanDerWaalsContact O-CG 3.29Å; K1167-D1171 PolarHBondContact O-N 3.48Å
1168C47Very low48.4Very low41 Ų4180.9 Ų80.928%0.27740%0.403SS..Hα-helixtrans-61.8-29.7174.3-83.10000114.1E1164 I1165 A1166 S1172E1164-C1168 PolarHBondContact O-N 2.75Å; I1165-C1168 PolarHBondContact O-N 2.95Å; I1165-C1168 VanDerWaalsContact O-N 3.12Å; A1166-C1168 PolarHBondContact O-N 2.97Å; C1168-S1172 PolarHBondContact O-OG 2.8Å
1169F49.2Very low47.9Very low33 Ų3375.7 Ų75.715%0.14538%0.381CS..Hα-helixtrans-80.8-29.4171.1-75.6-81000112.9I1165 A1166 K1167 S1172 M1173 F1183 L1191I1165-F1169 HydrophobicContact CG2-CD2 4.06Å; I1165-F1169 HydrophobicContact CG2-CE2 3.82Å; I1165-F1169 VanDerWaalsContact O-CD2 3.27Å; I1165-F1169 WeakPolarHBondContact O-CD2 3.47Å; I1165-F1169 PolarHBondContact O-N 2.91Å; I1165-F1169 VanDerWaalsContact O-N 3.13Å; A1166-F1169 CarbonylContact O-C 3.52Å; A1166-F1169 PolarHBondContact O-N 3.39Å; A1166-F1169 VanDerWaalsContact O-N 3.11Å; K1167-F1169 VanDerWaalsContact C-N 3.26Å; K1167-F1169 PolarHBondContact O-N 3.1Å; F1169-S1172 CarbonylContact O-C 3.59Å; F1169-M1173 WeakPolarHBondContact O-CB 3.21Å; F1169-M1173 PolarHBondContact O-N 2.9Å; F1169-F1183 HydrophobicContact CB-CE2 4.13Å; F1169-F1183 HydrophobicContact CB-CZ 3.85Å; F1169-F1183 HydrophobicContact CD2-CE1 4.48Å; F1169-F1183 AromaticContact CD2-CZ 3.8Å; F1169-F1183 HydrophobicContact CD2-CZ 3.8Å; F1169-F1183 HydrophobicContact CG-CZ 4.08Å; F1169-L1191 HydrophobicContact CE1-CD1 4.2Å; F1169-L1191 HydrophobicContact CZ-CD1 3.97Å
1170Q52.8Low47.5Very low80 Ų8072.4 Ų72.437%0.37437%0.365SS..Hα-helixtrans-80.9-46.8-178.2-159.5150.4700111.3A1166 K1167 S1172 M1173 E1174 E1180A1166-Q1170 WeakPolarHBondContact O-CB 3.23Å; A1166-Q1170 PolarHBondContact O-N 3.32Å; K1167-Q1170 PolarHBondContact O-N 2.95Å; Q1170-S1172 PolarHBondContact O-N 3.35Å; Q1170-M1173 CarbonylContact O-C 3.51Å; Q1170-M1173 PolarHBondContact O-N 3.31Å; Q1170-E1174 WeakPolarHBondContact O-CA 3.48Å; Q1170-E1174 VanDerWaalsContact O-CG 3.26Å; Q1170-E1174 WeakPolarHBondContact O-CG 3.5Å; Q1170-E1174 PolarHBondContact O-N 3.36Å; Q1170-E1180 PolarHBondContact NE2-OE1 3.06Å; Q1170-E1180 VanDerWaalsContact NE2-OE1 3.15Å
1171D47.1Very low47.5Very low90 Ų9072.7 Ų72.748%0.48137%0.371SS..THydrogen-bonded Turntrans-61.1-5.2169.7-67.36.3000113.6K1167K1167-D1171 VanDerWaalsContact CE-CG 3.41Å; K1167-D1171 WeakPolarHBondContact CE-OD1 3.07Å; K1167-D1171 WeakPolarHBondContact CE-OD2 3.43Å; K1167-D1171 VanDerWaalsContact CG-CG 3.49Å; K1167-D1171 WeakPolarHBondContact CG-OD1 3.4Å; K1167-D1171 WeakPolarHBondContact CG-OD2 3.4Å; K1167-D1171 VanDerWaalsContact O-CB 3.23Å; K1167-D1171 WeakPolarHBondContact O-CB 2.96Å; K1167-D1171 VanDerWaalsContact O-CG 3.29Å; K1167-D1171 PolarHBondContact O-N 3.48Å
1172S49Very low47.7Very low16 Ų1672 Ų7211%0.11236%0.364CS..THydrogen-bonded Turntrans-130.211.8174.167.20000113.8C1168 F1169 Q1170 F1500C1168-S1172 PolarHBondContact O-OG 2.8Å; F1169-S1172 CarbonylContact O-C 3.59Å; Q1170-S1172 PolarHBondContact O-N 3.35Å; S1172-F1500 WeakPolarHBondContact O-CE2 3.09Å; S1172-F1500 WeakPolarHBondContact O-CZ 3.23Å
1173M50.4Low47.4Very low14 Ų1466.8 Ų66.87%0.06934%0.339CS..  trans-160.850.3176-54.7-171.8170.500112.1F1169 Q1170 N1175 L1176 L1179 I1198 F1500F1169-M1173 WeakPolarHBondContact O-CB 3.21Å; F1169-M1173 PolarHBondContact O-N 2.9Å; Q1170-M1173 CarbonylContact O-C 3.51Å; Q1170-M1173 PolarHBondContact O-N 3.31Å; M1173-N1175 PolarHBondContact O-N 2.85Å; M1173-L1176 HydrophobicContact CB-CD1 3.56Å; M1173-L1176 HydrophobicContact CB-CG 3.88Å; M1173-L1176 HydrophobicContact CG-CD1 3.98Å; M1173-L1176 PolarHBondContact O-N 3.28Å; M1173-L1176 HydrophobicContact SD-CD1 3.38Å; M1173-L1176 WeakPolarHBondContact SD-CD1 3.45Å; M1173-L1179 HydrophobicContact SD-CD1 4.15Å; M1173-I1198 HydrophobicContact CE-CD1 3.57Å; M1173-F1500 HydrophobicContact CG-CE2 4.39Å; M1173-F1500 HydrophobicContact CG-CZ 4.06Å
1174E42.9Very low46.9Very low131 Ų13172.5 Ų72.561%0.61235%0.353SS*.THydrogen-bonded Turntrans-56.4-5.4-166.7-71.6-164.7138.400117.2Q1170Q1170-E1174 WeakPolarHBondContact O-CA 3.48Å; Q1170-E1174 VanDerWaalsContact O-CG 3.26Å; Q1170-E1174 WeakPolarHBondContact O-CG 3.5Å; Q1170-E1174 PolarHBondContact O-N 3.36Å
1175N47Very low46.8Very low114 Ų11476.8 Ų76.861%0.6137%0.371SS*.THydrogen-bonded Turntrans-114.121.2-171.1-78.3-86.7000115.2M1173 K1467M1173-N1175 PolarHBondContact O-N 2.85Å; N1175-K1467 WeakPolarHBondContact O-CE 3.32Å; N1175-K1467 PolarHBondContact O-NZ 3.07Å
1176L48.6Very low46.8Very low24 Ų2477.2 Ų77.213%0.12638%0.375CS..  trans-111.871.9-169.8-55.7-168.7000115.4M1173 W1178 L1179 E1180 Y1463 K1467M1173-L1176 HydrophobicContact CB-CD1 3.56Å; M1173-L1176 HydrophobicContact CB-CG 3.88Å; M1173-L1176 HydrophobicContact CG-CD1 3.98Å; M1173-L1176 PolarHBondContact O-N 3.28Å; M1173-L1176 HydrophobicContact SD-CD1 3.38Å; M1173-L1176 WeakPolarHBondContact SD-CD1 3.45Å; L1176-W1178 PolarHBondContact O-N 2.95Å; L1176-L1179 HydrophobicContact CB-CB 4.05Å; L1176-L1179 HydrophobicContact CB-CD1 4.34Å; L1176-L1179 HydrophobicContact CD1-CD1 3.68Å; L1176-L1179 WeakPolarHBondContact O-CA 3.25Å; L1176-L1179 WeakPolarHBondContact O-CB 3.21Å; L1176-L1179 PolarHBondContact O-N 3.25Å; L1176-E1180 PolarHBondContact O-N 3.22Å; L1176-Y1463 HydrophobicContact CD1-CE1 4.4Å; L1176-Y1463 HydrophobicContact CD2-CE1 4.1Å; L1176-K1467 HydrophobicContact CD2-CD 3.39Å
1177K45.1Very low47.3Very low162 Ų16279.4 Ų79.470%0.70439%0.387SS*.Hα-helixtrans-52.5-22.8171.8-69.8-173.4173.9-176.50115.6N1181K1177-N1181 WeakPolarHBondContact O-CB 3.41Å; K1177-N1181 PolarHBondContact O-N 3.13Å; K1177-N1181 VanDerWaalsContact O-N 3.16Å
1178W46.7Very low48Very low82 Ų8275.8 Ų75.831%0.31138%0.375SS..Hα-helixtrans-72.1-33.3174178.294.2000111.9L1176 N1182 F1194 Y1463L1176-W1178 PolarHBondContact O-N 2.95Å; W1178-N1182 PolarHBondContact NE1-ND2 3.44Å; W1178-N1182 WeakPolarHBondContact O-CB 3.42Å; W1178-N1182 PolarHBondContact O-N 3.28Å; W1178-N1182 PolarHBondContact O-ND2 3.12Å; W1178-F1194 HydrophobicContact CH2-CZ 4.33Å; W1178-F1194 AromaticContact CZ3-CZ 3.97Å; W1178-F1194 HydrophobicContact CZ3-CZ 3.97Å; W1178-Y1463 HydrophobicContact CB-CD2 4.14Å; W1178-Y1463 HydrophobicContact CB-CE1 4.12Å; W1178-Y1463 HydrophobicContact CB-CE2 3.37Å; W1178-Y1463 WeakPolarHBondContact CB-OH 3.23Å; W1178-Y1463 HydrophobicContact CD2-CD1 4.32Å; W1178-Y1463 HydrophobicContact CD2-CD2 4.27Å; W1178-Y1463 HydrophobicContact CD2-CE1 4.35Å; W1178-Y1463 HydrophobicContact CD2-CE2 4.32Å; W1178-Y1463 HydrophobicContact CD2-CG 4.29Å; W1178-Y1463 HydrophobicContact CE3-CD1 4.16Å; W1178-Y1463 HydrophobicContact CE3-CE1 4.13Å; W1178-Y1463 AromaticContact CG-CD2 3.92Å; W1178-Y1463 HydrophobicContact CG-CD2 3.92Å; W1178-Y1463 HydrophobicContact CG-CE1 4.39Å; W1178-Y1463 AromaticContact CG-CE2 3.67Å; W1178-Y1463 HydrophobicContact CG-CE2 3.67Å; W1178-Y1463 HydrophobicContact CG-CG 4.41Å; W1178-Y1463 AromaticContact CG-CZ 3.94Å
1179L46.3Very low49.2Very low12 Ų1275.7 Ų75.76%0.06337%0.372CS..Hα-helixtrans-71.4-41.2175.2-111.1159.3000110.1M1173 L1176 N1181 N1182 F1183 C1186M1173-L1179 HydrophobicContact SD-CD1 4.15Å; L1176-L1179 HydrophobicContact CB-CB 4.05Å; L1176-L1179 HydrophobicContact CB-CD1 4.34Å; L1176-L1179 HydrophobicContact CD1-CD1 3.68Å; L1176-L1179 WeakPolarHBondContact O-CA 3.25Å; L1176-L1179 WeakPolarHBondContact O-CB 3.21Å; L1176-L1179 PolarHBondContact O-N 3.25Å; L1179-N1181 PolarHBondContact O-N 3.11Å; L1179-N1182 CarbonylContact O-C 3.4Å; L1179-N1182 PolarHBondContact O-N 2.69Å; L1179-N1182 VanDerWaalsContact O-N 3.16Å; L1179-F1183 HydrophobicContact CB-CD2 4.33Å; L1179-F1183 HydrophobicContact CB-CE2 4.4Å; L1179-F1183 HydrophobicContact CD2-CD2 3.79Å; L1179-F1183 HydrophobicContact CD2-CE2 3.52Å; L1179-F1183 HydrophobicContact CD2-CZ 4.02Å; L1179-F1183 HydrophobicContact CG-CE2 4.48Å; L1179-F1183 VanDerWaalsContact O-CA 3.25Å; L1179-F1183 WeakPolarHBondContact O-CA 3.48Å; L1179-F1183 WeakPolarHBondContact O-CB 3.31Å; L1179-F1183 WeakPolarHBondContact O-CD2 3.33Å; L1179-F1183 PolarHBondContact O-N 2.77Å; L1179-C1186 HydrophobicContact CD2-CB 4.27Å
1180E41.9Very low50.6Low103 Ų10375.9 Ų75.948%0.48137%0.373SS..Hα-helixtrans-54.5-51.5170.1-64.9178.913000111.3Q1170 L1176 N1182 F1183Q1170-E1180 PolarHBondContact NE2-OE1 3.06Å; Q1170-E1180 VanDerWaalsContact NE2-OE1 3.15Å; L1176-E1180 PolarHBondContact O-N 3.22Å; E1180-N1182 PolarHBondContact O-N 3.38Å; E1180-F1183 PolarHBondContact O-N 3.07Å
1181N45.5Very low52Low132 Ų13272.8 Ų72.871%0.70636%0.359SS*.THydrogen-bonded Turntrans-71.9-5.5-179.9-71.5-15.7000115.2K1177 L1179K1177-N1181 WeakPolarHBondContact O-CB 3.41Å; K1177-N1181 PolarHBondContact O-N 3.13Å; K1177-N1181 VanDerWaalsContact O-N 3.16Å; L1179-N1181 PolarHBondContact O-N 3.11Å
1182N48.9Very low54Low38 Ų3868.9 Ų68.920%0.20334%0.339CS..THydrogen-bonded Turntrans-13216176.7-65.4-84.2000112.5W1178 L1179 E1180 E1184 K1185 C1186W1178-N1182 PolarHBondContact NE1-ND2 3.44Å; W1178-N1182 WeakPolarHBondContact O-CB 3.42Å; W1178-N1182 PolarHBondContact O-N 3.28Å; W1178-N1182 PolarHBondContact O-ND2 3.12Å; L1179-N1182 CarbonylContact O-C 3.4Å; L1179-N1182 PolarHBondContact O-N 2.69Å; L1179-N1182 VanDerWaalsContact O-N 3.16Å; E1180-N1182 PolarHBondContact O-N 3.38Å; N1182-E1184 VanDerWaalsContact C-N 3.32Å; N1182-E1184 PolarHBondContact O-N 2.99Å; N1182-K1185 CarbonylContact O-C 3.34Å; N1182-K1185 WeakPolarHBondContact O-CA 3.31Å; N1182-K1185 WeakPolarHBondContact O-CB 3.47Å; N1182-K1185 PolarHBondContact O-N 2.86Å; N1182-C1186 PolarHBondContact O-N 2.85Å; N1182-C1186 PolarHBondContact O-SG 3.5Å
1183F41.5Very low56Low41 Ų4168.2 Ų68.218%0.1833%0.334CS..G310 helixtrans-67.8-37.9-172.6-136-65.7000111.3A1166 F1169 L1179 E1180 K1185 C1186A1166-F1183 VanDerWaalsContact CA-CZ 3.45Å; A1166-F1183 HydrophobicContact CB-CD1 4.07Å; A1166-F1183 HydrophobicContact CB-CD2 4.42Å; A1166-F1183 HydrophobicContact CB-CE1 3.8Å; A1166-F1183 HydrophobicContact CB-CE2 4.14Å; A1166-F1183 HydrophobicContact CB-CG 4.42Å; A1166-F1183 HydrophobicContact CB-CZ 3.88Å; F1169-F1183 HydrophobicContact CB-CE2 4.13Å; F1169-F1183 HydrophobicContact CB-CZ 3.85Å; F1169-F1183 HydrophobicContact CD2-CE1 4.48Å; F1169-F1183 AromaticContact CD2-CZ 3.8Å; F1169-F1183 HydrophobicContact CD2-CZ 3.8Å; F1169-F1183 HydrophobicContact CG-CZ 4.08Å; L1179-F1183 HydrophobicContact CB-CD2 4.33Å; L1179-F1183 HydrophobicContact CB-CE2 4.4Å; L1179-F1183 HydrophobicContact CD2-CD2 3.79Å; L1179-F1183 HydrophobicContact CD2-CE2 3.52Å; L1179-F1183 HydrophobicContact CD2-CZ 4.02Å; L1179-F1183 HydrophobicContact CG-CE2 4.48Å; L1179-F1183 VanDerWaalsContact O-CA 3.25Å; L1179-F1183 WeakPolarHBondContact O-CA 3.48Å; L1179-F1183 WeakPolarHBondContact O-CB 3.31Å; L1179-F1183 WeakPolarHBondContact O-CD2 3.33Å; L1179-F1183 PolarHBondContact O-N 2.77Å; E1180-F1183 PolarHBondContact O-N 3.07Å; F1183-K1185 PolarHBondContact O-N 3.09Å; F1183-K1185 VanDerWaalsContact O-N 3.1Å; F1183-C1186 PolarHBondContact O-N 3.25Å; F1183-C1186 VanDerWaalsContact O-N 3.15Å
1184E37.5Very low57.9Low194 Ų19468.1 Ų68.191%0.90733%0.333SS*.G310 helixtrans-60.2-16.7171.1-59.1-176.5136.900113.5N1182N1182-E1184 VanDerWaalsContact C-N 3.32Å; N1182-E1184 PolarHBondContact O-N 2.99Å
1185K44.6Very low60.1Low142 Ų14262.8 Ų62.862%0.61731%0.308SS*.G310 helixtrans-105.9-15178.1-61.4175.6-175.3167.30113.4N1182 F1183 T1187N1182-K1185 CarbonylContact O-C 3.34Å; N1182-K1185 WeakPolarHBondContact O-CA 3.31Å; N1182-K1185 WeakPolarHBondContact O-CB 3.47Å; N1182-K1185 PolarHBondContact O-N 2.86Å; F1183-K1185 PolarHBondContact O-N 3.09Å; F1183-K1185 VanDerWaalsContact O-N 3.1Å; K1185-T1187 PolarHBondContact O-N 3.28Å
1186C50.2Low62.2Low33 Ų3357.4 Ų57.422%0.22328%0.28CS..  trans-77.565.5179.8-71.20000111.3L1179 N1182 F1183L1179-C1186 HydrophobicContact CD2-CB 4.27Å; N1182-C1186 PolarHBondContact O-N 2.85Å; N1182-C1186 PolarHBondContact O-SG 3.5Å; F1183-C1186 PolarHBondContact O-N 3.25Å; F1183-C1186 VanDerWaalsContact O-N 3.15Å
1187T60.8Low64.3Low66 Ų6656.4 Ų56.441%0.40528%0.275SS..  trans-59.5159.6173.666.60000111.7K1185 N1189 H1190K1185-T1187 PolarHBondContact O-N 3.28Å; T1187-N1189 PolarHBondContact O-N 2.95Å; T1187-H1190 PolarHBondContact O-CD2 3.29Å; T1187-H1190 PolarHBondContact O-N 2.82Å; T1187-H1190 PolarHBondContact OG1-CD2 2.9Å; T1187-H1190 VanDerWaalsContact OG1-CD2 3.28Å
1188T65.8Low66.3Low44 Ų4449.3 Ų49.327%0.2724%0.244SC..THydrogen-bonded Turntrans-51.3-21.8173.839.20000114.1W1152 H1190 H1311W1152-T1188 HydrophobicContact CZ2-CG2 4.29Å; T1188-H1190 VanDerWaalsContact C-N 3.31Å; T1188-H1190 PolarHBondContact O-N 3.48Å; T1188-H1311 PolarHBondContact OG1-CE1 2.75Å; T1188-H1311 PolarHBondContact OG1-ND1 3.02Å; T1188-H1311 PolarHBondContact OG1-NE2 2.93Å
1189N70.6Confident68.5Low39 Ų3945.5 Ų45.521%0.20923%0.23CC..THydrogen-bonded Turntrans-65.2-27.2174.8-63-30.9000113.7T1187 H1311 L1312 N1315T1187-N1189 PolarHBondContact O-N 2.95Å; N1189-H1311 PolarHBondContact OD1-CE1 3.33Å; N1189-H1311 PolarHBondContact OD1-ND1 3.22Å; N1189-L1312 HydrophobicContact CB-CD1 3.92Å; N1189-N1315 PolarHBondContact ND2-ND2 2.98Å; N1189-N1315 PolarHBondContact OD1-ND2 2.77Å
1190H79.6Confident70.7Confident36 Ų3645 Ų4517%0.16723%0.227CC..THydrogen-bonded Turntrans-83.8-22.4-178.6-60.8-89.5000113.3T1187 T1188 L1193 F1194 N1456 I1460T1187-H1190 PolarHBondContact O-CD2 3.29Å; T1187-H1190 PolarHBondContact O-N 2.82Å; T1187-H1190 PolarHBondContact OG1-CD2 2.9Å; T1187-H1190 VanDerWaalsContact OG1-CD2 3.28Å; T1188-H1190 VanDerWaalsContact C-N 3.31Å; T1188-H1190 PolarHBondContact O-N 3.48Å; H1190-L1193 WeakPolarHBondContact O-CB 3.45Å; H1190-L1193 PolarHBondContact O-N 2.92Å; H1190-F1194 HydrophobicContact CB-CD2 4.07Å; H1190-F1194 HydrophobicContact CB-CE2 3.92Å; H1190-F1194 WeakPolarHBondContact O-CD2 3.39Å; H1190-F1194 PolarHBondContact O-N 3.4Å; H1190-N1456 PolarHBondContact CE1-OD1 3.26Å; H1190-I1460 HydrophobicContact CB-CD1 4.45Å
1191L83Confident72.8Confident16 Ų1642.2 Ų42.28%0.08422%0.219CC..Hα-helixtrans-57.2-46.4-175.2173.154.7000113.1W1152 F1169 L1193 F1194 D1195 P1308W1152-L1191 HydrophobicContact CD2-CD2 4.09Å; W1152-L1191 HydrophobicContact CG-CD2 3.84Å; F1169-L1191 HydrophobicContact CE1-CD1 4.2Å; F1169-L1191 HydrophobicContact CZ-CD1 3.97Å; L1191-L1193 PolarHBondContact O-N 3.15Å; L1191-F1194 PolarHBondContact O-N 2.99Å; L1191-D1195 WeakPolarHBondContact CD1-OD1 3.49Å; L1191-D1195 PolarHBondContact O-N 3.34Å; L1191-P1308 HydrophobicContact CD2-CB 4.2Å; L1191-P1308 HydrophobicContact CD2-CG 3.92Å; L1191-P1308 HydrophobicContact CG-CB 4.45Å
1192P88.4Confident74.7Confident8 Ų838 Ų385%0.05219%0.194CC..Hα-helixtrans-57.1-34.3173.7-2635.7000113.8L1196 P1308 E1309 L1312P1192-L1196 WeakPolarHBondContact O-CG 3.36Å; P1192-L1196 PolarHBondContact O-N 3.1Å; P1192-L1196 VanDerWaalsContact O-N 3.12Å; P1192-P1308 HydrophobicContact CG-CB 4.08Å; P1192-E1309 HydrophobicContact CB-CG 4.36Å; P1192-E1309 HydrophobicContact CG-CG 4.24Å; P1192-L1312 HydrophobicContact CB-CD2 3.82Å; P1192-L1312 HydrophobicContact CG-CB 4.27Å; P1192-L1312 HydrophobicContact CG-CD2 3.86Å
1193L91.6Very high76.6Confident2 Ų236.2 Ų36.21%0.0119%0.185CC..Hα-helixtrans-72-43.4178.8-59-179.9000112H1190 L1191 D1195 L1196 V1197 I1226 L1453 N1456 L1457 I1460H1190-L1193 WeakPolarHBondContact O-CB 3.45Å; H1190-L1193 PolarHBondContact O-N 2.92Å; L1191-L1193 PolarHBondContact O-N 3.15Å; L1193-D1195 VanDerWaalsContact C-N 3.3Å; L1193-D1195 PolarHBondContact O-N 3.12Å; L1193-L1196 PolarHBondContact O-N 3.24Å; L1193-V1197 WeakPolarHBondContact O-CG2 3.43Å; L1193-V1197 PolarHBondContact O-N 2.92Å; L1193-V1197 VanDerWaalsContact O-N 3.13Å; L1193-I1226 HydrophobicContact CD2-CD1 4.47Å; L1193-L1453 HydrophobicContact CD1-CD1 3.99Å; L1193-L1453 HydrophobicContact CD2-CD1 4.06Å; L1193-L1453 HydrophobicContact CD2-CG 4.43Å; L1193-L1453 HydrophobicContact CG-CD1 4.38Å; L1193-N1456 HydrophobicContact CD1-CB 3.86Å; L1193-L1457 HydrophobicContact CD2-CB 4.38Å; L1193-L1457 HydrophobicContact CD2-CD1 4.31Å; L1193-I1460 HydrophobicContact CB-CD1 3.79Å; L1193-I1460 HydrophobicContact CD1-CD1 4.27Å
1194F88.7Confident78.2Confident11 Ų1136.2 Ų36.25%0.04819%0.189CC..Hα-helixtrans-57.7-44.9172.4-81.7-74.6000111.2W1178 H1190 L1191 L1196 V1197 I1198 I1460 L1464W1178-F1194 HydrophobicContact CH2-CZ 4.33Å; W1178-F1194 AromaticContact CZ3-CZ 3.97Å; W1178-F1194 HydrophobicContact CZ3-CZ 3.97Å; H1190-F1194 HydrophobicContact CB-CD2 4.07Å; H1190-F1194 HydrophobicContact CB-CE2 3.92Å; H1190-F1194 WeakPolarHBondContact O-CD2 3.39Å; H1190-F1194 PolarHBondContact O-N 3.4Å; L1191-F1194 PolarHBondContact O-N 2.99Å; F1194-L1196 PolarHBondContact O-N 2.94Å; F1194-V1197 PolarHBondContact O-N 3.34Å; F1194-I1198 HydrophobicContact CB-CD1 4.47Å; F1194-I1198 WeakPolarHBondContact O-CB 3.45Å; F1194-I1198 WeakPolarHBondContact O-CD1 3.3Å; F1194-I1198 VanDerWaalsContact O-CG1 3.24Å; F1194-I1198 WeakPolarHBondContact O-CG1 3.45Å; F1194-I1198 PolarHBondContact O-N 2.77Å; F1194-I1460 HydrophobicContact CD1-CG1 4.5Å; F1194-I1460 HydrophobicContact CD1-CG2 3.56Å; F1194-I1460 HydrophobicContact CD2-CD1 3.97Å; F1194-I1460 HydrophobicContact CE1-CB 4.39Å; F1194-I1460 HydrophobicContact CE1-CD1 4.42Å; F1194-I1460 HydrophobicContact CE1-CG1 4.02Å; F1194-I1460 HydrophobicContact CE1-CG2 3.63Å; F1194-I1460 HydrophobicContact CE2-CD1 3.78Å; F1194-I1460 HydrophobicContact CE2-CG1 4.08Å; F1194-I1460 HydrophobicContact CG-CD1 4.35Å; F1194-I1460 HydrophobicContact CG-CG2 4.15Å; F1194-I1460 HydrophobicContact CZ-CD1 4.02Å; F1194-I1460 HydrophobicContact CZ-CG1 3.77Å; F1194-I1460 HydrophobicContact CZ-CG2 4.27Å; F1194-L1464 HydrophobicContact CD1-CD1 4.31Å
1195D89.3Confident79.9Confident19 Ų1927.5 Ų27.510%0.10215%0.148CC..Hα-helixtrans-64.9-37.3-178.4-74.47.1000112.3I1145 R1148 L1191 L1193 W1199I1145-D1195 HydrophobicContact CD1-CB 4.06Å; I1145-D1195 WeakPolarHBondContact CD1-O 3.47Å; I1145-D1195 HydrophobicContact CG2-CB 4.33Å; R1148-D1195 IonicContact CZ-OD1 3.81Å; R1148-D1195 VanDerWaalsContact CZ-OD1 3.22Å; R1148-D1195 IonicContact NH1-OD1 2.99Å; R1148-D1195 PolarHBondContact NH1-OD1 3.34Å; R1148-D1195 IonicContact NH2-OD1 2.61Å; R1148-D1195 PolarHBondContact NH2-OD1 3.24Å; L1191-D1195 WeakPolarHBondContact CD1-OD1 3.49Å; L1191-D1195 PolarHBondContact O-N 3.34Å; L1193-D1195 VanDerWaalsContact C-N 3.3Å; L1193-D1195 PolarHBondContact O-N 3.12Å; D1195-W1199 WeakPolarHBondContact O-CB 3.3Å; D1195-W1199 PolarHBondContact O-N 3.03Å
1196L92.7Very high81.5Confident2 Ų221 Ų211%0.0112%0.12CC..Hα-helixtrans-67.6-41.4174-70.7-177000113.7P1192 L1193 F1194 S1200 L1225 I1226P1192-L1196 WeakPolarHBondContact O-CG 3.36Å; P1192-L1196 PolarHBondContact O-N 3.1Å; P1192-L1196 VanDerWaalsContact O-N 3.12Å; L1193-L1196 PolarHBondContact O-N 3.24Å; F1194-L1196 PolarHBondContact O-N 2.94Å; L1196-S1200 WeakPolarHBondContact O-CB 3.29Å; L1196-S1200 PolarHBondContact O-N 2.97Å; L1196-S1200 PolarHBondContact O-OG 3.27Å; L1196-L1225 HydrophobicContact CD1-CB 3.91Å; L1196-L1225 HydrophobicContact CD2-CB 3.62Å; L1196-L1225 HydrophobicContact CD2-CD1 4.29Å; L1196-L1225 HydrophobicContact CG-CB 4.45Å; L1196-I1226 HydrophobicContact CD1-CG1 3.96Å
1197V91.4Very high82.6Confident3 Ų323.1 Ų23.12%0.01813%0.134CC..Hα-helixtrans-67.6-44.2177.1177.30000110.3L1193 F1194 S1200 S1201 L1218 I1460 F1461 L1464L1193-V1197 WeakPolarHBondContact O-CG2 3.43Å; L1193-V1197 PolarHBondContact O-N 2.92Å; L1193-V1197 VanDerWaalsContact O-N 3.13Å; F1194-V1197 PolarHBondContact O-N 3.34Å; V1197-S1200 PolarHBondContact O-OG 2.93Å; V1197-S1201 VanDerWaalsContact O-CB 3.22Å; V1197-S1201 WeakPolarHBondContact O-CB 3.36Å; V1197-S1201 PolarHBondContact O-N 3.4Å; V1197-S1201 PolarHBondContact O-OG 2.98Å; V1197-L1218 HydrophobicContact CG2-CD1 4.39Å; V1197-I1460 HydrophobicContact CB-CG2 4.39Å; V1197-I1460 HydrophobicContact CG2-CG2 4.13Å; V1197-F1461 HydrophobicContact CG1-CD2 3.93Å; V1197-F1461 HydrophobicContact CG2-CB 4.33Å; V1197-F1461 HydrophobicContact CG2-CD2 4.25Å; V1197-L1464 HydrophobicContact CB-CD1 4.14Å; V1197-L1464 HydrophobicContact CG1-CB 4.4Å; V1197-L1464 HydrophobicContact CG1-CD1 3.61Å
1198I88.4Confident83.2Confident12 Ų1225.6 Ų25.66%0.06214%0.141CC..Hα-helixtrans-63.7-48.2178.2-69164.7000110.9I1145 M1173 F1194 S1201 L1464I1145-I1198 HydrophobicContact CD1-CG2 4.27Å; M1173-I1198 HydrophobicContact CE-CD1 3.57Å; F1194-I1198 HydrophobicContact CB-CD1 4.47Å; F1194-I1198 WeakPolarHBondContact O-CB 3.45Å; F1194-I1198 WeakPolarHBondContact O-CD1 3.3Å; F1194-I1198 VanDerWaalsContact O-CG1 3.24Å; F1194-I1198 WeakPolarHBondContact O-CG1 3.45Å; F1194-I1198 PolarHBondContact O-N 2.77Å; I1198-S1201 PolarHBondContact O-N 3.03Å; I1198-S1201 PolarHBondContact O-OG 3.14Å; I1198-L1464 HydrophobicContact CG1-CD1 4.26Å
1199W92.8Very high84Confident3 Ų324.5 Ų24.51%0.01113%0.133CC..Hα-helixtrans-53.8-55.3175.7170.782.4000112E1142 I1145 D1195 S1201 K1202 L1203 L1225 K1377 L1378 L1381E1142-W1199 PolarHBondContact OE1-NE1 3.37Å; I1145-W1199 HydrophobicContact CD1-CB 4.2Å; I1145-W1199 HydrophobicContact CG1-CB 3.99Å; D1195-W1199 WeakPolarHBondContact O-CB 3.3Å; D1195-W1199 PolarHBondContact O-N 3.03Å; W1199-S1201 VanDerWaalsContact C-N 3.32Å; W1199-S1201 PolarHBondContact O-N 2.67Å; W1199-K1202 PolarHBondContact O-N 2.99Å; W1199-L1203 HydrophobicContact CD2-CD1 4.34Å; W1199-L1203 HydrophobicContact CH2-CD1 3.83Å; W1199-L1203 HydrophobicContact CZ2-CD1 3.66Å; W1199-L1203 HydrophobicContact CZ3-CD1 4.29Å; W1199-L1225 HydrophobicContact CZ3-CD1 4.43Å; W1199-L1225 HydrophobicContact CZ3-CD2 4.45Å; W1199-K1377 HydrophobicContact CH2-CB 3.49Å; W1199-K1377 VanDerWaalsContact CH2-CB 3.49Å; W1199-K1377 HydrophobicContact CH2-CD 4.46Å; W1199-K1377 HydrophobicContact CZ2-CB 3.41Å; W1199-K1377 VanDerWaalsContact CZ2-CB 3.41Å; W1199-K1377 HydrophobicContact CZ2-CD 3.84Å; W1199-K1377 HydrophobicContact CZ2-CG 4.31Å; W1199-K1377 HydrophobicContact CZ3-CB 4.41Å; W1199-L1378 HydrophobicContact CH2-CB 4.44Å; W1199-L1381 HydrophobicContact CH2-CD2 4.35Å; W1199-L1381 HydrophobicContact CZ3-CD2 3.84Å
1200S91.8Very high84.8Confident0 Ų026.1 Ų26.10%015%0.148CC..Hα-helixtrans-67.6-30.8-177.559.70000112.8L1196 V1197 K1202 L1203 H1214L1196-S1200 WeakPolarHBondContact O-CB 3.29Å; L1196-S1200 PolarHBondContact O-N 2.97Å; L1196-S1200 PolarHBondContact O-OG 3.27Å; V1197-S1200 PolarHBondContact O-OG 2.93Å; S1200-K1202 PolarHBondContact O-N 3.45Å; S1200-L1203 PolarHBondContact O-N 3.47Å; S1200-H1214 WeakPolarHBondContact CB-NE2 3.45Å; S1200-H1214 PolarHBondContact OG-NE2 3.49Å
1201S86.9Confident85.1Confident45 Ų4527.9 Ų27.932%0.31516%0.164SC..Hα-helixtrans-64.6-19.5177.876.90000114.9V1197 I1198 W1199V1197-S1201 VanDerWaalsContact O-CB 3.22Å; V1197-S1201 WeakPolarHBondContact O-CB 3.36Å; V1197-S1201 PolarHBondContact O-N 3.4Å; V1197-S1201 PolarHBondContact O-OG 2.98Å; I1198-S1201 PolarHBondContact O-N 3.03Å; I1198-S1201 PolarHBondContact O-OG 3.14Å; W1199-S1201 VanDerWaalsContact C-N 3.32Å; W1199-S1201 PolarHBondContact O-N 2.67Å
1202K85Confident85.3Confident44 Ų4429 Ų2919%0.19118%0.178CC..THydrogen-bonded Turntrans-91.1-8.7179.1-71.5-173176.2-124.50114.2A1141 T1144 W1199 S1200 S1501A1141-K1202 HydrophobicContact CB-CB 4.18Å; T1144-K1202 PolarHBondContact OG1-NZ 2.9Å; W1199-K1202 PolarHBondContact O-N 2.99Å; S1200-K1202 PolarHBondContact O-N 3.45Å; K1202-S1501 WeakPolarHBondContact CE-O 3.49Å; K1202-S1501 PolarHBondContact NZ-O 2.95Å
1203L87.5Confident85.2Confident0 Ų029.1 Ų29.10%018%0.179CC..  trans-88.2127.4-173.5-60.4179.8000112.2I1138 A1141 W1199 S1200 Y1205 I1206 L1378I1138-L1203 HydrophobicContact CG1-CD2 3.97Å; A1141-L1203 HydrophobicContact CB-CD2 3.9Å; W1199-L1203 HydrophobicContact CD2-CD1 4.34Å; W1199-L1203 HydrophobicContact CH2-CD1 3.83Å; W1199-L1203 HydrophobicContact CZ2-CD1 3.66Å; W1199-L1203 HydrophobicContact CZ3-CD1 4.29Å; S1200-L1203 PolarHBondContact O-N 3.47Å; L1203-Y1205 VanDerWaalsContact C-N 3.33Å; L1203-Y1205 PolarHBondContact O-N 3.24Å; L1203-I1206 HydrophobicContact CB-CD1 4.1Å; L1203-I1206 HydrophobicContact CB-CG1 4.23Å; L1203-I1206 HydrophobicContact CD1-CD1 4.03Å; L1203-I1206 PolarHBondContact O-N 3.09Å; L1203-I1206 VanDerWaalsContact O-N 3.14Å; L1203-L1378 HydrophobicContact CD1-CD1 3.96Å; L1203-L1378 HydrophobicContact CD1-CD2 4.4Å
1204P75.3Confident85.1Confident42 Ų4230 Ų3027%0.27318%0.183SC..THydrogen-bonded Turntrans-65.6-33.9-17526.1-35.5000113F1137 I1206 C1207F1137-P1204 HydrophobicContact CB-CG 4.03Å; F1137-P1204 HydrophobicContact CD2-CB 4.43Å; F1137-P1204 HydrophobicContact CD2-CG 3.83Å; F1137-P1204 HydrophobicContact CG-CG 4.08Å; P1204-I1206 PolarHBondContact O-N 3.32Å; P1204-C1207 WeakPolarHBondContact O-CB 3.47Å; P1204-C1207 PolarHBondContact O-N 2.88Å
1205Y74.6Confident85.3Confident10 Ų1030.4 Ų30.44%0.03919%0.186CC..THydrogen-bonded Turntrans-55-34.8174.8-60.5-84.3000113A1134 I1138 L1203 L1378 L1400 Q1403 V1404A1134-Y1205 HydrophobicContact CB-CE2 4.23Å; I1138-Y1205 HydrophobicContact CD1-CE2 4.16Å; L1203-Y1205 VanDerWaalsContact C-N 3.33Å; L1203-Y1205 PolarHBondContact O-N 3.24Å; Y1205-L1378 HydrophobicContact CD2-CD2 3.57Å; Y1205-L1378 HydrophobicContact CE2-CD2 3.98Å; Y1205-L1378 HydrophobicContact CG-CD2 4.1Å; Y1205-L1400 HydrophobicContact CD1-CD2 4.08Å; Y1205-Q1403 HydrophobicContact CE1-CB 4.02Å; Y1205-V1404 HydrophobicContact CD1-CG2 4.23Å; Y1205-V1404 HydrophobicContact CE1-CG2 3.97Å; Y1205-V1404 HydrophobicContact CE2-CG2 4.3Å
1206I78.5Confident85.3Confident7 Ų732.8 Ų32.84%0.03620%0.199CC..G310 helixtrans-83.3-25.1-175.2-62.7-179.1000111.3L1203 P1204 Q1208 L1209 H1214 L1378 L1381L1203-I1206 HydrophobicContact CB-CD1 4.1Å; L1203-I1206 HydrophobicContact CB-CG1 4.23Å; L1203-I1206 HydrophobicContact CD1-CD1 4.03Å; L1203-I1206 PolarHBondContact O-N 3.09Å; L1203-I1206 VanDerWaalsContact O-N 3.14Å; P1204-I1206 PolarHBondContact O-N 3.32Å; I1206-Q1208 PolarHBondContact O-N 3.22Å; I1206-Q1208 VanDerWaalsContact O-N 3.09Å; I1206-L1209 WeakPolarHBondContact O-CB 3.46Å; I1206-L1209 PolarHBondContact O-N 2.97Å; I1206-H1214 HydrophobicContact CG2-CB 4.13Å; I1206-H1214 VanDerWaalsContact CG2-CE1 3.5Å; I1206-H1214 WeakPolarHBondContact CG2-CE1 3.1Å; I1206-H1214 VanDerWaalsContact CG2-CG 3.43Å; I1206-H1214 WeakPolarHBondContact CG2-ND1 3.37Å; I1206-L1378 HydrophobicContact CD1-CD1 4.2Å; I1206-L1378 HydrophobicContact CG1-CD1 4.39Å; I1206-L1381 HydrophobicContact CD1-CD2 3.55Å
1207C71.4Confident85.2Confident76 Ų7632.8 Ų32.851%0.51420%0.199SC..G310 helixtrans-65.2-8.4172.8-63.80000113.9P1204P1204-C1207 WeakPolarHBondContact O-CB 3.47Å; P1204-C1207 PolarHBondContact O-N 2.88Å
1208Q74.1Confident85.3Confident118 Ų11832.7 Ų32.755%0.55120%0.198SC*.G310 helixtrans-89.1-8172.2-55.3-175.62400113.1I1206I1206-Q1208 PolarHBondContact O-N 3.22Å; I1206-Q1208 VanDerWaalsContact O-N 3.09Å
1209L83.6Confident85.5Confident21 Ų2135 Ų3511%0.1121%0.207CC..SBendtrans-100.5152.7-177.7-58.4176.5000111I1206 V1213 L1217 L1382 L1396 L1400I1206-L1209 WeakPolarHBondContact O-CB 3.46Å; I1206-L1209 PolarHBondContact O-N 2.97Å; L1209-V1213 HydrophobicContact CB-CG1 4.4Å; L1209-V1213 HydrophobicContact CD1-CG1 4.42Å; L1209-V1213 HydrophobicContact CD2-CG1 4.29Å; L1209-L1217 HydrophobicContact CD1-CD1 3.72Å; L1209-L1382 HydrophobicContact CD1-CD2 4.29Å; L1209-L1396 HydrophobicContact CD2-CD2 4.07Å; L1209-L1396 HydrophobicContact CD2-CG 4.45Å; L1209-L1400 HydrophobicContact CD2-CD1 3.83Å; L1209-L1400 HydrophobicContact CG-CD1 4.25Å
1210S86Confident85.4Confident73 Ų7336.8 Ų36.851%0.5122%0.22SC..  trans-71.9152.317274.80000110.9G1212 V1213 H1214S1210-G1212 PolarHBondContact O-N 2.91Å; S1210-V1213 PolarHBondContact O-N 3.1Å; S1210-V1213 WeakPolarHBondContact OG-CG2 3.13Å; S1210-H1214 PolarHBondContact O-N 2.73Å
1211C86.3Confident85.5Confident74 Ų7436.9 Ų36.950%0.522%0.221SC..Hα-helixtrans-55-36.8-177-1640000112.9L1215 F1461C1211-L1215 PolarHBondContact O-N 2.79Å; C1211-L1215 VanDerWaalsContact O-N 3.1Å; C1211-F1461 WeakPolarHBondContact O-CE1 3.31Å; C1211-F1461 WeakPolarHBondContact O-CZ 3.24Å; C1211-F1461 VanDerWaalsContact SG-CE1 3.52Å
1212G86.2Confident85.8Confident38 Ų3834.8 Ų34.839%0.39221%0.207SC..Hα-helixtrans-66.6-47173.700000113.2S1210 H1214 L1215 D1216S1210-G1212 PolarHBondContact O-N 2.91Å; G1212-H1214 VanDerWaalsContact C-N 3.31Å; G1212-H1214 PolarHBondContact O-N 2.72Å; G1212-L1215 WeakPolarHBondContact O-CB 3.37Å; G1212-L1215 PolarHBondContact O-N 2.93Å; G1212-L1215 VanDerWaalsContact O-N 3.15Å; G1212-D1216 PolarHBondContact O-N 3.26Å
1213V88Confident86.2Confident12 Ų1233 Ų337%0.07320%0.199CC..Hα-helixtrans-63.4-37.8178.1173.70000111.4L1209 S1210 D1216 L1217 I1393L1209-V1213 HydrophobicContact CB-CG1 4.4Å; L1209-V1213 HydrophobicContact CD1-CG1 4.42Å; L1209-V1213 HydrophobicContact CD2-CG1 4.29Å; S1210-V1213 PolarHBondContact O-N 3.1Å; S1210-V1213 WeakPolarHBondContact OG-CG2 3.13Å; V1213-D1216 PolarHBondContact O-N 3.43Å; V1213-L1217 HydrophobicContact CG1-CD1 3.97Å; V1213-L1217 HydrophobicContact CG1-CG 4.32Å; V1213-L1217 WeakPolarHBondContact O-CB 3.46Å; V1213-L1217 VanDerWaalsContact O-CG 3.23Å; V1213-L1217 WeakPolarHBondContact O-CG 3.43Å; V1213-L1217 PolarHBondContact O-N 3.31Å; V1213-I1393 HydrophobicContact CG1-CG2 4.28Å; V1213-I1393 HydrophobicContact CG2-CD1 3.71Å; V1213-I1393 HydrophobicContact CG2-CG2 4.47Å
1214H89.8Confident86.5Confident21 Ų2134.4 Ų34.410%0.09721%0.206CC..Hα-helixtrans-62.4-45.1173.4179.2-166.3000111.4S1200 I1206 S1210 G1212 L1218 F1461S1200-H1214 WeakPolarHBondContact CB-NE2 3.45Å; S1200-H1214 PolarHBondContact OG-NE2 3.49Å; I1206-H1214 HydrophobicContact CG2-CB 4.13Å; I1206-H1214 VanDerWaalsContact CG2-CE1 3.5Å; I1206-H1214 WeakPolarHBondContact CG2-CE1 3.1Å; I1206-H1214 VanDerWaalsContact CG2-CG 3.43Å; I1206-H1214 WeakPolarHBondContact CG2-ND1 3.37Å; S1210-H1214 PolarHBondContact O-N 2.73Å; G1212-H1214 VanDerWaalsContact C-N 3.31Å; G1212-H1214 PolarHBondContact O-N 2.72Å; H1214-L1218 WeakPolarHBondContact NE2-CD1 3.43Å; H1214-L1218 WeakPolarHBondContact O-CB 3.23Å; H1214-L1218 WeakPolarHBondContact O-CG 3.38Å; H1214-L1218 PolarHBondContact O-N 2.87Å; H1214-F1461 HydrophobicContact CB-CE2 4.47Å; H1214-F1461 HydrophobicContact CB-CZ 4.08Å; H1214-F1461 AromaticContact CE1-CE2 3.59Å; H1214-F1461 AromaticContact CG-CE2 3.78Å; H1214-F1461 AromaticContact CG-CZ 3.84Å; H1214-F1461 AromaticContact ND1-CE2 3.5Å; H1214-F1461 WeakPolarHBondContact ND1-CE2 3.34Å; H1214-F1461 AromaticContact ND1-CZ 3.62Å; H1214-F1461 AromaticContact NE2-CE2 3.91Å
1215L91Very high87.5Confident18 Ų1832.4 Ų32.49%0.09419%0.193CC..Hα-helixtrans-61.4-46.7175177.158.2000112.4C1211 G1212 L1218 K1219 L1457 E1458 F1461C1211-L1215 PolarHBondContact O-N 2.79Å; C1211-L1215 VanDerWaalsContact O-N 3.1Å; G1212-L1215 WeakPolarHBondContact O-CB 3.37Å; G1212-L1215 PolarHBondContact O-N 2.93Å; G1212-L1215 VanDerWaalsContact O-N 3.15Å; L1215-L1218 WeakPolarHBondContact O-CB 3.49Å; L1215-L1218 PolarHBondContact O-N 3.46Å; L1215-K1219 HydrophobicContact CD1-CD 4.38Å; L1215-K1219 HydrophobicContact CD1-CG 4.23Å; L1215-K1219 HydrophobicContact CG-CD 4.22Å; L1215-K1219 HydrophobicContact CG-CG 4.5Å; L1215-K1219 WeakPolarHBondContact O-CG 3.41Å; L1215-K1219 PolarHBondContact O-N 2.89Å; L1215-L1457 HydrophobicContact CD1-CD2 3.53Å; L1215-E1458 HydrophobicContact CD1-CB 4.21Å; L1215-E1458 HydrophobicContact CD2-CB 4.32Å; L1215-E1458 HydrophobicContact CD2-CG 3.85Å; L1215-F1461 HydrophobicContact CB-CD1 3.91Å; L1215-F1461 HydrophobicContact CB-CE1 3.68Å; L1215-F1461 HydrophobicContact CB-CG 4.48Å; L1215-F1461 HydrophobicContact CB-CZ 4.07Å; L1215-F1461 HydrophobicContact CD1-CB 4.01Å; L1215-F1461 HydrophobicContact CD1-CD1 3.92Å; L1215-F1461 HydrophobicContact CD1-CD2 4.47Å; L1215-F1461 HydrophobicContact CD1-CG 3.88Å; L1215-F1461 HydrophobicContact CD2-CD1 4.24Å; L1215-F1461 HydrophobicContact CG-CD1 4.24Å; L1215-F1461 HydrophobicContact CG-CE1 4.49Å
1216D89.5Confident88.4Confident70 Ų7032 Ų3237%0.37419%0.191SC..Hα-helixtrans-69-37.9-176.3-66.4-29.5000111.7G1212 V1213 K1219 S1220 M1387G1212-D1216 PolarHBondContact O-N 3.26Å; V1213-D1216 PolarHBondContact O-N 3.43Å; D1216-K1219 PolarHBondContact O-N 3.5Å; D1216-K1219 IonicContact OD1-NZ 3.63Å; D1216-S1220 WeakPolarHBondContact O-CB 3.41Å; D1216-S1220 PolarHBondContact O-N 3.46Å; D1216-S1220 PolarHBondContact O-OG 3.23Å; D1216-M1387 VanDerWaalsContact C-CE 3.42Å; D1216-M1387 HydrophobicContact CB-CE 3.82Å; D1216-M1387 HydrophobicContact CB-SD 3.7Å; D1216-M1387 VanDerWaalsContact O-CE 3.25Å; D1216-M1387 WeakPolarHBondContact O-CE 3.23Å
1217L91.9Very high89.1Confident2 Ų231.7 Ų31.71%0.0119%0.189CC..Hα-helixtrans-61-46.8169.7-71.5173.6000111.3L1209 V1213 K1219 S1220 A1221 L1381 M1387 I1397L1209-L1217 HydrophobicContact CD1-CD1 3.72Å; V1213-L1217 HydrophobicContact CG1-CD1 3.97Å; V1213-L1217 HydrophobicContact CG1-CG 4.32Å; V1213-L1217 WeakPolarHBondContact O-CB 3.46Å; V1213-L1217 VanDerWaalsContact O-CG 3.23Å; V1213-L1217 WeakPolarHBondContact O-CG 3.43Å; V1213-L1217 PolarHBondContact O-N 3.31Å; L1217-K1219 PolarHBondContact O-N 2.85Å; L1217-S1220 PolarHBondContact O-N 3.06Å; L1217-S1220 VanDerWaalsContact O-N 3.15Å; L1217-S1220 PolarHBondContact O-OG 2.95Å; L1217-A1221 WeakPolarHBondContact O-CB 3.45Å; L1217-A1221 PolarHBondContact O-N 3.17Å; L1217-L1381 VanDerWaalsContact C-CD1 3.49Å; L1217-L1381 HydrophobicContact CB-CD1 3.86Å; L1217-M1387 HydrophobicContact CD2-CE 4.28Å; L1217-M1387 HydrophobicContact CD2-CG 3.91Å; L1217-I1397 HydrophobicContact CD1-CD1 4.42Å; L1217-I1397 HydrophobicContact CD2-CD1 4.26Å
1218L93.3Very high90.2Very high0 Ų028.1 Ų28.10%017%0.165CC..Hα-helixtrans-58.7-45.7175.8-83.5173.3000112.2V1197 H1214 L1215 S1220 A1221 C1222 L1225 L1381 L1457 F1461V1197-L1218 HydrophobicContact CG2-CD1 4.39Å; H1214-L1218 WeakPolarHBondContact NE2-CD1 3.43Å; H1214-L1218 WeakPolarHBondContact O-CB 3.23Å; H1214-L1218 WeakPolarHBondContact O-CG 3.38Å; H1214-L1218 PolarHBondContact O-N 2.87Å; L1215-L1218 WeakPolarHBondContact O-CB 3.49Å; L1215-L1218 PolarHBondContact O-N 3.46Å; L1218-S1220 VanDerWaalsContact C-N 3.3Å; L1218-S1220 PolarHBondContact O-N 3.19Å; L1218-A1221 PolarHBondContact O-N 3.43Å; L1218-C1222 WeakPolarHBondContact O-CA 3.24Å; L1218-C1222 WeakPolarHBondContact O-CB 3.37Å; L1218-C1222 PolarHBondContact O-N 3.25Å; L1218-L1225 HydrophobicContact CD2-CD1 4.45Å; L1218-L1381 HydrophobicContact CD2-CD1 4.03Å; L1218-L1381 HydrophobicContact CD2-CD2 4.38Å; L1218-L1381 HydrophobicContact CG-CD1 4.22Å; L1218-L1457 HydrophobicContact CB-CD2 4.19Å; L1218-F1461 HydrophobicContact CD1-CD2 3.68Å; L1218-F1461 HydrophobicContact CD1-CE2 3.71Å
1219K92.8Very high91.1Very high60 Ų6023 Ų2326%0.26114%0.142SC..Hα-helixtrans-55.7-46.6174.1-74.8173175.3173.60110.9L1215 D1216 L1217 A1221 L1454 L1457 E1458L1215-K1219 HydrophobicContact CD1-CD 4.38Å; L1215-K1219 HydrophobicContact CD1-CG 4.23Å; L1215-K1219 HydrophobicContact CG-CD 4.22Å; L1215-K1219 HydrophobicContact CG-CG 4.5Å; L1215-K1219 WeakPolarHBondContact O-CG 3.41Å; L1215-K1219 PolarHBondContact O-N 2.89Å; D1216-K1219 PolarHBondContact O-N 3.5Å; D1216-K1219 IonicContact OD1-NZ 3.63Å; L1217-K1219 PolarHBondContact O-N 2.85Å; K1219-A1221 PolarHBondContact O-N 3.06Å; K1219-L1454 HydrophobicContact CB-CD2 3.99Å; K1219-L1454 HydrophobicContact CG-CD2 4.1Å; K1219-L1457 HydrophobicContact CG-CD2 4.31Å; K1219-E1458 VanDerWaalsContact CE-OE2 3.22Å; K1219-E1458 WeakPolarHBondContact CE-OE2 3.34Å; K1219-E1458 IonicContact NZ-OE2 3.23Å; K1219-E1458 PolarHBondContact NZ-OE2 3.38Å
1220S90.6Very high91.5Very high41 Ų4122 Ų2229%0.28714%0.137SC..Hα-helixtrans-71.1-23.4-177.776.50000115.3D1216 L1217 L1218 S1386D1216-S1220 WeakPolarHBondContact O-CB 3.41Å; D1216-S1220 PolarHBondContact O-N 3.46Å; D1216-S1220 PolarHBondContact O-OG 3.23Å; L1217-S1220 PolarHBondContact O-N 3.06Å; L1217-S1220 VanDerWaalsContact O-N 3.15Å; L1217-S1220 PolarHBondContact O-OG 2.95Å; L1218-S1220 VanDerWaalsContact C-N 3.3Å; L1218-S1220 PolarHBondContact O-N 3.19Å; S1220-S1386 VanDerWaalsContact CB-CB 3.41Å; S1220-S1386 WeakPolarHBondContact CB-OG 3.36Å; S1220-S1386 WeakPolarHBondContact OG-CB 3.48Å; S1220-S1386 PolarHBondContact OG-OG 3.38Å
1221A93.3Very high91.8Very high2 Ų218.6 Ų18.62%0.01711%0.113CC..Hα-helixtrans-106.8-7.8-178.600000114L1217 L1218 K1219 M1223 Q1224 L1225 L1381L1217-A1221 WeakPolarHBondContact O-CB 3.45Å; L1217-A1221 PolarHBondContact O-N 3.17Å; L1218-A1221 PolarHBondContact O-N 3.43Å; K1219-A1221 PolarHBondContact O-N 3.06Å; A1221-M1223 PolarHBondContact O-N 2.88Å; A1221-Q1224 WeakPolarHBondContact O-CB 3.33Å; A1221-Q1224 PolarHBondContact O-N 3.12Å; A1221-L1225 HydrophobicContact CB-CD1 3.89Å; A1221-L1225 HydrophobicContact CB-CG 4.12Å; A1221-L1225 WeakPolarHBondContact O-CG 3.48Å; A1221-L1225 PolarHBondContact O-N 3.37Å; A1221-L1381 HydrophobicContact CB-CB 4.48Å; A1221-L1381 HydrophobicContact CB-CD1 3.97Å
1222C93.8Very high92.1Very high2 Ų215.7 Ų15.71%0.0149%0.091CC..Hα-helixtrans-45.6-56.9-169.9-177.40000113.4L1218 Q1224 L1225 I1226 L1457L1218-C1222 WeakPolarHBondContact O-CA 3.24Å; L1218-C1222 WeakPolarHBondContact O-CB 3.37Å; L1218-C1222 PolarHBondContact O-N 3.25Å; C1222-Q1224 PolarHBondContact O-N 3.44Å; C1222-L1225 PolarHBondContact O-N 2.89Å; C1222-I1226 WeakPolarHBondContact O-CG1 3.2Å; C1222-I1226 PolarHBondContact O-N 3Å; C1222-L1457 HydrophobicContact CB-CD1 3.98Å
1223M92.6Very high92.3Very high7 Ų715.9 Ų15.93%0.0348%0.08CC..Hα-helixtrans-60.9-45-179-65.2-56.7-63.900112.3A1221 L1225 I1226 I1227 L1313 A1438 I1441 E1442 I1445 L1453A1221-M1223 PolarHBondContact O-N 2.88Å; M1223-L1225 VanDerWaalsContact C-N 3.3Å; M1223-L1225 PolarHBondContact O-N 3.45Å; M1223-I1226 PolarHBondContact O-N 2.9Å; M1223-I1226 HydrophobicContact SD-CD1 4.46Å; M1223-I1227 WeakPolarHBondContact O-CB 3.34Å; M1223-I1227 WeakPolarHBondContact O-CD1 3.32Å; M1223-I1227 WeakPolarHBondContact O-CG1 3.26Å; M1223-I1227 PolarHBondContact O-N 3.32Å; M1223-L1313 HydrophobicContact CE-CD2 3.56Å; M1223-A1438 HydrophobicContact CB-CB 4.34Å; M1223-I1441 HydrophobicContact CE-CB 4.41Å; M1223-I1441 HydrophobicContact CE-CG2 3.51Å; M1223-E1442 HydrophobicContact CB-CG 4.42Å; M1223-E1442 VanDerWaalsContact CB-OE1 3.28Å; M1223-E1442 WeakPolarHBondContact CB-OE1 3.41Å; M1223-E1442 HydrophobicContact CG-CG 3.96Å; M1223-E1442 WeakPolarHBondContact CG-OE1 3.38Å; M1223-I1445 HydrophobicContact CE-CD1 3.52Å; M1223-I1445 HydrophobicContact SD-CD1 4.2Å; M1223-L1453 HydrophobicContact SD-CD2 3.68Å
1224Q94.3Very high92.3Very high29 Ų2915.8 Ų15.814%0.1368%0.079CC..Hα-helixtrans-61.4-39.7179-61.5173.330.900111.1A1221 C1222 I1227 V1228 A1438A1221-Q1224 WeakPolarHBondContact O-CB 3.33Å; A1221-Q1224 PolarHBondContact O-N 3.12Å; C1222-Q1224 PolarHBondContact O-N 3.44Å; Q1224-I1227 PolarHBondContact O-N 2.92Å; Q1224-V1228 WeakPolarHBondContact O-CB 3.4Å; Q1224-V1228 VanDerWaalsContact O-CG2 3.27Å; Q1224-V1228 WeakPolarHBondContact O-CG2 3.35Å; Q1224-V1228 PolarHBondContact O-N 3.05Å; Q1224-A1438 HydrophobicContact CG-CB 3.58Å
1225L95.5Very high92.3Very high0 Ų015 Ų150%08%0.076CC..Hα-helixtrans-71.7-37.4177.6-63.2171.9000113L1196 W1199 L1218 A1221 C1222 M1223 N1229 K1377 L1380 L1381L1196-L1225 HydrophobicContact CD1-CB 3.91Å; L1196-L1225 HydrophobicContact CD2-CB 3.62Å; L1196-L1225 HydrophobicContact CD2-CD1 4.29Å; L1196-L1225 HydrophobicContact CG-CB 4.45Å; W1199-L1225 HydrophobicContact CZ3-CD1 4.43Å; W1199-L1225 HydrophobicContact CZ3-CD2 4.45Å; L1218-L1225 HydrophobicContact CD2-CD1 4.45Å; A1221-L1225 HydrophobicContact CB-CD1 3.89Å; A1221-L1225 HydrophobicContact CB-CG 4.12Å; A1221-L1225 WeakPolarHBondContact O-CG 3.48Å; A1221-L1225 PolarHBondContact O-N 3.37Å; C1222-L1225 PolarHBondContact O-N 2.89Å; M1223-L1225 VanDerWaalsContact C-N 3.3Å; M1223-L1225 PolarHBondContact O-N 3.45Å; L1225-N1229 PolarHBondContact O-N 3Å; L1225-N1229 VanDerWaalsContact O-N 3.1Å; L1225-N1229 PolarHBondContact O-ND2 3.05Å; L1225-K1377 HydrophobicContact CD2-CB 3.74Å; L1225-K1377 HydrophobicContact CD2-CG 4.04Å; L1225-K1377 WeakPolarHBondContact CD2-O 3.02Å; L1225-L1380 HydrophobicContact CD2-CB 4.46Å; L1225-L1381 HydrophobicContact CD1-CB 4.42Å; L1225-L1381 HydrophobicContact CD1-CD1 4.31Å
1226I94Very high91.9Very high1 Ų116.5 Ų16.51%0.0058%0.084CC..Hα-helixtrans-61.2-46.6172.2-67.3165.5000110L1193 L1196 C1222 M1223 N1229 L1230 E1309 L1312 L1313L1193-I1226 HydrophobicContact CD2-CD1 4.47Å; L1196-I1226 HydrophobicContact CD1-CG1 3.96Å; C1222-I1226 WeakPolarHBondContact O-CG1 3.2Å; C1222-I1226 PolarHBondContact O-N 3Å; M1223-I1226 PolarHBondContact O-N 2.9Å; M1223-I1226 HydrophobicContact SD-CD1 4.46Å; I1226-N1229 PolarHBondContact O-N 3.04Å; I1226-L1230 PolarHBondContact O-N 2.94Å; I1226-E1309 HydrophobicContact CG2-CB 4.02Å; I1226-E1309 HydrophobicContact CG2-CG 4.49Å; I1226-L1312 HydrophobicContact CD1-CD2 3.86Å; I1226-L1313 HydrophobicContact CG2-CD1 4.2Å; I1226-L1313 HydrophobicContact CG2-CD2 4.26Å; I1226-L1313 HydrophobicContact CG2-CG 4.1Å
1227I93.6Very high91.4Very high0 Ų014.7 Ų14.70%08%0.075CC..Hα-helixtrans-66.5-43-178.6-65.5156.4000111.1M1223 Q1224 N1229 L1230 V1231 L1313 F1434 V1437 A1438 I1441M1223-I1227 WeakPolarHBondContact O-CB 3.34Å; M1223-I1227 WeakPolarHBondContact O-CD1 3.32Å; M1223-I1227 WeakPolarHBondContact O-CG1 3.26Å; M1223-I1227 PolarHBondContact O-N 3.32Å; Q1224-I1227 PolarHBondContact O-N 2.92Å; I1227-N1229 PolarHBondContact O-N 2.66Å; I1227-L1230 PolarHBondContact O-N 3Å; I1227-V1231 HydrophobicContact CG2-CG2 4.12Å; I1227-V1231 WeakPolarHBondContact O-CB 3.32Å; I1227-V1231 WeakPolarHBondContact O-CG2 3.28Å; I1227-V1231 PolarHBondContact O-N 3.04Å; I1227-L1313 HydrophobicContact CG1-CD1 4.34Å; I1227-F1434 HydrophobicContact CG2-CD1 4.3Å; I1227-V1437 HydrophobicContact CD1-CG1 4.19Å; I1227-V1437 HydrophobicContact CG2-CB 4.36Å; I1227-V1437 HydrophobicContact CG2-CG1 3.86Å; I1227-A1438 VanDerWaalsContact CD1-CA 3.43Å; I1227-A1438 HydrophobicContact CD1-CB 3.66Å; I1227-I1441 HydrophobicContact CD1-CD1 3.67Å; I1227-I1441 HydrophobicContact CG1-CD1 3.99Å
1228V94.4Very high89.8Confident1 Ų121.8 Ų21.81%0.00611%0.108CC..Hα-helixtrans-61-43176.2165.60000111.8Q1224 Y1232 L1373 K1377 L1380 F1434Q1224-V1228 WeakPolarHBondContact O-CB 3.4Å; Q1224-V1228 VanDerWaalsContact O-CG2 3.27Å; Q1224-V1228 WeakPolarHBondContact O-CG2 3.35Å; Q1224-V1228 PolarHBondContact O-N 3.05Å; V1228-Y1232 WeakPolarHBondContact O-CB 3.4Å; V1228-Y1232 PolarHBondContact O-N 3.25Å; V1228-L1373 HydrophobicContact CG1-CD1 3.57Å; V1228-K1377 HydrophobicContact CG1-CG 3.76Å; V1228-L1380 HydrophobicContact CG2-CD1 3.6Å; V1228-F1434 HydrophobicContact CG2-CB 4.02Å; V1228-F1434 HydrophobicContact CG2-CD1 3.55Å; V1228-F1434 HydrophobicContact CG2-CD2 3.62Å; V1228-F1434 HydrophobicContact CG2-CE1 3.81Å; V1228-F1434 HydrophobicContact CG2-CE2 3.89Å; V1228-F1434 HydrophobicContact CG2-CG 3.46Å; V1228-F1434 VanDerWaalsContact CG2-CG 3.46Å; V1228-F1434 HydrophobicContact CG2-CZ 3.99Å
1229N93.1Very high87.8Confident12 Ų1229 Ų296%0.06414%0.139CC..Hα-helixtrans-59.8-53.3173.1-81.6-58.3000111.3L1225 I1226 I1227 V1231 Y1232 W1233 E1309 K1377L1225-N1229 PolarHBondContact O-N 3Å; L1225-N1229 VanDerWaalsContact O-N 3.1Å; L1225-N1229 PolarHBondContact O-ND2 3.05Å; I1226-N1229 PolarHBondContact O-N 3.04Å; I1227-N1229 PolarHBondContact O-N 2.66Å; N1229-V1231 PolarHBondContact O-N 3.01Å; N1229-Y1232 PolarHBondContact O-N 3.28Å; N1229-W1233 PolarHBondContact O-N 3.37Å; N1229-E1309 HydrophobicContact CB-CG 4.34Å; N1229-K1377 WeakPolarHBondContact OD1-CE 3.27Å; N1229-K1377 PolarHBondContact OD1-NZ 2.85Å
1230L92.2Very high85.3Confident0 Ų028.6 Ų28.60%014%0.142CC..Hα-helixtrans-56.4-47.9-179.4178.255.7000112.1I1226 I1227 Y1232 W1233 L1234 F1307 E1309 F1310 L1313 I1356I1226-L1230 PolarHBondContact O-N 2.94Å; I1227-L1230 PolarHBondContact O-N 3Å; L1230-Y1232 PolarHBondContact O-N 2.96Å; L1230-W1233 PolarHBondContact O-N 3.43Å; L1230-L1234 HydrophobicContact CD1-CD1 3.78Å; L1230-L1234 HydrophobicContact CD1-CG 3.96Å; L1230-L1234 HydrophobicContact CG-CD1 3.84Å; L1230-L1234 HydrophobicContact CG-CG 4.43Å; L1230-L1234 WeakPolarHBondContact O-CB 3.31Å; L1230-L1234 VanDerWaalsContact O-CG 3.26Å; L1230-L1234 WeakPolarHBondContact O-CG 3.38Å; L1230-L1234 PolarHBondContact O-N 2.94Å; L1230-F1307 HydrophobicContact CD1-CB 3.89Å; L1230-F1307 HydrophobicContact CD1-CD1 3.91Å; L1230-F1307 HydrophobicContact CD1-CG 4.18Å; L1230-E1309 HydrophobicContact CB-CB 3.83Å; L1230-E1309 HydrophobicContact CB-CG 4.5Å; L1230-E1309 HydrophobicContact CD1-CB 4.27Å; L1230-E1309 HydrophobicContact CG-CB 4.42Å; L1230-F1310 HydrophobicContact CD1-CB 3.96Å; L1230-F1310 HydrophobicContact CD2-CB 4.22Å; L1230-F1310 HydrophobicContact CD2-CD2 4.31Å; L1230-L1313 HydrophobicContact CD2-CD1 3.74Å; L1230-I1356 HydrophobicContact CD2-CD1 4.5Å; L1230-I1356 HydrophobicContact CD2-CG2 4.13Å; L1230-I1356 HydrophobicContact CG-CG2 4.32Å
1231V92.4Very high82.6Confident0 Ų037.3 Ų37.30%017%0.169CC..Hα-helixtrans-64.3-38.9-179.6174.20000111.5I1227 N1229 A1235 I1356 L1359 A1360 L1363 F1434I1227-V1231 HydrophobicContact CG2-CG2 4.12Å; I1227-V1231 WeakPolarHBondContact O-CB 3.32Å; I1227-V1231 WeakPolarHBondContact O-CG2 3.28Å; I1227-V1231 PolarHBondContact O-N 3.04Å; N1229-V1231 PolarHBondContact O-N 3.01Å; V1231-A1235 VanDerWaalsContact O-CB 3.23Å; V1231-A1235 WeakPolarHBondContact O-CB 3.34Å; V1231-A1235 PolarHBondContact O-N 2.85Å; V1231-I1356 HydrophobicContact CG2-CG2 3.95Å; V1231-L1359 HydrophobicContact CG1-CB 4.35Å; V1231-L1359 HydrophobicContact CG1-CG 4.03Å; V1231-L1359 HydrophobicContact CG2-CD2 4.33Å; V1231-A1360 HydrophobicContact CG1-CB 4.11Å; V1231-L1363 HydrophobicContact CG1-CB 4.24Å; V1231-L1363 HydrophobicContact CG1-CD2 3.8Å; V1231-F1434 HydrophobicContact CB-CE1 4.02Å; V1231-F1434 HydrophobicContact CG1-CE1 3.94Å; V1231-F1434 HydrophobicContact CG2-CE1 4.25Å
1232Y92.8Very high79.6Confident14 Ų1441.8 Ų41.86%0.05520%0.2CC..Hα-helixtrans-64.7-46.5174.7170.6-101.2000112.4V1228 N1229 L1230 L1234 A1235 N1236 L1368 L1373V1228-Y1232 WeakPolarHBondContact O-CB 3.4Å; V1228-Y1232 PolarHBondContact O-N 3.25Å; N1229-Y1232 PolarHBondContact O-N 3.28Å; L1230-Y1232 PolarHBondContact O-N 2.96Å; Y1232-L1234 PolarHBondContact O-N 2.95Å; Y1232-A1235 WeakPolarHBondContact O-CB 3.48Å; Y1232-A1235 PolarHBondContact O-N 3.18Å; Y1232-A1235 VanDerWaalsContact O-N 3.16Å; Y1232-N1236 WeakPolarHBondContact CE2-ND2 3.46Å; Y1232-N1236 PolarHBondContact O-N 3.24Å; Y1232-N1236 PolarHBondContact OH-ND2 3.03Å; Y1232-L1368 HydrophobicContact CD2-CB 4.39Å; Y1232-L1368 HydrophobicContact CD2-CD2 3.91Å; Y1232-L1368 HydrophobicContact CE2-CB 4.48Å; Y1232-L1368 HydrophobicContact CE2-CD2 4.44Å; Y1232-L1373 HydrophobicContact CD1-CD2 3.48Å; Y1232-L1373 VanDerWaalsContact CD1-CD2 3.48Å; Y1232-L1373 HydrophobicContact CD2-CD1 4.1Å; Y1232-L1373 HydrophobicContact CD2-CD2 3.82Å; Y1232-L1373 HydrophobicContact CD2-CG 4.37Å; Y1232-L1373 HydrophobicContact CE1-CD2 3.59Å; Y1232-L1373 HydrophobicContact CE2-CB 4.47Å; Y1232-L1373 HydrophobicContact CE2-CD2 3.9Å; Y1232-L1373 HydrophobicContact CG-CD1 3.95Å; Y1232-L1373 HydrophobicContact CG-CD2 3.58Å; Y1232-L1373 HydrophobicContact CG-CG 4.35Å
1233W89.7Confident76.6Confident41 Ų4148 Ų4816%0.15523%0.232CC..Hα-helixtrans-66.9-37.1178.5-70114.6000112.1R1149 N1229 L1230 N1236 D1237 F1307R1149-W1233 HydrophobicContact CB-CZ2 4.46Å; R1149-W1233 VanDerWaalsContact CD-CD2 3.45Å; R1149-W1233 VanDerWaalsContact CD-CE2 3.43Å; N1229-W1233 PolarHBondContact O-N 3.37Å; L1230-W1233 PolarHBondContact O-N 3.43Å; W1233-N1236 PolarHBondContact O-N 3.15Å; W1233-D1237 PolarHBondContact O-N 3.42Å; W1233-F1307 HydrophobicContact CB-CD1 4.02Å; W1233-F1307 HydrophobicContact CB-CE1 3.8Å
1234L89.1Confident73.5Confident11 Ų1152.5 Ų52.56%0.05827%0.265CS..Hα-helixtrans-66.7-35.2170.9-71171.2000112.1L1230 Y1232 N1236 Y1303 F1307 I1356 A1360 R1364L1230-L1234 HydrophobicContact CD1-CD1 3.78Å; L1230-L1234 HydrophobicContact CD1-CG 3.96Å; L1230-L1234 HydrophobicContact CG-CD1 3.84Å; L1230-L1234 HydrophobicContact CG-CG 4.43Å; L1230-L1234 WeakPolarHBondContact O-CB 3.31Å; L1230-L1234 VanDerWaalsContact O-CG 3.26Å; L1230-L1234 WeakPolarHBondContact O-CG 3.38Å; L1230-L1234 PolarHBondContact O-N 2.94Å; Y1232-L1234 PolarHBondContact O-N 2.95Å; L1234-N1236 VanDerWaalsContact C-N 3.33Å; L1234-Y1303 HydrophobicContact CD2-CD1 3.44Å; L1234-Y1303 VanDerWaalsContact CD2-CD1 3.44Å; L1234-Y1303 HydrophobicContact CD2-CE1 3.41Å; L1234-Y1303 VanDerWaalsContact CD2-CE1 3.41Å; L1234-Y1303 HydrophobicContact CD2-CG 4.18Å; L1234-F1307 HydrophobicContact CD2-CD1 4.14Å; L1234-F1307 HydrophobicContact CD2-CE1 3.76Å; L1234-F1307 HydrophobicContact CD2-CE2 4.2Å; L1234-F1307 HydrophobicContact CD2-CZ 3.8Å; L1234-F1307 HydrophobicContact CG-CD1 4.27Å; L1234-F1307 HydrophobicContact CG-CE1 4.03Å; L1234-I1356 HydrophobicContact CD1-CG2 3.85Å; L1234-A1360 HydrophobicContact CB-CB 3.63Å; L1234-R1364 PolarHBondContact O-NH2 3.09Å
1235A88.1Confident70.3Confident3 Ų356.4 Ų56.43%0.02529%0.291CS..Hα-helixtrans-65-37.117500000111.7V1231 Y1232 A1360 L1363 R1364V1231-A1235 VanDerWaalsContact O-CB 3.23Å; V1231-A1235 WeakPolarHBondContact O-CB 3.34Å; V1231-A1235 PolarHBondContact O-N 2.85Å; Y1232-A1235 WeakPolarHBondContact O-CB 3.48Å; Y1232-A1235 PolarHBondContact O-N 3.18Å; Y1232-A1235 VanDerWaalsContact O-N 3.16Å; A1235-A1360 WeakPolarHBondContact CB-O 3.42Å; A1235-L1363 HydrophobicContact CB-CB 4.2Å; A1235-L1363 HydrophobicContact CB-CD2 4.36Å; A1235-L1363 HydrophobicContact CB-CG 4.46Å; A1235-R1364 HydrophobicContact CB-CB 4.07Å; A1235-R1364 WeakPolarHBondContact O-CG 3.47Å; A1235-R1364 VanDerWaalsContact O-CZ 3.3Å; A1235-R1364 PolarHBondContact O-NE 3.2Å; A1235-R1364 PolarHBondContact O-NH2 3.34Å
1236N84.4Confident67Low51 Ų5161.6 Ų61.627%0.27333%0.327SS..SBendtrans-975.1-176.9-68.4-10.3000114.7Y1232 W1233 L1234 H1238Y1232-N1236 WeakPolarHBondContact CE2-ND2 3.46Å; Y1232-N1236 PolarHBondContact O-N 3.24Å; Y1232-N1236 PolarHBondContact OH-ND2 3.03Å; W1233-N1236 PolarHBondContact O-N 3.15Å; L1234-N1236 VanDerWaalsContact C-N 3.33Å; N1236-H1238 PolarHBondContact O-CD2 3.06Å; N1236-H1238 PolarHBondContact O-N 2.75Å
1237D77.6Confident63.9Low31 Ų3167.9 Ų67.917%0.16636%0.361CS..  trans-72.7118170.5174.335000112.1W1233 K1239 F1307 R1364W1233-D1237 PolarHBondContact O-N 3.42Å; D1237-K1239 PolarHBondContact OD1-N 3.18Å; D1237-F1307 HydrophobicContact CB-CZ 4.28Å; D1237-R1364 PolarHBondContact O-NH2 2.78Å
1238H59.1Low60.6Low152 Ų15273.8 Ų73.870%0.70440%0.402SS*.  trans-101.66.9178-69-85.4000113.8N1236 M1287N1236-H1238 PolarHBondContact O-CD2 3.06Å; N1236-H1238 PolarHBondContact O-N 2.75Å; H1238-M1287 WeakPolarHBondContact O-CE 3.4Å
1239K51.7Low57.6Low151 Ų15179.8 Ų79.866%0.65744%0.439SS*.  trans-137.272.2-174.3-70.6-175.4179172.80115.7D1237 R1241 Y1302D1237-K1239 PolarHBondContact OD1-N 3.18Å; K1239-R1241 PolarHBondContact O-N 3.44Å; K1239-Y1302 PolarHBondContact O-OH 3.16Å
1240P39.8Very low54.4Low52 Ų5284.7 Ų84.734%0.33847%0.474SS..  trans-70.176145.833.1-32.3000108.6
1241R34.1Very low51.5Low224 Ų22494.5 Ų94.585%0.84552%0.517SS*.  trans-64.8137.7176.4-156.7179.8-161.6-1704.6108K1239 L1243K1239-R1241 PolarHBondContact O-N 3.44Å; R1241-L1243 PolarHBondContact O-N 3.16Å; R1241-L1243 VanDerWaalsContact O-N 3.16Å
1242S29.2Very low48.6Very low96 Ų96102.2 Ų102.267%0.67156%0.557SS**  trans-46.5120.5-17752.40000111.7S1244S1242-S1244 PolarHBondContact O-N 3.02Å
1243L31.9Very low45.8Very low131 Ų131106 Ų10669%0.68658%0.583SS**  trans-6498174-166.873.5000107.9R1241 T1245R1241-L1243 PolarHBondContact O-N 3.16Å; R1241-L1243 VanDerWaalsContact O-N 3.16Å; L1243-T1245 PolarHBondContact O-N 3.36Å
1244S26.7Very low42.9Very low103 Ų103110.3 Ų110.372%0.7261%0.609SS**  trans-73.195.5-177.4530000108.9S1242 S1246S1242-S1244 PolarHBondContact O-N 3.02Å; S1244-S1246 PolarHBondContact O-N 2.75Å
1245T27.1Very low40.2Very low110 Ų110116.3 Ų116.368%0.67565%0.647SS**  trans-56.299.4176.350.60000110.3L1243 N1247L1243-T1245 PolarHBondContact O-N 3.36Å; T1245-N1247 PolarHBondContact O-N 2.82Å
1246S26.7Very low37.4Very low109 Ų109122.2 Ų122.276%0.76268%0.682SS**  trans-7559.5173.559.10000110.6S1244 S1248S1244-S1246 PolarHBondContact O-N 2.75Å; S1246-S1248 VanDerWaalsContact C-N 3.32Å; S1246-S1248 PolarHBondContact O-N 3.42Å
1247N28.3Very low34.9Very low134 Ų134124.7 Ų124.772%0.71770%0.702SS**  trans-72.889.5174.5-85.5-4.3000109.2T1245 T1249T1245-N1247 PolarHBondContact O-N 2.82Å; N1247-T1249 PolarHBondContact O-N 3.35Å
1248S24.8Very low32.4Very low123 Ų123128.7 Ų128.786%0.8673%0.727SS**  trans-71.371.1174.342.30000111.7S1246S1246-S1248 VanDerWaalsContact C-N 3.32Å; S1246-S1248 PolarHBondContact O-N 3.42Å
1249T31.1Very low31.1Very low128 Ų128128.7 Ų128.779%0.78573%0.731SS**  trans-119.6115.5167.8420000110.8N1247N1247-T1249 PolarHBondContact O-N 3.35Å
1250S26.2Very low30Very low115 Ų115128.2 Ų128.280%0.80474%0.736SS**  trans-84.9137.5-172.247.30000113.6
1251K31.5Very low29.3Very low206 Ų206131 Ų13190%0.89676%0.756SS**  trans-166.7101.6150-108.4158.4-173.31760111.6
1252L31.1Very low29Very low161 Ų161125.8 Ų125.884%0.84375%0.749SS**  trans-76.3-178158.8-117.480.5000109.1
1253P34.7Very low29.1Very low94 Ų94129 Ų12961%0.6176%0.759SS**  cis-139.8178.617.847.1-30000117.6
1254D27.5Very low28.9Very low131 Ų131129.6 Ų129.670%0.70176%0.761SS**  trans58.1138.9152-51-31.5000120
1255T33.3Very low28.9Very low137 Ų137129.3 Ų129.384%0.8476%0.759SS**  cis-140.4172.634.840.90000115.9
1256T28.3Very low28.8Very low127 Ų127131.2 Ų131.278%0.77977%0.765SS**  trans-114.4-171.5-171.848.80000112
1257P32.1Very low29Very low104 Ų104133.6 Ų133.668%0.67577%0.768SS**  cis-136.3176-1627.1-3.3000116.2
1258T25.3Very low28.9Very low114 Ų114133.7 Ų133.770%0.69977%0.773SS**  trans40.9140.1141.859.70000123.9
1259I31.6Very low29.2Very low153 Ų153134.9 Ų134.979%0.78577%0.77SS**  -161.1125.5101.4-95.9156.8000112.7
1260N29.3Very low28.9Very low141 Ų141136.6 Ų136.675%0.75477%0.774SS**  trans20.7135.2153.4-49.4-6.5000123.5
1261S24.9Very low29.3Very low109 Ų109136.7 Ų136.776%0.76277%0.773SS**  trans-53.9167.6143.7-37.40000111.9
1262T27.5Very low29.2Very low116 Ų116132.4 Ų132.471%0.71277%0.766SS**  cis-153.4157.631.1480000110.9
1263D30.8Very low29Very low162 Ų162134 Ų13487%0.86677%0.769SS**  -162.5170126.8-104.1-25.1000112
1264I28.6Very low28.6Very low145 Ų145136.7 Ų136.774%0.74478%0.778SS**  trans-123.4138.7-154.1-69.6173.3000113.8
1265S25.7Very low28.6Very low96 Ų96134.2 Ų134.267%0.67177%0.771SS**  trans74.5137156.769.60000121
1266N26.6Very low28.5Very low151 Ų151134.7 Ų134.781%0.80777%0.767SS**  trans57.599.9141.3-57.34.4000119.3
1267I29.5Very low28.7Very low159 Ų159132.1 Ų132.182%0.81575%0.754SS**  -142.5144.6117.9-96143.8000108
1268T25.9Very low28.7Very low135 Ų135131.1 Ų131.183%0.82874%0.743SS**  trans-89.1127.1177.7470000110.9
1269D31.4Very low29.1Very low149 Ų149131 Ų13180%0.79774%0.737SS**  trans-148.8132.5164-86-54.4000109.1
1270D26.1Very low29.1Very low163 Ų163127.4 Ų127.487%0.87273%0.725SS**PPolyproline II helixtrans-80.2128.3-177.7-67.5-65.1000112.6
1271P33.4Very low29.3Very low118 Ų118124.6 Ų124.677%0.76671%0.707SS**PPolyproline II helixtrans-83.2139.5167.532.7-31.7000111.2
1272P30Very low29.7Very low116 Ų116123 Ų12375%0.75369%0.69SS**PPolyproline II helixtrans-81.7150.5-16131.1-37.6000115.8N1274P1272-N1274 PolarHBondContact O-N 3.33Å
1273E26.2Very low29.7Very low193 Ų193120.8 Ų120.890%0.90268%0.678SS**SBendtrans-65.887.6163.3-64.3-171.1129.300111.5
1274N26Very low29.8Very low151 Ų151116.6 Ų116.681%0.80766%0.658SS**  trans-168.6109161.2-100.2-52.1000112.2P1272P1272-N1274 PolarHBondContact O-N 3.33Å
1275S28Very low30.1Very low79 Ų79113.5 Ų113.555%0.55264%0.642SS**  trans167.6-13.216243.10000115.2S1277S1275-S1277 PolarHBondContact O-N 3.36Å; S1275-S1277 VanDerWaalsContact O-N 3.09Å
1276I31.6Very low30.3Very low147 Ų147114.8 Ų114.875%0.75464%0.638SS**Hα-helixtrans-65.4-18.3-170-63.3174.9000113.5D1278I1276-D1278 VanDerWaalsContact C-N 3.34Å; I1276-D1278 PolarHBondContact O-N 2.97Å
1277S32.7Very low30.5Very low73 Ų73110.9 Ų110.951%0.5162%0.616SS.*Hα-helixtrans-59.4-33.8-179.244.50000115.4S1275S1275-S1277 PolarHBondContact O-N 3.36Å; S1275-S1277 VanDerWaalsContact O-N 3.09Å
1278D32Very low31Very low83 Ų83110.6 Ų110.644%0.44461%0.608SS.*Hα-helixtrans-105.9-30.1-165.4-64.1-69000113.3I1276 S1280 K1281 D1282I1276-D1278 VanDerWaalsContact C-N 3.34Å; I1276-D1278 PolarHBondContact O-N 2.97Å; D1278-S1280 PolarHBondContact O-N 2.93Å; D1278-K1281 PolarHBondContact O-N 3.42Å; D1278-K1281 IonicContact OD1-NZ 2.69Å; D1278-K1281 PolarHBondContact OD1-NZ 2.88Å; D1278-D1282 PolarHBondContact O-N 3.49Å
1279I33.2Very low31.5Very low112 Ų112111.9 Ų111.957%0.57460%0.602SS**Hα-helixtrans-57-36.9168.8-58.7173.8000110.8K1281 D1282 C1283I1279-K1281 VanDerWaalsContact C-N 3.32Å; I1279-K1281 PolarHBondContact O-N 3.42Å; I1279-D1282 PolarHBondContact O-N 2.97Å; I1279-C1283 WeakPolarHBondContact O-CB 3.47Å; I1279-C1283 PolarHBondContact O-N 2.92Å; I1279-C1283 VanDerWaalsContact O-N 3.09Å
1280S32.4Very low31.8Very low77 Ų77108.5 Ų108.554%0.53858%0.584SS.*Hα-helixtrans-57.1-42.2175.5-179.70000112.9D1278 T1284D1278-S1280 PolarHBondContact O-N 2.93Å; S1280-T1284 PolarHBondContact O-N 2.87Å; S1280-T1284 PolarHBondContact O-OG1 3.3Å
1281K33.1Very low32.8Very low83 Ų83103.2 Ų103.236%0.36156%0.555SS.*Hα-helixtrans-70.9-46.2-179.3-55.9172.1-169.9157.80110.2I513 D1278 I1279 T1284 I1285I513-K1281 HydrophobicContact CD1-CB 3.41Å; I513-K1281 VanDerWaalsContact CD1-CB 3.41Å; I513-K1281 VanDerWaalsContact CD1-O 3.27Å; I513-K1281 WeakPolarHBondContact CD1-O 3.18Å; I513-K1281 HydrophobicContact CG1-CB 3.64Å; I513-K1281 HydrophobicContact CG1-CD 4.44Å; D1278-K1281 PolarHBondContact O-N 3.42Å; D1278-K1281 IonicContact OD1-NZ 2.69Å; D1278-K1281 PolarHBondContact OD1-NZ 2.88Å; I1279-K1281 VanDerWaalsContact C-N 3.32Å; I1279-K1281 PolarHBondContact O-N 3.42Å; K1281-T1284 WeakPolarHBondContact O-CA 3.42Å; K1281-T1284 VanDerWaalsContact O-CB 3.23Å; K1281-T1284 WeakPolarHBondContact O-CB 3.22Å; K1281-T1284 PolarHBondContact O-N 3.32Å; K1281-I1285 PolarHBondContact O-N 2.9Å; K1281-I1285 VanDerWaalsContact O-N 3.16Å
1282D32.3Very low33.5Very low76 Ų76105.7 Ų105.741%0.40655%0.554SS.*Hα-helixtrans-68.7-39.2-174.3-112.4-47.3000112.6I513 D1278 I1279 T1284 I1285 Q1286I513-D1282 HydrophobicContact CD1-CB 4.27Å; D1278-D1282 PolarHBondContact O-N 3.49Å; I1279-D1282 PolarHBondContact O-N 2.97Å; D1282-T1284 PolarHBondContact O-N 2.9Å; D1282-I1285 PolarHBondContact O-N 3.28Å; D1282-I1285 VanDerWaalsContact O-N 3.12Å; D1282-Q1286 PolarHBondContact O-N 3.33Å
1283C28.1Very low34.2Very low69 Ų69104.6 Ų104.647%0.46655%0.549SS..Hα-helixtrans-53.1-38.6166.8-85.90000112.1I1279 M1287I1279-C1283 WeakPolarHBondContact O-CB 3.47Å; I1279-C1283 PolarHBondContact O-N 2.92Å; I1279-C1283 VanDerWaalsContact O-N 3.09Å; C1283-M1287 VanDerWaalsContact O-CB 3.29Å; C1283-M1287 WeakPolarHBondContact O-CB 3.45Å; C1283-M1287 VanDerWaalsContact O-CG 3.32Å; C1283-M1287 WeakPolarHBondContact O-CG 3.34Å; C1283-M1287 PolarHBondContact O-N 2.68Å
1284T32.7Very low35.5Very low73 Ų7397.7 Ų97.745%0.44852%0.52SS..Hα-helixtrans-69.3-33.7179.7-56.70000112.8S1280 K1281 D1282 K1288S1280-T1284 PolarHBondContact O-N 2.87Å; S1280-T1284 PolarHBondContact O-OG1 3.3Å; K1281-T1284 WeakPolarHBondContact O-CA 3.42Å; K1281-T1284 VanDerWaalsContact O-CB 3.23Å; K1281-T1284 WeakPolarHBondContact O-CB 3.22Å; K1281-T1284 PolarHBondContact O-N 3.32Å; D1282-T1284 PolarHBondContact O-N 2.9Å; T1284-K1288 WeakPolarHBondContact O-CG 3.35Å; T1284-K1288 PolarHBondContact O-N 3.21Å
1285I35.8Very low37Very low81 Ų8193.7 Ų93.742%0.41550%0.502SS..Hα-helixtrans-78-41.1174.7-63.6-163.9000111.4I513 K1281 D1282 K1288 K1289I513-I1285 HydrophobicContact CB-CD1 4.22Å; I513-I1285 HydrophobicContact CD1-CB 4.42Å; I513-I1285 HydrophobicContact CD1-CD1 3.58Å; I513-I1285 HydrophobicContact CD1-CG1 3.77Å; I513-I1285 HydrophobicContact CG1-CD1 4.09Å; K1281-I1285 PolarHBondContact O-N 2.9Å; K1281-I1285 VanDerWaalsContact O-N 3.16Å; D1282-I1285 PolarHBondContact O-N 3.28Å; D1282-I1285 VanDerWaalsContact O-N 3.12Å; I1285-K1288 PolarHBondContact O-N 3.49Å; I1285-K1289 PolarHBondContact O-N 2.93Å
1286Q30.3Very low38.6Very low122 Ų12291.7 Ų91.757%0.5749%0.485SS*.Hα-helixtrans-64.6-42.8175.9-65.7-148.422.600112.1D1282 K1288 K1289 I1290D1282-Q1286 PolarHBondContact O-N 3.33Å; Q1286-K1288 PolarHBondContact O-N 3.3Å; Q1286-K1289 PolarHBondContact O-N 3.43Å; Q1286-I1290 WeakPolarHBondContact O-CG1 3.41Å; Q1286-I1290 PolarHBondContact O-N 2.84Å
1287M29.8Very low39.8Very low70 Ų7089.1 Ų89.135%0.34547%0.473SS..Hα-helixtrans-60.7-30.8172.9-77.4-168.7-175.700113H1238 C1283 N1291H1238-M1287 WeakPolarHBondContact O-CE 3.4Å; C1283-M1287 VanDerWaalsContact O-CB 3.29Å; C1283-M1287 WeakPolarHBondContact O-CB 3.45Å; C1283-M1287 VanDerWaalsContact O-CG 3.32Å; C1283-M1287 WeakPolarHBondContact O-CG 3.34Å; C1283-M1287 PolarHBondContact O-N 2.68Å; M1287-N1291 VanDerWaalsContact O-CB 3.26Å; M1287-N1291 WeakPolarHBondContact O-CB 3.26Å; M1287-N1291 PolarHBondContact O-N 2.82Å; M1287-N1291 PolarHBondContact O-ND2 3.3Å
1288K39.3Very low41Very low153 Ų15390.7 Ų90.767%0.66547%0.472SS*.Hα-helixtrans-72.9-24174.2-81.7-179.9178179.50113.8T1284 I1285 Q1286T1284-K1288 WeakPolarHBondContact O-CG 3.35Å; T1284-K1288 PolarHBondContact O-N 3.21Å; I1285-K1288 PolarHBondContact O-N 3.49Å; Q1286-K1288 PolarHBondContact O-N 3.3Å
1289K36.6Very low42.8Very low161 Ų16188 Ų8870%0.746%0.457SS*.Hα-helixtrans-78.4-50.4168.2-75.2-175.7174.6179.20111.1I1285 Q1286 N1291 K1292I1285-K1289 PolarHBondContact O-N 2.93Å; Q1286-K1289 PolarHBondContact O-N 3.43Å; K1289-N1291 PolarHBondContact O-N 2.77Å; K1289-K1292 PolarHBondContact O-N 3.49Å
1290I37.9Very low44.4Very low79 Ų7984.3 Ų84.341%0.40544%0.437SS..Hα-helixtrans-64.8-39.1-175.8-63.6165.4000112.1Q1286 K1292 S1293Q1286-I1290 WeakPolarHBondContact O-CG1 3.41Å; Q1286-I1290 PolarHBondContact O-N 2.84Å; I1290-K1292 PolarHBondContact O-N 2.93Å; I1290-K1292 VanDerWaalsContact O-N 3.13Å; I1290-S1293 PolarHBondContact O-N 3.36Å; I1290-S1293 VanDerWaalsContact O-N 3.15Å; I1290-S1293 PolarHBondContact O-OG 3.1Å; I1290-S1293 VanDerWaalsContact O-OG 3.1Å
1291N47.5Very low45.9Very low52 Ų5286.3 Ų86.328%0.27844%0.442SS..THydrogen-bonded Turntrans-65.9-16.3178.8-86-74000114.4M1287 K1289 K1299M1287-N1291 VanDerWaalsContact O-CB 3.26Å; M1287-N1291 WeakPolarHBondContact O-CB 3.26Å; M1287-N1291 PolarHBondContact O-N 2.82Å; M1287-N1291 PolarHBondContact O-ND2 3.3Å; K1289-N1291 PolarHBondContact O-N 2.77Å; N1291-K1299 PolarHBondContact O-NZ 2.95Å
1292K49Very low47.8Very low170 Ų17086 Ų8674%0.73944%0.439SS*.THydrogen-bonded Turntrans-87.4-14.9175.5-79-167.3169.9-165.40114.4K1289 I1290K1289-K1292 PolarHBondContact O-N 3.49Å; I1290-K1292 PolarHBondContact O-N 2.93Å; I1290-K1292 VanDerWaalsContact O-N 3.13Å
1293S43.3Very low50Low92 Ų9283.4 Ų83.464%0.64342%0.424SS*.THydrogen-bonded Turntrans-106.3-13.1-172.659.30000115.1I1290I1290-S1293 PolarHBondContact O-N 3.36Å; I1290-S1293 VanDerWaalsContact O-N 3.15Å; I1290-S1293 PolarHBondContact O-OG 3.1Å; I1290-S1293 VanDerWaalsContact O-OG 3.1Å
1294V54.4Low51.9Low49 Ų4983.1 Ų83.130%0.29741%0.413SS..SBendtrans-97121.1178.5179.50000109.1E1298 K1299V1294-E1298 HydrophobicContact CG1-CB 4.05Å; V1294-K1299 HydrophobicContact CG1-CD 4.48Å; V1294-K1299 HydrophobicContact CG1-CG 3.96Å; V1294-K1299 VanDerWaalsContact O-CE 3.31Å; V1294-K1299 WeakPolarHBondContact O-CE 3.46Å; V1294-K1299 PolarHBondContact O-NZ 2.76Å
1295P57.4Low53.6Low67 Ų6782 Ų8244%0.43541%0.408SS..  trans-52.9159.9174.7-26.935.8000113.1D1297P1295-D1297 VanDerWaalsContact C-N 3.26Å; P1295-D1297 PolarHBondContact O-N 3.24Å
1296L60.4Low55.5Low37 Ų3779.5 Ų79.519%0.19440%0.396CS..Hα-helixtrans-67.3-33.2177.4-174.460.9000111.2K1299 M1300 T1350 K1354L1296-K1299 WeakPolarHBondContact O-CA 3.49Å; L1296-K1299 WeakPolarHBondContact O-CB 3.27Å; L1296-K1299 PolarHBondContact O-N 2.92Å; L1296-M1300 PolarHBondContact O-N 3.39Å; L1296-T1350 HydrophobicContact CD2-CG2 4.33Å; L1296-K1354 HydrophobicContact CD2-CB 3.84Å; L1296-K1354 HydrophobicContact CD2-CG 4.34Å
1297D58.1Low58.1Low93 Ų9374.1 Ų74.150%0.49737%0.371SS..Hα-helixtrans-67.4-43-173.6-43.5-74.9000111.7P1295 K1299 M1300P1295-D1297 VanDerWaalsContact C-N 3.26Å; P1295-D1297 PolarHBondContact O-N 3.24Å; D1297-K1299 PolarHBondContact O-N 2.9Å; D1297-K1299 VanDerWaalsContact O-N 3.15Å; D1297-M1300 WeakPolarHBondContact O-CB 3.38Å; D1297-M1300 PolarHBondContact O-N 2.93Å
1298E58.4Low60.6Low106 Ų10671.1 Ų71.150%0.49536%0.356SS..Hα-helixtrans-61.3-22.5172-67.5-173.2162.300113.1V1294V1294-E1298 HydrophobicContact CG1-CB 4.05Å
1299K68.2Low63Low26 Ų2664.4 Ų64.411%0.11333%0.327CS..Hα-helixtrans-84.2-18.6174.7-56.4176.8-167.7177.40112.2N1291 V1294 L1296 D1297 Y1302 Y1303N1291-K1299 PolarHBondContact O-NZ 2.95Å; V1294-K1299 HydrophobicContact CG1-CD 4.48Å; V1294-K1299 HydrophobicContact CG1-CG 3.96Å; V1294-K1299 VanDerWaalsContact O-CE 3.31Å; V1294-K1299 WeakPolarHBondContact O-CE 3.46Å; V1294-K1299 PolarHBondContact O-NZ 2.76Å; L1296-K1299 WeakPolarHBondContact O-CA 3.49Å; L1296-K1299 WeakPolarHBondContact O-CB 3.27Å; L1296-K1299 PolarHBondContact O-N 2.92Å; D1297-K1299 PolarHBondContact O-N 2.9Å; D1297-K1299 VanDerWaalsContact O-N 3.15Å; K1299-Y1302 PolarHBondContact O-N 3.28Å; K1299-Y1303 HydrophobicContact CB-CD2 4.19Å; K1299-Y1303 HydrophobicContact CB-CE2 3.61Å; K1299-Y1303 WeakPolarHBondContact O-CD2 3.44Å; K1299-Y1303 VanDerWaalsContact O-CG 3.31Å; K1299-Y1303 PolarHBondContact O-N 3.39Å
1300M66.6Low65.4Low34 Ų3457 Ų5717%0.16730%0.295CS..Hα-helixtrans-66.1-38.4-178.9-68.2-172.766.100112.2L1296 D1297 Y1302 Y1303 Y1304 F1310 Y1353L1296-M1300 PolarHBondContact O-N 3.39Å; D1297-M1300 WeakPolarHBondContact O-CB 3.38Å; D1297-M1300 PolarHBondContact O-N 2.93Å; M1300-Y1302 VanDerWaalsContact C-N 3.34Å; M1300-Y1302 PolarHBondContact O-N 3.42Å; M1300-Y1303 PolarHBondContact O-N 3.04Å; M1300-Y1304 VanDerWaalsContact O-CB 3.3Å; M1300-Y1304 WeakPolarHBondContact O-CB 3.36Å; M1300-Y1304 PolarHBondContact O-N 3.43Å; M1300-F1310 HydrophobicContact CB-CZ 4.31Å; M1300-F1310 HydrophobicContact CE-CE1 4.49Å; M1300-F1310 HydrophobicContact CE-CZ 3.97Å; M1300-F1310 HydrophobicContact CG-CZ 4.24Å; M1300-Y1353 HydrophobicContact CE-CD2 3.6Å; M1300-Y1353 HydrophobicContact CE-CE2 3.97Å; M1300-Y1353 HydrophobicContact CE-CG 4.26Å
1301D64.8Low67.5Low120 Ų12054.7 Ų54.764%0.64228%0.282SS*.Hα-helixtrans-64.4-39.4175.6-70.5-23.2000111.9S1305D1301-S1305 WeakPolarHBondContact O-CB 3.37Å; D1301-S1305 PolarHBondContact O-N 3.29Å; D1301-S1305 PolarHBondContact O-OG 3.38Å
1302Y74Confident69.3Low77 Ų7752.5 Ų52.530%0.30227%0.271SS..Hα-helixtrans-62.4-44.9172.7174.6-96.4000111.5K1239 K1299 M1300 S1305 N1306 F1307K1239-Y1302 PolarHBondContact O-OH 3.16Å; K1299-Y1302 PolarHBondContact O-N 3.28Å; M1300-Y1302 VanDerWaalsContact C-N 3.34Å; M1300-Y1302 PolarHBondContact O-N 3.42Å; Y1302-S1305 PolarHBondContact O-N 3.44Å; Y1302-N1306 WeakPolarHBondContact CD2-ND2 3.41Å; Y1302-N1306 WeakPolarHBondContact CE2-ND2 3.28Å; Y1302-N1306 WeakPolarHBondContact O-CB 3.48Å; Y1302-N1306 PolarHBondContact O-N 2.64Å; Y1302-N1306 PolarHBondContact O-ND2 3.08Å; Y1302-F1307 AromaticContact CE1-CE2 3.95Å; Y1302-F1307 HydrophobicContact CE1-CE2 3.95Å
1303Y76.9Confident71.1Confident20 Ų2044.4 Ų44.48%0.07824%0.236CC..Hα-helixtrans-67.1-42.4178.1-62.2-40.6000112.5L1234 K1299 M1300 S1305 N1306 F1307 F1310 Y1357L1234-Y1303 HydrophobicContact CD2-CD1 3.44Å; L1234-Y1303 VanDerWaalsContact CD2-CD1 3.44Å; L1234-Y1303 HydrophobicContact CD2-CE1 3.41Å; L1234-Y1303 VanDerWaalsContact CD2-CE1 3.41Å; L1234-Y1303 HydrophobicContact CD2-CG 4.18Å; K1299-Y1303 HydrophobicContact CB-CD2 4.19Å; K1299-Y1303 HydrophobicContact CB-CE2 3.61Å; K1299-Y1303 WeakPolarHBondContact O-CD2 3.44Å; K1299-Y1303 VanDerWaalsContact O-CG 3.31Å; K1299-Y1303 PolarHBondContact O-N 3.39Å; M1300-Y1303 PolarHBondContact O-N 3.04Å; Y1303-S1305 VanDerWaalsContact C-N 3.27Å; Y1303-S1305 PolarHBondContact O-N 3.35Å; Y1303-N1306 PolarHBondContact O-N 2.99Å; Y1303-F1307 HydrophobicContact CD1-CD2 4.07Å; Y1303-F1307 AromaticContact CD1-CE2 3.82Å; Y1303-F1307 HydrophobicContact CD1-CE2 3.82Å; Y1303-F1307 HydrophobicContact CD1-CZ 4.49Å; Y1303-F1307 HydrophobicContact CE1-CE2 4.47Å; Y1303-F1307 WeakPolarHBondContact O-CB 3.49Å; Y1303-F1307 WeakPolarHBondContact O-CD2 3.41Å; Y1303-F1307 PolarHBondContact O-N 2.88Å; Y1303-F1310 HydrophobicContact CD2-CE2 4.2Å; Y1303-F1310 HydrophobicContact CG-CE2 4.35Å; Y1303-Y1357 HydrophobicContact CE2-CD2 4.5Å; Y1303-Y1357 VanDerWaalsContact OH-CE2 3.29Å; Y1303-Y1357 WeakPolarHBondContact OH-CE2 3.38Å
1304Y69Low73Confident64 Ų6441.6 Ų41.625%0.25121%0.213SC..Hα-helixtrans-61.9-34176.1-169.2-99.1000112.5M1300 F1310 H1311 N1314 N1315 K1318M1300-Y1304 VanDerWaalsContact O-CB 3.3Å; M1300-Y1304 WeakPolarHBondContact O-CB 3.36Å; M1300-Y1304 PolarHBondContact O-N 3.43Å; Y1304-F1310 HydrophobicContact CD2-CD1 4.3Å; Y1304-H1311 AromaticContact CD1-CD2 3.88Å; Y1304-H1311 HydrophobicContact CD2-CB 4.32Å; Y1304-H1311 AromaticContact CE1-CD2 3.42Å; Y1304-H1311 VanDerWaalsContact CE1-CD2 3.42Å; Y1304-H1311 WeakPolarHBondContact CE1-CD2 3.41Å; Y1304-H1311 AromaticContact CE1-NE2 3.7Å; Y1304-H1311 HydrophobicContact CE2-CB 4.32Å; Y1304-H1311 AromaticContact CE2-CD2 3.62Å; Y1304-H1311 AromaticContact CE2-CG 3.94Å; Y1304-H1311 AromaticContact CZ-CD2 3.28Å; Y1304-H1311 AromaticContact CZ-NE2 3.46Å; Y1304-H1311 PolarHBondContact OH-NE2 3.32Å; Y1304-N1314 HydrophobicContact CD2-CB 3.96Å; Y1304-N1314 VanDerWaalsContact CD2-ND2 3.3Å; Y1304-N1314 WeakPolarHBondContact CD2-ND2 3.45Å; Y1304-N1314 HydrophobicContact CE2-CB 3.95Å; Y1304-N1314 WeakPolarHBondContact CE2-ND2 3.43Å; Y1304-N1315 PolarHBondContact OH-OD1 2.98Å; Y1304-K1318 PolarHBondContact OH-NZ 3.48Å
1305S67.6Low74.3Confident48 Ų4840.8 Ų40.834%0.33621%0.207SC..Hα-helixtrans-80.3-32178.6-560000114.3F1156 D1301 Y1302 Y1303F1156-S1305 VanDerWaalsContact CE1-O 3.26Å; F1156-S1305 WeakPolarHBondContact CE1-O 3.47Å; D1301-S1305 WeakPolarHBondContact O-CB 3.37Å; D1301-S1305 PolarHBondContact O-N 3.29Å; D1301-S1305 PolarHBondContact O-OG 3.38Å; Y1302-S1305 PolarHBondContact O-N 3.44Å; Y1303-S1305 VanDerWaalsContact C-N 3.27Å; Y1303-S1305 PolarHBondContact O-N 3.35Å
1306N75.3Confident75.5Confident29 Ų2938.4 Ų38.416%0.15519%0.191CC..Hα-helixtrans-108.6-7.8-170.1-68.2-91.7000114.6Y1302 Y1303Y1302-N1306 WeakPolarHBondContact CD2-ND2 3.41Å; Y1302-N1306 WeakPolarHBondContact CE2-ND2 3.28Å; Y1302-N1306 WeakPolarHBondContact O-CB 3.48Å; Y1302-N1306 PolarHBondContact O-N 2.64Å; Y1302-N1306 PolarHBondContact O-ND2 3.08Å; Y1303-N1306 PolarHBondContact O-N 2.99Å
1307F84.7Confident76.5Confident10 Ų1037 Ų374%0.04418%0.184CC..  trans-130.697.9-174.8-59.7-106.3000110.4L1230 W1233 L1234 D1237 Y1302 Y1303 E1309 F1310 H1311L1230-F1307 HydrophobicContact CD1-CB 3.89Å; L1230-F1307 HydrophobicContact CD1-CD1 3.91Å; L1230-F1307 HydrophobicContact CD1-CG 4.18Å; W1233-F1307 HydrophobicContact CB-CD1 4.02Å; W1233-F1307 HydrophobicContact CB-CE1 3.8Å; L1234-F1307 HydrophobicContact CD2-CD1 4.14Å; L1234-F1307 HydrophobicContact CD2-CE1 3.76Å; L1234-F1307 HydrophobicContact CD2-CE2 4.2Å; L1234-F1307 HydrophobicContact CD2-CZ 3.8Å; L1234-F1307 HydrophobicContact CG-CD1 4.27Å; L1234-F1307 HydrophobicContact CG-CE1 4.03Å; D1237-F1307 HydrophobicContact CB-CZ 4.28Å; Y1302-F1307 AromaticContact CE1-CE2 3.95Å; Y1302-F1307 HydrophobicContact CE1-CE2 3.95Å; Y1303-F1307 HydrophobicContact CD1-CD2 4.07Å; Y1303-F1307 AromaticContact CD1-CE2 3.82Å; Y1303-F1307 HydrophobicContact CD1-CE2 3.82Å; Y1303-F1307 HydrophobicContact CD1-CZ 4.49Å; Y1303-F1307 HydrophobicContact CE1-CE2 4.47Å; Y1303-F1307 WeakPolarHBondContact O-CB 3.49Å; Y1303-F1307 WeakPolarHBondContact O-CD2 3.41Å; Y1303-F1307 PolarHBondContact O-N 2.88Å; F1307-E1309 PolarHBondContact O-N 2.83Å; F1307-E1309 VanDerWaalsContact O-N 3.11Å; F1307-F1310 HydrophobicContact CB-CB 3.82Å; F1307-F1310 WeakPolarHBondContact O-CA 3.09Å; F1307-F1310 WeakPolarHBondContact O-CB 3.32Å; F1307-F1310 PolarHBondContact O-N 3.42Å; F1307-H1311 PolarHBondContact O-N 3.47Å
1308P84.1Confident77.2Confident6 Ų637.1 Ų37.14%0.03918%0.18CC..Hα-helixtrans-54.4-30.9177.8-2836.2000113.6W1152 L1191 P1192 H1311 L1312W1152-P1308 HydrophobicContact CD2-CG 4.21Å; W1152-P1308 HydrophobicContact CE3-CG 3.93Å; W1152-P1308 HydrophobicContact CH2-CG 3.74Å; W1152-P1308 HydrophobicContact CZ2-CG 3.98Å; W1152-P1308 HydrophobicContact CZ3-CG 3.69Å; L1191-P1308 HydrophobicContact CD2-CB 4.2Å; L1191-P1308 HydrophobicContact CD2-CG 3.92Å; L1191-P1308 HydrophobicContact CG-CB 4.45Å; P1192-P1308 HydrophobicContact CG-CB 4.08Å; P1308-H1311 PolarHBondContact O-N 3.24Å; P1308-L1312 WeakPolarHBondContact O-CB 3.44Å; P1308-L1312 PolarHBondContact O-N 3.13Å
1309E89.1Confident77.1Confident12 Ų1234.4 Ų34.46%0.05617%0.171CC..Hα-helixtrans-66.5-38.2174.4-51.998.114200112.4R1149 P1192 I1226 N1229 L1230 F1307 L1313R1149-E1309 IonicContact CZ-OE1 3.7Å; R1149-E1309 IonicContact CZ-OE2 3.45Å; R1149-E1309 IonicContact NH1-OE1 2.69Å; R1149-E1309 PolarHBondContact NH1-OE1 2.99Å; R1149-E1309 IonicContact NH1-OE2 3Å; R1149-E1309 PolarHBondContact NH1-OE2 3.39Å; R1149-E1309 IonicContact NH2-OE1 3.84Å; R1149-E1309 IonicContact NH2-OE2 2.94Å; R1149-E1309 PolarHBondContact NH2-OE2 3.06Å; P1192-E1309 HydrophobicContact CB-CG 4.36Å; P1192-E1309 HydrophobicContact CG-CG 4.24Å; I1226-E1309 HydrophobicContact CG2-CB 4.02Å; I1226-E1309 HydrophobicContact CG2-CG 4.49Å; N1229-E1309 HydrophobicContact CB-CG 4.34Å; L1230-E1309 HydrophobicContact CB-CB 3.83Å; L1230-E1309 HydrophobicContact CB-CG 4.5Å; L1230-E1309 HydrophobicContact CD1-CB 4.27Å; L1230-E1309 HydrophobicContact CG-CB 4.42Å; F1307-E1309 PolarHBondContact O-N 2.83Å; F1307-E1309 VanDerWaalsContact O-N 3.11Å; E1309-L1313 WeakPolarHBondContact O-CB 3.42Å; E1309-L1313 VanDerWaalsContact O-CG 3.26Å; E1309-L1313 WeakPolarHBondContact O-CG 3.43Å; E1309-L1313 PolarHBondContact O-N 2.98Å
1310F86.2Confident75.9Confident5 Ų539.2 Ų39.22%0.02220%0.196CC..Hα-helixtrans-70.1-42.6175.2-171.1-79.7000110.8L1230 M1300 Y1303 Y1304 F1307 L1312 L1313 N1314 Y1353L1230-F1310 HydrophobicContact CD1-CB 3.96Å; L1230-F1310 HydrophobicContact CD2-CB 4.22Å; L1230-F1310 HydrophobicContact CD2-CD2 4.31Å; M1300-F1310 HydrophobicContact CB-CZ 4.31Å; M1300-F1310 HydrophobicContact CE-CE1 4.49Å; M1300-F1310 HydrophobicContact CE-CZ 3.97Å; M1300-F1310 HydrophobicContact CG-CZ 4.24Å; Y1303-F1310 HydrophobicContact CD2-CE2 4.2Å; Y1303-F1310 HydrophobicContact CG-CE2 4.35Å; Y1304-F1310 HydrophobicContact CD2-CD1 4.3Å; F1307-F1310 HydrophobicContact CB-CB 3.82Å; F1307-F1310 WeakPolarHBondContact O-CA 3.09Å; F1307-F1310 WeakPolarHBondContact O-CB 3.32Å; F1307-F1310 PolarHBondContact O-N 3.42Å; F1310-L1312 PolarHBondContact O-N 3.15Å; F1310-L1313 PolarHBondContact O-N 2.99Å; F1310-N1314 VanDerWaalsContact O-CB 3.3Å; F1310-N1314 WeakPolarHBondContact O-CB 3.46Å; F1310-N1314 PolarHBondContact O-N 3.31Å; F1310-Y1353 AromaticContact CD2-CD1 3.94Å; F1310-Y1353 HydrophobicContact CD2-CD1 3.94Å; F1310-Y1353 AromaticContact CD2-CE1 3.94Å; F1310-Y1353 HydrophobicContact CD2-CE1 3.94Å; F1310-Y1353 AromaticContact CE2-CD1 3.3Å; F1310-Y1353 HydrophobicContact CE2-CD1 3.3Å; F1310-Y1353 AromaticContact CE2-CE1 3.62Å; F1310-Y1353 HydrophobicContact CE2-CE1 3.62Å; F1310-Y1353 AromaticContact CE2-CG 3.98Å; F1310-Y1353 HydrophobicContact CE2-CG 3.98Å; F1310-Y1353 AromaticContact CZ-CD1 3.8Å; F1310-Y1353 HydrophobicContact CZ-CD1 3.8Å; F1310-Y1353 AromaticContact CZ-CE1 3.94Å; F1310-Y1353 HydrophobicContact CZ-CE1 3.94Å; F1310-Y1353 HydrophobicContact CZ-CG 4.15Å
1311H82.3Confident74.5Confident31 Ų3144.3 Ų44.314%0.14422%0.224CC..Hα-helixtrans-57.4-47.1175.4-175.3-76.7000111.6T1188 N1189 Y1304 F1307 P1308 N1314 N1315T1188-H1311 PolarHBondContact OG1-CE1 2.75Å; T1188-H1311 PolarHBondContact OG1-ND1 3.02Å; T1188-H1311 PolarHBondContact OG1-NE2 2.93Å; N1189-H1311 PolarHBondContact OD1-CE1 3.33Å; N1189-H1311 PolarHBondContact OD1-ND1 3.22Å; Y1304-H1311 AromaticContact CD1-CD2 3.88Å; Y1304-H1311 HydrophobicContact CD2-CB 4.32Å; Y1304-H1311 AromaticContact CE1-CD2 3.42Å; Y1304-H1311 VanDerWaalsContact CE1-CD2 3.42Å; Y1304-H1311 WeakPolarHBondContact CE1-CD2 3.41Å; Y1304-H1311 AromaticContact CE1-NE2 3.7Å; Y1304-H1311 HydrophobicContact CE2-CB 4.32Å; Y1304-H1311 AromaticContact CE2-CD2 3.62Å; Y1304-H1311 AromaticContact CE2-CG 3.94Å; Y1304-H1311 AromaticContact CZ-CD2 3.28Å; Y1304-H1311 AromaticContact CZ-NE2 3.46Å; Y1304-H1311 PolarHBondContact OH-NE2 3.32Å; F1307-H1311 PolarHBondContact O-N 3.47Å; P1308-H1311 PolarHBondContact O-N 3.24Å; H1311-N1314 PolarHBondContact O-N 2.93Å; H1311-N1315 PolarHBondContact CE1-ND2 3.4Å; H1311-N1315 PolarHBondContact ND1-ND2 3.4Å; H1311-N1315 VanDerWaalsContact ND1-ND2 3.12Å; H1311-N1315 PolarHBondContact O-N 3.47Å; H1311-N1315 PolarHBondContact O-ND2 2.84Å
1312L86.4Confident72.8Confident6 Ų645.5 Ų45.53%0.03123%0.23CC..Hα-helixtrans-59.7-52.8174.6174.158.3000111.9N1189 P1192 I1226 P1308 F1310 N1314 N1315 L1316 L1453N1189-L1312 HydrophobicContact CB-CD1 3.92Å; P1192-L1312 HydrophobicContact CB-CD2 3.82Å; P1192-L1312 HydrophobicContact CG-CB 4.27Å; P1192-L1312 HydrophobicContact CG-CD2 3.86Å; I1226-L1312 HydrophobicContact CD1-CD2 3.86Å; P1308-L1312 WeakPolarHBondContact O-CB 3.44Å; P1308-L1312 PolarHBondContact O-N 3.13Å; F1310-L1312 PolarHBondContact O-N 3.15Å; L1312-N1314 VanDerWaalsContact C-N 3.3Å; L1312-N1314 PolarHBondContact O-N 2.85Å; L1312-N1315 PolarHBondContact O-N 3.12Å; L1312-L1316 HydrophobicContact CD1-CD1 3.76Å; L1312-L1316 HydrophobicContact CD1-CG 4.07Å; L1312-L1316 HydrophobicContact CG-CD1 3.92Å; L1312-L1316 WeakPolarHBondContact O-CG 3.47Å; L1312-L1316 PolarHBondContact O-N 2.84Å; L1312-L1453 HydrophobicContact CD1-CD1 3.89Å; L1312-L1453 HydrophobicContact CD2-CD1 4.27Å
1313L87.1Confident70.7Confident1 Ų147.8 Ų47.81%0.00525%0.248CC..Hα-helixtrans-61.8-36.5-179.4-71.3175.4000112.7M1223 I1226 I1227 L1230 E1309 F1310 L1316 T1317 Y1353 I1441M1223-L1313 HydrophobicContact CE-CD2 3.56Å; I1226-L1313 HydrophobicContact CG2-CD1 4.2Å; I1226-L1313 HydrophobicContact CG2-CD2 4.26Å; I1226-L1313 HydrophobicContact CG2-CG 4.1Å; I1227-L1313 HydrophobicContact CG1-CD1 4.34Å; L1230-L1313 HydrophobicContact CD2-CD1 3.74Å; E1309-L1313 WeakPolarHBondContact O-CB 3.42Å; E1309-L1313 VanDerWaalsContact O-CG 3.26Å; E1309-L1313 WeakPolarHBondContact O-CG 3.43Å; E1309-L1313 PolarHBondContact O-N 2.98Å; F1310-L1313 PolarHBondContact O-N 2.99Å; L1313-L1316 PolarHBondContact O-N 2.9Å; L1313-T1317 WeakPolarHBondContact O-CG2 3.22Å; L1313-T1317 PolarHBondContact O-N 3.47Å; L1313-T1317 PolarHBondContact O-OG1 3.03Å; L1313-Y1353 PolarHBondContact O-OH 2.89Å; L1313-I1441 HydrophobicContact CD2-CG2 4.18Å
1314N82.5Confident68.4Low32 Ų3254.9 Ų54.917%0.17129%0.287CS..Hα-helixtrans-69.8-36.5177-168.741.8000111.5Y1304 F1310 H1311 L1312 T1317 K1318 Y1353Y1304-N1314 HydrophobicContact CD2-CB 3.96Å; Y1304-N1314 VanDerWaalsContact CD2-ND2 3.3Å; Y1304-N1314 WeakPolarHBondContact CD2-ND2 3.45Å; Y1304-N1314 HydrophobicContact CE2-CB 3.95Å; Y1304-N1314 WeakPolarHBondContact CE2-ND2 3.43Å; F1310-N1314 VanDerWaalsContact O-CB 3.3Å; F1310-N1314 WeakPolarHBondContact O-CB 3.46Å; F1310-N1314 PolarHBondContact O-N 3.31Å; H1311-N1314 PolarHBondContact O-N 2.93Å; L1312-N1314 VanDerWaalsContact C-N 3.3Å; L1312-N1314 PolarHBondContact O-N 2.85Å; N1314-T1317 PolarHBondContact O-N 3.39Å; N1314-K1318 WeakPolarHBondContact O-CG 3.43Å; N1314-K1318 PolarHBondContact O-N 2.72Å; N1314-Y1353 WeakPolarHBondContact CA-OH 3.35Å; N1314-Y1353 PolarHBondContact N-OH 3.14Å; N1314-Y1353 VanDerWaalsContact N-OH 3.13Å
1315N80.5Confident66.6Low33 Ų3358 Ų5818%0.17631%0.308CS..Hα-helixtrans-69.7-34.8174.3-73.5-33.9000113.1N1189 Y1304 H1311 L1312 T1317 K1318N1189-N1315 PolarHBondContact ND2-ND2 2.98Å; N1189-N1315 PolarHBondContact OD1-ND2 2.77Å; Y1304-N1315 PolarHBondContact OH-OD1 2.98Å; H1311-N1315 PolarHBondContact CE1-ND2 3.4Å; H1311-N1315 PolarHBondContact ND1-ND2 3.4Å; H1311-N1315 VanDerWaalsContact ND1-ND2 3.12Å; H1311-N1315 PolarHBondContact O-N 3.47Å; H1311-N1315 PolarHBondContact O-ND2 2.84Å; L1312-N1315 PolarHBondContact O-N 3.12Å; N1315-T1317 PolarHBondContact O-N 3.33Å; N1315-K1318 WeakPolarHBondContact OD1-CE 3.15Å; N1315-K1318 PolarHBondContact OD1-NZ 2.85Å
1316L84.3Confident64.7Low16 Ų1664 Ų648%0.08434%0.336CS..THydrogen-bonded Turntrans-73.8-8174.9-66.9166.9000114.2L1312 L1313 I1445 E1449 L1453L1312-L1316 HydrophobicContact CD1-CD1 3.76Å; L1312-L1316 HydrophobicContact CD1-CG 4.07Å; L1312-L1316 HydrophobicContact CG-CD1 3.92Å; L1312-L1316 WeakPolarHBondContact O-CG 3.47Å; L1312-L1316 PolarHBondContact O-N 2.84Å; L1313-L1316 PolarHBondContact O-N 2.9Å; L1316-I1445 HydrophobicContact CB-CD1 3.98Å; L1316-I1445 HydrophobicContact CB-CG1 4.04Å; L1316-I1445 HydrophobicContact CB-CG2 4.35Å; L1316-I1445 HydrophobicContact CD1-CD1 4.23Å; L1316-I1445 HydrophobicContact CD2-CG2 4.49Å; L1316-I1445 WeakPolarHBondContact O-CG1 3.47Å; L1316-E1449 HydrophobicContact CD2-CB 4.27Å; L1316-L1453 HydrophobicContact CD1-CD1 4.06Å; L1316-L1453 HydrophobicContact CD1-CD2 3.85Å; L1316-L1453 HydrophobicContact CD2-CB 4.41Å; L1316-L1453 HydrophobicContact CD2-CD1 4.42Å
1317T80Confident62.5Low9 Ų967 Ų676%0.05536%0.36CS..THydrogen-bonded Turntrans-124.79-177.2540000113.4L1313 N1314 N1315 N1349 Y1353 I1441 L1444 I1445L1313-T1317 WeakPolarHBondContact O-CG2 3.22Å; L1313-T1317 PolarHBondContact O-N 3.47Å; L1313-T1317 PolarHBondContact O-OG1 3.03Å; N1314-T1317 PolarHBondContact O-N 3.39Å; N1315-T1317 PolarHBondContact O-N 3.33Å; T1317-N1349 PolarHBondContact O-ND2 2.78Å; T1317-Y1353 PolarHBondContact OG1-OH 3.45Å; T1317-I1441 HydrophobicContact CG2-CG2 4.38Å; T1317-L1444 HydrophobicContact CG2-CB 4.19Å; T1317-I1445 HydrophobicContact CG2-CG1 4.01Å
1318K72.5Confident60.1Low94 Ų9473.8 Ų73.841%0.40940%0.395SS..SBendtrans-66.7140.2169.4-85.4165.8-174.7174.50110Y1304 N1314 N1315Y1304-K1318 PolarHBondContact OH-NZ 3.48Å; N1314-K1318 WeakPolarHBondContact O-CG 3.43Å; N1314-K1318 PolarHBondContact O-N 2.72Å; N1315-K1318 WeakPolarHBondContact OD1-CE 3.15Å; N1315-K1318 PolarHBondContact OD1-NZ 2.85Å
1319P58.1Low57.3Low49 Ų4979.5 Ų79.532%0.31844%0.435SS..  trans-60.5142.9165.227.1-32.3000109.7D1321 I1345P1319-D1321 PolarHBondContact O-N 2.84Å; P1319-I1345 HydrophobicContact CB-CD1 4.26Å; P1319-I1345 HydrophobicContact CB-CG2 4.39Å
1320M41.3Very low54.5Low128 Ų12883.8 Ų83.863%0.63147%0.466SS*.  trans-75.9102.2178.8-82.2-82.9-67.200110.5N1322M1320-N1322 PolarHBondContact O-N 2.79Å
1321D37.8Very low51.7Low140 Ų14092.2 Ų92.275%0.74950%0.503SS*.  trans-6195.9168.8-82-46000110.5P1319 N1323P1319-D1321 PolarHBondContact O-N 2.84Å; D1321-N1323 PolarHBondContact O-N 2.99Å
1322N30Very low49.4Very low145 Ų14596.7 Ų96.778%0.77554%0.535SS*.  trans-72.771.4176.4-88.6-39.6000111.6M1320M1320-N1322 PolarHBondContact O-N 2.79Å
1323N29.7Very low46.5Very low126 Ų126101.7 Ų101.767%0.67457%0.565SS**  trans-132.165.1173.4-87.8-56.2000112.4D1321 N1325D1321-N1323 PolarHBondContact O-N 2.99Å; N1323-N1325 PolarHBondContact O-N 2.78Å
1324N29.1Very low43.8Very low169 Ų169108.3 Ų108.390%0.90460%0.601SS**  trans-68.281.2154.8-83.7-21.7000109.1
1325N30.1Very low41.4Very low129 Ų129113.7 Ų113.769%0.6963%0.628SS**  trans-14971.9170.3-91.8-43.3000110.6N1323 S1327N1323-N1325 PolarHBondContact O-N 2.78Å; N1325-S1327 PolarHBondContact O-N 2.61Å
1326D27.9Very low39.1Very low174 Ų174118.3 Ų118.393%0.9365%0.653SS**  trans-66.281.4158.6-85.4-47.2000109.6
1327S29.4Very low36.8Very low93 Ų93124.4 Ų124.465%0.6569%0.686SS**  trans173.6158.7146.949.50000114.1N1325N1325-S1327 PolarHBondContact O-N 2.61Å
1328I33.5Very low34.9Very low152 Ų152131.1 Ų131.178%0.77972%0.721SS**  trans68.7100.3167.5-56.3166.5000116.4S1330I1328-S1330 PolarHBondContact O-N 3.05Å
1329S25.4Very low33.6Very low125 Ų125130.5 Ų130.587%0.87473%0.729SS**  trans-52.1114.6161.4150.10000112.9
1330S31.1Very low33.2Very low103 Ų103133.2 Ų133.272%0.7274%0.744SS**  trans-151.6151.9152.7640000110.9I1328I1328-S1330 PolarHBondContact O-N 3.05Å
1331K27.3Very low33.8Very low181 Ų181131.9 Ų131.979%0.78774%0.74SS**  trans-76128.3178.5-88.4-173.3170.5-1740110.7T1333K1331-T1333 HydrophobicContact CB-CG2 4.47Å; K1331-T1333 PolarHBondContact O-N 3.03Å
1332P33Very low34.4Very low125 Ų125128.4 Ų128.481%0.81272%0.721SS**  trans-75.1106163.630-31.5000109.9
1333T25.4Very low35.7Very low111 Ų111125.3 Ų125.368%0.68171%0.705SS**  trans-12272.3168.953.40000110.8K1331K1331-T1333 HydrophobicContact CB-CG2 4.47Å; K1331-T1333 PolarHBondContact O-N 3.03Å
1334N31.8Very low37Very low141 Ų141122.3 Ų122.375%0.75469%0.687SS**  trans-170.6118.8156.2-85.5-31.4000103.7
1335I31.3Very low38.5Very low145 Ų145116.6 Ų116.674%0.74466%0.656SS**  58.583.962.6-49.7173.8000110.5
1336N32.6Very low40Very low129 Ų129117.9 Ų117.969%0.6965%0.651SS**  trans175.8133.8131.2-84.1-9.3000112.4N1338N1336-N1338 PolarHBondContact O-N 3.08Å; N1336-N1338 VanDerWaalsContact O-N 3.11Å
1337D35.3Very low41.8Very low144 Ų144116.4 Ų116.477%0.7764%0.636SS**SBendtrans627140.9-51-21000124.2
1338N39.8Very low43.5Very low150 Ų150117.5 Ų117.580%0.80263%0.626SS**  trans-97.5-5.3174.9-80.7-4.7000116.9N1336 V1340N1336-N1338 PolarHBondContact O-N 3.08Å; N1336-N1338 VanDerWaalsContact O-N 3.11Å; N1338-V1340 PolarHBondContact O-N 3.01Å
1339S45.5Very low45.3Very low81 Ų81111 Ų11157%0.56659%0.593SS**Hα-helixtrans-82.2-12.6-166.162.80000117.2D1343S1339-D1343 PolarHBondContact O-N 3.4Å
1340V49.7Very low47.6Very low106 Ų106106.6 Ų106.664%0.64256%0.561SS**Hα-helixtrans-74.3-39-166.4-177.40000112.8N1338 M1344N1338-V1340 PolarHBondContact O-N 3.01Å; V1340-M1344 WeakPolarHBondContact O-CB 3.37Å; V1340-M1344 PolarHBondContact O-N 3.16Å
1341D54.1Low49.9Very low101 Ų101106.1 Ų106.154%0.5455%0.551SS.*Hα-helixtrans-70.5-37.4178.6-82.4-57.5000112.4M1344 I1345D1341-M1344 PolarHBondContact O-N 3.42Å; D1341-M1344 WeakPolarHBondContact OD1-CE 3.45Å; D1341-I1345 VanDerWaalsContact O-CG1 3.32Å; D1341-I1345 WeakPolarHBondContact O-CG1 3.38Å; D1341-I1345 PolarHBondContact O-N 3.29Å
1342D51Low52.5Low66 Ų6698 Ų9835%0.35352%0.516SS..Hα-helixtrans-62-45.6177-83.6-31000112.2M1344 I1345 R1346D1342-M1344 VanDerWaalsContact C-N 3.28Å; D1342-M1344 PolarHBondContact O-N 2.96Å; D1342-I1345 PolarHBondContact O-N 3.39Å; D1342-R1346 WeakPolarHBondContact O-CB 3.46Å; D1342-R1346 PolarHBondContact O-N 3.12Å
1343D56.6Low54.9Low81 Ų8192.6 Ų92.643%0.43348%0.479SS..Hα-helixtrans-67.1-31.2176.4-91.9-7000112.3S1339 R1346 K1347S1339-D1343 PolarHBondContact O-N 3.4Å; D1343-R1346 IonicContact OD1-NE 3.27Å; D1343-R1346 PolarHBondContact OD1-NE 3.34Å; D1343-K1347 WeakPolarHBondContact O-CB 3.22Å; D1343-K1347 VanDerWaalsContact O-CG 3.22Å; D1343-K1347 WeakPolarHBondContact O-CG 3.49Å; D1343-K1347 PolarHBondContact O-N 2.99Å
1344M58.4Low57.7Low62 Ų6292.6 Ų92.631%0.30547%0.47SS..Hα-helixtrans-71.3-39.1174.3-172.5172.145.100112.1V1340 D1341 D1342 R1348V1340-M1344 WeakPolarHBondContact O-CB 3.37Å; V1340-M1344 PolarHBondContact O-N 3.16Å; D1341-M1344 PolarHBondContact O-N 3.42Å; D1341-M1344 WeakPolarHBondContact OD1-CE 3.45Å; D1342-M1344 VanDerWaalsContact C-N 3.28Å; D1342-M1344 PolarHBondContact O-N 2.96Å; M1344-R1348 VanDerWaalsContact O-CG 3.25Å; M1344-R1348 WeakPolarHBondContact O-CG 3.4Å; M1344-R1348 PolarHBondContact O-N 2.95Å; M1344-R1348 PolarHBondContact SD-NH2 3.45Å
1345I58.9Low60.3Low49 Ų4989.4 Ų89.425%0.25145%0.453SS..Hα-helixtrans-66.7-46172.6-68.6166.1000110.3P1319 D1341 D1342 K1347 R1348 N1349P1319-I1345 HydrophobicContact CB-CD1 4.26Å; P1319-I1345 HydrophobicContact CB-CG2 4.39Å; D1341-I1345 VanDerWaalsContact O-CG1 3.32Å; D1341-I1345 WeakPolarHBondContact O-CG1 3.38Å; D1341-I1345 PolarHBondContact O-N 3.29Å; D1342-I1345 PolarHBondContact O-N 3.39Å; I1345-K1347 PolarHBondContact O-N 2.91Å; I1345-R1348 WeakPolarHBondContact O-CB 3.35Å; I1345-R1348 PolarHBondContact O-N 3.08Å; I1345-R1348 VanDerWaalsContact O-N 3.1Å; I1345-N1349 PolarHBondContact O-N 3.1Å
1346R62.7Low63Low156 Ų15682.6 Ų82.659%0.58942%0.418SS*.Hα-helixtrans-53.9-50.8174.9-166.2-170-54.8-88.7-6.6111D1342 D1343 R1348 N1349 T1350D1342-R1346 WeakPolarHBondContact O-CB 3.46Å; D1342-R1346 PolarHBondContact O-N 3.12Å; D1343-R1346 IonicContact OD1-NE 3.27Å; D1343-R1346 PolarHBondContact OD1-NE 3.34Å; R1346-R1348 PolarHBondContact O-N 3.31Å; R1346-N1349 PolarHBondContact O-N 3.38Å; R1346-T1350 PolarHBondContact O-N 2.79Å; R1346-T1350 PolarHBondContact O-OG1 2.72Å; R1346-T1350 VanDerWaalsContact O-OG1 3.13Å
1347K64.7Low65.7Low143 Ų14379 Ų7962%0.62240%0.395SS*.Hα-helixtrans-60.6-38.9175.5-75.7172.5-179.6-178.70113.2D1343 I1345 N1351D1343-K1347 WeakPolarHBondContact O-CB 3.22Å; D1343-K1347 VanDerWaalsContact O-CG 3.22Å; D1343-K1347 WeakPolarHBondContact O-CG 3.49Å; D1343-K1347 PolarHBondContact O-N 2.99Å; I1345-K1347 PolarHBondContact O-N 2.91Å; K1347-N1351 PolarHBondContact O-N 3.4Å; K1347-N1351 VanDerWaalsContact O-N 3.13Å; K1347-N1351 PolarHBondContact O-ND2 3.16Å; K1347-N1351 VanDerWaalsContact O-ND2 3.15Å
1348R65.3Low68.1Low116 Ų11675.6 Ų75.644%0.43838%0.377SS..Hα-helixtrans-63-44.6175-74.7166.2-176.7148.60.7111.5M1344 I1345 R1346 N1351 V1352 L1444M1344-R1348 VanDerWaalsContact O-CG 3.25Å; M1344-R1348 WeakPolarHBondContact O-CG 3.4Å; M1344-R1348 PolarHBondContact O-N 2.95Å; M1344-R1348 PolarHBondContact SD-NH2 3.45Å; I1345-R1348 WeakPolarHBondContact O-CB 3.35Å; I1345-R1348 PolarHBondContact O-N 3.08Å; I1345-R1348 VanDerWaalsContact O-N 3.1Å; R1346-R1348 PolarHBondContact O-N 3.31Å; R1348-N1351 PolarHBondContact O-N 2.99Å; R1348-V1352 PolarHBondContact O-N 3.48Å; R1348-L1444 HydrophobicContact CB-CD2 4.42Å
1349N72.6Confident70.5Confident15 Ų1568.7 Ų68.78%0.0834%0.34CS..Hα-helixtrans-64-47.6178-68.9-4.2000111.5T1317 I1345 R1346 N1351 V1352 Y1353T1317-N1349 PolarHBondContact O-ND2 2.78Å; I1345-N1349 PolarHBondContact O-N 3.1Å; R1346-N1349 PolarHBondContact O-N 3.38Å; N1349-N1351 VanDerWaalsContact C-N 3.25Å; N1349-N1351 PolarHBondContact O-N 3.36Å; N1349-V1352 PolarHBondContact O-N 2.9Å; N1349-Y1353 HydrophobicContact CB-CE2 4.28Å; N1349-Y1353 WeakPolarHBondContact O-CD2 3.49Å; N1349-Y1353 PolarHBondContact O-N 3.09Å
1350T73.6Confident72.7Confident34 Ų3465 Ų6521%0.20931%0.314CS..Hα-helixtrans-55.8-39.3175.7-55.90000112L1296 R1346 V1352 Y1353 K1354L1296-T1350 HydrophobicContact CD2-CG2 4.33Å; R1346-T1350 PolarHBondContact O-N 2.79Å; R1346-T1350 PolarHBondContact O-OG1 2.72Å; R1346-T1350 VanDerWaalsContact O-OG1 3.13Å; T1350-V1352 PolarHBondContact O-N 2.97Å; T1350-Y1353 PolarHBondContact O-N 2.95Å; T1350-K1354 VanDerWaalsContact O-CB 3.27Å; T1350-K1354 WeakPolarHBondContact O-CB 3.4Å; T1350-K1354 PolarHBondContact O-N 3.25Å
1351N78.6Confident74.4Confident93 Ų9363.4 Ų63.450%0.49730%0.301SS..Hα-helixtrans-65.4-33.8175.6-81.7-41.9000113.6K1347 R1348 N1349 L1355K1347-N1351 PolarHBondContact O-N 3.4Å; K1347-N1351 VanDerWaalsContact O-N 3.13Å; K1347-N1351 PolarHBondContact O-ND2 3.16Å; K1347-N1351 VanDerWaalsContact O-ND2 3.15Å; R1348-N1351 PolarHBondContact O-N 2.99Å; N1349-N1351 VanDerWaalsContact C-N 3.25Å; N1349-N1351 PolarHBondContact O-N 3.36Å; N1351-L1355 PolarHBondContact O-N 3.47Å; N1351-L1355 VanDerWaalsContact O-N 3.1Å
1352V82.5Confident76Confident9 Ų962.5 Ų62.56%0.05529%0.293CS..Hα-helixtrans-71.8-42.2174.1174.10000111.4R1348 N1349 T1350 K1354 L1355 I1356 R1440 I1441 L1444R1348-V1352 PolarHBondContact O-N 3.48Å; N1349-V1352 PolarHBondContact O-N 2.9Å; T1350-V1352 PolarHBondContact O-N 2.97Å; V1352-K1354 VanDerWaalsContact C-N 3.32Å; V1352-K1354 PolarHBondContact O-N 3.21Å; V1352-L1355 WeakPolarHBondContact O-CB 3.49Å; V1352-L1355 PolarHBondContact O-N 3.41Å; V1352-L1355 VanDerWaalsContact O-N 3.09Å; V1352-I1356 HydrophobicContact CG1-CD1 4.29Å; V1352-I1356 WeakPolarHBondContact O-CG1 3.42Å; V1352-I1356 PolarHBondContact O-N 2.87Å; V1352-R1440 HydrophobicContact CG2-CG 3.83Å; V1352-I1441 HydrophobicContact CG1-CD1 4.03Å; V1352-I1441 HydrophobicContact CG1-CG1 3.53Å; V1352-L1444 HydrophobicContact CG2-CD1 3.77Å
1353Y82.3Confident77.8Confident12 Ų1259.5 Ų59.55%0.04728%0.277CS..Hα-helixtrans-64.6-36.2174.3-68.4-61.3000112.8M1300 F1310 L1313 N1314 T1317 N1349 T1350 L1355 I1356 Y1357M1300-Y1353 HydrophobicContact CE-CD2 3.6Å; M1300-Y1353 HydrophobicContact CE-CE2 3.97Å; M1300-Y1353 HydrophobicContact CE-CG 4.26Å; F1310-Y1353 AromaticContact CD2-CD1 3.94Å; F1310-Y1353 HydrophobicContact CD2-CD1 3.94Å; F1310-Y1353 AromaticContact CD2-CE1 3.94Å; F1310-Y1353 HydrophobicContact CD2-CE1 3.94Å; F1310-Y1353 AromaticContact CE2-CD1 3.3Å; F1310-Y1353 HydrophobicContact CE2-CD1 3.3Å; F1310-Y1353 AromaticContact CE2-CE1 3.62Å; F1310-Y1353 HydrophobicContact CE2-CE1 3.62Å; F1310-Y1353 AromaticContact CE2-CG 3.98Å; F1310-Y1353 HydrophobicContact CE2-CG 3.98Å; F1310-Y1353 AromaticContact CZ-CD1 3.8Å; F1310-Y1353 HydrophobicContact CZ-CD1 3.8Å; F1310-Y1353 AromaticContact CZ-CE1 3.94Å; F1310-Y1353 HydrophobicContact CZ-CE1 3.94Å; F1310-Y1353 HydrophobicContact CZ-CG 4.15Å; L1313-Y1353 PolarHBondContact O-OH 2.89Å; N1314-Y1353 WeakPolarHBondContact CA-OH 3.35Å; N1314-Y1353 PolarHBondContact N-OH 3.14Å; N1314-Y1353 VanDerWaalsContact N-OH 3.13Å; T1317-Y1353 PolarHBondContact OG1-OH 3.45Å; N1349-Y1353 HydrophobicContact CB-CE2 4.28Å; N1349-Y1353 WeakPolarHBondContact O-CD2 3.49Å; N1349-Y1353 PolarHBondContact O-N 3.09Å; T1350-Y1353 PolarHBondContact O-N 2.95Å; Y1353-L1355 VanDerWaalsContact C-N 3.3Å; Y1353-L1355 PolarHBondContact O-N 2.96Å; Y1353-I1356 HydrophobicContact CD1-CD1 3.92Å; Y1353-I1356 HydrophobicContact CE1-CD1 4.23Å; Y1353-I1356 PolarHBondContact O-N 3.15Å; Y1353-Y1357 WeakPolarHBondContact O-CB 3.38Å; Y1353-Y1357 PolarHBondContact O-N 3.1Å
1354K84.8Confident79.3Confident111 Ų11160.7 Ų60.748%0.48328%0.275SS..Hα-helixtrans-60.1-38.4170.2-172.3177.1179.8-178.30111.8L1296 T1350 V1352 N1358L1296-K1354 HydrophobicContact CD2-CB 3.84Å; L1296-K1354 HydrophobicContact CD2-CG 4.34Å; T1350-K1354 VanDerWaalsContact O-CB 3.27Å; T1350-K1354 WeakPolarHBondContact O-CB 3.4Å; T1350-K1354 PolarHBondContact O-N 3.25Å; V1352-K1354 VanDerWaalsContact C-N 3.32Å; V1352-K1354 PolarHBondContact O-N 3.21Å; K1354-N1358 WeakPolarHBondContact O-CB 3.48Å; K1354-N1358 PolarHBondContact O-N 2.74Å; K1354-N1358 PolarHBondContact O-ND2 3.47Å
1355L86.8Confident80.5Confident75 Ų7565.2 Ų65.239%0.39330%0.297SS..Hα-helixtrans-69.4-42.8175-17559.9000112.5N1351 V1352 Y1353 Y1357 N1358 L1359 V1437N1351-L1355 PolarHBondContact O-N 3.47Å; N1351-L1355 VanDerWaalsContact O-N 3.1Å; V1352-L1355 WeakPolarHBondContact O-CB 3.49Å; V1352-L1355 PolarHBondContact O-N 3.41Å; V1352-L1355 VanDerWaalsContact O-N 3.09Å; Y1353-L1355 VanDerWaalsContact C-N 3.3Å; Y1353-L1355 PolarHBondContact O-N 2.96Å; L1355-Y1357 PolarHBondContact O-N 3.46Å; L1355-N1358 PolarHBondContact O-N 3.07Å; L1355-L1359 WeakPolarHBondContact O-CB 3.07Å; L1355-L1359 PolarHBondContact O-N 3.23Å; L1355-V1437 HydrophobicContact CD2-CG2 3.76Å; L1355-V1437 HydrophobicContact CG-CG2 3.86Å
1356I88.5Confident81.8Confident2 Ų264.1 Ų64.11%0.0129%0.292CS..Hα-helixtrans-58.1-47.2172.8-67.6167.2000110.5L1230 V1231 L1234 V1352 Y1353 L1359 A1360 V1437 I1441L1230-I1356 HydrophobicContact CD2-CD1 4.5Å; L1230-I1356 HydrophobicContact CD2-CG2 4.13Å; L1230-I1356 HydrophobicContact CG-CG2 4.32Å; V1231-I1356 HydrophobicContact CG2-CG2 3.95Å; L1234-I1356 HydrophobicContact CD1-CG2 3.85Å; V1352-I1356 HydrophobicContact CG1-CD1 4.29Å; V1352-I1356 WeakPolarHBondContact O-CG1 3.42Å; V1352-I1356 PolarHBondContact O-N 2.87Å; Y1353-I1356 HydrophobicContact CD1-CD1 3.92Å; Y1353-I1356 HydrophobicContact CE1-CD1 4.23Å; Y1353-I1356 PolarHBondContact O-N 3.15Å; I1356-L1359 PolarHBondContact O-N 3.43Å; I1356-A1360 PolarHBondContact O-N 2.67Å; I1356-V1437 HydrophobicContact CD1-CG1 4.49Å; I1356-V1437 HydrophobicContact CG1-CG1 3.83Å; I1356-I1441 HydrophobicContact CD1-CD1 4.24Å
1357Y87.6Confident82.9Confident52 Ų5261.9 Ų61.920%0.20429%0.292CS..Hα-helixtrans-64-43.1179.1-176.4-109.6000112.4Y1303 Y1353 L1355 L1359 A1360 I1361Y1303-Y1357 HydrophobicContact CE2-CD2 4.5Å; Y1303-Y1357 VanDerWaalsContact OH-CE2 3.29Å; Y1303-Y1357 WeakPolarHBondContact OH-CE2 3.38Å; Y1353-Y1357 WeakPolarHBondContact O-CB 3.38Å; Y1353-Y1357 PolarHBondContact O-N 3.1Å; L1355-Y1357 PolarHBondContact O-N 3.46Å; Y1357-L1359 VanDerWaalsContact C-N 3.29Å; Y1357-L1359 PolarHBondContact O-N 3.32Å; Y1357-A1360 WeakPolarHBondContact O-CB 3.5Å; Y1357-A1360 PolarHBondContact O-N 3.16Å; Y1357-I1361 HydrophobicContact CD1-CD1 3.97Å; Y1357-I1361 HydrophobicContact CE1-CD1 3.6Å; Y1357-I1361 HydrophobicContact CE1-CG1 4.49Å; Y1357-I1361 WeakPolarHBondContact O-CG1 3.23Å; Y1357-I1361 PolarHBondContact O-N 3.48Å
1358N87Confident84Confident73 Ų7355.6 Ų55.639%0.3927%0.265SS..Hα-helixtrans-61.2-37.5173.4-75-23.7000112.1K1354 L1355 I1361 K1362K1354-N1358 WeakPolarHBondContact O-CB 3.48Å; K1354-N1358 PolarHBondContact O-N 2.74Å; K1354-N1358 PolarHBondContact O-ND2 3.47Å; L1355-N1358 PolarHBondContact O-N 3.07Å; N1358-I1361 PolarHBondContact O-N 2.92Å; N1358-K1362 WeakPolarHBondContact O-CG 3.35Å; N1358-K1362 PolarHBondContact O-N 3.48Å
1359L89.9Confident85.1Confident5 Ų552.2 Ų52.23%0.02626%0.255CS..Hα-helixtrans-69.7-36.1175.5-170.256.5000111.7V1231 L1355 I1356 Y1357 K1362 L1363 N1433 F1434 V1437V1231-L1359 HydrophobicContact CG1-CB 4.35Å; V1231-L1359 HydrophobicContact CG1-CG 4.03Å; V1231-L1359 HydrophobicContact CG2-CD2 4.33Å; L1355-L1359 WeakPolarHBondContact O-CB 3.07Å; L1355-L1359 PolarHBondContact O-N 3.23Å; I1356-L1359 PolarHBondContact O-N 3.43Å; Y1357-L1359 VanDerWaalsContact C-N 3.29Å; Y1357-L1359 PolarHBondContact O-N 3.32Å; L1359-K1362 CarbonylContact O-C 3.59Å; L1359-K1362 PolarHBondContact O-N 2.95Å; L1359-L1363 WeakPolarHBondContact O-CB 3.5Å; L1359-L1363 PolarHBondContact O-N 2.89Å; L1359-N1433 HydrophobicContact CD1-CB 3.64Å; L1359-N1433 HydrophobicContact CD2-CB 3.96Å; L1359-N1433 HydrophobicContact CG-CB 4.49Å; L1359-F1434 HydrophobicContact CD2-CD1 3.64Å; L1359-F1434 HydrophobicContact CD2-CE1 3.72Å; L1359-F1434 HydrophobicContact CG-CE1 4.26Å; L1359-V1437 HydrophobicContact CD2-CG2 4.31Å
1360A90.4Very high86Confident3 Ų353.5 Ų53.53%0.02526%0.264CS..Hα-helixtrans-64.7-39.117400000112.4V1231 L1234 A1235 I1356 Y1357 L1363 R1364V1231-A1360 HydrophobicContact CG1-CB 4.11Å; L1234-A1360 HydrophobicContact CB-CB 3.63Å; A1235-A1360 WeakPolarHBondContact CB-O 3.42Å; I1356-A1360 PolarHBondContact O-N 2.67Å; Y1357-A1360 WeakPolarHBondContact O-CB 3.5Å; Y1357-A1360 PolarHBondContact O-N 3.16Å; A1360-L1363 PolarHBondContact O-N 2.81Å; A1360-R1364 VanDerWaalsContact O-CB 3.3Å; A1360-R1364 WeakPolarHBondContact O-CB 3.25Å; A1360-R1364 PolarHBondContact O-N 3.2Å
1361I87.1Confident86.8Confident73 Ų7351.9 Ų51.937%0.37425%0.254SS..Hα-helixtrans-62.4-46171.2-66.7168.7000110.7Y1357 N1358 L1363 R1364 M1365Y1357-I1361 HydrophobicContact CD1-CD1 3.97Å; Y1357-I1361 HydrophobicContact CE1-CD1 3.6Å; Y1357-I1361 HydrophobicContact CE1-CG1 4.49Å; Y1357-I1361 WeakPolarHBondContact O-CG1 3.23Å; Y1357-I1361 PolarHBondContact O-N 3.48Å; N1358-I1361 PolarHBondContact O-N 2.92Å; I1361-L1363 VanDerWaalsContact C-N 3.28Å; I1361-L1363 PolarHBondContact O-N 3.43Å; I1361-R1364 PolarHBondContact O-N 2.84Å; I1361-M1365 PolarHBondContact O-N 3.42Å
1362K86.9Confident87.5Confident83 Ų8347.5 Ų47.536%0.36123%0.231SC..Hα-helixtrans-63.4-31.4177.5-72.6176.5179.3-174.20112.7G108 N1358 L1359G108-K1362 PolarHBondContact O-NZ 2.97Å; N1358-K1362 WeakPolarHBondContact O-CG 3.35Å; N1358-K1362 PolarHBondContact O-N 3.48Å; L1359-K1362 CarbonylContact O-C 3.59Å; L1359-K1362 PolarHBondContact O-N 2.95Å
1363L88.1Confident88Confident3 Ų347 Ų472%0.01623%0.228CC..Hα-helixtrans-79.4-38.8176.4-165.667.8000112.3V1231 A1235 L1359 A1360 I1361 M1365 L1366 L1368 F1434V1231-L1363 HydrophobicContact CG1-CB 4.24Å; V1231-L1363 HydrophobicContact CG1-CD2 3.8Å; A1235-L1363 HydrophobicContact CB-CB 4.2Å; A1235-L1363 HydrophobicContact CB-CD2 4.36Å; A1235-L1363 HydrophobicContact CB-CG 4.46Å; L1359-L1363 WeakPolarHBondContact O-CB 3.5Å; L1359-L1363 PolarHBondContact O-N 2.89Å; A1360-L1363 PolarHBondContact O-N 2.81Å; I1361-L1363 VanDerWaalsContact C-N 3.28Å; I1361-L1363 PolarHBondContact O-N 3.43Å; L1363-M1365 PolarHBondContact O-N 2.99Å; L1363-L1366 HydrophobicContact CD1-CD1 4.41Å; L1363-L1366 WeakPolarHBondContact O-CB 3.45Å; L1363-L1366 PolarHBondContact O-N 2.91Å; L1363-L1368 HydrophobicContact CD1-CB 4.5Å; L1363-L1368 HydrophobicContact CD1-CD2 4.24Å; L1363-L1368 HydrophobicContact CD2-CD2 4.16Å; L1363-L1368 HydrophobicContact CG-CB 4.47Å; L1363-L1368 HydrophobicContact CG-CD2 4.47Å; L1363-F1434 HydrophobicContact CD2-CZ 4.43Å
1364R88.3Confident88.6Confident106 Ų10646.5 Ų46.540%0.423%0.226SC..Hα-helixtrans-55.3-34.9173.2-175.4-178.9-67.6-155.9-7.5111.9L1234 A1235 D1237 A1360 I1361 L1366 N1367L1234-R1364 PolarHBondContact O-NH2 3.09Å; A1235-R1364 HydrophobicContact CB-CB 4.07Å; A1235-R1364 WeakPolarHBondContact O-CG 3.47Å; A1235-R1364 VanDerWaalsContact O-CZ 3.3Å; A1235-R1364 PolarHBondContact O-NE 3.2Å; A1235-R1364 PolarHBondContact O-NH2 3.34Å; D1237-R1364 PolarHBondContact O-NH2 2.78Å; A1360-R1364 VanDerWaalsContact O-CB 3.3Å; A1360-R1364 WeakPolarHBondContact O-CB 3.25Å; A1360-R1364 PolarHBondContact O-N 3.2Å; I1361-R1364 PolarHBondContact O-N 2.84Å; R1364-L1366 PolarHBondContact O-N 3.05Å; R1364-N1367 PolarHBondContact O-N 2.7Å; R1364-N1367 PolarHBondContact O-OD1 3.4Å; R1364-N1367 VanDerWaalsContact O-OD1 3.1Å
1365M84.5Confident89Confident156 Ų15641.2 Ų41.277%0.76820%0.203SC*.THydrogen-bonded Turntrans-65.6-16.4175.1-73.1-179.959.600115I1361 L1363I1361-M1365 PolarHBondContact O-N 3.42Å; L1363-M1365 PolarHBondContact O-N 2.99Å
1366L84.9Confident89.4Confident27 Ų2737.8 Ų37.814%0.14119%0.185CC..THydrogen-bonded Turntrans-94-16.1178.3-65.6171.3000112.9L1363 R1364 R1423 R1426 L1427 K1430L1363-L1366 HydrophobicContact CD1-CD1 4.41Å; L1363-L1366 WeakPolarHBondContact O-CB 3.45Å; L1363-L1366 PolarHBondContact O-N 2.91Å; R1364-L1366 PolarHBondContact O-N 3.05Å; L1366-R1423 PolarHBondContact O-NH1 3.46Å; L1366-R1423 PolarHBondContact O-NH2 3.47Å; L1366-R1423 VanDerWaalsContact O-NH2 3.17Å; L1366-R1426 HydrophobicContact CD2-CB 4.21Å; L1366-L1427 HydrophobicContact CD1-CD2 4.35Å; L1366-K1430 HydrophobicContact CD1-CG 4.22Å
1367N85.5Confident89.7Confident109 Ų10937.7 Ų37.758%0.58319%0.185SC*.  trans46.472-167.7-68.1-21.1000110.8R1364 D1369 R1423R1364-N1367 PolarHBondContact O-N 2.7Å; R1364-N1367 PolarHBondContact O-OD1 3.4Å; R1364-N1367 VanDerWaalsContact O-OD1 3.1Å; N1367-D1369 PolarHBondContact O-N 3.17Å; N1367-R1423 PolarHBondContact O-NH2 3.25Å
1368L88.8Confident90Very high11 Ų1135.2 Ų35.26%0.05818%0.175CC..  trans-67.5125.3-176.2-169.973.8000111Y1232 L1363 E1372 L1373 L1376 L1427Y1232-L1368 HydrophobicContact CD2-CB 4.39Å; Y1232-L1368 HydrophobicContact CD2-CD2 3.91Å; Y1232-L1368 HydrophobicContact CE2-CB 4.48Å; Y1232-L1368 HydrophobicContact CE2-CD2 4.44Å; L1363-L1368 HydrophobicContact CD1-CB 4.5Å; L1363-L1368 HydrophobicContact CD1-CD2 4.24Å; L1363-L1368 HydrophobicContact CD2-CD2 4.16Å; L1363-L1368 HydrophobicContact CG-CB 4.47Å; L1363-L1368 HydrophobicContact CG-CD2 4.47Å; L1368-E1372 HydrophobicContact CD1-CB 3.59Å; L1368-E1372 HydrophobicContact CG-CB 4.21Å; L1368-L1373 HydrophobicContact CD2-CB 3.74Å; L1368-L1373 HydrophobicContact CD2-CD1 3.8Å; L1368-L1373 HydrophobicContact CD2-CG 4.37Å; L1368-L1373 HydrophobicContact CG-CB 4.31Å; L1368-L1376 HydrophobicContact CD1-CD1 3.91Å; L1368-L1376 HydrophobicContact CD2-CD1 4.33Å; L1368-L1427 HydrophobicContact CD1-CD2 3.38Å
1369D88.8Confident90.4Very high45 Ų4531.9 Ų31.924%0.24116%0.157CC..  trans-78.3150175.2-179.277.1000111.2N1367 V1371 E1372 L1373 Y1411N1367-D1369 PolarHBondContact O-N 3.17Å; D1369-V1371 VanDerWaalsContact C-N 3.25Å; D1369-V1371 PolarHBondContact O-N 3.39Å; D1369-V1371 WeakPolarHBondContact OD2-CB 3.39Å; D1369-V1371 WeakPolarHBondContact OD2-CG2 3.19Å; D1369-V1371 PolarHBondContact OD2-N 3.15Å; D1369-E1372 HydrophobicContact CB-CB 4.4Å; D1369-E1372 HydrophobicContact CB-CG 3.97Å; D1369-E1372 PolarHBondContact N-OE2 2.99Å; D1369-E1372 WeakPolarHBondContact O-CB 3.25Å; D1369-E1372 PolarHBondContact O-N 3.43Å; D1369-E1372 VanDerWaalsContact O-N 3.09Å; D1369-L1373 PolarHBondContact O-N 3.09Å; D1369-Y1411 HydrophobicContact CB-CE1 4.48Å; D1369-Y1411 WeakPolarHBondContact OD2-CE1 3.35Å; D1369-Y1411 PolarHBondContact OD2-OH 3.18Å
1370P90.2Very high90.6Very high42 Ų4231.8 Ų31.827%0.27316%0.157SC..Hα-helixtrans-55.9-34.5177.6-28.136.4000114.2E1142 L1373 G1374E1142-P1370 HydrophobicContact CB-CB 4.11Å; E1142-P1370 WeakPolarHBondContact CG-O 3.18Å; P1370-L1373 WeakPolarHBondContact O-CB 3.29Å; P1370-L1373 PolarHBondContact O-N 3.22Å; P1370-G1374 PolarHBondContact O-N 2.93Å
1371V92Very high90.7Very high0 Ų031.7 Ų31.70%016%0.156CC..Hα-helixtrans-68.8-40.9177.4-176.70000110.6L1135 I1138 R1139 D1369 L1373 G1374 C1375 Y1411L1135-V1371 HydrophobicContact CB-CG1 4.37Å; L1135-V1371 HydrophobicContact CD2-CG1 4.05Å; I1138-V1371 HydrophobicContact CG2-CG1 4.47Å; R1139-V1371 HydrophobicContact CB-CG2 3.86Å; R1139-V1371 HydrophobicContact CG-CG2 4.13Å; D1369-V1371 VanDerWaalsContact C-N 3.25Å; D1369-V1371 PolarHBondContact O-N 3.39Å; D1369-V1371 WeakPolarHBondContact OD2-CB 3.39Å; D1369-V1371 WeakPolarHBondContact OD2-CG2 3.19Å; D1369-V1371 PolarHBondContact OD2-N 3.15Å; V1371-L1373 PolarHBondContact O-N 3.05Å; V1371-G1374 PolarHBondContact O-N 3.34Å; V1371-C1375 PolarHBondContact O-N 3.19Å; V1371-C1375 PolarHBondContact O-SG 3.23Å; V1371-C1375 VanDerWaalsContact O-SG 3.32Å; V1371-Y1411 HydrophobicContact CB-CD1 4.24Å; V1371-Y1411 HydrophobicContact CB-CE1 3.63Å; V1371-Y1411 HydrophobicContact CB-CE2 4.1Å; V1371-Y1411 HydrophobicContact CG1-CD1 4.14Å; V1371-Y1411 HydrophobicContact CG1-CD2 4.16Å; V1371-Y1411 HydrophobicContact CG1-CE1 4Å; V1371-Y1411 HydrophobicContact CG1-CE2 4.02Å; V1371-Y1411 HydrophobicContact CG1-CG 4.19Å; V1371-Y1411 HydrophobicContact CG2-CE1 4.3Å; V1371-Y1411 HydrophobicContact CG2-CE2 4.12Å; V1371-Y1411 VanDerWaalsContact CG2-OH 3.3Å; V1371-Y1411 WeakPolarHBondContact CG2-OH 3.27Å
1372E93.2Very high91Very high0 Ų028.2 Ų28.20%014%0.138CC..Hα-helixtrans-63.8-40.7176.2-61.4169.2164.800111.6L1368 D1369 C1375 L1376 L1408 Y1411 W1416 R1423 L1427L1368-E1372 HydrophobicContact CD1-CB 3.59Å; L1368-E1372 HydrophobicContact CG-CB 4.21Å; D1369-E1372 HydrophobicContact CB-CB 4.4Å; D1369-E1372 HydrophobicContact CB-CG 3.97Å; D1369-E1372 PolarHBondContact N-OE2 2.99Å; D1369-E1372 WeakPolarHBondContact O-CB 3.25Å; D1369-E1372 PolarHBondContact O-N 3.43Å; D1369-E1372 VanDerWaalsContact O-N 3.09Å; E1372-C1375 PolarHBondContact O-N 3.34Å; E1372-L1376 WeakPolarHBondContact O-CB 3.37Å; E1372-L1376 VanDerWaalsContact O-CG 3.29Å; E1372-L1376 WeakPolarHBondContact O-CG 3.4Å; E1372-L1376 PolarHBondContact O-N 3.17Å; E1372-L1408 HydrophobicContact CB-CD1 4.28Å; E1372-L1408 HydrophobicContact CG-CD1 4.07Å; E1372-Y1411 HydrophobicContact CG-CD1 4.01Å; E1372-Y1411 HydrophobicContact CG-CE1 4.02Å; E1372-W1416 PolarHBondContact OE1-NE1 2.64Å; E1372-R1423 IonicContact OE1-CZ 3.37Å; E1372-R1423 IonicContact OE1-NE 2.72Å; E1372-R1423 PolarHBondContact OE1-NE 3.08Å; E1372-R1423 IonicContact OE1-NH2 3.2Å; E1372-R1423 PolarHBondContact OE1-NH2 3.05Å; E1372-R1423 IonicContact OE2-CZ 3.57Å; E1372-R1423 IonicContact OE2-NE 3.6Å; E1372-R1423 IonicContact OE2-NH2 2.69Å; E1372-R1423 PolarHBondContact OE2-NH2 2.61Å; E1372-L1427 HydrophobicContact CB-CD1 4.09Å; E1372-L1427 HydrophobicContact CG-CD1 4.04Å
1373L93.4Very high91.1Very high0 Ų025.7 Ų25.70%013%0.128CC..Hα-helixtrans-58.1-49.5171.6176.868.7000111.5E1142 V1228 Y1232 L1368 D1369 P1370 V1371 L1376 K1377E1142-L1373 WeakPolarHBondContact OE2-CD2 3.38Å; V1228-L1373 HydrophobicContact CG1-CD1 3.57Å; Y1232-L1373 HydrophobicContact CD1-CD2 3.48Å; Y1232-L1373 VanDerWaalsContact CD1-CD2 3.48Å; Y1232-L1373 HydrophobicContact CD2-CD1 4.1Å; Y1232-L1373 HydrophobicContact CD2-CD2 3.82Å; Y1232-L1373 HydrophobicContact CD2-CG 4.37Å; Y1232-L1373 HydrophobicContact CE1-CD2 3.59Å; Y1232-L1373 HydrophobicContact CE2-CB 4.47Å; Y1232-L1373 HydrophobicContact CE2-CD2 3.9Å; Y1232-L1373 HydrophobicContact CG-CD1 3.95Å; Y1232-L1373 HydrophobicContact CG-CD2 3.58Å; Y1232-L1373 HydrophobicContact CG-CG 4.35Å; L1368-L1373 HydrophobicContact CD2-CB 3.74Å; L1368-L1373 HydrophobicContact CD2-CD1 3.8Å; L1368-L1373 HydrophobicContact CD2-CG 4.37Å; L1368-L1373 HydrophobicContact CG-CB 4.31Å; D1369-L1373 PolarHBondContact O-N 3.09Å; P1370-L1373 WeakPolarHBondContact O-CB 3.29Å; P1370-L1373 PolarHBondContact O-N 3.22Å; V1371-L1373 PolarHBondContact O-N 3.05Å; L1373-L1376 PolarHBondContact O-N 3.03Å; L1373-K1377 HydrophobicContact CD1-CD 4.44Å; L1373-K1377 HydrophobicContact CG-CD 4.12Å; L1373-K1377 WeakPolarHBondContact O-CG 3.36Å; L1373-K1377 PolarHBondContact O-N 3.38Å
1374G93.5Very high91Very high0 Ų025.8 Ų25.80%013%0.129CC..Hα-helixtrans-63.3-40.5-18000000112.8E1142 P1370 V1371 L1378E1142-G1374 WeakPolarHBondContact OE1-CA 3.39Å; P1370-G1374 PolarHBondContact O-N 2.93Å; V1371-G1374 PolarHBondContact O-N 3.34Å; G1374-L1378 VanDerWaalsContact O-CB 3.28Å; G1374-L1378 WeakPolarHBondContact O-CB 3.43Å; G1374-L1378 PolarHBondContact O-N 3.27Å
1375C94Very high90.7Very high1 Ų124.4 Ų24.41%0.00713%0.13CC..Hα-helixtrans-62.9-45.7171.9-68.90000112.1V1371 E1372 K1377 L1378 I1379 V1404 L1408V1371-C1375 PolarHBondContact O-N 3.19Å; V1371-C1375 PolarHBondContact O-SG 3.23Å; V1371-C1375 VanDerWaalsContact O-SG 3.32Å; E1372-C1375 PolarHBondContact O-N 3.34Å; C1375-K1377 PolarHBondContact O-N 2.95Å; C1375-L1378 PolarHBondContact O-N 3.39Å; C1375-I1379 WeakPolarHBondContact O-CD1 3.29Å; C1375-I1379 VanDerWaalsContact O-CG1 3.26Å; C1375-I1379 WeakPolarHBondContact O-CG1 3.46Å; C1375-I1379 PolarHBondContact O-N 3.02Å; C1375-V1404 HydrophobicContact CB-CG1 4.16Å; C1375-L1408 HydrophobicContact CB-CB 4.03Å; C1375-L1408 HydrophobicContact CB-CD1 3.87Å; C1375-L1408 HydrophobicContact CB-CD2 3.88Å; C1375-L1408 HydrophobicContact CB-CG 4.14Å
1376L94.7Very high90.1Very high2 Ų218.8 Ų18.81%0.0111%0.106CC..Hα-helixtrans-61.6-44177.5-74.2171.4000112.1L1368 E1372 L1373 L1378 I1379 L1380 L1427 L1431L1368-L1376 HydrophobicContact CD1-CD1 3.91Å; L1368-L1376 HydrophobicContact CD2-CD1 4.33Å; E1372-L1376 WeakPolarHBondContact O-CB 3.37Å; E1372-L1376 VanDerWaalsContact O-CG 3.29Å; E1372-L1376 WeakPolarHBondContact O-CG 3.4Å; E1372-L1376 PolarHBondContact O-N 3.17Å; L1373-L1376 PolarHBondContact O-N 3.03Å; L1376-L1378 VanDerWaalsContact C-N 3.35Å; L1376-I1379 PolarHBondContact O-N 3.44Å; L1376-L1380 WeakPolarHBondContact O-CG 3.27Å; L1376-L1380 PolarHBondContact O-N 3.3Å; L1376-L1380 VanDerWaalsContact O-N 3.1Å; L1376-L1427 HydrophobicContact CD1-CB 4.42Å; L1376-L1427 HydrophobicContact CD1-CD2 4.44Å; L1376-L1427 HydrophobicContact CD2-CB 4.29Å; L1376-L1431 HydrophobicContact CD2-CD2 3.78Å; L1376-L1431 HydrophobicContact CD2-CG 4.13Å
1377K95.2Very high89.1Confident1 Ų119.6 Ų19.60%0.00411%0.109CC..Hα-helixtrans-59.4-44.4172.7-73166.7173.2179.90111.7E1142 W1199 L1225 V1228 N1229 L1373 C1375 L1380 L1381E1142-K1377 WeakPolarHBondContact OE1-CD 3.4Å; E1142-K1377 WeakPolarHBondContact OE1-CE 3.49Å; E1142-K1377 IonicContact OE1-NZ 3.17Å; E1142-K1377 PolarHBondContact OE1-NZ 3.12Å; E1142-K1377 IonicContact OE2-NZ 2.78Å; E1142-K1377 PolarHBondContact OE2-NZ 2.84Å; W1199-K1377 HydrophobicContact CH2-CB 3.49Å; W1199-K1377 VanDerWaalsContact CH2-CB 3.49Å; W1199-K1377 HydrophobicContact CH2-CD 4.46Å; W1199-K1377 HydrophobicContact CZ2-CB 3.41Å; W1199-K1377 VanDerWaalsContact CZ2-CB 3.41Å; W1199-K1377 HydrophobicContact CZ2-CD 3.84Å; W1199-K1377 HydrophobicContact CZ2-CG 4.31Å; W1199-K1377 HydrophobicContact CZ3-CB 4.41Å; L1225-K1377 HydrophobicContact CD2-CB 3.74Å; L1225-K1377 HydrophobicContact CD2-CG 4.04Å; L1225-K1377 WeakPolarHBondContact CD2-O 3.02Å; V1228-K1377 HydrophobicContact CG1-CG 3.76Å; N1229-K1377 WeakPolarHBondContact OD1-CE 3.27Å; N1229-K1377 PolarHBondContact OD1-NZ 2.85Å; L1373-K1377 HydrophobicContact CD1-CD 4.44Å; L1373-K1377 HydrophobicContact CG-CD 4.12Å; L1373-K1377 WeakPolarHBondContact O-CG 3.36Å; L1373-K1377 PolarHBondContact O-N 3.38Å; C1375-K1377 PolarHBondContact O-N 2.95Å; K1377-L1380 PolarHBondContact O-N 3.34Å; K1377-L1381 WeakPolarHBondContact O-CB 3.24Å; K1377-L1381 PolarHBondContact O-N 2.96Å
1378L93.9Very high87.6Confident0 Ų018.2 Ų18.20%011%0.105CC..Hα-helixtrans-69.4-34.6-178.4-173.557.8000112.2I1138 W1199 L1203 Y1205 I1206 G1374 C1375 L1376 L1381 L1382 V1404I1138-L1378 HydrophobicContact CD1-CD2 4.24Å; W1199-L1378 HydrophobicContact CH2-CB 4.44Å; L1203-L1378 HydrophobicContact CD1-CD1 3.96Å; L1203-L1378 HydrophobicContact CD1-CD2 4.4Å; Y1205-L1378 HydrophobicContact CD2-CD2 3.57Å; Y1205-L1378 HydrophobicContact CE2-CD2 3.98Å; Y1205-L1378 HydrophobicContact CG-CD2 4.1Å; I1206-L1378 HydrophobicContact CD1-CD1 4.2Å; I1206-L1378 HydrophobicContact CG1-CD1 4.39Å; G1374-L1378 VanDerWaalsContact O-CB 3.28Å; G1374-L1378 WeakPolarHBondContact O-CB 3.43Å; G1374-L1378 PolarHBondContact O-N 3.27Å; C1375-L1378 PolarHBondContact O-N 3.39Å; L1376-L1378 VanDerWaalsContact C-N 3.35Å; L1378-L1381 PolarHBondContact O-N 3.29Å; L1378-L1382 HydrophobicContact CD1-CD1 3.8Å; L1378-L1382 HydrophobicContact CD1-CG 3.86Å; L1378-L1382 HydrophobicContact CG-CD1 3.82Å; L1378-L1382 HydrophobicContact CG-CG 4.3Å; L1378-L1382 WeakPolarHBondContact O-CB 3.45Å; L1378-L1382 WeakPolarHBondContact O-CG 3.45Å; L1378-L1382 PolarHBondContact O-N 3.3Å; L1378-V1404 HydrophobicContact CB-CG1 4.36Å; L1378-V1404 HydrophobicContact CD2-CG1 4.25Å; L1378-V1404 HydrophobicContact CD2-CG2 3.47Å; L1378-V1404 VanDerWaalsContact CD2-CG2 3.47Å; L1378-V1404 HydrophobicContact CG-CG1 4.4Å; L1378-V1404 HydrophobicContact CG-CG2 3.92Å
1379I94.5Very high85.7Confident2 Ų223 Ų231%0.0114%0.138CC..Hα-helixtrans-61-43.3170.1-70.5157.8000110.9C1375 L1376 R1401 V1404 Y1405 L1408 L1428 L1431C1375-I1379 WeakPolarHBondContact O-CD1 3.29Å; C1375-I1379 VanDerWaalsContact O-CG1 3.26Å; C1375-I1379 WeakPolarHBondContact O-CG1 3.46Å; C1375-I1379 PolarHBondContact O-N 3.02Å; L1376-I1379 PolarHBondContact O-N 3.44Å; I1379-R1401 PolarHBondContact O-NE 3.07Å; I1379-R1401 VanDerWaalsContact O-NE 3.1Å; I1379-R1401 PolarHBondContact O-NH2 3.32Å; I1379-V1404 HydrophobicContact CD1-CG1 4.29Å; I1379-V1404 HydrophobicContact CG1-CB 4.48Å; I1379-V1404 HydrophobicContact CG1-CG1 3.83Å; I1379-Y1405 HydrophobicContact CB-CE1 4.45Å; I1379-Y1405 HydrophobicContact CD1-CD1 3.69Å; I1379-Y1405 HydrophobicContact CD1-CE1 3.65Å; I1379-Y1405 HydrophobicContact CG1-CD1 4.03Å; I1379-Y1405 HydrophobicContact CG1-CE1 3.8Å; I1379-Y1405 HydrophobicContact CG2-CE1 3.74Å; I1379-L1408 HydrophobicContact CD1-CD2 4.06Å; I1379-L1428 HydrophobicContact CD1-CD2 4.05Å; I1379-L1431 HydrophobicContact CG2-CD1 3.83Å; I1379-L1431 HydrophobicContact CG2-CD2 4.46Å
1380L94.3Very high84.2Confident3 Ų325.6 Ų25.62%0.01615%0.151CC..Hα-helixtrans-66.7-41.3176.6-68.1166.2000112.2L1225 V1228 L1376 K1377 L1431 Q1435L1225-L1380 HydrophobicContact CD2-CB 4.46Å; V1228-L1380 HydrophobicContact CG2-CD1 3.6Å; L1376-L1380 WeakPolarHBondContact O-CG 3.27Å; L1376-L1380 PolarHBondContact O-N 3.3Å; L1376-L1380 VanDerWaalsContact O-N 3.1Å; K1377-L1380 PolarHBondContact O-N 3.34Å; L1380-L1431 HydrophobicContact CD1-CD2 4.12Å; L1380-L1431 HydrophobicContact CD2-CD2 3.74Å; L1380-L1431 HydrophobicContact CG-CD2 3.73Å; L1380-Q1435 HydrophobicContact CD2-CG 4.32Å
1381L93.7Very high82.8Confident2 Ų229 Ų291%0.0117%0.167CC..Hα-helixtrans-68-42.6179.1178.559.6000113.1W1199 I1206 L1217 L1218 A1221 L1225 K1377 L1378 N1383W1199-L1381 HydrophobicContact CH2-CD2 4.35Å; W1199-L1381 HydrophobicContact CZ3-CD2 3.84Å; I1206-L1381 HydrophobicContact CD1-CD2 3.55Å; L1217-L1381 VanDerWaalsContact C-CD1 3.49Å; L1217-L1381 HydrophobicContact CB-CD1 3.86Å; L1218-L1381 HydrophobicContact CD2-CD1 4.03Å; L1218-L1381 HydrophobicContact CD2-CD2 4.38Å; L1218-L1381 HydrophobicContact CG-CD1 4.22Å; A1221-L1381 HydrophobicContact CB-CB 4.48Å; A1221-L1381 HydrophobicContact CB-CD1 3.97Å; L1225-L1381 HydrophobicContact CD1-CB 4.42Å; L1225-L1381 HydrophobicContact CD1-CD1 4.31Å; K1377-L1381 WeakPolarHBondContact O-CB 3.24Å; K1377-L1381 PolarHBondContact O-N 2.96Å; L1378-L1381 PolarHBondContact O-N 3.29Å; L1381-N1383 PolarHBondContact O-N 3.1Å
1382L92.1Very high81.7Confident0 Ų035 Ų350%020%0.2CC..SBendtrans-78.960.2179.9-65.8173.5000111.3L1209 L1378 P1384 I1397 L1400 R1401 V1404L1209-L1382 HydrophobicContact CD1-CD2 4.29Å; L1378-L1382 HydrophobicContact CD1-CD1 3.8Å; L1378-L1382 HydrophobicContact CD1-CG 3.86Å; L1378-L1382 HydrophobicContact CG-CD1 3.82Å; L1378-L1382 HydrophobicContact CG-CG 4.3Å; L1378-L1382 WeakPolarHBondContact O-CB 3.45Å; L1378-L1382 WeakPolarHBondContact O-CG 3.45Å; L1378-L1382 PolarHBondContact O-N 3.3Å; L1382-P1384 WeakPolarHBondContact O-CD 3.47Å; L1382-I1397 HydrophobicContact CB-CG2 4.23Å; L1382-I1397 WeakPolarHBondContact O-CG2 3.36Å; L1382-L1400 HydrophobicContact CD1-CB 3.94Å; L1382-L1400 HydrophobicContact CD2-CB 4.37Å; L1382-R1401 HydrophobicContact CB-CB 4.16Å; L1382-R1401 PolarHBondContact O-NE 2.87Å; L1382-R1401 PolarHBondContact O-NH2 2.88Å; L1382-V1404 HydrophobicContact CD1-CG2 4.19Å
1383N89.1Confident81Confident29 Ų2937.1 Ų37.116%0.15521%0.21CC..  trans-94.1111.4-176.6-159.935.1000112.6L1381 D1385 S1386 R1401L1381-N1383 PolarHBondContact O-N 3.1Å; N1383-D1385 PolarHBondContact O-N 3.2Å; N1383-S1386 PolarHBondContact O-OG 3.05Å; N1383-R1401 PolarHBondContact OD1-NH1 3.32Å; N1383-R1401 PolarHBondContact OD1-NH2 3.33Å
1384P86.6Confident80.6Confident6 Ų641.4 Ų41.44%0.03923%0.226CC..THydrogen-bonded Turntrans-75.2-14.2179.433.6-37000112.9L1382 R1394 I1397 E1398 R1401L1382-P1384 WeakPolarHBondContact O-CD 3.47Å; P1384-R1394 HydrophobicContact CB-CG 3.69Å; P1384-R1394 PolarHBondContact O-NH1 3.43Å; P1384-I1397 HydrophobicContact CB-CB 4.41Å; P1384-I1397 HydrophobicContact CB-CG2 4.13Å; P1384-E1398 HydrophobicContact CB-CG 3.62Å; P1384-E1398 HydrophobicContact CG-CG 3.67Å; P1384-R1401 VanDerWaalsContact CD-NH1 3.29Å
1385D82.8Confident80.2Confident76 Ų7645.1 Ų45.141%0.40625%0.252SS..THydrogen-bonded Turntrans-89.2-14.9-177.8-63.7-40000113.8N1383 R1394N1383-D1385 PolarHBondContact O-N 3.2Å; D1385-R1394 IonicContact OD1-CZ 3.51Å; D1385-R1394 IonicContact OD1-NH1 3.71Å; D1385-R1394 PolarHBondContact OD1-NH1 3.2Å; D1385-R1394 IonicContact OD1-NH2 2.66Å; D1385-R1394 PolarHBondContact OD1-NH2 2.83Å
1386S71.1Confident79.8Confident38 Ų3848 Ų4827%0.26627%0.267SS..SBendtrans-83.8-15176.355.10000114S1220 N1383 T1388S1220-S1386 VanDerWaalsContact CB-CB 3.41Å; S1220-S1386 WeakPolarHBondContact CB-OG 3.36Å; S1220-S1386 WeakPolarHBondContact OG-CB 3.48Å; S1220-S1386 PolarHBondContact OG-OG 3.38Å; N1383-S1386 PolarHBondContact O-OG 3.05Å; S1386-T1388 PolarHBondContact O-N 3.33Å
1387M64.2Low79.5Confident44 Ų4447.9 Ų47.922%0.21727%0.267CS..  trans-10267.6-174.5-64.1-63118.300111.9D1216 L1217 C1389 I1397D1216-M1387 VanDerWaalsContact C-CE 3.42Å; D1216-M1387 HydrophobicContact CB-CE 3.82Å; D1216-M1387 HydrophobicContact CB-SD 3.7Å; D1216-M1387 VanDerWaalsContact O-CE 3.25Å; D1216-M1387 WeakPolarHBondContact O-CE 3.23Å; L1217-M1387 HydrophobicContact CD2-CE 4.28Å; L1217-M1387 HydrophobicContact CD2-CG 3.91Å; M1387-C1389 PolarHBondContact O-N 3.48Å; M1387-I1397 HydrophobicContact CG-CD1 4.38Å
1388T54.2Low79.2Confident81 Ų8151 Ų5150%0.49728%0.282SS..THydrogen-bonded Turntrans-66.2-6.5-17653.40000115.2S1386S1386-T1388 PolarHBondContact O-N 3.33Å
1389C49.3Very low79Confident112 Ų11255.6 Ų55.676%0.75731%0.306SS*.THydrogen-bonded Turntrans-100.2-15-169.8-62.40000115.7M1387M1387-C1389 PolarHBondContact O-N 3.48Å
1390L56.2Low78.7Confident98 Ų9855.6 Ų55.651%0.51331%0.306SS..  trans-141.379.7-171.2-70.3175.6000113.4N1392 I1393L1390-N1392 PolarHBondContact O-N 3.11Å; L1390-I1393 HydrophobicContact CB-CD1 4.39Å; L1390-I1393 HydrophobicContact CB-CG1 4.34Å; L1390-I1393 HydrophobicContact CD1-CD1 3.84Å; L1390-I1393 PolarHBondContact O-N 3.2Å
1391N62.1Low78.6Confident114 Ų11456.9 Ų56.961%0.6131%0.31SS*.Hα-helixtrans-49.4-34175.9-67.812.8000113.4I1393 R1394N1391-I1393 PolarHBondContact O-N 3Å; N1391-R1394 PolarHBondContact O-N 3.15Å
1392N67.4Low78.5Confident126 Ų12661.3 Ų61.367%0.67433%0.334SS*.Hα-helixtrans-63.8-19.4-178-65.110.9000114.4L1390L1390-N1392 PolarHBondContact O-N 3.11Å
1393I78.6Confident78.4Confident44 Ų4464.8 Ų64.823%0.22635%0.35CS..Hα-helixtrans-105.7-17.4-176.9-51.8-174000111.4V1213 L1390 N1391 S1395 L1396 I1397V1213-I1393 HydrophobicContact CG1-CG2 4.28Å; V1213-I1393 HydrophobicContact CG2-CD1 3.71Å; V1213-I1393 HydrophobicContact CG2-CG2 4.47Å; L1390-I1393 HydrophobicContact CB-CD1 4.39Å; L1390-I1393 HydrophobicContact CB-CG1 4.34Å; L1390-I1393 HydrophobicContact CD1-CD1 3.84Å; L1390-I1393 PolarHBondContact O-N 3.2Å; N1391-I1393 PolarHBondContact O-N 3Å; I1393-S1395 VanDerWaalsContact C-N 3.35Å; I1393-S1395 PolarHBondContact O-N 3.29Å; I1393-L1396 WeakPolarHBondContact O-CB 3.2Å; I1393-L1396 PolarHBondContact O-N 3.09Å; I1393-L1396 VanDerWaalsContact O-N 3.09Å; I1393-I1397 HydrophobicContact CG2-CD1 3.98Å; I1393-I1397 HydrophobicContact CG2-CG1 4.25Å; I1393-I1397 PolarHBondContact O-N 3.35Å; I1393-I1397 VanDerWaalsContact O-N 3.15Å
1394R85.4Confident78.5Confident90 Ų9063.4 Ų63.434%0.3434%0.343SS..Hα-helixtrans-54.6-47.1-176.7-169.8-169.7164.694.48112.8P1384 D1385 N1391 L1396 I1397 E1398P1384-R1394 HydrophobicContact CB-CG 3.69Å; P1384-R1394 PolarHBondContact O-NH1 3.43Å; D1385-R1394 IonicContact OD1-CZ 3.51Å; D1385-R1394 IonicContact OD1-NH1 3.71Å; D1385-R1394 PolarHBondContact OD1-NH1 3.2Å; D1385-R1394 IonicContact OD1-NH2 2.66Å; D1385-R1394 PolarHBondContact OD1-NH2 2.83Å; N1391-R1394 PolarHBondContact O-N 3.15Å; R1394-L1396 VanDerWaalsContact C-N 3.3Å; R1394-L1396 PolarHBondContact O-N 3.33Å; R1394-I1397 PolarHBondContact O-N 2.97Å; R1394-I1397 VanDerWaalsContact O-N 3.17Å; R1394-E1398 IonicContact CZ-OE1 2.7Å; R1394-E1398 IonicContact NE-OE1 2.78Å; R1394-E1398 PolarHBondContact NE-OE1 3.03Å; R1394-E1398 IonicContact NE-OE2 2.66Å; R1394-E1398 IonicContact NH2-OE1 2.92Å; R1394-E1398 PolarHBondContact NH2-OE1 3.47Å; R1394-E1398 WeakPolarHBondContact O-CG 3.32Å; R1394-E1398 PolarHBondContact O-N 3.37Å
1395S84.9Confident78.8Confident78 Ų7866.3 Ų66.355%0.54535%0.354SS..Hα-helixtrans-66.9-27.9-179.252.20000113.6I1393 L1399I1393-S1395 VanDerWaalsContact C-N 3.35Å; I1393-S1395 PolarHBondContact O-N 3.29Å; S1395-L1399 WeakPolarHBondContact O-CB 3.12Å; S1395-L1399 PolarHBondContact O-N 3.2Å
1396L85.9Confident79.3Confident61 Ų6164.6 Ų64.632%0.31935%0.35SS..Hα-helixtrans-71.3-40.8172.2178.562.1000111L1209 I1393 R1394 L1399 L1400L1209-L1396 HydrophobicContact CD2-CD2 4.07Å; L1209-L1396 HydrophobicContact CD2-CG 4.45Å; I1393-L1396 WeakPolarHBondContact O-CB 3.2Å; I1393-L1396 PolarHBondContact O-N 3.09Å; I1393-L1396 VanDerWaalsContact O-N 3.09Å; R1394-L1396 VanDerWaalsContact C-N 3.3Å; R1394-L1396 PolarHBondContact O-N 3.33Å; L1396-L1399 PolarHBondContact O-N 3.05Å; L1396-L1400 HydrophobicContact CD1-CD1 4.27Å; L1396-L1400 HydrophobicContact CD1-CG 4.36Å; L1396-L1400 HydrophobicContact CG-CD1 4.1Å; L1396-L1400 WeakPolarHBondContact O-CB 3.17Å; L1396-L1400 VanDerWaalsContact O-CG 3.27Å; L1396-L1400 WeakPolarHBondContact O-CG 3.32Å; L1396-L1400 PolarHBondContact O-N 2.9Å
1397I88.7Confident80.2Confident1 Ų162.9 Ų62.91%0.00534%0.338CS..Hα-helixtrans-66.9-40.5176.3-63161.6000110.6L1217 L1382 P1384 M1387 I1393 R1394 L1400 R1401L1217-I1397 HydrophobicContact CD1-CD1 4.42Å; L1217-I1397 HydrophobicContact CD2-CD1 4.26Å; L1382-I1397 HydrophobicContact CB-CG2 4.23Å; L1382-I1397 WeakPolarHBondContact O-CG2 3.36Å; P1384-I1397 HydrophobicContact CB-CB 4.41Å; P1384-I1397 HydrophobicContact CB-CG2 4.13Å; M1387-I1397 HydrophobicContact CG-CD1 4.38Å; I1393-I1397 HydrophobicContact CG2-CD1 3.98Å; I1393-I1397 HydrophobicContact CG2-CG1 4.25Å; I1393-I1397 PolarHBondContact O-N 3.35Å; I1393-I1397 VanDerWaalsContact O-N 3.15Å; R1394-I1397 PolarHBondContact O-N 2.97Å; R1394-I1397 VanDerWaalsContact O-N 3.17Å; I1397-L1400 PolarHBondContact O-N 3.3Å; I1397-R1401 WeakPolarHBondContact O-CB 3.35Å; I1397-R1401 PolarHBondContact O-N 2.9Å
1398E89.3Confident81.5Confident66 Ų6660.8 Ų60.831%0.30833%0.327SS..Hα-helixtrans-59.9-50172.5-74.5169.616100111.1P1384 R1394 L1400 R1401 D1402P1384-E1398 HydrophobicContact CB-CG 3.62Å; P1384-E1398 HydrophobicContact CG-CG 3.67Å; R1394-E1398 IonicContact CZ-OE1 2.7Å; R1394-E1398 IonicContact NE-OE1 2.78Å; R1394-E1398 PolarHBondContact NE-OE1 3.03Å; R1394-E1398 IonicContact NE-OE2 2.66Å; R1394-E1398 IonicContact NH2-OE1 2.92Å; R1394-E1398 PolarHBondContact NH2-OE1 3.47Å; R1394-E1398 WeakPolarHBondContact O-CG 3.32Å; R1394-E1398 PolarHBondContact O-N 3.37Å; E1398-L1400 PolarHBondContact O-N 2.91Å; E1398-R1401 PolarHBondContact O-N 2.91Å; E1398-D1402 PolarHBondContact O-N 2.85Å
1399L88.5Confident83.3Confident97 Ų9760.5 Ų60.551%0.50832%0.321SS..Hα-helixtrans-60.2-41.9177.3-179.763.2000113.2S1395 L1396 D1402 Q1403S1395-L1399 WeakPolarHBondContact O-CB 3.12Å; S1395-L1399 PolarHBondContact O-N 3.2Å; L1396-L1399 PolarHBondContact O-N 3.05Å; L1399-D1402 PolarHBondContact O-N 3.09Å; L1399-Q1403 WeakPolarHBondContact O-CG 3.38Å; L1399-Q1403 PolarHBondContact O-N 2.69Å; L1399-Q1403 VanDerWaalsContact O-N 3.09Å
1400L89Confident85.3Confident1 Ų159.7 Ų59.71%0.00530%0.302CS..Hα-helixtrans-66.3-39.7176.6-72.9167.9000111.5Y1205 L1209 L1382 L1396 I1397 E1398 Q1403 V1404Y1205-L1400 HydrophobicContact CD1-CD2 4.08Å; L1209-L1400 HydrophobicContact CD2-CD1 3.83Å; L1209-L1400 HydrophobicContact CG-CD1 4.25Å; L1382-L1400 HydrophobicContact CD1-CB 3.94Å; L1382-L1400 HydrophobicContact CD2-CB 4.37Å; L1396-L1400 HydrophobicContact CD1-CD1 4.27Å; L1396-L1400 HydrophobicContact CD1-CG 4.36Å; L1396-L1400 HydrophobicContact CG-CD1 4.1Å; L1396-L1400 WeakPolarHBondContact O-CB 3.17Å; L1396-L1400 VanDerWaalsContact O-CG 3.27Å; L1396-L1400 WeakPolarHBondContact O-CG 3.32Å; L1396-L1400 PolarHBondContact O-N 2.9Å; I1397-L1400 PolarHBondContact O-N 3.3Å; E1398-L1400 PolarHBondContact O-N 2.91Å; L1400-Q1403 PolarHBondContact O-N 3.18Å; L1400-V1404 WeakPolarHBondContact O-CG2 3.34Å; L1400-V1404 PolarHBondContact O-N 3.43Å
1401R91.5Very high86.9Confident31 Ų3155.8 Ų55.812%0.11728%0.281CS..Hα-helixtrans-64.2-41174.6179.1-176.8-97.9177.7-1.5111.2I1379 L1382 N1383 P1384 I1397 E1398 Q1403 V1404 Y1405I1379-R1401 PolarHBondContact O-NE 3.07Å; I1379-R1401 VanDerWaalsContact O-NE 3.1Å; I1379-R1401 PolarHBondContact O-NH2 3.32Å; L1382-R1401 HydrophobicContact CB-CB 4.16Å; L1382-R1401 PolarHBondContact O-NE 2.87Å; L1382-R1401 PolarHBondContact O-NH2 2.88Å; N1383-R1401 PolarHBondContact OD1-NH1 3.32Å; N1383-R1401 PolarHBondContact OD1-NH2 3.33Å; P1384-R1401 VanDerWaalsContact CD-NH1 3.29Å; I1397-R1401 WeakPolarHBondContact O-CB 3.35Å; I1397-R1401 PolarHBondContact O-N 2.9Å; E1398-R1401 PolarHBondContact O-N 2.91Å; R1401-Q1403 PolarHBondContact O-N 3.04Å; R1401-V1404 WeakPolarHBondContact O-CB 3.25Å; R1401-V1404 PolarHBondContact O-N 3.22Å; R1401-V1404 VanDerWaalsContact O-N 3.08Å; R1401-Y1405 HydrophobicContact CG-CD2 4.16Å; R1401-Y1405 HydrophobicContact CG-CE2 3.65Å; R1401-Y1405 PolarHBondContact O-N 3.1Å
1402D91.5Very high88.3Confident94 Ų9450.4 Ų50.450%0.50325%0.252SS..Hα-helixtrans-66-35.7178.7-72.8-14.3000112.6E1398 L1399 V1404 Y1405 A1406E1398-D1402 PolarHBondContact O-N 2.85Å; L1399-D1402 PolarHBondContact O-N 3.09Å; D1402-V1404 VanDerWaalsContact C-N 3.27Å; D1402-V1404 PolarHBondContact O-N 3.41Å; D1402-Y1405 PolarHBondContact O-N 3.24Å; D1402-A1406 PolarHBondContact O-N 3.49Å
1403Q89.5Confident89.3Confident73 Ų7348.8 Ų48.834%0.34124%0.244SC..Hα-helixtrans-61.3-35.3170.3-70.71739.500112.5Y1205 L1399 L1400 R1401 G1407Y1205-Q1403 HydrophobicContact CE1-CB 4.02Å; L1399-Q1403 WeakPolarHBondContact O-CG 3.38Å; L1399-Q1403 PolarHBondContact O-N 2.69Å; L1399-Q1403 VanDerWaalsContact O-N 3.09Å; L1400-Q1403 PolarHBondContact O-N 3.18Å; R1401-Q1403 PolarHBondContact O-N 3.04Å; Q1403-G1407 PolarHBondContact O-N 3.15Å
1404V91.9Very high89.8Confident1 Ų152.2 Ų52.21%0.00626%0.259CS..Hα-helixtrans-75.5-35177.5179.60000111.3Y1205 C1375 L1378 I1379 L1382 L1400 R1401 D1402 G1407 L1408Y1205-V1404 HydrophobicContact CD1-CG2 4.23Å; Y1205-V1404 HydrophobicContact CE1-CG2 3.97Å; Y1205-V1404 HydrophobicContact CE2-CG2 4.3Å; C1375-V1404 HydrophobicContact CB-CG1 4.16Å; L1378-V1404 HydrophobicContact CB-CG1 4.36Å; L1378-V1404 HydrophobicContact CD2-CG1 4.25Å; L1378-V1404 HydrophobicContact CD2-CG2 3.47Å; L1378-V1404 VanDerWaalsContact CD2-CG2 3.47Å; L1378-V1404 HydrophobicContact CG-CG1 4.4Å; L1378-V1404 HydrophobicContact CG-CG2 3.92Å; I1379-V1404 HydrophobicContact CD1-CG1 4.29Å; I1379-V1404 HydrophobicContact CG1-CB 4.48Å; I1379-V1404 HydrophobicContact CG1-CG1 3.83Å; L1382-V1404 HydrophobicContact CD1-CG2 4.19Å; L1400-V1404 WeakPolarHBondContact O-CG2 3.34Å; L1400-V1404 PolarHBondContact O-N 3.43Å; R1401-V1404 WeakPolarHBondContact O-CB 3.25Å; R1401-V1404 PolarHBondContact O-N 3.22Å; R1401-V1404 VanDerWaalsContact O-N 3.08Å; D1402-V1404 VanDerWaalsContact C-N 3.27Å; D1402-V1404 PolarHBondContact O-N 3.41Å; V1404-G1407 PolarHBondContact O-N 3.21Å; V1404-L1408 WeakPolarHBondContact O-CB 3.43Å; V1404-L1408 PolarHBondContact O-N 3.34Å
1405Y93.7Very high89.9Confident67 Ų6751.2 Ų51.226%0.26326%0.263SS..Hα-helixtrans-61.5-48.1169.7-70.6-43.7000111.6I1379 R1401 D1402 G1407 L1408 E1409 M1424 L1428I1379-Y1405 HydrophobicContact CB-CE1 4.45Å; I1379-Y1405 HydrophobicContact CD1-CD1 3.69Å; I1379-Y1405 HydrophobicContact CD1-CE1 3.65Å; I1379-Y1405 HydrophobicContact CG1-CD1 4.03Å; I1379-Y1405 HydrophobicContact CG1-CE1 3.8Å; I1379-Y1405 HydrophobicContact CG2-CE1 3.74Å; R1401-Y1405 HydrophobicContact CG-CD2 4.16Å; R1401-Y1405 HydrophobicContact CG-CE2 3.65Å; R1401-Y1405 PolarHBondContact O-N 3.1Å; D1402-Y1405 PolarHBondContact O-N 3.24Å; Y1405-G1407 VanDerWaalsContact C-N 3.31Å; Y1405-G1407 PolarHBondContact O-N 3.45Å; Y1405-L1408 PolarHBondContact O-N 2.86Å; Y1405-E1409 WeakPolarHBondContact O-CB 3.45Å; Y1405-E1409 PolarHBondContact O-N 3.09Å; Y1405-M1424 HydrophobicContact CD1-CE 4.1Å; Y1405-M1424 WeakPolarHBondContact O-CE 3.46Å; Y1405-L1428 HydrophobicContact CD1-CD2 4.15Å; Y1405-L1428 HydrophobicContact CE1-CD2 3.77Å
1406A91.4Very high90Very high40 Ų4051.9 Ų51.933%0.33125%0.253SS..Hα-helixtrans-61-39.1176.700000112.3D1402 Y1410D1402-A1406 PolarHBondContact O-N 3.49Å; A1406-Y1410 WeakPolarHBondContact O-CB 3.4Å; A1406-Y1410 PolarHBondContact O-N 3.17Å
1407G90.5Very high90Very high1 Ų153.3 Ų53.31%0.0127%0.266CS..Hα-helixtrans-65.9-42.1174.900000114P1130 Q1403 V1404 Y1405 Y1410 Y1411P1130-G1407 VanDerWaalsContact CG-CA 3.43Å; Q1403-G1407 PolarHBondContact O-N 3.15Å; V1404-G1407 PolarHBondContact O-N 3.21Å; Y1405-G1407 VanDerWaalsContact C-N 3.31Å; Y1405-G1407 PolarHBondContact O-N 3.45Å; G1407-Y1410 PolarHBondContact O-N 3.25Å; G1407-Y1411 WeakPolarHBondContact O-CB 3.17Å; G1407-Y1411 PolarHBondContact O-N 2.78Å
1408L92.3Very high89.7Confident0 Ų060.8 Ų60.80%031%0.306CS..Hα-helixtrans-72.1-34.1177.8-176.558.2000112.1E1372 C1375 I1379 V1404 Y1405 C1412 M1424 L1427E1372-L1408 HydrophobicContact CB-CD1 4.28Å; E1372-L1408 HydrophobicContact CG-CD1 4.07Å; C1375-L1408 HydrophobicContact CB-CB 4.03Å; C1375-L1408 HydrophobicContact CB-CD1 3.87Å; C1375-L1408 HydrophobicContact CB-CD2 3.88Å; C1375-L1408 HydrophobicContact CB-CG 4.14Å; I1379-L1408 HydrophobicContact CD1-CD2 4.06Å; V1404-L1408 WeakPolarHBondContact O-CB 3.43Å; V1404-L1408 PolarHBondContact O-N 3.34Å; Y1405-L1408 PolarHBondContact O-N 2.86Å; L1408-C1412 VanDerWaalsContact O-CB 3.31Å; L1408-C1412 WeakPolarHBondContact O-CB 3.4Å; L1408-C1412 PolarHBondContact O-N 3.35Å; L1408-C1412 PolarHBondContact O-SG 3.46Å; L1408-M1424 HydrophobicContact CB-CE 3.85Å; L1408-M1424 HydrophobicContact CB-SD 4.15Å; L1408-M1424 HydrophobicContact CD2-CE 4.03Å; L1408-M1424 HydrophobicContact CD2-SD 3.56Å; L1408-M1424 VanDerWaalsContact CD2-SD 3.56Å; L1408-M1424 HydrophobicContact CG-CE 3.99Å; L1408-M1424 HydrophobicContact CG-SD 3.59Å; L1408-M1424 VanDerWaalsContact CG-SD 3.59Å; L1408-L1427 HydrophobicContact CD1-CD1 4.31Å
1409E91.5Very high89.2Confident76 Ų7659.2 Ų59.236%0.35530%0.304SS..Hα-helixtrans-63.6-49.8170.7178.5169.2-152.800111Y1405 Y1411 C1412 N1413 M1424Y1405-E1409 WeakPolarHBondContact O-CB 3.45Å; Y1405-E1409 PolarHBondContact O-N 3.09Å; E1409-Y1411 VanDerWaalsContact C-N 3.35Å; E1409-Y1411 PolarHBondContact O-N 3.48Å; E1409-C1412 PolarHBondContact O-N 3.04Å; E1409-N1413 WeakPolarHBondContact O-CB 3.47Å; E1409-N1413 PolarHBondContact O-N 3.12Å; E1409-N1413 PolarHBondContact O-ND2 3.45Å; E1409-M1424 HydrophobicContact CB-CE 4.42Å
1410Y90.5Very high87.9Confident94 Ų9458.7 Ų58.737%0.36931%0.307SS..Hα-helixtrans-56.9-46.4174.9178.3-106.3000111.8P1129 L1135 A1406 G1407 N1413 Q1414P1129-Y1410 HydrophobicContact CB-CD2 4.15Å; P1129-Y1410 HydrophobicContact CB-CE2 4.26Å; P1129-Y1410 HydrophobicContact CB-CG 4.33Å; L1135-Y1410 HydrophobicContact CD1-CD1 4.33Å; A1406-Y1410 WeakPolarHBondContact O-CB 3.4Å; A1406-Y1410 PolarHBondContact O-N 3.17Å; G1407-Y1410 PolarHBondContact O-N 3.25Å; Y1410-N1413 PolarHBondContact O-N 2.78Å; Y1410-Q1414 HydrophobicContact CD1-CG 4.42Å; Y1410-Q1414 HydrophobicContact CD2-CG 4.05Å; Y1410-Q1414 HydrophobicContact CE1-CG 4.11Å; Y1410-Q1414 HydrophobicContact CE2-CG 3.69Å; Y1410-Q1414 HydrophobicContact CG-CG 4.39Å; Y1410-Q1414 WeakPolarHBondContact O-CB 3.45Å; Y1410-Q1414 VanDerWaalsContact O-CG 3.22Å; Y1410-Q1414 WeakPolarHBondContact O-CG 3.45Å; Y1410-Q1414 PolarHBondContact O-N 2.91Å; Y1410-Q1414 PolarHBondContact OH-NE2 3.03Å
1411Y91.2Very high86.8Confident16 Ų1663.7 Ų63.76%0.06333%0.33CS..Hα-helixtrans-62.5-45.4177.6-167.4-106.9000112.7L1135 R1139 D1369 V1371 E1372 G1407 E1409 N1413 Q1414 V1415L1135-Y1411 HydrophobicContact CD1-CD2 4.08Å; R1139-Y1411 PolarHBondContact NH2-OH 3.27Å; D1369-Y1411 HydrophobicContact CB-CE1 4.48Å; D1369-Y1411 WeakPolarHBondContact OD2-CE1 3.35Å; D1369-Y1411 PolarHBondContact OD2-OH 3.18Å; V1371-Y1411 HydrophobicContact CB-CD1 4.24Å; V1371-Y1411 HydrophobicContact CB-CE1 3.63Å; V1371-Y1411 HydrophobicContact CB-CE2 4.1Å; V1371-Y1411 HydrophobicContact CG1-CD1 4.14Å; V1371-Y1411 HydrophobicContact CG1-CD2 4.16Å; V1371-Y1411 HydrophobicContact CG1-CE1 4Å; V1371-Y1411 HydrophobicContact CG1-CE2 4.02Å; V1371-Y1411 HydrophobicContact CG1-CG 4.19Å; V1371-Y1411 HydrophobicContact CG2-CE1 4.3Å; V1371-Y1411 HydrophobicContact CG2-CE2 4.12Å; V1371-Y1411 VanDerWaalsContact CG2-OH 3.3Å; V1371-Y1411 WeakPolarHBondContact CG2-OH 3.27Å; E1372-Y1411 HydrophobicContact CG-CD1 4.01Å; E1372-Y1411 HydrophobicContact CG-CE1 4.02Å; G1407-Y1411 WeakPolarHBondContact O-CB 3.17Å; G1407-Y1411 PolarHBondContact O-N 2.78Å; E1409-Y1411 VanDerWaalsContact C-N 3.35Å; E1409-Y1411 PolarHBondContact O-N 3.48Å; Y1411-N1413 VanDerWaalsContact C-N 3.32Å; Y1411-N1413 PolarHBondContact O-N 3.13Å; Y1411-Q1414 PolarHBondContact O-N 3.34Å; Y1411-V1415 HydrophobicContact CD1-CG2 4.31Å; Y1411-V1415 HydrophobicContact CD2-CG2 3.94Å; Y1411-V1415 HydrophobicContact CE1-CG2 4.06Å; Y1411-V1415 HydrophobicContact CE2-CG2 3.67Å; Y1411-V1415 HydrophobicContact CG-CG2 4.28Å; Y1411-V1415 WeakPolarHBondContact O-CB 3.28Å; Y1411-V1415 WeakPolarHBondContact O-CG2 3.5Å; Y1411-V1415 PolarHBondContact O-N 3.49Å
1412C91Very high86.3Confident2 Ų264.4 Ų64.41%0.01435%0.347CS..Hα-helixtrans-59.9-42.6176.2-740000111.8L1408 E1409 W1416 M1424L1408-C1412 VanDerWaalsContact O-CB 3.31Å; L1408-C1412 WeakPolarHBondContact O-CB 3.4Å; L1408-C1412 PolarHBondContact O-N 3.35Å; L1408-C1412 PolarHBondContact O-SG 3.46Å; E1409-C1412 PolarHBondContact O-N 3.04Å; C1412-W1416 CarbonylContact O-C 3.37Å; C1412-W1416 VanDerWaalsContact O-CA 3.31Å; C1412-W1416 WeakPolarHBondContact O-CA 3.47Å; C1412-W1416 WeakPolarHBondContact O-CB 3.49Å; C1412-W1416 PolarHBondContact O-N 3.34Å; C1412-M1424 HydrophobicContact CB-CB 4.21Å
1413N89.1Confident86.2Confident91 Ų9161.2 Ų61.249%0.48733%0.328SS..Hα-helixtrans-71.2-34.1-178.4-67.5-18.2000112.3E1409 Y1410 Y1411 P1417E1409-N1413 WeakPolarHBondContact O-CB 3.47Å; E1409-N1413 PolarHBondContact O-N 3.12Å; E1409-N1413 PolarHBondContact O-ND2 3.45Å; Y1410-N1413 PolarHBondContact O-N 2.78Å; Y1411-N1413 VanDerWaalsContact C-N 3.32Å; Y1411-N1413 PolarHBondContact O-N 3.13Å; N1413-P1417 WeakPolarHBondContact O-CA 3.25Å; N1413-P1417 WeakPolarHBondContact O-CB 3.36Å
1414Q87.9Confident86.3Confident117 Ų11759.1 Ų59.155%0.54732%0.318SS..Hα-helixtrans-80.2-42179.4-66.2-73.657.600113.3Y1410 Y1411Y1410-Q1414 HydrophobicContact CD1-CG 4.42Å; Y1410-Q1414 HydrophobicContact CD2-CG 4.05Å; Y1410-Q1414 HydrophobicContact CE1-CG 4.11Å; Y1410-Q1414 HydrophobicContact CE2-CG 3.69Å; Y1410-Q1414 HydrophobicContact CG-CG 4.39Å; Y1410-Q1414 WeakPolarHBondContact O-CB 3.45Å; Y1410-Q1414 VanDerWaalsContact O-CG 3.22Å; Y1410-Q1414 WeakPolarHBondContact O-CG 3.45Å; Y1410-Q1414 PolarHBondContact O-N 2.91Å; Y1410-Q1414 PolarHBondContact OH-NE2 3.03Å; Y1411-Q1414 PolarHBondContact O-N 3.34Å
1415V88.5Confident86.3Confident69 Ų6960.9 Ų60.942%0.41834%0.337SS..Hα-helixtrans-85.5-29.5-177.7-177.60000112Y1411 P1417Y1411-V1415 HydrophobicContact CD1-CG2 4.31Å; Y1411-V1415 HydrophobicContact CD2-CG2 3.94Å; Y1411-V1415 HydrophobicContact CE1-CG2 4.06Å; Y1411-V1415 HydrophobicContact CE2-CG2 3.67Å; Y1411-V1415 HydrophobicContact CG-CG2 4.28Å; Y1411-V1415 WeakPolarHBondContact O-CB 3.28Å; Y1411-V1415 WeakPolarHBondContact O-CG2 3.5Å; Y1411-V1415 PolarHBondContact O-N 3.49Å; V1415-P1417 VanDerWaalsContact C-CD 3.42Å
1416W87.5Confident86.1Confident91 Ų9162.6 Ų62.635%0.34534%0.343SS..  trans-129.846.7-173.8-55.897.5000114.2E1372 C1412 N1418 A1419 R1423E1372-W1416 PolarHBondContact OE1-NE1 2.64Å; C1412-W1416 CarbonylContact O-C 3.37Å; C1412-W1416 VanDerWaalsContact O-CA 3.31Å; C1412-W1416 WeakPolarHBondContact O-CA 3.47Å; C1412-W1416 WeakPolarHBondContact O-CB 3.49Å; C1412-W1416 PolarHBondContact O-N 3.34Å; W1416-N1418 PolarHBondContact O-N 3.47Å; W1416-N1418 VanDerWaalsContact O-N 3.12Å; W1416-A1419 HydrophobicContact CB-CB 3.91Å; W1416-A1419 VanDerWaalsContact O-CB 3.29Å; W1416-A1419 WeakPolarHBondContact O-CB 3.46Å; W1416-A1419 PolarHBondContact O-N 2.8Å; W1416-R1423 VanDerWaalsContact CD1-NE 3.32Å; W1416-R1423 VanDerWaalsContact NE1-NE 3.15Å
1417P84.7Confident86.2Confident92 Ų9260.7 Ų60.760%0.59733%0.327SS*.THydrogen-bonded Turntrans-58-32.1-175.523.6-34.5000113.4N1413 V1415N1413-P1417 WeakPolarHBondContact O-CA 3.25Å; N1413-P1417 WeakPolarHBondContact O-CB 3.36Å; V1415-P1417 VanDerWaalsContact C-CD 3.42Å
1418N83Confident86.3Confident158 Ų15862.7 Ų62.785%0.84534%0.337SS*.THydrogen-bonded Turntrans-91.89.9-179.2-64.4-25.4000113.7W1416 P1420W1416-N1418 PolarHBondContact O-N 3.47Å; W1416-N1418 VanDerWaalsContact O-N 3.12Å; N1418-P1420 WeakPolarHBondContact O-CD 3.41Å
1419A78.5Confident86.3Confident32 Ų3267.8 Ų67.826%0.26436%0.364SS..  trans-73.9117.2-176.800000112.3W1416 H1421 R1423W1416-A1419 HydrophobicContact CB-CB 3.91Å; W1416-A1419 VanDerWaalsContact O-CB 3.29Å; W1416-A1419 WeakPolarHBondContact O-CB 3.46Å; W1416-A1419 PolarHBondContact O-N 2.8Å; A1419-H1421 PolarHBondContact O-N 3.08Å; A1419-R1423 HydrophobicContact CB-CB 4.16Å
1420P60.8Low86.3Confident87 Ų8765.6 Ų65.657%0.56535%0.353SS*.THydrogen-bonded Turntrans-68.1132.7-176.128.5-35.3000111.5N1418N1418-P1420 WeakPolarHBondContact O-CD 3.41Å
1421H66Low86.4Confident105 Ų10562 Ų6249%0.48634%0.34SS..THydrogen-bonded Turntrans65.645.6177.5-36.3-79.4000115.6Y114 A1419 R1426Y114-H1421 AromaticContact CE2-CE1 3.34Å; Y114-H1421 WeakPolarHBondContact CE2-CE1 3.45Å; Y114-H1421 AromaticContact CE2-NE2 3.51Å; Y114-H1421 AromaticContact CZ-CE1 3.67Å; Y114-H1421 AromaticContact CZ-NE2 3.75Å; Y114-H1421 PolarHBondContact OH-CE1 3.16Å; A1419-H1421 PolarHBondContact O-N 3.08Å; H1421-R1426 PolarHBondContact CD2-NH2 2.85Å; H1421-R1426 PolarHBondContact O-NE 3.28Å
1422G80.5Confident86.5Confident46 Ų4663.8 Ų63.847%0.47436%0.355SS..  trans65.481.8158.800000114.6M1424 G1425 R1426G1422-M1424 VanDerWaalsContact C-N 3.33Å; G1422-M1424 PolarHBondContact O-N 3.29Å; G1422-G1425 PolarHBondContact O-N 3.49Å; G1422-R1426 PolarHBondContact O-N 3.13Å
1423R90.3Very high86.5Confident28 Ų2866.4 Ų66.411%0.10637%0.369CS..Hα-helixtrans-51.6-46.6-175.1-172172.7174.396.53.3113.2L1366 N1367 E1372 W1416 A1419 G1425 R1426 L1427L1366-R1423 PolarHBondContact O-NH1 3.46Å; L1366-R1423 PolarHBondContact O-NH2 3.47Å; L1366-R1423 VanDerWaalsContact O-NH2 3.17Å; N1367-R1423 PolarHBondContact O-NH2 3.25Å; E1372-R1423 IonicContact OE1-CZ 3.37Å; E1372-R1423 IonicContact OE1-NE 2.72Å; E1372-R1423 PolarHBondContact OE1-NE 3.08Å; E1372-R1423 IonicContact OE1-NH2 3.2Å; E1372-R1423 PolarHBondContact OE1-NH2 3.05Å; E1372-R1423 IonicContact OE2-CZ 3.57Å; E1372-R1423 IonicContact OE2-NE 3.6Å; E1372-R1423 IonicContact OE2-NH2 2.69Å; E1372-R1423 PolarHBondContact OE2-NH2 2.61Å; W1416-R1423 VanDerWaalsContact CD1-NE 3.32Å; W1416-R1423 VanDerWaalsContact NE1-NE 3.15Å; A1419-R1423 HydrophobicContact CB-CB 4.16Å; R1423-G1425 PolarHBondContact O-N 3.32Å; R1423-R1426 WeakPolarHBondContact O-CB 3.5Å; R1423-R1426 PolarHBondContact O-N 3.29Å; R1423-L1427 HydrophobicContact CG-CD1 4.38Å; R1423-L1427 HydrophobicContact CG-CG 4.47Å; R1423-L1427 WeakPolarHBondContact O-CG 3.43Å; R1423-L1427 PolarHBondContact O-N 3.29Å
1424M92Very high86.7Confident28 Ų2862.1 Ų62.114%0.13835%0.346CS..Hα-helixtrans-50.2-49.9175.1174.149.9151.600112.6Y1405 L1408 E1409 C1412 G1422 R1426 L1427 L1428Y1405-M1424 HydrophobicContact CD1-CE 4.1Å; Y1405-M1424 WeakPolarHBondContact O-CE 3.46Å; L1408-M1424 HydrophobicContact CB-CE 3.85Å; L1408-M1424 HydrophobicContact CB-SD 4.15Å; L1408-M1424 HydrophobicContact CD2-CE 4.03Å; L1408-M1424 HydrophobicContact CD2-SD 3.56Å; L1408-M1424 VanDerWaalsContact CD2-SD 3.56Å; L1408-M1424 HydrophobicContact CG-CE 3.99Å; L1408-M1424 HydrophobicContact CG-SD 3.59Å; L1408-M1424 VanDerWaalsContact CG-SD 3.59Å; E1409-M1424 HydrophobicContact CB-CE 4.42Å; C1412-M1424 HydrophobicContact CB-CB 4.21Å; G1422-M1424 VanDerWaalsContact C-N 3.33Å; G1422-M1424 PolarHBondContact O-N 3.29Å; M1424-R1426 VanDerWaalsContact C-N 3.35Å; M1424-R1426 PolarHBondContact O-N 3.02Å; M1424-L1427 WeakPolarHBondContact O-CB 3.49Å; M1424-L1427 PolarHBondContact O-N 3.21Å; M1424-L1427 VanDerWaalsContact O-N 3.16Å; M1424-L1428 HydrophobicContact CE-CD1 3.97Å; M1424-L1428 HydrophobicContact CE-CD2 4.33Å; M1424-L1428 HydrophobicContact CE-CG 4.32Å; M1424-L1428 HydrophobicContact CG-CD1 4.31Å; M1424-L1428 WeakPolarHBondContact O-CG 3.48Å; M1424-L1428 PolarHBondContact O-N 3.16Å; M1424-L1428 HydrophobicContact SD-CD1 3.88Å; M1424-L1428 HydrophobicContact SD-CD2 4.14Å; M1424-L1428 HydrophobicContact SD-CG 3.79Å
1425G91.7Very high86.9Confident38 Ų3860.3 Ų60.339%0.39234%0.337SS..Hα-helixtrans-61-40.9177.200000113G1422 R1423 L1427 L1428 L1429G1422-G1425 PolarHBondContact O-N 3.49Å; R1423-G1425 PolarHBondContact O-N 3.32Å; G1425-L1427 VanDerWaalsContact C-N 3.29Å; G1425-L1427 PolarHBondContact O-N 2.96Å; G1425-L1428 PolarHBondContact O-N 2.97Å; G1425-L1429 WeakPolarHBondContact O-CB 3.32Å; G1425-L1429 VanDerWaalsContact O-CG 3.29Å; G1425-L1429 WeakPolarHBondContact O-CG 3.31Å; G1425-L1429 PolarHBondContact O-N 3.03Å
1426R90.1Very high87Confident103 Ų10360.1 Ų60.139%0.38934%0.339SS..Hα-helixtrans-64.7-31176.5-66.6179.2167.8-155.3-10.1113.2L1366 H1421 G1422 R1423 M1424L1366-R1426 HydrophobicContact CD2-CB 4.21Å; H1421-R1426 PolarHBondContact CD2-NH2 2.85Å; H1421-R1426 PolarHBondContact O-NE 3.28Å; G1422-R1426 PolarHBondContact O-N 3.13Å; R1423-R1426 WeakPolarHBondContact O-CB 3.5Å; R1423-R1426 PolarHBondContact O-N 3.29Å; M1424-R1426 VanDerWaalsContact C-N 3.35Å; M1424-R1426 PolarHBondContact O-N 3.02Å
1427L92.1Very high87.2Confident1 Ų155.9 Ų55.91%0.00532%0.324CS..Hα-helixtrans-72.9-50.8173.9-65176.7000111.2L1366 L1368 E1372 L1376 L1408 R1423 M1424 G1425 L1429 K1430L1366-L1427 HydrophobicContact CD1-CD2 4.35Å; L1368-L1427 HydrophobicContact CD1-CD2 3.38Å; E1372-L1427 HydrophobicContact CB-CD1 4.09Å; E1372-L1427 HydrophobicContact CG-CD1 4.04Å; L1376-L1427 HydrophobicContact CD1-CB 4.42Å; L1376-L1427 HydrophobicContact CD1-CD2 4.44Å; L1376-L1427 HydrophobicContact CD2-CB 4.29Å; L1408-L1427 HydrophobicContact CD1-CD1 4.31Å; R1423-L1427 HydrophobicContact CG-CD1 4.38Å; R1423-L1427 HydrophobicContact CG-CG 4.47Å; R1423-L1427 WeakPolarHBondContact O-CG 3.43Å; R1423-L1427 PolarHBondContact O-N 3.29Å; M1424-L1427 WeakPolarHBondContact O-CB 3.49Å; M1424-L1427 PolarHBondContact O-N 3.21Å; M1424-L1427 VanDerWaalsContact O-N 3.16Å; G1425-L1427 VanDerWaalsContact C-N 3.29Å; G1425-L1427 PolarHBondContact O-N 2.96Å; L1427-L1429 VanDerWaalsContact C-N 3.27Å; L1427-L1429 PolarHBondContact O-N 3.01Å; L1427-K1430 WeakPolarHBondContact O-CB 3.29Å; L1427-K1430 PolarHBondContact O-N 3.25Å
1428L93.7Very high87.5Confident43 Ų4351.5 Ų51.523%0.22530%0.295CS..Hα-helixtrans-60-35.4179.7-64.9-179.4000112.5I1379 Y1405 M1424 G1425 K1430 L1431I1379-L1428 HydrophobicContact CD1-CD2 4.05Å; Y1405-L1428 HydrophobicContact CD1-CD2 4.15Å; Y1405-L1428 HydrophobicContact CE1-CD2 3.77Å; M1424-L1428 HydrophobicContact CE-CD1 3.97Å; M1424-L1428 HydrophobicContact CE-CD2 4.33Å; M1424-L1428 HydrophobicContact CE-CG 4.32Å; M1424-L1428 HydrophobicContact CG-CD1 4.31Å; M1424-L1428 WeakPolarHBondContact O-CG 3.48Å; M1424-L1428 PolarHBondContact O-N 3.16Å; M1424-L1428 HydrophobicContact SD-CD1 3.88Å; M1424-L1428 HydrophobicContact SD-CD2 4.14Å; M1424-L1428 HydrophobicContact SD-CG 3.79Å; G1425-L1428 PolarHBondContact O-N 2.97Å; L1428-K1430 PolarHBondContact O-N 2.95Å; L1428-L1431 HydrophobicContact CB-CD1 4.36Å; L1428-L1431 HydrophobicContact CD2-CD1 3.69Å; L1428-L1431 VanDerWaalsContact O-CB 3.3Å; L1428-L1431 WeakPolarHBondContact O-CB 3.46Å; L1428-L1431 WeakPolarHBondContact O-CG 3.28Å; L1428-L1431 PolarHBondContact O-N 2.97Å
1429L92.2Very high87.8Confident106 Ų10645.8 Ų45.856%0.55527%0.27SS*.THydrogen-bonded Turntrans-62.8-7.2174-75172.6000114.6G1425 L1427 S1432 N1433G1425-L1429 WeakPolarHBondContact O-CB 3.32Å; G1425-L1429 VanDerWaalsContact O-CG 3.29Å; G1425-L1429 WeakPolarHBondContact O-CG 3.31Å; G1425-L1429 PolarHBondContact O-N 3.03Å; L1427-L1429 VanDerWaalsContact C-N 3.27Å; L1427-L1429 PolarHBondContact O-N 3.01Å; L1429-S1432 PolarHBondContact O-OG 2.98Å; L1429-N1433 PolarHBondContact O-ND2 3.11Å; L1429-N1433 VanDerWaalsContact O-ND2 3.1Å
1430K90.9Very high88.3Confident30 Ų3051.8 Ų51.813%0.1329%0.286CS..THydrogen-bonded Turntrans-91-16.5171.9-51-48.8171.4-159.40113.2L1366 L1427 L1428 S1432 N1433 F1434L1366-K1430 HydrophobicContact CD1-CG 4.22Å; L1427-K1430 WeakPolarHBondContact O-CB 3.29Å; L1427-K1430 PolarHBondContact O-N 3.25Å; L1428-K1430 PolarHBondContact O-N 2.95Å; K1430-S1432 PolarHBondContact O-N 2.92Å; K1430-N1433 WeakPolarHBondContact O-CB 3.21Å; K1430-N1433 PolarHBondContact O-N 3.43Å; K1430-F1434 HydrophobicContact CB-CD2 4.42Å; K1430-F1434 HydrophobicContact CB-CE2 3.82Å; K1430-F1434 HydrophobicContact CB-CZ 4.41Å; K1430-F1434 WeakPolarHBondContact O-CD2 3.41Å; K1430-F1434 PolarHBondContact O-N 3.43Å; K1430-F1434 VanDerWaalsContact O-N 3.12Å
1431L92.9Very high89.6Confident18 Ų1847.8 Ų47.89%0.09426%0.26CS..Hα-helixtrans-58-44.4178.9-63.9171.6000112.4L1376 I1379 L1380 L1428 N1433 F1434 Q1435L1376-L1431 HydrophobicContact CD2-CD2 3.78Å; L1376-L1431 HydrophobicContact CD2-CG 4.13Å; I1379-L1431 HydrophobicContact CG2-CD1 3.83Å; I1379-L1431 HydrophobicContact CG2-CD2 4.46Å; L1380-L1431 HydrophobicContact CD1-CD2 4.12Å; L1380-L1431 HydrophobicContact CD2-CD2 3.74Å; L1380-L1431 HydrophobicContact CG-CD2 3.73Å; L1428-L1431 HydrophobicContact CB-CD1 4.36Å; L1428-L1431 HydrophobicContact CD2-CD1 3.69Å; L1428-L1431 VanDerWaalsContact O-CB 3.3Å; L1428-L1431 WeakPolarHBondContact O-CB 3.46Å; L1428-L1431 WeakPolarHBondContact O-CG 3.28Å; L1428-L1431 PolarHBondContact O-N 2.97Å; L1431-N1433 VanDerWaalsContact C-N 3.28Å; L1431-N1433 PolarHBondContact O-N 3.25Å; L1431-F1434 PolarHBondContact O-N 3.42Å; L1431-Q1435 WeakPolarHBondContact O-CG 3.43Å; L1431-Q1435 PolarHBondContact O-N 3.12Å
1432S92.4Very high90.7Very high55 Ų5546.2 Ų46.239%0.38525%0.252SS..Hα-helixtrans-61.7-33.7175.654.40000113.2L1429 K1430 S1436L1429-S1432 PolarHBondContact O-OG 2.98Å; K1430-S1432 PolarHBondContact O-N 2.92Å; S1432-S1436 WeakPolarHBondContact O-CB 3.36Å; S1432-S1436 PolarHBondContact O-N 3Å
1433N91.6Very high91Very high56 Ų5652.3 Ų52.330%0.29927%0.266SS..Hα-helixtrans-69.6-43.2177.3-69.1-107.3000110.3L1359 L1429 K1430 L1431 S1436 V1437L1359-N1433 HydrophobicContact CD1-CB 3.64Å; L1359-N1433 HydrophobicContact CD2-CB 3.96Å; L1359-N1433 HydrophobicContact CG-CB 4.49Å; L1429-N1433 PolarHBondContact O-ND2 3.11Å; L1429-N1433 VanDerWaalsContact O-ND2 3.1Å; K1430-N1433 WeakPolarHBondContact O-CB 3.21Å; K1430-N1433 PolarHBondContact O-N 3.43Å; L1431-N1433 VanDerWaalsContact C-N 3.28Å; L1431-N1433 PolarHBondContact O-N 3.25Å; N1433-S1436 PolarHBondContact O-N 2.89Å; N1433-V1437 VanDerWaalsContact O-CG2 3.28Å; N1433-V1437 WeakPolarHBondContact O-CG2 3.29Å; N1433-V1437 PolarHBondContact O-N 3.37Å
1434F92.8Very high90.7Very high1 Ų153.8 Ų53.80%0.00428%0.276CS..Hα-helixtrans-63.3-41.7175.1-61.4-57.8000112.3I1227 V1228 V1231 L1359 L1363 K1430 L1431 V1437 A1438I1227-F1434 HydrophobicContact CG2-CD1 4.3Å; V1228-F1434 HydrophobicContact CG2-CB 4.02Å; V1228-F1434 HydrophobicContact CG2-CD1 3.55Å; V1228-F1434 HydrophobicContact CG2-CD2 3.62Å; V1228-F1434 HydrophobicContact CG2-CE1 3.81Å; V1228-F1434 HydrophobicContact CG2-CE2 3.89Å; V1228-F1434 HydrophobicContact CG2-CG 3.46Å; V1228-F1434 VanDerWaalsContact CG2-CG 3.46Å; V1228-F1434 HydrophobicContact CG2-CZ 3.99Å; V1231-F1434 HydrophobicContact CB-CE1 4.02Å; V1231-F1434 HydrophobicContact CG1-CE1 3.94Å; V1231-F1434 HydrophobicContact CG2-CE1 4.25Å; L1359-F1434 HydrophobicContact CD2-CD1 3.64Å; L1359-F1434 HydrophobicContact CD2-CE1 3.72Å; L1359-F1434 HydrophobicContact CG-CE1 4.26Å; L1363-F1434 HydrophobicContact CD2-CZ 4.43Å; K1430-F1434 HydrophobicContact CB-CD2 4.42Å; K1430-F1434 HydrophobicContact CB-CE2 3.82Å; K1430-F1434 HydrophobicContact CB-CZ 4.41Å; K1430-F1434 WeakPolarHBondContact O-CD2 3.41Å; K1430-F1434 PolarHBondContact O-N 3.43Å; K1430-F1434 VanDerWaalsContact O-N 3.12Å; L1431-F1434 PolarHBondContact O-N 3.42Å; F1434-V1437 PolarHBondContact O-N 3.41Å; F1434-A1438 WeakPolarHBondContact O-CB 3.48Å; F1434-A1438 PolarHBondContact O-N 3.3Å
1435Q92.4Very high90.4Very high79 Ų7953 Ų5337%0.36927%0.272SS..Hα-helixtrans-64.2-43.6176.4-72.1170-20.600112.4L1380 L1431 A1438 A1439L1380-Q1435 HydrophobicContact CD2-CG 4.32Å; L1431-Q1435 WeakPolarHBondContact O-CG 3.43Å; L1431-Q1435 PolarHBondContact O-N 3.12Å; Q1435-A1438 PolarHBondContact O-N 3.35Å; Q1435-A1439 WeakPolarHBondContact O-CB 3.48Å; Q1435-A1439 PolarHBondContact O-N 2.88Å
1436S90.9Very high89.9Confident65 Ų6553.8 Ų53.846%0.45527%0.27SS..Hα-helixtrans-63.9-42.3176.7-177.50000112.2S1432 N1433 R1440S1432-S1436 WeakPolarHBondContact O-CB 3.36Å; S1432-S1436 PolarHBondContact O-N 3Å; N1433-S1436 PolarHBondContact O-N 2.89Å; S1436-R1440 WeakPolarHBondContact O-CB 3.41Å; S1436-R1440 PolarHBondContact O-N 3.5Å
1437V90.9Very high89.6Confident3 Ų352.7 Ų52.72%0.01828%0.279CS..Hα-helixtrans-64.7-41.7175175.50000111.5I1227 L1355 I1356 L1359 N1433 F1434 R1440 I1441I1227-V1437 HydrophobicContact CD1-CG1 4.19Å; I1227-V1437 HydrophobicContact CG2-CB 4.36Å; I1227-V1437 HydrophobicContact CG2-CG1 3.86Å; L1355-V1437 HydrophobicContact CD2-CG2 3.76Å; L1355-V1437 HydrophobicContact CG-CG2 3.86Å; I1356-V1437 HydrophobicContact CD1-CG1 4.49Å; I1356-V1437 HydrophobicContact CG1-CG1 3.83Å; L1359-V1437 HydrophobicContact CD2-CG2 4.31Å; N1433-V1437 VanDerWaalsContact O-CG2 3.28Å; N1433-V1437 WeakPolarHBondContact O-CG2 3.29Å; N1433-V1437 PolarHBondContact O-N 3.37Å; F1434-V1437 PolarHBondContact O-N 3.41Å; V1437-R1440 WeakPolarHBondContact O-CB 3.36Å; V1437-R1440 PolarHBondContact O-N 3.31Å; V1437-I1441 HydrophobicContact CG1-CD1 3.79Å; V1437-I1441 WeakPolarHBondContact O-CG1 3.4Å; V1437-I1441 PolarHBondContact O-N 3.26Å
1438A91.7Very high89.1Confident0 Ų057.8 Ų57.80%031%0.306CS..Hα-helixtrans-60.4-53175.500000111.8M1223 Q1224 I1227 F1434 Q1435 R1440 I1441 E1442M1223-A1438 HydrophobicContact CB-CB 4.34Å; Q1224-A1438 HydrophobicContact CG-CB 3.58Å; I1227-A1438 VanDerWaalsContact CD1-CA 3.43Å; I1227-A1438 HydrophobicContact CD1-CB 3.66Å; F1434-A1438 WeakPolarHBondContact O-CB 3.48Å; F1434-A1438 PolarHBondContact O-N 3.3Å; Q1435-A1438 PolarHBondContact O-N 3.35Å; A1438-R1440 PolarHBondContact O-N 3.01Å; A1438-R1440 VanDerWaalsContact O-N 3.13Å; A1438-I1441 PolarHBondContact O-N 3.06Å; A1438-E1442 WeakPolarHBondContact O-CB 3.49Å; A1438-E1442 WeakPolarHBondContact O-CG 3.02Å; A1438-E1442 PolarHBondContact O-N 2.77Å
1439A89.8Confident88.7Confident38 Ų3857.6 Ų57.631%0.31430%0.304SS..Hα-helixtrans-66-15.6178.400000113.9Q1435 K1443Q1435-A1439 WeakPolarHBondContact O-CB 3.48Å; Q1435-A1439 PolarHBondContact O-N 2.88Å; A1439-K1443 WeakPolarHBondContact O-CD 3.48Å; A1439-K1443 WeakPolarHBondContact O-CE 3.46Å; A1439-K1443 VanDerWaalsContact O-CG 3.28Å; A1439-K1443 WeakPolarHBondContact O-CG 3.19Å
1440R89Confident88.4Confident157 Ų15754.7 Ų54.759%0.59229%0.289SS*.Hα-helixtrans-81.6-38170.5-168.372.3178.2-148.72.1111.7V1352 S1436 V1437 A1438V1352-R1440 HydrophobicContact CG2-CG 3.83Å; S1436-R1440 WeakPolarHBondContact O-CB 3.41Å; S1436-R1440 PolarHBondContact O-N 3.5Å; V1437-R1440 WeakPolarHBondContact O-CB 3.36Å; V1437-R1440 PolarHBondContact O-N 3.31Å; A1438-R1440 PolarHBondContact O-N 3.01Å; A1438-R1440 VanDerWaalsContact O-N 3.13Å
1441I88.3Confident88.2Confident4 Ų457.1 Ų57.12%0.02130%0.303CS..Hα-helixtrans-73.9-45.2177.3-69.9161.4000111M1223 I1227 L1313 T1317 V1352 I1356 V1437 A1438 K1443 L1444 I1445M1223-I1441 HydrophobicContact CE-CB 4.41Å; M1223-I1441 HydrophobicContact CE-CG2 3.51Å; I1227-I1441 HydrophobicContact CD1-CD1 3.67Å; I1227-I1441 HydrophobicContact CG1-CD1 3.99Å; L1313-I1441 HydrophobicContact CD2-CG2 4.18Å; T1317-I1441 HydrophobicContact CG2-CG2 4.38Å; V1352-I1441 HydrophobicContact CG1-CD1 4.03Å; V1352-I1441 HydrophobicContact CG1-CG1 3.53Å; I1356-I1441 HydrophobicContact CD1-CD1 4.24Å; V1437-I1441 HydrophobicContact CG1-CD1 3.79Å; V1437-I1441 WeakPolarHBondContact O-CG1 3.4Å; V1437-I1441 PolarHBondContact O-N 3.26Å; A1438-I1441 PolarHBondContact O-N 3.06Å; I1441-K1443 PolarHBondContact O-N 3.02Å; I1441-L1444 WeakPolarHBondContact O-CA 3.4Å; I1441-L1444 WeakPolarHBondContact O-CB 3.36Å; I1441-L1444 PolarHBondContact O-N 3.46Å; I1441-I1445 HydrophobicContact CG2-CD1 3.69Å; I1441-I1445 HydrophobicContact CG2-CG1 4.03Å; I1441-I1445 WeakPolarHBondContact O-CG1 3.48Å; I1441-I1445 PolarHBondContact O-N 3.44Å; I1441-I1445 VanDerWaalsContact O-N 3.13Å
1442E88.3Confident87.9Confident71 Ų7160.8 Ų60.833%0.33232%0.323SS..THydrogen-bonded Turntrans-58.3-22.1178.9-71.7160.5-172.900113M1223 A1438M1223-E1442 HydrophobicContact CB-CG 4.42Å; M1223-E1442 VanDerWaalsContact CB-OE1 3.28Å; M1223-E1442 WeakPolarHBondContact CB-OE1 3.41Å; M1223-E1442 HydrophobicContact CG-CG 3.96Å; M1223-E1442 WeakPolarHBondContact CG-OE1 3.38Å; A1438-E1442 WeakPolarHBondContact O-CB 3.49Å; A1438-E1442 WeakPolarHBondContact O-CG 3.02Å; A1438-E1442 PolarHBondContact O-N 2.77Å
1443K86.7Confident87.7Confident175 Ų17558.5 Ų58.576%0.76131%0.306SS*.THydrogen-bonded Turntrans-85.7-5.9173.7-69.2173.8-172.21720114.6A1439 I1441A1439-K1443 WeakPolarHBondContact O-CD 3.48Å; A1439-K1443 WeakPolarHBondContact O-CE 3.46Å; A1439-K1443 VanDerWaalsContact O-CG 3.28Å; A1439-K1443 WeakPolarHBondContact O-CG 3.19Å; I1441-K1443 PolarHBondContact O-N 3.02Å
1444L83.4Confident87.7Confident59 Ų5957.7 Ų57.731%0.30930%0.302SS..THydrogen-bonded Turntrans-105.9-28.5175.5-63.7173.1000112.1T1317 R1348 V1352 I1441T1317-L1444 HydrophobicContact CG2-CB 4.19Å; R1348-L1444 HydrophobicContact CB-CD2 4.42Å; V1352-L1444 HydrophobicContact CG2-CD1 3.77Å; I1441-L1444 WeakPolarHBondContact O-CA 3.4Å; I1441-L1444 WeakPolarHBondContact O-CB 3.36Å; I1441-L1444 PolarHBondContact O-N 3.46Å
1445I86.1Confident87.4Confident12 Ų1261.7 Ų61.76%0.06232%0.323CS..SBendtrans-71.2136.9175.9-56.4175.9000109.7M1223 L1316 T1317 I1441 E1449 L1450M1223-I1445 HydrophobicContact CE-CD1 3.52Å; M1223-I1445 HydrophobicContact SD-CD1 4.2Å; L1316-I1445 HydrophobicContact CB-CD1 3.98Å; L1316-I1445 HydrophobicContact CB-CG1 4.04Å; L1316-I1445 HydrophobicContact CB-CG2 4.35Å; L1316-I1445 HydrophobicContact CD1-CD1 4.23Å; L1316-I1445 HydrophobicContact CD2-CG2 4.49Å; L1316-I1445 WeakPolarHBondContact O-CG1 3.47Å; T1317-I1445 HydrophobicContact CG2-CG1 4.01Å; I1441-I1445 HydrophobicContact CG2-CD1 3.69Å; I1441-I1445 HydrophobicContact CG2-CG1 4.03Å; I1441-I1445 WeakPolarHBondContact O-CG1 3.48Å; I1441-I1445 PolarHBondContact O-N 3.44Å; I1441-I1445 VanDerWaalsContact O-N 3.13Å; I1445-E1449 HydrophobicContact CG2-CB 3.84Å; I1445-L1450 HydrophobicContact CG2-CB 3.99Å
1446C81.4Confident87.2Confident53 Ų5360.9 Ų60.936%0.35832%0.321SS..  trans-68.3140.7172.1-1780000110.9N1448 E1449 L1450C1446-N1448 PolarHBondContact O-N 3.42Å; C1446-N1448 VanDerWaalsContact O-N 3.09Å; C1446-E1449 HydrophobicContact CB-CB 4.45Å; C1446-E1449 HydrophobicContact CB-CG 4.07Å; C1446-E1449 VanDerWaalsContact CB-OE2 3.26Å; C1446-E1449 WeakPolarHBondContact CB-OE2 3.46Å; C1446-E1449 PolarHBondContact N-OE2 3.03Å; C1446-E1449 WeakPolarHBondContact O-CA 3.33Å; C1446-E1449 WeakPolarHBondContact O-CB 3.36Å; C1446-E1449 PolarHBondContact O-N 3.23Å; C1446-L1450 PolarHBondContact O-N 3.08Å
1447S83.5Confident87.2Confident81 Ų8157.8 Ų57.857%0.56630%0.3SS*.Hα-helixtrans-56.1-32.5-178.757.20000113.2N1451S1447-N1451 VanDerWaalsContact O-CB 3.31Å; S1447-N1451 WeakPolarHBondContact O-CB 3.31Å; S1447-N1451 PolarHBondContact O-N 3.39Å; S1447-N1451 PolarHBondContact O-ND2 2.87Å
1448N82.8Confident87.1Confident107 Ų10761.4 Ų61.457%0.57232%0.316SS*.Hα-helixtrans-64.9-38.8173.1-70.8-21.7000112.9C1446 N1452C1446-N1448 PolarHBondContact O-N 3.42Å; C1446-N1448 VanDerWaalsContact O-N 3.09Å; N1448-N1452 WeakPolarHBondContact O-CB 3.46Å; N1448-N1452 PolarHBondContact O-N 3.39Å; N1448-N1452 PolarHBondContact O-ND2 3.26Å
1449E84.8Confident86.8Confident40 Ų4064.6 Ų64.619%0.18734%0.338CS..Hα-helixtrans-74.8-38.8179.7-62.8176.9122.400111.6L1316 I1445 C1446 N1452 L1453L1316-E1449 HydrophobicContact CD2-CB 4.27Å; I1445-E1449 HydrophobicContact CG2-CB 3.84Å; C1446-E1449 HydrophobicContact CB-CB 4.45Å; C1446-E1449 HydrophobicContact CB-CG 4.07Å; C1446-E1449 VanDerWaalsContact CB-OE2 3.26Å; C1446-E1449 WeakPolarHBondContact CB-OE2 3.46Å; C1446-E1449 PolarHBondContact N-OE2 3.03Å; C1446-E1449 WeakPolarHBondContact O-CA 3.33Å; C1446-E1449 WeakPolarHBondContact O-CB 3.36Å; C1446-E1449 PolarHBondContact O-N 3.23Å; E1449-N1452 PolarHBondContact O-N 2.76Å; E1449-L1453 WeakPolarHBondContact O-CB 3.33Å; E1449-L1453 PolarHBondContact O-N 2.99Å
1450L86.4Confident86.6Confident44 Ų4463 Ų6323%0.2332%0.324CS..Hα-helixtrans-62-43.7171.5-173.863.4000111I1445 C1446 L1453 L1454I1445-L1450 HydrophobicContact CG2-CB 3.99Å; C1446-L1450 PolarHBondContact O-N 3.08Å; L1450-L1453 WeakPolarHBondContact O-CB 3.48Å; L1450-L1453 PolarHBondContact O-N 3.41Å; L1450-L1454 HydrophobicContact CG-CD1 4.38Å; L1450-L1454 WeakPolarHBondContact O-CG 3.39Å; L1450-L1454 PolarHBondContact O-N 3.07Å
1451N86.8Confident86.6Confident82 Ų8255.9 Ų55.944%0.43930%0.298SS..Hα-helixtrans-62-42.6173-76.5-35.1000111.8S1447 L1453 L1454 N1455S1447-N1451 VanDerWaalsContact O-CB 3.31Å; S1447-N1451 WeakPolarHBondContact O-CB 3.31Å; S1447-N1451 PolarHBondContact O-N 3.39Å; S1447-N1451 PolarHBondContact O-ND2 2.87Å; N1451-L1453 VanDerWaalsContact C-N 3.33Å; N1451-L1453 PolarHBondContact O-N 3.23Å; N1451-L1454 PolarHBondContact O-N 3.29Å; N1451-N1455 VanDerWaalsContact O-CB 3.32Å; N1451-N1455 WeakPolarHBondContact O-CB 3.45Å; N1451-N1455 PolarHBondContact O-N 3.44Å; N1451-N1455 PolarHBondContact O-ND2 3.03Å
1452N86.3Confident86.5Confident94 Ų9457.9 Ų57.950%0.50331%0.313SS..Hα-helixtrans-61.7-38.9174.6-72.9-23000112.2N1448 E1449 N1456N1448-N1452 WeakPolarHBondContact O-CB 3.46Å; N1448-N1452 PolarHBondContact O-N 3.39Å; N1448-N1452 PolarHBondContact O-ND2 3.26Å; E1449-N1452 PolarHBondContact O-N 2.76Å; N1452-N1456 WeakPolarHBondContact O-CB 3.49Å; N1452-N1456 VanDerWaalsContact O-CG 3.28Å; N1452-N1456 PolarHBondContact O-N 3.41Å; N1452-N1456 PolarHBondContact O-ND2 3.08Å
1453L88.5Confident86Confident7 Ų756.4 Ų56.44%0.03730%0.304CS..Hα-helixtrans-61.5-46.6174.5-172.172.1000111.8L1193 M1223 L1312 L1316 E1449 L1450 N1451 N1456 L1457L1193-L1453 HydrophobicContact CD1-CD1 3.99Å; L1193-L1453 HydrophobicContact CD2-CD1 4.06Å; L1193-L1453 HydrophobicContact CD2-CG 4.43Å; L1193-L1453 HydrophobicContact CG-CD1 4.38Å; M1223-L1453 HydrophobicContact SD-CD2 3.68Å; L1312-L1453 HydrophobicContact CD1-CD1 3.89Å; L1312-L1453 HydrophobicContact CD2-CD1 4.27Å; L1316-L1453 HydrophobicContact CD1-CD1 4.06Å; L1316-L1453 HydrophobicContact CD1-CD2 3.85Å; L1316-L1453 HydrophobicContact CD2-CB 4.41Å; L1316-L1453 HydrophobicContact CD2-CD1 4.42Å; E1449-L1453 WeakPolarHBondContact O-CB 3.33Å; E1449-L1453 PolarHBondContact O-N 2.99Å; L1450-L1453 WeakPolarHBondContact O-CB 3.48Å; L1450-L1453 PolarHBondContact O-N 3.41Å; N1451-L1453 VanDerWaalsContact C-N 3.33Å; N1451-L1453 PolarHBondContact O-N 3.23Å; L1453-N1456 PolarHBondContact O-N 3.14Å; L1453-L1457 PolarHBondContact O-N 2.78Å
1454L90.2Very high85.6Confident39 Ų3950 Ų5020%0.20428%0.278CS..Hα-helixtrans-69.6-37180-64.8172.3000112.2K1219 L1450 N1451 L1457 E1458K1219-L1454 HydrophobicContact CB-CD2 3.99Å; K1219-L1454 HydrophobicContact CG-CD2 4.1Å; L1450-L1454 HydrophobicContact CG-CD1 4.38Å; L1450-L1454 WeakPolarHBondContact O-CG 3.39Å; L1450-L1454 PolarHBondContact O-N 3.07Å; N1451-L1454 PolarHBondContact O-N 3.29Å; L1454-L1457 PolarHBondContact O-N 3.08Å; L1454-E1458 WeakPolarHBondContact O-CB 3.36Å; L1454-E1458 PolarHBondContact O-N 2.9Å
1455N88Confident85.4Confident85 Ų8548.6 Ų48.646%0.45527%0.273SS..Hα-helixtrans-65.4-37.9173-70.3-23.7000112N1451 S1459N1451-N1455 VanDerWaalsContact O-CB 3.32Å; N1451-N1455 WeakPolarHBondContact O-CB 3.45Å; N1451-N1455 PolarHBondContact O-N 3.44Å; N1451-N1455 PolarHBondContact O-ND2 3.03Å; N1455-S1459 WeakPolarHBondContact O-CB 3.46Å; N1455-S1459 PolarHBondContact O-N 3.06Å; N1455-S1459 PolarHBondContact O-OG 3.31Å
1456N87.5Confident84.6Confident62 Ų6254.1 Ų54.133%0.33230%0.297SS..Hα-helixtrans-65.8-44.2172.9-80.3-46.3000111.5H1190 L1193 N1452 L1453 S1459 I1460H1190-N1456 PolarHBondContact CE1-OD1 3.26Å; L1193-N1456 HydrophobicContact CD1-CB 3.86Å; N1452-N1456 WeakPolarHBondContact O-CB 3.49Å; N1452-N1456 VanDerWaalsContact O-CG 3.28Å; N1452-N1456 PolarHBondContact O-N 3.41Å; N1452-N1456 PolarHBondContact O-ND2 3.08Å; L1453-N1456 PolarHBondContact O-N 3.14Å; N1456-S1459 PolarHBondContact O-N 3.34Å; N1456-I1460 WeakPolarHBondContact O-CB 3.27Å; N1456-I1460 VanDerWaalsContact O-CG1 3.28Å; N1456-I1460 WeakPolarHBondContact O-CG1 3.42Å; N1456-I1460 PolarHBondContact O-N 3.36Å
1457L90.3Very high83.6Confident0 Ų053.7 Ų53.70%029%0.289CS..Hα-helixtrans-59-47.5174.5-175.7157.9000111L1193 L1215 L1218 K1219 C1222 L1453 L1454 S1459 I1460 F1461L1193-L1457 HydrophobicContact CD2-CB 4.38Å; L1193-L1457 HydrophobicContact CD2-CD1 4.31Å; L1215-L1457 HydrophobicContact CD1-CD2 3.53Å; L1218-L1457 HydrophobicContact CB-CD2 4.19Å; K1219-L1457 HydrophobicContact CG-CD2 4.31Å; C1222-L1457 HydrophobicContact CB-CD1 3.98Å; L1453-L1457 PolarHBondContact O-N 2.78Å; L1454-L1457 PolarHBondContact O-N 3.08Å; L1457-S1459 PolarHBondContact O-N 2.91Å; L1457-I1460 PolarHBondContact O-N 2.9Å; L1457-F1461 WeakPolarHBondContact O-CB 3.36Å; L1457-F1461 PolarHBondContact O-N 3.34Å
1458E89Confident82.5Confident80 Ų8055 Ų5537%0.37428%0.284SS..Hα-helixtrans-62.4-39.8176.9175160.8-176.300112.7L1215 K1219 L1454 F1461 S1462L1215-E1458 HydrophobicContact CD1-CB 4.21Å; L1215-E1458 HydrophobicContact CD2-CB 4.32Å; L1215-E1458 HydrophobicContact CD2-CG 3.85Å; K1219-E1458 VanDerWaalsContact CE-OE2 3.22Å; K1219-E1458 WeakPolarHBondContact CE-OE2 3.34Å; K1219-E1458 IonicContact NZ-OE2 3.23Å; K1219-E1458 PolarHBondContact NZ-OE2 3.38Å; L1454-E1458 WeakPolarHBondContact O-CB 3.36Å; L1454-E1458 PolarHBondContact O-N 2.9Å; E1458-F1461 PolarHBondContact O-N 3.42Å; E1458-S1462 VanDerWaalsContact O-CB 3.25Å; E1458-S1462 WeakPolarHBondContact O-CB 3.2Å; E1458-S1462 PolarHBondContact O-N 2.91Å
1459S86.2Confident81Confident66 Ų6653.2 Ų53.246%0.46228%0.277SS..Hα-helixtrans-63.5-46.5176.8-61.40000111.8N1455 N1456 L1457 Y1463N1455-S1459 WeakPolarHBondContact O-CB 3.46Å; N1455-S1459 PolarHBondContact O-N 3.06Å; N1455-S1459 PolarHBondContact O-OG 3.31Å; N1456-S1459 PolarHBondContact O-N 3.34Å; L1457-S1459 PolarHBondContact O-N 2.91Å; S1459-Y1463 WeakPolarHBondContact O-CB 3.03Å; S1459-Y1463 PolarHBondContact O-N 3.38Å
1460I86.4Confident78.6Confident4 Ų455.9 Ų55.92%0.02129%0.293CS..Hα-helixtrans-62.2-45.5175.6-69.5166.3000110.5H1190 L1193 F1194 V1197 N1456 L1457 Y1463 L1464H1190-I1460 HydrophobicContact CB-CD1 4.45Å; L1193-I1460 HydrophobicContact CB-CD1 3.79Å; L1193-I1460 HydrophobicContact CD1-CD1 4.27Å; F1194-I1460 HydrophobicContact CD1-CG1 4.5Å; F1194-I1460 HydrophobicContact CD1-CG2 3.56Å; F1194-I1460 HydrophobicContact CD2-CD1 3.97Å; F1194-I1460 HydrophobicContact CE1-CB 4.39Å; F1194-I1460 HydrophobicContact CE1-CD1 4.42Å; F1194-I1460 HydrophobicContact CE1-CG1 4.02Å; F1194-I1460 HydrophobicContact CE1-CG2 3.63Å; F1194-I1460 HydrophobicContact CE2-CD1 3.78Å; F1194-I1460 HydrophobicContact CE2-CG1 4.08Å; F1194-I1460 HydrophobicContact CG-CD1 4.35Å; F1194-I1460 HydrophobicContact CG-CG2 4.15Å; F1194-I1460 HydrophobicContact CZ-CD1 4.02Å; F1194-I1460 HydrophobicContact CZ-CG1 3.77Å; F1194-I1460 HydrophobicContact CZ-CG2 4.27Å; V1197-I1460 HydrophobicContact CB-CG2 4.39Å; V1197-I1460 HydrophobicContact CG2-CG2 4.13Å; N1456-I1460 WeakPolarHBondContact O-CB 3.27Å; N1456-I1460 VanDerWaalsContact O-CG1 3.28Å; N1456-I1460 WeakPolarHBondContact O-CG1 3.42Å; N1456-I1460 PolarHBondContact O-N 3.36Å; L1457-I1460 PolarHBondContact O-N 2.9Å; I1460-Y1463 PolarHBondContact O-N 3.08Å; I1460-L1464 HydrophobicContact CG2-CD1 3.89Å; I1460-L1464 WeakPolarHBondContact O-CG 3.18Å; I1460-L1464 PolarHBondContact O-N 3.05Å
1461F89.1Confident76.2Confident8 Ų858.5 Ų58.54%0.03530%0.304CS..Hα-helixtrans-64-44.9179.9-175.1-89.7000112.4V1197 C1211 H1214 L1215 L1218 L1457 E1458 Y1463 S1465V1197-F1461 HydrophobicContact CG1-CD2 3.93Å; V1197-F1461 HydrophobicContact CG2-CB 4.33Å; V1197-F1461 HydrophobicContact CG2-CD2 4.25Å; C1211-F1461 WeakPolarHBondContact O-CE1 3.31Å; C1211-F1461 WeakPolarHBondContact O-CZ 3.24Å; C1211-F1461 VanDerWaalsContact SG-CE1 3.52Å; H1214-F1461 HydrophobicContact CB-CE2 4.47Å; H1214-F1461 HydrophobicContact CB-CZ 4.08Å; H1214-F1461 AromaticContact CE1-CE2 3.59Å; H1214-F1461 AromaticContact CG-CE2 3.78Å; H1214-F1461 AromaticContact CG-CZ 3.84Å; H1214-F1461 AromaticContact ND1-CE2 3.5Å; H1214-F1461 WeakPolarHBondContact ND1-CE2 3.34Å; H1214-F1461 AromaticContact ND1-CZ 3.62Å; H1214-F1461 AromaticContact NE2-CE2 3.91Å; L1215-F1461 HydrophobicContact CB-CD1 3.91Å; L1215-F1461 HydrophobicContact CB-CE1 3.68Å; L1215-F1461 HydrophobicContact CB-CG 4.48Å; L1215-F1461 HydrophobicContact CB-CZ 4.07Å; L1215-F1461 HydrophobicContact CD1-CB 4.01Å; L1215-F1461 HydrophobicContact CD1-CD1 3.92Å; L1215-F1461 HydrophobicContact CD1-CD2 4.47Å; L1215-F1461 HydrophobicContact CD1-CG 3.88Å; L1215-F1461 HydrophobicContact CD2-CD1 4.24Å; L1215-F1461 HydrophobicContact CG-CD1 4.24Å; L1215-F1461 HydrophobicContact CG-CE1 4.49Å; L1218-F1461 HydrophobicContact CD1-CD2 3.68Å; L1218-F1461 HydrophobicContact CD1-CE2 3.71Å; L1457-F1461 WeakPolarHBondContact O-CB 3.36Å; L1457-F1461 PolarHBondContact O-N 3.34Å; E1458-F1461 PolarHBondContact O-N 3.42Å; F1461-Y1463 VanDerWaalsContact C-N 3.33Å; F1461-Y1463 PolarHBondContact O-N 3.38Å; F1461-S1465 WeakPolarHBondContact O-CB 3.3Å; F1461-S1465 PolarHBondContact O-N 3.21Å; F1461-S1465 PolarHBondContact O-OG 2.78Å
1462S85.5Confident73.7Confident47 Ų4755.4 Ų55.433%0.32929%0.289SS..Hα-helixtrans-62.3-40175.6-169.90000111.6E1458 K1466E1458-S1462 VanDerWaalsContact O-CB 3.25Å; E1458-S1462 WeakPolarHBondContact O-CB 3.2Å; E1458-S1462 PolarHBondContact O-N 2.91Å; S1462-K1466 WeakPolarHBondContact O-CD 3.46Å; S1462-K1466 VanDerWaalsContact O-CG 3.29Å; S1462-K1466 WeakPolarHBondContact O-CG 3.33Å; S1462-K1466 PolarHBondContact O-N 3.34Å; S1462-K1466 PolarHBondContact OG-NZ 3.35Å; S1462-K1466 VanDerWaalsContact OG-NZ 3.16Å
1463Y76.7Confident71.1Confident40 Ų4054 Ų5416%0.15728%0.281CS..Hα-helixtrans-65.5-51.4177.9-178.1-108.8000112.4L1176 W1178 S1459 I1460 F1461 S1465 K1466 K1467L1176-Y1463 HydrophobicContact CD1-CE1 4.4Å; L1176-Y1463 HydrophobicContact CD2-CE1 4.1Å; W1178-Y1463 HydrophobicContact CB-CD2 4.14Å; W1178-Y1463 HydrophobicContact CB-CE1 4.12Å; W1178-Y1463 HydrophobicContact CB-CE2 3.37Å; W1178-Y1463 WeakPolarHBondContact CB-OH 3.23Å; W1178-Y1463 HydrophobicContact CD2-CD1 4.32Å; W1178-Y1463 HydrophobicContact CD2-CD2 4.27Å; W1178-Y1463 HydrophobicContact CD2-CE1 4.35Å; W1178-Y1463 HydrophobicContact CD2-CE2 4.32Å; W1178-Y1463 HydrophobicContact CD2-CG 4.29Å; W1178-Y1463 HydrophobicContact CE3-CD1 4.16Å; W1178-Y1463 HydrophobicContact CE3-CE1 4.13Å; W1178-Y1463 AromaticContact CG-CD2 3.92Å; W1178-Y1463 HydrophobicContact CG-CD2 3.92Å; W1178-Y1463 HydrophobicContact CG-CE1 4.39Å; W1178-Y1463 AromaticContact CG-CE2 3.67Å; W1178-Y1463 HydrophobicContact CG-CE2 3.67Å; W1178-Y1463 HydrophobicContact CG-CG 4.41Å; W1178-Y1463 AromaticContact CG-CZ 3.94Å; S1459-Y1463 WeakPolarHBondContact O-CB 3.03Å; S1459-Y1463 PolarHBondContact O-N 3.38Å; I1460-Y1463 PolarHBondContact O-N 3.08Å; F1461-Y1463 VanDerWaalsContact C-N 3.33Å; F1461-Y1463 PolarHBondContact O-N 3.38Å; Y1463-S1465 PolarHBondContact O-N 3.34Å; Y1463-K1466 PolarHBondContact O-N 2.83Å; Y1463-K1467 HydrophobicContact CE1-CD 4.33Å; Y1463-K1467 PolarHBondContact O-N 3.38Å; Y1463-K1467 WeakPolarHBondContact OH-CE 3.32Å
1464L78.9Confident68.2Low40 Ų4061.3 Ų61.321%0.20931%0.309CS..Hα-helixtrans-66.7-36.6-180-68.2172.8000112.1F1194 V1197 I1198 I1460 K1467 K1468F1194-L1464 HydrophobicContact CD1-CD1 4.31Å; V1197-L1464 HydrophobicContact CB-CD1 4.14Å; V1197-L1464 HydrophobicContact CG1-CB 4.4Å; V1197-L1464 HydrophobicContact CG1-CD1 3.61Å; I1198-L1464 HydrophobicContact CG1-CD1 4.26Å; I1460-L1464 HydrophobicContact CG2-CD1 3.89Å; I1460-L1464 WeakPolarHBondContact O-CG 3.18Å; I1460-L1464 PolarHBondContact O-N 3.05Å; L1464-K1467 PolarHBondContact O-N 2.74Å; L1464-K1468 PolarHBondContact O-N 2.98Å
1465S79.7Confident65.6Low30 Ų3063.1 Ų63.121%0.2132%0.318CS..Hα-helixtrans-65.7-37.8178.1-62.60000113.1F1461 Y1463 K1468 V1469F1461-S1465 WeakPolarHBondContact O-CB 3.3Å; F1461-S1465 PolarHBondContact O-N 3.21Å; F1461-S1465 PolarHBondContact O-OG 2.78Å; Y1463-S1465 PolarHBondContact O-N 3.34Å; S1465-K1468 WeakPolarHBondContact O-CB 3.16Å; S1465-K1468 PolarHBondContact O-N 3.34Å; S1465-V1469 PolarHBondContact O-N 2.84Å
1466K69.7Low62.8Low128 Ų12862 Ų6256%0.55732%0.317SS*.Hα-helixtrans-60.7-48175.9-76.4163.1-178.1158.80111.4S1462 Y1463 K1468 V1469 D1470S1462-K1466 WeakPolarHBondContact O-CD 3.46Å; S1462-K1466 VanDerWaalsContact O-CG 3.29Å; S1462-K1466 WeakPolarHBondContact O-CG 3.33Å; S1462-K1466 PolarHBondContact O-N 3.34Å; S1462-K1466 PolarHBondContact OG-NZ 3.35Å; S1462-K1466 VanDerWaalsContact OG-NZ 3.16Å; Y1463-K1466 PolarHBondContact O-N 2.83Å; K1466-K1468 VanDerWaalsContact C-N 3.28Å; K1466-K1468 PolarHBondContact O-N 2.79Å; K1466-V1469 WeakPolarHBondContact O-CA 3.42Å; K1466-V1469 WeakPolarHBondContact O-CB 3.21Å; K1466-V1469 PolarHBondContact O-N 2.75Å; K1466-D1470 PolarHBondContact O-N 3.38Å
1467K60.1Low60.1Low44 Ų4463.5 Ų63.519%0.19133%0.329CS..Hα-helixtrans-61.8-31.4177.7-90.3176.2156.5-83.10114N1175 L1176 Y1463 L1464 V1469 D1470 H1471N1175-K1467 WeakPolarHBondContact O-CE 3.32Å; N1175-K1467 PolarHBondContact O-NZ 3.07Å; L1176-K1467 HydrophobicContact CD2-CD 3.39Å; Y1463-K1467 HydrophobicContact CE1-CD 4.33Å; Y1463-K1467 PolarHBondContact O-N 3.38Å; Y1463-K1467 WeakPolarHBondContact OH-CE 3.32Å; L1464-K1467 PolarHBondContact O-N 2.74Å; K1467-V1469 PolarHBondContact O-N 2.74Å; K1467-D1470 PolarHBondContact O-N 3.47Å; K1467-H1471 PolarHBondContact O-CD2 3.05Å; K1467-H1471 VanDerWaalsContact O-CD2 3.3Å; K1467-H1471 PolarHBondContact O-N 2.89Å; K1467-H1471 VanDerWaalsContact O-N 3.07Å
1468K60Low57.4Low107 Ų10767 Ų6747%0.46535%0.35SS..Hα-helixtrans-62.2-32.1172.8-166.8170.2-179.2172.70112.2L1464 S1465 K1466L1464-K1468 PolarHBondContact O-N 2.98Å; S1465-K1468 WeakPolarHBondContact O-CB 3.16Å; S1465-K1468 PolarHBondContact O-N 3.34Å; K1466-K1468 VanDerWaalsContact C-N 3.28Å; K1466-K1468 PolarHBondContact O-N 2.79Å
1469V51.1Low54.7Low71 Ų7168.2 Ų68.243%0.4336%0.363SS..Hα-helixtrans-75.1-47.7172.2-177.30000110.8S1465 K1466 K1467 H1471 S1472 N1473S1465-V1469 PolarHBondContact O-N 2.84Å; K1466-V1469 WeakPolarHBondContact O-CA 3.42Å; K1466-V1469 WeakPolarHBondContact O-CB 3.21Å; K1466-V1469 PolarHBondContact O-N 2.75Å; K1467-V1469 PolarHBondContact O-N 2.74Å; V1469-H1471 PolarHBondContact O-N 3.33Å; V1469-S1472 PolarHBondContact O-N 2.9Å; V1469-S1472 VanDerWaalsContact O-N 3.1Å; V1469-S1472 PolarHBondContact O-OG 3.46Å; V1469-N1473 PolarHBondContact O-N 2.95Å; V1469-N1473 PolarHBondContact O-ND2 2.84Å
1470D34.9Very low52Low95 Ų9570.5 Ų70.551%0.50837%0.374SS..Hα-helixtrans-57.9-44.2-176.2-61.3-37000112.8K1466 K1467 S1472 N1473 Y1474K1466-D1470 PolarHBondContact O-N 3.38Å; K1467-D1470 PolarHBondContact O-N 3.47Å; D1470-S1472 PolarHBondContact O-N 3.02Å; D1470-N1473 PolarHBondContact O-N 3.37Å; D1470-Y1474 PolarHBondContact O-N 3.23Å
1471H36.2Very low49.3Very low100 Ų10075.3 Ų75.346%0.46340%0.404SS..Hα-helixtrans-66.8-33.7177.3-78.4-78.9000113.1K1467 V1469 N1473 Y1474 I1475K1467-H1471 PolarHBondContact O-CD2 3.05Å; K1467-H1471 VanDerWaalsContact O-CD2 3.3Å; K1467-H1471 PolarHBondContact O-N 2.89Å; K1467-H1471 VanDerWaalsContact O-N 3.07Å; V1469-H1471 PolarHBondContact O-N 3.33Å; H1471-N1473 VanDerWaalsContact C-N 3.33Å; H1471-N1473 PolarHBondContact O-N 3.4Å; H1471-Y1474 WeakPolarHBondContact O-CB 3.25Å; H1471-Y1474 PolarHBondContact O-N 2.57Å; H1471-Y1474 VanDerWaalsContact O-N 3.15Å; H1471-I1475 WeakPolarHBondContact O-CG1 3.49Å; H1471-I1475 PolarHBondContact O-N 2.79Å
1472S34.3Very low46.5Very low17 Ų1782.1 Ų82.112%0.11945%0.446CS..Hα-helixtrans-65.3-35.8175.872.20000112.6V1469 D1470 Y1474 S1476V1469-S1472 PolarHBondContact O-N 2.9Å; V1469-S1472 VanDerWaalsContact O-N 3.1Å; V1469-S1472 PolarHBondContact O-OG 3.46Å; D1470-S1472 PolarHBondContact O-N 3.02Å; S1472-Y1474 VanDerWaalsContact C-N 3.31Å; S1472-Y1474 PolarHBondContact O-N 2.66Å; S1472-S1476 WeakPolarHBondContact O-CB 3.47Å; S1472-S1476 PolarHBondContact O-N 3.22Å; S1472-S1476 VanDerWaalsContact O-N 3.09Å; S1472-S1476 PolarHBondContact O-OG 3.1Å
1473N30.4Very low43.8Very low65 Ų6586 Ų8635%0.34847%0.468SS..Hα-helixtrans-68.8-30.9173.8-63.8-35.5000111.9V1469 D1470 H1471 T1477V1469-N1473 PolarHBondContact O-N 2.95Å; V1469-N1473 PolarHBondContact O-ND2 2.84Å; D1470-N1473 PolarHBondContact O-N 3.37Å; H1471-N1473 VanDerWaalsContact C-N 3.33Å; H1471-N1473 PolarHBondContact O-N 3.4Å; N1473-T1477 WeakPolarHBondContact O-CG2 3.27Å; N1473-T1477 PolarHBondContact O-N 2.92Å; N1473-T1477 PolarHBondContact O-OG1 3.42Å
1474Y29.2Very low41.5Very low159 Ų15989.9 Ų89.962%0.62450%0.496SS*.Hα-helixtrans-73.8-38.9177.8-154.7-97000112.6D1470 H1471 S1472 T1477 T1478D1470-Y1474 PolarHBondContact O-N 3.23Å; H1471-Y1474 WeakPolarHBondContact O-CB 3.25Å; H1471-Y1474 PolarHBondContact O-N 2.57Å; H1471-Y1474 VanDerWaalsContact O-N 3.15Å; S1472-Y1474 VanDerWaalsContact C-N 3.31Å; S1472-Y1474 PolarHBondContact O-N 2.66Å; Y1474-T1477 WeakPolarHBondContact CA-OG1 3.32Å; Y1474-T1477 PolarHBondContact O-N 2.78Å; Y1474-T1477 PolarHBondContact O-OG1 3.1Å; Y1474-T1478 HydrophobicContact CD1-CG2 4.11Å; Y1474-T1478 HydrophobicContact CE1-CG2 3.89Å; Y1474-T1478 PolarHBondContact O-N 3.49Å; Y1474-T1478 VanDerWaalsContact O-N 3.12Å; Y1474-T1478 PolarHBondContact O-OG1 3.38Å
1475I33.7Very low39.2Very low78 Ų7896.4 Ų96.440%0.453%0.528SS..Hα-helixtrans-66.3-41.8173.6-65.3166.6000110.4E1034 H1471 T1477 T1478 T1479E1034-I1475 WeakPolarHBondContact OE1-CG2 3.32Å; H1471-I1475 WeakPolarHBondContact O-CG1 3.49Å; H1471-I1475 PolarHBondContact O-N 2.79Å; I1475-T1477 PolarHBondContact O-N 2.7Å; I1475-T1477 VanDerWaalsContact O-N 3.11Å; I1475-T1478 PolarHBondContact O-N 3.18Å; I1475-T1478 PolarHBondContact O-OG1 2.71Å; I1475-T1479 PolarHBondContact O-N 3.43Å; I1475-T1479 PolarHBondContact O-OG1 3.04Å
1476S29.5Very low36.8Very low61 Ų6199.7 Ų99.743%0.42755%0.551SS.*Hα-helixtrans-65-10.9174.8-59.10000114.6S1472S1472-S1476 WeakPolarHBondContact O-CB 3.47Å; S1472-S1476 PolarHBondContact O-N 3.22Å; S1472-S1476 VanDerWaalsContact O-N 3.09Å; S1472-S1476 PolarHBondContact O-OG 3.1Å
1477T31.7Very low34.8Very low94 Ų9498.1 Ų98.158%0.57756%0.556SS**Hα-helixtrans-116.2-7.2180460000114.5N1473 Y1474 I1475N1473-T1477 WeakPolarHBondContact O-CG2 3.27Å; N1473-T1477 PolarHBondContact O-N 2.92Å; N1473-T1477 PolarHBondContact O-OG1 3.42Å; Y1474-T1477 WeakPolarHBondContact CA-OG1 3.32Å; Y1474-T1477 PolarHBondContact O-N 2.78Å; Y1474-T1477 PolarHBondContact O-OG1 3.1Å; I1475-T1477 PolarHBondContact O-N 2.7Å; I1475-T1477 VanDerWaalsContact O-N 3.11Å
1478T33.8Very low33.2Very low74 Ų74102.4 Ų102.445%0.45459%0.586SS.*Hα-helixtrans-102.3-15.1176.543.40000113.6Y1474 I1475 T1480Y1474-T1478 HydrophobicContact CD1-CG2 4.11Å; Y1474-T1478 HydrophobicContact CE1-CG2 3.89Å; Y1474-T1478 PolarHBondContact O-N 3.49Å; Y1474-T1478 VanDerWaalsContact O-N 3.12Å; Y1474-T1478 PolarHBondContact O-OG1 3.38Å; I1475-T1478 PolarHBondContact O-N 3.18Å; I1475-T1478 PolarHBondContact O-OG1 2.71Å; T1478-T1480 VanDerWaalsContact C-N 3.3Å; T1478-T1480 PolarHBondContact O-N 2.6Å
1479T30.6Very low31.8Very low105 Ų105103.1 Ų103.164%0.64460%0.6SS**THydrogen-bonded Turntrans-77.7-2.1-179.437.30000115.2I1475I1475-T1479 PolarHBondContact O-N 3.43Å; I1475-T1479 PolarHBondContact O-OG1 3.04Å
1480T31Very low30.6Very low113 Ų113106.2 Ų106.269%0.69362%0.619SS**THydrogen-bonded Turntrans-101.8-0.5-174.346.80000115.5T1478T1478-T1480 VanDerWaalsContact C-N 3.3Å; T1478-T1480 PolarHBondContact O-N 2.6Å
1481T29Very low30.2Very low106 Ų106107.3 Ų107.365%0.6563%0.634SS**  trans-144.386.9-177.955.60000114.9
1482T29.4Very low29.7Very low150 Ų150109.5 Ų109.592%0.9266%0.655SS**  trans-171.5115136.620.40000111
1483T28.9Very low29.3Very low129 Ų129113.9 Ų113.979%0.79169%0.685SS**  trans-114144.6168.5-23.90000109.1
1484T29Very low29Very low121 Ų121118.7 Ų118.774%0.74271%0.711SS**  trans51.6103.3167.254.80000118.4
1485M31.8Very low28.9Very low178 Ų178116.1 Ų116.188%0.87772%0.716SS**  -159.8154.9126.3-100.7-53105.900109.5
1486S27.5Very low28.5Very low98 Ų98119.9 Ų119.969%0.68574%0.735SS**  trans-135.2156.1-16356.90000115.1
1487S28.3Very low28.4Very low96 Ų96125.1 Ų125.167%0.67175%0.753SS**  trans64.5120.2155.953.50000120.6
1488T27.5Very low28.2Very low133 Ų133126.3 Ų126.382%0.81676%0.755SS**  trans64.9135.7146.360.60000118.2
1489T29.1Very low27.8Very low123 Ų123127.4 Ų127.476%0.75576%0.755SS**  cis-146.7159.637.143.20000115.5
1490T26.7Very low27.5Very low136 Ų136128.4 Ų128.483%0.83475%0.75SS**  trans-20.2126.9164.152.20000119.8
1491S27Very low27.4Very low118 Ų118129.5 Ų129.583%0.82576%0.763SS**  trans-159.9158.3136.752.80000110.8
1492T25Very low27.4Very low146 Ų146130.7 Ų130.790%0.89677%0.769SS**  trans-91.5122.7-173.248.60000112.8
1493S25.6Very low27.3Very low108 Ų108129.7 Ų129.776%0.75576%0.761SS**  trans-152.1148.216555.20000111.7
1494N24.8Very low27.2Very low167 Ų167129.7 Ų129.789%0.89376%0.759SS**  trans-69.1130.9171.3-60.7-44.5000109
1495S26.1Very low27.1Very low104 Ų104130.2 Ų130.273%0.72776%0.76SS**  trans-129.9114169.9-163.30000110.5H1497S1495-H1497 PolarHBondContact O-N 2.86Å
1496I25.8Very low26.8Very low157 Ų157127.3 Ų127.381%0.80575%0.753SS**  trans-78.9107179.3-63.3162.5000107.2L1498I1496-L1498 PolarHBondContact O-N 3.04Å; I1496-L1498 VanDerWaalsContact O-N 3.08Å
1497H27.8Very low26.7Very low172 Ų172129.2 Ų129.280%0.79676%0.757SS**  trans-87.281.4179.4-140-69.1000111.6S1495S1495-H1497 PolarHBondContact O-N 2.86Å
1498L28.4Very low26.6Very low118 Ų118131.6 Ų131.662%0.61876%0.763SS**  trans16.9112.1149.9-63.9161.3000116.2I1496I1496-L1498 PolarHBondContact O-N 3.04Å; I1496-L1498 VanDerWaalsContact O-N 3.08Å
1499E25.3Very low26.5Very low97 Ų97131.5 Ų131.545%0.45376%0.759SS.*  71.1124.978.3-75.5-102.3102.200113.8
1500F24.4Very low26.3Very low126 Ų126132.2 Ų132.255%0.55376%0.759SS**  trans54.6106.2175.4-76.3-83.8000120.6S1172 M1173S1172-F1500 WeakPolarHBondContact O-CE2 3.09Å; S1172-F1500 WeakPolarHBondContact O-CZ 3.23Å; M1173-F1500 HydrophobicContact CG-CE2 4.39Å; M1173-F1500 HydrophobicContact CG-CZ 4.06Å
1501S29Very low26.3Very low137 Ų137131.8 Ų131.896%0.95875%0.753SS**  trans-145.10141.1-75.70000110.4K1202K1202-S1501 WeakPolarHBondContact CE-O 3.49Å; K1202-S1501 PolarHBondContact NZ-O 2.95Å

Retrieved 1,501 of 1,501 residues in 1662.6 ms (Link to these results)