A0A5K4F1P1_SCHMA Loading...

SAM domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F1P1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,639 aa.

>A0A5K4F1P1_SCHMA|A0A5K4F1P1
MDEMNSCVFTRSVDRSEDDSPPVCLVELINSKTKVTDTHESTELSGGKSNISLQENSGNGCKVGGICPIKSGSSSISFHDLKSKSPLPVVTSADDKSDGLSNTVSSEDPLPRSIDLDNTHLPTMKEPSSLTSNHHANRDDNESLTGENYLQSKAKISTCDLEAEDEDDVDLEDRPLTVDTQESDEALLNESSKKTIPSTNNSVCTISNSVAEDKQDPTSSVTTASKTSFVVINNTPSAVVCLSSSLSSCQSTLSLQNCQSTSVPNKNCSSDGHHTSAPVALATVAPIRMSSVGPDYSLSNEILRPIKPASQDTQTNTVMSNHATPQTVTSIFPSKHEAVSTTSTVSYNPKSSQSSTNERFGFPAISITKPASIGTTSVTISIAPTISSSVITTHSMPSIFNVRTRPTVAQSVLPVLSVGPQPAPPLNTQTSLSSLQSQSTVQFMPLVGNMPVTMPVPATSTGLRNVINHNQAIPIAGAPTAPCPPLQIFNMTPMPQFMGTPSYVLHPTGPVAGANSFQFPQGSTHLLPGLSGSAGVGGTTFNFLQPQNYPSTIFPQPPTIPDLLIDPQNPMGLGHSVLTPPASIALISAINNPSSSSFTSIYPTLLHQPNQNFFPTSSTHSGPVSYPYSTALAAGTHLVNATAPQMATSLVPAAVTNLPNMHNSNETSFMFQSGPPHGTSFISSNFAPNPGQLFPPCQFPTFPNLFQTNDNCLTNTFISSSLPTDLTSTCDTKSSLNMNGSNLGGNGGTCLSTYWPYVSSNDLINPTSIVQATNSTHQTDFLQSVNNNNNNLNDRSKMNDVNTDNSGILNVENINDGTTTTTTITINPLTHAPINSSINSTLTTINTATTTNITSALDNGSHNKNNIPLNSSTVVLPAIRRRRRLFAQNGIKPITNVIQSPFLNHTNSMNDESNNSTVMNSTGDDTNNPTVSDSLLCANVNNSNDNDDNNNDNSVDNDANGINNSNRDSLTTCDNELKQSDTIQSPDKLTPSTKSSASTIPTFRSNTLPQSVEDVQLCNQISTDIEFTSKLSKEIQQKDSVEYDDITKLPSSSSSSSCSTFISSSVMVTTIVTTQLIPTMSTITMTSNTTITPSQMITTSFATSPDATKIHDLNHNADSSVSSTSLPFSPSNADNSSKTVYKNSDLLQNESKMVSVGKSDDKEAAKNIVNNQMKSPVSSTLLVNNDSNNTSDQKDSINENYSKLLSTVCVSSSGSNNSIDASSTTYSKLKSTITPFEFPPPPVLIGPDDRRILTHYIDGHIIYESDKPFPVKNGMIVVETALMKQQSCLVSSTNSPLKTFLINGYEDGVMSTVKSPTAPSFSSLKTTAVKPVDNHESEALIATPSRLPIQDVGGCGSGWINPLKASNSSSLSIVDKHTNHPGSIATSNSPAMLLHYETRRRKPSNEQQLYNDIHDENDSSPSTSNHYHQPTQGILASYPHSTILSLANRNSASVVYTQSPIVSIPSRNDRQSSSDMKGGNELTVMDGKSIESYSHHSQYQHTESSTSLSKPLNEIQSSSGIMMGLTSTAFNQSTCQQRLPSIAQAMYGISQTITPSFGLLTPNPPPKGPIYKWTPDDVVAFVRGTPGCGAYASAFLNNEIDGEALLLLAEDQFIQPPIGMKIGPALKLVARLESLKNCC
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(Predicted Aligned Error values between residue pairs)
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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
1M31.2Very low31.2Very low171 Ų171146.4 Ų146.484%0.84275%0.753SS**  089.70-93.4-147.8-160.200110.3S916M1-S916 WeakPolarHBondContact CE-OG 3.08Å
2D35.1Very low31.1Very low157 Ų157144.1 Ų144.184%0.8476%0.76SS**  57.4111.5120.5-84.5-24.8000111
3E34.5Very low31Very low176 Ų176142.3 Ų142.382%0.82276%0.758SS**  146.2106.4106.3-124.7178.4176.200109.6
4M35.1Very low30.9Very low154 Ų154140.2 Ų140.276%0.75975%0.747SS**  92.6106.585.8-105.6164.4-169.500110
5N36Very low30.8Very low150 Ų150145.3 Ų145.380%0.80275%0.751SS**  147.9084.9-91.4-12.9000109.8
6S32Very low30.8Very low112 Ų112142.3 Ų142.378%0.78375%0.746SS**  01260176.60000109.3
7C26.9Very low31Very low93 Ų93143.5 Ų143.563%0.62875%0.747SS**  147.3131.9115.8-90.60000109.1M909C7-M909 HydrophobicContact CB-CE 4.46Å; C7-M909 WeakPolarHBondContact O-CE 3.27Å
8V29.2Very low31Very low83 Ų83142.8 Ų142.850%0.50375%0.745SS.*  90.1127.1104.6178.70000108.9M909V8-M909 HydrophobicContact CB-CE 3.27Å; V8-M909 HydrophobicContact CG1-CE 4.14Å; V8-M909 HydrophobicContact CG2-CE 4.5Å; V8-M909 CovalentContact O-CE 1.62Å; V8-M909 WeakPolarHBondContact O-CE 2.55Å
9F27.8Very low31.3Very low171 Ų171143.4 Ų143.475%0.7575%0.749SS**  115.4128.5101.5-109.7-85.9000109.5
10T28.4Very low31.2Very low110 Ų110141.9 Ų141.968%0.67575%0.751SS**  128.6124.5103.850.30000109.1
11R27.3Very low32Very low233 Ų233140.5 Ų140.588%0.87975%0.75SS**  74.5122.599.7-141.7175-172.2-174-0.3110.3
12S29.9Very low32.1Very low119 Ų119138.1 Ų138.183%0.83275%0.747SS**  176.6111.8128.8-690000109.1
13V29.5Very low31.8Very low121 Ų121136.5 Ų136.573%0.73374%0.743SS**  11.2117.7109.4-178.30000110.2
14D29Very low31.3Very low113 Ų113133 Ų13360%0.60474%0.737SS**  169.3116.7116.5-106.9-16.6000109.3
15R29.4Very low31Very low217 Ų217133.2 Ų133.282%0.81974%0.74SS**  112.8117.690.6-104.9-175.5175.8151.90.4109.6
16S31.3Very low30.7Very low96 Ų96130 Ų13067%0.67173%0.726SS**  153.7111.1104.170.30000109.6
17E33.7Very low30.4Very low163 Ų163132.2 Ų132.276%0.76272%0.724SS**  118.9113.393.3-91.4-178.9158.800109.9
18D32.2Very low30.4Very low132 Ų132133.8 Ų133.871%0.70673%0.726SS**  109102.9103.6-104.9-19.2000109.8
19D35.6Very low30.5Very low153 Ų153136.5 Ų136.582%0.81874%0.736SS**  167.497.1114.7-111-24.8000109.3
20S30.2Very low30.6Very low114 Ų114135.2 Ų135.280%0.79774%0.737SS**  36.8138112.8-82.20000111.6
21P47.4Very low30.7Very low112 Ų112134.8 Ų134.873%0.72774%0.738SS**  trans-96176.9-179.334.5-5.5000112
22P34.4Very low31Very low121 Ų121133 Ų13379%0.78674%0.737SS**  -163.4142.2110.234.1-5.5000111.9
23V27.2Very low31.2Very low123 Ų123132.8 Ų132.875%0.74573%0.731SS**  36.3118.9106.6-179.20000109.8
24C25.3Very low31.4Very low104 Ų104133 Ų13370%0.70372%0.722SS**  131128.596.5-80.50000109.2
25L27.9Very low31.7Very low157 Ų157130.1 Ų130.182%0.82271%0.708SS**  148.4124.9110.4-122.4139.9000109.2
26V29.5Very low31.9Very low84 Ų84122.8 Ų122.851%0.50969%0.688SS.*  111.9119.4101.8174.70000108.4
27E25.9Very low32Very low157 Ų157126.3 Ų126.373%0.73470%0.699SS**  93.2114.9109-117.9-177.4174.200110.1
28L26.6Very low32.1Very low127 Ų127124.8 Ų124.867%0.66570%0.701SS**  98.8109.5116-108.6130.5000109.6
29I32.4Very low32.3Very low140 Ų140127.9 Ų127.972%0.71871%0.711SS**  139.9107.2121-55.9174.1000108.1
30N29.9Very low32.2Very low143 Ų143128.6 Ų128.677%0.76571%0.709SS**  62.9115.4115.8-101.3-4.1000110.9
31S29.7Very low32.5Very low101 Ų101128.6 Ų128.671%0.70671%0.709SS**  67113.4120.522.70000110.5
32K33.3Very low32.1Very low195 Ų195128.1 Ų128.185%0.84870%0.704SS**  80.2120.2109.2-119.5173.8-179.8174.80110.2
33T34.6Very low32.2Very low116 Ų116129.8 Ų129.871%0.71270%0.702SS**  114.8124.6105.726.60000109.4
34K33.3Very low32.7Very low126 Ų126130.9 Ų130.955%0.54870%0.703SS.*  33.8124110.6-145174.5-179.7-176.40111.7
35V35.5Very low33.2Very low51 Ų51132 Ų13231%0.30971%0.712SS.*  139.1135.990.4172.70000108.6S1517 S1518V35-S1517 WeakPolarHBondContact CA-OG 2.64Å; V35-S1517 WeakPolarHBondContact CB-OG 3.26Å; V35-S1517 VanDerWaalsContact CG1-CA 3.4Å; V35-S1517 WeakPolarHBondContact CG1-OG 2.7Å; V35-S1517 WeakPolarHBondContact CG2-OG 3.27Å; V35-S1518 WeakPolarHBondContact CG1-OG 3.4Å
36T34.5Very low33.3Very low64 Ų64128.4 Ų128.439%0.39371%0.712SS.*  12314067.940.70000109.7S1517 S1518T36-S1517 WeakPolarHBondContact CA-OG 3.37Å; T36-S1517 WeakPolarHBondContact CB-OG 3.01Å; T36-S1517 CovalentContact CG2-OG 0.97Å; T36-S1517 WeakPolarHBondContact CG2-OG 3.42Å; T36-S1517 PolarHBondContact OG1-OG 3.47Å; T36-S1518 WeakPolarHBondContact OG1-CB 3.39Å; T36-S1518 PolarHBondContact OG1-OG 3.06Å
37D32.3Very low33.6Very low169 Ų169128 Ų12890%0.90473%0.725SS**  trans-139.5129.4139-86.7-21.3000109.6
38T36.4Very low34.1Very low132 Ų132130.1 Ų130.181%0.8173%0.732SS**  trans-83.8147.5156.628.80000109.8
39H36.5Very low34.4Very low197 Ų197128.3 Ų128.391%0.91273%0.729SS**  trans-133.7131.9143.3-98.4-84.3000109.7
40E34.4Very low34.5Very low167 Ų167128.5 Ų128.578%0.7873%0.732SS**  -20.10122.5-140.3-175.4160.600112.1
41S34.9Very low34.7Very low114 Ų114129.7 Ų129.780%0.79774%0.737SS**  000-56.30000109.6
42T39.2Very low34.6Very low102 Ų102129.4 Ų129.463%0.62674%0.735SS**  000-39.10000109.6
43E36.7Very low34.5Very low157 Ų157127.3 Ų127.373%0.73473%0.732SS**  000-94.8-157.6164.400110
44L38.5Very low34.2Very low146 Ų146130.1 Ų130.176%0.76474%0.737SS**  000-80.9165.4000109.4
45S34.7Very low34.2Very low128 Ų128132.8 Ų132.890%0.89575%0.751SS**  000168.90000109.2
46G30.1Very low34.1Very low80 Ų80137.7 Ų137.783%0.82578%0.776SS**  00000000110.7
47G35.5Very low34.1Very low75 Ų75140.5 Ų140.577%0.77380%0.798SS**  00000000111
48K38.3Very low34Very low203 Ų203135.8 Ų135.888%0.88379%0.79SS**  01340-82.3179.9177.7175.90110.2
49S32.7Very low33.8Very low88 Ų88138 Ų13862%0.61580%0.796SS**  77.5083.344.60000110.4
50N33.1Very low33.6Very low144 Ų144131.9 Ų131.977%0.7779%0.786SS**  000-93.4-22.3000109.9
51I35.1Very low33.4Very low169 Ų169129.9 Ų129.987%0.86779%0.79SS**  0129.30-81.3164.2000108
52S27.2Very low33.3Very low95 Ų95133.7 Ų133.766%0.66479%0.792SS**  80111.8-170.70000111.8
53L31.9Very low33Very low150 Ų150134.7 Ų134.779%0.78580%0.798SS**  0132.40-78.6170.7000109.3
54Q28.1Very low32.7Very low176 Ų176130.9 Ų130.982%0.82280%0.8SS**  74084.1-154.914323.800110.5
55E32Very low32.4Very low181 Ų181127.2 Ų127.285%0.84680%0.798SS**  0122.70-92.1-173.517200109.3
56N33.3Very low32.2Very low155 Ų155128.9 Ų128.983%0.82980%0.796SS**  82.60105.3-101.7-1.8000111
57S34.3Very low32.2Very low123 Ų123130.9 Ų130.986%0.8680%0.796SS**  000560000109.8
58G31.4Very low32.5Very low70 Ų70132.4 Ų132.472%0.72279%0.791SS**  00000000110.8
59N33Very low32Very low177 Ų177130 Ų13095%0.94779%0.787SS**  000-93.723000110.4
60G31.9Very low31.8Very low69 Ų69135.8 Ų135.871%0.71180%0.801SS**  00000000110.8
61C28.8Very low31.7Very low126 Ų126134.4 Ų134.485%0.85180%0.803SS**  000-89.60000110.3
62K33Very low31.5Very low193 Ų193129.8 Ų129.884%0.83980%0.796SS**  000-122.8174.8-179.3177.40110.1
63V32.4Very low31.8Very low123 Ų123130.9 Ų130.975%0.74580%0.804SS**  000178.90000108.4
64G31.5Very low31.8Very low77 Ų77128.8 Ų128.879%0.79480%0.802SS**  0123.3000000110.9
65G32.1Very low32Very low70 Ų70125.3 Ų125.372%0.72280%0.797SS**  108.6093.500000111.1
66I31.5Very low32Very low163 Ų163124.3 Ų124.384%0.83680%0.796SS**  0118.70-60.5175.6000108.5
67C30.1Very low31.7Very low122 Ų122121.2 Ų121.282%0.82479%0.787SS**  80.9098.9-88.50000110.1
68P40.4Very low31.6Very low106 Ų106123.7 Ų123.769%0.68878%0.782SS**  00034-4.9000112
69I28.1Very low31.5Very low154 Ų154127.3 Ų127.379%0.7978%0.78SS**  0132.60-38.7175.4000108.1
70K29.3Very low31.5Very low208 Ų208124.6 Ų124.690%0.90477%0.766SS**  -171.1127.7122.6-108.1179.4-176.2179.10109.3
71S31.3Very low31.4Very low116 Ų116128.5 Ų128.581%0.81177%0.769SS**  trans-59.60136.850.20000111.8
72G30.2Very low31.5Very low71 Ų71132 Ų13273%0.73277%0.77SS**  0130.2000000110.5
73S33.4Very low31.5Very low118 Ų118127.6 Ų127.683%0.82576%0.764SS**  96.7134.1100.1-35.60000110
74S31.2Very low31.6Very low107 Ų107131.5 Ų131.575%0.74877%0.771SS**  93128.4100.438.40000110.1
75S33.1Very low31.6Very low102 Ų102133.1 Ų133.171%0.71377%0.769SS**  87.9124.7102.349.10000110.3
76I32Very low32.1Very low160 Ų160135.2 Ų135.282%0.82177%0.771SS**  101.2117.4102.7-82.6157.9000108.6
77S27.8Very low32.1Very low91 Ų91135.5 Ų135.564%0.63677%0.773SS**  90091.189.70000110.3
78F30.5Very low32.5Very low175 Ų175133.4 Ų133.477%0.76876%0.758SS**  0132.60-99.6-82.6000109.3
79H30.9Very low32.1Very low146 Ų146134.2 Ų134.268%0.67676%0.76SS**  144.6128.998.1-103.4-79.6000109.5
80D31Very low32.3Very low120 Ų120131.9 Ų131.964%0.64275%0.753SS**  111084.5-120.5-11.1000109.9
81L30.6Very low32.4Very low151 Ų151127.3 Ų127.379%0.79174%0.743SS**  0122.70-74.6168.4000109.2
82K31.7Very low32.5Very low200 Ų200126.9 Ų126.987%0.8774%0.74SS**  -175.3116.5110-144.4142.5178.2-1750109.5
83S33Very low32.7Very low100 Ų100127.2 Ų127.270%0.69974%0.735SS**  100.6083.265.10000110.1
84K33.8Very low32.7Very low205 Ų205128.5 Ų128.589%0.89173%0.733SS**  0115.40-128.5164.8-174.5-1760109.7
85S31.2Very low33.1Very low110 Ų110130.1 Ų130.177%0.76973%0.733SS**  -5.10128.680.60000111.9
86P42.2Very low33.4Very low115 Ų115134.1 Ų134.175%0.74774%0.738SS**  0145.8033.8-4.9000111.8
87L31.8Very low33.5Very low169 Ų169130.4 Ų130.489%0.88573%0.726SS**  trans30.80147-72.4173.9000111.2
88P38.3Very low33.8Very low78 Ų78132.5 Ų132.551%0.50673%0.73SS.*  00034-5.1000112.1
89V32.3Very low34.1Very low123 Ų123128 Ų12875%0.74573%0.733SS**  0134.90176.50000108.9
90V32Very low34.1Very low104 Ų104127.1 Ų127.163%0.6373%0.733SS**  121.9136.388.4177.90000108.5
91T33.2Very low34.4Very low113 Ų113126.3 Ų126.369%0.69374%0.736SS**  143.7131.393.351.20000109
92S32.5Very low34.6Very low107 Ų107125.9 Ų125.975%0.74874%0.735SS**  122.6124.797.255.50000109.7
93A33.4Very low34.5Very low77 Ų77122.5 Ų122.564%0.63673%0.731SS**  103.7120.895.200000109.8
94D34.6Very low34.4Very low146 Ų146121.9 Ų121.978%0.78172%0.723SS**  139.6109.9105.2-78.9-28.3000109.4
95D39Very low34.1Very low140 Ų140116.3 Ų116.375%0.74971%0.71SS**  -173100.4115.2-94.5-19000109.4
96K39.8Very low34.1Very low186 Ų186115.9 Ų115.981%0.80971%0.707SS**  89.593.992.6-95.8-173-179.4159.70110.4
97S33.8Very low33.6Very low82 Ų82118.3 Ų118.357%0.57371%0.708SS**  48.5117.688.663.60000111.2
98D33.5Very low33.6Very low135 Ų135117.6 Ų117.672%0.72271%0.705SS**  102.1110.581.8-79.4-26.2000109.8L100D98-L100 HydrophobicContact CB-CD1 4.27Å; D98-L100 HydrophobicContact CB-CG 4.33Å
99G37.9Very low33.4Very low80 Ų80118.5 Ų118.583%0.82571%0.711SS**  trans-164.192.113100000110.1
100L31.4Very low34Very low129 Ų129120.5 Ų120.568%0.67572%0.717SS**  53.9121.887.1-70.3174.4000110.8D98D98-L100 HydrophobicContact CB-CD1 4.27Å; D98-L100 HydrophobicContact CB-CG 4.33Å
101S37.5Very low34.3Very low102 Ų102121 Ų12171%0.71372%0.722SS**  143.70105.846.30000109.8
102N34.4Very low34.1Very low143 Ų143126.9 Ų126.977%0.76573%0.732SS**  000-82.3-7.6000110.2
103T29.8Very low34Very low129 Ų129126 Ų12679%0.79173%0.726SS**  00034.30000109.1
104V29.4Very low34Very low87 Ų87129 Ų12953%0.52773%0.73SS.*  000174.80000108.3S106 E107V104-S106 WeakPolarHBondContact CG1-O 2.88Å; V104-E107 HydrophobicContact CG1-CB 3.85Å; V104-E107 WeakPolarHBondContact CG1-O 2.77Å
105S28.7Very low33.9Very low87 Ų87127.8 Ų127.861%0.60872%0.723SS**  0101.80-75.10000111.1E107S105-E107 PolarHBondContact O-N 3.3Å; S105-E107 VanDerWaalsContact O-O 3.1Å
106S30.2Very low34Very low102 Ų102126.8 Ų126.871%0.71372%0.717SS**SBend30.288.7125.753.90000111.1V104V104-S106 WeakPolarHBondContact CG1-O 2.88Å
107E31.7Very low34.1Very low165 Ų165124.4 Ų124.477%0.77171%0.713SS**SBendtrans107.20157.1-76.4-141.2154.300110.1V104 S105V104-E107 HydrophobicContact CG1-CB 3.85Å; V104-E107 WeakPolarHBondContact CG1-O 2.77Å; S105-E107 PolarHBondContact O-N 3.3Å; S105-E107 VanDerWaalsContact O-O 3.1Å
108D31.6Very low34.1Very low155 Ų155126.3 Ų126.383%0.82972%0.717SS**  000-90.8-20.5000111.6
109P35.7Very low34.3Very low97 Ų97124.4 Ų124.463%0.6371%0.71SS**  00033.5-4000112
110L44.3Very low34.3Very low164 Ų164126.7 Ų126.786%0.85970%0.699SS**  01560-78.2163.9000111.1
111P38.3Very low34.3Very low115 Ų115126.5 Ų126.575%0.74770%0.698SS**  -176.412599.233.9-5.4000111.8
112R28.8Very low34.4Very low236 Ų236124.5 Ų124.589%0.89168%0.683SS**  121.6106.3120.4-113.7-167.9-136.4-176.61.3109.6
113S29.6Very low34.3Very low90 Ų90122.4 Ų122.463%0.62968%0.675SS**  138.996.590.7-770000109.6
114I33.6Very low34.1Very low140 Ų140123.1 Ų123.172%0.71867%0.671SS**  167.897.5105.2-62.7167.3000107.9
115D33.8Very low34.1Very low119 Ų119127.5 Ų127.564%0.63668%0.683SS**  115.7101.8109-110-15.5000109.9
116L40.6Very low34.4Very low119 Ų119131.6 Ų131.662%0.62369%0.693SS**  86.794.4105.3-81.7149000110.3
117D41.6Very low34.7Very low137 Ų137131.5 Ų131.573%0.73369%0.69SS**  1740101.4-89.4-21.7000109.3
118N33.2Very low34.5Very low121 Ų121129 Ų12965%0.64769%0.691SS**  0107.60-90.33.6000111.8
119T38.1Very low34.5Very low95 Ų95126.8 Ų126.858%0.58369%0.687SS**  112.5106.4103.424.60000109.5
120H38.9Very low34.4Very low128 Ų128129.1 Ų129.159%0.59369%0.694SS**  112.3100.196.3-123.6-79.9000110P122H120-P122 WeakPolarHBondContact ND1-CG 2.79Å
121L30.2Very low33.8Very low125 Ų125127.1 Ų127.165%0.65469%0.688SS**  62.6140.294.9-112.1108.8000110.6T123L121-T123 HydrophobicContact CD2-CG2 4.12Å
122P40.5Very low33.4Very low60 Ų60125.4 Ų125.439%0.3968%0.679SS.*  cis139.3145.922.934.7-6.1000112.2H120H120-P122 WeakPolarHBondContact ND1-CG 2.79Å
123T31.3Very low33.5Very low99 Ų99120.3 Ų120.361%0.60767%0.67SS**  139109.1124.932.90000109.2L121L121-T123 HydrophobicContact CD2-CG2 4.12Å
124M26.7Very low33.9Very low144 Ų144124.7 Ų124.771%0.70968%0.68SS**  90.3107.392.5-83.4-144.5130.800110.1
125K29.6Very low33.7Very low179 Ų179125.8 Ų125.878%0.77868%0.681SS**  126.395.2105-125.5175-177.7177.80109.7
126E33.6Very low33.9Very low174 Ų174124.9 Ų124.981%0.81369%0.691SS**  42.6151.5114.5-104.7-155.2168.900111.3
127P37Very low33.6Very low100 Ų100124.4 Ų124.465%0.64969%0.689SS**  165.6131.864.533.8-4.8000111.9
128S27.9Very low32.9Very low113 Ų113127.2 Ų127.279%0.7969%0.689SS**  trans152.7104.1141.5460000109.4
129S31.8Very low33Very low108 Ų108127 Ų12776%0.75569%0.688SS**  162.8107.7110.9580000109.6
130L32.4Very low32.6Very low146 Ų146128.8 Ų128.876%0.76469%0.694SS**  85.6113.679.7-93.9151.2000110.3
131T32.6Very low32.4Very low121 Ų121129.4 Ų129.474%0.74270%0.702SS**  94.8110125.548.90000109.7
132S30.1Very low32.6Very low80 Ų80132.2 Ų132.256%0.55971%0.712SS**  115.7110.759.8166.90000110.1
133N31.2Very low32.3Very low129 Ų129134.5 Ų134.569%0.6973%0.729SS**  154.493.6113.5-84.4-20000109.7
134H37.1Very low32.3Very low181 Ų181137.5 Ų137.584%0.83874%0.74SS**  trans142.698169.2-98.6-55.7000109.5
135H30.7Very low32.5Very low163 Ų163137.2 Ų137.276%0.75575%0.747SS**  68.1102.6107-112.2-46.1000110.5
136A37.8Very low32.7Very low101 Ų101132.3 Ų132.384%0.83575%0.747SS**  -40124.300000111.5
137N32.8Very low32.7Very low108 Ų108133 Ų13358%0.57875%0.75SS**  0114.50-117.9-14.2000109.7
138R27.2Very low32.7Very low196 Ų196136.4 Ų136.474%0.7476%0.763SS**  81.4105.894-110-179.9165151.2-2.5110.4
139D35.5Very low33Very low116 Ų116141.5 Ų141.562%0.6277%0.766SS**  132.2101.9121.6-82.6-28000109.4
140D29.9Very low33.1Very low134 Ų134142.6 Ų142.672%0.71776%0.763SS**  64.411095.1-68.2-34.3000110.7
141N35.3Very low33.3Very low141 Ų141143.2 Ų143.275%0.75476%0.762SS**  167.1105.1110.4-88.9-10000109.7
142E33.6Very low33.3Very low184 Ų184142.3 Ų142.386%0.8676%0.761SS**  106.7097.6-110.8-17616700110.1
143S33.6Very low33.5Very low108 Ų108148.3 Ų148.376%0.75578%0.777SS**  000122.80000109.5
144L32.2Very low33.6Very low161 Ų161146.4 Ų146.484%0.84378%0.779SS**  0120.40-89.1152.6000109.5
145T31.8Very low33.5Very low138 Ų138147 Ų14785%0.84778%0.779SS**  trans-37.40135.3410000111.5
146G32.5Very low33.8Very low76 Ų76146.1 Ų146.178%0.78478%0.779SS**  00000000111.1
147E34.8Very low33.5Very low188 Ų188146.3 Ų146.388%0.87977%0.774SS**  000-69.9-151.9164.100109.5
148N35.8Very low33.6Very low172 Ų172146.8 Ų146.892%0.9278%0.781SS**  000-81.4-24.5000109.8
149Y34.6Very low33.9Very low220 Ų220142.6 Ų142.686%0.86378%0.78SS**  000-117.7-94.2000111.6
150L34Very low33.9Very low131 Ų131143.1 Ų143.169%0.68678%0.783SS**  000-90.6160000110.1
151Q35.5Very low34.4Very low159 Ų159142.6 Ų142.674%0.74378%0.78SS**  000-154.6103.321.200109.4
152S34.4Very low34.3Very low103 Ų103144 Ų14472%0.7278%0.781SS**  00056.20000109.5
153K33Very low34.6Very low206 Ų206139.1 Ų139.190%0.89677%0.773SS**  000-125.3165178.2-170.60109.7
154A33.5Very low34.7Very low89 Ų89141.5 Ų141.574%0.73677%0.772SS**  0120.1000000109.4
155K35.9Very low35.1Very low192 Ų192140.1 Ų140.184%0.83577%0.765SS**  126.4115.194-123.9158.2-177.3-179.50109.6
156I35.7Very low35.4Very low146 Ų146141.6 Ų141.675%0.74976%0.763SS**  123.6095.4-71.6165.5000108.2
157S31.3Very low35.9Very low104 Ų104144.8 Ų144.873%0.72776%0.762SS**  000168.30000109.2
158T35.2Very low36.5Very low119 Ų119142.9 Ų142.973%0.7376%0.758SS**  000-450000109.3
159C33.8Very low36.7Very low107 Ų107141.4 Ų141.472%0.72376%0.755SS**  000-70.90000109.6
160D36.4Very low36.8Very low128 Ų128138 Ų13868%0.68475%0.752SS**  000-104.4-21.7000109.7
161L39.3Very low37.1Very low123 Ų123139.4 Ų139.464%0.64476%0.759SS**  0117.40-71.5176.7000109.5
162E34Very low37.1Very low169 Ų169139.5 Ų139.579%0.7976%0.759SS**  98.3066.9-69.1-161.2163.400110.2
163A38.6Very low37.1Very low82 Ų82141.7 Ų141.768%0.67876%0.763SS**  0117000000109.7
164E36.4Very low37.3Very low158 Ų158143.5 Ų143.574%0.73876%0.764SS**  117.3074.5-60-88.9154.500109.9
165D40Very low37.4Very low132 Ų132144.3 Ų144.371%0.70676%0.762SS**  000-82.6-24.7000110.3
166E38.5Very low37Very low169 Ų169142.6 Ų142.679%0.7976%0.761SS**  000-66.2-78.4167.400111
167D43.9Very low36.6Very low143 Ų143140.6 Ų140.677%0.76576%0.756SS**  000-68.3-40.9000111.8
168D46.4Very low36.6Very low148 Ų148140 Ų14079%0.79175%0.747SS**  0140.20-85.8-29.4000110
169V41Very low36.5Very low142 Ų142140.5 Ų140.586%0.86175%0.746SS**  169.2127.3115.7-117.40000108
170D36.2Very low36.7Very low148 Ų148140.5 Ų140.579%0.79174%0.742SS**  53.4130.6106.5-88.3-17.6000110.9
171L39.6Very low36.7Very low161 Ų161141.7 Ų141.784%0.84374%0.744SS**  148.9108122.3-103.7123.6000109
172E35.5Very low36.4Very low160 Ų160143 Ų14375%0.74875%0.747SS**  77.2118.5103.6-73.9-117168.500110.3
173D35.8Very low36.4Very low149 Ų149138.8 Ų138.880%0.79774%0.736SS**  154.292.3124.2-91.4-19.6000109.1
174R36.9Very low36.2Very low244 Ų244141.8 Ų141.892%0.92174%0.741SS**  trans-13.1149.2134.8-106.7-176.7-179-163.3-0.6111.9
175P36.3Very low36Very low106 Ų106142.5 Ų142.569%0.68874%0.744SS**  -171.7140.28434.3-5.5000112.1
176L27.2Very low35.6Very low156 Ų156140 Ų14082%0.81774%0.741SS**  79.3120.498.6-80.5164.5000110.2
177T26.2Very low35.3Very low104 Ų104139.1 Ų139.164%0.63874%0.742SS**  100.1118.3104.9-260000109.6
178V31.6Very low34.8Very low91 Ų91139.2 Ų139.255%0.55274%0.741SS**  133.8111.8114.4177.20000108.2
179D32.9Very low34.2Very low130 Ų130138.7 Ų138.770%0.69574%0.739SS**  141.4111.7101.5-91.9-28.9000109.4
180T38.7Very low33.8Very low107 Ų107140.1 Ų140.166%0.65674%0.736SS**  134.9108.596.440000109.2
181Q35.4Very low33.6Very low154 Ų154138.1 Ų138.172%0.7273%0.734SS**  126.6110.291.3-132.5171.4-32.900109.9
182E33.3Very low33.3Very low151 Ų151136.8 Ų136.871%0.70674%0.737SS**  96.7112.885.3-137.1-174.5171.500110.2
183S35Very low33.2Very low79 Ų79139.3 Ų139.355%0.55275%0.746SS**  123.7117.294.4-5.40000109.7
184D32.8Very low33Very low146 Ų146141.7 Ų141.778%0.78175%0.749SS**  129113.994.4-85.1-19.7000109.6
185E33.9Very low32.5Very low172 Ų172135 Ų13580%0.80474%0.736SS**  137.7112.799.8-80.4-103.8163.800109.5
186A30.7Very low32.2Very low79 Ų79137.8 Ų137.865%0.65374%0.743SS**  113.9112.997.100000109.5
187L32.4Very low32.6Very low152 Ų152135.1 Ų135.180%0.79674%0.735SS**  128.9117.5103.2-85.5176.9000109.3
188L34.3Very low32.8Very low144 Ų144135 Ų13575%0.75474%0.738SS**  106122.6101.9-78.7171.7000109.5
189N32.4Very low32.8Very low138 Ų138136 Ų13674%0.73875%0.745SS**  106.7125.593.7-125.517.6000110.2
190E32.9Very low32.8Very low171 Ų171135.9 Ų135.980%0.79974%0.744SS**  132.2125.5103.1-108-158.5167.100109.5
191S31.8Very low32.6Very low107 Ų107137.7 Ų137.775%0.74875%0.75SS**  107.9117.790.9-1360000109.6
192S33Very low32.5Very low132 Ų132135.1 Ų135.192%0.92375%0.749SS**  -171.5110.4119.4-54.10000109.2
193K34.6Very low32.4Very low213 Ų213134 Ų13493%0.92675%0.752SS**  trans-88.50174.5-124.7175.4-177.3-1780109.9
194K30.8Very low31.9Very low200 Ų200135.5 Ų135.587%0.8776%0.762SS**  01150-147.9172.9-178.5178.80109.5
195T27.5Very low31.7Very low104 Ų104134.3 Ų134.364%0.63876%0.76SS**  123.7117.293.3-46.10000109
196I28.6Very low31.4Very low164 Ų164132.6 Ų132.684%0.84176%0.755SS**  -168.50120.3-58.7176.1000108.4
197P36.3Very low31.2Very low99 Ų99133.1 Ų133.164%0.64375%0.754SS**  00034-5.3000111.9
198S29.2Very low31.1Very low102 Ų102133 Ų13371%0.71375%0.754SS**  00075.70000109.6
199T31.8Very low30.8Very low111 Ų111130.5 Ų130.568%0.68175%0.748SS**  0128.6047.60000109.1
200N33.5Very low30.6Very low129 Ų129130.2 Ų130.269%0.6975%0.751SS**  149.6118.4101.8-79.8-17.7000109.8
201N34.5Very low30.5Very low145 Ų145125.6 Ų125.678%0.77574%0.742SS**  115.1124.692.3-87.2-9.3000110.3
202S33.8Very low30.5Very low100 Ų100128.9 Ų128.970%0.69975%0.746SS**  30.7127.299.470.40000111.8
203V30.3Very low30.6Very low126 Ų126128.5 Ų128.576%0.76473%0.734SS**  131.6127.795.9172.50000108.2
204C25.6Very low30.5Very low112 Ų112126.5 Ų126.576%0.75773%0.725SS**  80.5128.496.8-87.90000110.1
205T27.2Very low30.8Very low121 Ų121125.8 Ų125.874%0.74272%0.724SS**  131.1125.11005.30000109.2
206I28.6Very low30.7Very low136 Ų136128.2 Ų128.270%0.69773%0.733SS**  123.5119.8109-61.7179.1000108.1
207S27.3Very low31.5Very low90 Ų90125.3 Ų125.363%0.62973%0.725SS**  96.2120107.2-61.40000110
208N28.9Very low31.3Very low149 Ų149126.7 Ų126.780%0.79773%0.732SS**  89.5116.8109.2-88.8-6000110.5
209S28.2Very low31.6Very low92 Ų92127.1 Ų127.164%0.64374%0.735SS**  88.3121.897.5600000110.3
210V27.3Very low31.6Very low132 Ų132126.9 Ų126.980%0.874%0.738SS**  113.5120.6102.71740000108.5
211A31.8Very low31.5Very low74 Ų74126.7 Ų126.761%0.61274%0.741SS**  138.2115.3106.800000109.3
212E32.3Very low31.2Very low175 Ų175125 Ų12582%0.81874%0.737SS**  143.2098.1-94.3-173.7173.800109.6
213D33.5Very low31.1Very low125 Ų125126.2 Ų126.267%0.66874%0.74SS**  000-127.9-0.9000109.5
214K34.1Very low31.1Very low171 Ų171124.7 Ų124.774%0.74374%0.741SS**  000-103.4-177-177.7-178.20109.6
215Q35.5Very low31.2Very low184 Ų184124.8 Ų124.886%0.8674%0.743SS**  0112.30-116.9165.99.100109.3
216D27Very low31.4Very low155 Ų155128.5 Ų128.583%0.82975%0.748SS**  -9.20121.3-85.7-20.4000112
217P44.1Very low31.4Very low103 Ų103128.3 Ų128.367%0.66975%0.754SS**  00034.8-5.9000112.3
218T33.7Very low31.4Very low128 Ų128129 Ų12979%0.78576%0.758SS**  00038.90000109.3
219S33.8Very low31.2Very low111 Ų111131 Ų13178%0.77676%0.761SS**  0113.7054.60000109.6
220S32.2Very low31.1Very low107 Ų107132 Ų13275%0.74876%0.763SS**  96.9083.361.30000110.2
221V30.8Very low31.2Very low125 Ų125131.7 Ų131.776%0.75876%0.761SS**  01130175.60000108.1
222T29.6Very low31Very low110 Ų110134 Ų13468%0.67576%0.761SS**  35.6127.7105.70.40000111
223T31.6Very low30.9Very low124 Ų124131.1 Ų131.176%0.76175%0.751SS**  112.8130.682.5340000109.7
224A30.9Very low30.6Very low95 Ų95133 Ų13379%0.78576%0.762SS**  112.4128.678.700000109.7
225S27.5Very low30.4Very low114 Ų114130.3 Ų130.380%0.79776%0.76SS**  21.30105.2-68.70000111.5
226K31.4Very low30.7Very low198 Ų198127 Ų12786%0.86175%0.754SS**  0137.10-103.2175.8-177.8174.80109.9
227T29Very low30.6Very low132 Ų132125.4 Ų125.481%0.8176%0.755SS**  trans28.6126.9136.747.50000110.9
228S26.4Very low29.7Very low104 Ų104124.9 Ų124.973%0.72776%0.759SS**  134.5119.7111.7-66.80000109.5
229F25.3Very low29.5Very low193 Ų193125.3 Ų125.385%0.84676%0.761SS**  87119.3103.3-91.5-82.2000110.1
230V25.1Very low29.3Very low113 Ų113125.2 Ų125.269%0.68576%0.756SS**  136.6114.798.4174.90000108.2
231V30.1Very low28.9Very low125 Ų125125.4 Ų125.476%0.75876%0.756SS**  62.1123.489.5177.80000109.5
232I27Very low28.7Very low123 Ų123126.8 Ų126.863%0.63176%0.758SS**  175.5121.1122.1-59.8178.3000108.1
233N30Very low28.6Very low113 Ų113125.3 Ų125.360%0.60475%0.752SS**  162.3112.688.1-85.3-0.1000109.8
234N26.8Very low28.3Very low166 Ų166123.4 Ų123.489%0.88875%0.745SS**  -145.694.3107.2-93.7-3.4000109.7
235T30.6Very low28.1Very low114 Ų114123.5 Ų123.570%0.69974%0.739SS**  trans-13.70132.738.50000111.6
236P41.8Very low28.1Very low113 Ų113125.2 Ų125.273%0.73474%0.739SS**  00034.1-4.6000111.9
237S25.1Very low27.8Very low123 Ų123119.9 Ų119.986%0.8673%0.727SS**  0127.20-960000109.3
238A25.7Very low27.6Very low92 Ų92118.1 Ų118.176%0.7672%0.72SS**  108112.9109.400000109.9
239V29Very low27.6Very low136 Ų136118.8 Ų118.882%0.82472%0.723SS**  164103.9124.2176.60000108
240V29.4Very low27.5Very low109 Ų109118.5 Ų118.566%0.66172%0.724SS**  150.3106.6104.7173.60000108.1
241C23.9Very low27.6Very low112 Ų112117.7 Ų117.776%0.75772%0.723SS**  33.8121.8104-72.20000110.9
242L27.4Very low27.4Very low153 Ų153117.7 Ų117.780%0.80172%0.724SS**  170.3105.892.6-77.5160000109.2
243S26.1Very low27.5Very low79 Ų79119.1 Ų119.155%0.55273%0.732SS**  -35.6124.4120.344.70000111.6
244S26.9Very low27.3Very low85 Ų85118.4 Ų118.459%0.59474%0.736SS**  155.7119.3125.519.10000109.5
245S26.5Very low27.5Very low96 Ų96118.5 Ų118.567%0.67174%0.735SS**  87.5115.5110.8-53.30000110.4
246L27.8Very low27.5Very low150 Ų150121.1 Ų121.179%0.78574%0.74SS**  101.3105.3118.5-112.698.4000109.8
247S24.7Very low27Very low87 Ų87122.4 Ų122.461%0.60874%0.74SS**  70.8109.8104.9740000110.6
248S23.8Very low27Very low95 Ų95120.9 Ų120.966%0.66473%0.729SS**  119.9112.6115.171.70000109.9
249C26.8Very low27.2Very low117 Ų117125.1 Ų125.179%0.79173%0.733SS**  -17994.5114.8-68.70000108.9
250Q23.2Very low27.3Very low188 Ų188122.7 Ų122.788%0.87972%0.722SS**  -40.4123.4124.3-93.7-166.8-5.100111.5
251S26.2Very low27.3Very low96 Ų96123.7 Ų123.767%0.67173%0.728SS**  146.9120115.8-51.70000109.3
252T26.4Very low27.7Very low124 Ų124123.8 Ų123.876%0.76173%0.73SS**  68.1121.4106.246.30000110.3
253L29.2Very low28.6Very low154 Ų154122.8 Ų122.881%0.80673%0.73SS**  151.2108.9119.3-98.9147.3000109.1
254S25.7Very low29.3Very low98 Ų98124.5 Ų124.569%0.68574%0.74SS**  73.6118.9102.7-70.70000110.5
255L31.7Very low29.5Very low167 Ų167126.5 Ų126.587%0.87474%0.743SS**  162.3106.6115.3-114114.5000109
256Q29.8Very low29.8Very low170 Ų170131 Ų13179%0.79475%0.751SS**  30.9121.9105.5-147117.16.700111.4
257N31.2Very low30Very low140 Ų140128.8 Ų128.875%0.74974%0.74SS**  156.5118114.2-124.7-3.5000109.9
258C26.6Very low30.4Very low91 Ų91128.8 Ų128.862%0.61574%0.739SS**  91.1124.182.1-71.90000109.9
259Q29.7Very low30.6Very low181 Ų181129.5 Ų129.585%0.84674%0.744SS**  138.4116.3107.6-111.3168.49.300109.5
260S29.4Very low30.8Very low84 Ų84128.5 Ų128.559%0.58774%0.738SS**  125.5119100.8-460000109.6
261T31.1Very low31.1Very low131 Ų131126.9 Ų126.980%0.80474%0.735SS**  121.8114.493.741.90000109.3
262S31.8Very low31.3Very low114 Ų114126.3 Ų126.380%0.79775%0.745SS**  139.596.5103.378.30000109.3
263V46.1Very low31.6Very low132 Ų132128.2 Ų128.280%0.875%0.745SS**  trans-91.8150.2145.2-171.10000108.9
264P40.6Very low31.6Very low115 Ų115129.3 Ų129.375%0.74775%0.745SS**  -166.2140.8118.733.3-5000111.8
265N31.8Very low32Very low126 Ų126128.2 Ų128.267%0.67474%0.735SS**  76.9126.877.3-123.7-3.4000111
266K32.1Very low31.9Very low192 Ų192123.6 Ų123.684%0.83572%0.717SS**  -161.5116.3108.8-89.9-177.5-175.9176.60109.5
267N33.1Very low31.8Very low102 Ų102119.5 Ų119.555%0.54571%0.712SS.*  101.9118.774.5-92.1-4.9000110.5
268C31Very low31.7Very low88 Ų88118 Ų11860%0.59571%0.709SS**  130.8124.673.3-77.20000109.3
269S29.8Very low31.9Very low109 Ų109119.5 Ų119.576%0.76272%0.716SS**  129.4119.178-1210000109.7
270S30.7Very low31.8Very low96 Ų96114.2 Ų114.267%0.67170%0.703SS**  -1.4123.3108.758.20000111.8
271D28.1Very low31.6Very low154 Ų154116.5 Ų116.582%0.82471%0.708SS**  85.8107.9101.9-84.5-25.1000110.4
272G31Very low31.5Very low85 Ų85112 Ų11288%0.87668%0.684SS**  trans-144.397.2134.200000110.1
273H32.4Very low31.4Very low164 Ų164111.8 Ų111.876%0.75968%0.678SS**  trans-55.7120144.1-91.1-69.3000111.4
274H30.5Very low30.9Very low176 Ų176111.4 Ų111.482%0.81568%0.676SS**  -173.7105.1119.4-81.1-79.4000109
275T33.1Very low30.3Very low75 Ų75109.7 Ų109.746%0.4667%0.672SS.*  165.790.8114.550.50000108.8
276S29.2Very low30.7Very low71 Ų71108.5 Ų108.550%0.49767%0.671SS.*  43.1105.5109.256.50000111.1
277A28.6Very low30.6Very low83 Ų83105.9 Ų105.969%0.68666%0.664SS**  -162.1117.197.100000109.1
278P29.3Very low30.5Very low108 Ų108107.5 Ų107.570%0.70166%0.663SS**  -69.2119.5120.333.5-5.2000111.9
279V30.6Very low30.2Very low123 Ų123109.7 Ų109.775%0.74567%0.666SS**  107.8110.2123.7177.40000108.4L281V279-L281 HydrophobicContact CG1-CD1 4.35Å
280A27Very low30Very low70 Ų70109.2 Ų109.258%0.57966%0.663SS**  trans-153.4112.9137.200000109.3
281L26.3Very low29.8Very low132 Ų132109.2 Ų109.269%0.69166%0.663SS**  65.4104.680.6-13875.4000110.4V279 T849V279-L281 HydrophobicContact CG1-CD1 4.35Å; L281-T849 VanDerWaalsContact O-CG2 3.22Å; L281-T849 WeakPolarHBondContact O-CG2 3.45Å
282A29.2Very low30Very low37 Ų37108.6 Ų108.631%0.30666%0.664SS.*  140.6109.5107.500000109.5T849 T850A282-T849 HydrophobicContact CB-CG2 3.58Å; A282-T850 VanDerWaalsContact O-CG2 3.23Å; A282-T850 WeakPolarHBondContact O-CG2 3.28Å
283T29.5Very low29.9Very low110 Ų110107.6 Ų107.668%0.67565%0.654SS**  123.2105.596.4-32.40000109.3
284V34.9Very low30.1Very low123 Ų123105.1 Ų105.175%0.74565%0.653SS**  151.594.599.71760000107.9
285A28.1Very low30Very low80 Ų80103.8 Ų103.866%0.66165%0.651SS**  48.3153.998.800000111
286P39.3Very low29.7Very low101 Ų101110.8 Ų110.866%0.65667%0.671SS**  cis-179153.1-4.534.1-5.6000112
287I31.5Very low29.5Very low137 Ų137112.2 Ų112.270%0.70368%0.681SS**  144.3121.8111.7-60.5178.9000108.1
288R31.2Very low29.4Very low135 Ų135115.7 Ų115.751%0.50969%0.687SS.*  108.8123.586.2-104.7-158-167.9-175.3-0109.9P1078R288-P1078 PolarHBondContact NH2-O 2.02Å
289M24.2Very low29.3Very low135 Ų135114.5 Ų114.567%0.66568%0.682SS**  110.3124.290.7-86.8-151.3-118.900109.5
290S26Very low29.4Very low99 Ų99115.8 Ų115.869%0.69268%0.684SS**  97.9113.9102.3110.10000109.9
291S26.6Very low29.5Very low96 Ų96120 Ų12067%0.67169%0.692SS**  82108.3105.987.20000110.3
292V31.4Very low29.8Very low140 Ų140119.7 Ų119.785%0.84869%0.69SS**  171.5102.3123.5179.90000107.9
293G29.6Very low29.9Very low65 Ų65125.2 Ų125.267%0.6771%0.713SS**  35.9146.7124.600000112.2
294P36.5Very low30Very low112 Ų112129.6 Ų129.673%0.72772%0.717SS**  trans-102.9135.7-130.433.3-4.6000111.9
295D27.7Very low30Very low147 Ų147128.5 Ų128.579%0.78671%0.713SS**  trans-161.1119.2143.5-72.9-25.3000109.4
296Y26.8Very low30.2Very low222 Ų222131.9 Ų131.987%0.87172%0.718SS**  46.2118.2116.3-82.9-82.7000110.8
297S25.4Very low29.9Very low102 Ų102135.8 Ų135.871%0.71373%0.725SS**  122.6097.6-116.10000109.7
298L26.6Very low30.2Very low155 Ų155135.1 Ų135.181%0.81273%0.729SS**  0121.40-95151.1000110.1
299S27.9Very low30.2Very low84 Ų84132.7 Ų132.759%0.58774%0.739SS**  121088.8-51.50000109.5
300N31.5Very low30.6Very low149 Ų149130.9 Ų130.980%0.79774%0.739SS**  0131.10-93.2-6.9000110
301E29.9Very low30.9Very low160 Ų160133.8 Ų133.875%0.74874%0.742SS**  132.1127.496.6-128.9-176.9174.900109.6
302I33.1Very low31.1Very low125 Ų125134.9 Ų134.964%0.64174%0.74SS**  150118.8106.4-68173.1000108.3
303L30.9Very low31.2Very low153 Ų153133 Ų13380%0.80173%0.729SS**  100.7109.495.5-119.795.7000110.1
304R30.9Very low31.4Very low201 Ų201137.8 Ų137.876%0.75873%0.734SS**  -6.20128.5-79.6-168.5-158.4-143.6-0.1111.8
305P35.9Very low31Very low101 Ų101137.9 Ų137.966%0.65673%0.733SS**  00034.4-5.5000112.3
306I31.1Very low30.9Very low151 Ų151138.1 Ų138.177%0.77473%0.734SS**  0126.40-61.1176.8000108.4
307K34.3Very low30.9Very low182 Ų182133.2 Ų133.279%0.79173%0.727SS**  610100.8-128.1173.1-177.31710111
308P37.7Very low31Very low123 Ų123133 Ų13380%0.79972%0.722SS**  00030.1-2.8000111.9
309A31.2Very low31.1Very low85 Ų85133.2 Ų133.270%0.70272%0.72SS**  00000000110.4
310S32Very low31.2Very low96 Ų96134.9 Ų134.967%0.67173%0.732SS**  00031.30000110
311Q31.1Very low31.2Very low160 Ų160133.8 Ų133.875%0.74873%0.726SS**  000-111.4178.3-12.400109.8
312D32.6Very low31.3Very low120 Ų120134.9 Ų134.964%0.64273%0.731SS**  000-90.6-19.5000109.7
313T31.6Very low31.2Very low100 Ų100132.9 Ų132.961%0.61373%0.733SS**  000-32.80000109.9
314Q34.5Very low31.2Very low166 Ų166132.1 Ų132.178%0.77674%0.735SS**  000-94.9-174.512.600109.7
315T28Very low31.3Very low114 Ų114128 Ų12870%0.69973%0.734SS**  0114.8033.60000110.9
316N25.2Very low31Very low151 Ų151131.8 Ų131.881%0.80774%0.743SS**  92.2118.1119.5-86.4-16.7000110.8
317T27.2Very low31Very low120 Ų120129.9 Ų129.974%0.73674%0.738SS**  117.4110.4122.6-41.30000109.4
318V28.6Very low30.6Very low98 Ų98126.6 Ų126.659%0.59473%0.733SS**  114.6106.4117176.90000108.5
319M27.8Very low30.1Very low159 Ų159126.4 Ų126.478%0.78373%0.73SS**  95.199.6118.8-109.6-171.1-58.800109.9
320S30.9Very low29.9Very low119 Ų119127 Ų12783%0.83273%0.729SS**  -153.791122.2-1640000109.4
321N30.9Very low29.7Very low125 Ų125129.3 Ų129.367%0.66873%0.733SS**  58.690.9122.5-76.2-18.2000111.1
322H31.7Very low29.5Very low183 Ų183131 Ų13185%0.84774%0.738SS**  10499118.6-108.9-77.1000110
323A30.5Very low29.6Very low83 Ų83129.9 Ų129.969%0.68674%0.737SS**  144.594.691.400000109.4
324T31.4Very low29.4Very low138 Ų138130 Ų13085%0.84774%0.741SS**  98.7130.2102.917.10000109.2
325P33.4Very low29.1Very low113 Ų113130.6 Ų130.673%0.73474%0.742SS**  trans-108.40170.533.7-4.6000112
326Q30.3Very low29.1Very low181 Ų181132.1 Ų132.185%0.84674%0.74SS**  0130.40-71.7-147-0.800109.6
327T29.4Very low29.2Very low111 Ų111132.6 Ų132.668%0.68174%0.738SS**  73.5124.590.2-43.10000110.2
328V26.3Very low29.4Very low114 Ų114131.2 Ų131.269%0.69174%0.739SS**  75.2120.9106.7-167.60000109.2
329T27.9Very low29.4Very low119 Ų119132.3 Ų132.373%0.7375%0.745SS**  99.4115.2129.2-8.30000109.7
330S27.4Very low29.6Very low97 Ų97129.2 Ų129.268%0.67874%0.739SS**  61.5118.2122.674.40000110.8
331I26Very low29.6Very low145 Ų145128.8 Ų128.874%0.74473%0.732SS**  trans123.3112.1136.8-65177.3000108.2
332F28.6Very low29.6Very low196 Ų196128.7 Ų128.786%0.8674%0.736SS**  77.3142.3128.2-101.8-85.8000110
333P33.9Very low29.4Very low95 Ų95125.2 Ų125.262%0.61773%0.732SS**  trans-74.5125.1-171.133.9-5.4000111.9
334S27.3Very low29.3Very low102 Ų102127.6 Ų127.671%0.71374%0.738SS**  115.8119.4126.8-88.70000109.6
335K27.7Very low29.1Very low180 Ų180127.9 Ų127.978%0.78374%0.74SS**  115.80103.3-92.1-172.4-176.1176.80109.6
336H29.1Very low28.8Very low145 Ų145126.5 Ų126.567%0.67173%0.732SS**  0116.80-108.5-83.9000109.4
337E26.5Very low28.9Very low162 Ų162128.3 Ų128.376%0.75773%0.733SS**  134.5107.1105-127.7-178.3174.100109.6
338A31.3Very low28.8Very low91 Ų91130.2 Ų130.275%0.75274%0.739SS**  174.8101.1117.400000109.1
339V29.5Very low29.6Very low120 Ų120129.5 Ų129.573%0.72774%0.737SS**  90.6105.282176.30000109
340S31.8Very low29.6Very low94 Ų94133.5 Ų133.566%0.65774%0.744SS**  160.3107.1107.8-91.80000109.6
341T30.3Very low29.8Very low111 Ų111134.1 Ų134.168%0.68175%0.748SS**  98.7119.886.841.50000109.8
342T31.7Very low30.1Very low122 Ų122132.5 Ų132.575%0.74875%0.75SS**  117.2115.592.341.20000109.4
343S27.3Very low30.3Very low110 Ų110132.2 Ų132.277%0.76975%0.751SS**  28.7128105.5-39.10000111.5
344T28.5Very low30.1Very low134 Ų134132.7 Ų132.782%0.82276%0.757SS**  40.10125.750.10000110.7
345V26.4Very low30.3Very low144 Ų144133 Ų13387%0.87376%0.759SS**  0124.50179.20000108.2
346S28Very low30.4Very low83 Ų83130.6 Ų130.658%0.5876%0.76SS**  trans150.2118.1131-162.50000109.4
347Y31.3Very low30.5Very low220 Ų220131.2 Ų131.286%0.86377%0.768SS**  107.5101.2110.9-94-85000109.7
348N27.2Very low30.6Very low151 Ų151132 Ų13281%0.80777%0.772SS**  26.90123.6-127.3-25.2000112
349P43.8Very low30.5Very low99 Ų99137.8 Ų137.864%0.64377%0.774SS**  0142.2033.9-5000111.9
350K28.1Very low30.4Very low202 Ų202140.1 Ų140.188%0.87878%0.775SS**SBend177.3100.1112.2-89.8-176.2-178.4171.10109.1
351S30.7Very low30.3Very low110 Ų110139.3 Ų139.377%0.76978%0.781SS**SBend137.795.894.666.20000109.4
352S32.2Very low30.3Very low112 Ų112143.5 Ų143.578%0.78379%0.79SS**  1370107.735.70000109.4
353Q33.2Very low30.6Very low189 Ų189143.3 Ų143.388%0.88379%0.792SS**  000-84.2-162.51.700109.8
354S31Very low30.6Very low106 Ų106142.2 Ų142.274%0.74179%0.789SS**  000108.70000110.2
355S30.3Very low30.6Very low107 Ų107143 Ų14375%0.74879%0.787SS**  00060.40000110
356T30.3Very low30.7Very low131 Ų131138.8 Ų138.880%0.80476%0.763SS**  00047.80000111.1
357N31.9Very low30.8Very low157 Ų157137.7 Ų137.784%0.8475%0.75SS**  0126.40-92.4-21.2000109.7
358E27.9Very low30.8Very low180 Ų180131.6 Ų131.684%0.84174%0.736SS**  18.80114.5-78-147.2165.600111.5
359R28.9Very low31.1Very low212 Ų212128.4 Ų128.480%0.872%0.715SS**  0107.90-160.2171.4-161.6-156.1-2.2110.1
360F28.5Very low30.8Very low169 Ų169129.9 Ų129.974%0.74173%0.725SS**  119.399117.9-91.7-79000109.2
361G29.1Very low31.1Very low77 Ų77122.9 Ų122.979%0.79470%0.704SS**  176.498.112500000109.8
362F30.9Very low31.3Very low198 Ų198121.5 Ų121.587%0.86870%0.695SS**  trans-31.70141.8-79.3-76.9000111.5
363P36.5Very low31.6Very low119 Ų119121 Ų12177%0.77368%0.682SS**  0145.2034.3-5.3000112.1
364A28.8Very low31.8Very low86 Ų86112.8 Ų112.871%0.71165%0.648SS**  128.711911400000109.3
365I27.4Very low32Very low152 Ų152113.7 Ų113.778%0.77965%0.649SS**  63.9113.5108.8-66.1169000109.4
366S28.6Very low32.2Very low55 Ų55114.5 Ų114.539%0.38565%0.649SS.*  112.6128.6107.5-100.70000110.1C1018 N1019S366-C1018 CarbonylContact O-C 1.84Å; S366-C1018 WeakPolarHBondContact O-CA 3.48Å; S366-N1019 CovalentContact C-OD1 0.82Å; S366-N1019 WeakPolarHBondContact CA-ND2 2.99Å; S366-N1019 WeakPolarHBondContact CA-OD1 3.33Å; S366-N1019 WeakPolarHBondContact CB-ND2 1.85Å; S366-N1019 WeakPolarHBondContact CB-OD1 3.35Å; S366-N1019 PolarHBondContact N-OD1 2.94Å; S366-N1019 CarbonylContact O-C 2.82Å; S366-N1019 WeakPolarHBondContact O-CA 3.36Å; S366-N1019 WeakPolarHBondContact O-CB 3.31Å; S366-N1019 CovalentContact O-CG 1.7Å; S366-N1019 PolarHBondContact O-N 3.46Å; S366-N1019 PolarHBondContact O-ND2 3.44Å; S366-N1019 PolarHBondContact O-OD1 3.18Å; S366-N1019 PolarHBondContact OG-OD1 3.5Å
367I30.1Very low32.2Very low59 Ų59113.1 Ų113.130%0.30365%0.646SS.*  82.3126.798.4-57.2175.9000109.3C1018 N1019 Q1020I367-C1018 CarbonylContact O-C 2.19Å; I367-N1019 CovalentContact C-C 1.54Å; I367-N1019 CarbonylContact C-O 3.59Å; I367-N1019 WeakPolarHBondContact CA-OD1 3.39Å; I367-N1019 HydrophobicContact CB-CB 3.02Å; I367-N1019 WeakPolarHBondContact CB-ND2 3.04Å; I367-N1019 WeakPolarHBondContact CB-OD1 3.43Å; I367-N1019 HydrophobicContact CG1-CB 4.13Å; I367-N1019 HydrophobicContact CG2-CB 4.14Å; I367-N1019 PolarHBondContact N-OD1 3.47Å; I367-N1019 CarbonylContact O-C 3.49Å; I367-N1019 WeakPolarHBondContact O-CA 3.43Å; I367-N1019 CovalentContact O-CB 1.39Å; I367-N1019 WeakPolarHBondContact O-CB 1.76Å; I367-N1019 PolarHBondContact O-N 3.37Å; I367-Q1020 VanDerWaalsContact C-C 3.42Å; I367-Q1020 HydrophobicContact CB-CB 2.86Å; I367-Q1020 CovalentContact CB-CD 1.52Å; I367-Q1020 HydrophobicContact CB-CG 2.67Å; I367-Q1020 CovalentContact CB-OE1 1.05Å; I367-Q1020 HydrophobicContact CG1-CB 4.18Å; I367-Q1020 HydrophobicContact CG1-CG 3.77Å; I367-Q1020 VanDerWaalsContact CG2-CA 3.41Å; I367-Q1020 HydrophobicContact CG2-CB 2.53Å; I367-Q1020 HydrophobicContact CG2-CG 1.54Å; I367-Q1020 CovalentContact CG2-OE1 1.22Å; I367-Q1020 VanDerWaalsContact O-CA 3.23Å; I367-Q1020 WeakPolarHBondContact O-CA 2.28Å; I367-Q1020 WeakPolarHBondContact O-CB 3.34Å; I367-Q1020 PolarHBondContact O-N 2.66Å; I367-Q1020 PolarHBondContact O-OE1 3.46Å; I367-Q1020 VanDerWaalsContact O-OE1 3.07Å
368T31.4Very low32.1Very low92 Ų92111.5 Ų111.556%0.56464%0.641SS**  161.2121.6110.329.20000108N1019 Q1020 I1021T368-N1019 CarbonylContact C-O 3.06Å; T368-N1019 WeakPolarHBondContact CA-O 3.18Å; T368-N1019 WeakPolarHBondContact CB-O 3.26Å; T368-N1019 PolarHBondContact N-O 2.79Å; T368-N1019 VanDerWaalsContact OG1-C 3.28Å; T368-N1019 PolarHBondContact OG1-O 3.21Å; T368-Q1020 CarbonylContact C-O 3.5Å; T368-Q1020 CovalentContact CA-CB 1.46Å; T368-Q1020 VanDerWaalsContact CA-N 3.3Å; T368-Q1020 WeakPolarHBondContact CA-O 3Å; T368-Q1020 HydrophobicContact CG2-CB 2.84Å; T368-Q1020 HydrophobicContact CG2-CG 2.72Å; T368-Q1020 VanDerWaalsContact CG2-OE1 3.26Å; T368-Q1020 CovalentContact N-CA 1.5Å; T368-Q1020 CovalentContact N-CB 1Å; T368-Q1020 PolarHBondContact N-O 2.89Å; T368-Q1020 CarbonylContact O-C 3.54Å; T368-Q1020 WeakPolarHBondContact OG1-CB 3.48Å; T368-I1021 WeakPolarHBondContact O-CD1 3.43Å; T368-I1021 WeakPolarHBondContact O-CG1 3.25Å
369K33.8Very low32.1Very low85 Ų85109 Ų10937%0.3764%0.638SS.*  15.3170.8119.2-110177.5-177.9169.10109.9Q1020 I1021 S1022 T1023K369-Q1020 PolarHBondContact N-O 3.04Å; K369-I1021 VanDerWaalsContact C-CG1 3.43Å; K369-I1021 CovalentContact CA-CD1 0.48Å; K369-I1021 VanDerWaalsContact CA-CG2 3.48Å; K369-I1021 HydrophobicContact CB-CB 3.05Å; K369-I1021 CovalentContact CB-CD1 1.42Å; K369-I1021 HydrophobicContact CB-CD1 1.42Å; K369-I1021 HydrophobicContact CB-CG1 2.29Å; K369-I1021 HydrophobicContact CB-CG2 2.9Å; K369-I1021 HydrophobicContact CD-CB 3.77Å; K369-I1021 HydrophobicContact CD-CD1 3.71Å; K369-I1021 HydrophobicContact CD-CG1 3.89Å; K369-I1021 HydrophobicContact CD-CG2 2.51Å; K369-I1021 HydrophobicContact CG-CB 2.7Å; K369-I1021 HydrophobicContact CG-CD1 2.39Å; K369-I1021 HydrophobicContact CG-CG1 2.81Å; K369-I1021 CovalentContact CG-CG2 1.88Å; K369-I1021 HydrophobicContact CG-CG2 1.88Å; K369-I1021 CovalentContact N-CD1 1.26Å; K369-I1021 CovalentContact N-CG1 1.41Å; K369-I1021 WeakPolarHBondContact O-CD1 3.45Å; K369-S1022 WeakPolarHBondContact CE-O 3.48Å; K369-S1022 PolarHBondContact NZ-O 2.7Å; K369-T1023 HydrophobicContact CD-CG2 3.71Å; K369-T1023 CovalentContact NZ-CG2 1.48Å; K369-T1023 PolarHBondContact NZ-OG1 2.31Å
370P36.3Very low32.1Very low130 Ų130105.9 Ų105.984%0.84464%0.636SS**  -160.8136.999.734-5.4000111.5
371A35.2Very low31.9Very low54 Ų54103 Ų10345%0.44664%0.636SS.*  trans-180130.800000111.7T819 T820A371-T819 HydrophobicContact CB-CG2 4.18Å; A371-T820 HydrophobicContact CB-CG2 4.27Å
372S34.9Very low31.9Very low81 Ų81106.8 Ų106.857%0.56664%0.637SS**  000154.60000109.2T819S372-T819 WeakPolarHBondContact CA-OG1 3.49Å
373I37.6Very low31.7Very low103 Ų103101.4 Ų101.453%0.52863%0.629SS.*  000-67.3168.1000107.6G817 T818 T819I373-G817 CarbonylContact O-C 3.18Å; I373-G817 WeakPolarHBondContact O-CA 3.31Å; I373-G817 PolarHBondContact O-N 3.5Å; I373-T818 CovalentContact C-CA 1.37Å; I373-T818 CovalentContact C-CB 0.88Å; I373-T818 CovalentContact C-CG2 1.21Å; I373-T818 CarbonylContact C-O 3.49Å; I373-T818 VanDerWaalsContact CA-C 3.44Å; I373-T818 CovalentContact CA-CB 1.81Å; I373-T818 CovalentContact CA-CG2 1.49Å; I373-T818 WeakPolarHBondContact CA-OG1 3.41Å; I373-T818 CovalentContact CB-CG2 1.57Å; I373-T818 HydrophobicContact CB-CG2 1.57Å; I373-T818 HydrophobicContact CD1-CG2 4.11Å; I373-T818 HydrophobicContact CG1-CG2 3.1Å; I373-T818 HydrophobicContact CG2-CG2 1.89Å; I373-T818 VanDerWaalsContact CG2-OG1 3.28Å; I373-T818 WeakPolarHBondContact CG2-OG1 3.19Å; I373-T818 CarbonylContact O-C 3.51Å; I373-T818 WeakPolarHBondContact O-CA 3.37Å; I373-T818 WeakPolarHBondContact O-CB 3.37Å; I373-T818 WeakPolarHBondContact O-CG2 3.43Å; I373-T818 CovalentContact O-N 1.69Å; I373-T818 PolarHBondContact O-N 2.85Å; I373-T818 PolarHBondContact O-OG1 3.3Å; I373-T819 WeakPolarHBondContact CA-OG1 3.48Å; I373-T819 PolarHBondContact N-OG1 2.81Å
374G38Very low31.6Very low15 Ų15100.7 Ų100.716%0.15563%0.625CS.*  00000000109.4G817 T818G374-G817 CarbonylContact O-C 2.34Å; G374-G817 WeakPolarHBondContact O-CA 3.32Å; G374-T818 CarbonylContact C-O 3.35Å; G374-T818 WeakPolarHBondContact CA-O 3.29Å; G374-T818 CovalentContact CA-OG1 1.08Å; G374-T818 WeakPolarHBondContact CA-OG1 3.41Å; G374-T818 CovalentContact N-CA 1.54Å; G374-T818 CovalentContact N-CB 0.82Å; G374-T818 PolarHBondContact N-O 3.46Å; G374-T818 CovalentContact N-OG1 1.09Å; G374-T818 PolarHBondContact N-OG1 3.26Å; G374-T818 WeakPolarHBondContact O-CB 3.22Å; G374-T818 PolarHBondContact O-N 3.17Å; G374-T818 PolarHBondContact O-OG1 2.44Å
375T35.6Very low31.5Very low125 Ų125102.1 Ų102.177%0.76763%0.625SS**  0128.2047.50000108.8T818T375-T818 PolarHBondContact N-OG1 3.33Å; T375-T818 VanDerWaalsContact N-OG1 3.13Å
376T33.9Very low31.7Very low124 Ų124101.3 Ų101.376%0.76162%0.62SS**  120.7121.284.646.80000109.2
377S30.3Very low31.7Very low103 Ų103102.6 Ų102.672%0.7263%0.63SS**  103.6126.978.760.40000109.9
378V30.7Very low31.7Very low123 Ų123104.4 Ų104.475%0.74565%0.647SS**  150.4118.4104.61770000108
379T27.2Very low31.7Very low126 Ų126104.1 Ų104.177%0.77365%0.649SS**  100121.921.60000111.2
380I28.9Very low31.8Very low148 Ų148103.7 Ų103.776%0.75965%0.653SS**  0123.30-63.9173000107.9
381S24.2Very low31.6Very low107 Ų107101.2 Ų101.275%0.74863%0.632SS**  37.5120.1110.9-103.80000111.2
382I29.4Very low31.6Very low157 Ų157103.9 Ų103.981%0.80564%0.643SS**  156.3114.1116.7-53.2175000107.9
383A26.5Very low31.5Very low86 Ų86104.9 Ų104.971%0.71165%0.646SS**  88142112.300000110.1
384P35.1Very low31.3Very low104 Ų104108.5 Ų108.568%0.67566%0.66SS**  trans-64.3138168.733.7-4.7000112
385T27.1Very low31Very low116 Ų116113.6 Ų113.671%0.71269%0.694SS**  92.7125.1116.7420000109.8
386I30.9Very low30.6Very low134 Ų134115.7 Ų115.769%0.68770%0.696SS**  115.6127.395.1-36.6173.7000108.8
387S28Very low31.1Very low83 Ų83114.9 Ų114.958%0.5869%0.693SS**  109.5132.593.7-560000110
388S31.2Very low31Very low96 Ų96114.9 Ų114.967%0.67169%0.694SS**  103.6087.6-27.20000110.1
389S30.7Very low30.8Very low86 Ų86115.7 Ų115.760%0.60169%0.692SS**  000-9.50000109.8
390V35.3Very low30.9Very low76 Ų76118 Ų11846%0.46169%0.692SS.*  000176.60000108.8N852 I853V390-N852 WeakPolarHBondContact CG1-O 3.45Å; V390-N852 WeakPolarHBondContact CG2-O 3.47Å; V390-I853 WeakPolarHBondContact CA-O 3.44Å; V390-I853 VanDerWaalsContact CB-O 3.27Å; V390-I853 WeakPolarHBondContact CB-O 3.26Å; V390-I853 WeakPolarHBondContact CG1-O 3.31Å; V390-I853 VanDerWaalsContact CG2-O 3.25Å; V390-I853 WeakPolarHBondContact CG2-O 3.41Å
391I33.9Very low30.8Very low79 Ų79116.9 Ų116.941%0.40569%0.687SS.*  000-64.1174.8000108.5N852 I853I391-N852 WeakPolarHBondContact CD1-O 3.24Å; I391-I853 HydrophobicContact CD1-CB 4Å; I391-I853 HydrophobicContact CG1-CB 3.85Å; I391-I853 WeakPolarHBondContact CG1-O 3.21Å
392T35.1Very low31Very low109 Ų109117.4 Ų117.467%0.66969%0.686SS**  000-7.50000109.5
393T32.1Very low31Very low103 Ų103120.4 Ų120.463%0.63269%0.687SS**  0134.5050.50000109.2
394H33Very low31.5Very low179 Ų179121.3 Ų121.383%0.82968%0.684SS**  179.4118.386-76.9-76.7000109.2
395S31.3Very low31.3Very low122 Ų122126.4 Ų126.485%0.85369%0.689SS**  137.8103.3104.8153.60000109.3
396M28.6Very low31.8Very low168 Ų168126 Ų12683%0.82869%0.689SS**  trans-49.30152.5-79.5-118.6126.300111.1
397P43.1Very low31.9Very low107 Ų107124 Ų12470%0.69568%0.683SS**  00033.8-5.7000112.1
398S28.3Very low32.2Very low104 Ų104126 Ų12673%0.72769%0.691SS**  0134.30-161.90000109.3
399I27.9Very low32.1Very low139 Ų139125.5 Ų125.571%0.71369%0.693SS**  63.3131.8106.6-64.5172.2000109.1
400F28.5Very low32.3Very low176 Ų176130.2 Ų130.277%0.77271%0.705SS**  74.7119.8127.2-104.2-84.4000109.8
401N26.3Very low32.3Very low124 Ų124131 Ų13166%0.66371%0.714SS**  144.5129.5104.2-112.7-4.9000109.8
402V27.9Very low32.1Very low117 Ų117132.4 Ų132.471%0.70973%0.726SS**  176.2107.4120.81770000108
403R31Very low31.7Very low221 Ų221134.7 Ų134.783%0.83473%0.733SS**  -34124.6129.3-162.3160.5-163.6169.70.3111.4
404T37.1Very low32.3Very low104 Ų104133.8 Ų133.864%0.63873%0.729SS**  117.413399.238.50000109.4
405R29.5Very low31.9Very low212 Ų212130.9 Ų130.980%0.872%0.724SS**  trans-159.60142.9-115.6-173.5-176.6-142.40.5109.4
406P38.3Very low31.7Very low107 Ų107132.5 Ų132.570%0.69572%0.722SS**  00032.7-4000112.4
407T33.3Very low32.1Very low93 Ų93130.5 Ų130.557%0.57173%0.725SS**  000-38.50000110.2
408V33.9Very low31.7Very low124 Ų124132.5 Ų132.575%0.75274%0.735SS**  0134.301780000108.4
409A28.6Very low31.8Very low85 Ų85130.8 Ų130.870%0.70273%0.733SS**  105.812778.900000109.7
410Q35.7Very low32.5Very low186 Ų186130 Ų13087%0.86974%0.737SS**  -161.2121117.6-83.4-167.2-20.900109.4
411S33.9Very low32.6Very low92 Ų92130.4 Ų130.464%0.64374%0.742SS**  61.5121.794670000110.9
412V30.5Very low33.1Very low109 Ų109129.3 Ų129.366%0.66174%0.741SS**  73.3109.591.3-179.30000109.2
413L27.6Very low33.2Very low156 Ų156128.3 Ų128.382%0.81775%0.746SS**  119.8152.6111.9-80.2167.6000109.7
414P43.3Very low33.6Very low84 Ų84123.2 Ų123.255%0.54574%0.741SS.*  -169.2137.6-76.134.6-5.1000112.1
415V24.2Very low33.6Very low118 Ų118123.4 Ų123.472%0.71574%0.744SS**  trans104.5114.9136178.60000108.4
416L27.9Very low33.4Very low156 Ų156120.2 Ų120.282%0.81774%0.742SS**  175.689.4113.6-79.8168.2000109.2
417S37.3Very low33.1Very low126 Ų126121 Ų12188%0.88174%0.74SS**  trans-69.8108146.5-141.70000110.9
418V33.7Very low33.1Very low149 Ų149122.1 Ų122.190%0.90375%0.748SS**  trans-54.20155.9-169.80000109.4
419G31.4Very low33Very low68 Ų68124.1 Ų124.170%0.70175%0.749SS**  00000000110.6
420P43.4Very low33.3Very low123 Ų123125.9 Ų125.980%0.79975%0.751SS**  0137.2033-5000111.9
421Q30.4Very low33.3Very low185 Ų185121.8 Ų121.886%0.86474%0.743SS**  117.70116.8-142.8-178.8-900109.8
422P36.9Very low33Very low100 Ų100125.3 Ų125.365%0.64975%0.753SS**  00033.9-3.8000111.9
423A29.5Very low33.1Very low97 Ų97124.8 Ų124.880%0.80275%0.754SS**  0144.5000000110.4
424P39.8Very low33.4Very low113 Ų113122 Ų12273%0.73475%0.749SS**  -102.8169.5-110.234-4.9000111.9
425P35.9Very low32.6Very low109 Ų109124.9 Ų124.971%0.70876%0.758SS**  168.9142.459.134.3-5.1000112
426L26.9Very low33Very low144 Ų144126.9 Ų126.975%0.75476%0.76SS**  trans136.7105.8135-144.280.2000109.4
427N30.3Very low33.1Very low123 Ų123124 Ų12466%0.65875%0.753SS**  107.9105.5112.4-94.71.2000110.3
428T33.9Very low32.9Very low118 Ų118126.5 Ų126.572%0.72475%0.751SS**  152.3104.9104.513.30000109.1
429Q32.4Very low32.7Very low166 Ų166124.3 Ų124.378%0.77674%0.742SS**  79.1110.593.8-82.8-167.25.500110.5
430T33.9Very low32.6Very low121 Ų121127.4 Ų127.474%0.74275%0.747SS**  133.1104.996.714.60000109.2
431S35.5Very low31.9Very low101 Ų101127.5 Ų127.571%0.70675%0.745SS**  120.5109.397.545.20000109.7
432L27.6Very low32Very low165 Ų165126.2 Ų126.286%0.86474%0.74SS**  55.6110.583.6-81.4166.1000110.9
433S33Very low31.6Very low98 Ų98131.5 Ų131.569%0.68575%0.753SS**  151110.4102.2-24.80000109.3
434S33.2Very low31.8Very low99 Ų99134.1 Ų134.169%0.69275%0.75SS**  77.3112.187.2650000110.8
435L26.6Very low31.8Very low143 Ų143134.9 Ų134.975%0.74976%0.755SS**  65.1117.594-102.4125.2000110.6
436Q34.1Very low31.4Very low161 Ų161136 Ų13675%0.75276%0.755SS**  130.2118.9108.5-98.8177.7-15.700109.7
437S30.4Very low31.6Very low96 Ų96135.8 Ų135.867%0.67176%0.758SS**  60.312897.9650000110.9
438Q31.9Very low31.6Very low177 Ų177132.6 Ų132.683%0.82776%0.755SS**  147.8125.9104.3-93.9-154.41500109.4
439S29.7Very low31.7Very low104 Ų104134.8 Ų134.873%0.72776%0.762SS**  50.8126.5103.6-56.60000111
440T28.9Very low31.7Very low132 Ų132135.7 Ų135.781%0.8177%0.769SS**  90119.995.7-58.10000109.6
441V30.1Very low32.1Very low125 Ų125135 Ų13576%0.75877%0.767SS**  trans3.8118.9140.4-175.10000110.2
442Q30.9Very low32.2Very low159 Ų159135.9 Ų135.974%0.74377%0.767SS**  113120.491.5-78.4-126.50.200109.7
443F28.9Very low32.8Very low210 Ų210134.3 Ų134.392%0.92176%0.764SS**  trans-166102.1138.3-94.5-80.6000108.7
444M33.5Very low32.6Very low153 Ų153138.4 Ų138.475%0.75478%0.775SS**  trans-51.8150.1149.6-100.9158.9103.200111.3L446M444-L446 HydrophobicContact CE-CD1 3.01Å; M444-L446 HydrophobicContact CE-CG 4.45Å
445P39.5Very low33.1Very low128 Ų128138 Ų13883%0.83177%0.77SS**  -141121.4121.232.9-4.8000111.7
446L28.9Very low33.3Very low134 Ų134137.9 Ų137.970%0.70278%0.775SS**  trans-20129.1134-11397.9000111.7M444M444-L446 HydrophobicContact CE-CD1 3.01Å; M444-L446 HydrophobicContact CE-CG 4.45Å
447V30.8Very low33.7Very low138 Ų138135.2 Ų135.284%0.83677%0.772SS**  157124106.8-176.50000107.9
448G29.3Very low33.8Very low57 Ų57134.8 Ų134.859%0.58877%0.774SS**  150.8106.7102.800000110.4
449N35.8Very low33.7Very low164 Ų164132.6 Ų132.688%0.87777%0.773SS**  146.3101.9105.4-90.518.3000109.7
450M33.3Very low33.8Very low185 Ų185132.2 Ų132.291%0.91177%0.771SS**  27.7158.8119.7-72.2-140.6-169.100111.1
451P42.1Very low33.7Very low107 Ų107132.6 Ų132.670%0.69577%0.773SS**  cis-166.4134.548.634.2-5.5000112
452V38.1Very low33.8Very low118 Ų118129.8 Ų129.872%0.71577%0.769SS**  149.8100.3123.8177.20000108
453T39.4Very low33.7Very low132 Ų132129.6 Ų129.681%0.8177%0.773SS**  130.488.1110.410.50000109.2
454M30.2Very low33.7Very low184 Ų184129.9 Ų129.991%0.90677%0.768SS**  6.10127.6-83.7-100-87.500111.6
455P42.7Very low33.6Very low91 Ų91129.4 Ų129.459%0.59177%0.768SS**  0152.9033.5-4.4000111.8
456V31.7Very low33.2Very low140 Ų140128.5 Ų128.585%0.84876%0.76SS**  trans179.7149.5149.4179.50000108
457P42.6Very low33.3Very low105 Ų105128.9 Ų128.968%0.68276%0.761SS**  -127.70-110.933.6-3.9000111.9
458A31.1Very low33.3Very low88 Ų88128.3 Ų128.373%0.72775%0.753SS**  0114.7000000109.2
459T31.2Very low33.5Very low130 Ų130133.8 Ų133.880%0.79876%0.763SS**  74.812591.228.20000110.1
460S29.9Very low33.3Very low97 Ų97131.8 Ų131.868%0.67875%0.753SS**  103.3126.699.291.20000109.9
461T28.5Very low33.4Very low139 Ų139131.1 Ų131.185%0.85375%0.747SS**  65.6127.7108.845.70000110
462G31.4Very low32.8Very low67 Ų67129.3 Ų129.369%0.69174%0.742SS**  147.9115122.200000110.1
463L28.6Very low32.6Very low155 Ų155130.7 Ų130.781%0.81274%0.743SS**  75.8126.9105.2-78.6169.6000110.3
464R29.4Very low32.7Very low216 Ų216128.6 Ų128.682%0.81573%0.732SS**  110.3124.7103.6-105.2-168.8-150.5-121-0.3109.7
465N30.7Very low32.8Very low142 Ų142127 Ų12776%0.75973%0.726SS**  57.4120.7105-104.60.2000111.2
466V30.7Very low32.3Very low110 Ų110127.4 Ų127.467%0.66774%0.736SS**  66.5119.6105.4-178.20000109.2
467I32.3Very low32.3Very low141 Ų141124.7 Ų124.772%0.72374%0.737SS**  129.6123111.9-63.9175.9000108.2
468N30.5Very low32Very low126 Ų126124.3 Ų124.367%0.67474%0.743SS**  79.2124.996.9-126.5-15.8000110.8
469H33.8Very low32.6Very low172 Ų172125.3 Ų125.380%0.79674%0.742SS**  -178.2111.4120.7-9526000109.4
470N30.8Very low32.9Very low123 Ų123125.7 Ų125.766%0.65874%0.744SS**  41.1129.997.6-93.2-7.6000111.8
471Q35.6Very low32.9Very low170 Ų170125.6 Ų125.679%0.79475%0.75SS**  123.6124.998.9-94.8-172.5-4.400109.8
472A30.5Very low33.7Very low70 Ų70124.5 Ų124.558%0.57974%0.744SS**  111.1123.188.600000109.8
473I33Very low33.7Very low146 Ų146127.1 Ų127.175%0.74975%0.751SS**  98.8091.9-61.5175.6000108.9I475I473-I475 HydrophobicContact CG2-CG1 4.48Å
474P42Very low34.6Very low89 Ų89125.2 Ų125.258%0.57875%0.748SS**  0151.5034.1-4.8000112.7
475I32.5Very low35.6Very low151 Ų151120.1 Ų120.177%0.77474%0.743SS**  129.8098.6-68.6175.8000108.5I473I473-I475 HydrophobicContact CG2-CG1 4.48Å
476A31.6Very low35.7Very low98 Ų98120.1 Ų120.181%0.8174%0.742SS**  00000000109.7
477G32.1Very low36Very low84 Ų84122.6 Ų122.687%0.86675%0.746SS**  0118.3000000110.4
478A35.5Very low36.2Very low97 Ų97122.1 Ų122.180%0.80274%0.744SS**  trans-55.60152.100000111.1
479P44.8Very low36.4Very low109 Ų109124.8 Ų124.871%0.70875%0.75SS**  00034.1-5.4000112.1
480T36Very low36.6Very low137 Ų137122 Ų12284%0.8474%0.741SS**  0114.3038.80000109.2
481A30.6Very low36.7Very low96 Ų96123.4 Ų123.479%0.79375%0.745SS**  25.50115.300000111.3
482P45Very low36.9Very low115 Ų115120.1 Ų120.175%0.74774%0.737SS**  00032.9-4.9000112.1
483C32.2Very low37.7Very low123 Ų123121.1 Ų121.183%0.83174%0.737SS**  000-75.30000109.3
484P47Very low37.9Very low114 Ų114121 Ų12174%0.7474%0.736SS**  00034.1-5.5000111.8
485P49.8Very low37.8Very low110 Ų110121 Ų12171%0.71474%0.735SS**  00034.3-5.3000112
486L33.5Very low37.8Very low141 Ų141120.7 Ų120.774%0.73873%0.731SS**  0119.80-78.8175.7000109.3
487Q37.3Very low37.9Very low162 Ų162122.9 Ų122.976%0.75772%0.722SS**  93.6071.9-83.7-169-41.700110.5
488I36.4Very low38Very low131 Ų131124.8 Ų124.867%0.67271%0.71SS**  0114.20-69.1172000108.2
489F35.2Very low38Very low182 Ų182122.9 Ų122.980%0.79870%0.7SS**  136.197.984.3-96.7-81.8000109.2
490N36.3Very low37.5Very low113 Ų113124.9 Ų124.960%0.60471%0.71SS**  34.612390.9-137.112.4000112.1T492N490-T492 PolarHBondContact OD1-OG1 3.02Å
491M34.2Very low38.1Very low154 Ų154124 Ų12476%0.75971%0.707SS**  151.7082.6-67.3-115.6-142.300109.6
492T39.8Very low38.2Very low100 Ų100124 Ų12461%0.61370%0.701SS**  0151.60-21.30000110.2N490N490-T492 PolarHBondContact OD1-OG1 3.02Å
493P48Very low37.6Very low91 Ų91128.8 Ų128.859%0.59171%0.706SS**  cis171.70-36.235.3-6.6000112
494M35.3Very low37.6Very low145 Ų145125.5 Ų125.571%0.71468%0.682SS**  000-114.2-143.2108.900109.6Q496M494-Q496 HydrophobicContact CE-CG 3.68Å
495P41.1Very low37Very low87 Ų87126.4 Ų126.457%0.56568%0.68SS**  00035.1-6.4000112.3
496Q32.4Very low36Very low146 Ų146128 Ų12868%0.68268%0.677SS**  000-65.8-139.8-37.600109.8M494M494-Q496 HydrophobicContact CE-CG 3.68Å
497F33.8Very low36.2Very low144 Ų144126.6 Ų126.663%0.63268%0.677SS**  0134.40-104.6-85.8000109.1
498M33.7Very low36.1Very low123 Ų123124.6 Ų124.661%0.60668%0.676SS**  44.3082.1-77.4-102.6139.300111.1S1215 N1216M498-S1215 WeakPolarHBondContact CB-OG 3.49Å; M498-N1216 WeakPolarHBondContact CG-ND2 3.37Å
499G36.7Very low35.7Very low58 Ų58122 Ų12260%0.59868%0.682SS**  00000000110.9
500T33.9Very low36.1Very low150 Ų150119.3 Ų119.392%0.9268%0.682SS**  00046.10000111.6
501P47.5Very low35.9Very low118 Ų118119.7 Ų119.777%0.76669%0.688SS**  00034.3-5.3000112.1
502S33.2Very low35.8Very low96 Ų96114.3 Ų114.367%0.67167%0.668SS**  000-69.50000109.2
503Y32.3Very low35.6Very low216 Ų216112.5 Ų112.585%0.84767%0.67SS**  000-94.9-88000109.4
504V33Very low35.2Very low55 Ų55112.4 Ų112.433%0.33368%0.677SS.*  000175.20000109.1Y1201V504-Y1201 HydrophobicContact CB-CD2 4.36Å; V504-Y1201 HydrophobicContact CB-CE2 3.93Å; V504-Y1201 HydrophobicContact CG1-CE1 4.38Å; V504-Y1201 HydrophobicContact CG1-CE2 3.89Å; V504-Y1201 WeakPolarHBondContact CG1-OH 3.21Å; V504-Y1201 HydrophobicContact CG2-CD1 3.9Å; V504-Y1201 HydrophobicContact CG2-CD2 2.89Å; V504-Y1201 HydrophobicContact CG2-CE1 3.81Å; V504-Y1201 HydrophobicContact CG2-CE2 2.75Å; V504-Y1201 HydrophobicContact CG2-CG 3.47Å; V504-Y1201 VanDerWaalsContact CG2-CG 3.47Å
505L33.2Very low35.3Very low133 Ų133113 Ų11370%0.69668%0.683SS**  0134.20-78.2170.8000109.4
506H29.1Very low35.2Very low143 Ų143113.7 Ų113.766%0.66269%0.69SS**  104.4090.4-128.8-104.1000110T508H506-T508 WeakPolarHBondContact CE1-CG2 3.34Å; H506-T508 WeakPolarHBondContact ND1-CG2 3.5Å
507P38.9Very low35.6Very low112 Ų112116.1 Ų116.173%0.72770%0.699SS**  00034.1-5.6000112.7
508T34.2Very low35.8Very low119 Ų119117.6 Ų117.673%0.7371%0.707SS**  0110.6049.10000110.3H506H506-T508 WeakPolarHBondContact CE1-CG2 3.34Å; H506-T508 WeakPolarHBondContact ND1-CG2 3.5Å
509G29Very low36.1Very low78 Ų78120.8 Ų120.880%0.80472%0.718SS**  73097.400000111.3
510P41.6Very low36.4Very low124 Ų124123.6 Ų123.681%0.80573%0.726SS**  00034.5-5.8000112.1
511V32.4Very low36.6Very low121 Ų121126.1 Ų126.173%0.73373%0.727SS**  000-178.10000108.4V1177V511-V1177 CarbonylContact C-O 3.32Å
512A33.6Very low35.8Very low41 Ų41124.1 Ų124.134%0.33973%0.728SS.*  00000000109.9V1177 S1178A512-V1177 CovalentContact C-CG1 1.28Å; A512-V1177 CarbonylContact C-O 3.54Å; A512-V1177 HydrophobicContact CB-CG1 3.77Å; A512-V1177 PolarHBondContact N-O 3.29Å; A512-V1177 VanDerWaalsContact N-O 3.16Å; A512-V1177 CarbonylContact O-C 3.36Å; A512-V1177 WeakPolarHBondContact O-CA 3.46Å; A512-V1177 WeakPolarHBondContact O-CB 3.3Å; A512-V1177 CovalentContact O-CG1 1.48Å; A512-V1177 WeakPolarHBondContact O-CG1 3.41Å; A512-V1177 WeakPolarHBondContact O-CG2 3.48Å; A512-S1178 CarbonylContact C-O 3.53Å; A512-S1178 WeakPolarHBondContact CB-O 3.47Å; A512-S1178 CarbonylContact O-C 2.16Å; A512-S1178 PolarHBondContact O-N 3.34Å
513G35.5Very low36.1Very low62 Ų62124.9 Ų124.964%0.63973%0.733SS**  00000000111.5V1177G513-V1177 VanDerWaalsContact C-CG1 3.42Å; G513-V1177 CovalentContact N-CG1 1.47Å; G513-V1177 VanDerWaalsContact O-CG1 3.29Å; G513-V1177 WeakPolarHBondContact O-CG1 3.15Å
514A37.9Very low36.1Very low90 Ų90120.5 Ų120.574%0.74473%0.729SS**  00000000109.8
515N38.1Very low36.1Very low156 Ų156124.9 Ų124.983%0.83475%0.746SS**  000-73.3-21.4000109.7
516S39.6Very low36.1Very low102 Ų102125.2 Ų125.271%0.71375%0.748SS**  00027.20000109.7
517F40.3Very low36.2Very low198 Ų198126 Ų12687%0.86876%0.756SS**  000-98.6-83000109.1
518Q38.3Very low36.2Very low174 Ų174126.2 Ų126.281%0.81376%0.758SS**  000-163.791.719.500109.9
519F39.8Very low36Very low190 Ų190123.5 Ų123.583%0.83375%0.753SS**  000-92.2-83.2000109
520P43.5Very low36Very low118 Ų118127.6 Ų127.677%0.76676%0.756SS**  00033.8-5.5000112
521Q37.8Very low35.5Very low202 Ų202127.3 Ų127.394%0.94476%0.757SS**  000-87.8-170.8-3.800110
522G31.5Very low35.6Very low77 Ų77124.9 Ų124.979%0.79476%0.756SS**  0113.4000000110.5
523S38.1Very low36Very low111 Ų111128.5 Ų128.578%0.77678%0.779SS**  177.1109.6109.55.60000109.3
524T33.6Very low36Very low124 Ų124130 Ų13076%0.76179%0.785SS**  96.9113.186.229.30000110.1
525H32.8Very low36Very low147 Ų147128.8 Ų128.868%0.68178%0.781SS**  125.5093.5-119.7-93.8000109.8
526L31.6Very low36Very low141 Ų141128.5 Ų128.574%0.73879%0.785SS**  096.30-72.8179000109.7
527L32.7Very low35.6Very low159 Ų159127 Ų12783%0.83279%0.786SS**  -18.40119.3-85.3147.9000111.5
528P38.5Very low35.3Very low117 Ų117120.8 Ų120.876%0.7678%0.777SS**  0137.1033.7-4.9000111.9
529G30.6Very low35.2Very low62 Ų62119.4 Ų119.464%0.63978%0.781SS**  trans174.1103.513900000110.4
530L28.6Very low34.6Very low164 Ų164115.3 Ų115.386%0.85977%0.772SS**  69.6106.295.6-71.6171.6000110.6
531S30.2Very low34.1Very low118 Ų118117.5 Ų117.583%0.82577%0.77SS**  113.7107.4105.785.20000109.9
532G35.6Very low33.6Very low70 Ų70114 Ų11472%0.72276%0.757SS**  13399.3109.200000110.4
533S40.8Very low33.7Very low117 Ų117119.4 Ų119.482%0.81876%0.759SS**  125.8103.5106.4175.90000109.7
534A35.3Very low33.6Very low93 Ų93121.3 Ų121.377%0.76976%0.76SS**  95.8104.396.600000110
535G38Very low33.5Very low64 Ų64123.7 Ų123.766%0.6676%0.762SS**  150.197105.900000110.6
536V38.7Very low33.7Very low150 Ų150120.8 Ų120.891%0.90976%0.756SS**  111.2098.8-177.20000108.5
537G31.8Very low33.7Very low72 Ų72121.3 Ų121.374%0.74276%0.755SS**  0108.9000000111.1
538G32.8Very low33.5Very low66 Ų66119.6 Ų119.668%0.6875%0.747SS**  95.4104.992.100000111.1
539T36.6Very low33Very low145 Ų145123.3 Ų123.389%0.8975%0.747SS**  -178.493101.353.60000108.9
540T27.7Very low33.4Very low104 Ų104125 Ų12564%0.63875%0.747SS**  -18.1124.3109.632.10000111.5
541F33.4Very low33.3Very low165 Ų165122.2 Ų122.272%0.72474%0.741SS**  141.7112.5113.5-92.5-81.5000109.3
542N26.3Very low33.3Very low127 Ų127122.7 Ų122.768%0.67974%0.739SS**  70112.191.3-98.6-28.4000111.2
543F34Very low33Very low192 Ų192126.2 Ų126.284%0.84274%0.74SS**  trans-161.995.9140.9-105.7-85.2000109.1
544L36.5Very low32.3Very low151 Ų151129.7 Ų129.779%0.79174%0.74SS**  145.191.4108.9-79.7165.2000109.3
545Q32Very low32.2Very low173 Ų173130.4 Ų130.481%0.80874%0.738SS**  12.3153.3120.5-130.8171.38.500112
546P35.6Very low31.7Very low86 Ų86136.2 Ų136.256%0.55875%0.748SS**  cis173.3142.734.434.1-5.3000112.1
547Q32.7Very low32.1Very low153 Ų153133.5 Ų133.572%0.71573%0.733SS**  129.5105.7116.8-74.2-76.3-1600109.7
548N28.1Very low32.4Very low122 Ų122134.6 Ų134.665%0.65273%0.727SS**  48.3120100.9-106.3-26000111.9
549Y28.2Very low32.6Very low196 Ų196138.3 Ų138.377%0.76974%0.736SS**  137.6154.4110.9-92.8-83.3000109.4
550P38.2Very low32.3Very low97 Ų97136.8 Ų136.863%0.6372%0.722SS**  -139.10-76.434.4-5.2000112
551S28.2Very low33.2Very low106 Ų106137 Ų13774%0.74173%0.725SS**  0127.80-320000110
552T28.6Very low33Very low128 Ų128134.4 Ų134.479%0.78572%0.718SS**  32.8129.2122.649.10000111
553I29.5Very low33.3Very low144 Ų144134.7 Ų134.774%0.73872%0.72SS**  123.8113.6120.3-71.9173.6000108.1
554F26.2Very low33.3Very low189 Ų189132.1 Ų132.183%0.82971%0.714SS**  88.4148.4123.8-109-88.8000109.7
555P33.5Very low33.3Very low109 Ų109131.4 Ų131.471%0.70871%0.709SS**  cis-159.4125.135.833.5-4.8000111.9
556Q27.6Very low33.1Very low186 Ų186130 Ų13087%0.86971%0.707SS**  trans8.4153.3134.5-100.1-172.2-13.300111.8
557P47Very low33.4Very low92 Ų92130.7 Ų130.760%0.59771%0.712SS**  -87.2175.9-128.434.5-5.1000112
558P38.2Very low33.6Very low95 Ų95132.8 Ų132.862%0.61772%0.722SS**  166136.374.333.7-4.6000111.9
559T35.8Very low33.8Very low144 Ų144134.8 Ų134.888%0.88373%0.732SS**  trans-164.492.8138.332.20000108.9
560I30.7Very low34.8Very low114 Ų114130.1 Ų130.159%0.58573%0.726SS**  40.914589.9-61.6176.5000110.1D562I560-D562 HydrophobicContact CG2-CB 3.65Å; I560-D562 WeakPolarHBondContact CG2-OD1 3.44Å; I560-D562 WeakPolarHBondContact CG2-OD2 3.42Å
561P46.7Very low34.7Very low109 Ų109134.7 Ų134.771%0.70874%0.741SS**  -156.5124.57133.7-5.2000112.6
562D29.8Very low35.1Very low109 Ų109132.9 Ų132.958%0.58374%0.74SS**  86.8105.793-94.2-18.1000110.3I560I560-D562 HydrophobicContact CG2-CB 3.65Å; I560-D562 WeakPolarHBondContact CG2-OD1 3.44Å; I560-D562 WeakPolarHBondContact CG2-OD2 3.42Å
563L33.2Very low35.6Very low134 Ų134135.4 Ų135.470%0.70275%0.747SS**  139.2106.389.8-79174.9000109.5
564L32.5Very low35.8Very low137 Ų137131.3 Ų131.372%0.71774%0.741SS**  121.8102.999.3-158.570.2000109.8
565I37.8Very low36.3Very low136 Ų136131.1 Ų131.170%0.69774%0.742SS**  128.9100.4107.7-64.9171.9000108.2
566D26.6Very low36.3Very low144 Ų144130.7 Ų130.777%0.7774%0.742SS**  trans-19.9151.7139.7-130-6.9000111.9
567P41.5Very low36.6Very low101 Ų101127.4 Ų127.466%0.65673%0.734SS**  cis-176.3033.133.4-4.3000111.9
568Q36.8Very low35.9Very low197 Ų197129.7 Ų129.792%0.92174%0.74SS**  000-84.2-176.414.300109.2
569N33.6Very low35.6Very low163 Ų163130.7 Ų130.787%0.87275%0.745SS**  000-117.8-6.9000112
570P48.7Very low35.5Very low98 Ų98129 Ų12964%0.63674%0.737SS**  0142.9034.1-5.1000111.9
571M36.2Very low36.1Very low194 Ų194129.2 Ų129.296%0.95675%0.745SS**  trans-176.1113.4131.4-77.9-133.7-43.700108.9
572G36.2Very low35.2Very low68 Ų68128.4 Ų128.470%0.70175%0.747SS**  130.8107.490.200000110.6
573L39.5Very low35.1Very low180 Ų180127.9 Ų127.994%0.94275%0.752SS**  115.5106.496-78.7169.5000109.6
574G34.1Very low34.8Very low59 Ų59129.5 Ų129.561%0.60876%0.76SS**  69.1111.291.700000111.5
575H36Very low34.7Very low185 Ų185127.6 Ų127.686%0.85676%0.764SS**  116.9106.392.5-79.5-81.3000109.8
576S33.3Very low34.1Very low100 Ų100128 Ų12870%0.69977%0.767SS**  76113.881.5-69.80000110.8
577V34.1Very low34Very low116 Ų116127.7 Ų127.770%0.70376%0.764SS**  84.6108.189.9177.10000109.3
578L32.2Very low33.4Very low140 Ų140127.7 Ų127.773%0.73377%0.766SS**  97.9104.191.5-118.5106.2000109.8
579T31.4Very low33Very low116 Ų116121.8 Ų121.871%0.71275%0.751SS**  75.5139.695.842.10000110
580P35.1Very low32.6Very low110 Ų110120.8 Ų120.871%0.71474%0.744SS**  trans-77.2-178.9-163.434.3-5.1000112
581P43.3Very low31.8Very low118 Ų118123.4 Ų123.477%0.76675%0.753SS**  -141.3147.3-54.434.1-5.5000112
582A27.7Very low31.3Very low91 Ų91121.3 Ų121.375%0.75275%0.746SS**  167.3126.7125.700000109.2
583S26.7Very low31.3Very low98 Ų98123.2 Ų123.269%0.68575%0.745SS**  127.2127.896-31.40000109.5
584I26.8Very low30.7Very low168 Ų168120 Ų12086%0.86274%0.738SS**  106.20110.2-67.1167.1000108.5
585A31.2Very low30.4Very low97 Ų97122.2 Ų122.280%0.80274%0.744SS**  0116.3000000109
586L26.2Very low30Very low144 Ų144118.8 Ų118.875%0.75474%0.741SS**  6.1123.2101.5-108143.5000111.6
587I24.2Very low29.9Very low139 Ų139119.4 Ų119.471%0.71375%0.746SS**  102.2115.2124.2-64.4172.2000108.8
588S27.4Very low29.4Very low101 Ų101123.6 Ų123.671%0.70676%0.755SS**  155.1107.512252.30000109.5
589A29.7Very low29.3Very low72 Ų72123.1 Ų123.160%0.59576%0.758SS**  102.3105.110300000110
590I24.4Very low29.1Very low143 Ų143122.5 Ų122.573%0.73376%0.758SS**  79102.596.3-58.1174.9000109.3
591N31.4Very low28.9Very low153 Ų153125 Ų12582%0.81876%0.763SS**  15382.1120.1-90-21000109.7
592N27.1Very low28.1Very low150 Ų150128.4 Ų128.480%0.80276%0.762SS**  trans-68.3145.8136.4-118.2-27.1000111.4
593P35.7Very low28.4Very low107 Ų107130.1 Ų130.170%0.69577%0.766SS**  179.5128.46133.8-4.7000111.9
594S26.1Very low28.6Very low114 Ų114131.1 Ų131.180%0.79777%0.768SS**  trans161.8103.2137.133.10000109.1
595S29Very low28.8Very low105 Ų105130.3 Ų130.373%0.73477%0.765SS**  163.7107.6114.754.50000109.2
596S26.1Very low28.8Very low112 Ų112130.7 Ų130.778%0.78375%0.753SS**  24.8102.7106.552.30000111.6
597S31.5Very low28.9Very low114 Ų114131 Ų13180%0.79775%0.75SS**  -159.5100.2129.75.90000109.3
598F25.2Very low29.4Very low204 Ų204133.4 Ų133.490%0.89576%0.758SS**  -48.7111.7124.2-88.7-78.3000111
599T29.2Very low29.6Very low130 Ų130133.7 Ų133.780%0.79876%0.758SS**  trans167.1116.3132.646.60000108.7
600S27.4Very low29.5Very low102 Ų102136.4 Ų136.471%0.71376%0.762SS**  114.5113.393.4174.10000109.7
601I30.7Very low29.9Very low162 Ų162137.1 Ų137.183%0.83176%0.763SS**  -171.9101.3113.1-62.8176.4000107.9
602Y27.3Very low29.8Very low190 Ų190137.4 Ų137.475%0.74576%0.764SS**  -17.5134.5120.7-104.8-85.3000111.6
603P34Very low30.1Very low128 Ų128140.3 Ų140.383%0.83177%0.77SS**  trans-106.8107.1141.932.8-4.7000111.5
604T30.8Very low30.6Very low118 Ų118143.6 Ų143.672%0.72477%0.773SS**  trans-67.5120.5152.217.80000110.7
605L30Very low31.6Very low152 Ų152143.6 Ų143.680%0.79677%0.771SS**  trans-140.5109.1136.8-94.2153.3000109.5
606L30.6Very low31.6Very low105 Ų105144.7 Ų144.755%0.5577%0.773SS.*  117.9107.991.2-95.7155.2000109.8
607H30.1Very low31.8Very low149 Ų149144.5 Ų144.569%0.6977%0.772SS**  138114.891.7-94.294.2000109.4
608Q33.6Very low31.8Very low190 Ų190143.6 Ų143.689%0.88877%0.766SS**  trans-85.10137.8-91.3-163.7-7.100110.6
609P31.9Very low32.1Very low107 Ų107140 Ų14070%0.69576%0.761SS**  0124.3033.4-4.9000111.7
610N28.3Very low32.3Very low129 Ų129142.3 Ų142.369%0.6976%0.762SS**  172.7108.4126-109.9-27.2000109.9
611Q31.8Very low32.7Very low159 Ų159142.4 Ų142.474%0.74376%0.762SS**  89.9092.3-74-154.3-10.600110.2
612N30.7Very low32.6Very low158 Ų158137.9 Ų137.985%0.84576%0.756SS**  0110.70-82.7-22000110.1
613F31.7Very low33.3Very low211 Ų211134.2 Ų134.293%0.92576%0.755SS**  trans-100.4107.5158-98.4-81.5000109.8
614F46.4Very low33.2Very low176 Ų176133.6 Ų133.677%0.77275%0.749SS**  trans-63.70147.6-89.1-80.9000110.9
615P47.4Very low33.4Very low115 Ų115132.2 Ų132.275%0.74774%0.744SS**  0141.1033.6-5.5000112
616T30.1Very low33.3Very low128 Ų128134.2 Ų134.279%0.78574%0.742SS**  -175.3116.5112.2540000109
617S29.4Very low34Very low107 Ų107133.5 Ų133.575%0.74874%0.744SS**  152.3097.256.20000109.4
618S30.9Very low34.1Very low96 Ų96136.1 Ų136.167%0.67175%0.749SS**  0105.9056.90000109.8
619T32.7Very low34Very low128 Ų128130.6 Ų130.679%0.78573%0.732SS**  128.3103.6100.8450000109.1
620H33.7Very low33.8Very low179 Ų179131.7 Ų131.783%0.82974%0.736SS**  135.499105.8-139.3-68.6000109.4
621S35.7Very low33.8Very low103 Ų103129.7 Ų129.772%0.7274%0.738SS**  12498.4105.147.10000109.6
622G27.6Very low33.7Very low67 Ų67130 Ų13069%0.69174%0.744SS**  -7.90111.800000112.9
623P42.5Very low33.6Very low113 Ų113127 Ų12773%0.73474%0.741SS**  00034.9-5.8000112.2
624V31.8Very low33.5Very low115 Ų115122 Ų12270%0.69774%0.739SS**  000179.80000108.6
625S33.8Very low32.8Very low89 Ų89116.5 Ų116.562%0.62273%0.732SS**  000-99.70000109.9
626Y28.4Very low32Very low195 Ų195117 Ų11777%0.76573%0.732SS**  01470-87.6-79.9000110.4
627P46.3Very low32Very low90 Ų90118.5 Ų118.558%0.58473%0.731SS**  cis178.7149.4-535.2-6.3000112.3
628Y30.6Very low32.2Very low203 Ų203120.8 Ų120.880%0.79673%0.734SS**  119.5118.1107.1-116-91.5000109.6
629S32.2Very low32.2Very low75 Ų75122.7 Ų122.752%0.52474%0.741SS.*  129121.181.8-72.70000110
630T28.2Very low32Very low129 Ų129124 Ų12479%0.79174%0.743SS**  57.5123.382.336.40000110.7
631A28.6Very low32Very low88 Ų88119 Ų11973%0.72773%0.733SS**  127.3119.5111.600000109.3
632L29Very low32.2Very low166 Ų166119.9 Ų119.987%0.86973%0.734SS**  100.7114.898.7-153.870.9000109.9
633A28.9Very low32.3Very low94 Ų94120.2 Ų120.278%0.77773%0.73SS**  69.8117.8110.800000110.3
634A29.5Very low32.2Very low107 Ų107120.7 Ų120.788%0.88473%0.733SS**  134.4111.9128.600000109.1
635G31.1Very low32.1Very low60 Ų60123.7 Ų123.762%0.61974%0.74SS**  114.8111.7102.500000110.7
636T31.6Very low32Very low124 Ų124128.3 Ų128.376%0.76175%0.754SS**  66.2115109.751.40000110.1
637H30Very low32.2Very low161 Ų161123.1 Ų123.175%0.74575%0.751SS**  119.3108.2106.8-94.6-83.4000109.5
638L33.5Very low31.7Very low155 Ų155125.4 Ų125.481%0.81276%0.763SS**  133.8102123.6-84.9159.9000109.1
639V31.2Very low31.7Very low136 Ų136120.3 Ų120.382%0.82476%0.758SS**  14.9114106.1-156.70000109.9
640N28.1Very low31.9Very low155 Ų155123.9 Ų123.983%0.82977%0.77SS**  trans170105.6136.7-150.222.7000109.6
641A34.1Very low32.2Very low75 Ų75123.6 Ų123.662%0.6277%0.768SS**  15494.5118.100000109.3
642T38.6Very low32.8Very low121 Ų121124.6 Ų124.674%0.74277%0.767SS**  138.291.4105.3-380000109.2
643A31Very low32.9Very low74 Ų74121.1 Ų121.161%0.61276%0.762SS**  61.40108.400000110.7
644P39.4Very low33Very low123 Ų123120.7 Ų120.780%0.79976%0.758SS**  00032.7-4.1000111.8
645Q29.9Very low33Very low177 Ų177120.3 Ų120.383%0.82775%0.745SS**  0116.90-70.4-143.8-6.800109.2
646M32.2Very low32.9Very low187 Ų187124.6 Ų124.692%0.92176%0.76SS**  -174.40108.4-95.4-165-92.600109.2
647A32.6Very low32.7Very low86 Ų86124.7 Ų124.771%0.71176%0.755SS**  00000000109.4
648T35.9Very low33Very low137 Ų137124.2 Ų124.284%0.8476%0.758SS**  0104.1032.20000109
649S30.8Very low33.1Very low97 Ų97121.7 Ų121.768%0.67875%0.75SS**  106.3102.5106.9170.20000109.8
650L35.8Very low33Very low149 Ų149122 Ų12278%0.7875%0.748SS**  127.498.8116.6-89.1143.9000109.3
651V35.1Very low33.1Very low123 Ų123122.7 Ų122.775%0.74575%0.748SS**  68.2139.6104.6-179.90000109.1
652P41.4Very low33Very low109 Ų109126.9 Ų126.971%0.70875%0.754SS**  cis-142.3137-24.531.1-2.4000112.2
653A30.6Very low32.7Very low93 Ų93127.5 Ų127.577%0.76975%0.753SS**  103.2102.379.300000109.7
654A30.2Very low32.8Very low85 Ų85128.4 Ų128.470%0.70276%0.755SS**  49.3117.775.400000111.4
655V29.7Very low33.3Very low100 Ų100126.9 Ų126.961%0.60674%0.74SS**  90.397.395.1-175.60000109.1N657V655-N657 HydrophobicContact CG1-CB 3.85Å; V655-N657 VanDerWaalsContact CG1-CG 3.48Å; V655-N657 WeakPolarHBondContact CG1-ND2 3.49Å; V655-N657 PolarHBondContact O-N 3.2Å
656T28.8Very low33.2Very low150 Ų150127 Ų12792%0.9274%0.741SS**  trans-39.669.2151.740.80000110.9
657N27.9Very low33.2Very low125 Ų125124.2 Ų124.267%0.66873%0.734SS**  trans-118.9119.3161.6-92.9-41.6000110V655V655-N657 HydrophobicContact CG1-CB 3.85Å; V655-N657 VanDerWaalsContact CG1-CG 3.48Å; V655-N657 WeakPolarHBondContact CG1-ND2 3.49Å; V655-N657 PolarHBondContact O-N 3.2Å
658L35.7Very low33Very low152 Ų152124.6 Ų124.680%0.79673%0.732SS**  54.30124.6-12488.1000110.9
659P36Very low32.7Very low101 Ų101127.1 Ų127.166%0.65673%0.731SS**  0143.9034.1-5000112.3
660N28.9Very low32.5Very low144 Ų144130.6 Ų130.677%0.7774%0.739SS**  119.9119.886.9-103.4-9.6000110.3
661M31.3Very low32.4Very low168 Ų168132 Ų13283%0.82874%0.739SS**  146.4110.1103.7-85.5-136.87500109.2
662H30.6Very low32.1Very low164 Ų164133.5 Ų133.576%0.75974%0.738SS**  330126.9-124.2-100.1000111.5
663N32.7Very low31.6Very low133 Ų133133.6 Ų133.671%0.71174%0.741SS**  093.40-110-1.1000109.9
664S33.2Very low31.6Very low93 Ų93132.5 Ų132.565%0.6574%0.739SS**  trans25.9115.8164.453.40000111.5
665N50.6Low32.4Very low91 Ų91134.2 Ų134.249%0.48774%0.742SS.*  -169.384.182.3-77-8.8000109.7T667N665-T667 PolarHBondContact O-N 3.37Å
666E27.4Very low32.8Very low181 Ų181134.1 Ų134.185%0.84674%0.744SS**  trans117.2119-166.9-80.2-157.7166.800110.3
667T32.2Very low33.2Very low127 Ų127135.7 Ų135.778%0.77974%0.741SS**  54.6093.947.20000110.5N665N665-T667 PolarHBondContact O-N 3.37Å
668S28.5Very low33.5Very low95 Ų95132.7 Ų132.766%0.66474%0.739SS**  000-86.20000109.7
669F29.3Very low33.3Very low190 Ų190131.9 Ų131.983%0.83374%0.741SS**  000-88.8-80.4000109
670M26.6Very low33.1Very low170 Ų170131.3 Ų131.384%0.83774%0.739SS**  000-79.6-100.6-128.900110.7
671F33.4Very low33.2Very low178 Ų178133 Ų13378%0.78174%0.74SS**  0108.50-93.6-79.7000109
672Q28.4Very low33.2Very low154 Ų154131.8 Ų131.872%0.7274%0.735SS**  77.8091.2-142.714811.600110.5
673S31.1Very low33Very low112 Ų112128.9 Ų128.978%0.78373%0.734SS**  0116.1047.60000109.7
674G31.1Very low32.9Very low69 Ų69127.1 Ų127.171%0.71173%0.732SS**  133.30111.300000110.3
675P46.3Very low32.6Very low121 Ų121129.5 Ų129.579%0.78674%0.737SS**  0169.8034.6-5000112
676P39Very low31.7Very low99 Ų99134.9 Ų134.964%0.64376%0.757SS**  -170.512982.834.6-6000112.1
677H36.5Very low31.9Very low183 Ų183130.3 Ų130.385%0.84775%0.75SS**  139.5100.9107.2-88.9-80.7000109.4
678G35Very low32.3Very low62 Ų62129.9 Ų129.964%0.63975%0.749SS**  101.2101.696.900000110.6
679T32.1Very low32.3Very low134 Ų134132.7 Ų132.782%0.82276%0.757SS**  82.8120.397.255.30000109.8
680S31.3Very low33Very low90 Ų90129.2 Ų129.263%0.62975%0.753SS**  98.2125.997.4760000110.2
681F30.7Very low33.3Very low178 Ų178122.1 Ų122.178%0.78172%0.724SS**  94.5124.997.3-83.1-78.1000109.9
682I31Very low33.3Very low143 Ų143119 Ų11973%0.73371%0.711SS**  90.6128.3106.8-59.9178.5000108.7
683S27.1Very low33.5Very low104 Ų104116.3 Ų116.373%0.72770%0.702SS**  63.8127.5117.6-126.90000110.7
684S29.8Very low33.5Very low95 Ų95119.5 Ų119.566%0.66470%0.702SS**  100.9122.6116.1-34.20000109.8
685N27.9Very low34.4Very low144 Ų144120.8 Ų120.877%0.7770%0.698SS**  90.7116.1114.6-87.2-24.1000110.6
686F30.6Very low34.1Very low203 Ų203120.4 Ų120.489%0.8970%0.695SS**  trans152.498.5130.6-102-85.4000108.8
687A32Very low33.5Very low86 Ų86120.5 Ų120.571%0.71170%0.697SS**  trans-14.20141.100000111.8
688P40.3Very low33.4Very low117 Ų117120.4 Ų120.476%0.7670%0.697SS**  0146033.3-4.3000111.9
689N29.9Very low33.1Very low154 Ų154125.7 Ų125.782%0.82470%0.703SS**  62.90115.8-101.6-16.7000111.4
690P42.9Very low33.4Very low117 Ų117124.4 Ų124.476%0.7670%0.697SS**  00033.8-5.3000112
691G32.4Very low33.5Very low21 Ų21125.3 Ų125.322%0.21670%0.698CS.*  0121.7000000110.4K1364G691-K1364 VanDerWaalsContact O-CD 3.26Å; G691-K1364 WeakPolarHBondContact O-CD 1.77Å; G691-K1364 WeakPolarHBondContact O-CE 3.41Å; G691-K1364 WeakPolarHBondContact O-CG 3.47Å
692Q34.7Very low33.5Very low112 Ų112125.5 Ų125.552%0.52370%0.699SS.*  57089.1-87.3-150.524.700111.3K1364 A1365Q692-K1364 CarbonylContact O-C 3.55Å; Q692-K1364 VanDerWaalsContact O-C 3.27Å; Q692-K1364 WeakPolarHBondContact O-CA 3.16Å; Q692-K1364 WeakPolarHBondContact O-CG 3.37Å; Q692-A1365 VanDerWaalsContact O-CA 3.27Å; Q692-A1365 WeakPolarHBondContact O-CA 2.14Å; Q692-A1365 PolarHBondContact O-N 2.77Å
693L31Very low34.1Very low99 Ų99123.5 Ų123.552%0.51870%0.696SS.*  01220-94.2154.1000109.5
694F32Very low34.4Very low178 Ų178125.1 Ų125.178%0.78170%0.696SS**  55.6098.8-88.5-80000110.9
695P49.8Very low34.4Very low97 Ų97126.5 Ų126.563%0.6370%0.696SS**  00034.2-5.9000111.9
696P40.8Very low34.5Very low113 Ų113128 Ų12873%0.73470%0.695SS**  0141.1033.5-5000111.9
697C26.9Very low34.3Very low101 Ų101126.2 Ų126.268%0.68269%0.69SS**  75.9079.7-65.40000110.5
698Q33.7Very low34.2Very low181 Ų181127.1 Ų127.185%0.84669%0.687SS**  01190-102.3175.2-1300109.7
699F27.5Very low33.7Very low173 Ų173127.9 Ų127.976%0.75968%0.684SS**  87.3075.4-91.8-81.5000110.2
700P40.3Very low33.6Very low106 Ų106126.7 Ų126.769%0.68868%0.678SS**  00033.8-5.3000112.2
701T31.7Very low33Very low109 Ų109128.2 Ų128.267%0.66968%0.68SS**  0114.60-36.80000109.7
702F30.4Very low32.8Very low182 Ų182132.6 Ų132.680%0.79871%0.706SS**  94.1087.8-89.8-80.9000109.9
703P44.4Very low32.4Very low102 Ų102134.8 Ų134.866%0.66272%0.721SS**  0142.7033.4-4.6000112.1
704N32.6Very low32.3Very low137 Ų137136.6 Ų136.673%0.73374%0.736SS**  154.2117.1117.7-100.6-40.3000109.9
705L30Very low32.1Very low125 Ų125135.5 Ų135.565%0.65474%0.738SS**  120.2110.584.2-122.4119.7000109.8
706F30.8Very low31Very low174 Ų174136.8 Ų136.876%0.76374%0.744SS**  96.3113.397.1-91.2-79.7000109.9
707Q26.5Very low30.4Very low167 Ų167138.5 Ų138.578%0.7874%0.74SS**  36.3121.594.2-104.8170.730.400111.3
708T28.8Very low30.5Very low105 Ų105140 Ų14064%0.64474%0.74SS**  143127.4100.450.20000109
709N29.7Very low30.1Very low132 Ų132135.7 Ų135.771%0.70673%0.73SS**  116.4126.389.8-79.7-11.3000110
710D28.9Very low30.1Very low130 Ų130132.9 Ų132.970%0.69573%0.732SS**  102.9097.6-70.5-27.9000109.8
711N30.2Very low29.7Very low148 Ų148133.5 Ų133.579%0.79174%0.739SS**  0109.90-79.2-10.3000109.9
712C27.4Very low29.7Very low113 Ų113135.2 Ų135.276%0.76474%0.743SS**  133102100.6-89.40000109.2
713L28Very low29.9Very low159 Ų159132.2 Ų132.283%0.83274%0.742SS**  99.986.2103.9-80.6166.2000109.9
714T27.3Very low29.1Very low137 Ų137131.9 Ų131.984%0.8474%0.738SS**  trans-134.698.5139.829.40000109.1
715N29.3Very low29Very low154 Ų154132.5 Ų132.582%0.82474%0.741SS**  trans-123.8115.5163.8-95-7.8000110.1
716T26.5Very low28.9Very low124 Ų124133.2 Ų133.276%0.76175%0.745SS**  trans-134.30132.1-42.70000109.3
717F27.7Very low28.7Very low149 Ų149130.6 Ų130.665%0.65474%0.744SS**  000-97.2-79.4000109
718I29.9Very low29Very low132 Ų132127.6 Ų127.668%0.67774%0.741SS**  0127.50-62.2-178.2000108.2
719S25.2Very low29.1Very low92 Ų92128.3 Ų128.364%0.64375%0.745SS**  103.4092.7-35.50000109.8
720S25.8Very low29.1Very low114 Ų114126.8 Ų126.880%0.79774%0.744SS**  0122.5051.70000109.7
721S31.7Very low29.1Very low119 Ų119127.3 Ų127.383%0.83275%0.747SS**  -171.497.7122.946.40000109.4
722L32.9Very low29.3Very low145 Ų145125.4 Ų125.476%0.75974%0.741SS**  trans-26.9155.5133.7-133.877.1000111.6T724L722-T724 HydrophobicContact CD2-CG2 3.99Å
723P34.3Very low29.5Very low119 Ų119129.1 Ų129.177%0.77374%0.744SS**  -142.2127.411032.9-3.8000111.8
724T28.4Very low29.7Very low95 Ų95126.3 Ų126.358%0.58374%0.738SS**  31.712399.118.90000110.7L722L722-T724 HydrophobicContact CD2-CG2 3.99Å
725D29.3Very low29.9Very low149 Ų149124.8 Ų124.880%0.79773%0.733SS**  -170.90119.5-99.4-13.6000109.4
726L27.5Very low29.9Very low140 Ų140125.7 Ų125.773%0.73374%0.737SS**  0125.10-79.2161.7000110.8
727T28.4Very low30Very low120 Ų120126.8 Ų126.874%0.73674%0.738SS**  128.5118104.353.30000109.1
728S32.5Very low30.2Very low103 Ų103127 Ų12772%0.7274%0.743SS**  146.50107.7720000109.5
729T29.6Very low30.3Very low120 Ų120127.9 Ų127.974%0.73675%0.749SS**  000350000110.1
730C29.5Very low30.6Very low100 Ų100126.6 Ų126.668%0.67675%0.75SS**  0125.80-62.60000109.6
731D29Very low31Very low141 Ų141126.3 Ų126.375%0.75475%0.748SS**  132.4098.3-92.7-17.7000109.5
732T35.8Very low30.9Very low109 Ų109127.6 Ų127.667%0.66975%0.746SS**  0119.6039.40000109.3
733K31.4Very low31.1Very low190 Ų190128.9 Ų128.983%0.82675%0.752SS**  135093.8-97.6-175.1-176.8179.70109.6
734S31.2Very low31Very low100 Ų100127.1 Ų127.170%0.69976%0.756SS**  0114.8060.40000110
735S31.2Very low31.3Very low106 Ų106126.1 Ų126.174%0.74176%0.764SS**  89.6083.827.10000110.3
736L29.3Very low31.5Very low172 Ų172127.2 Ų127.290%0.90177%0.77SS**  01250-70.7170.2000111.2
737N29.3Very low31.8Very low148 Ų148124.3 Ų124.379%0.79177%0.774SS**  -166.2120.7123.3-152.64.5000109.7
738M32.3Very low32Very low152 Ų152121.8 Ų121.875%0.74977%0.772SS**  73.5080.2-79.4-102.2-146.300110.3
739N31.9Very low32.1Very low152 Ų152123.2 Ų123.281%0.81378%0.777SS**  000-93.3-7.9000109.9
740G32.1Very low31.9Very low64 Ų64122.5 Ų122.566%0.6678%0.775SS**  00000000110.5
741S32.5Very low31.9Very low108 Ų108125.6 Ų125.676%0.75578%0.784SS**  0116.10-9.90000109.9
742N31.5Very low31.9Very low147 Ų147123.3 Ų123.379%0.78678%0.78SS**  109.3097.5-101.3-22.5000110.3
743L36.2Very low31.6Very low172 Ų172122.8 Ų122.890%0.90178%0.776SS**  0109.10-86.9153.3000109.1
744G32.6Very low31.4Very low82 Ų82122.7 Ų122.785%0.84577%0.772SS**  109.7110.193.700000110.7
745G34Very low31.1Very low74 Ų74127.9 Ų127.976%0.76378%0.776SS**  122.5111.896.100000110.2
746N34.5Very low31.5Very low171 Ų171127.2 Ų127.291%0.91477%0.769SS**  131.2116.399.1-103.6-7.6000109.9
747G33Very low31.2Very low80 Ų80129.6 Ų129.683%0.82577%0.768SS**  9909100000110.7
748G33.9Very low31.2Very low67 Ų67128.6 Ų128.669%0.69177%0.767SS**  0111.1000000110.3
749T34.1Very low30.9Very low133 Ų133126.4 Ų126.482%0.81677%0.766SS**  68.3123.398.653.90000110.3
750C25.9Very low30.8Very low105 Ų105124.2 Ų124.271%0.70976%0.763SS**  64.9121.797.7-41.70000110.4
751L27.8Very low30.6Very low164 Ų164129 Ų12986%0.85977%0.774SS**  142.7125.2107.3-100.7130.3000109.2
752S28.9Very low30.5Very low94 Ų94131 Ų13166%0.65778%0.776SS**  122.9124.495.6-174.70000109.8
753T29.4Very low30.3Very low98 Ų98131.9 Ų131.960%0.60178%0.78SS**  105.3129.490.1-23.60000109.7
754Y27.1Very low30.1Very low188 Ų188131.4 Ų131.474%0.73778%0.776SS**  98.9123.7100.1-109.9-90.6000109.9
755W26.4Very low29.9Very low209 Ų209134.1 Ų134.179%0.79277%0.771SS**  133158.897.3-83.961.3000109.4
756P38.9Very low30.3Very low91 Ų91134.3 Ų134.359%0.59176%0.76SS**  -118.7145.9-106.134-4.9000112
757Y23.8Very low30.2Very low222 Ų222132.6 Ų132.687%0.87176%0.755SS**  trans126.2111.7130.1-116.1-92.8000109.4
758V29.5Very low30.1Very low128 Ų128133.5 Ų133.578%0.77675%0.749SS**  165.6113.7126.6176.30000108
759S24.7Very low30Very low105 Ų105137.9 Ų137.973%0.73476%0.755SS**  44.295.3114.3-165.50000111.1
760S30Very low29.7Very low106 Ų106137.4 Ų137.474%0.74175%0.752SS**  trans-168.190.9142.8-69.90000109.1
761N28.9Very low29.8Very low166 Ų166141 Ų14189%0.88876%0.758SS**  trans-11579.1158.7-88.4-4.2000110.2
762D28.7Very low29.8Very low149 Ų149136.7 Ų136.780%0.79775%0.746SS**  trans-116.898.2146.3-88.8-20.4000110.2
763L28.7Very low29.8Very low165 Ų165137.9 Ų137.986%0.86475%0.749SS**  160.4106.9129.2-11792.6000109
764I32Very low29.9Very low162 Ų162140.3 Ų140.383%0.83176%0.758SS**  trans-135108.9148.5-67.3171.4000108.2
765N28.6Very low30Very low139 Ų139135.6 Ų135.674%0.74375%0.753SS**  137.9148.397-134.3-1.4000110.1
766P41.7Very low30.3Very low79 Ų79131.2 Ų131.251%0.51375%0.75SS.*  cis-176.4141-34.135-6.4000111.9
767T32.3Very low30.1Very low135 Ų135134 Ų13483%0.82876%0.755SS**  trans163.6107.6132.327.30000108.9
768S30.9Very low30.4Very low99 Ų99131 Ų13169%0.69275%0.748SS**  64.5115.593.9-45.70000110.7
769I30.8Very low30.4Very low159 Ų159129.9 Ų129.982%0.81574%0.742SS**  128.2108.299.7-75.8172.1000108.1
770V28.4Very low30.7Very low123 Ų123131 Ų13175%0.74574%0.739SS**  39119.892.6178.40000109.8
771Q29.3Very low30.6Very low181 Ų181133.8 Ų133.885%0.84674%0.739SS**  170.6119.3113.7-129.3173.4-17.100109.5
772A26.1Very low30.7Very low73 Ų73132.7 Ų132.760%0.60373%0.732SS**  30.5094.800000111.2
773T29.1Very low30.6Very low118 Ų118134.4 Ų134.472%0.72474%0.735SS**  0131.5042.40000109.3
774N31.8Very low30.6Very low149 Ų149131.2 Ų131.280%0.79773%0.727SS**  172.6120.1107.1-108.4-8.5000109.7
775S28.7Very low30.6Very low89 Ų89129 Ų12962%0.62272%0.72SS**  106.4076.265.70000109.9
776T33.3Very low30.8Very low117 Ų117128.6 Ų128.672%0.71872%0.718SS**  0113.5035.50000109
777H34.2Very low30.4Very low151 Ų151130.7 Ų130.770%0.69973%0.726SS**  126.2113.2100.8-103.2-80.8000109.5
778Q30.7Very low30.5Very low157 Ų157130.5 Ų130.573%0.73472%0.719SS**  119.9116.294.5-129.9174.68.600109.8
779T29.9Very low30.5Very low105 Ų105132.4 Ų132.464%0.64472%0.722SS**  89.9120.286.334.60000110
780D29.9Very low30.6Very low128 Ų128132.1 Ų132.168%0.68472%0.722SS**  137.1118.899.6-86.5-18.7000109.5
781F29.7Very low30.8Very low165 Ų165133 Ų13372%0.72472%0.722SS**  125.811692.7-114.7-91.2000109.3
782L30Very low31Very low144 Ų144130.4 Ų130.475%0.75471%0.714SS**  90.1118.297.1-79.2176000110
783Q25.9Very low31.2Very low184 Ų184133 Ų13386%0.8672%0.718SS**  17.70110.4-153.793.22100111.5
784S29.3Very low31.4Very low98 Ų98133.9 Ų133.969%0.68572%0.718SS**  0117.40163.70000109.5
785V33Very low31.5Very low115 Ų115137.9 Ų137.970%0.69772%0.722SS**  131.2114.5102.4-178.10000108.3
786N32.8Very low31.7Very low131 Ų131138.4 Ų138.470%0.70173%0.725SS**  73.2115.1101.7-13610.2000111
787N32.7Very low31.9Very low124 Ų124141.8 Ų141.866%0.66373%0.73SS**  106.5117.5102.1-96-6.1000110.5
788N33.4Very low31.9Very low131 Ų131142.1 Ų142.170%0.70173%0.734SS**  96.8121.195.2-83-8.3000110.5
789N31.7Very low32.1Very low138 Ų138140.7 Ų140.774%0.73873%0.731SS**  106.6118.299.1-84.5-6000110.4
790N33.8Very low32.3Very low153 Ų153142.5 Ų142.582%0.81874%0.737SS**  159.5109.2121.1-78.7-16.5000109.6
791N32.2Very low32.6Very low142 Ų142142.4 Ų142.476%0.75974%0.741SS**  57.6119.1102.5-105.8-5.8000111.4
792L33.3Very low32.7Very low127 Ų127141.4 Ų141.467%0.66574%0.743SS**  106.5119.4105.9-103.2127.4000109.8
793N30.3Very low33Very low128 Ų128139.4 Ų139.468%0.68474%0.737SS**  82.6091-85.1-10.9000111
794D33.8Very low33.3Very low136 Ų136137.4 Ų137.473%0.72773%0.732SS**  000-99.8-16.1000109.7
795R32Very low33.4Very low233 Ų233140.5 Ų140.588%0.87974%0.741SS**  000-128.2178.9176.4172.1-0.2109.5
796S33.1Very low33.4Very low100 Ų100140.9 Ų140.970%0.69975%0.749SS**  00049.10000109.7
797K38.5Very low33.3Very low188 Ų188138 Ų13882%0.81775%0.749SS**  000-103.7-174-175.8-173.10109.4
798M33.1Very low33Very low157 Ų157139.4 Ų139.477%0.77376%0.756SS**  000-117174.1-148.600109.6
799N36.2Very low32.9Very low128 Ų128140.5 Ų140.568%0.68476%0.76SS**  000-86-12.9000109.8
800D33Very low32.8Very low142 Ų142141.1 Ų141.176%0.75976%0.764SS**  01070-90.5-19.7000109.4
801V36.4Very low32.7Very low126 Ų126139.2 Ų139.276%0.76476%0.758SS**  138.7103.699.1177.20000107.9
802N33Very low32.8Very low144 Ų144140.2 Ų140.277%0.7776%0.758SS**  85.4114.296.8-104.4-6000110.7
803T36Very low32.7Very low103 Ų103140.4 Ų140.463%0.63276%0.76SS**  75.3079.4-26.40000110.2
804D32.7Very low33.1Very low141 Ų141141.9 Ų141.975%0.75477%0.765SS**  01200-79.9-18.9000109.3
805N31.3Very low33.1Very low164 Ų164141.7 Ų141.788%0.87777%0.765SS**  5.6119.5112.5-92.34.3000112
806S31.3Very low33.2Very low123 Ų123138.3 Ų138.386%0.8676%0.764SS**  trans166.9119145.8550000109.2
807G30.5Very low33.2Very low69 Ų69136.3 Ų136.371%0.71176%0.759SS**  98.8102.2109.200000110.8
808I28Very low32.9Very low155 Ų155129.1 Ų129.180%0.79573%0.731SS**  44.7105115.3-62.5-173.1000109.7
809L31.3Very low32.8Very low153 Ų153125.1 Ų125.180%0.80172%0.715SS**  122.2110.2128.6-77.7168.8000109.5
810N28.2Very low32.5Very low152 Ų152123.5 Ų123.581%0.81371%0.71SS**  52.70103.6-9910.7000111.3
811V33.4Very low32.3Very low113 Ų113121 Ų12169%0.68570%0.7SS**  0117.20176.30000108.1
812E32.7Very low32Very low162 Ų162120.8 Ų120.876%0.75770%0.699SS**  111.4115.589.7-98.7-178.4177.500109.9
813N32.8Very low32.1Very low132 Ų132120.4 Ų120.471%0.70670%0.702SS**  123.6116.186.6-107.1-8.4000110
814I36.8Very low31.8Very low158 Ų158123 Ų12381%0.8171%0.71SS**  174.9101.5109-62.6174.5000107.9
815N35.1Very low31.5Very low133 Ų133121.8 Ų121.871%0.71171%0.708SS**  75.50107.1-84.8-9.1000110.7
816D32.7Very low31.6Very low162 Ų162121.8 Ų121.887%0.86671%0.707SS**  000-88.2-17.6000109.4
817G34.1Very low31.5Very low57 Ų57123.3 Ų123.359%0.58871%0.706SS**  00000000111.5I373 G374I373-G817 CarbonylContact O-C 3.18Å; I373-G817 WeakPolarHBondContact O-CA 3.31Å; I373-G817 PolarHBondContact O-N 3.5Å; G374-G817 CarbonylContact O-C 2.34Å; G374-G817 WeakPolarHBondContact O-CA 3.32Å
818T32.5Very low31.8Very low38 Ų38124.7 Ų124.723%0.23370%0.702CS.*  00041.40000110.3I373 G374 T375I373-T818 CovalentContact C-CA 1.37Å; I373-T818 CovalentContact C-CB 0.88Å; I373-T818 CovalentContact C-CG2 1.21Å; I373-T818 CarbonylContact C-O 3.49Å; I373-T818 VanDerWaalsContact CA-C 3.44Å; I373-T818 CovalentContact CA-CB 1.81Å; I373-T818 CovalentContact CA-CG2 1.49Å; I373-T818 WeakPolarHBondContact CA-OG1 3.41Å; I373-T818 CovalentContact CB-CG2 1.57Å; I373-T818 HydrophobicContact CB-CG2 1.57Å; I373-T818 HydrophobicContact CD1-CG2 4.11Å; I373-T818 HydrophobicContact CG1-CG2 3.1Å; I373-T818 HydrophobicContact CG2-CG2 1.89Å; I373-T818 VanDerWaalsContact CG2-OG1 3.28Å; I373-T818 WeakPolarHBondContact CG2-OG1 3.19Å; I373-T818 CarbonylContact O-C 3.51Å; I373-T818 WeakPolarHBondContact O-CA 3.37Å; I373-T818 WeakPolarHBondContact O-CB 3.37Å; I373-T818 WeakPolarHBondContact O-CG2 3.43Å; I373-T818 CovalentContact O-N 1.69Å; I373-T818 PolarHBondContact O-N 2.85Å; I373-T818 PolarHBondContact O-OG1 3.3Å; G374-T818 CarbonylContact C-O 3.35Å; G374-T818 WeakPolarHBondContact CA-O 3.29Å; G374-T818 CovalentContact CA-OG1 1.08Å; G374-T818 WeakPolarHBondContact CA-OG1 3.41Å; G374-T818 CovalentContact N-CA 1.54Å; G374-T818 CovalentContact N-CB 0.82Å; G374-T818 PolarHBondContact N-O 3.46Å; G374-T818 CovalentContact N-OG1 1.09Å; G374-T818 PolarHBondContact N-OG1 3.26Å; G374-T818 WeakPolarHBondContact O-CB 3.22Å; G374-T818 PolarHBondContact O-N 3.17Å; G374-T818 PolarHBondContact O-OG1 2.44Å; T375-T818 PolarHBondContact N-OG1 3.33Å; T375-T818 VanDerWaalsContact N-OG1 3.13Å
819T30.2Very low31.9Very low72 Ų72124.7 Ų124.744%0.44270%0.702SS.*  00043.70000110.9A371 S372 I373A371-T819 HydrophobicContact CB-CG2 4.18Å; S372-T819 WeakPolarHBondContact CA-OG1 3.49Å; I373-T819 WeakPolarHBondContact CA-OG1 3.48Å; I373-T819 PolarHBondContact N-OG1 2.81Å
820T30.9Very low31.9Very low95 Ų95123.1 Ų123.158%0.58370%0.699SS**  0143.1040.80000109.7A371A371-T820 HydrophobicContact CB-CG2 4.27Å
821T29.1Very low32.1Very low89 Ų89124.6 Ų124.655%0.54670%0.701SS.*  68.9136.891.5-2.10000110.6
822T30.2Very low32.1Very low122 Ų122123.4 Ų123.475%0.74870%0.703SS**  109.8134.592.31.90000109.3
823T34.7Very low32.5Very low135 Ų135120.9 Ų120.983%0.82870%0.701SS**  trans-50.90173.5-20.50000111.4
824I28.4Very low32.5Very low157 Ų157121.8 Ų121.881%0.80570%0.704SS**  0130.90-62.8177.2000108.1
825T26.6Very low32.3Very low116 Ų116121.4 Ų121.471%0.71270%0.704SS**  71.6132.590.7-70000110.2
826I34.4Very low32.2Very low164 Ų164120.3 Ų120.384%0.84171%0.706SS**  trans166.9108.1132.3-56.7177.6000107.7
827N28.9Very low32.1Very low156 Ų156117.1 Ų117.183%0.83470%0.697SS**  47.30111.5-102.613.6000111.7
828P37.7Very low32.1Very low98 Ų98120.4 Ų120.464%0.63670%0.699SS**  0146.1033.9-4.9000112.1
829L28.4Very low32.1Very low154 Ų154125.2 Ų125.281%0.80672%0.724SS**  106.1086.4-105.7116.2000109.9
830T31.8Very low31.9Very low120 Ų120126.3 Ų126.374%0.73673%0.734SS**  0124.80440000108.8
831H33.7Very low31.6Very low183 Ų183127.7 Ų127.785%0.84774%0.743SS**  161.3104.9113-91.6-76.3000109.3
832A32.4Very low31.4Very low88 Ų88130.4 Ų130.473%0.72775%0.753SS**  28.20107.200000111.4
833P41.8Very low31.2Very low110 Ų110128.7 Ų128.771%0.71474%0.743SS**  00033-4.2000112
834I33.3Very low30.8Very low150 Ų150125.6 Ų125.677%0.76972%0.724SS**  000-58.8174.3000108
835N32.2Very low30.8Very low151 Ų151124.1 Ų124.181%0.80772%0.716SS**  0109.80-106.2-5.6000110.1
836S32.5Very low30.9Very low109 Ų109124 Ų12476%0.76271%0.711SS**  143.7109.297.557.40000109.4
837S31.4Very low30.6Very low95 Ų95122.4 Ų122.466%0.66471%0.709SS**  78.3121.380.9780000110.3
838I34Very low30.7Very low126 Ų126118.2 Ų118.265%0.64670%0.696SS**  144116.595.6-58.8175.1000108.1
839N31.4Very low30.5Very low140 Ų140117.4 Ų117.475%0.74969%0.69SS**  114.3124.292.8-84.7-13.6000110.1
840S25.7Very low30.7Very low94 Ų94114.2 Ų114.266%0.65768%0.677SS**  80.1129.890.258.70000110.3
841T25Very low30.8Very low125 Ų125113.9 Ų113.977%0.76768%0.675SS**  80.8122.911619.40000109.9
842L25.7Very low30.9Very low146 Ų146110.5 Ų110.576%0.76466%0.663SS**  105.7120.6123.4-155.379.1000109.5
843T26.3Very low31Very low85 Ų85110.1 Ų110.152%0.52165%0.648SS.*  105.4121.1113.126.70000109.1
844T25.1Very low30.7Very low71 Ų71109.8 Ų109.844%0.43664%0.644SS.*  53.1124.4112.7-46.40000110
845I28.3Very low30.7Very low126 Ų126107.9 Ų107.965%0.64664%0.644SS**  126.7119.7115.4-63.8176.2000108.1
846N28.5Very low31Very low113 Ų113104.9 Ų104.960%0.60464%0.64SS**  78127.9102.3-86.4-8000110.7
847T29.5Very low31.2Very low130 Ų130106.9 Ų106.980%0.79864%0.641SS**  137.4116.6108.816.40000109.1
848A30.2Very low31.3Very low68 Ų68107.9 Ų107.956%0.56264%0.639SS**  98.5117.3100.700000109.9
849T33.4Very low31.3Very low82 Ų82108.9 Ų108.950%0.50365%0.646SS.*  92.312298.717.90000109.9L281 A282L281-T849 VanDerWaalsContact O-CG2 3.22Å; L281-T849 WeakPolarHBondContact O-CG2 3.45Å; A282-T849 HydrophobicContact CB-CG2 3.58Å
850T33.6Very low31.3Very low87 Ų87106 Ų10653%0.53465%0.649SS.*  105.2125.693.9-5.60000109.7A282A282-T850 VanDerWaalsContact O-CG2 3.23Å; A282-T850 WeakPolarHBondContact O-CG2 3.28Å
851T33.7Very low31.7Very low113 Ų113106 Ų10669%0.69365%0.649SS**  118.7124.995.237.90000109.5
852N34.3Very low32.1Very low112 Ų112107.4 Ų107.460%0.59965%0.647SS**  80.1088.4-93-12.5000111V390 I391V390-N852 WeakPolarHBondContact CG1-O 3.45Å; V390-N852 WeakPolarHBondContact CG2-O 3.47Å; I391-N852 WeakPolarHBondContact CD1-O 3.24Å
853I35.2Very low32.4Very low79 Ų79106.2 Ų106.241%0.40564%0.641SS.*  000-54.4175.5000108.9V390 I391V390-I853 WeakPolarHBondContact CA-O 3.44Å; V390-I853 VanDerWaalsContact CB-O 3.27Å; V390-I853 WeakPolarHBondContact CB-O 3.26Å; V390-I853 WeakPolarHBondContact CG1-O 3.31Å; V390-I853 VanDerWaalsContact CG2-O 3.25Å; V390-I853 WeakPolarHBondContact CG2-O 3.41Å; I391-I853 HydrophobicContact CD1-CB 4Å; I391-I853 HydrophobicContact CG1-CB 3.85Å; I391-I853 WeakPolarHBondContact CG1-O 3.21Å
854T35.4Very low32.8Very low103 Ų103110.8 Ų110.863%0.63265%0.654SS**  0134.5026.50000109.9
855S34.1Very low33.1Very low110 Ų110114.1 Ų114.177%0.76967%0.669SS**  98.3080.954.90000110.1
856A37.1Very low33.1Very low88 Ų88114 Ų11473%0.72767%0.669SS**  00000000109.6
857L37.8Very low33.1Very low151 Ų151114.6 Ų114.679%0.79167%0.671SS**  000-111.7122.2000109.3
858D32.7Very low33.1Very low116 Ų116114 Ų11462%0.6267%0.67SS**  000-137.71.9000109.6
859N34.2Very low33Very low148 Ų148117.6 Ų117.679%0.79168%0.679SS**  000-94.9-3.9000110
860G31.5Very low32.6Very low78 Ų78118.8 Ų118.880%0.80468%0.682SS**  00000000110
861S33.7Very low32.3Very low94 Ų94119.8 Ų119.866%0.65769%0.692SS**  0122.60-160.70000110.8
862H33.8Very low32Very low156 Ų156119.4 Ų119.472%0.72269%0.694SS**  134.3116.692.8-92.3-59.2000109.8
863N32.6Very low31.7Very low120 Ų120120.2 Ų120.264%0.64270%0.704SS**  115.2114.192.4-108.6-5.3000110.5
864K33.1Very low31.3Very low182 Ų182122.5 Ų122.579%0.79172%0.721SS**  136.39885-89.8-177.9-176.6174.50109.6
865N31.4Very low31Very low141 Ų141123.7 Ų123.775%0.75473%0.728SS**  11.1126.9110.7-73-18.9000112.3
866N29.4Very low30.7Very low123 Ų123125.8 Ų125.866%0.65873%0.729SS**  112.1131.966.3-95.40.4000110.4
867I28.7Very low30.5Very low126 Ų126126.5 Ų126.565%0.64673%0.727SS**  145.1146.580.2-61.1171000108.3
868P29.8Very low30.1Very low117 Ų117124.1 Ų124.176%0.7673%0.729SS**  -167.6124.395.433.6-5.3000111.4
869L26.5Very low29.9Very low144 Ų144125.5 Ų125.575%0.75474%0.735SS**  trans-139.4126.1160.3-86.1154.1000109.5
870N26.1Very low29.8Very low106 Ų106130.4 Ų130.457%0.56774%0.742SS**  71.30102.13.9-5.3000110.7
871S27.2Very low30Very low108 Ų108134 Ų13476%0.75573%0.732SS**  0125.80-71.50000109.8
872S27.5Very low30Very low105 Ų105141.5 Ų141.573%0.73475%0.745SS**  104.4126.692.2-66.70000109.9
873T27.2Very low29.9Very low130 Ų130144.9 Ų144.980%0.79875%0.752SS**  133.3115.697.317.20000109.1
874V26.6Very low30Very low126 Ų126150.8 Ų150.876%0.76477%0.765SS**  149.1109.2115.6175.80000108
875V29.5Very low29.6Very low128 Ų128149.6 Ų149.678%0.77677%0.767SS**  143.696.1118.8176.10000107.9
876L27.6Very low29.7Very low154 Ų154151.6 Ų151.681%0.80677%0.769SS**  trans-84.2150.7162.1-96.7121.2000110.1
877P33.4Very low29.6Very low103 Ų103150.1 Ų150.167%0.66977%0.774SS**  cis-179.713345.133-4.5000112
878A29.4Very low29.8Very low102 Ų102152.5 Ų152.584%0.84378%0.782SS**  trans-14595.3148.400000109.5
879I28.4Very low30Very low145 Ų145154.8 Ų154.874%0.74479%0.788SS**  -23.589.9129.7-64.7174.6000110
880R32.8Very low30.2Very low250 Ų250151.1 Ų151.194%0.94379%0.785SS**  trans-96.4105.1151.3-123.8-178.8-172.2137-0.4110.3
881R34.8Very low30.6Very low155 Ų155154.3 Ų154.359%0.58580%0.801SS**  trans-19.7116132.9-101.2-172.2-175.9155.31.3111.7
882R33.8Very low30.8Very low250 Ų250158.3 Ų158.394%0.94380%0.804SS**  trans-124.5107.8135.8-98.8-165.9-160.5175.20.7109.9
883R31.6Very low31.4Very low227 Ų227158.2 Ų158.286%0.85780%0.801SS**  -18.9107.7125-99.2-170.7-160.1177.21.2111.8
884R34.4Very low31.6Very low245 Ų245159.6 Ų159.693%0.92580%0.802SS**  trans-147.4104.9137.1-104.3-171.1-173.3171.10.8109.4
885L26.1Very low32Very low157 Ų157159 Ų15982%0.82280%0.799SS**  -4.2108.8126.3-74.5164.3000111.5
886F32.2Very low32Very low182 Ų182159.8 Ų159.880%0.79880%0.799SS**  169.1109122.3-97.5-81.2000108.9
887A28.2Very low32.1Very low92 Ų92157.6 Ų157.676%0.7679%0.791SS**  5.2108.2125.900000111.5
888Q33.5Very low32Very low177 Ų177158.6 Ų158.683%0.82779%0.79SS**  154.3107.9111.8-115.3178.913.100109.3
889N32.8Very low32.1Very low164 Ų164162 Ų16288%0.87779%0.789SS**  56.5107.2116.4-75.9-15.1000111.3
890G31.6Very low32.1Very low68 Ų68160 Ų16070%0.70179%0.787SS**  84.2107.598.400000111.1
891I33.7Very low32.2Very low173 Ų173152.9 Ų152.989%0.88777%0.773SS**  142.8107.9102.8-63.6178.4000107.8
892K31.5Very low32Very low192 Ų192155.2 Ų155.284%0.83579%0.788SS**  3.80127.1-85.7-178.5-174.9-171.90111.8
893P39.7Very low31.8Very low102 Ų102150.4 Ų150.466%0.66278%0.78SS**  00034.2-5.3000112
894I32.9Very low31.8Very low160 Ų160145.2 Ų145.282%0.82177%0.77SS**  0113.10-62.4174.4000107.9
895T33.3Very low31.7Very low114 Ų114140.2 Ų140.270%0.69976%0.756SS**  25.2124.8114.627.60000111
896N30.1Very low32.1Very low144 Ų144138 Ų13877%0.7775%0.749SS**  116122.694.1-91.1-7.6000110.2
897V30.7Very low32.1Very low107 Ų107137.6 Ų137.665%0.64876%0.756SS**  130.7112.995.4177.30000108.3
898I31.3Very low32.4Very low125 Ų125137.8 Ų137.864%0.64175%0.751SS**  141.2107.1106.4-62.2179.5000108
899Q30.3Very low32.2Very low174 Ų174133.2 Ų133.281%0.81373%0.731SS**  102.3101.4115.6-117.3168.1-14.400109.8
900S28.3Very low32.2Very low103 Ų103131.2 Ų131.272%0.7272%0.72SS**  trans2.1154140.948.10000111.8
901P34.8Very low32.3Very low99 Ų99135.6 Ų135.664%0.64373%0.727SS**  cis-167.3125.122.133.3-4.6000111.8
902F30.4Very low32.2Very low204 Ų204136.2 Ų136.290%0.89573%0.727SS**  trans-178.695.4144.3-101-82.3000108.9
903L30.7Very low32.6Very low149 Ų149131.6 Ų131.678%0.7872%0.718SS**  15110.1120.3-86.7162.1000111.3
904N31Very low32.4Very low119 Ų119134 Ų13464%0.63673%0.726SS**  114.2110.6108.9-105.8-3.6000110.2
905H33.8Very low32.6Very low140 Ų140130.2 Ų130.265%0.64871%0.707SS**  94.8108.7110.7-83.6-67.6000110.3
906T34Very low32.6Very low109 Ų109127.9 Ų127.967%0.66970%0.696SS**  67.496.9105.852.70000110.3S908T906-S908 PolarHBondContact O-N 3.16Å
907N32.7Very low32.9Very low175 Ų175126.7 Ų126.794%0.93669%0.694SS**  trans-36.788.5144.9-79.5-22.1000111.8
908S33.9Very low33.1Very low95 Ų95126.4 Ų126.466%0.66469%0.692SS**  40.299101.4-174.10000111T906T906-S908 PolarHBondContact O-N 3.16Å
909M29.8Very low33.3Very low82 Ų82128.1 Ų128.140%0.40470%0.699SS.*SBend-20.50110.7-91.5166.415900111.5C7 V8C7-M909 HydrophobicContact CB-CE 4.46Å; C7-M909 WeakPolarHBondContact O-CE 3.27Å; V8-M909 HydrophobicContact CB-CE 3.27Å; V8-M909 HydrophobicContact CG1-CE 4.14Å; V8-M909 HydrophobicContact CG2-CE 4.5Å; V8-M909 CovalentContact O-CE 1.62Å; V8-M909 WeakPolarHBondContact O-CE 2.55Å
910N32.5Very low33.6Very low121 Ų121126.8 Ų126.865%0.64770%0.698SS**  0109.80-77.4-17.9000110.4
911D32.7Very low34Very low160 Ų160127 Ų12786%0.85670%0.699SS**  -164.985.5118.1-88.1-21.7000109.3
912E32.9Very low34.1Very low186 Ų186129.5 Ų129.587%0.86971%0.713SS**  trans-45.1100.8131.8-99.2179.9176.700111.4
913S38Very low34.5Very low95 Ų95123.4 Ų123.466%0.66471%0.707SS**  62.509963.90000110.8
914N35.9Very low34.9Very low152 Ų152123.5 Ų123.581%0.81371%0.708SS**  000-75.4-21.3000111.9
915N37.4Very low35.2Very low82 Ų82124.2 Ų124.244%0.43971%0.713SS.*  000-113.22.4000109.9V940 N941N915-V940 VanDerWaalsContact ND2-CG1 3.28Å; N915-V940 WeakPolarHBondContact ND2-CG1 3.46Å; N915-N941 WeakPolarHBondContact CB-ND2 3.37Å; N915-N941 VanDerWaalsContact CG-ND2 3.33Å; N915-N941 PolarHBondContact ND2-ND2 3.11Å
916S32.5Very low35.3Very low65 Ų65123.7 Ų123.746%0.45572%0.719SS.*  0117.2078.90000109.7M1M1-S916 WeakPolarHBondContact CE-OG 3.08Å
917T36.5Very low35.5Very low118 Ų118126.3 Ų126.372%0.72473%0.729SS**  142.1114.4102.514.80000108.9
918V36.2Very low35.4Very low101 Ų101125.5 Ų125.561%0.61273%0.725SS**  64.4081.9178.20000109.2
919M36Very low35.7Very low161 Ų161125.7 Ų125.779%0.79372%0.724SS**  000-88.4-97.2-117.900109
920N36Very low35.8Very low147 Ų147127.6 Ų127.679%0.78674%0.74SS**  000-1091.1000111.9
921S35.9Very low35.7Very low108 Ų108128 Ų12876%0.75575%0.747SS**  000-38.90000109.2
922T38.1Very low35.7Very low151 Ų151124.9 Ų124.993%0.92674%0.738SS**  000-290000109.8
923G38.2Very low35.6Very low75 Ų75123 Ų12377%0.77373%0.734SS**  00000000110.4
924D38.9Very low35.3Very low151 Ų151123.1 Ų123.181%0.80773%0.734SS**  000-102.1-12.5000110.7
925D36.9Very low35.2Very low135 Ų135122.8 Ų122.872%0.72273%0.731SS**  000-75.1-25.9000109.6
926T37Very low35Very low128 Ų128125.6 Ų125.679%0.78575%0.746SS**  00038.70000111.3
927N37.9Very low34.9Very low164 Ų164128.1 Ų128.188%0.87776%0.762SS**  0109.80-76.6-33.7000109.5
928N31Very low34.8Very low159 Ų159126.9 Ų126.985%0.8576%0.764SS**  55.2150.5112.1-132.713000111.4
929P39.4Very low34.6Very low99 Ų99127.7 Ų127.764%0.64377%0.765SS**  cis-123.8141.8-35.734.2-5.5000111.9
930T31.3Very low34.6Very low122 Ų122123.2 Ų123.275%0.74875%0.746SS**  trans112.8112.2136.828.10000109.3
931V30.9Very low34.6Very low130 Ų130121.1 Ų121.179%0.78874%0.735SS**  93111.4117.9-175.90000108.6
932S32.8Very low34.5Very low94 Ų94123.1 Ų123.166%0.65774%0.737SS**  142.8111.8121.5-30.60000109.3
933D30.4Very low34.5Very low147 Ų147121.1 Ų121.179%0.78673%0.729SS**  95.5108.2110-87-19.3000110.1
934S33.3Very low34.3Very low96 Ų96124.6 Ų124.667%0.67173%0.73SS**  101.60113.6-45.60000110
935L33.1Very low34.3Very low145 Ų145123.9 Ų123.976%0.75973%0.727SS**  000-86.7158.9000110
936L33.3Very low34.3Very low142 Ų142123.8 Ų123.874%0.74373%0.726SS**  0117.30-110.3132.2000110
937C30Very low34.2Very low117 Ų117124 Ų12479%0.79172%0.722SS**  78.8094.8-790000110
938A33.3Very low34.2Very low93 Ų93122.7 Ų122.777%0.76972%0.715SS**  00000000109.2
939N32.2Very low34.4Very low118 Ų118121.6 Ų121.663%0.63171%0.71SS**  000-127.21000110
940V37.4Very low34.1Very low66 Ų66123.4 Ų123.440%0.471%0.714SS.*  000-179.70000109.5N915N915-V940 VanDerWaalsContact ND2-CG1 3.28Å; N915-V940 WeakPolarHBondContact ND2-CG1 3.46Å
941N35.3Very low34.3Very low104 Ų104125 Ų12556%0.55672%0.718SS**  01310-81-16000110.6N915N915-N941 WeakPolarHBondContact CB-ND2 3.37Å; N915-N941 VanDerWaalsContact CG-ND2 3.33Å; N915-N941 PolarHBondContact ND2-ND2 3.11Å
942N34Very low34.6Very low149 Ų149124.9 Ų124.980%0.79771%0.713SS**  121.5120.499.6-117.1-3.8000110.2
943S36.9Very low34.8Very low109 Ų109128.6 Ų128.676%0.76273%0.725SS**  154.8111.5108.4-78.20000109.1
944N35.5Very low35.1Very low148 Ų148126.5 Ų126.579%0.79172%0.722SS**  5.3112.6121.7-97.83.2000112.2
945D37.6Very low35.5Very low137 Ų137127.1 Ų127.173%0.73372%0.722SS**  trans169.5107.7130.1-82.4-25.1000109.1
946N37.3Very low35.7Very low133 Ų133126.4 Ų126.471%0.71172%0.718SS**  72.393.8108.2-89.6-14.3000111.1
947D36Very low35.8Very low132 Ų132125.6 Ų125.671%0.70672%0.715SS**  139.1100.8117.3-82.1-24.1000109.3
948D37.1Very low36.1Very low136 Ų136126.8 Ų126.873%0.72771%0.714SS**  81.1102.8112.2-76.6-24.6000110.4
949N35.1Very low36.3Very low137 Ų137126.4 Ų126.473%0.73371%0.71SS**  96.40100.2-89.9-11000110.6
950N33.3Very low36.4Very low136 Ų136128.7 Ų128.773%0.72772%0.723SS**  0112.30-92.4-11.3000109.9
951N36.1Very low36.1Very low156 Ų156128.6 Ų128.683%0.83474%0.735SS**  -160.6103.7122.9-94.2-4.7000110
952D36.9Very low35.8Very low128 Ų128130.7 Ų130.768%0.68474%0.744SS**  46.6089.5-82.7-19.5000111.3
953N35.9Very low35.7Very low172 Ų172130.3 Ų130.392%0.9274%0.742SS**  098.40-84.8-4000110
954S37.1Very low35.4Very low103 Ų103132 Ų13272%0.7274%0.743SS**SBend166.2105.4106.2119.40000109.4
955V42.1Very low35.2Very low109 Ų109130.1 Ų130.166%0.66174%0.741SS**  123.597.587.7-178.70000108.5
956D36.6Very low34.8Very low129 Ų129131.2 Ų131.269%0.6975%0.747SS**  89.2106.7111.1-81.6-30.5000110.2
957N37Very low34.4Very low125 Ų125135.8 Ų135.867%0.66875%0.754SS**  110.2109.4104.8-81.7-26.3000110.4
958D35.2Very low34.1Very low143 Ų143136.1 Ų136.177%0.76576%0.756SS**  107.4114.8104.3-80.4-25.8000109.9
959A36.9Very low33.6Very low85 Ų85134.4 Ų134.470%0.70276%0.755SS**  100111.3107.600000110
960N34.7Very low33.2Very low166 Ų166134.8 Ų134.889%0.88876%0.756SS**  108.5121109.3-93.7-7.2000110.5
961G32.4Very low33.1Very low63 Ų63133.7 Ų133.765%0.64975%0.754SS**  80.6114.3102.500000111.6
962I29Very low32.8Very low149 Ų149131.7 Ų131.776%0.76475%0.748SS**  75.6121.9113.8-57.1-176.3000109.3
963N31.8Very low32.6Very low140 Ų140130 Ų13075%0.74975%0.746SS**  148.4120.3114-95.5-8000110
964N29.1Very low32.6Very low146 Ų146128.3 Ų128.378%0.78174%0.736SS**  41.7099.7-95.6-2.1000111.9
965S31.3Very low32.4Very low108 Ų108129.9 Ų129.976%0.75574%0.737SS**  0117.30-59.20000110
966N29.1Very low31.9Very low160 Ų160132.3 Ų132.386%0.85674%0.741SS**  16.2108.7114.4-95.3-5.5000112.1
967R30.3Very low31.7Very low228 Ų228131.5 Ų131.586%0.8674%0.736SS**  112.2114124.6-106.2-167-173.8153.6-0.2109.5
968D29Very low31.5Very low139 Ų139133.3 Ų133.374%0.74374%0.738SS**  66.8112.2101.1-79-24.4000110.5
969S27.7Very low31.3Very low101 Ų101134.1 Ų134.171%0.70674%0.737SS**  121.6113.6105.6-106.30000109.5
970L26.1Very low31Very low145 Ų145134.2 Ų134.276%0.75973%0.732SS**  125119.2109.5-14880.7000109.3
971T31.7Very low30.7Very low112 Ų112133.4 Ų133.469%0.68773%0.728SS**  155.9118.6106.843.90000109.1
972T29.1Very low30.6Very low115 Ų115135.1 Ų135.171%0.70673%0.726SS**  103116.793.7-49.40000109.4
973C32.4Very low30.6Very low93 Ų93134 Ų13463%0.62872%0.72SS**  157.7113.6101-69.10000109
974D35.9Very low30.5Very low135 Ų135135.6 Ų135.672%0.72272%0.723SS**  146.2112.994.8-87.2-32.8000109.5
975N33.5Very low30.5Very low137 Ų137133.7 Ų133.773%0.73372%0.721SS**  95.3114.598.3-85.1-15.5000110.6
976E31.5Very low30.9Very low159 Ų159133.8 Ų133.874%0.74372%0.719SS**  126.8116101.3-85.7-128.7145.700109.7
977L31.6Very low30.9Very low112 Ų112133.2 Ų133.259%0.58672%0.716SS**  110.6113.7106.2-113129.6000109.8
978K33.3Very low31Very low164 Ų164131 Ų13171%0.71371%0.713SS**  94.1118112.4-102.8176.7176.8-174.90110.2
979Q32Very low31.1Very low160 Ų160131 Ų13175%0.74871%0.712SS**  104.7120.2110.4-92.9-177.118.900109.9
980S29.6Very low31.3Very low86 Ų86132.5 Ų132.560%0.60172%0.717SS**  99.2123.2101.3-26.60000110
981D27.5Very low32Very low149 Ų149130.8 Ų130.880%0.79772%0.715SS**  80.2125.6107.8-83.4-20.9000110.2
982T30.5Very low31.9Very low100 Ų100130.5 Ų130.561%0.61372%0.717SS**  118.4118112.4-51.60000109.3
983I29.8Very low32Very low124 Ų124130.8 Ų130.864%0.63672%0.719SS**  106.3117.3102.6-63.7-176.8000108.5
984Q30.4Very low32Very low175 Ų175136 Ų13682%0.81873%0.731SS**  104108.7109.8-99.8-176.5-0.400109.8
985S27.9Very low31.7Very low105 Ų105135 Ų13573%0.73474%0.735SS**  17.20124.832.40000111.7
986P40.1Very low31.6Very low110 Ų110134.2 Ų134.271%0.71474%0.74SS**  00033.8-4.9000112.1
987D29.6Very low31.6Very low148 Ų148131.5 Ų131.579%0.79175%0.745SS**  0119.60-91.4-19.9000109.4
988K31.7Very low31.6Very low183 Ų183131.4 Ų131.480%0.79675%0.754SS**  103.7119.4100-145.3166.6-161.4-122.90109.8
989L30.6Very low31.4Very low138 Ų138130.1 Ų130.172%0.72376%0.759SS**  94.9084-80.8160.2000109.8
990T33.2Very low31.4Very low133 Ų133129.5 Ų129.582%0.81676%0.76SS**  000360000109
991P40.2Very low31.8Very low108 Ų108130.1 Ų130.170%0.70176%0.762SS**  00033.6-4.7000111.9
992S29.6Very low31.9Very low106 Ų106128 Ų12874%0.74176%0.755SS**  00046.20000109.4
993T32.2Very low31.7Very low121 Ų121131.9 Ų131.974%0.74276%0.763SS**  00044.10000109.4
994K30.8Very low31.6Very low202 Ų202137.9 Ų137.988%0.87878%0.778SS**  0114.80-85.9-175-176.4179.30109.8
995S31.1Very low31.5Very low115 Ų115133.9 Ų133.980%0.80477%0.769SS**  49.8087.277.20000111.1
996S31.3Very low31.5Very low120 Ų120136 Ų13684%0.83977%0.772SS**  00037.90000111.8
997A31Very low31.2Very low102 Ų102137.8 Ų137.884%0.84378%0.781SS**  00000000110.8
998S31.2Very low31.1Very low111 Ų111138.1 Ų138.178%0.77678%0.782SS**  000149.80000110.6
999T29.9Very low31.2Very low136 Ų136133.9 Ų133.983%0.83477%0.774SS**  0112.40-46.80000110.3
1000I30.5Very low31.1Very low147 Ų147135.9 Ų135.975%0.75478%0.779SS**  28.80118.8-59.8-175.1000110.2
1001P38.7Very low30.7Very low100 Ų100134.2 Ų134.265%0.64977%0.773SS**  00034.1-5.7000112.1
1002T29.4Very low30.3Very low105 Ų105133.8 Ų133.864%0.64477%0.768SS**  0004.10000109.5
1003F27.4Very low30.2Very low180 Ų180136.1 Ų136.179%0.78977%0.767SS**  000-99-81.4000109.2
1004R27.5Very low29.9Very low251 Ų251136.3 Ų136.395%0.94776%0.764SS**  000-133.3-177.2-176173.2-1.1109.3
1005S27.9Very low29.8Very low91 Ų91131.2 Ų131.264%0.63675%0.749SS**  000-72.60000110.9
1006N28.2Very low29.6Very low150 Ų150133.5 Ų133.580%0.80275%0.747SS**  000-78.7-13.2000109.6
1007T34Very low29.7Very low146 Ų146134.2 Ų134.290%0.89674%0.741SS**  01110-22.90000108.8
1008L26.9Very low29.6Very low155 Ų155132.9 Ų132.981%0.81273%0.725SS**  -1.40122.5-146.177.5000111.8
1009P34.1Very low29.3Very low95 Ų95129.7 Ų129.762%0.61770%0.699SS**  0149.4034.9-5.9000112.9
1010Q28.6Very low29.3Very low179 Ų179126 Ų12684%0.83667%0.672SS**  109.4118.6105.6-97.8-168.61.900109.7
1011S25Very low29.4Very low99 Ų99121.9 Ų121.969%0.69265%0.651SS**  52.5131.391124.20000111
1012V31.2Very low29Very low99 Ų99120.8 Ų120.860%0.665%0.646SS**  141.5122.1114.9-176.50000108.3
1013E27.3Very low29.1Very low154 Ų154119.9 Ų119.972%0.7264%0.64SS**  94.7117.495.8-81.9-165.117300110.2
1014D26.6Very low29.5Very low126 Ų126115 Ų11567%0.67462%0.622SS**  109.8119.8106-89.7-15.4000109.9
1015V27.8Very low29.7Very low94 Ų94110 Ų11057%0.5761%0.613SS**  97.1112.581.2176.70000108.8
1016Q27Very low29.8Very low163 Ų163111.6 Ų111.676%0.76261%0.61SS**  119.3112103.2-141.6156.4-16.200109.7
1017L32.6Very low29.7Very low136 Ų136112.6 Ų112.671%0.71261%0.608SS**  141.8109.6110.7-155.579.7000109.1
1018C29Very low29.4Very low74 Ų74110.5 Ų110.550%0.560%0.595SS.*  89.311799.1-94.90000109.5S366 I367S366-C1018 CarbonylContact O-C 1.84Å; S366-C1018 WeakPolarHBondContact O-CA 3.48Å; I367-C1018 CarbonylContact O-C 2.19Å
1019N26.7Very low29.4Very low43 Ų43108.2 Ų108.223%0.2359%0.592CS.*  80.7119.385.5-91.2-7.6000111.6S366 I367 T368S366-N1019 CovalentContact C-OD1 0.82Å; S366-N1019 WeakPolarHBondContact CA-ND2 2.99Å; S366-N1019 WeakPolarHBondContact CA-OD1 3.33Å; S366-N1019 WeakPolarHBondContact CB-ND2 1.85Å; S366-N1019 WeakPolarHBondContact CB-OD1 3.35Å; S366-N1019 PolarHBondContact N-OD1 2.94Å; S366-N1019 CarbonylContact O-C 2.82Å; S366-N1019 WeakPolarHBondContact O-CA 3.36Å; S366-N1019 WeakPolarHBondContact O-CB 3.31Å; S366-N1019 CovalentContact O-CG 1.7Å; S366-N1019 PolarHBondContact O-N 3.46Å; S366-N1019 PolarHBondContact O-ND2 3.44Å; S366-N1019 PolarHBondContact O-OD1 3.18Å; S366-N1019 PolarHBondContact OG-OD1 3.5Å; I367-N1019 CovalentContact C-C 1.54Å; I367-N1019 CarbonylContact C-O 3.59Å; I367-N1019 WeakPolarHBondContact CA-OD1 3.39Å; I367-N1019 HydrophobicContact CB-CB 3.02Å; I367-N1019 WeakPolarHBondContact CB-ND2 3.04Å; I367-N1019 WeakPolarHBondContact CB-OD1 3.43Å; I367-N1019 HydrophobicContact CG1-CB 4.13Å; I367-N1019 HydrophobicContact CG2-CB 4.14Å; I367-N1019 PolarHBondContact N-OD1 3.47Å; I367-N1019 CarbonylContact O-C 3.49Å; I367-N1019 WeakPolarHBondContact O-CA 3.43Å; I367-N1019 CovalentContact O-CB 1.39Å; I367-N1019 WeakPolarHBondContact O-CB 1.76Å; I367-N1019 PolarHBondContact O-N 3.37Å; T368-N1019 CarbonylContact C-O 3.06Å; T368-N1019 WeakPolarHBondContact CA-O 3.18Å; T368-N1019 WeakPolarHBondContact CB-O 3.26Å; T368-N1019 PolarHBondContact N-O 2.79Å; T368-N1019 VanDerWaalsContact OG1-C 3.28Å; T368-N1019 PolarHBondContact OG1-O 3.21Å
1020Q28.6Very low29Very low58 Ų58112.5 Ų112.527%0.27160%0.601SS.*  123.4115.3114.7-15588.936.100110.3I367 T368 K369I367-Q1020 VanDerWaalsContact C-C 3.42Å; I367-Q1020 HydrophobicContact CB-CB 2.86Å; I367-Q1020 CovalentContact CB-CD 1.52Å; I367-Q1020 HydrophobicContact CB-CG 2.67Å; I367-Q1020 CovalentContact CB-OE1 1.05Å; I367-Q1020 HydrophobicContact CG1-CB 4.18Å; I367-Q1020 HydrophobicContact CG1-CG 3.77Å; I367-Q1020 VanDerWaalsContact CG2-CA 3.41Å; I367-Q1020 HydrophobicContact CG2-CB 2.53Å; I367-Q1020 HydrophobicContact CG2-CG 1.54Å; I367-Q1020 CovalentContact CG2-OE1 1.22Å; I367-Q1020 VanDerWaalsContact O-CA 3.23Å; I367-Q1020 WeakPolarHBondContact O-CA 2.28Å; I367-Q1020 WeakPolarHBondContact O-CB 3.34Å; I367-Q1020 PolarHBondContact O-N 2.66Å; I367-Q1020 PolarHBondContact O-OE1 3.46Å; I367-Q1020 VanDerWaalsContact O-OE1 3.07Å; T368-Q1020 CarbonylContact C-O 3.5Å; T368-Q1020 CovalentContact CA-CB 1.46Å; T368-Q1020 VanDerWaalsContact CA-N 3.3Å; T368-Q1020 WeakPolarHBondContact CA-O 3Å; T368-Q1020 HydrophobicContact CG2-CB 2.84Å; T368-Q1020 HydrophobicContact CG2-CG 2.72Å; T368-Q1020 VanDerWaalsContact CG2-OE1 3.26Å; T368-Q1020 CovalentContact N-CA 1.5Å; T368-Q1020 CovalentContact N-CB 1Å; T368-Q1020 PolarHBondContact N-O 2.89Å; T368-Q1020 CarbonylContact O-C 3.54Å; T368-Q1020 WeakPolarHBondContact OG1-CB 3.48Å; K369-Q1020 PolarHBondContact N-O 3.04Å
1021I33.3Very low28.8Very low62 Ų62110.9 Ų110.932%0.31860%0.597SS.*  175.40101.5-68.2171.1000108.5T368 K369 T1023T368-I1021 WeakPolarHBondContact O-CD1 3.43Å; T368-I1021 WeakPolarHBondContact O-CG1 3.25Å; K369-I1021 VanDerWaalsContact C-CG1 3.43Å; K369-I1021 CovalentContact CA-CD1 0.48Å; K369-I1021 VanDerWaalsContact CA-CG2 3.48Å; K369-I1021 HydrophobicContact CB-CB 3.05Å; K369-I1021 CovalentContact CB-CD1 1.42Å; K369-I1021 HydrophobicContact CB-CD1 1.42Å; K369-I1021 HydrophobicContact CB-CG1 2.29Å; K369-I1021 HydrophobicContact CB-CG2 2.9Å; K369-I1021 HydrophobicContact CD-CB 3.77Å; K369-I1021 HydrophobicContact CD-CD1 3.71Å; K369-I1021 HydrophobicContact CD-CG1 3.89Å; K369-I1021 HydrophobicContact CD-CG2 2.51Å; K369-I1021 HydrophobicContact CG-CB 2.7Å; K369-I1021 HydrophobicContact CG-CD1 2.39Å; K369-I1021 HydrophobicContact CG-CG1 2.81Å; K369-I1021 CovalentContact CG-CG2 1.88Å; K369-I1021 HydrophobicContact CG-CG2 1.88Å; K369-I1021 CovalentContact N-CD1 1.26Å; K369-I1021 CovalentContact N-CG1 1.41Å; K369-I1021 WeakPolarHBondContact O-CD1 3.45Å; I1021-T1023 HydrophobicContact CG2-CG2 4.43Å
1022S29.1Very low28.8Very low76 Ų76111.4 Ų111.453%0.53160%0.601SS.*  000-141.30000111.3K369K369-S1022 WeakPolarHBondContact CE-O 3.48Å; K369-S1022 PolarHBondContact NZ-O 2.7Å
1023T32.3Very low28.6Very low87 Ų87116.8 Ų116.853%0.53462%0.616SS.*  00048.70000109.3K369 I1021K369-T1023 HydrophobicContact CD-CG2 3.71Å; K369-T1023 CovalentContact NZ-CG2 1.48Å; K369-T1023 PolarHBondContact NZ-OG1 2.31Å; I1021-T1023 HydrophobicContact CG2-CG2 4.43Å
1024D34.9Very low28.6Very low77 Ų77118.5 Ų118.541%0.41262%0.624SS.*  01240-91-13.7000109.8
1025I31.9Very low28.6Very low146 Ų146118.9 Ų118.975%0.74963%0.625SS**  176.8070.6-66.2175.2000108
1026E29.9Very low28.6Very low124 Ų124121.8 Ų121.858%0.57963%0.632SS**  0130.30-125.4176.6-178.600110.6
1027F27.4Very low28.6Very low171 Ų171121.6 Ų121.675%0.7563%0.631SS**  99.2126.378.7-120.9-93.5000109.7
1028T28.3Very low28.5Very low102 Ų102123.4 Ų123.463%0.62663%0.634SS**  45.6134.694.738.30000110.6
1029S25Very low28.5Very low107 Ų107126.2 Ų126.275%0.74864%0.644SS**  13712999.381.90000109.5
1030K25.8Very low28.6Very low186 Ų186128.9 Ų128.981%0.80967%0.665SS**  63.8117.595-114175.9-178.3-174.90110.9
1031L24.6Very low28.8Very low144 Ų144131.6 Ų131.675%0.75469%0.686SS**  135.8116.6105.1-143.8100.8000109.3
1032S24.5Very low28.5Very low110 Ų110135.5 Ų135.577%0.76970%0.703SS**  80.8116.9103.2-109.60000110.5
1033K27.5Very low28.5Very low212 Ų212140.2 Ų140.292%0.92271%0.71SS**  1.5109.9128.4-96.5-178-174-179.60111.8
1034E27.3Very low28.4Very low190 Ų190141.3 Ų141.389%0.88871%0.713SS**  trans-158.3105.7137.2-129.5-176.7173.500109.5
1035I27Very low28.3Very low134 Ų134143.7 Ų143.769%0.68773%0.725SS**  -1.40119.2-65.5174.2000110.4
1036Q26.9Very low28.3Very low156 Ų156141.9 Ų141.973%0.72972%0.716SS**  000-104.817730.100109.6
1037Q28.3Very low28.3Very low159 Ų159141.5 Ų141.574%0.74372%0.723SS**  000-136.5170.31200109.6
1038K29.1Very low28.7Very low174 Ų174143.3 Ų143.376%0.75773%0.73SS**  0109.20-143.8177.4177.6165.70109.6
1039D30.2Very low28.5Very low133 Ų133146.4 Ų146.471%0.71174%0.742SS**  1740111.7-86.5-17.1000109.3
1040S29.2Very low29.1Very low98 Ų98146.4 Ų146.469%0.68574%0.739SS**  0110.40-59.70000110.1
1041V31.5Very low29.3Very low116 Ų116141.9 Ų141.970%0.70373%0.731SS**  114.3109.9102.1-1790000108.4
1042E27.8Very low29.6Very low144 Ų144140 Ų14067%0.67373%0.73SS**  96.2119.498.6-159.3169.4-177.700110.2
1043Y29.6Very low29.9Very low175 Ų175139.7 Ų139.769%0.68673%0.728SS**  105.10101.4-111.6-86.4000109.8
1044D30.3Very low30Very low110 Ų110134.4 Ų134.459%0.58872%0.718SS**  0121.50-89.3-23.8000109.7
1045D32Very low30.2Very low126 Ų126130.4 Ų130.467%0.67471%0.71SS**  109.4098.6-119.5-6000109.9
1046I31.9Very low30.3Very low109 Ų109128.9 Ų128.956%0.55971%0.712SS**  0119.50-61.5177.5000108.4
1047T29.7Very low30.4Very low116 Ų116126.6 Ų126.671%0.71271%0.713SS**  112.1094.136.90000109.5
1048K35.7Very low30.2Very low208 Ų208124.9 Ų124.990%0.90472%0.717SS**  0101.80-111.3-178.7-171.1-1540109.4
1049L24.7Very low30.1Very low168 Ų168121.5 Ų121.588%0.8872%0.715SS**  8.10121.6-85.7152.1000111.5
1050P36.6Very low29.9Very low107 Ų107119.7 Ų119.770%0.69571%0.709SS**  0146.6034.6-6.2000112
1051S30.3Very low29.8Very low90 Ų90123.3 Ų123.363%0.62971%0.713SS**  98.8112.997.449.50000109.9
1052S31Very low29.7Very low105 Ų105124.4 Ų124.473%0.73471%0.714SS**  119.3112.497.157.80000109.8
1053S31.8Very low29.6Very low103 Ų103122.8 Ų122.872%0.7272%0.718SS**  131.2114.493.852.60000109.5
1054S30.2Very low29.6Very low102 Ų102119.9 Ų119.971%0.71372%0.723SS**  102.912081.458.20000110
1055S29.9Very low29.5Very low105 Ų105120 Ų12073%0.73473%0.733SS**  107.4085.462.50000109.9
1056S29.9Very low29.2Very low103 Ų103119.9 Ų119.972%0.7274%0.736SS**  00099.70000109.9
1057S28.2Very low29Very low107 Ų107122.1 Ų122.175%0.74875%0.746SS**  0128.30-51.40000110
1058C24.9Very low28.8Very low123 Ų123122 Ų12283%0.83175%0.745SS**  129.5126.693.3-97.20000109.2
1059S26.9Very low28.4Very low103 Ų103117 Ų11772%0.7273%0.732SS**  123.4122.288.769.50000109.7
1060T26.3Very low28.6Very low95 Ų95113.4 Ų113.458%0.58372%0.717SS**  101.8119.799.8-36.10000109.5
1061F26.1Very low28.2Very low174 Ų174113.6 Ų113.676%0.76371%0.711SS**  131113.6102.6-100-82.7000109.1
1062I30.7Very low28.1Very low140 Ų140115.9 Ų115.972%0.71872%0.721SS**  118.5111.6110.2-61.6-176.2000108.2
1063S24.6Very low28.1Very low109 Ų109114.9 Ų114.976%0.76271%0.711SS**  42.3113117.4-90.80000111
1064S30Very low28.2Very low115 Ų115115.3 Ų115.380%0.80471%0.709SS**  148.7114.9121.9-59.30000109.2
1065S28.5Very low28.2Very low113 Ų113118 Ų11879%0.7971%0.711SS**  54.1110.5118.2-106.20000111
1066V25.9Very low28.2Very low122 Ų122119.5 Ų119.574%0.73971%0.709SS**  123.5112.1112.9177.90000108.2
1067M27Very low28.5Very low157 Ų157121.2 Ų121.277%0.77371%0.709SS**  155117.2116.1-88-107.5-136.700109.2
1068V25.8Very low29.1Very low112 Ų112120.4 Ų120.468%0.67970%0.701SS**  51.3111.7106.4176.70000109.6
1069T27.5Very low29.5Very low104 Ų104118.9 Ų118.964%0.63869%0.688SS**  147119.5111.3-33.50000109.4
1070T28.3Very low29.8Very low92 Ų92121.5 Ų121.556%0.56469%0.691SS**  102.412499.2-43.50000109.7
1071I27.9Very low29.9Very low112 Ų112121.2 Ų121.257%0.57469%0.693SS**  168.3112.9121-57.5176.8000108T1073I1071-T1073 HydrophobicContact CG2-CG2 2.96Å; I1071-T1073 WeakPolarHBondContact CG2-OG1 3.21Å
1072V28.7Very low30.1Very low138 Ų138118.2 Ų118.284%0.83669%0.689SS**  -151.9114.4119.6170.90000108.8
1073T32.1Very low30Very low84 Ų84118 Ų11852%0.51569%0.688SS.*  58.9119.382.119.90000110.3I1071I1071-T1073 HydrophobicContact CG2-CG2 2.96Å; I1071-T1073 WeakPolarHBondContact CG2-OG1 3.21Å
1074T33.6Very low30.2Very low112 Ų112117.3 Ų117.369%0.68768%0.679SS**  138.9119.689.80.70000109.4
1075Q28.9Very low30.2Very low159 Ų159119 Ų11974%0.74368%0.676SS**  79.6074.9-92.9-150.314.500110.4
1076L31.2Very low30.2Very low135 Ų135118.7 Ų118.771%0.70767%0.67SS**  000-104.2133.2000109.5
1077I35.1Very low30.6Very low140 Ų140117.6 Ų117.672%0.71867%0.668SS**  000-57.1172.5000109.9
1078P42.2Very low30.8Very low90 Ų90117.2 Ų117.258%0.58467%0.669SS**  00033.9-5000112.2R288R288-P1078 PolarHBondContact NH2-O 2.02Å
1079T33.4Very low31Very low90 Ų90117 Ų11755%0.55267%0.668SS**  00050.70000108.4
1080M31.3Very low31Very low159 Ų159116.5 Ų116.578%0.78367%0.665SS**  000-79.7-73.8135.700109.3
1081S28.8Very low31Very low88 Ų88118.3 Ų118.362%0.61567%0.669SS**  000-34.40000109.7
1082T30.2Very low31.1Very low112 Ų112119 Ų11969%0.68768%0.679SS**  0126.60-23.60000109.2
1083I29Very low31.4Very low134 Ų134118 Ų11869%0.68768%0.676SS**  112.6123.584.4-63.7174.8000108.5
1084T28.5Very low31.3Very low96 Ų96119.6 Ų119.659%0.58969%0.69SS**  118.4122.392-10000109.4
1085M29.7Very low31.3Very low150 Ų150122.9 Ų122.974%0.73970%0.698SS**  147.8118.579.4-77.2-96.6125.400109.3
1086T30.1Very low31.1Very low106 Ų106123.3 Ų123.365%0.6570%0.702SS**  108111.987.841.50000109.4
1087S32.5Very low31.1Very low100 Ų100123.6 Ų123.670%0.69970%0.702SS**  127.8112.490.511.40000109.5
1088N31Very low30.8Very low149 Ų149122.4 Ų122.480%0.79770%0.702SS**  89.4118.485.9-86.8-1.3000110.5
1089T31.3Very low30.1Very low108 Ų108123.6 Ų123.666%0.66371%0.708SS**  102.9119.879.51.60000109.6
1090T26.7Very low29.7Very low92 Ų92123.7 Ų123.756%0.56471%0.712SS**  69.6123.790.1-270000110.5
1091I28.3Very low29.7Very low130 Ų130125.6 Ų125.667%0.66772%0.716SS**  100.4117.792.1-62.7-179.8000108.6
1092T31.1Very low29.7Very low127 Ų127125.9 Ų125.978%0.77972%0.724SS**  138.4136.6104.529.90000109.1
1093P35.1Very low29.8Very low118 Ų118126.8 Ų126.877%0.76673%0.73SS**  trans-115.4119.8-178.933.6-5.3000111.7
1094S29.6Very low29.7Very low116 Ų116125.7 Ų125.781%0.81173%0.734SS**  trans-139.9106150.4-61.40000109.5
1095Q33.2Very low30.2Very low182 Ų182126.1 Ų126.185%0.8574%0.738SS**  70.199.5111.5-77.3-169.1-13.300110.4
1096M25.8Very low30.1Very low167 Ų167126.4 Ų126.482%0.82374%0.743SS**  90.194.9106.9-115.4-177.2178.200110
1097I30.9Very low30.1Very low141 Ų141124.8 Ų124.872%0.72374%0.74SS**  126.696.1115.1-64.9175.2000108.3
1098T28.5Very low30.1Very low116 Ų116126.2 Ų126.271%0.71275%0.745SS**  55.2108.4111-5.80000110.6
1099T26.5Very low30.1Very low115 Ų115128.2 Ų128.271%0.70675%0.746SS**  85.5122.995.250.60000109.9
1100S26.5Very low30.2Very low91 Ų91129.7 Ų129.764%0.63675%0.749SS**  151.5125.3107.919.60000109.7
1101F29.3Very low30.6Very low199 Ų199133.3 Ų133.387%0.87376%0.759SS**  121.5089.5-81.7-78.1000109.4
1102A30.6Very low30.7Very low95 Ų95133.6 Ų133.679%0.78576%0.762SS**SBend0103.7000000109.5
1103T32.1Very low31Very low131 Ų131135.9 Ų135.980%0.80477%0.768SS**  112.7109.7101.449.90000109.1
1104S27.3Very low31Very low111 Ų111137.1 Ų137.178%0.77677%0.768SS**  156.7069.6-176.60000109.5
1105P37.6Very low31.3Very low104 Ų104139.5 Ų139.568%0.67577%0.766SS**  0130033.2-4.8000111.8
1106D27.7Very low31.2Very low157 Ų157138.2 Ų138.284%0.8477%0.765SS**  119.4101.8128.1-119.4-7.4000109.7
1107A30.1Very low31.6Very low71 Ų71134.2 Ų134.259%0.58776%0.759SS**  93.9107.3101.300000109.8
1108T33.6Very low31.7Very low131 Ų131134.6 Ų134.680%0.80476%0.762SS**  106.1111.7104.347.10000109.4
1109K30Very low31.8Very low190 Ų190130.8 Ų130.883%0.82674%0.74SS**  73.7097.1-110.6-178.3-173-175.10110.4
1110I32.7Very low33.1Very low139 Ų139128.9 Ų128.971%0.71373%0.732SS**  0119.90-62.8-170.5000108.5
1111H36.1Very low33.3Very low169 Ų169130.5 Ų130.578%0.78274%0.737SS**  97.3094.7-122-85.1000110.1
1112D29.7Very low33.3Very low135 Ų135125.5 Ų125.572%0.72273%0.727SS**  000-89.1-20.6000110.7
1113L38.1Very low33.3Very low176 Ų176125.6 Ų125.692%0.92172%0.722SS**  000-77.4162.9000109.5
1114N34.6Very low33.2Very low143 Ų143125.6 Ų125.677%0.76572%0.722SS**  000-111.60.5000110.7
1115H36.2Very low33.4Very low167 Ų167125.7 Ų125.777%0.77372%0.723SS**  000-100-41.6000110.5
1116N32.1Very low33.3Very low154 Ų154129 Ų12982%0.82473%0.734SS**  0109.90-110.80.8000110.5
1117A34Very low34Very low83 Ų83126.2 Ų126.269%0.68672%0.724SS**  88.70100.700000110
1118D32.2Very low34Very low150 Ų150132.1 Ų132.180%0.80274%0.737SS**  000-87.6-18.1000109.5Y1141D1118-Y1141 WeakPolarHBondContact O-CE2 3.34Å
1119S30.7Very low33.5Very low35 Ų35131 Ų13125%0.24573%0.734CS.*SBend000590000110.1V1121 Y1141S1119-V1121 PolarHBondContact O-N 2.46Å; S1119-Y1141 WeakPolarHBondContact OG-CD1 3.45Å; S1119-Y1141 WeakPolarHBondContact OG-CD2 3.17Å; S1119-Y1141 WeakPolarHBondContact OG-CE1 3.45Å; S1119-Y1141 CovalentContact OG-CE2 1.76Å; S1119-Y1141 WeakPolarHBondContact OG-CE2 3.42Å; S1119-Y1141 PolarHBondContact OG-OH 2.37Å
1120S53.7Low34.6Very low76 Ų76127.5 Ų127.553%0.53173%0.732SS.*SBend073.8065.20000111Y1141S1120-Y1141 WeakPolarHBondContact OG-CE1 2.85Å; S1120-Y1141 WeakPolarHBondContact OG-CE2 3.18Å; S1120-Y1141 PolarHBondContact OG-OH 3.45Å
1121V30.4Very low34.5Very low124 Ų124126.3 Ų126.375%0.75274%0.735SS**  159.8109.181.9-136.50000107.9S1119S1119-V1121 PolarHBondContact O-N 2.46Å
1122S30.6Very low34.2Very low95 Ų95126 Ų12666%0.66474%0.74SS**  59111.9120.1111.50000110.8
1123S29.6Very low34.2Very low97 Ų97123.7 Ų123.768%0.67874%0.739SS**  100123.7128.127.30000110
1124T30.9Very low33.7Very low130 Ų130122.7 Ų122.780%0.79874%0.735SS**  115.10119-15.70000109.3
1125S31.4Very low33.5Very low113 Ų113122.9 Ų122.979%0.7974%0.736SS**  00058.60000110.3
1126L34.6Very low33.2Very low173 Ų173120.6 Ų120.691%0.90674%0.739SS**  000-71.3169.5000111.2
1127P41.9Very low33Very low99 Ų99119 Ų11964%0.64374%0.739SS**  00034.1-5.1000112
1128F30.1Very low32.9Very low196 Ų196124.3 Ų124.386%0.8675%0.747SS**  000-96.2-80.3000109.7
1129S24.7Very low33Very low106 Ų106122.5 Ų122.574%0.74174%0.742SS**  000-690000109.8
1130P53.4Low33.1Very low118 Ų118125.7 Ų125.777%0.76676%0.759SS**  00033.7-4.7000111.9
1131S29Very low31.8Very low113 Ų113130.1 Ų130.179%0.7977%0.765SS**  00064.40000109.5
1132N30.4Very low32Very low164 Ų164132.5 Ų132.588%0.87777%0.766SS**  0125.70-102.2-5.6000110.2
1133A28.8Very low32Very low86 Ų86135.6 Ų135.671%0.71178%0.775SS**  168.2118.896.100000109.1
1134D28.2Very low32.1Very low154 Ų154135.3 Ų135.382%0.82477%0.773SS**  136.1088-93-14.3000109.4
1135N31.4Very low32.1Very low148 Ų148136.1 Ų136.179%0.79177%0.772SS**  000-79-4.9000110.9
1136S28.5Very low31.9Very low119 Ų119137.1 Ų137.183%0.83277%0.768SS**  00059.60000110.4
1137S29.2Very low31.8Very low120 Ų120135 Ų13584%0.83976%0.757SS**  0121.70670000110
1138K32.2Very low31.3Very low195 Ų195137.7 Ų137.785%0.84876%0.761SS**  76.40106.6-118.9178.7-174.3179.80110.6
1139T33.4Very low31.3Very low112 Ų112134.4 Ų134.469%0.68775%0.752SS**  00015.90000109.7
1140V33.8Very low31.6Very low101 Ų101137 Ų13761%0.61275%0.753SS**  000176.20000108.4K1142V1140-K1142 HydrophobicContact CG1-CB 4.22Å; V1140-K1142 HydrophobicContact CG1-CD 4.46Å; V1140-K1142 HydrophobicContact CG1-CG 3.94Å
1141Y26.1Very low30.6Very low169 Ų169135.9 Ų135.966%0.66375%0.748SS**  000-102.8-83.8000110.6D1118 S1119 S1120D1118-Y1141 WeakPolarHBondContact O-CE2 3.34Å; S1119-Y1141 WeakPolarHBondContact OG-CD1 3.45Å; S1119-Y1141 WeakPolarHBondContact OG-CD2 3.17Å; S1119-Y1141 WeakPolarHBondContact OG-CE1 3.45Å; S1119-Y1141 CovalentContact OG-CE2 1.76Å; S1119-Y1141 WeakPolarHBondContact OG-CE2 3.42Å; S1119-Y1141 PolarHBondContact OG-OH 2.37Å; S1120-Y1141 WeakPolarHBondContact OG-CE1 2.85Å; S1120-Y1141 WeakPolarHBondContact OG-CE2 3.18Å; S1120-Y1141 PolarHBondContact OG-OH 3.45Å
1142K33.6Very low30.8Very low174 Ų174139.2 Ų139.276%0.75775%0.748SS**  000-94.5-177.7-177.41790110V1140V1140-K1142 HydrophobicContact CG1-CB 4.22Å; V1140-K1142 HydrophobicContact CG1-CD 4.46Å; V1140-K1142 HydrophobicContact CG1-CG 3.94Å
1143N31.9Very low30.7Very low161 Ų161138.5 Ų138.586%0.86174%0.741SS**  0127.50-87.9-16.5000109.9
1144S31.3Very low30.6Very low90 Ų90140 Ų14063%0.62974%0.741SS**  132.1122.469-39.90000109.6
1145D29.8Very low30.5Very low147 Ų147137.1 Ų137.179%0.78673%0.733SS**SBend-171.7109.9105.5-87-21.9000109.2
1146L28.7Very low30.3Very low135 Ų135136.3 Ų136.371%0.70773%0.733SS**  143.5104.190.5-112.9133.9000109.3
1147L30.6Very low30.2Very low127 Ų127133.7 Ų133.767%0.66573%0.725SS**  125.6107.398.9-84.2168.6000109.5
1148Q31.8Very low30.3Very low156 Ų156137.3 Ų137.373%0.72973%0.726SS**  126.4105.497.4-109.7169.42600109.7
1149N31.1Very low30.2Very low128 Ų128132 Ų13268%0.68471%0.713SS**  110.410999.3-104.9-3.8000110.5
1150E31.5Very low30Very low161 Ų161132.9 Ų132.975%0.75271%0.714SS**  103.9120.694.3-77.7-154.3157.100110
1151S31.4Very low29.9Very low94 Ų94134 Ų13466%0.65772%0.716SS**  103.3119.993-48.80000110
1152K34.3Very low30.3Very low182 Ų182134.5 Ų134.579%0.79172%0.722SS**  111.10101.6-130.3177.9-175.4-168.70109.8
1153M26.6Very low30.2Very low149 Ų149134.4 Ų134.473%0.73472%0.724SS**  000-105.6-174.2113.600109.8
1154V27.3Very low30.2Very low117 Ų117131.4 Ų131.471%0.70972%0.722SS**  0119.10171.70000108.7
1155S26.6Very low30Very low95 Ų95131.6 Ų131.666%0.66473%0.728SS**  92.2125.4102.9-152.30000109.9
1156V27.5Very low30.3Very low130 Ų130134.4 Ų134.479%0.78873%0.734SS**  111114.1119.31770000108.3
1157G26.1Very low30.5Very low64 Ų64135.5 Ų135.566%0.6674%0.74SS**  66.2111.2114.800000111.2
1158K30.7Very low30.9Very low197 Ų197136.3 Ų136.386%0.85774%0.744SS**  140.8115.3121.7-108.8174.3-178.4173.70109.6
1159S29.4Very low31.1Very low83 Ų83134.8 Ų134.858%0.5875%0.745SS**  83.1117100.248.90000110.5
1160D29.8Very low30.9Very low131 Ų131135.2 Ų135.270%0.70175%0.747SS**  82.8117.6108-72.5-30.2000110.1
1161D32.1Very low31Very low124 Ų124133.7 Ų133.766%0.66374%0.744SS**  103.6113.8107.6-73.9-25.7000109.8
1162K33.4Very low30.9Very low179 Ų179136.8 Ų136.878%0.77875%0.748SS**  100.6104.8106.1-99.1-171.7-177.7-179.20110.1
1163E32.4Very low30.6Very low172 Ų172136.2 Ų136.280%0.80475%0.75SS**  78.4096.3-160.5159.5-179.600110.3
1164A31.2Very low30.8Very low99 Ų99139 Ų13982%0.81876%0.758SS**  0108000000109.3
1165A28Very low31Very low93 Ų93138.2 Ų138.277%0.76976%0.758SS**  77.8083.500000110.3
1166K34.9Very low31.8Very low207 Ų207138.5 Ų138.590%0.976%0.758SS**  0100.30-100.5178.9-175.2-177.40109.6
1167N34Very low31.9Very low157 Ų157135 Ų13584%0.8474%0.737SS**  -86.4113.8124.5-95.5-25000111.1
1168I39Very low32Very low144 Ų144136.4 Ų136.474%0.73874%0.737SS**  73.9073.5-68.7175.9000109.5
1169V35.1Very low32.1Very low124 Ų124131.5 Ų131.575%0.75273%0.727SS**  000173.90000108.8
1170N28.5Very low32.3Very low137 Ų137133.5 Ų133.573%0.73374%0.736SS**  0111.90-123.319.7000110.5
1171N31.9Very low32.5Very low130 Ų130134.9 Ų134.970%0.69574%0.742SS**  trans135.9103.4136-90.4-19.2000110
1172Q30.6Very low32.3Very low158 Ų158136.7 Ų136.774%0.73875%0.751SS**  79.2110.6106.4-99.2-171.733.700110.8
1173M28.3Very low32.1Very low170 Ų170134 Ų13484%0.83775%0.749SS**  76.8102.6120.6-100.7170.1179.100110.5
1174K30.9Very low31.9Very low207 Ų207132.2 Ų132.290%0.975%0.745SS**  150.80100.2-127.3169.6-172.1-158.90109.4
1175S31.2Very low31.8Very low102 Ų102134 Ų13471%0.71374%0.741SS**  0132.20131.20000110.1
1176P42.4Very low31.9Very low101 Ų101136 Ų13666%0.65674%0.739SS**  -154.60-59.434.8-6000112.3
1177V29.8Very low31.8Very low57 Ų57130.6 Ų130.635%0.34573%0.727SS.*  000-172.50000108.2V511 A512 G513V511-V1177 CarbonylContact C-O 3.32Å; A512-V1177 CovalentContact C-CG1 1.28Å; A512-V1177 CarbonylContact C-O 3.54Å; A512-V1177 HydrophobicContact CB-CG1 3.77Å; A512-V1177 PolarHBondContact N-O 3.29Å; A512-V1177 VanDerWaalsContact N-O 3.16Å; A512-V1177 CarbonylContact O-C 3.36Å; A512-V1177 WeakPolarHBondContact O-CA 3.46Å; A512-V1177 WeakPolarHBondContact O-CB 3.3Å; A512-V1177 CovalentContact O-CG1 1.48Å; A512-V1177 WeakPolarHBondContact O-CG1 3.41Å; A512-V1177 WeakPolarHBondContact O-CG2 3.48Å; G513-V1177 VanDerWaalsContact C-CG1 3.42Å; G513-V1177 CovalentContact N-CG1 1.47Å; G513-V1177 VanDerWaalsContact O-CG1 3.29Å; G513-V1177 WeakPolarHBondContact O-CG1 3.15Å
1178S29.2Very low31.8Very low93 Ų93129.9 Ų129.965%0.6572%0.723SS**  000-98.90000112A512A512-S1178 CarbonylContact C-O 3.53Å; A512-S1178 WeakPolarHBondContact CB-O 3.47Å; A512-S1178 CarbonylContact O-C 2.16Å; A512-S1178 PolarHBondContact O-N 3.34Å
1179S32.1Very low31.3Very low94 Ų94129.4 Ų129.466%0.65772%0.722SS**  000-9.90000110.6
1180T33.9Very low31.2Very low124 Ų124129 Ų12976%0.76172%0.721SS**  000-34.50000109.4
1181L34.2Very low31.5Very low160 Ų160126.8 Ų126.884%0.83872%0.715SS**  0134.10-85.1169.4000110.6
1182L26.7Very low31.7Very low163 Ų163126.5 Ų126.585%0.85371%0.714SS**  trans82.5116.2144.2-92.2159.3000109.8
1183V29.7Very low31.9Very low121 Ų121125.1 Ų125.173%0.73371%0.708SS**  131.4108.5119.6177.20000108
1184N28.1Very low32.3Very low136 Ų136123.9 Ų123.973%0.72770%0.698SS**  52.3114.2121.8-81.1-12.2000111.1
1185N29.3Very low32.6Very low135 Ų135119.1 Ų119.172%0.72268%0.682SS**  106.8113.9118.3-89.6-13.9000110.1
1186D30.7Very low32.9Very low136 Ų136117 Ų11773%0.72767%0.667SS**  130.1115109.3-82.4-23.7000109.3
1187S33Very low32.6Very low94 Ų94117 Ų11766%0.65766%0.66SS**  65.3118.2101.8-480000110.4
1188N32.5Very low32.6Very low141 Ų141119.3 Ų119.375%0.75467%0.671SS**  121.6117.2107.9-84.4-14.9000110
1189N30.3Very low32.8Very low134 Ų134121 Ų12172%0.71767%0.668SS**  98.3118.6100.1-102.9-6.1000110.5
1190T32.8Very low32.8Very low117 Ų117120.4 Ų120.472%0.71866%0.658SS**  124.5114.6104.8320000109.3
1191S34.4Very low32.5Very low89 Ų89121 Ų12162%0.62265%0.647SS**  102.7112.9100.175.70000110.1
1192D35.6Very low32.1Very low124 Ų124118.5 Ų118.566%0.66364%0.643SS**  121.7110.8104.1-83-25.6000109.6
1193Q35.4Very low32.2Very low130 Ų130120.4 Ų120.461%0.60764%0.644SS**  86.2115.895.2-111.9-178-18.100110.2
1194K36.5Very low32.2Very low144 Ų144123 Ų12363%0.62665%0.653SS**  101.6111.391.1-120.2-178.1179.5169.80110
1195D36Very low32.4Very low107 Ų107123.5 Ų123.557%0.57266%0.655SS**  142.3115.596.8-82.1-21.6000109.4
1196S37.8Very low32.2Very low57 Ų57122.1 Ų122.140%0.39966%0.656SS.*  119.4116.183.57.90000109.9
1197I35.9Very low32.2Very low101 Ų101121.4 Ų121.452%0.51866%0.657SS.*  94.9123.269.3-58.5174000109.1
1198N31.4Very low32Very low105 Ų105121.4 Ų121.456%0.56165%0.652SS**  104128.275.5-144.811.2000110.7
1199E32.8Very low31.6Very low129 Ų129118.2 Ų118.260%0.60364%0.641SS**  143.5129.592.9-94.5-143.4177.100109.9
1200N31.7Very low31.6Very low82 Ų82114.9 Ų114.944%0.43963%0.625SS.*  90.5131.277.4-93.1-14.9000111
1201Y27Very low31.6Very low137 Ų137113.7 Ų113.754%0.53762%0.621SS.*  8112193.4-97.2-85.8000110V504V504-Y1201 HydrophobicContact CB-CD2 4.36Å; V504-Y1201 HydrophobicContact CB-CE2 3.93Å; V504-Y1201 HydrophobicContact CG1-CE1 4.38Å; V504-Y1201 HydrophobicContact CG1-CE2 3.89Å; V504-Y1201 WeakPolarHBondContact CG1-OH 3.21Å; V504-Y1201 HydrophobicContact CG2-CD1 3.9Å; V504-Y1201 HydrophobicContact CG2-CD2 2.89Å; V504-Y1201 HydrophobicContact CG2-CE1 3.81Å; V504-Y1201 HydrophobicContact CG2-CE2 2.75Å; V504-Y1201 HydrophobicContact CG2-CG 3.47Å; V504-Y1201 VanDerWaalsContact CG2-CG 3.47Å
1202S26.1Very low31.8Very low107 Ų107114.1 Ų114.175%0.74862%0.624SS**  151.1109.4102.755.40000109.6
1203K30Very low31.9Very low203 Ų203111 Ų11188%0.88361%0.612SS**  trans-130.995.8144-117.6179.8-172.3-168.60109.6
1204L29.1Very low32Very low174 Ų174106.8 Ų106.891%0.91160%0.604SS**SBend-137.692.4115.8-100161.7000109.4
1205L31.4Very low32.3Very low147 Ų147102.7 Ų102.777%0.7759%0.593SS**  82.80113.6-116.993.8000109.6
1206S26.5Very low32.4Very low106 Ų106101.6 Ų101.674%0.74159%0.588SS**  00068.20000109.5
1207T29.4Very low32.3Very low122 Ų122105.9 Ų105.975%0.74861%0.606SS**  000-58.90000109.3
1208V28.9Very low32.3Very low93 Ų93105 Ų10556%0.56461%0.609SS**  000177.80000108.4M1522V1208-M1522 HydrophobicContact CB-CE 2.88Å; V1208-M1522 HydrophobicContact CB-SD 3.96Å; V1208-M1522 HydrophobicContact CG1-CB 4.47Å; V1208-M1522 HydrophobicContact CG1-CE 2.13Å; V1208-M1522 HydrophobicContact CG1-CG 3.57Å; V1208-M1522 HydrophobicContact CG1-SD 3.32Å; V1208-M1522 WeakPolarHBondContact CG1-SD 3.33Å; V1208-M1522 HydrophobicContact CG2-CE 4.11Å; V1208-M1522 WeakPolarHBondContact O-CE 3.4Å
1209C24Very low32.7Very low75 Ų75106.2 Ų106.251%0.50761%0.614SS.*  000-49.10000110.2M1522 M1523C1209-M1522 VanDerWaalsContact C-CG 3.44Å; C1209-M1522 CovalentContact CA-SD 2.13Å; C1209-M1522 WeakPolarHBondContact CA-SD 3.19Å; C1209-M1522 HydrophobicContact CB-CB 2.69Å; C1209-M1522 CovalentContact CB-CE 1.61Å; C1209-M1522 HydrophobicContact CB-CE 1.61Å; C1209-M1522 HydrophobicContact CB-CG 2.84Å; C1209-M1522 HydrophobicContact CB-SD 2.14Å; C1209-M1522 WeakPolarHBondContact CB-SD 3.27Å; C1209-M1522 PolarHBondContact N-SD 2.8Å; C1209-M1522 WeakPolarHBondContact O-CE 3.5Å; C1209-M1522 WeakPolarHBondContact O-CG 3.14Å; C1209-M1522 CovalentContact O-SD 1.79Å; C1209-M1522 CovalentContact SG-CE 1.77Å; C1209-M1522 WeakPolarHBondContact SG-CE 3.23Å; C1209-M1522 PolarHBondContact SG-SD 3.02Å; C1209-M1523 WeakPolarHBondContact O-CE 3.36Å; C1209-M1523 WeakPolarHBondContact O-CG 3.37Å
1210V30.3Very low32.6Very low63 Ų63107.2 Ų107.238%0.38262%0.623SS.*  000-177.10000108.5I1521 M1522V1210-I1521 HydrophobicContact CB-CG2 3.91Å; V1210-I1521 HydrophobicContact CG1-CB 4.15Å; V1210-I1521 HydrophobicContact CG1-CG1 4.27Å; V1210-I1521 HydrophobicContact CG1-CG2 3.06Å; V1210-I1521 HydrophobicContact CG2-CG2 3.9Å; V1210-M1522 HydrophobicContact CB-CB 3.67Å; V1210-M1522 WeakPolarHBondContact CB-O 3.45Å; V1210-M1522 HydrophobicContact CB-SD 4.44Å; V1210-M1522 HydrophobicContact CG2-CB 2.63Å; V1210-M1522 HydrophobicContact CG2-CE 4.45Å; V1210-M1522 HydrophobicContact CG2-CG 3.76Å; V1210-M1522 WeakPolarHBondContact CG2-O 3.47Å; V1210-M1522 HydrophobicContact CG2-SD 3.85Å
1211S34.4Very low32.6Very low92 Ų92107.5 Ų107.564%0.64364%0.637SS**  000-52.30000110.3
1212S37.4Very low32.7Very low98 Ų98106.7 Ų106.769%0.68565%0.651SS**  000-42.40000110.1
1213S37.3Very low32.8Very low58 Ų58107 Ų10741%0.40665%0.653SS.*  00053.80000109.6
1214G38.6Very low32.7Very low42 Ų42102.8 Ų102.843%0.43365%0.645SS.*  00000000111.2
1215S42.5Very low32.9Very low59 Ų59100.8 Ų100.841%0.41364%0.64SS.*  0133.70-710000110.2M498M498-S1215 WeakPolarHBondContact CB-OG 3.49Å
1216N37.2Very low32.5Very low84 Ų84104.4 Ų104.445%0.44965%0.645SS.*  136.5128.387.6-69.2-23.1000109.9M498M498-N1216 WeakPolarHBondContact CG-ND2 3.37Å
1217N36.7Very low32.7Very low147 Ų147104.9 Ų104.979%0.78665%0.648SS**  68.1141.372-85.9-11.3000110.9
1218S36.2Very low32.7Very low82 Ų82108.3 Ų108.357%0.57365%0.653SS**  135.2136.494159.60000109.5
1219I38.2Very low32.9Very low131 Ų131112.5 Ų112.567%0.67267%0.671SS**  13513290.1-66173000108.4
1220D32Very low33.1Very low149 Ų149118.2 Ų118.280%0.79769%0.688SS**  114.7077.3-107.1-7.4000109.7
1221A31.4Very low33.1Very low88 Ų88119.8 Ų119.873%0.72770%0.701SS**  0129.1000000109.1
1222S28.5Very low32.8Very low120 Ų120121.8 Ų121.884%0.83971%0.71SS**  110.8075.7-48.50000109.8
1223S29.6Very low32.8Very low113 Ų113124 Ų12479%0.7971%0.712SS**  01210168.80000109.4
1224T27.5Very low32.6Very low116 Ų116126.3 Ų126.371%0.71272%0.724SS**  99.1121.793-18.70000109.8
1225T33.6Very low32.5Very low132 Ų132130.3 Ų130.381%0.8174%0.742SS**  153.2113.3109.9-10.50000109.1
1226Y23.2Very low32.1Very low223 Ų223136.9 Ų136.988%0.87576%0.764SS**  24.9125.1114.9-93.1-84.5000111.3
1227S29.8Very low32.1Very low115 Ų115141.8 Ų141.880%0.80478%0.784SS**  176.9117106.7320000109.2
1228K28.7Very low32.4Very low195 Ų195143.6 Ų143.685%0.84879%0.785SS**  69.695.6101.8-146.4162.5-174.7178.80110.7
1229L33.9Very low33.2Very low180 Ų180144.7 Ų144.794%0.94279%0.79SS**  trans-135.487.9142.6-85.3160.1000109.4
1230K29.1Very low34Very low196 Ų196143.7 Ų143.785%0.85279%0.793SS**  trans488.8131-161.5130178.9-171.20111.6
1231S29.2Very low35.5Very low96 Ų96138.9 Ų138.967%0.67177%0.77SS**  trans-49.398.3156.460.50000111.5
1232T28.1Very low37.7Very low133 Ų133137.5 Ų137.582%0.81675%0.753SS**  trans-57.684.5146-58.50000110.3
1233I37.4Very low40.3Very low144 Ų144135.7 Ų135.774%0.73874%0.737SS**  trans-72.493.8163.2-63.2175.5000109.1
1234T32.5Very low43.1Very low108 Ų108130.5 Ų130.566%0.66370%0.7SS**  trans-38.7120.5151.752.40000110.8F1236T1234-F1236 PolarHBondContact O-N 3.02Å
1235P37.4Very low46Very low125 Ų125129.5 Ų129.581%0.81269%0.689SS**  trans-60.7102.4178.618.3-5.1000111.7E1237P1235-E1237 PolarHBondContact O-N 3.46Å
1236F34.9Very low48.6Very low198 Ų198123.2 Ų123.287%0.86865%0.651SS**  trans-23.989.4154.4-110.6-88.2000111.3T1234T1234-F1236 PolarHBondContact O-N 3.02Å
1237E36.3Very low51.5Low186 Ų186114.8 Ų114.887%0.86962%0.624SS**  trans-54.50167.8-159.2165.8177.700110.9P1235P1235-E1237 PolarHBondContact O-N 3.46Å
1238F42.2Very low54.2Low185 Ų185115.2 Ų115.281%0.81162%0.617SS**  0117.60-76.7-78.3000110.8
1239P53.2Low56.9Low105 Ų105111.7 Ų111.768%0.68261%0.607SS**  trans-46.70172.816.4-17000111.9
1240P56.5Low59.7Low111 Ų111104.5 Ų104.572%0.72157%0.567SS**  0131.3016.1-17.9000111.7
1241P63Low62.7Low48 Ų48102.4 Ų102.431%0.31255%0.554SS.*PPolyproline II helixtrans-50.8127.5-179.18.1-7.4000111.8V1243 L1253 T1254P1241-V1243 PolarHBondContact O-N 3.36Å; P1241-L1253 HydrophobicContact CB-CD1 3.32Å; P1241-L1253 HydrophobicContact CB-CG 3.83Å; P1241-L1253 HydrophobicContact CG-CD1 3.4Å; P1241-L1253 VanDerWaalsContact CG-CD1 3.4Å; P1241-L1253 HydrophobicContact CG-CD2 4.07Å; P1241-L1253 HydrophobicContact CG-CG 3.85Å; P1241-L1253 VanDerWaalsContact O-CD1 3.27Å; P1241-L1253 WeakPolarHBondContact O-CD1 2.04Å; P1241-T1254 WeakPolarHBondContact CB-O 3.34Å
1242P76.7Confident65.9Low58 Ų5897.9 Ų97.938%0.37752%0.522SS..PPolyproline II helixtrans-52.8127.1178.516.9-18.1000111.8T1254P1242-T1254 PolarHBondContact O-N 3.5Å; P1242-T1254 VanDerWaalsContact O-N 3.12Å
1243V84.3Confident69Low82 Ų8293.8 Ų93.850%0.49750%0.495SS..EExtended strand (participates in β ladder)trans-92.7121.2175.7178.30000108.4P1241 R1251 I1252 L1253P1241-V1243 PolarHBondContact O-N 3.36Å; V1243-R1251 HydrophobicContact CG1-CB 3.97Å; V1243-R1251 HydrophobicContact CG1-CG 4.39Å; V1243-I1252 CarbonylContact C-O 3.54Å; V1243-I1252 VanDerWaalsContact CA-O 3.24Å; V1243-I1252 WeakPolarHBondContact CA-O 1.48Å; V1243-L1253 HydrophobicContact CG2-CD1 3.72Å
1244L87.5Confident71.7Confident4 Ų487.1 Ų87.12%0.02146%0.461CS..EExtended strand (participates in β ladder)trans-96.7138173.3-60.5169000111.1R1251 I1252 Y1263 A1281 L1282 Q1285L1244-R1251 CarbonylContact O-C 3.5Å; L1244-R1251 VanDerWaalsContact O-CA 3.29Å; L1244-R1251 WeakPolarHBondContact O-CA 3.34Å; L1244-I1252 WeakPolarHBondContact CA-O 3.48Å; L1244-I1252 HydrophobicContact CB-CB 3.97Å; L1244-I1252 PolarHBondContact N-O 3.24Å; L1244-I1252 WeakPolarHBondContact O-CA 3.17Å; L1244-I1252 WeakPolarHBondContact O-CB 3.49Å; L1244-I1252 PolarHBondContact O-N 3.35Å; L1244-Y1263 HydrophobicContact CD1-CE1 4.47Å; L1244-A1281 HydrophobicContact CB-CB 4.01Å; L1244-L1282 HydrophobicContact CD1-CD1 4.35Å; L1244-L1282 HydrophobicContact CD1-CD2 3.79Å; L1244-L1282 HydrophobicContact CD1-CG 3.52Å; L1244-L1282 HydrophobicContact CD2-CD2 4.47Å; L1244-Q1285 HydrophobicContact CD2-CB 3.96Å; L1244-Q1285 HydrophobicContact CD2-CG 3.98Å; L1244-Q1285 CovalentContact CD2-OE1 1.82Å
1245I89.3Confident74.6Confident95 Ų9584 Ų8449%0.48744%0.439SS..EExtended strand (participates in β ladder)trans-99.4109.8176.1-58.8-164.2000108.3R1250I1245-R1250 CarbonylContact C-O 3.27Å; I1245-R1250 VanDerWaalsContact C-O 3.3Å; I1245-R1250 WeakPolarHBondContact CA-O 3.44Å
1246G87.7Confident77.3Confident0 Ų085.6 Ų85.60%043%0.43CS..EExtended strand (participates in β ladder)trans-88.3-178.2179.400000112.9D1249 R1250G1246-D1249 PolarHBondContact O-N 3.38Å; G1246-R1250 WeakPolarHBondContact CA-O 3.48Å; G1246-R1250 PolarHBondContact N-O 3.06Å; G1246-R1250 PolarHBondContact O-N 3.14Å
1247P83.8Confident80Confident47 Ų4780.2 Ų80.231%0.30541%0.41SS..G310 helixtrans-54.7142.9177.3-7.410.9000111.9D1249 R1250 V1277 T1280P1247-D1249 PolarHBondContact O-N 2.88Å; P1247-R1250 VanDerWaalsContact O-CB 3.26Å; P1247-R1250 WeakPolarHBondContact O-CB 3.28Å; P1247-R1250 PolarHBondContact O-N 3.33Å; P1247-V1277 HydrophobicContact CG-CG1 4.19Å; P1247-T1280 HydrophobicContact CG-CG2 4.19Å
1248D85.8Confident82.7Confident123 Ų12378.8 Ų78.866%0.65841%0.408SS*.G310 helixtrans71.224.4-178.2-61.8-28.1000110.8R1250 K1267D1248-R1250 PolarHBondContact O-N 3.45Å; D1248-K1267 PolarHBondContact O-NZ 3.12Å
1249D86.9Confident84.9Confident121 Ų12174 Ų7465%0.64741%0.411SS*.G310 helixtrans62.727.7177-67.2-29.6000111.3G1246 P1247 R1251G1246-D1249 PolarHBondContact O-N 3.38Å; P1247-D1249 PolarHBondContact O-N 2.88Å; D1249-R1251 PolarHBondContact O-N 3.4Å
1250R91.9Very high86.6Confident29 Ų2975.3 Ų75.311%0.10941%0.408CS..EExtended strand (participates in β ladder)trans-72.6130.8176.5-170.2-179.9-63.7-91.6-1.2109.8I1245 G1246 P1247 D1248 I1252 D1266 K1267 P1268I1245-R1250 CarbonylContact C-O 3.27Å; I1245-R1250 VanDerWaalsContact C-O 3.3Å; I1245-R1250 WeakPolarHBondContact CA-O 3.44Å; G1246-R1250 WeakPolarHBondContact CA-O 3.48Å; G1246-R1250 PolarHBondContact N-O 3.06Å; G1246-R1250 PolarHBondContact O-N 3.14Å; P1247-R1250 VanDerWaalsContact O-CB 3.26Å; P1247-R1250 WeakPolarHBondContact O-CB 3.28Å; P1247-R1250 PolarHBondContact O-N 3.33Å; D1248-R1250 PolarHBondContact O-N 3.45Å; R1250-I1252 HydrophobicContact CG-CG1 4.3Å; R1250-D1266 WeakPolarHBondContact CG-OD1 3.42Å; R1250-K1267 HydrophobicContact CG-CB 3.97Å; R1250-K1267 HydrophobicContact CG-CD 4.4Å; R1250-K1267 HydrophobicContact CG-CG 4.38Å; R1250-K1267 VanDerWaalsContact CZ-C 3.48Å; R1250-K1267 PolarHBondContact NH1-O 2.47Å; R1250-K1267 VanDerWaalsContact NH2-CB 3.3Å; R1250-P1268 VanDerWaalsContact NH1-C 3.27Å; R1250-P1268 PolarHBondContact NH1-O 3.03Å; R1250-P1268 PolarHBondContact NH2-O 3.35Å; R1250-P1268 VanDerWaalsContact NH2-O 3.17Å
1251R93.2Very high88.3Confident153 Ų15374.1 Ų74.158%0.57739%0.394SS*.EExtended strand (participates in β ladder)trans-94.1121.9178.1-66.7-169-73.3-104.3-0.4110.8V1243 L1244 D1249 S1265 D1266V1243-R1251 HydrophobicContact CG1-CB 3.97Å; V1243-R1251 HydrophobicContact CG1-CG 4.39Å; L1244-R1251 CarbonylContact O-C 3.5Å; L1244-R1251 VanDerWaalsContact O-CA 3.29Å; L1244-R1251 WeakPolarHBondContact O-CA 3.34Å; D1249-R1251 PolarHBondContact O-N 3.4Å; R1251-S1265 WeakPolarHBondContact O-CA 3.5Å; R1251-D1266 WeakPolarHBondContact CA-OD1 3.33Å; R1251-D1266 PolarHBondContact N-OD1 2.96Å; R1251-D1266 IonicContact NE-OD2 3.89Å; R1251-D1266 IonicContact NH2-OD2 3.95Å; R1251-D1266 PolarHBondContact O-N 2.77Å; R1251-D1266 VanDerWaalsContact O-OD1 3.08Å
1252I95.3Very high89.8Confident0 Ų075.8 Ų75.80%040%0.4CS..EExtended strand (participates in β ladder)trans-115122.4-175.5-60.7172.6000107.6V1243 L1244 R1250 Y1263 E1264 F1269 V1277 V1278 A1281V1243-I1252 CarbonylContact C-O 3.54Å; V1243-I1252 VanDerWaalsContact CA-O 3.24Å; V1243-I1252 WeakPolarHBondContact CA-O 1.48Å; L1244-I1252 WeakPolarHBondContact CA-O 3.48Å; L1244-I1252 HydrophobicContact CB-CB 3.97Å; L1244-I1252 PolarHBondContact N-O 3.24Å; L1244-I1252 WeakPolarHBondContact O-CA 3.17Å; L1244-I1252 WeakPolarHBondContact O-CB 3.49Å; L1244-I1252 PolarHBondContact O-N 3.35Å; R1250-I1252 HydrophobicContact CG-CG1 4.3Å; I1252-Y1263 HydrophobicContact CG2-CD1 4.03Å; I1252-Y1263 HydrophobicContact CG2-CG 4.41Å; I1252-E1264 CarbonylContact C-O 3.3Å; I1252-E1264 VanDerWaalsContact CA-O 3.28Å; I1252-E1264 WeakPolarHBondContact CA-O 3.33Å; I1252-F1269 HydrophobicContact CD1-CE1 4.37Å; I1252-F1269 HydrophobicContact CG2-CZ 4.43Å; I1252-V1277 HydrophobicContact CD1-CG1 4.07Å; I1252-V1278 HydrophobicContact CD1-CG2 4.45Å; I1252-A1281 HydrophobicContact CD1-CB 3.68Å
1253L94Very high90.7Very high47 Ų4775.8 Ų75.825%0.24639%0.393CS..EExtended strand (participates in β ladder)trans-99.7131.8178.4-17563.4000109.8P1241 V1243 H1255 Y1263 E1264P1241-L1253 HydrophobicContact CB-CD1 3.32Å; P1241-L1253 HydrophobicContact CB-CG 3.83Å; P1241-L1253 HydrophobicContact CG-CD1 3.4Å; P1241-L1253 VanDerWaalsContact CG-CD1 3.4Å; P1241-L1253 HydrophobicContact CG-CD2 4.07Å; P1241-L1253 HydrophobicContact CG-CG 3.85Å; P1241-L1253 VanDerWaalsContact O-CD1 3.27Å; P1241-L1253 WeakPolarHBondContact O-CD1 2.04Å; V1243-L1253 HydrophobicContact CG2-CD1 3.72Å; L1253-H1255 WeakPolarHBondContact CD2-CE1 3.25Å; L1253-H1255 WeakPolarHBondContact CD2-NE2 2.99Å; L1253-Y1263 CarbonylContact O-C 3.48Å; L1253-Y1263 WeakPolarHBondContact O-CA 3.45Å; L1253-E1264 WeakPolarHBondContact CA-O 3.45Å; L1253-E1264 HydrophobicContact CB-CB 4.35Å; L1253-E1264 PolarHBondContact N-O 3.47Å; L1253-E1264 PolarHBondContact O-N 2.88Å
1254T93.5Very high91.1Very high4 Ų477.2 Ų77.23%0.02539%0.394CS..EExtended strand (participates in β ladder)trans-1020-179.3-56.20000109.8P1241 P1242 Y1256 I1261 I1262 Y1263P1241-T1254 WeakPolarHBondContact CB-O 3.34Å; P1242-T1254 PolarHBondContact O-N 3.5Å; P1242-T1254 VanDerWaalsContact O-N 3.12Å; T1254-Y1256 HydrophobicContact CG2-CD2 4.28Å; T1254-Y1256 HydrophobicContact CG2-CE2 3.64Å; T1254-I1261 HydrophobicContact CG2-CG2 3.45Å; T1254-I1261 VanDerWaalsContact CG2-CG2 3.45Å; T1254-I1262 CarbonylContact C-O 3.35Å; T1254-I1262 WeakPolarHBondContact CA-O 3.36Å; T1254-Y1263 HydrophobicContact CG2-CD1 4.09Å; T1254-Y1263 HydrophobicContact CG2-CE1 3.72Å; T1254-Y1263 WeakPolarHBondContact OG1-CD1 2.26Å; T1254-Y1263 WeakPolarHBondContact OG1-CE1 3.33Å
1255H93.1Very high91.4Very high44 Ų4478.1 Ų78.120%0.20440%0.401CS..EExtended strand (participates in β ladder)0133.40-58.4-79.4000109L1253 I1257 I1261 I1262 E1264L1253-H1255 WeakPolarHBondContact CD2-CE1 3.25Å; L1253-H1255 WeakPolarHBondContact CD2-NE2 2.99Å; H1255-I1257 HydrophobicContact CB-CD1 4.07Å; H1255-I1257 HydrophobicContact CB-CG1 4.15Å; H1255-I1261 CarbonylContact O-C 3.32Å; H1255-I1261 WeakPolarHBondContact O-CA 2.71Å; H1255-I1262 WeakPolarHBondContact CA-O 3.41Å; H1255-I1262 HydrophobicContact CB-CB 3.94Å; H1255-I1262 PolarHBondContact N-O 3.27Å; H1255-I1262 PolarHBondContact O-N 3.49Å; H1255-E1264 IonicContact CD2-OE2 3.69Å; H1255-E1264 IonicContact CE1-OE2 3.71Å; H1255-E1264 IonicContact NE2-OE2 2.79Å; H1255-E1264 PolarHBondContact NE2-OE2 3.31Å
1256Y93.4Very high91.6Very high157 Ų15777.2 Ų77.262%0.61640%0.397SS*.EExtended strand (participates in β ladder)trans-108.2103.5172.6-67.8-93.7000109.3T1254 H1260 I1261T1254-Y1256 HydrophobicContact CG2-CD2 4.28Å; T1254-Y1256 HydrophobicContact CG2-CE2 3.64Å; Y1256-H1260 CarbonylContact C-O 1.96Å; Y1256-H1260 WeakPolarHBondContact CA-O 3.28Å; Y1256-I1261 HydrophobicContact CD1-CD1 4.31Å; Y1256-I1261 HydrophobicContact CD1-CG1 3.63Å; Y1256-I1261 HydrophobicContact CE1-CD1 3.68Å; Y1256-I1261 HydrophobicContact CE1-CG1 3.49Å; Y1256-I1261 VanDerWaalsContact CE1-CG1 3.49Å; Y1256-I1261 HydrophobicContact CE1-CG2 4.38Å
1257I93Very high91.9Very high86 Ų8681.1 Ų81.144%0.44141%0.414SS..EExtended strand (participates in β ladder)trans-122.9118.8-178.1-58.4168.5000108.4H1255 G1259 H1260 I1262H1255-I1257 HydrophobicContact CB-CD1 4.07Å; H1255-I1257 HydrophobicContact CB-CG1 4.15Å; I1257-G1259 VanDerWaalsContact C-N 3.27Å; I1257-G1259 PolarHBondContact O-N 3.07Å; I1257-H1260 PolarHBondContact N-O 3.28Å; I1257-H1260 WeakPolarHBondContact O-CA 3.18Å; I1257-H1260 WeakPolarHBondContact O-CB 3.39Å; I1257-H1260 PolarHBondContact O-N 3.2Å; I1257-I1262 HydrophobicContact CD1-CD1 3.6Å; I1257-I1262 HydrophobicContact CG1-CD1 4.46Å
1258D91.9Very high92.2Very high155 Ų15584.4 Ų84.483%0.82944%0.435SS*.THydrogen-bonded Turntrans52.50173.9-74.5-15.5000110.9H1260D1258-H1260 PolarHBondContact O-N 2.59Å; D1258-H1260 PolarHBondContact O-ND1 2.76Å; D1258-H1260 VanDerWaalsContact O-ND1 3.15Å
1259G88.3Confident92.6Very high85 Ų8581.5 Ų81.588%0.87642%0.417SS*.THydrogen-bonded Turn00000000111.8I1257I1257-G1259 VanDerWaalsContact C-N 3.27Å; I1257-G1259 PolarHBondContact O-N 3.07Å
1260H89.9Confident92.7Very high132 Ų13278.8 Ų78.861%0.61141%0.406SS*.EExtended strand (participates in β ladder)0141.70-67.880.9000109.4Y1256 I1257 D1258Y1256-H1260 CarbonylContact C-O 1.96Å; Y1256-H1260 WeakPolarHBondContact CA-O 3.28Å; I1257-H1260 PolarHBondContact N-O 3.28Å; I1257-H1260 WeakPolarHBondContact O-CA 3.18Å; I1257-H1260 WeakPolarHBondContact O-CB 3.39Å; I1257-H1260 PolarHBondContact O-N 3.2Å; D1258-H1260 PolarHBondContact O-N 2.59Å; D1258-H1260 PolarHBondContact O-ND1 2.76Å; D1258-H1260 VanDerWaalsContact O-ND1 3.15Å
1261I92.3Very high92.4Very high87 Ų8784.7 Ų84.745%0.44645%0.445SS..EExtended strand (participates in β ladder)trans-101.9118.4176-58.9172.5000108.3T1254 H1255 Y1256 Y1263T1254-I1261 HydrophobicContact CG2-CG2 3.45Å; T1254-I1261 VanDerWaalsContact CG2-CG2 3.45Å; H1255-I1261 CarbonylContact O-C 3.32Å; H1255-I1261 WeakPolarHBondContact O-CA 2.71Å; Y1256-I1261 HydrophobicContact CD1-CD1 4.31Å; Y1256-I1261 HydrophobicContact CD1-CG1 3.63Å; Y1256-I1261 HydrophobicContact CE1-CD1 3.68Å; Y1256-I1261 HydrophobicContact CE1-CG1 3.49Å; Y1256-I1261 VanDerWaalsContact CE1-CG1 3.49Å; Y1256-I1261 HydrophobicContact CE1-CG2 4.38Å; I1261-Y1263 HydrophobicContact CG2-CD2 4.44Å; I1261-Y1263 HydrophobicContact CG2-CE1 4.05Å; I1261-Y1263 HydrophobicContact CG2-CE2 3.83Å
1262I94.1Very high92.1Very high83 Ų8385.6 Ų85.643%0.42645%0.453SS..EExtended strand (participates in β ladder)trans-109.40177-60.7175.1000109.2T1254 H1255 I1257T1254-I1262 CarbonylContact C-O 3.35Å; T1254-I1262 WeakPolarHBondContact CA-O 3.36Å; H1255-I1262 WeakPolarHBondContact CA-O 3.41Å; H1255-I1262 HydrophobicContact CB-CB 3.94Å; H1255-I1262 PolarHBondContact N-O 3.27Å; H1255-I1262 PolarHBondContact O-N 3.49Å; I1257-I1262 HydrophobicContact CD1-CD1 3.6Å; I1257-I1262 HydrophobicContact CG1-CD1 4.46Å
1263Y94.5Very high91.7Very high58 Ų5891 Ų9123%0.22748%0.482CS..EExtended strand (participates in β ladder)01200-63.8-76.3000109.7L1244 I1252 L1253 T1254 I1261 M1275 V1278L1244-Y1263 HydrophobicContact CD1-CE1 4.47Å; I1252-Y1263 HydrophobicContact CG2-CD1 4.03Å; I1252-Y1263 HydrophobicContact CG2-CG 4.41Å; L1253-Y1263 CarbonylContact O-C 3.48Å; L1253-Y1263 WeakPolarHBondContact O-CA 3.45Å; T1254-Y1263 HydrophobicContact CG2-CD1 4.09Å; T1254-Y1263 HydrophobicContact CG2-CE1 3.72Å; T1254-Y1263 WeakPolarHBondContact OG1-CD1 2.26Å; T1254-Y1263 WeakPolarHBondContact OG1-CE1 3.33Å; I1261-Y1263 HydrophobicContact CG2-CD2 4.44Å; I1261-Y1263 HydrophobicContact CG2-CE1 4.05Å; I1261-Y1263 HydrophobicContact CG2-CE2 3.83Å; Y1263-M1275 HydrophobicContact CE2-SD 4.4Å; Y1263-V1278 HydrophobicContact CD1-CG1 3.72Å; Y1263-V1278 HydrophobicContact CD2-CG1 3.84Å; Y1263-V1278 HydrophobicContact CD2-CG2 4.23Å; Y1263-V1278 HydrophobicContact CE1-CG1 3.64Å; Y1263-V1278 HydrophobicContact CE2-CG1 3.75Å; Y1263-V1278 HydrophobicContact CG-CG1 3.82Å; Y1263-V1278 HydrophobicContact CG-CG2 4.06Å
1264E94.2Very high91.5Very high111 Ų11189.7 Ų89.752%0.51948%0.48SS..EExtended strand (participates in β ladder)trans-110.7128.4176.4-174.5179.2172.200110.8I1252 L1253 H1255I1252-E1264 CarbonylContact C-O 3.3Å; I1252-E1264 VanDerWaalsContact CA-O 3.28Å; I1252-E1264 WeakPolarHBondContact CA-O 3.33Å; L1253-E1264 WeakPolarHBondContact CA-O 3.45Å; L1253-E1264 HydrophobicContact CB-CB 4.35Å; L1253-E1264 PolarHBondContact N-O 3.47Å; L1253-E1264 PolarHBondContact O-N 2.88Å; H1255-E1264 IonicContact CD2-OE2 3.69Å; H1255-E1264 IonicContact CE1-OE2 3.71Å; H1255-E1264 IonicContact NE2-OE2 2.79Å; H1255-E1264 PolarHBondContact NE2-OE2 3.31Å
1265S93.4Very high91.5Very high24 Ų2494.5 Ų94.517%0.16850%0.503CS..EExtended strand (participates in β ladder)trans-116.80-178.273.50000110R1251 K1267 F1269R1251-S1265 WeakPolarHBondContact O-CA 3.5Å; S1265-K1267 VanDerWaalsContact CB-O 3.26Å; S1265-K1267 WeakPolarHBondContact CB-O 3.3Å; S1265-K1267 PolarHBondContact O-N 3.07Å; S1265-K1267 PolarHBondContact OG-O 2.47Å; S1265-F1269 WeakPolarHBondContact OG-CE2 3.24Å
1266D94.3Very high91.4Very high75 Ų7596.5 Ų96.540%0.40151%0.514SS..SBend0-5.5058.3-31.4000111.3R1250 R1251R1250-D1266 WeakPolarHBondContact CG-OD1 3.42Å; R1251-D1266 WeakPolarHBondContact CA-OD1 3.33Å; R1251-D1266 PolarHBondContact N-OD1 2.96Å; R1251-D1266 IonicContact NE-OD2 3.89Å; R1251-D1266 IonicContact NH2-OD2 3.95Å; R1251-D1266 PolarHBondContact O-N 2.77Å; R1251-D1266 VanDerWaalsContact O-OD1 3.08Å
1267K92.2Very high91.3Very high82 Ų8290 Ų9036%0.35749%0.491SS..SBendtrans-130.6144.3173.7-62.9177.8-174.6-177.20109.6D1248 R1250 S1265 F1269D1248-K1267 PolarHBondContact O-NZ 3.12Å; R1250-K1267 HydrophobicContact CG-CB 3.97Å; R1250-K1267 HydrophobicContact CG-CD 4.4Å; R1250-K1267 HydrophobicContact CG-CG 4.38Å; R1250-K1267 VanDerWaalsContact CZ-C 3.48Å; R1250-K1267 PolarHBondContact NH1-O 2.47Å; R1250-K1267 VanDerWaalsContact NH2-CB 3.3Å; S1265-K1267 VanDerWaalsContact CB-O 3.26Å; S1265-K1267 WeakPolarHBondContact CB-O 3.3Å; S1265-K1267 PolarHBondContact O-N 3.07Å; S1265-K1267 PolarHBondContact OG-O 2.47Å; K1267-F1269 PolarHBondContact O-N 3.28Å
1268P92Very high91.4Very high116 Ų11686 Ų8675%0.75347%0.471SS*.PPolyproline II helixtrans-56.50-178.4-13.116.8000111.5R1250R1250-P1268 VanDerWaalsContact NH1-C 3.27Å; R1250-P1268 PolarHBondContact NH1-O 3.03Å; R1250-P1268 PolarHBondContact NH2-O 3.35Å; R1250-P1268 VanDerWaalsContact NH2-O 3.17Å
1269F94.2Very high91.4Very high63 Ų6383.2 Ų83.228%0.27645%0.453SS..PPolyproline II helix01410-74.3-77.1000110I1252 S1265 K1267 V1271 V1277 V1278I1252-F1269 HydrophobicContact CD1-CE1 4.37Å; I1252-F1269 HydrophobicContact CG2-CZ 4.43Å; S1265-F1269 WeakPolarHBondContact OG-CE2 3.24Å; K1267-F1269 PolarHBondContact O-N 3.28Å; F1269-V1271 PolarHBondContact O-N 3.18Å; F1269-V1277 HydrophobicContact CD1-CB 4.2Å; F1269-V1277 HydrophobicContact CD1-CG1 4.42Å; F1269-V1277 HydrophobicContact CE1-CB 4.33Å; F1269-V1277 HydrophobicContact CE1-CG1 4.27Å; F1269-V1278 HydrophobicContact CE1-CG2 3.64Å; F1269-V1278 HydrophobicContact CZ-CG2 3.96Å
1270P88.9Confident91.5Very high64 Ų6482.2 Ų82.242%0.41643%0.429SS..PPolyproline II helixtrans-49.5147.2171.5-16.322.2000111.7K1272 V1277P1270-K1272 PolarHBondContact O-N 2.63Å; P1270-V1277 HydrophobicContact CG-CG2 3.9Å
1271V84.5Confident91.6Very high153 Ų15376 Ų7693%0.92740%0.401SS*.SBendtrans-66-25.2-172178.60000109.5F1269F1269-V1271 PolarHBondContact O-N 3.18Å
1272K87.9Confident91.6Very high171 Ų17174.4 Ų74.474%0.74339%0.393SS*.SBendtrans-124.8128.6175.8-65.2-178.4-177.7-179.90109.6P1270 G1274P1270-K1272 PolarHBondContact O-N 2.63Å; K1272-G1274 PolarHBondContact O-N 2.79Å
1273N86.7Confident91.2Very high115 Ų11576.2 Ų76.262%0.61540%0.401SS*.  trans80.132.4170.6-63.2-16.2000111.1M1275 I1276N1273-M1275 PolarHBondContact O-N 3.24Å; N1273-I1276 HydrophobicContact CB-CB 4.33Å; N1273-I1276 HydrophobicContact CB-CD1 3.34Å; N1273-I1276 HydrophobicContact CB-CG1 3.89Å; N1273-I1276 VanDerWaalsContact O-CB 3.31Å; N1273-I1276 WeakPolarHBondContact O-CB 3.44Å; N1273-I1276 PolarHBondContact O-N 3.27Å; N1273-I1276 VanDerWaalsContact O-N 3.07Å
1274G90Very high90.7Very high19 Ų1978.6 Ų78.620%0.19641%0.413CS..Hα-helixtrans-55.4-27.8178.900000112K1272 I1276 V1277 V1278K1272-G1274 PolarHBondContact O-N 2.79Å; G1274-I1276 PolarHBondContact O-N 2.62Å; G1274-V1277 VanDerWaalsContact O-CB 3.3Å; G1274-V1277 WeakPolarHBondContact O-CB 3.4Å; G1274-V1277 PolarHBondContact O-N 2.49Å; G1274-V1278 PolarHBondContact O-N 3.15Å
1275M91.9Very high89.7Confident104 Ų10477.3 Ų77.351%0.51241%0.407SS..Hα-helixtrans-71.6-25.2-177.6-171.561.765.900110.8Y1263 N1273 V1277 V1278 E1279Y1263-M1275 HydrophobicContact CE2-SD 4.4Å; N1273-M1275 PolarHBondContact O-N 3.24Å; M1275-V1277 PolarHBondContact O-N 2.32Å; M1275-V1278 CarbonylContact O-C 3.49Å; M1275-V1278 WeakPolarHBondContact O-CB 3.15Å; M1275-V1278 PolarHBondContact O-N 3.26Å; M1275-V1278 HydrophobicContact SD-CB 4Å; M1275-V1278 HydrophobicContact SD-CG1 4.26Å; M1275-V1278 HydrophobicContact SD-CG2 4.44Å; M1275-E1279 HydrophobicContact CG-CG 4.16Å; M1275-E1279 WeakPolarHBondContact O-CB 3.06Å; M1275-E1279 VanDerWaalsContact O-CG 3.31Å; M1275-E1279 WeakPolarHBondContact O-CG 3.29Å; M1275-E1279 PolarHBondContact O-N 3.25Å
1276I91.3Very high88.4Confident86 Ų8682.5 Ų82.544%0.44143%0.428SS..Hα-helixtrans-63.1-35178.1-70.1177.3000109.8N1273 G1274 V1278 E1279 T1280N1273-I1276 HydrophobicContact CB-CB 4.33Å; N1273-I1276 HydrophobicContact CB-CD1 3.34Å; N1273-I1276 HydrophobicContact CB-CG1 3.89Å; N1273-I1276 VanDerWaalsContact O-CB 3.31Å; N1273-I1276 WeakPolarHBondContact O-CB 3.44Å; N1273-I1276 PolarHBondContact O-N 3.27Å; N1273-I1276 VanDerWaalsContact O-N 3.07Å; G1274-I1276 PolarHBondContact O-N 2.62Å; I1276-V1278 PolarHBondContact O-N 3.22Å; I1276-E1279 PolarHBondContact O-N 2.69Å; I1276-T1280 VanDerWaalsContact O-CB 3.32Å; I1276-T1280 WeakPolarHBondContact O-CB 3.32Å; I1276-T1280 PolarHBondContact O-N 3.1Å; I1276-T1280 PolarHBondContact O-OG1 2.51Å
1277V92.7Very high86.7Confident20 Ų2081.9 Ų81.912%0.12143%0.43CS..Hα-helixtrans-66.6-38.5178.4176.10000109.7P1247 I1252 F1269 P1270 G1274 M1275 E1279 T1280 A1281P1247-V1277 HydrophobicContact CG-CG1 4.19Å; I1252-V1277 HydrophobicContact CD1-CG1 4.07Å; F1269-V1277 HydrophobicContact CD1-CB 4.2Å; F1269-V1277 HydrophobicContact CD1-CG1 4.42Å; F1269-V1277 HydrophobicContact CE1-CB 4.33Å; F1269-V1277 HydrophobicContact CE1-CG1 4.27Å; P1270-V1277 HydrophobicContact CG-CG2 3.9Å; G1274-V1277 VanDerWaalsContact O-CB 3.3Å; G1274-V1277 WeakPolarHBondContact O-CB 3.4Å; G1274-V1277 PolarHBondContact O-N 2.49Å; M1275-V1277 PolarHBondContact O-N 2.32Å; V1277-E1279 VanDerWaalsContact C-N 3.27Å; V1277-E1279 PolarHBondContact O-N 3.37Å; V1277-T1280 PolarHBondContact O-N 3.31Å; V1277-A1281 WeakPolarHBondContact O-CB 3.39Å; V1277-A1281 PolarHBondContact O-N 3.39Å
1278V93.6Very high84.4Confident4 Ų481.4 Ų81.42%0.02444%0.436CS..Hα-helixtrans-69.4-41.5-179.6175.30000109.6I1252 Y1263 F1269 G1274 M1275 I1276 T1280 A1281 L1282I1252-V1278 HydrophobicContact CD1-CG2 4.45Å; Y1263-V1278 HydrophobicContact CD1-CG1 3.72Å; Y1263-V1278 HydrophobicContact CD2-CG1 3.84Å; Y1263-V1278 HydrophobicContact CD2-CG2 4.23Å; Y1263-V1278 HydrophobicContact CE1-CG1 3.64Å; Y1263-V1278 HydrophobicContact CE2-CG1 3.75Å; Y1263-V1278 HydrophobicContact CG-CG1 3.82Å; Y1263-V1278 HydrophobicContact CG-CG2 4.06Å; F1269-V1278 HydrophobicContact CE1-CG2 3.64Å; F1269-V1278 HydrophobicContact CZ-CG2 3.96Å; G1274-V1278 PolarHBondContact O-N 3.15Å; M1275-V1278 CarbonylContact O-C 3.49Å; M1275-V1278 WeakPolarHBondContact O-CB 3.15Å; M1275-V1278 PolarHBondContact O-N 3.26Å; M1275-V1278 HydrophobicContact SD-CB 4Å; M1275-V1278 HydrophobicContact SD-CG1 4.26Å; M1275-V1278 HydrophobicContact SD-CG2 4.44Å; I1276-V1278 PolarHBondContact O-N 3.22Å; V1278-T1280 PolarHBondContact O-N 2.95Å; V1278-A1281 CarbonylContact O-C 3.34Å; V1278-A1281 WeakPolarHBondContact O-CB 3.11Å; V1278-A1281 PolarHBondContact O-N 3.24Å; V1278-L1282 HydrophobicContact CG1-CD1 3.52Å; V1278-L1282 HydrophobicContact CG1-CG 4.47Å; V1278-L1282 WeakPolarHBondContact O-CB 3.33Å; V1278-L1282 WeakPolarHBondContact O-CD1 3.32Å; V1278-L1282 PolarHBondContact O-N 3.31Å
1279E92.8Very high82.2Confident96 Ų9682.4 Ų82.445%0.44943%0.434SS..Hα-helixtrans-63.5-40.1-179.3-78.6-179.1-177.400111.3M1275 I1276 V1277 A1281 L1282 M1283M1275-E1279 HydrophobicContact CG-CG 4.16Å; M1275-E1279 WeakPolarHBondContact O-CB 3.06Å; M1275-E1279 VanDerWaalsContact O-CG 3.31Å; M1275-E1279 WeakPolarHBondContact O-CG 3.29Å; M1275-E1279 PolarHBondContact O-N 3.25Å; I1276-E1279 PolarHBondContact O-N 2.69Å; V1277-E1279 VanDerWaalsContact C-N 3.27Å; V1277-E1279 PolarHBondContact O-N 3.37Å; E1279-A1281 PolarHBondContact O-N 3.21Å; E1279-L1282 PolarHBondContact O-N 3.2Å; E1279-L1282 VanDerWaalsContact O-N 3.14Å; E1279-M1283 WeakPolarHBondContact O-CB 3.11Å; E1279-M1283 WeakPolarHBondContact O-CG 3.35Å; E1279-M1283 PolarHBondContact O-N 3.45Å
1280T91Very high79.9Confident63 Ų6384.8 Ų84.839%0.38745%0.454SS..Hα-helixtrans-66.3-36.5-179.5-54.70000110.2P1247 I1276 V1277 V1278 L1282 M1283 K1284P1247-T1280 HydrophobicContact CG-CG2 4.19Å; I1276-T1280 VanDerWaalsContact O-CB 3.32Å; I1276-T1280 WeakPolarHBondContact O-CB 3.32Å; I1276-T1280 PolarHBondContact O-N 3.1Å; I1276-T1280 PolarHBondContact O-OG1 2.51Å; V1277-T1280 PolarHBondContact O-N 3.31Å; V1278-T1280 PolarHBondContact O-N 2.95Å; T1280-L1282 PolarHBondContact O-N 2.79Å; T1280-M1283 PolarHBondContact O-N 3.26Å; T1280-K1284 WeakPolarHBondContact O-CB 3.49Å; T1280-K1284 PolarHBondContact O-N 2.75Å
1281A91.9Very high77.2Confident1 Ų186.7 Ų86.71%0.00847%0.468CS..Hα-helixtrans-69.3-32.7179.300000110.5L1244 I1252 V1277 V1278 E1279 M1283 K1284 Q1285L1244-A1281 HydrophobicContact CB-CB 4.01Å; I1252-A1281 HydrophobicContact CD1-CB 3.68Å; V1277-A1281 WeakPolarHBondContact O-CB 3.39Å; V1277-A1281 PolarHBondContact O-N 3.39Å; V1278-A1281 CarbonylContact O-C 3.34Å; V1278-A1281 WeakPolarHBondContact O-CB 3.11Å; V1278-A1281 PolarHBondContact O-N 3.24Å; E1279-A1281 PolarHBondContact O-N 3.21Å; A1281-M1283 PolarHBondContact O-N 3.38Å; A1281-K1284 PolarHBondContact O-N 3.04Å; A1281-Q1285 PolarHBondContact O-N 3.35Å
1282L90.8Very high74.6Confident54 Ų5484.2 Ų84.228%0.28346%0.458SS..Hα-helixtrans-73.3-37.4-179.1-86.2147.8000110.3L1244 V1278 E1279 T1280 K1284 Q1285 Q1286L1244-L1282 HydrophobicContact CD1-CD1 4.35Å; L1244-L1282 HydrophobicContact CD1-CD2 3.79Å; L1244-L1282 HydrophobicContact CD1-CG 3.52Å; L1244-L1282 HydrophobicContact CD2-CD2 4.47Å; V1278-L1282 HydrophobicContact CG1-CD1 3.52Å; V1278-L1282 HydrophobicContact CG1-CG 4.47Å; V1278-L1282 WeakPolarHBondContact O-CB 3.33Å; V1278-L1282 WeakPolarHBondContact O-CD1 3.32Å; V1278-L1282 PolarHBondContact O-N 3.31Å; E1279-L1282 PolarHBondContact O-N 3.2Å; E1279-L1282 VanDerWaalsContact O-N 3.14Å; T1280-L1282 PolarHBondContact O-N 2.79Å; L1282-K1284 PolarHBondContact O-N 3.4Å; L1282-Q1285 WeakPolarHBondContact O-CB 3.45Å; L1282-Q1285 PolarHBondContact O-N 3.36Å; L1282-Q1286 WeakPolarHBondContact O-CG 3.41Å; L1282-Q1286 PolarHBondContact O-N 3.38Å; L1282-Q1286 VanDerWaalsContact O-N 3.07Å
1283M87.1Confident71.9Confident121 Ų12181.3 Ų81.360%0.59646%0.455SS*.Hα-helixtrans-67.3-36.6178.3-73.7169.2171.800111E1279 T1280 A1281 Q1285 Q1286 S1287E1279-M1283 WeakPolarHBondContact O-CB 3.11Å; E1279-M1283 WeakPolarHBondContact O-CG 3.35Å; E1279-M1283 PolarHBondContact O-N 3.45Å; T1280-M1283 PolarHBondContact O-N 3.26Å; A1281-M1283 PolarHBondContact O-N 3.38Å; M1283-Q1285 PolarHBondContact O-N 3.47Å; M1283-Q1286 WeakPolarHBondContact O-CB 3.19Å; M1283-Q1286 PolarHBondContact O-N 3.2Å; M1283-S1287 PolarHBondContact O-N 3.07Å
1284K83.4Confident69.2Low109 Ų10984 Ų8447%0.47447%0.469SS..Hα-helixtrans-66.7-32.7179.9-166.5172.1177.6-178.10111T1280 A1281 L1282 Q1286 S1287 C1288T1280-K1284 WeakPolarHBondContact O-CB 3.49Å; T1280-K1284 PolarHBondContact O-N 2.75Å; A1281-K1284 PolarHBondContact O-N 3.04Å; L1282-K1284 PolarHBondContact O-N 3.4Å; K1284-Q1286 PolarHBondContact O-N 3.2Å; K1284-S1287 WeakPolarHBondContact CA-OG 3.4Å; K1284-S1287 PolarHBondContact O-N 2.97Å; K1284-S1287 VanDerWaalsContact O-N 3.16Å; K1284-S1287 PolarHBondContact O-OG 2.92Å; K1284-C1288 PolarHBondContact O-N 3.35Å; K1284-C1288 VanDerWaalsContact O-N 3.11Å; K1284-C1288 PolarHBondContact O-SG 3.07Å
1285Q73.5Confident66.3Low84 Ų8488.6 Ų88.639%0.39350%0.498SS..Hα-helixtrans-69.3-27.8178.3-157-178.9-23.300110.7L1244 A1281 L1282 M1283 S1287L1244-Q1285 HydrophobicContact CD2-CB 3.96Å; L1244-Q1285 HydrophobicContact CD2-CG 3.98Å; L1244-Q1285 CovalentContact CD2-OE1 1.82Å; A1281-Q1285 PolarHBondContact O-N 3.35Å; L1282-Q1285 WeakPolarHBondContact O-CB 3.45Å; L1282-Q1285 PolarHBondContact O-N 3.36Å; M1283-Q1285 PolarHBondContact O-N 3.47Å; Q1285-S1287 VanDerWaalsContact C-N 3.29Å
1286Q65.2Low63.5Low132 Ų13289.6 Ų89.662%0.61751%0.512SS*.Hα-helixtrans-79.5-22.5-179.3-76178.612.400111L1282 M1283 K1284 L1289 V1290L1282-Q1286 WeakPolarHBondContact O-CG 3.41Å; L1282-Q1286 PolarHBondContact O-N 3.38Å; L1282-Q1286 VanDerWaalsContact O-N 3.07Å; M1283-Q1286 WeakPolarHBondContact O-CB 3.19Å; M1283-Q1286 PolarHBondContact O-N 3.2Å; K1284-Q1286 PolarHBondContact O-N 3.2Å; Q1286-L1289 PolarHBondContact O-N 3.16Å; Q1286-V1290 WeakPolarHBondContact O-CG2 3.45Å
1287S58.3Low60.7Low63 Ų6393.2 Ų93.244%0.44153%0.532SS..Hα-helixtrans-85-18.2179.4670000111M1283 K1284 Q1285 L1289 V1290 S1291M1283-S1287 PolarHBondContact O-N 3.07Å; K1284-S1287 WeakPolarHBondContact CA-OG 3.4Å; K1284-S1287 PolarHBondContact O-N 2.97Å; K1284-S1287 VanDerWaalsContact O-N 3.16Å; K1284-S1287 PolarHBondContact O-OG 2.92Å; Q1285-S1287 VanDerWaalsContact C-N 3.29Å; S1287-L1289 PolarHBondContact O-N 2.63Å; S1287-V1290 PolarHBondContact O-N 2.8Å; S1287-S1291 PolarHBondContact O-N 3.37Å; S1287-S1291 PolarHBondContact O-OG 2.39Å
1288C44.5Very low57.7Low71 Ų71100.5 Ų100.548%0.4856%0.562SS.*Hα-helixtrans-85.5-7.6175.8-29.70000109.8K1284 V1290K1284-C1288 PolarHBondContact O-N 3.35Å; K1284-C1288 VanDerWaalsContact O-N 3.11Å; K1284-C1288 PolarHBondContact O-SG 3.07Å; C1288-V1290 PolarHBondContact O-N 3.45Å
1289L45.7Very low54.6Low138 Ų138106 Ų10672%0.72360%0.596SS**Hα-helixtrans-93.8-1.3172.4-91.8152.9000110.6Q1286 S1287Q1286-L1289 PolarHBondContact O-N 3.16Å; S1287-L1289 PolarHBondContact O-N 2.63Å
1290V45.4Very low51.6Low113 Ų113109.5 Ų109.569%0.68561%0.61SS**Hα-helixtrans-116.816.8176179.80000109Q1286 S1287 C1288Q1286-V1290 WeakPolarHBondContact O-CG2 3.45Å; S1287-V1290 PolarHBondContact O-N 2.8Å; C1288-V1290 PolarHBondContact O-N 3.45Å
1291S33.3Very low48.7Very low103 Ų103112.4 Ų112.472%0.7262%0.622SS**SBendtrans-135.40176.6-68.50000109.3S1287S1287-S1291 PolarHBondContact O-N 3.37Å; S1287-S1291 PolarHBondContact O-OG 2.39Å
1292S29.5Very low45.8Very low102 Ų102119.5 Ų119.571%0.71366%0.659SS**SBend053.70-82.10000109.3
1293T30.7Very low42.9Very low110 Ų110123.8 Ų123.868%0.67568%0.682SS**  trans-139.574.6155.753.80000109
1294N31.2Very low40.3Very low172 Ų172121 Ų12192%0.9268%0.684SS**  trans-136.986.7148.8-80.6-31000109.7
1295S29.1Very low37.7Very low115 Ų115126.1 Ų126.180%0.80470%0.702SS**  trans-88.3132.3137.637.30000110.3
1296P32.9Very low35.7Very low124 Ų124130.2 Ų130.281%0.80572%0.721SS**  trans-85.40-178.333.5-4.7000111.7
1297L31.4Very low34.1Very low163 Ų163131.2 Ų131.285%0.85373%0.731SS**  000-90.9177.3000109.2
1298K30.5Very low32.9Very low172 Ų172131.5 Ų131.575%0.74874%0.743SS**  088.10-120.4175.8-174.7-176.20109.6F1300K1298-F1300 HydrophobicContact CD-CE2 4.11Å
1299T28.7Very low32.4Very low121 Ų121135 Ų13574%0.74276%0.762SS**  trans-28.295.6132.9-58.30000111.1L1301T1299-L1301 HydrophobicContact CG2-CB 4.18Å; T1299-L1301 HydrophobicContact CG2-CD1 3.99Å
1300F29Very low31.5Very low169 Ų169137 Ų13774%0.74177%0.77SS**  trans-92.786140.9-87.3-79.8000109.7K1298K1298-F1300 HydrophobicContact CD-CE2 4.11Å
1301L29.6Very low30.9Very low123 Ų123136.7 Ų136.764%0.64477%0.773SS**  trans-73.9111.5139.9-100.1137000109.5T1299 N1303T1299-L1301 HydrophobicContact CG2-CB 4.18Å; T1299-L1301 HydrophobicContact CG2-CD1 3.99Å; L1301-N1303 HydrophobicContact CD2-CB 4.21Å
1302I32.3Very low30.9Very low151 Ų151138.1 Ų138.177%0.77478%0.778SS**  trans-111.291.6133.1-64.5177000108.5
1303N29.5Very low31.1Very low144 Ų144140 Ų14077%0.7778%0.784SS**  trans-62.50135.9-81.5-4.5000111.2L1301L1301-N1303 HydrophobicContact CD2-CB 4.21Å
1304G32.2Very low31.2Very low63 Ų63144.4 Ų144.465%0.64979%0.794SS**  00000000110.4
1305Y29.7Very low31Very low215 Ų215141.5 Ų141.584%0.84379%0.787SS**  0111.30-115.3-93000109.4
1306E31.6Very low31.6Very low170 Ų170140.9 Ų140.979%0.79478%0.78SS**  43.6083.2-71.9-151.1165.200110.9
1307D31.9Very low31.5Very low154 Ų154141.9 Ų141.982%0.82479%0.785SS**  000-87.9-19.9000109.4
1308G32.4Very low31.4Very low68 Ų68138.1 Ų138.170%0.70178%0.777SS**  00000000110.2
1309V33.7Very low31.6Very low144 Ų144136.5 Ų136.587%0.87378%0.784SS**  0001780000108.2
1310M27.8Very low31.7Very low180 Ų180135.8 Ų135.889%0.88778%0.784SS**  0118.70-147100.2128.600110.2
1311S33.1Very low31.6Very low108 Ų108137.4 Ų137.476%0.75579%0.791SS**  -167.40122.166.40000109.5
1312T32.4Very low31.6Very low133 Ų133136.9 Ų136.982%0.81680%0.798SS**  0102.50-7.20000110.1
1313V33.5Very low31.5Very low140 Ų140134.7 Ų134.785%0.84880%0.796SS**  177.2102109.8177.90000107.8
1314K32.5Very low31.4Very low203 Ų203134.9 Ų134.988%0.88380%0.796SS**  74.4101.4111-104.3174.6-176.7-178.80110.4
1315S27.5Very low31.1Very low111 Ų111140.4 Ų140.478%0.77680%0.802SS**  27.90109.3129.90000111.9
1316P41.3Very low30.9Very low102 Ų102135.2 Ų135.266%0.66279%0.793SS**  00033.7-4.7000112
1317T31.4Very low30.6Very low145 Ų145132.2 Ų132.289%0.8979%0.787SS**  0119.90-43.20000109
1318A29.3Very low30.6Very low85 Ų85130.2 Ų130.270%0.70279%0.791SS**  98.9081.500000110.2
1319P35.3Very low30.4Very low137 Ų137132 Ų13289%0.8979%0.789SS**  0131.1033.8-5.7000111.7
1320S29.3Very low30.2Very low106 Ų106133.9 Ų133.974%0.74179%0.785SS**  trans-105.5137.5155.253.80000110.3
1321F26.9Very low30.4Very low203 Ų203131 Ų13189%0.8978%0.78SS**  35.70118.9-87.2-80.5000111.1
1322S29.9Very low30.3Very low112 Ų112131.4 Ų131.478%0.78378%0.777SS**  0124.8047.40000109.4
1323S29.5Very low30.1Very low106 Ų106131 Ų13174%0.74177%0.77SS**  76.6119.4111.7-93.20000110.5
1324L27.5Very low30Very low148 Ų148130.2 Ų130.278%0.77576%0.762SS**  98.3114.6120.9-88.9140.5000109.7
1325K26.7Very low30Very low178 Ų178127.1 Ų127.177%0.77475%0.75SS**  103.5115.6114.4-134.9167.8-177.7-178.20109.9
1326T25.9Very low30Very low106 Ų106131.1 Ų131.165%0.6576%0.756SS**  90.6107.9115.5-53.50000109.6
1327T25.3Very low29.5Very low108 Ų108130.4 Ų130.466%0.66375%0.753SS**  7594128.4-9.90000110.1V1329T1327-V1329 VanDerWaalsContact C-N 3.34Å
1328A30.7Very low29.6Very low111 Ų111131.8 Ų131.892%0.91775%0.75SS**  trans-82.487.3162.400000110.5
1329V28.7Very low29.5Very low107 Ų107131.9 Ų131.965%0.64875%0.751SS**  trans-53.3113.6148.7176.70000109.4T1327T1327-V1329 VanDerWaalsContact C-N 3.34Å
1330K29.2Very low29.2Very low182 Ų182132.5 Ų132.579%0.79175%0.746SS**  101.1123.196.3-94.5-178.4-175.7-178.90109.7
1331P31.8Very low29.2Very low121 Ų121134.4 Ų134.479%0.78675%0.746SS**SBendtrans-100.6108.4135.631-4.6000111.6
1332V31Very low29.2Very low115 Ų115128.7 Ų128.770%0.69774%0.736SS**SBend77.995.9126.4175.10000109.4
1333D29.7Very low29.6Very low125 Ų125129.5 Ų129.567%0.66874%0.737SS**  77.495.3121.6-79.1-29.5000110.5
1334N31.1Very low30Very low124 Ų124129.4 Ų129.466%0.66373%0.733SS**  102108.8118.7-82.8-9.2000110.4
1335H31.9Very low30.3Very low138 Ų138128 Ų12864%0.63974%0.736SS**  118.7090-92.6-75.1000109.9
1336E27.1Very low30.5Very low195 Ų195131.3 Ų131.391%0.91174%0.744SS**  091.90-104-172.815900109.7
1337S32Very low30.8Very low86 Ų86134 Ų13460%0.60175%0.754SS**  -61.796.4122.16.70000111.4
1338E31.6Very low31.7Very low175 Ų175133.8 Ų133.882%0.81875%0.754SS**  94.796.4119.8-82.3-146164.100110.2
1339A29Very low31.8Very low87 Ų87135.2 Ų135.272%0.71974%0.744SS**  34.597.2117.900000111.1
1340L28.4Very low32.1Very low149 Ų149138.1 Ų138.178%0.7875%0.751SS**  166.1102.4125.7-91.2156.8000109.1
1341I28.1Very low32Very low147 Ų147136.2 Ų136.275%0.75475%0.75SS**  74.4102.9106.6-61178000109.1
1342A28.3Very low32.2Very low83 Ų83137.4 Ų137.469%0.68675%0.754SS**  89.595.3106.500000110
1343T37.8Very low32.3Very low128 Ų128135.7 Ų135.779%0.78576%0.76SS**  trans5.3129.1134.539.70000111.4
1344P38.8Very low32.4Very low104 Ų104133.2 Ų133.268%0.67576%0.764SS**  155.4114.483.933.8-4.8000111.9R1346P1344-R1346 PolarHBondContact O-N 3.19Å
1345S33.4Very low32.4Very low120 Ų120134 Ų13484%0.83978%0.778SS**SBendtrans45.893.8153.490000111.1
1346R30.7Very low32.4Very low247 Ų247131 Ų13193%0.93278%0.784SS**SBendtrans53.494.6145.3-130.6-179.2-175.2-147.2-0.3110.9P1344P1344-R1346 PolarHBondContact O-N 3.19Å
1347L31.9Very low32.8Very low163 Ų163128 Ų12885%0.85379%0.785SS**  trans39.10146.7-76.4166.4000111.3
1348P43.6Very low32.8Very low103 Ų103127 Ų12767%0.66979%0.788SS**  00034.5-5.5000112.1
1349I34.4Very low32.5Very low140 Ų140130 Ų13072%0.71879%0.792SS**  000-63.2176.4000108.3
1350Q33.4Very low32.5Very low169 Ų169132.1 Ų132.179%0.7979%0.79SS**  000-112.7159.42.200110.2
1351D29Very low32.6Very low142 Ų142132.2 Ų132.276%0.75979%0.791SS**  000-102.3-12.1000109.9
1352V34.8Very low33.1Very low145 Ų145129.1 Ų129.188%0.87978%0.781SS**  000-175.80000108.1
1353G32.4Very low33Very low79 Ų79132.4 Ų132.481%0.81479%0.786SS**  00000000110.3
1354G32.2Very low32.7Very low74 Ų74133.6 Ų133.676%0.76378%0.78SS**  00000000110.5
1355C32.5Very low32.4Very low141 Ų141131.9 Ų131.995%0.95377%0.774SS**  000-68.60000109.4
1356G31.9Very low32.2Very low75 Ų75128.9 Ų128.977%0.77375%0.754SS**  00000000112.7
1357S34.5Very low32.4Very low132 Ų132123.5 Ų123.592%0.92374%0.744SS**  00040.50000111.5
1358G31.9Very low32.4Very low65 Ų65120.9 Ų120.967%0.6774%0.739SS**  0129.9000000110.3
1359W25.6Very low31.9Very low238 Ų238120.6 Ų120.690%0.90274%0.739SS**  100.9095.4-83.842.4000109.8
1360I28.7Very low31.8Very low130 Ų130119 Ų11967%0.66774%0.741SS**  0126.50-62.7176.5000108.5
1361N30.8Very low31.5Very low152 Ų152118.7 Ų118.781%0.81374%0.743SS**  132.10118.7-90.4-15.3000109.9
1362P39Very low31.6Very low82 Ų82116.7 Ų116.753%0.53274%0.74SS.*  00034-4.9000111.8
1363L26.5Very low31.5Very low151 Ų151117 Ų11779%0.79174%0.736SS**  0123.90-85.5157.4000109.2
1364K30Very low31.6Very low154 Ų154119 Ų11967%0.6773%0.731SS**  117.2121.3110.4-133.3168.3-176.3-174.90109.7G691 Q692G691-K1364 VanDerWaalsContact O-CD 3.26Å; G691-K1364 WeakPolarHBondContact O-CD 1.77Å; G691-K1364 WeakPolarHBondContact O-CE 3.41Å; G691-K1364 WeakPolarHBondContact O-CG 3.47Å; Q692-K1364 CarbonylContact O-C 3.55Å; Q692-K1364 VanDerWaalsContact O-C 3.27Å; Q692-K1364 WeakPolarHBondContact O-CA 3.16Å; Q692-K1364 WeakPolarHBondContact O-CG 3.37Å
1365A32.6Very low31.6Very low67 Ų67122.6 Ų122.655%0.55473%0.733SS**  145.40109.600000109Q692Q692-A1365 VanDerWaalsContact O-CA 3.27Å; Q692-A1365 WeakPolarHBondContact O-CA 2.14Å; Q692-A1365 PolarHBondContact O-N 2.77Å
1366S31Very low31.7Very low58 Ų58124.6 Ų124.641%0.40673%0.726SS.*  000-17.80000109.6
1367N34.4Very low31.9Very low134 Ų134128.8 Ų128.872%0.71773%0.725SS**  0122.40-77.9-10.3000109.8
1368S32.2Very low31.9Very low107 Ų107128.3 Ų128.375%0.74872%0.717SS**  100.5126.389.659.30000110
1369S32.1Very low32.2Very low98 Ų98133.3 Ų133.369%0.68573%0.728SS**  112122.295.5-10.60000109.8
1370S31.7Very low32.4Very low107 Ų107130.9 Ų130.975%0.74873%0.726SS**  30.1117.4114.531.80000111.2
1371L28.5Very low32.9Very low161 Ų161130.4 Ų130.484%0.84373%0.732SS**  115.4108.5125.5-98.3146.8000109.5
1372S31Very low33Very low100 Ų100127 Ų12770%0.69973%0.732SS**  trans105.3105.9130.866.40000109.9
1373I32.3Very low32.7Very low153 Ų153128.2 Ų128.279%0.78574%0.743SS**  99.8101.9118.8-73.5169.3000108.8
1374V34.1Very low32.7Very low119 Ų119128.5 Ų128.572%0.72174%0.743SS**  75.398.3125.7176.60000109.2
1375D33.5Very low32.8Very low150 Ų150124.5 Ų124.580%0.80274%0.74SS**  102.499.3120.7-101.6-22.9000110.1
1376K33.6Very low32.9Very low183 Ų183127.3 Ų127.380%0.79675%0.75SS**  50.30112.8-111-179.3-175.8-177.20111.1
1377H36.8Very low32.9Very low163 Ų163129.5 Ų129.576%0.75577%0.765SS**  000-92.2-74.4000109.4
1378T34.3Very low32.7Very low123 Ų123130.6 Ų130.676%0.75577%0.771SS**  00035.90000110.8
1379N36.8Very low32.5Very low170 Ų170130.7 Ų130.791%0.90977%0.772SS**  000-85.3-29.4000109.6
1380H31.6Very low32.9Very low186 Ų186131 Ų13186%0.86177%0.772SS**  000-97.5-56.7000112.1
1381P38.5Very low32.6Very low121 Ų121130 Ų13079%0.78677%0.769SS**  00034.2-5.3000112.1
1382G32.5Very low32.6Very low79 Ų79129.5 Ų129.581%0.81477%0.765SS**  0121.3000000110.4
1383S32.3Very low32.6Very low108 Ų108132.5 Ų132.576%0.75577%0.772SS**  94.7124.1100.9-126.50000110.2
1384I27.2Very low32.5Very low157 Ų157130.4 Ų130.481%0.80576%0.762SS**  84.8114.5103.5-62.9175.8000108.7
1385A31.7Very low32.5Very low71 Ų71131.7 Ų131.759%0.58776%0.759SS**  trans131.8107.7130.300000109.2
1386T35Very low32.3Very low126 Ų126133 Ų13377%0.77376%0.755SS**  115.5100.1125.2490000109.2
1387S31.4Very low32Very low104 Ų104131.7 Ų131.773%0.72775%0.751SS**  55.5109.3120.366.90000110.8
1388N30.7Very low32Very low157 Ų157129.2 Ų129.284%0.8475%0.748SS**  59.1104.6116.5-80.3-15.1000111.1
1389S27Very low32.1Very low109 Ų109134.8 Ų134.876%0.76276%0.755SS**  94.7148.5115.1-127.10000110.3
1390P40.3Very low31.8Very low105 Ų105138 Ų13868%0.68275%0.754SS**  -132.8145-65.234.3-5000112.1
1391A25.9Very low31.8Very low84 Ų84140.1 Ų140.169%0.69476%0.755SS**  121.7114.1123.900000109.6
1392M28.5Very low31.6Very low152 Ų152143.6 Ų143.675%0.74976%0.757SS**  -176.191.7128.9-109.2-124.3-104.500109.1L1394M1392-L1394 HydrophobicContact CG-CD1 4.26Å; M1392-L1394 HydrophobicContact SD-CD1 3.08Å; M1392-L1394 WeakPolarHBondContact SD-CD1 2.13Å; M1392-L1394 HydrophobicContact SD-CG 4.2Å
1393L30.7Very low31.8Very low163 Ų163144.8 Ų144.885%0.85375%0.751SS**  trans-171.598.1130.3-128.6128.2000109.2
1394L29.3Very low31.8Very low109 Ų109144.9 Ų144.957%0.57175%0.752SS**  61.3103.479.3-87.8165.1000110.6M1392M1392-L1394 HydrophobicContact CG-CD1 4.26Å; M1392-L1394 HydrophobicContact SD-CD1 3.08Å; M1392-L1394 WeakPolarHBondContact SD-CD1 2.13Å; M1392-L1394 HydrophobicContact SD-CG 4.2Å
1395H34Very low32.1Very low145 Ų145145 Ų14567%0.67175%0.754SS**  158.1108.9121.4-111.2-75.8000109.5
1396Y31.2Very low32.1Very low179 Ų179149.7 Ų149.770%0.70276%0.763SS**  96.5109.593.6-111.9-88.8000109.7
1397E27.1Very low32Very low155 Ų155151.9 Ų151.972%0.72477%0.765SS**  59.30101.9-120.8159.9-177.300110.8
1398T35.5Very low31.9Very low111 Ų111155.6 Ų155.668%0.68177%0.771SS**  0110.30-12.30000109.1
1399R37.7Very low31.7Very low239 Ų239155.9 Ų155.990%0.90277%0.772SS**  128.60116.3-103.6-161.7-110.7-138.5-0.6109.6
1400R29.7Very low31.7Very low238 Ų238160.4 Ų160.490%0.89877%0.773SS**  000-90.5-154.7-156.5-170.90.5110.9
1401R32.6Very low31.2Very low230 Ų230162.2 Ų162.287%0.86878%0.778SS**  000-89.6-164178.2158.60.8109.4
1402K32.7Very low31.3Very low194 Ų194163.8 Ų163.884%0.84377%0.774SS**  000-95.8-176-176.6176.50110.3
1403P36.5Very low31.4Very low104 Ų104163.1 Ų163.168%0.67577%0.772SS**  00033.7-5.1000112.1
1404S34Very low31.4Very low111 Ų111162.2 Ų162.278%0.77676%0.763SS**  00052.40000109.9
1405N32.2Very low31.3Very low159 Ų159162.5 Ų162.585%0.8577%0.765SS**SBend000-97.1-7.2000110
1406E32.5Very low31.2Very low169 Ų169162.9 Ų162.979%0.7977%0.767SS**  000-97.6-174.6161.500109.6
1407Q32.6Very low31.4Very low172 Ų172160.1 Ų160.180%0.80477%0.765SS**  000-82.6-174.40.700109.8
1408Q29.8Very low31.9Very low182 Ų182159 Ų15985%0.8576%0.764SS**  000-103.4177.75.700110.5
1409L26.7Very low31.9Very low164 Ų164158.1 Ų158.186%0.85976%0.762SS**  0125.60-137.991.6000111.2
1410Y26.9Very low31.5Very low203 Ų203151.8 Ų151.880%0.79675%0.754SS**  32.60126.5-134.5-97.3000110.8
1411N29.8Very low31.9Very low144 Ų144145.5 Ų145.577%0.7774%0.744SS**  0110.70-82.8-20000110
1412D28.1Very low31.6Very low117 Ų117138.9 Ų138.963%0.62673%0.733SS**  68.7103.998.8-91.6-20.8000110.5
1413I30.7Very low31.4Very low138 Ų138135.8 Ų135.871%0.70873%0.731SS**  27.4108.3119.9-59.5175.8000109.7
1414H29.1Very low31Very low144 Ų144135.5 Ų135.567%0.66773%0.731SS**  trans147.7106.6132.1-94.6-68.9000109.3
1415D28.6Very low30.7Very low115 Ų115136.8 Ų136.862%0.61573%0.73SS**  113.398.6107.4-90.6-25000109.6
1416E30.6Very low30.7Very low152 Ų152137 Ų13771%0.7173%0.725SS**  119.486.7112-86.2-130161.100109.6
1417N36.8Very low30.5Very low121 Ų121138 Ų13865%0.64772%0.723SS**  167.391.9124.4-89.5-19.2000109.7
1418D36.4Very low30.7Very low133 Ų133138.4 Ų138.471%0.71172%0.724SS**  105.896.6105.6-90.3-18.9000109.9
1419S36.9Very low30.7Very low91 Ų91138.2 Ų138.264%0.63672%0.724SS**  97.792.2103.4-34.90000110
1420S29.2Very low31.5Very low106 Ų106135.1 Ų135.174%0.74171%0.714SS**  13.3150.7118.112.70000111.7
1421P36.7Very low31.9Very low106 Ų106130.6 Ų130.669%0.68871%0.707SS**  166.8140.557.434.1-4.9000111.9
1422S27.2Very low32.3Very low91 Ų91132.6 Ų132.664%0.63671%0.712SS**  98.7112.6122.763.20000110.1
1423T28.4Very low32.4Very low129 Ų129130.1 Ų130.179%0.79171%0.714SS**  74.4113.2109.140.50000110
1424S28.3Very low32.5Very low98 Ų98131 Ų13169%0.68572%0.719SS**  116.3115.7113130.30000109.7
1425N26.7Very low32.4Very low139 Ų139131.3 Ų131.374%0.74372%0.724SS**  87116.2101.8-85.2-18.7000110.6
1426H32.7Very low32.7Very low163 Ų163130.6 Ų130.676%0.75573%0.734SS**  -171.2108121.8-102.259.5000109.6
1427Y28.8Very low32.9Very low190 Ų190129.1 Ų129.175%0.74574%0.741SS**  92.8106.193.8-100.3-84.5000109.8
1428H37Very low32.7Very low180 Ų180133.7 Ų133.783%0.83375%0.75SS**  167.598.3110-104-70.3000109.2
1429Q29.6Very low32.9Very low178 Ų178133 Ų13383%0.83275%0.754SS**  -9.10124.3-103.5-164-13.700112
1430P42.2Very low32.7Very low100 Ų100137.6 Ų137.665%0.64976%0.764SS**  0136.6034-4.9000112.2
1431T36.6Very low32.9Very low108 Ų108136.7 Ų136.766%0.66376%0.758SS**  139106.4109.6-30.10000109
1432Q37Very low32.8Very low185 Ų185137.7 Ų137.786%0.86476%0.763SS**  120.5105.7102.6-80.1-146.7-10.500109.7
1433G30.1Very low33Very low65 Ų65140 Ų14067%0.6777%0.766SS**  61.8108.788.100000111.7
1434I33Very low33.1Very low158 Ų158141.4 Ų141.481%0.8177%0.768SS**  147.30109.8-63.4179.5000108.1
1435L27.7Very low33.2Very low150 Ų150141.3 Ų141.379%0.78577%0.767SS**  0109.50-101.9138.4000110.4
1436A34.9Very low33.5Very low99 Ų99142.2 Ų142.282%0.81877%0.771SS**  -179.30128.200000109
1437S33.8Very low33.3Very low121 Ų121138.9 Ų138.985%0.84677%0.772SS**  00062.30000109.2
1438Y33.1Very low33.5Very low217 Ų217136.9 Ų136.985%0.85177%0.774SS**  000-86.6-83.3000111.1
1439P40.8Very low33.3Very low120 Ų120138.7 Ų138.778%0.77977%0.774SS**  00034.3-5.6000111.9
1440H33.4Very low33.4Very low186 Ų186136.9 Ų136.986%0.86177%0.77SS**  0116.90-134-118.6000109.2
1441S32.9Very low32.8Very low87 Ų87137.7 Ų137.761%0.60878%0.778SS**  102.2114.396.4550000110.2
1442T33.6Very low32.5Very low128 Ų128137.1 Ų137.179%0.78578%0.784SS**  106105.6104.8-41.70000109.5
1443I32.2Very low32Very low140 Ų140133.5 Ų133.572%0.71878%0.779SS**  155.1105.8104.3-65.2-164.4000107.9
1444L31.4Very low32Very low158 Ų158135.7 Ų135.783%0.82778%0.779SS**  111.2105.995.8-99.2145.3000109.6
1445S29.1Very low31.7Very low96 Ų96134 Ų13467%0.67178%0.776SS**  94.299.189.1-162.50000110
1446L33.2Very low31.7Very low157 Ų157136.7 Ų136.782%0.82278%0.777SS**  159.196.4115-98.6113.2000109.1
1447A28.7Very low31.4Very low94 Ų94136 Ų13678%0.77776%0.763SS**  -10.8102.8104.200000111.4
1448N32.6Very low31.2Very low147 Ų147138 Ų13879%0.78676%0.759SS**  -166.2100.1125.4-139.72.9000109.8
1449R33.5Very low31Very low219 Ų219132.3 Ų132.383%0.82675%0.751SS**  49.3095.3-97.2-171.3-173.5-1720.6110.9
1450N32.3Very low31Very low139 Ų139133 Ų13374%0.74376%0.755SS**  0108.60-78.2-16.9000109.8
1451S29.6Very low30.6Very low118 Ų118130.4 Ų130.483%0.82575%0.747SS**  1.2117.399.1-40.70000111.5
1452A30.5Very low30.4Very low95 Ų95132.2 Ų132.279%0.78575%0.754SS**  162.6117112.200000109.2
1453S25.4Very low30.1Very low110 Ų110129.7 Ų129.777%0.76974%0.741SS**  -2.80111.6135.30000111.7
1454V29.4Very low29.9Very low111 Ų111129.6 Ų129.667%0.67374%0.741SS**  0115.90172.20000108.3
1455V28.4Very low30.1Very low123 Ų123127.2 Ų127.275%0.74574%0.735SS**  59.1113.71201780000109.5
1456Y27.3Very low30Very low206 Ų206127.6 Ų127.681%0.80874%0.738SS**  61.4126.5123.2-106.7-87.3000110.6
1457T27.9Very low29.7Very low84 Ų84130.3 Ų130.352%0.51574%0.737SS.*  81.50108.257.20000109.9
1458Q29.6Very low29.7Very low162 Ų162131.6 Ų131.676%0.75773%0.731SS**  0116.10-122138.653.600109.5
1459S28.4Very low29.8Very low99 Ų99130.6 Ų130.669%0.69273%0.725SS**  29.7152122.3-190000111.4
1460P40.6Very low29.7Very low133 Ų133130.3 Ų130.386%0.86472%0.724SS**  trans-113.9113.3146.927.6-3.3000111.7
1461I26.3Very low29.3Very low133 Ų133131.9 Ų131.968%0.68273%0.727SS**  -23.10125.3-60.3177.1000110.5
1462V28.7Very low29.1Very low124 Ų124131.5 Ų131.575%0.75272%0.724SS**  0121.90173.20000108.2
1463S27.4Very low29.1Very low75 Ų75132.4 Ų132.452%0.52473%0.725SS.*  126.4121.475.4-62.70000110
1464I28Very low29.5Very low138 Ų138131.6 Ų131.671%0.70872%0.719SS**  80.3159.896.7-55.5177.5000109.2
1465P34.9Very low29.6Very low109 Ų109133.2 Ų133.271%0.70872%0.724SS**  cis179.9146.44433.1-3.6000112.7
1466S27.4Very low29.9Very low104 Ų104135 Ų13573%0.72773%0.726SS**  94.5123.492.4-141.80000110
1467R27.1Very low30.3Very low213 Ų213134.4 Ų134.480%0.80473%0.728SS**  144119.1112.5-116.7-178.8178165.20.4109.6
1468N27.4Very low30.5Very low121 Ų121134 Ų13465%0.64774%0.741SS**  111.3103.4113.3-88.9-9.4000110.2
1469D34.9Very low30.7Very low126 Ų126129.3 Ų129.367%0.67474%0.736SS**  157.1100.5122.7-83.5-27.9000109.3
1470R31.4Very low31.1Very low213 Ų213131.7 Ų131.780%0.80474%0.741SS**  112.40105.5-93.2-174.5-174.4171.61.2109.9
1471Q25.3Very low30.4Very low172 Ų172133.1 Ų133.180%0.80474%0.736SS**  000-98.1169.1-3.900111.1
1472S24.9Very low30.8Very low110 Ų110133 Ų13377%0.76974%0.736SS**  0104.7049.90000109.9
1473S30.8Very low30.8Very low115 Ų115132.2 Ų132.280%0.80473%0.731SS**SBend-159.895.6117.11340000109.5
1474S33.4Very low31.2Very low92 Ų92133.7 Ų133.764%0.64374%0.737SS**  139.1101.28956.70000109.5
1475D31.7Very low31.4Very low146 Ų146134.5 Ų134.578%0.78174%0.74SS**  112106.4100.6-87.2-25.6000110
1476M34.8Very low31.4Very low160 Ų160136.2 Ų136.279%0.78874%0.743SS**  133.6110.5101.1-85.6-137.4163.400109.4
1477K34.7Very low31.6Very low193 Ų193134.9 Ų134.984%0.83975%0.745SS**  94.1114.895.1-144.1161.5-175.8-169.90110.1
1478G31.8Very low31.9Very low76 Ų76134.6 Ų134.678%0.78475%0.75SS**  100.1110.394.300000110.9
1479G34.7Very low31.9Very low63 Ų63133.8 Ų133.865%0.64975%0.754SS**  107.70101.600000110.8
1480N35.9Very low31.7Very low150 Ų150134.2 Ų134.280%0.80276%0.755SS**  0120.50-67.1-6.7000110.4
1481E27.8Very low31.5Very low162 Ų162132.1 Ų132.176%0.75775%0.754SS**  87097.8-151.8177.9167.300110.2
1482L33.1Very low31.6Very low131 Ų131127.4 Ų127.469%0.68674%0.74SS**  000-143.989.6000109.4
1483T29.3Very low31.6Very low107 Ų107132 Ų13266%0.65674%0.742SS**  00040.80000110.3
1484V35.3Very low31.4Very low106 Ų106130.5 Ų130.564%0.64273%0.732SS**  0108.801750000108.1
1485M33.8Very low31.5Very low155 Ų155133 Ų13376%0.76473%0.733SS**  64.9123.798.2-76-131.3-112.300110.2
1486D33.6Very low31.5Very low146 Ų146133.4 Ų133.478%0.78173%0.73SS**  125.9117.3100.7-91.6-20.9000109.5
1487G32.1Very low31.3Very low75 Ų75129.6 Ų129.677%0.77372%0.719SS**  93.2114.387.500000111
1488K33.6Very low31.2Very low207 Ų207127.4 Ų127.490%0.971%0.712SS**  114.2120.5104.6-128.9172.8-175.5-1710109.7
1489S26.5Very low31.1Very low104 Ų104134.1 Ų134.173%0.72772%0.715SS**  67.10101.5-165.50000110.5
1490I32Very low30.6Very low135 Ų135139 Ų13969%0.69272%0.721SS**  0114.20-54.4179.9000108
1491E27Very low30.4Very low169 Ų169139.2 Ų139.279%0.7972%0.716SS**  76.2113.9111.2-115.9174.3-176.500110.5
1492S26Very low30.4Very low74 Ų74135.8 Ų135.852%0.51771%0.707SS.*  90122109.1-8.90000109.9
1493Y25.8Very low30.2Very low207 Ų207137.7 Ų137.781%0.81271%0.712SS**  103.2120.3112.7-93.9-84.3000109.5
1494S27.4Very low29.9Very low83 Ų83137 Ų13758%0.5871%0.712SS**  88.6125.295.3-108.10000110.1
1495H33.8Very low29.5Very low144 Ų144136.4 Ų136.467%0.66771%0.713SS**  146.2117.4107.8-102.5-89.7000109.3
1496H32Very low29.3Very low154 Ų154135 Ų13571%0.71371%0.712SS**  106116.891.7-129.510.6000110
1497S31.7Very low29Very low81 Ų81132.9 Ų132.957%0.56671%0.71SS**  157.8114.894.3-175.40000109.5
1498Q31.5Very low28.6Very low146 Ų146136.6 Ų136.668%0.68271%0.711SS**  123.8106.284-103.6-169.41.800109.8
1499Y30.3Very low28.4Very low217 Ų217132.3 Ų132.385%0.85171%0.707SS**  176.9101.6106.5-101.5-84.6000109.1
1500Q24.2Very low28.5Very low165 Ų165137.1 Ų137.177%0.77172%0.715SS**  -6.4115.4108.7-87.9-165.914.700111.9
1501H31Very low28.8Very low155 Ų155135.6 Ų135.672%0.71871%0.714SS**  170108.5105.5-113.4-86000109.2
1502T29.5Very low28.8Very low91 Ų91134.4 Ų134.456%0.55871%0.712SS**  82.5111.286.443.60000110
1503E27.2Very low28.9Very low170 Ų170137.3 Ų137.379%0.79472%0.722SS**  112.5113.597-77.1-165.3173.400109.8
1504S24.8Very low29.3Very low93 Ų93135.4 Ų135.465%0.6572%0.72SS**  72.8115.3104.241.80000110.5
1505S26.8Very low29.5Very low94 Ų94137.6 Ų137.666%0.65772%0.724SS**  128.6118.4108.736.50000109.6
1506T28.4Very low29.3Very low124 Ų124138.5 Ų138.576%0.76173%0.729SS**  114.4111.3116.437.50000109.3
1507S27.8Very low29.3Very low103 Ų103133 Ų13372%0.7271%0.707SS**  121110.3107.361.30000109.7
1508L23.5Very low29.3Very low153 Ų153132 Ų13280%0.80170%0.7SS**  61101108.5-125.6103.4000110.4
1509S29.6Very low29.5Very low117 Ų117129.4 Ų129.482%0.81870%0.699SS**  trans179.692.5130.847.70000109.5
1510K27.4Very low29.5Very low204 Ų204122.1 Ų122.189%0.88769%0.689SS**  trans-23156.1137.6-84.6177.2-174.9-178.70111.6
1511P39.9Very low30Very low104 Ų104121 Ų12168%0.67569%0.687SS**  cis-155.6150.1-24.934.6-6.1000111.9
1512L27Very low29.9Very low143 Ų143115.2 Ų115.275%0.74966%0.661SS**  trans173.6112.5137.2-105.5144.9000109.1
1513N27.2Very low30Very low135 Ų135117.9 Ų117.972%0.72267%0.669SS**  109.9100104-100.8-0.9000110.2
1514E33.4Very low30.1Very low168 Ų168112.8 Ų112.879%0.78566%0.662SS**  157.693.9127.6-120.2179.2-179.800109.6
1515I33.1Very low30.1Very low128 Ų128116.2 Ų116.266%0.65667%0.672SS**  105.70110.8-62.1174.9000108.7
1516Q28.6Very low30.5Very low164 Ų164118 Ų11877%0.76668%0.679SS**  0115.10-90-179.9-10.700111
1517S32.1Very low30.5Very low38 Ų38116.9 Ų116.927%0.26668%0.677SS.*  143.1116.2107.1-137.20000109.2V35 T36V35-S1517 WeakPolarHBondContact CA-OG 2.64Å; V35-S1517 WeakPolarHBondContact CB-OG 3.26Å; V35-S1517 VanDerWaalsContact CG1-CA 3.4Å; V35-S1517 WeakPolarHBondContact CG1-OG 2.7Å; V35-S1517 WeakPolarHBondContact CG2-OG 3.27Å; T36-S1517 WeakPolarHBondContact CA-OG 3.37Å; T36-S1517 WeakPolarHBondContact CB-OG 3.01Å; T36-S1517 CovalentContact CG2-OG 0.97Å; T36-S1517 WeakPolarHBondContact CG2-OG 3.42Å; T36-S1517 PolarHBondContact OG1-OG 3.47Å
1518S33.2Very low30.6Very low59 Ų59118.1 Ų118.141%0.41368%0.68SS.*  118.3114.388.1540000109.6V35 T36V35-S1518 WeakPolarHBondContact CG1-OG 3.4Å; T36-S1518 WeakPolarHBondContact OG1-CB 3.39Å; T36-S1518 PolarHBondContact OG1-OG 3.06Å
1519S33.9Very low30.9Very low93 Ų93115.4 Ų115.465%0.6568%0.68SS**  49.2125.498.3-113.60000110.7
1520G31Very low31.1Very low64 Ų64119.4 Ų119.466%0.6668%0.683SS**  119.3121.695.800000110.4
1521I35.1Very low31.5Very low141 Ų141115.7 Ų115.772%0.72367%0.672SS**  177.3112.2107.8-61.1-177.6000108.2V1210V1210-I1521 HydrophobicContact CB-CG2 3.91Å; V1210-I1521 HydrophobicContact CG1-CB 4.15Å; V1210-I1521 HydrophobicContact CG1-CG1 4.27Å; V1210-I1521 HydrophobicContact CG1-CG2 3.06Å; V1210-I1521 HydrophobicContact CG2-CG2 3.9Å
1522M29Very low31.3Very low33 Ų33118.5 Ų118.516%0.16368%0.677CS.*  -8.7125.6115-152.8-169.4-79.100111.5V1208 C1209 V1210V1208-M1522 HydrophobicContact CB-CE 2.88Å; V1208-M1522 HydrophobicContact CB-SD 3.96Å; V1208-M1522 HydrophobicContact CG1-CB 4.47Å; V1208-M1522 HydrophobicContact CG1-CE 2.13Å; V1208-M1522 HydrophobicContact CG1-CG 3.57Å; V1208-M1522 HydrophobicContact CG1-SD 3.32Å; V1208-M1522 WeakPolarHBondContact CG1-SD 3.33Å; V1208-M1522 HydrophobicContact CG2-CE 4.11Å; V1208-M1522 WeakPolarHBondContact O-CE 3.4Å; C1209-M1522 VanDerWaalsContact C-CG 3.44Å; C1209-M1522 CovalentContact CA-SD 2.13Å; C1209-M1522 WeakPolarHBondContact CA-SD 3.19Å; C1209-M1522 HydrophobicContact CB-CB 2.69Å; C1209-M1522 CovalentContact CB-CE 1.61Å; C1209-M1522 HydrophobicContact CB-CE 1.61Å; C1209-M1522 HydrophobicContact CB-CG 2.84Å; C1209-M1522 HydrophobicContact CB-SD 2.14Å; C1209-M1522 WeakPolarHBondContact CB-SD 3.27Å; C1209-M1522 PolarHBondContact N-SD 2.8Å; C1209-M1522 WeakPolarHBondContact O-CE 3.5Å; C1209-M1522 WeakPolarHBondContact O-CG 3.14Å; C1209-M1522 CovalentContact O-SD 1.79Å; C1209-M1522 CovalentContact SG-CE 1.77Å; C1209-M1522 WeakPolarHBondContact SG-CE 3.23Å; C1209-M1522 PolarHBondContact SG-SD 3.02Å; V1210-M1522 HydrophobicContact CB-CB 3.67Å; V1210-M1522 WeakPolarHBondContact CB-O 3.45Å; V1210-M1522 HydrophobicContact CB-SD 4.44Å; V1210-M1522 HydrophobicContact CG2-CB 2.63Å; V1210-M1522 HydrophobicContact CG2-CE 4.45Å; V1210-M1522 HydrophobicContact CG2-CG 3.76Å; V1210-M1522 WeakPolarHBondContact CG2-O 3.47Å; V1210-M1522 HydrophobicContact CG2-SD 3.85Å
1523M31.2Very low31.4Very low148 Ų148116.3 Ų116.373%0.72967%0.673SS**  129131.595.6-85.9-130.9-99.200109.2C1209C1209-M1523 WeakPolarHBondContact O-CE 3.36Å; C1209-M1523 WeakPolarHBondContact O-CG 3.37Å
1524G28.4Very low31.7Very low63 Ų63116.4 Ų116.465%0.64968%0.679SS**  120.9116.9102.900000110.7
1525L26.7Very low31.3Very low164 Ų164114.4 Ų114.486%0.85968%0.682SS**  118.8114.6104.6-66.9173.8000109.4
1526T34.7Very low31.2Very low131 Ų131116.3 Ų116.380%0.80469%0.688SS**  163105.4116.153.10000108.8
1527S29Very low31.2Very low102 Ų102117 Ų11771%0.71369%0.691SS**  80.5106.9105.5-144.10000110.6
1528T29.8Very low31Very low129 Ų129126.9 Ų126.979%0.79172%0.723SS**  114.3110.910934.50000109.3
1529A28.7Very low30.9Very low96 Ų96131.2 Ų131.279%0.79374%0.74SS**  128.3105.9101.900000109.4
1530F34.5Very low30.9Very low201 Ų201133 Ų13388%0.88275%0.75SS**  -174.799.8121.2-132.6-95.3000108.9
1531N35.3Very low30.7Very low125 Ų125134.3 Ų134.367%0.66875%0.749SS**  43.8114.1116.4-106.5-34.4000111.8
1532Q36.1Very low30.7Very low164 Ų164135 Ų13577%0.76675%0.752SS**  120.2107.3103.1-100.6-178.525.800109.6
1533S28.2Very low30.8Very low96 Ų96137.6 Ų137.667%0.67178%0.779SS**  35.2119.4106.5190000111.4
1534T34.9Very low30.7Very low138 Ų138140 Ų14085%0.84779%0.789SS**  146.40120.827.80000108.9
1535C24.4Very low30.7Very low126 Ų126141.4 Ų141.485%0.85179%0.794SS**  0109.30-79.20000110.9
1536Q29.6Very low30.9Very low168 Ų168141.1 Ų141.179%0.78579%0.79SS**  124.7119.1119-87.8-151.2-14.300109.4
1537Q28.8Very low30.7Very low177 Ų177145.3 Ų145.383%0.82779%0.793SS**  78.9111.8119.6-92.5-167.14.600110.1
1538R29.4Very low30.7Very low247 Ų247143.5 Ų143.593%0.93279%0.79SS**  169.5101.6125.2-131-176-175170.81109.2
1539L30.2Very low31Very low149 Ų149145.3 Ų145.378%0.7879%0.793SS**  19.7141.7128.6-97.997.6000111.1
1540P33.1Very low31.2Very low131 Ų131145.6 Ų145.685%0.85179%0.79SS**  -127.2116.1117.632.9-5.1000111.5
1541S27.6Very low31.2Very low92 Ų92144.1 Ų144.164%0.64379%0.785SS**  4.3120.9121-116.80000111.7
1542I34.5Very low30.7Very low155 Ų155144.1 Ų144.180%0.79579%0.79SS**  164.1112.5104.9-69.6169.9000108
1543A31.8Very low30.6Very low88 Ų88143.7 Ų143.773%0.72779%0.791SS**  97.5106.3100.300000109.8
1544Q28.5Very low30.5Very low198 Ų198145 Ų14593%0.92580%0.795SS**  21.1123.4114.1-76.2176.312.500111.2
1545A28.6Very low30.4Very low92 Ų92143.5 Ų143.576%0.7679%0.788SS**  151.9120112.400000109
1546M30.8Very low30.6Very low158 Ų158143.2 Ų143.278%0.77879%0.788SS**  163.10108-96.5-151-51.400109.2
1547Y31Very low30.8Very low220 Ų220145.8 Ų145.886%0.86380%0.797SS**  0109.60-103.8-88.6000109.6
1548G28Very low30.8Very low64 Ų64139.2 Ų139.266%0.6678%0.776SS**  108.309900000110.6
1549I37.6Very low30.8Very low166 Ų166136.1 Ų136.185%0.85178%0.778SS**  098.40-24.1173.9000107.9
1550S32.8Very low31.1Very low103 Ų103136.3 Ų136.372%0.7278%0.778SS**  89.1100.1104.1-87.20000110.3
1551Q34.1Very low31.5Very low169 Ų169135.6 Ų135.679%0.7977%0.772SS**  133.499.8106.7-73.8-167.136.600109.2
1552T24.5Very low32.7Very low125 Ų125134.5 Ų134.577%0.76776%0.763SS**  19.50104-3.10000111.1
1553I34.9Very low34.1Very low155 Ų155132 Ų13280%0.79575%0.751SS**  085.70-60.1175.8000108
1554T25.4Very low35.9Very low123 Ų123132.8 Ų132.876%0.75575%0.748SS**  trans-52.7107.1141.329.30000111.2
1555P33.4Very low38.4Very low108 Ų108125.4 Ų125.470%0.70172%0.718SS**  trans-90.6100.616233.4-6.6000111.7F1557P1555-F1557 PolarHBondContact O-N 3.3Å
1556S27.3Very low40.9Very low120 Ų120122.3 Ų122.384%0.83969%0.69SS**  trans6.785.4136-113.40000111.6G1558S1556-G1558 PolarHBondContact O-N 3.19Å
1557F34.2Very low43.3Very low221 Ų221124.9 Ų124.997%0.96970%0.697SS**  trans-42.80152.9-78.5-81.1000110.9P1555P1555-F1557 PolarHBondContact O-N 3.3Å
1558G29.1Very low45.8Very low39 Ų39116.3 Ų116.340%0.40268%0.676SS.*  093.1000000110.8S1556 L1560S1556-G1558 PolarHBondContact O-N 3.19Å; G1558-L1560 VanDerWaalsContact O-CG 3.31Å; G1558-L1560 WeakPolarHBondContact O-CG 3.22Å; G1558-L1560 PolarHBondContact O-N 3.2Å
1559L30.4Very low48.8Very low183 Ų183115.2 Ų115.296%0.95866%0.657SS**  trans34.257.8144.1-76.6166.6000111.1T1561L1559-T1561 PolarHBondContact O-N 3.25Å
1560L35.6Very low51.5Low152 Ų152107.7 Ų107.780%0.79662%0.618SS**  trans-77.989.1-172.2-70.8172.4000109.8G1558G1558-L1560 VanDerWaalsContact O-CG 3.31Å; G1558-L1560 WeakPolarHBondContact O-CG 3.22Å; G1558-L1560 PolarHBondContact O-N 3.2Å
1561T41Very low54.4Low117 Ų117108.4 Ų108.472%0.71861%0.606SS**  trans-25.10145.656.40000111L1559 N1563L1559-T1561 PolarHBondContact O-N 3.25Å; T1561-N1563 VanDerWaalsContact C-N 3.32Å; T1561-N1563 PolarHBondContact O-N 3.47Å
1562P52.8Low57.3Low69 Ų69107 Ų10745%0.44860%0.597SS.*  096.403.12.9000112P1564 G1584P1562-P1564 VanDerWaalsContact O-N 3.1Å; P1562-G1584 WeakPolarHBondContact CA-O 3Å; P1562-G1584 WeakPolarHBondContact CB-O 2.58Å
1563N63.6Low60.7Low102 Ų102101.5 Ų101.555%0.54556%0.562SS.*  trans-28.3121.5169.1-109.2-21.7000112T1561 R1631T1561-N1563 VanDerWaalsContact C-N 3.32Å; T1561-N1563 PolarHBondContact O-N 3.47Å; N1563-R1631 PolarHBondContact O-NH2 3.48Å
1564P71.2Confident63.6Low104 Ų10497.1 Ų97.168%0.67554%0.543SS*.PPolyproline II helixtrans-54.90179.417.5-19.3000111.6P1562P1562-P1564 VanDerWaalsContact O-N 3.1Å
1565P80.8Confident67.1Low44 Ų4493.3 Ų93.329%0.28652%0.52SS..PPolyproline II helix0143.809-8.1000111.9K1567 W1573 F1581 L1635P1565-K1567 PolarHBondContact O-N 3Å; P1565-W1573 HydrophobicContact CB-CH2 3.91Å; P1565-W1573 HydrophobicContact CB-CZ2 4.17Å; P1565-F1581 HydrophobicContact CB-CD2 4.03Å; P1565-F1581 HydrophobicContact CB-CE2 4.42Å; P1565-L1635 HydrophobicContact CB-CD1 3.79Å; P1565-L1635 HydrophobicContact CB-CD2 4Å; P1565-L1635 HydrophobicContact CG-CD1 4.06Å; P1565-L1635 HydrophobicContact CG-CD2 3.55Å; P1565-L1635 HydrophobicContact CG-CG 4.38Å
1566P81.5Confident70.1Confident26 Ų2693.3 Ų93.317%0.16952%0.515CS..PPolyproline II helixtrans-49.90176.5-16.122.5000111.8W1573 D1577P1566-W1573 HydrophobicContact CB-CZ2 4.29Å; P1566-W1573 HydrophobicContact CG-CD2 4.39Å; P1566-W1573 HydrophobicContact CG-CH2 4.44Å; P1566-W1573 HydrophobicContact CG-CZ2 4.27Å; P1566-W1573 WeakPolarHBondContact O-CZ2 2.64Å; P1566-W1573 PolarHBondContact O-NE1 3.19Å; P1566-D1577 HydrophobicContact CB-CB 3.97Å; P1566-D1577 HydrophobicContact CG-CB 3.72Å; P1566-D1577 WeakPolarHBondContact CG-O 2.89Å
1567K79.6Confident73.4Confident212 Ų21290.2 Ų90.292%0.92249%0.488SS*.SBend0129.60-66-175-177.4-179.50110.2P1565P1565-K1567 PolarHBondContact O-N 3Å
1568G85.1Confident76.3Confident41 Ų4179.7 Ų79.742%0.42344%0.442SS..SBendtrans123.7171.1172.200000110.8I1570 W1573G1568-I1570 PolarHBondContact O-N 3.31Å; G1568-W1573 PolarHBondContact O-NE1 2.93Å
1569P90Very high79.5Confident40 Ų4078.5 Ų78.526%0.2643%0.427SS..  trans-63.7140.8179.312.1-13.9000111.8Y1571 K1572 W1573P1569-Y1571 HydrophobicContact CB-CD1 3.38Å; P1569-Y1571 HydrophobicContact CB-CE1 2.88Å; P1569-Y1571 HydrophobicContact CB-CE2 4.48Å; P1569-Y1571 HydrophobicContact CB-CG 4.34Å; P1569-Y1571 HydrophobicContact CG-CD1 4.32Å; P1569-Y1571 HydrophobicContact CG-CE1 3.55Å; P1569-Y1571 HydrophobicContact CG-CE2 4.46Å; P1569-Y1571 PolarHBondContact O-N 3.26Å; P1569-K1572 HydrophobicContact CG-CB 4.39Å; P1569-K1572 HydrophobicContact CG-CD 3.76Å; P1569-K1572 HydrophobicContact CG-CG 4.08Å; P1569-K1572 PolarHBondContact O-N 3.37Å; P1569-W1573 PolarHBondContact O-NE1 2.78Å
1570I94.2Very high82.6Confident8 Ų872 Ų724%0.04140%0.4CS..G310 helixtrans-59.7-35-172.8-64.9174.2000109.5G1568 K1572 W1573 G1602 L1606 L1632 L1635 K1636G1568-I1570 PolarHBondContact O-N 3.31Å; I1570-K1572 PolarHBondContact O-N 2.94Å; I1570-W1573 HydrophobicContact CG1-CH2 4.24Å; I1570-W1573 HydrophobicContact CG1-CZ2 4.08Å; I1570-W1573 HydrophobicContact CG2-CD2 4.33Å; I1570-W1573 HydrophobicContact CG2-CE3 4.17Å; I1570-W1573 HydrophobicContact CG2-CZ3 4.49Å; I1570-W1573 VanDerWaalsContact O-CB 3.25Å; I1570-W1573 WeakPolarHBondContact O-CB 3.44Å; I1570-W1573 PolarHBondContact O-N 3.01Å; I1570-G1602 CarbonylContact O-C 3.5Å; I1570-G1602 WeakPolarHBondContact O-CA 1.89Å; I1570-L1606 HydrophobicContact CB-CD1 4.17Å; I1570-L1606 HydrophobicContact CB-CD2 4.47Å; I1570-L1606 HydrophobicContact CB-CG 4.48Å; I1570-L1606 HydrophobicContact CD1-CD2 4.41Å; I1570-L1606 HydrophobicContact CG2-CD1 3.93Å; I1570-L1606 HydrophobicContact CG2-CD2 3.93Å; I1570-L1606 HydrophobicContact CG2-CG 3.76Å; I1570-L1632 HydrophobicContact CD1-CD1 4.04Å; I1570-L1632 HydrophobicContact CG2-CD1 4.38Å; I1570-L1635 HydrophobicContact CD1-CB 3.75Å; I1570-K1636 HydrophobicContact CD1-CG 3.91Å
1571Y94.3Very high85.5Confident118 Ų11864.8 Ų64.846%0.46336%0.362SS..G310 helixtrans-68.4-7.4-175.362-90.1000111P1569 E1603P1569-Y1571 HydrophobicContact CB-CD1 3.38Å; P1569-Y1571 HydrophobicContact CB-CE1 2.88Å; P1569-Y1571 HydrophobicContact CB-CE2 4.48Å; P1569-Y1571 HydrophobicContact CB-CG 4.34Å; P1569-Y1571 HydrophobicContact CG-CD1 4.32Å; P1569-Y1571 HydrophobicContact CG-CE1 3.55Å; P1569-Y1571 HydrophobicContact CG-CE2 4.46Å; P1569-Y1571 PolarHBondContact O-N 3.26Å; Y1571-E1603 WeakPolarHBondContact O-CG 1.42Å
1572K94.4Very high88.1Confident140 Ų14059.2 Ų59.261%0.60933%0.328SS*.G310 helixtrans-106.58.4179.9-73-173.7179.5-1790110.1P1569 I1570 T1574P1569-K1572 HydrophobicContact CG-CB 4.39Å; P1569-K1572 HydrophobicContact CG-CD 3.76Å; P1569-K1572 HydrophobicContact CG-CG 4.08Å; P1569-K1572 PolarHBondContact O-N 3.37Å; I1570-K1572 PolarHBondContact O-N 2.94Å; K1572-T1574 PolarHBondContact O-N 3.36Å
1573W96.4Very high90.2Very high9 Ų964 Ų643%0.03434%0.337CS..  trans-75138.2-177.9-76.95.6000109.4P1565 P1566 G1568 P1569 I1570 D1577 V1578 F1581 D1601 G1602 L1635P1565-W1573 HydrophobicContact CB-CH2 3.91Å; P1565-W1573 HydrophobicContact CB-CZ2 4.17Å; P1566-W1573 HydrophobicContact CB-CZ2 4.29Å; P1566-W1573 HydrophobicContact CG-CD2 4.39Å; P1566-W1573 HydrophobicContact CG-CH2 4.44Å; P1566-W1573 HydrophobicContact CG-CZ2 4.27Å; P1566-W1573 WeakPolarHBondContact O-CZ2 2.64Å; P1566-W1573 PolarHBondContact O-NE1 3.19Å; G1568-W1573 PolarHBondContact O-NE1 2.93Å; P1569-W1573 PolarHBondContact O-NE1 2.78Å; I1570-W1573 HydrophobicContact CG1-CH2 4.24Å; I1570-W1573 HydrophobicContact CG1-CZ2 4.08Å; I1570-W1573 HydrophobicContact CG2-CD2 4.33Å; I1570-W1573 HydrophobicContact CG2-CE3 4.17Å; I1570-W1573 HydrophobicContact CG2-CZ3 4.49Å; I1570-W1573 VanDerWaalsContact O-CB 3.25Å; I1570-W1573 WeakPolarHBondContact O-CB 3.44Å; I1570-W1573 PolarHBondContact O-N 3.01Å; W1573-D1577 HydrophobicContact CB-CB 3.84Å; W1573-D1577 HydrophobicContact CD2-CB 4.44Å; W1573-D1577 HydrophobicContact CG-CB 4.04Å; W1573-V1578 HydrophobicContact CB-CG2 4.16Å; W1573-V1578 HydrophobicContact CE3-CG2 4.35Å; W1573-F1581 HydrophobicContact CH2-CB 4.41Å; W1573-F1581 HydrophobicContact CH2-CD2 4.03Å; W1573-F1581 HydrophobicContact CH2-CG 4.23Å; W1573-F1581 HydrophobicContact CZ3-CB 3.79Å; W1573-F1581 HydrophobicContact CZ3-CD1 4.19Å; W1573-F1581 HydrophobicContact CZ3-CD2 4.02Å; W1573-F1581 AromaticContact CZ3-CG 3.75Å; W1573-F1581 HydrophobicContact CZ3-CG 3.75Å; W1573-D1601 WeakPolarHBondContact O-CB 3.15Å; W1573-G1602 PolarHBondContact O-N 2.8Å; W1573-L1635 HydrophobicContact CH2-CD1 3.82Å
1574T96.6Very high91.7Very high63 Ų6359.5 Ų59.539%0.38732%0.315SS..  trans-83.9163.9173.363.10000110.5K1572 D1576 D1577 V1578K1572-T1574 PolarHBondContact O-N 3.36Å; T1574-D1576 PolarHBondContact O-N 3.07Å; T1574-D1577 PolarHBondContact N-OD2 3.12Å; T1574-D1577 VanDerWaalsContact N-OD2 3.14Å; T1574-D1577 WeakPolarHBondContact O-CA 3.4Å; T1574-D1577 WeakPolarHBondContact O-CB 3.49Å; T1574-D1577 PolarHBondContact O-N 2.93Å; T1574-D1577 VanDerWaalsContact OG1-CG 3.3Å; T1574-D1577 PolarHBondContact OG1-N 3.3Å; T1574-D1577 PolarHBondContact OG1-OD2 3.37Å; T1574-V1578 WeakPolarHBondContact O-CG2 2.12Å; T1574-V1578 PolarHBondContact O-N 3.07Å
1575P96.9Very high92.8Very high43 Ų4354.8 Ų54.828%0.27928%0.284SS..Hα-helixtrans-53.9-32.4178.5-26.433000111.8D1577 V1578 V1579 I1600 D1601P1575-D1577 PolarHBondContact O-N 2.81Å; P1575-V1578 PolarHBondContact O-N 2.99Å; P1575-V1579 WeakPolarHBondContact O-CG2 2.78Å; P1575-V1579 PolarHBondContact O-N 3.1Å; P1575-I1600 WeakPolarHBondContact CA-O 3.32Å; P1575-D1601 HydrophobicContact CG-CB 4.17Å
1576D96.8Very high93.4Very high109 Ų10956.4 Ų56.458%0.58329%0.294SS*.Hα-helixtrans-69.7-36.5178.4-71.6-31.9000111.1T1574 V1578 V1579 A1580T1574-D1576 PolarHBondContact O-N 3.07Å; D1576-V1578 PolarHBondContact O-N 3.1Å; D1576-V1579 PolarHBondContact O-N 3.44Å; D1576-A1580 PolarHBondContact O-N 3.44Å
1577D96.6Very high93.9Very high54 Ų5457.8 Ų57.829%0.28931%0.313SS..Hα-helixtrans-66.1-34.7177.1-68.6-26.2000111.2P1566 W1573 T1574 P1575 V1579 A1580 F1581P1566-D1577 HydrophobicContact CB-CB 3.97Å; P1566-D1577 HydrophobicContact CG-CB 3.72Å; P1566-D1577 WeakPolarHBondContact CG-O 2.89Å; W1573-D1577 HydrophobicContact CB-CB 3.84Å; W1573-D1577 HydrophobicContact CD2-CB 4.44Å; W1573-D1577 HydrophobicContact CG-CB 4.04Å; T1574-D1577 PolarHBondContact N-OD2 3.12Å; T1574-D1577 VanDerWaalsContact N-OD2 3.14Å; T1574-D1577 WeakPolarHBondContact O-CA 3.4Å; T1574-D1577 WeakPolarHBondContact O-CB 3.49Å; T1574-D1577 PolarHBondContact O-N 2.93Å; T1574-D1577 VanDerWaalsContact OG1-CG 3.3Å; T1574-D1577 PolarHBondContact OG1-N 3.3Å; T1574-D1577 PolarHBondContact OG1-OD2 3.37Å; P1575-D1577 PolarHBondContact O-N 2.81Å; D1577-V1579 PolarHBondContact O-N 3.23Å; D1577-A1580 PolarHBondContact O-N 2.77Å; D1577-F1581 WeakPolarHBondContact O-CB 3.23Å; D1577-F1581 PolarHBondContact O-N 2.83Å
1578V96.6Very high94.7Very high0 Ų047.7 Ų47.70%027%0.269CS..Hα-helixtrans-70.2-38.5-179.5171.10000109.2W1573 T1574 P1575 D1576 A1580 F1581 V1582 F1595 L1605W1573-V1578 HydrophobicContact CB-CG2 4.16Å; W1573-V1578 HydrophobicContact CE3-CG2 4.35Å; T1574-V1578 WeakPolarHBondContact O-CG2 2.12Å; T1574-V1578 PolarHBondContact O-N 3.07Å; P1575-V1578 PolarHBondContact O-N 2.99Å; D1576-V1578 PolarHBondContact O-N 3.1Å; V1578-A1580 PolarHBondContact O-N 3Å; V1578-F1581 CarbonylContact O-C 3.56Å; V1578-F1581 WeakPolarHBondContact O-CB 3.39Å; V1578-F1581 PolarHBondContact O-N 3.09Å; V1578-F1581 VanDerWaalsContact O-N 3.07Å; V1578-V1582 HydrophobicContact CG1-CG2 4.03Å; V1578-V1582 WeakPolarHBondContact O-CG2 1.39Å; V1578-V1582 PolarHBondContact O-N 3.3Å; V1578-F1595 HydrophobicContact CG1-CB 4.43Å; V1578-F1595 HydrophobicContact CG1-CD1 3.92Å; V1578-F1595 HydrophobicContact CG1-CG 4.46Å; V1578-L1605 HydrophobicContact CG1-CD1 4.3Å; V1578-L1605 HydrophobicContact CG1-CD2 4.06Å; V1578-L1605 HydrophobicContact CG2-CD2 4.3Å
1579V96.2Very high95.1Very high14 Ų1447.3 Ų47.39%0.08527%0.266CS..Hα-helixtrans-66.1-39.2-179.4169.50000109.9P1575 D1576 D1577 F1581 V1582 R1583 A1592 F1595 L1596P1575-V1579 WeakPolarHBondContact O-CG2 2.78Å; P1575-V1579 PolarHBondContact O-N 3.1Å; D1576-V1579 PolarHBondContact O-N 3.44Å; D1577-V1579 PolarHBondContact O-N 3.23Å; V1579-F1581 PolarHBondContact O-N 3.36Å; V1579-V1582 PolarHBondContact O-N 2.62Å; V1579-R1583 HydrophobicContact CG1-CG 4.35Å; V1579-R1583 WeakPolarHBondContact O-CB 3.07Å; V1579-R1583 WeakPolarHBondContact O-CG 3.1Å; V1579-R1583 PolarHBondContact O-N 3.16Å; V1579-A1592 HydrophobicContact CG1-CB 3.7Å; V1579-F1595 HydrophobicContact CG2-CB 4.39Å; V1579-L1596 HydrophobicContact CG2-CB 3.64Å; V1579-L1596 HydrophobicContact CG2-CD1 3.85Å; V1579-L1596 HydrophobicContact CG2-CG 4.33Å
1580A95.3Very high95.4Very high46 Ų4649.4 Ų49.438%0.3829%0.286SS..Hα-helixtrans-62.9-38.4176.600000111.3D1576 D1577 V1578 R1583 G1584D1576-A1580 PolarHBondContact O-N 3.44Å; D1577-A1580 PolarHBondContact O-N 2.77Å; V1578-A1580 PolarHBondContact O-N 3Å; A1580-R1583 PolarHBondContact O-N 3.23Å; A1580-G1584 PolarHBondContact O-N 3.29Å
1581F95.8Very high95.5Very high2 Ų250.9 Ų50.91%0.00929%0.291CS..Hα-helixtrans-67-43.1178.8170.3-106.5000110.4P1565 W1573 D1577 V1578 V1579 R1583 G1584 T1585 L1628 R1631 L1632 L1635P1565-F1581 HydrophobicContact CB-CD2 4.03Å; P1565-F1581 HydrophobicContact CB-CE2 4.42Å; W1573-F1581 HydrophobicContact CH2-CB 4.41Å; W1573-F1581 HydrophobicContact CH2-CD2 4.03Å; W1573-F1581 HydrophobicContact CH2-CG 4.23Å; W1573-F1581 HydrophobicContact CZ3-CB 3.79Å; W1573-F1581 HydrophobicContact CZ3-CD1 4.19Å; W1573-F1581 HydrophobicContact CZ3-CD2 4.02Å; W1573-F1581 AromaticContact CZ3-CG 3.75Å; W1573-F1581 HydrophobicContact CZ3-CG 3.75Å; D1577-F1581 WeakPolarHBondContact O-CB 3.23Å; D1577-F1581 PolarHBondContact O-N 2.83Å; V1578-F1581 CarbonylContact O-C 3.56Å; V1578-F1581 WeakPolarHBondContact O-CB 3.39Å; V1578-F1581 PolarHBondContact O-N 3.09Å; V1578-F1581 VanDerWaalsContact O-N 3.07Å; V1579-F1581 PolarHBondContact O-N 3.36Å; F1581-R1583 VanDerWaalsContact C-N 3.29Å; F1581-R1583 PolarHBondContact O-N 3.32Å; F1581-G1584 PolarHBondContact O-N 3.48Å; F1581-G1584 VanDerWaalsContact O-N 3.07Å; F1581-T1585 PolarHBondContact O-N 3.14Å; F1581-T1585 VanDerWaalsContact O-N 3.12Å; F1581-T1585 PolarHBondContact O-OG1 3.15Å; F1581-L1628 HydrophobicContact CD1-CD1 4.3Å; F1581-L1628 HydrophobicContact CE1-CD1 3.92Å; F1581-L1628 HydrophobicContact CE1-CG 4.37Å; F1581-R1631 HydrophobicContact CE2-CG 3.82Å; F1581-R1631 HydrophobicContact CZ-CB 3.98Å; F1581-R1631 HydrophobicContact CZ-CG 3.71Å; F1581-L1632 HydrophobicContact CE1-CD1 4.38Å; F1581-L1635 HydrophobicContact CD2-CD1 3.81Å; F1581-L1635 HydrophobicContact CE2-CD1 3.07Å; F1581-L1635 HydrophobicContact CE2-CG 4.43Å; F1581-L1635 HydrophobicContact CZ-CD1 3.66Å
1582V96.1Very high95.6Very high0 Ų045.3 Ų45.30%027%0.27CS..Hα-helixtrans-66.9-36.9-178.4174.40000109V1578 V1579 G1584 T1585 C1588 A1592 F1595 L1628V1578-V1582 HydrophobicContact CG1-CG2 4.03Å; V1578-V1582 WeakPolarHBondContact O-CG2 1.39Å; V1578-V1582 PolarHBondContact O-N 3.3Å; V1579-V1582 PolarHBondContact O-N 2.62Å; V1582-G1584 PolarHBondContact O-N 3.48Å; V1582-T1585 WeakPolarHBondContact O-CB 3.32Å; V1582-T1585 PolarHBondContact O-N 2.93Å; V1582-T1585 VanDerWaalsContact O-N 3.09Å; V1582-C1588 HydrophobicContact CG1-CB 3.98Å; V1582-C1588 WeakPolarHBondContact CG1-O 2.8Å; V1582-A1592 HydrophobicContact CB-CB 4.41Å; V1582-A1592 HydrophobicContact CG1-CB 4.21Å; V1582-F1595 HydrophobicContact CG1-CD2 4.15Å; V1582-F1595 HydrophobicContact CG1-CE2 4.12Å; V1582-F1595 HydrophobicContact CG2-CD1 4.19Å; V1582-F1595 HydrophobicContact CG2-CD2 3.98Å; V1582-F1595 HydrophobicContact CG2-CE1 4.31Å; V1582-F1595 HydrophobicContact CG2-CE2 4.07Å; V1582-F1595 HydrophobicContact CG2-CG 4.04Å; V1582-F1595 HydrophobicContact CG2-CZ 4.24Å; V1582-L1628 HydrophobicContact CB-CD1 4.31Å; V1582-L1628 HydrophobicContact CG1-CD1 4.26Å; V1582-L1628 HydrophobicContact CG2-CD1 3.99Å; V1582-L1628 HydrophobicContact CG2-CD2 4.45Å
1583R95.8Very high95.6Very high170 Ų17041.7 Ų41.764%0.64226%0.262SS*.Hα-helixtrans-68.1-28.1177.7-81.2-173-173.4-150.20.5111.4V1579 A1580 F1581 T1585 A1592V1579-R1583 HydrophobicContact CG1-CG 4.35Å; V1579-R1583 WeakPolarHBondContact O-CB 3.07Å; V1579-R1583 WeakPolarHBondContact O-CG 3.1Å; V1579-R1583 PolarHBondContact O-N 3.16Å; A1580-R1583 PolarHBondContact O-N 3.23Å; F1581-R1583 VanDerWaalsContact C-N 3.29Å; F1581-R1583 PolarHBondContact O-N 3.32Å; R1583-T1585 PolarHBondContact O-N 2.91Å; R1583-A1592 HydrophobicContact CG-CB 3.39Å
1584G94.6Very high95.6Very high7 Ų742 Ų427%0.07227%0.266CS..Hα-helixtrans-83.4-6.4-177.700000111.7P1562 A1580 F1581 V1582 P1586 R1631P1562-G1584 WeakPolarHBondContact CA-O 3Å; P1562-G1584 WeakPolarHBondContact CB-O 2.58Å; A1580-G1584 PolarHBondContact O-N 3.29Å; F1581-G1584 PolarHBondContact O-N 3.48Å; F1581-G1584 VanDerWaalsContact O-N 3.07Å; V1582-G1584 PolarHBondContact O-N 3.48Å; G1584-P1586 WeakPolarHBondContact O-CD 3.34Å; G1584-R1631 PolarHBondContact O-NH1 2.92Å
1585T95Very high95.6Very high4 Ų439 Ų393%0.02525%0.248CC..SBendtrans-92.2125.4178.2-53.50000109.8F1581 V1582 R1583 G1587 C1588 L1628 R1631F1581-T1585 PolarHBondContact O-N 3.14Å; F1581-T1585 VanDerWaalsContact O-N 3.12Å; F1581-T1585 PolarHBondContact O-OG1 3.15Å; V1582-T1585 WeakPolarHBondContact O-CB 3.32Å; V1582-T1585 PolarHBondContact O-N 2.93Å; V1582-T1585 VanDerWaalsContact O-N 3.09Å; R1583-T1585 PolarHBondContact O-N 2.91Å; T1585-G1587 PolarHBondContact O-N 3Å; T1585-G1587 VanDerWaalsContact O-N 3.1Å; T1585-C1588 HydrophobicContact CG2-CB 4.31Å; T1585-C1588 PolarHBondContact O-N 3.41Å; T1585-L1628 HydrophobicContact CG2-CD1 4.24Å; T1585-R1631 HydrophobicContact CG2-CB 4.45Å; T1585-R1631 WeakPolarHBondContact OG1-CD 2.39Å; T1585-R1631 PolarHBondContact OG1-NH1 2.19Å
1586P93.2Very high95.6Very high79 Ų7940.5 Ų40.551%0.51325%0.253SS..THydrogen-bonded Turntrans-58123.8-174.7-12.917.4000111.7G1584 C1588G1584-P1586 WeakPolarHBondContact O-CD 3.34Å; P1586-C1588 VanDerWaalsContact C-N 3.26Å; P1586-C1588 PolarHBondContact O-N 3.2Å
1587G92.7Very high95.5Very high55 Ų5541.3 Ų41.357%0.56726%0.257SS*.THydrogen-bonded Turntrans90.40.5174.600000111.4T1585T1585-G1587 PolarHBondContact O-N 3Å; T1585-G1587 VanDerWaalsContact O-N 3.1Å
1588C95.5Very high95.4Very high0 Ų041.6 Ų41.60%026%0.259CS..  trans-1172.3-174.2-63.80000109.2V1582 T1585 P1586 A1590 Y1591 M1620 P1624 L1628V1582-C1588 HydrophobicContact CG1-CB 3.98Å; V1582-C1588 WeakPolarHBondContact CG1-O 2.8Å; T1585-C1588 HydrophobicContact CG2-CB 4.31Å; T1585-C1588 PolarHBondContact O-N 3.41Å; P1586-C1588 VanDerWaalsContact C-N 3.26Å; P1586-C1588 PolarHBondContact O-N 3.2Å; C1588-A1590 PolarHBondContact O-N 3.2Å; C1588-A1590 VanDerWaalsContact O-N 3.1Å; C1588-Y1591 PolarHBondContact O-N 3.35Å; C1588-M1620 HydrophobicContact CB-CE 4.39Å; C1588-P1624 PolarHBondContact SG-O 2.51Å; C1588-L1628 HydrophobicContact CB-CD1 4.25Å
1589G95Very high95.4Very high33 Ų3349 Ų4934%0.3429%0.294SS..G310 helixtrans-60.9-30.4-175.600000111.4Y1591 A1592G1589-Y1591 PolarHBondContact O-N 2.84Å; G1589-A1592 VanDerWaalsContact O-CB 3.32Å; G1589-A1592 WeakPolarHBondContact O-CB 3.23Å; G1589-A1592 PolarHBondContact O-N 3.29Å; G1589-A1592 VanDerWaalsContact O-N 3.08Å
1590A95.2Very high95.4Very high83 Ų8349 Ų4969%0.68629%0.293SS*.G310 helixtrans-71.7-11.5-174.500000111.3C1588C1588-A1590 PolarHBondContact O-N 3.2Å; C1588-A1590 VanDerWaalsContact O-N 3.1Å
1591Y96.1Very high95.5Very high40 Ų4049.4 Ų49.416%0.15729%0.289CS..G310 helixtrans-105.82.8-176.1-60.6-79.5000110.5C1588 G1589 S1593 A1594 F1595 M1620 K1621 P1624C1588-Y1591 PolarHBondContact O-N 3.35Å; G1589-Y1591 PolarHBondContact O-N 2.84Å; Y1591-S1593 PolarHBondContact O-N 3.02Å; Y1591-S1593 VanDerWaalsContact O-N 3.13Å; Y1591-A1594 WeakPolarHBondContact O-CB 2.99Å; Y1591-A1594 PolarHBondContact O-N 3.29Å; Y1591-F1595 WeakPolarHBondContact O-CD2 3.12Å; Y1591-F1595 PolarHBondContact O-N 3.21Å; Y1591-M1620 HydrophobicContact CD1-CB 4.08Å; Y1591-M1620 HydrophobicContact CD1-CG 3.21Å; Y1591-M1620 HydrophobicContact CD2-CE 3.82Å; Y1591-M1620 HydrophobicContact CD2-CG 3.76Å; Y1591-M1620 HydrophobicContact CD2-SD 4.39Å; Y1591-M1620 VanDerWaalsContact CE1-CA 3.44Å; Y1591-M1620 HydrophobicContact CE1-CB 4.02Å; Y1591-M1620 HydrophobicContact CE1-CG 3.67Å; Y1591-M1620 HydrophobicContact CE2-CE 4.33Å; Y1591-M1620 HydrophobicContact CE2-CG 4.17Å; Y1591-M1620 HydrophobicContact CG-CB 4.38Å; Y1591-M1620 HydrophobicContact CG-CE 4.15Å; Y1591-M1620 HydrophobicContact CG-CG 3.26Å; Y1591-M1620 HydrophobicContact CG-SD 4.12Å; Y1591-K1621 WeakPolarHBondContact OH-CG 1.84Å; Y1591-K1621 PolarHBondContact OH-N 3.33Å; Y1591-P1624 HydrophobicContact CD2-CB 4.17Å; Y1591-P1624 HydrophobicContact CE2-CB 3.61Å; Y1591-P1624 HydrophobicContact CE2-CG 3.69Å
1592A96Very high95.5Very high1 Ų149.3 Ų49.31%0.00829%0.288CS..Hα-helixtrans-62.5-34.1-176.100000110.2V1579 V1582 R1583 G1589 A1594 F1595 L1596V1579-A1592 HydrophobicContact CG1-CB 3.7Å; V1582-A1592 HydrophobicContact CB-CB 4.41Å; V1582-A1592 HydrophobicContact CG1-CB 4.21Å; R1583-A1592 HydrophobicContact CG-CB 3.39Å; G1589-A1592 VanDerWaalsContact O-CB 3.32Å; G1589-A1592 WeakPolarHBondContact O-CB 3.23Å; G1589-A1592 PolarHBondContact O-N 3.29Å; G1589-A1592 VanDerWaalsContact O-N 3.08Å; A1592-A1594 PolarHBondContact O-N 3.14Å; A1592-F1595 WeakPolarHBondContact O-CB 1.98Å; A1592-F1595 PolarHBondContact O-N 3.17Å; A1592-L1596 PolarHBondContact O-N 3.39Å
1593S95.6Very high95.4Very high63 Ų6354.6 Ų54.644%0.44131%0.313SS..Hα-helixtrans-68.4-31.4-178.455.30000111.1Y1591 F1595 L1596 N1597Y1591-S1593 PolarHBondContact O-N 3.02Å; Y1591-S1593 VanDerWaalsContact O-N 3.13Å; S1593-F1595 PolarHBondContact O-N 2.89Å; S1593-L1596 CarbonylContact O-C 3.46Å; S1593-L1596 WeakPolarHBondContact O-CB 3.19Å; S1593-L1596 PolarHBondContact O-N 2.74Å; S1593-L1596 VanDerWaalsContact O-N 3.08Å; S1593-N1597 WeakPolarHBondContact O-CB 1.9Å; S1593-N1597 PolarHBondContact O-N 2.84Å; S1593-N1597 PolarHBondContact O-ND2 3.07Å; S1593-N1597 PolarHBondContact O-OD1 3.18Å
1594A96Very high95.4Very high16 Ų1648.1 Ų48.113%0.13230%0.296CS..Hα-helixtrans-66.3-31.8178.400000111.3Y1591 A1592 L1596 N1597 N1598 I1618Y1591-A1594 WeakPolarHBondContact O-CB 2.99Å; Y1591-A1594 PolarHBondContact O-N 3.29Å; A1592-A1594 PolarHBondContact O-N 3.14Å; A1594-L1596 PolarHBondContact O-N 2.87Å; A1594-N1597 PolarHBondContact O-N 3.27Å; A1594-N1598 WeakPolarHBondContact O-CB 3.23Å; A1594-N1598 VanDerWaalsContact O-CG 3.29Å; A1594-N1598 PolarHBondContact O-N 3.44Å; A1594-N1598 PolarHBondContact O-ND2 2.88Å; A1594-I1618 HydrophobicContact CB-CG2 4.32Å
1595F96.4Very high95.4Very high0 Ų047.8 Ų47.80%029%0.292CS..Hα-helixtrans-74.2-32.1178.2-78.4-99000110.6V1578 V1579 V1582 Y1591 A1592 S1593 N1597 N1598 E1599 I1600 L1605 L1608 F1613 I1618 M1620 L1628V1578-F1595 HydrophobicContact CG1-CB 4.43Å; V1578-F1595 HydrophobicContact CG1-CD1 3.92Å; V1578-F1595 HydrophobicContact CG1-CG 4.46Å; V1579-F1595 HydrophobicContact CG2-CB 4.39Å; V1582-F1595 HydrophobicContact CG1-CD2 4.15Å; V1582-F1595 HydrophobicContact CG1-CE2 4.12Å; V1582-F1595 HydrophobicContact CG2-CD1 4.19Å; V1582-F1595 HydrophobicContact CG2-CD2 3.98Å; V1582-F1595 HydrophobicContact CG2-CE1 4.31Å; V1582-F1595 HydrophobicContact CG2-CE2 4.07Å; V1582-F1595 HydrophobicContact CG2-CG 4.04Å; V1582-F1595 HydrophobicContact CG2-CZ 4.24Å; Y1591-F1595 WeakPolarHBondContact O-CD2 3.12Å; Y1591-F1595 PolarHBondContact O-N 3.21Å; A1592-F1595 WeakPolarHBondContact O-CB 1.98Å; A1592-F1595 PolarHBondContact O-N 3.17Å; S1593-F1595 PolarHBondContact O-N 2.89Å; F1595-N1597 VanDerWaalsContact C-N 3.35Å; F1595-N1598 PolarHBondContact O-N 3.39Å; F1595-E1599 PolarHBondContact O-N 3.37Å; F1595-E1599 VanDerWaalsContact O-N 3.09Å; F1595-I1600 HydrophobicContact CB-CB 4.46Å; F1595-I1600 HydrophobicContact CD1-CB 3.97Å; F1595-I1600 HydrophobicContact CD1-CD1 3.55Å; F1595-I1600 HydrophobicContact CD1-CG1 4.34Å; F1595-I1600 HydrophobicContact CD1-CG2 4Å; F1595-I1600 HydrophobicContact CE1-CD1 4Å; F1595-I1600 HydrophobicContact CG-CD1 4.16Å; F1595-I1600 PolarHBondContact O-N 2.93Å; F1595-L1605 HydrophobicContact CD1-CD1 4.27Å; F1595-L1605 HydrophobicContact CE1-CD1 3.68Å; F1595-L1608 HydrophobicContact CE1-CD1 4.38Å; F1595-F1613 HydrophobicContact CE1-CD1 4.33Å; F1595-F1613 AromaticContact CE1-CE1 3.79Å; F1595-F1613 HydrophobicContact CE1-CE1 3.79Å; F1595-F1613 AromaticContact CZ-CD1 3.75Å; F1595-F1613 HydrophobicContact CZ-CD1 3.75Å; F1595-F1613 AromaticContact CZ-CE1 3.6Å; F1595-F1613 HydrophobicContact CZ-CE1 3.6Å; F1595-I1618 HydrophobicContact CD2-CG2 4.45Å; F1595-I1618 HydrophobicContact CE1-CD1 4.02Å; F1595-I1618 HydrophobicContact CE2-CG2 3.83Å; F1595-I1618 HydrophobicContact CZ-CD1 4.03Å; F1595-I1618 HydrophobicContact CZ-CG2 4.17Å; F1595-M1620 HydrophobicContact CE2-SD 3.69Å; F1595-M1620 HydrophobicContact CZ-SD 3.89Å; F1595-L1628 HydrophobicContact CE1-CD2 4.22Å; F1595-L1628 HydrophobicContact CE2-CD2 4.31Å; F1595-L1628 HydrophobicContact CZ-CD2 3.57Å
1596L96.3Very high95.4Very high74 Ų7450.1 Ų50.139%0.38730%0.304SS..Hα-helixtrans-74.3-39.8179-174.268.9000110.4V1579 A1592 S1593 A1594 N1598 E1599V1579-L1596 HydrophobicContact CG2-CB 3.64Å; V1579-L1596 HydrophobicContact CG2-CD1 3.85Å; V1579-L1596 HydrophobicContact CG2-CG 4.33Å; A1592-L1596 PolarHBondContact O-N 3.39Å; S1593-L1596 CarbonylContact O-C 3.46Å; S1593-L1596 WeakPolarHBondContact O-CB 3.19Å; S1593-L1596 PolarHBondContact O-N 2.74Å; S1593-L1596 VanDerWaalsContact O-N 3.08Å; A1594-L1596 PolarHBondContact O-N 2.87Å; L1596-N1598 PolarHBondContact O-N 3.24Å; L1596-N1598 VanDerWaalsContact O-N 3.14Å; L1596-E1599 WeakPolarHBondContact O-CA 2.63Å; L1596-E1599 PolarHBondContact O-N 2.92Å
1597N96.3Very high95.4Very high126 Ų12653.1 Ų53.167%0.67432%0.316SS*.Hα-helixtrans-67.2-25.4-178-72-14000111.3S1593 A1594 F1595 E1599S1593-N1597 WeakPolarHBondContact O-CB 1.9Å; S1593-N1597 PolarHBondContact O-N 2.84Å; S1593-N1597 PolarHBondContact O-ND2 3.07Å; S1593-N1597 PolarHBondContact O-OD1 3.18Å; A1594-N1597 PolarHBondContact O-N 3.27Å; F1595-N1597 VanDerWaalsContact C-N 3.35Å; N1597-E1599 PolarHBondContact O-N 3.28Å
1598N94.7Very high95.4Very high61 Ų6152.4 Ų52.433%0.32630%0.298SS..THydrogen-bonded Turntrans-97.77.3179.8-71-69.9000111.2A1594 F1595 L1596 I1600 P1617A1594-N1598 WeakPolarHBondContact O-CB 3.23Å; A1594-N1598 VanDerWaalsContact O-CG 3.29Å; A1594-N1598 PolarHBondContact O-N 3.44Å; A1594-N1598 PolarHBondContact O-ND2 2.88Å; F1595-N1598 PolarHBondContact O-N 3.39Å; L1596-N1598 PolarHBondContact O-N 3.24Å; L1596-N1598 VanDerWaalsContact O-N 3.14Å; N1598-I1600 HydrophobicContact CB-CD1 4.07Å; N1598-I1600 HydrophobicContact CB-CG1 3.71Å; N1598-I1600 PolarHBondContact O-N 3.13Å; N1598-I1600 VanDerWaalsContact O-N 3.16Å; N1598-P1617 VanDerWaalsContact OD1-CB 3.23Å; N1598-P1617 WeakPolarHBondContact OD1-CB 2.4Å; N1598-P1617 WeakPolarHBondContact OD1-CG 3Å
1599E96.1Very high95.1Very high155 Ų15554.5 Ų54.572%0.72432%0.316SS*.THydrogen-bonded Turntrans5047178.2-68.3-176.2171.400111.6F1595 L1596 N1597 D1601F1595-E1599 PolarHBondContact O-N 3.37Å; F1595-E1599 VanDerWaalsContact O-N 3.09Å; L1596-E1599 WeakPolarHBondContact O-CA 2.63Å; L1596-E1599 PolarHBondContact O-N 2.92Å; N1597-E1599 PolarHBondContact O-N 3.28Å; E1599-D1601 PolarHBondContact O-N 3.24Å
1600I96.1Very high94.8Very high13 Ų1357.3 Ų57.37%0.06732%0.32CS..  trans-81.90178.7-62.1-179.8000109.2P1575 F1595 N1598 A1604 L1605 L1608 I1618P1575-I1600 WeakPolarHBondContact CA-O 3.32Å; F1595-I1600 HydrophobicContact CB-CB 4.46Å; F1595-I1600 HydrophobicContact CD1-CB 3.97Å; F1595-I1600 HydrophobicContact CD1-CD1 3.55Å; F1595-I1600 HydrophobicContact CD1-CG1 4.34Å; F1595-I1600 HydrophobicContact CD1-CG2 4Å; F1595-I1600 HydrophobicContact CE1-CD1 4Å; F1595-I1600 HydrophobicContact CG-CD1 4.16Å; F1595-I1600 PolarHBondContact O-N 2.93Å; N1598-I1600 HydrophobicContact CB-CD1 4.07Å; N1598-I1600 HydrophobicContact CB-CG1 3.71Å; N1598-I1600 PolarHBondContact O-N 3.13Å; N1598-I1600 VanDerWaalsContact O-N 3.16Å; I1600-A1604 HydrophobicContact CG2-CB 3.94Å; I1600-L1605 HydrophobicContact CG2-CB 4.17Å; I1600-L1605 HydrophobicContact CG2-CD1 4.4Å; I1600-L1608 HydrophobicContact CD1-CD1 3.83Å; I1600-L1608 HydrophobicContact CG2-CD1 3.86Å; I1600-I1618 HydrophobicContact CD1-CD1 3.43Å; I1600-I1618 VanDerWaalsContact CD1-CD1 3.43Å; I1600-I1618 HydrophobicContact CD1-CG1 3.82Å
1601D96.3Very high94.4Very high55 Ų5556.9 Ų56.929%0.29431%0.306SS..  00060.34.6000110.6W1573 P1575 E1599 E1603 A1604 L1605W1573-D1601 WeakPolarHBondContact O-CB 3.15Å; P1575-D1601 HydrophobicContact CG-CB 4.17Å; E1599-D1601 PolarHBondContact O-N 3.24Å; D1601-E1603 PolarHBondContact O-N 3.46Å; D1601-E1603 PolarHBondContact OD1-N 3.3Å; D1601-A1604 PolarHBondContact O-N 2.87Å; D1601-A1604 VanDerWaalsContact O-N 3.17Å; D1601-A1604 WeakPolarHBondContact OD1-CB 0.97Å; D1601-A1604 PolarHBondContact OD1-N 3.22Å; D1601-L1605 VanDerWaalsContact O-CB 3.28Å; D1601-L1605 WeakPolarHBondContact O-CB 3.21Å; D1601-L1605 PolarHBondContact O-N 3.08Å
1602G95.9Very high94.2Very high0 Ų058.5 Ų58.50%032%0.315CS..Hα-helix0-31.6000000111.8I1570 W1573 L1605 L1606I1570-G1602 CarbonylContact O-C 3.5Å; I1570-G1602 WeakPolarHBondContact O-CA 1.89Å; W1573-G1602 PolarHBondContact O-N 2.8Å; G1602-L1605 PolarHBondContact O-N 3.02Å; G1602-L1606 WeakPolarHBondContact O-CG 2.8Å; G1602-L1606 PolarHBondContact O-N 2.29Å
1603E94.6Very high94Very high112 Ų11258.6 Ų58.652%0.52332%0.315SS..Hα-helixtrans-71.8-42.9179.2-80-171.5173.100110.9Y1571 D1601 L1605 L1606 L1607Y1571-E1603 WeakPolarHBondContact O-CG 1.42Å; D1601-E1603 PolarHBondContact O-N 3.46Å; D1601-E1603 PolarHBondContact OD1-N 3.3Å; E1603-L1605 PolarHBondContact O-N 3.42Å; E1603-L1606 PolarHBondContact O-N 3.08Å; E1603-L1607 WeakPolarHBondContact O-CG 1.93Å; E1603-L1607 PolarHBondContact O-N 3.22Å
1604A95.4Very high93.9Very high33 Ų3358.3 Ų58.327%0.27331%0.308SS..Hα-helixtrans-68.7-37.1179.400000110.9I1600 D1601 L1606 L1607 L1608I1600-A1604 HydrophobicContact CG2-CB 3.94Å; D1601-A1604 PolarHBondContact O-N 2.87Å; D1601-A1604 VanDerWaalsContact O-N 3.17Å; D1601-A1604 WeakPolarHBondContact OD1-CB 0.97Å; D1601-A1604 PolarHBondContact OD1-N 3.22Å; A1604-L1606 PolarHBondContact O-N 2.8Å; A1604-L1607 WeakPolarHBondContact O-CB 2.7Å; A1604-L1607 PolarHBondContact O-N 3.45Å; A1604-L1608 WeakPolarHBondContact O-CG 2.38Å; A1604-L1608 PolarHBondContact O-N 3.17Å; A1604-L1608 VanDerWaalsContact O-N 3.08Å
1605L95.8Very high93.6Very high0 Ų063 Ų630%033%0.327CS..Hα-helixtrans-59.2-34.3-179.4-176.265.8000111.3V1578 F1595 I1600 D1601 G1602 E1603 L1607 L1608 F1613 L1632V1578-L1605 HydrophobicContact CG1-CD1 4.3Å; V1578-L1605 HydrophobicContact CG1-CD2 4.06Å; V1578-L1605 HydrophobicContact CG2-CD2 4.3Å; F1595-L1605 HydrophobicContact CD1-CD1 4.27Å; F1595-L1605 HydrophobicContact CE1-CD1 3.68Å; I1600-L1605 HydrophobicContact CG2-CB 4.17Å; I1600-L1605 HydrophobicContact CG2-CD1 4.4Å; D1601-L1605 VanDerWaalsContact O-CB 3.28Å; D1601-L1605 WeakPolarHBondContact O-CB 3.21Å; D1601-L1605 PolarHBondContact O-N 3.08Å; G1602-L1605 PolarHBondContact O-N 3.02Å; E1603-L1605 PolarHBondContact O-N 3.42Å; L1605-L1607 PolarHBondContact O-N 2.82Å; L1605-L1608 HydrophobicContact CD1-CD1 4.19Å; L1605-L1608 PolarHBondContact O-N 3.46Å; L1605-F1613 HydrophobicContact CD1-CE1 4.12Å; L1605-F1613 HydrophobicContact CD1-CZ 4.12Å; L1605-L1632 HydrophobicContact CD2-CD1 3.71Å; L1605-L1632 HydrophobicContact CD2-CD2 4.36Å; L1605-L1632 HydrophobicContact CG-CD1 4.25Å; L1605-L1632 HydrophobicContact CG-CD2 3.96Å
1606L93.9Very high93.2Very high53 Ų5367.4 Ų67.428%0.27736%0.356SS..Hα-helixtrans-78.1-12.9-177.5-73.7170.7000110.7I1570 G1602 E1603 A1604 K1636I1570-L1606 HydrophobicContact CB-CD1 4.17Å; I1570-L1606 HydrophobicContact CB-CD2 4.47Å; I1570-L1606 HydrophobicContact CB-CG 4.48Å; I1570-L1606 HydrophobicContact CD1-CD2 4.41Å; I1570-L1606 HydrophobicContact CG2-CD1 3.93Å; I1570-L1606 HydrophobicContact CG2-CD2 3.93Å; I1570-L1606 HydrophobicContact CG2-CG 3.76Å; G1602-L1606 WeakPolarHBondContact O-CG 2.8Å; G1602-L1606 PolarHBondContact O-N 2.29Å; E1603-L1606 PolarHBondContact O-N 3.08Å; A1604-L1606 PolarHBondContact O-N 2.8Å; L1606-K1636 HydrophobicContact CD2-CD 3.67Å; L1606-K1636 HydrophobicContact CD2-CG 3.77Å
1607L94.3Very high92.8Very high143 Ų14367 Ų6775%0.74936%0.358SS*.Hα-helixtrans-98.2-6.5-177.8-69.9171.1000110.7E1603 A1604 L1605 A1609E1603-L1607 WeakPolarHBondContact O-CG 1.93Å; E1603-L1607 PolarHBondContact O-N 3.22Å; A1604-L1607 WeakPolarHBondContact O-CB 2.7Å; A1604-L1607 PolarHBondContact O-N 3.45Å; L1605-L1607 PolarHBondContact O-N 2.82Å; L1607-A1609 PolarHBondContact O-N 3.27Å
1608L92.8Very high92.6Very high39 Ų3961.5 Ų61.520%0.20433%0.329CS..  trans-79130.1-177.7-78.7163.1000110.3F1595 I1600 A1604 L1605 Q1612 F1613 I1618F1595-L1608 HydrophobicContact CE1-CD1 4.38Å; I1600-L1608 HydrophobicContact CD1-CD1 3.83Å; I1600-L1608 HydrophobicContact CG2-CD1 3.86Å; A1604-L1608 WeakPolarHBondContact O-CG 2.38Å; A1604-L1608 PolarHBondContact O-N 3.17Å; A1604-L1608 VanDerWaalsContact O-N 3.08Å; L1605-L1608 HydrophobicContact CD1-CD1 4.19Å; L1605-L1608 PolarHBondContact O-N 3.46Å; L1608-Q1612 HydrophobicContact CD2-CB 3.61Å; L1608-Q1612 HydrophobicContact CD2-CG 4.43Å; L1608-F1613 HydrophobicContact CB-CE2 3.89Å; L1608-F1613 HydrophobicContact CB-CZ 3.92Å; L1608-F1613 HydrophobicContact CD1-CE1 4.25Å; L1608-F1613 HydrophobicContact CD1-CZ 4.29Å; L1608-I1618 HydrophobicContact CD1-CD1 3.94Å; L1608-I1618 HydrophobicContact CD2-CD1 4.39Å
1609A89.2Confident92.5Very high44 Ų4460.5 Ų60.536%0.36433%0.332SS..  trans-85160.3174.400000110.7L1607 D1611 Q1612 F1613L1607-A1609 PolarHBondContact O-N 3.27Å; A1609-D1611 WeakPolarHBondContact CB-OD1 3.28Å; A1609-D1611 PolarHBondContact O-N 2.71Å; A1609-Q1612 HydrophobicContact CB-CG 4.39Å; A1609-Q1612 WeakPolarHBondContact O-CB 2.85Å; A1609-Q1612 PolarHBondContact O-N 3.27Å; A1609-F1613 WeakPolarHBondContact O-CD2 3.21Å; A1609-F1613 PolarHBondContact O-N 2.88Å
1610E87.4Confident92.5Very high92 Ų9253.2 Ų53.243%0.4330%0.298SS..Hα-helixtrans-51.8-32.6-177.2-161.9168.2-179.500111Q1612 F1613 L1626 V1629E1610-Q1612 PolarHBondContact O-N 3.4Å; E1610-F1613 WeakPolarHBondContact O-CB 2.41Å; E1610-F1613 PolarHBondContact O-N 3.26Å; E1610-L1626 HydrophobicContact CG-CD2 4.38Å; E1610-L1626 WeakPolarHBondContact OE1-CD2 3.35Å; E1610-V1629 HydrophobicContact CG-CG2 4.35Å
1611D88.3Confident92.4Very high75 Ų7559.9 Ų59.940%0.40133%0.327SS..Hα-helixtrans-74.5-26.8-176.756.8-28000111.2A1609 F1613 I1614 Q1615A1609-D1611 WeakPolarHBondContact CB-OD1 3.28Å; A1609-D1611 PolarHBondContact O-N 2.71Å; D1611-F1613 PolarHBondContact O-N 3.39Å; D1611-I1614 PolarHBondContact O-N 3.06Å; D1611-I1614 VanDerWaalsContact O-N 3.07Å; D1611-Q1615 WeakPolarHBondContact O-CB 2.76Å; D1611-Q1615 WeakPolarHBondContact O-CG 1.73Å; D1611-Q1615 PolarHBondContact O-N 3.35Å
1612Q89.9Confident92.3Very high74 Ų7462 Ų6235%0.34634%0.337SS..Hα-helixtrans-78.7-14.9-177-69.2178.6-40.700111L1608 A1609 E1610L1608-Q1612 HydrophobicContact CD2-CB 3.61Å; L1608-Q1612 HydrophobicContact CD2-CG 4.43Å; A1609-Q1612 HydrophobicContact CB-CG 4.39Å; A1609-Q1612 WeakPolarHBondContact O-CB 2.85Å; A1609-Q1612 PolarHBondContact O-N 3.27Å; E1610-Q1612 PolarHBondContact O-N 3.4Å
1613F92.8Very high92.3Very high2 Ų263.5 Ų63.51%0.00935%0.353CS..Hα-helixtrans-74.1-32173.2-76.3-79.4000110.5F1595 L1605 L1608 A1609 E1610 D1611 I1618 G1619 M1620 A1625 L1628 V1629F1595-F1613 HydrophobicContact CE1-CD1 4.33Å; F1595-F1613 AromaticContact CE1-CE1 3.79Å; F1595-F1613 HydrophobicContact CE1-CE1 3.79Å; F1595-F1613 AromaticContact CZ-CD1 3.75Å; F1595-F1613 HydrophobicContact CZ-CD1 3.75Å; F1595-F1613 AromaticContact CZ-CE1 3.6Å; F1595-F1613 HydrophobicContact CZ-CE1 3.6Å; L1605-F1613 HydrophobicContact CD1-CE1 4.12Å; L1605-F1613 HydrophobicContact CD1-CZ 4.12Å; L1608-F1613 HydrophobicContact CB-CE2 3.89Å; L1608-F1613 HydrophobicContact CB-CZ 3.92Å; L1608-F1613 HydrophobicContact CD1-CE1 4.25Å; L1608-F1613 HydrophobicContact CD1-CZ 4.29Å; A1609-F1613 WeakPolarHBondContact O-CD2 3.21Å; A1609-F1613 PolarHBondContact O-N 2.88Å; E1610-F1613 WeakPolarHBondContact O-CB 2.41Å; E1610-F1613 PolarHBondContact O-N 3.26Å; D1611-F1613 PolarHBondContact O-N 3.39Å; F1613-I1618 HydrophobicContact CD1-CD1 4.29Å; F1613-G1619 PolarHBondContact O-N 3.45Å; F1613-M1620 HydrophobicContact CB-SD 4.45Å; F1613-M1620 HydrophobicContact CD1-SD 3.98Å; F1613-M1620 VanDerWaalsContact O-CB 3.24Å; F1613-M1620 WeakPolarHBondContact O-CB 1.08Å; F1613-M1620 PolarHBondContact O-N 3.08Å; F1613-A1625 HydrophobicContact CB-CB 3.78Å; F1613-L1628 HydrophobicContact CD1-CD2 3.83Å; F1613-L1628 HydrophobicContact CE1-CD2 3.32Å; F1613-L1628 HydrophobicContact CZ-CD2 4.11Å; F1613-V1629 HydrophobicContact CD2-CG2 3.85Å; F1613-V1629 HydrophobicContact CE2-CG2 3.7Å; F1613-V1629 HydrophobicContact CZ-CG2 4.38Å
1614I92.7Very high92.4Very high57 Ų5759.4 Ų59.429%0.29234%0.336SS..Hα-helixtrans-89.9-26.6-172.1-56.8167.6000109.3D1611 G1619 M1620 I1622 A1625D1611-I1614 PolarHBondContact O-N 3.06Å; D1611-I1614 VanDerWaalsContact O-N 3.07Å; I1614-G1619 WeakPolarHBondContact O-CA 2.01Å; I1614-M1620 VanDerWaalsContact CA-O 3.3Å; I1614-M1620 WeakPolarHBondContact CA-O 3.44Å; I1614-M1620 WeakPolarHBondContact CG2-O 3.09Å; I1614-I1622 HydrophobicContact CD1-CD1 2.81Å; I1614-I1622 HydrophobicContact CD1-CG1 4.14Å; I1614-I1622 HydrophobicContact CG1-CD1 3.95Å; I1614-A1625 HydrophobicContact CG1-CB 3.92Å
1615Q90.9Very high92.4Very high114 Ų11457.8 Ų57.853%0.53332%0.323SS..SBendtrans-97.7147.7-176.6-68.5-179.925.800109.5D1611 I1618 G1619D1611-Q1615 WeakPolarHBondContact O-CB 2.76Å; D1611-Q1615 WeakPolarHBondContact O-CG 1.73Å; D1611-Q1615 PolarHBondContact O-N 3.35Å; Q1615-I1618 PolarHBondContact O-N 3.46Å; Q1615-G1619 PolarHBondContact O-N 3.02Å
1616P87.4Confident92.4Very high94 Ų9461.8 Ų61.861%0.6134%0.343SS*.THydrogen-bonded Turntrans-45.9145.4173.3-20.328.5000111.6
1617P87.8Confident92.4Very high64 Ų6465.1 Ų65.142%0.41636%0.356SS..THydrogen-bonded Turncis-98-0.425.726.7-27.8000112N1598N1598-P1617 VanDerWaalsContact OD1-CB 3.23Å; N1598-P1617 WeakPolarHBondContact OD1-CB 2.4Å; N1598-P1617 WeakPolarHBondContact OD1-CG 3Å
1618I93.2Very high92.5Very high12 Ų1258.3 Ų58.36%0.06232%0.32CS..THydrogen-bonded Turntrans-90.7-41.6179.9-66.1168.6000109.3A1594 F1595 I1600 L1608 F1613 Q1615 M1620A1594-I1618 HydrophobicContact CB-CG2 4.32Å; F1595-I1618 HydrophobicContact CD2-CG2 4.45Å; F1595-I1618 HydrophobicContact CE1-CD1 4.02Å; F1595-I1618 HydrophobicContact CE2-CG2 3.83Å; F1595-I1618 HydrophobicContact CZ-CD1 4.03Å; F1595-I1618 HydrophobicContact CZ-CG2 4.17Å; I1600-I1618 HydrophobicContact CD1-CD1 3.43Å; I1600-I1618 VanDerWaalsContact CD1-CD1 3.43Å; I1600-I1618 HydrophobicContact CD1-CG1 3.82Å; L1608-I1618 HydrophobicContact CD1-CD1 3.94Å; L1608-I1618 HydrophobicContact CD2-CD1 4.39Å; F1613-I1618 HydrophobicContact CD1-CD1 4.29Å; Q1615-I1618 PolarHBondContact O-N 3.46Å; I1618-M1620 HydrophobicContact CG2-CB 4.27Å; I1618-M1620 HydrophobicContact CG2-CG 3.35Å; I1618-M1620 HydrophobicContact CG2-SD 3.67Å
1619G92.6Very high92.5Very high39 Ų3957.5 Ų57.540%0.40232%0.317SS..  trans60.947.6171.500000111.9F1613 I1614 Q1615F1613-G1619 PolarHBondContact O-N 3.45Å; I1614-G1619 WeakPolarHBondContact O-CA 2.01Å; Q1615-G1619 PolarHBondContact O-N 3.02Å
1620M94.8Very high92.8Very high3 Ų358.1 Ų58.12%0.01532%0.322CS..  trans-87.5146.3179.4-80.4175.173.800110.1C1588 Y1591 F1595 F1613 I1614 I1618 P1624 A1625 L1628C1588-M1620 HydrophobicContact CB-CE 4.39Å; Y1591-M1620 HydrophobicContact CD1-CB 4.08Å; Y1591-M1620 HydrophobicContact CD1-CG 3.21Å; Y1591-M1620 HydrophobicContact CD2-CE 3.82Å; Y1591-M1620 HydrophobicContact CD2-CG 3.76Å; Y1591-M1620 HydrophobicContact CD2-SD 4.39Å; Y1591-M1620 VanDerWaalsContact CE1-CA 3.44Å; Y1591-M1620 HydrophobicContact CE1-CB 4.02Å; Y1591-M1620 HydrophobicContact CE1-CG 3.67Å; Y1591-M1620 HydrophobicContact CE2-CE 4.33Å; Y1591-M1620 HydrophobicContact CE2-CG 4.17Å; Y1591-M1620 HydrophobicContact CG-CB 4.38Å; Y1591-M1620 HydrophobicContact CG-CE 4.15Å; Y1591-M1620 HydrophobicContact CG-CG 3.26Å; Y1591-M1620 HydrophobicContact CG-SD 4.12Å; F1595-M1620 HydrophobicContact CE2-SD 3.69Å; F1595-M1620 HydrophobicContact CZ-SD 3.89Å; F1613-M1620 HydrophobicContact CB-SD 4.45Å; F1613-M1620 HydrophobicContact CD1-SD 3.98Å; F1613-M1620 VanDerWaalsContact O-CB 3.24Å; F1613-M1620 WeakPolarHBondContact O-CB 1.08Å; F1613-M1620 PolarHBondContact O-N 3.08Å; I1614-M1620 VanDerWaalsContact CA-O 3.3Å; I1614-M1620 WeakPolarHBondContact CA-O 3.44Å; I1614-M1620 WeakPolarHBondContact CG2-O 3.09Å; I1618-M1620 HydrophobicContact CG2-CB 4.27Å; I1618-M1620 HydrophobicContact CG2-CG 3.35Å; I1618-M1620 HydrophobicContact CG2-SD 3.67Å; M1620-P1624 HydrophobicContact CE-CB 3.67Å; M1620-A1625 HydrophobicContact CB-CB 4.21Å; M1620-L1628 HydrophobicContact CE-CB 4.39Å; M1620-L1628 HydrophobicContact CE-CD2 4.4Å; M1620-L1628 HydrophobicContact SD-CD2 4.38Å
1621K95.3Very high93Very high153 Ų15355.6 Ų55.667%0.66531%0.308SS*.  trans-65.6151.5170.4-69.3-178.4176.61780111.3Y1591 G1623 P1624 A1625Y1591-K1621 WeakPolarHBondContact OH-CG 1.84Å; Y1591-K1621 PolarHBondContact OH-N 3.33Å; K1621-G1623 PolarHBondContact O-N 3.06Å; K1621-G1623 VanDerWaalsContact O-N 3.14Å; K1621-P1624 HydrophobicContact CB-CG 4.14Å; K1621-P1624 VanDerWaalsContact O-CD 3.28Å; K1621-P1624 WeakPolarHBondContact O-CD 3.27Å; K1621-A1625 WeakPolarHBondContact O-CB 3.25Å; K1621-A1625 PolarHBondContact O-N 2.66Å
1622I94.1Very high93.3Very high99 Ų9952.3 Ų52.351%0.50829%0.291SS..Hα-helixtrans-55.9-37-171.6-165.780.7000110.1I1614 A1625 L1626I1614-I1622 HydrophobicContact CD1-CD1 2.81Å; I1614-I1622 HydrophobicContact CD1-CG1 4.14Å; I1614-I1622 HydrophobicContact CG1-CD1 3.95Å; I1622-A1625 PolarHBondContact O-N 3.41Å; I1622-L1626 HydrophobicContact CG1-CD1 4.13Å; I1622-L1626 HydrophobicContact CG1-CG 4.39Å; I1622-L1626 WeakPolarHBondContact O-CB 2.81Å; I1622-L1626 VanDerWaalsContact O-CG 3.25Å; I1622-L1626 WeakPolarHBondContact O-CG 2.79Å; I1622-L1626 PolarHBondContact O-N 3.49Å
1623G95.3Very high93.4Very high32 Ų3254.1 Ų54.133%0.3330%0.299SS..Hα-helixtrans-61.4-61.1-178.500000111.7K1621 A1625 L1626 K1627K1621-G1623 PolarHBondContact O-N 3.06Å; K1621-G1623 VanDerWaalsContact O-N 3.14Å; G1623-A1625 PolarHBondContact O-N 2.99Å; G1623-A1625 VanDerWaalsContact O-N 3.16Å; G1623-L1626 PolarHBondContact O-N 3.39Å; G1623-K1627 PolarHBondContact O-N 3.16Å
1624P95.7Very high93.3Very high25 Ų2556.9 Ų56.916%0.16232%0.319CS..Hα-helixtrans-59.7-34.9-178.7-26.231.3000111.8C1588 Y1591 M1620 K1621 L1626 K1627 L1628C1588-P1624 PolarHBondContact SG-O 2.51Å; Y1591-P1624 HydrophobicContact CD2-CB 4.17Å; Y1591-P1624 HydrophobicContact CE2-CB 3.61Å; Y1591-P1624 HydrophobicContact CE2-CG 3.69Å; M1620-P1624 HydrophobicContact CE-CB 3.67Å; K1621-P1624 HydrophobicContact CB-CG 4.14Å; K1621-P1624 VanDerWaalsContact O-CD 3.28Å; K1621-P1624 WeakPolarHBondContact O-CD 3.27Å; P1624-L1626 PolarHBondContact O-N 3.29Å; P1624-K1627 PolarHBondContact O-N 2.84Å; P1624-L1628 WeakPolarHBondContact O-CB 3.06Å; P1624-L1628 PolarHBondContact O-N 3.09Å
1625A96.1Very high93.1Very high0 Ų055.6 Ų55.60%031%0.312CS..Hα-helixtrans-61.6-43.3178.300000111F1613 I1614 M1620 K1621 I1622 G1623 K1627 L1628 V1629F1613-A1625 HydrophobicContact CB-CB 3.78Å; I1614-A1625 HydrophobicContact CG1-CB 3.92Å; M1620-A1625 HydrophobicContact CB-CB 4.21Å; K1621-A1625 WeakPolarHBondContact O-CB 3.25Å; K1621-A1625 PolarHBondContact O-N 2.66Å; I1622-A1625 PolarHBondContact O-N 3.41Å; G1623-A1625 PolarHBondContact O-N 2.99Å; G1623-A1625 VanDerWaalsContact O-N 3.16Å; A1625-K1627 PolarHBondContact O-N 3.48Å; A1625-L1628 PolarHBondContact O-N 3.14Å; A1625-V1629 WeakPolarHBondContact O-CG2 2.78Å; A1625-V1629 PolarHBondContact O-N 3.07Å
1626L95Very high92.9Very high83 Ų8354 Ų5444%0.43530%0.304SS..Hα-helixtrans-66.9-37.2-178.7-76.6172.8000110.8E1610 I1622 G1623 P1624 L1628 V1629 A1630E1610-L1626 HydrophobicContact CG-CD2 4.38Å; E1610-L1626 WeakPolarHBondContact OE1-CD2 3.35Å; I1622-L1626 HydrophobicContact CG1-CD1 4.13Å; I1622-L1626 HydrophobicContact CG1-CG 4.39Å; I1622-L1626 WeakPolarHBondContact O-CB 2.81Å; I1622-L1626 VanDerWaalsContact O-CG 3.25Å; I1622-L1626 WeakPolarHBondContact O-CG 2.79Å; I1622-L1626 PolarHBondContact O-N 3.49Å; G1623-L1626 PolarHBondContact O-N 3.39Å; P1624-L1626 PolarHBondContact O-N 3.29Å; L1626-L1628 VanDerWaalsContact C-N 3.25Å; L1626-L1628 PolarHBondContact O-N 3.39Å; L1626-V1629 PolarHBondContact O-N 3.03Å; L1626-A1630 WeakPolarHBondContact O-CB 3.33Å; L1626-A1630 PolarHBondContact O-N 3.17Å
1627K95.3Very high92.3Very high124 Ų12456.3 Ų56.354%0.53931%0.311SS..Hα-helixtrans-65.5-38.8179-77.4-178.3-176.7177.60110.9G1623 P1624 A1625 V1629 A1630 R1631G1623-K1627 PolarHBondContact O-N 3.16Å; P1624-K1627 PolarHBondContact O-N 2.84Å; A1625-K1627 PolarHBondContact O-N 3.48Å; K1627-V1629 VanDerWaalsContact C-N 3.27Å; K1627-V1629 PolarHBondContact O-N 2.88Å; K1627-A1630 PolarHBondContact O-N 1.99Å; K1627-R1631 WeakPolarHBondContact O-CB 1.62Å; K1627-R1631 PolarHBondContact O-N 2.43Å
1628L95.5Very high91.1Very high0 Ų058.5 Ų58.50%033%0.326CS..Hα-helixtrans-69.5-39.8-179.2-169.482000110.6F1581 V1582 T1585 C1588 F1595 F1613 M1620 P1624 A1625 L1626 A1630 R1631 L1632F1581-L1628 HydrophobicContact CD1-CD1 4.3Å; F1581-L1628 HydrophobicContact CE1-CD1 3.92Å; F1581-L1628 HydrophobicContact CE1-CG 4.37Å; V1582-L1628 HydrophobicContact CB-CD1 4.31Å; V1582-L1628 HydrophobicContact CG1-CD1 4.26Å; V1582-L1628 HydrophobicContact CG2-CD1 3.99Å; V1582-L1628 HydrophobicContact CG2-CD2 4.45Å; T1585-L1628 HydrophobicContact CG2-CD1 4.24Å; C1588-L1628 HydrophobicContact CB-CD1 4.25Å; F1595-L1628 HydrophobicContact CE1-CD2 4.22Å; F1595-L1628 HydrophobicContact CE2-CD2 4.31Å; F1595-L1628 HydrophobicContact CZ-CD2 3.57Å; F1613-L1628 HydrophobicContact CD1-CD2 3.83Å; F1613-L1628 HydrophobicContact CE1-CD2 3.32Å; F1613-L1628 HydrophobicContact CZ-CD2 4.11Å; M1620-L1628 HydrophobicContact CE-CB 4.39Å; M1620-L1628 HydrophobicContact CE-CD2 4.4Å; M1620-L1628 HydrophobicContact SD-CD2 4.38Å; P1624-L1628 WeakPolarHBondContact O-CB 3.06Å; P1624-L1628 PolarHBondContact O-N 3.09Å; A1625-L1628 PolarHBondContact O-N 3.14Å; L1626-L1628 VanDerWaalsContact C-N 3.25Å; L1626-L1628 PolarHBondContact O-N 3.39Å; L1628-A1630 PolarHBondContact O-N 1.33Å; L1628-R1631 PolarHBondContact O-N 2.92Å; L1628-L1632 VanDerWaalsContact O-CB 3.27Å; L1628-L1632 WeakPolarHBondContact O-CB 3.49Å; L1628-L1632 PolarHBondContact O-N 2.83Å
1629V94.2Very high89Confident22 Ų2263.6 Ų63.613%0.13336%0.362CS..Hα-helixtrans-65.7-39.3-179.8170.60000109.7E1610 F1613 A1625 L1626 K1627 R1631 L1632 E1633E1610-V1629 HydrophobicContact CG-CG2 4.35Å; F1613-V1629 HydrophobicContact CD2-CG2 3.85Å; F1613-V1629 HydrophobicContact CE2-CG2 3.7Å; F1613-V1629 HydrophobicContact CZ-CG2 4.38Å; A1625-V1629 WeakPolarHBondContact O-CG2 2.78Å; A1625-V1629 PolarHBondContact O-N 3.07Å; L1626-V1629 PolarHBondContact O-N 3.03Å; K1627-V1629 VanDerWaalsContact C-N 3.27Å; K1627-V1629 PolarHBondContact O-N 2.88Å; V1629-R1631 PolarHBondContact O-N 2.53Å; V1629-L1632 PolarHBondContact O-N 3.39Å; V1629-E1633 HydrophobicContact CG1-CG 4.34Å; V1629-E1633 WeakPolarHBondContact O-CB 3.39Å; V1629-E1633 WeakPolarHBondContact O-CG 3.28Å; V1629-E1633 PolarHBondContact O-N 2.3Å
1630A93.6Very high88.8Confident57 Ų5764.9 Ų64.947%0.47136%0.36SS..Hα-helixtrans-64-42.9179.500000110.7L1626 K1627 L1628 L1632 E1633 S1634L1626-A1630 WeakPolarHBondContact O-CB 3.33Å; L1626-A1630 PolarHBondContact O-N 3.17Å; K1627-A1630 PolarHBondContact O-N 1.99Å; L1628-A1630 PolarHBondContact O-N 1.33Å; A1630-L1632 PolarHBondContact O-N 3Å; A1630-E1633 PolarHBondContact O-N 2.33Å; A1630-S1634 PolarHBondContact O-N 3.39Å
1631R93.1Very high88.5Confident38 Ų3868.1 Ų68.114%0.14338%0.378CS..Hα-helixtrans-68.4-38.5179.9-166.7169.7174.6175.7-0.6110.9N1563 F1581 G1584 T1585 K1627 L1628 V1629 E1633 S1634 L1635N1563-R1631 PolarHBondContact O-NH2 3.48Å; F1581-R1631 HydrophobicContact CE2-CG 3.82Å; F1581-R1631 HydrophobicContact CZ-CB 3.98Å; F1581-R1631 HydrophobicContact CZ-CG 3.71Å; G1584-R1631 PolarHBondContact O-NH1 2.92Å; T1585-R1631 HydrophobicContact CG2-CB 4.45Å; T1585-R1631 WeakPolarHBondContact OG1-CD 2.39Å; T1585-R1631 PolarHBondContact OG1-NH1 2.19Å; K1627-R1631 WeakPolarHBondContact O-CB 1.62Å; K1627-R1631 PolarHBondContact O-N 2.43Å; L1628-R1631 PolarHBondContact O-N 2.92Å; V1629-R1631 PolarHBondContact O-N 2.53Å; R1631-E1633 PolarHBondContact O-N 2.65Å; R1631-S1634 PolarHBondContact O-N 2.01Å; R1631-S1634 PolarHBondContact O-OG 2.1Å; R1631-L1635 PolarHBondContact O-N 1.09Å
1632L93.9Very high88.1Confident7 Ų763.4 Ų63.44%0.03736%0.362CS..Hα-helixtrans-62.7-36.4176.8-174.662.3000110.9I1570 F1581 L1605 L1628 V1629 A1630 S1634 L1635 K1636I1570-L1632 HydrophobicContact CD1-CD1 4.04Å; I1570-L1632 HydrophobicContact CG2-CD1 4.38Å; F1581-L1632 HydrophobicContact CE1-CD1 4.38Å; L1605-L1632 HydrophobicContact CD2-CD1 3.71Å; L1605-L1632 HydrophobicContact CD2-CD2 4.36Å; L1605-L1632 HydrophobicContact CG-CD1 4.25Å; L1605-L1632 HydrophobicContact CG-CD2 3.96Å; L1628-L1632 VanDerWaalsContact O-CB 3.27Å; L1628-L1632 WeakPolarHBondContact O-CB 3.49Å; L1628-L1632 PolarHBondContact O-N 2.83Å; V1629-L1632 PolarHBondContact O-N 3.39Å; A1630-L1632 PolarHBondContact O-N 3Å; L1632-S1634 PolarHBondContact O-N 2.59Å; L1632-L1635 PolarHBondContact O-N 2.62Å; L1632-L1635 VanDerWaalsContact O-N 3.1Å; L1632-K1636 WeakPolarHBondContact O-CG 2.38Å; L1632-K1636 PolarHBondContact O-N 3.13Å
1633E92.2Very high87.8Confident112 Ų11261.3 Ų61.352%0.52335%0.353SS..Hα-helixtrans-69.8-29.8-179.6-84.5-179.2-17900110.5V1629 A1630 R1631 L1635 K1636 N1637V1629-E1633 HydrophobicContact CG1-CG 4.34Å; V1629-E1633 WeakPolarHBondContact O-CB 3.39Å; V1629-E1633 WeakPolarHBondContact O-CG 3.28Å; V1629-E1633 PolarHBondContact O-N 2.3Å; A1630-E1633 PolarHBondContact O-N 2.33Å; R1631-E1633 PolarHBondContact O-N 2.65Å; E1633-L1635 PolarHBondContact O-N 3.33Å; E1633-K1636 PolarHBondContact O-N 3.34Å; E1633-N1637 PolarHBondContact O-N 2.45Å
1634S90.5Very high87.3Confident60 Ų6063.1 Ų63.142%0.4236%0.355SS..Hα-helixtrans-71.4-27.2178.365.70000111A1630 R1631 L1632 K1636 C1638A1630-S1634 PolarHBondContact O-N 3.39Å; R1631-S1634 PolarHBondContact O-N 2.01Å; R1631-S1634 PolarHBondContact O-OG 2.1Å; L1632-S1634 PolarHBondContact O-N 2.59Å; S1634-K1636 VanDerWaalsContact C-N 3.29Å; S1634-C1638 PolarHBondContact O-SG 3.23Å
1635L89.5Confident86.7Confident30 Ų3065.7 Ų65.716%0.15737%0.368CS..Hα-helixtrans-84.5-26.3-179.5-76.1167.6000110.7P1565 I1570 W1573 F1581 R1631 L1632 E1633 N1637 C1638 C1639P1565-L1635 HydrophobicContact CB-CD1 3.79Å; P1565-L1635 HydrophobicContact CB-CD2 4Å; P1565-L1635 HydrophobicContact CG-CD1 4.06Å; P1565-L1635 HydrophobicContact CG-CD2 3.55Å; P1565-L1635 HydrophobicContact CG-CG 4.38Å; I1570-L1635 HydrophobicContact CD1-CB 3.75Å; W1573-L1635 HydrophobicContact CH2-CD1 3.82Å; F1581-L1635 HydrophobicContact CD2-CD1 3.81Å; F1581-L1635 HydrophobicContact CE2-CD1 3.07Å; F1581-L1635 HydrophobicContact CE2-CG 4.43Å; F1581-L1635 HydrophobicContact CZ-CD1 3.66Å; R1631-L1635 PolarHBondContact O-N 1.09Å; L1632-L1635 PolarHBondContact O-N 2.62Å; L1632-L1635 VanDerWaalsContact O-N 3.1Å; E1633-L1635 PolarHBondContact O-N 3.33Å; L1635-N1637 PolarHBondContact O-N 3.35Å; L1635-C1638 PolarHBondContact O-N 1.69Å; L1635-C1638 VanDerWaalsContact O-N 3.15Å; L1635-C1639 PolarHBondContact O-N 2.41Å
1636K86.5Confident86.1Confident81 Ų8170.4 Ų70.435%0.35239%0.394SS..Hα-helixtrans-68.8-28.5-179.8-80.9-179.6176.7-178.80110.8I1570 L1606 L1632 E1633 S1634 C1638I1570-K1636 HydrophobicContact CD1-CG 3.91Å; L1606-K1636 HydrophobicContact CD2-CD 3.67Å; L1606-K1636 HydrophobicContact CD2-CG 3.77Å; L1632-K1636 WeakPolarHBondContact O-CG 2.38Å; L1632-K1636 PolarHBondContact O-N 3.13Å; E1633-K1636 PolarHBondContact O-N 3.34Å; S1634-K1636 VanDerWaalsContact C-N 3.29Å; K1636-C1638 PolarHBondContact O-N 3.41Å
1637N74.9Confident85.4Confident142 Ų14269.4 Ų69.476%0.75939%0.391SS*.THydrogen-bonded Turntrans-90.6-3-175.2-67.6-15.2000110.9E1633 L1635E1633-N1637 PolarHBondContact O-N 2.45Å; L1635-N1637 PolarHBondContact O-N 3.35Å
1638C61.7Low84.5Confident109 Ų10964.8 Ų64.874%0.73638%0.379SS*.THydrogen-bonded Turntrans-102.5-8.8-179-77.10000110.3S1634 L1635 K1636S1634-C1638 PolarHBondContact O-SG 3.23Å; L1635-C1638 PolarHBondContact O-N 1.69Å; L1635-C1638 VanDerWaalsContact O-N 3.15Å; K1636-C1638 PolarHBondContact O-N 3.41Å
1639C48.9Very low83.5Confident120 Ų12070.7 Ų70.781%0.81141%0.413SS*.  trans-108.60175.1-63.20000110.5L1635L1635-C1639 PolarHBondContact O-N 2.41Å

Retrieved 1,639 of 1,639 residues in 266.4 ms (Link to these results)