A0A3B3VA32_9TELE Loading...

CCAAT enhancer binding protein beta

AlphaFold DB , UniProt , Accession A0A3B3VA32, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 287 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M41.8Very low43.5Very low244 Ų244150.4 Ų150.4100%1.20286%0.861SS**  0110.10-157.1157.2151.700105.9
2E40.8Very low43Very low193 Ų193156.1 Ų156.190%0.90287%0.869SS**  trans-69145-168.3-60.7166.4157.300111
3V46.4Very low42.7Very low147 Ų147149.9 Ų149.989%0.89185%0.851SS**  trans-123.8103.8157.9-177.10000106.2
4A44.1Very low42.5Very low90 Ų90151 Ų15174%0.74485%0.85SS**  trans-66.8133.8178.500000110.9
5G43.7Very low42.5Very low70 Ų70151 Ų15172%0.72284%0.84SS**  trans-151.787.6165.200000107.7
6L42.4Very low42.5Very low163 Ų163146 Ų14685%0.85383%0.833SS**  trans-59.5133.3179-87.598000111.2
7Y48.6Very low42.4Very low225 Ų225150.1 Ų150.188%0.88283%0.832SS**  trans-63.2140.1151.7-78.3-105.2000109
8E48.1Very low42.3Very low185 Ų185151.3 Ų151.386%0.86484%0.837SS**  trans-149.3112.4145.3-124.8-166.4-17400112
9E42.9Very low41.9Very low189 Ų189146.7 Ų146.788%0.88383%0.828SS**  trans-65.8141.9149.5-85.3-172.4132.600109.9
10G41.4Very low41.7Very low75 Ų75148.1 Ų148.177%0.77383%0.831SS**  trans95.8141.5138.600000117.8
11G38.5Very low41.6Very low73 Ų73148.8 Ų148.875%0.75383%0.832SS**  trans116.279.8152.500000116A13G11-A13 PolarHBondContact O-N 3.49Å
12F37.8Very low41.4Very low219 Ų219141.2 Ų141.296%0.96181%0.808SS**  trans-6596.8154.4-79.5-90.8000109.1
13A39.2Very low41.6Very low76 Ų76137.8 Ų137.863%0.62880%0.802SS**  trans-110.394.5173.100000110.5G11 H15G11-A13 PolarHBondContact O-N 3.49Å; A13-H15 PolarHBondContact O-N 2.98Å; A13-H15 PolarHBondContact O-ND1 2.58Å
14I40Very low41.2Very low165 Ų165139 Ų13985%0.84680%0.802SS**  trans-67.3113.4170.7-59.6-173.2000108.2G16I14-G16 PolarHBondContact O-N 3.47Å
15H41.5Very low41Very low151 Ų151138.3 Ų138.370%0.69980%0.804SS**  trans-76.4102.1170.4-79.444000109.5A13A13-H15 PolarHBondContact O-N 2.98Å; A13-H15 PolarHBondContact O-ND1 2.58Å
16G43.6Very low40.6Very low71 Ų71138.8 Ų138.873%0.73281%0.808SS**  trans-65.5132159.800000110I14I14-G16 PolarHBondContact O-N 3.47Å
17R39.7Very low40.7Very low216 Ų216134.8 Ų134.882%0.81581%0.807SS**  trans-129.8111.7165.2-55.4-174.9171-137.1-5.9107
18D40.2Very low40.4Very low171 Ų171128 Ų12891%0.91480%0.797SS**  trans-46.2145.4163-50.8-62.5000109.6
19G36.3Very low40.2Very low65 Ų65126.7 Ų126.767%0.6779%0.785SS**  cis154.7123.511.200000105
20I37.1Very low40.2Very low173 Ų173128.3 Ų128.389%0.88778%0.783SS**  trans-159.299151.1-80.1133.3000104.1
21I39.2Very low40.9Very low164 Ų164132.8 Ų132.884%0.84178%0.777SS**PPolyproline II helixtrans-100.2118.8169.8-66173.9000106.5
22A37.1Very low41.2Very low85 Ų85138.3 Ų138.370%0.70279%0.788SS**PPolyproline II helixtrans-102.3139.6151.400000107.6
23P44.9Very low42.1Very low121 Ų121131.2 Ų131.279%0.78678%0.777SS**PPolyproline II helixtrans-87.2123.5-166.633.8-30.6000110.5
24I39.1Very low42.5Very low172 Ų172131.9 Ų131.988%0.88277%0.77SS**  trans-113.5111.3155.6-63.5178.6000105.7
25G38.9Very low43Very low76 Ų76127.7 Ų127.778%0.78476%0.755SS**  trans-66.1160.9-175.900000113.3
26G35.5Very low43.3Very low79 Ų79128.6 Ų128.681%0.81476%0.762SS**  trans135.176.5176.800000110
27G44.5Very low43.9Very low80 Ų80131 Ų13183%0.82576%0.763SS**  trans-66.8137.6179.200000112.3
28A43.2Very low44.6Very low82 Ų82127.8 Ų127.868%0.67876%0.757SS**  trans-168.184.6147.500000107
29Y43.4Very low44.9Very low157 Ų157126.1 Ų126.162%0.61675%0.747SS**  trans-77.7119.5160.459.4-88.7000105.7R31Y29-R31 HydrophobicContact CD2-CB 3.94Å; Y29-R31 HydrophobicContact CD2-CG 3.65Å; Y29-R31 HydrophobicContact CE2-CB 3.87Å; Y29-R31 HydrophobicContact CE2-CG 3.59Å; Y29-R31 PolarHBondContact O-N 3.45Å; Y29-R31 PolarHBondContact OH-NH2 3.34Å
30W43.2Very low45.5Very low223 Ų223126.3 Ų126.385%0.84575%0.749SS**  trans-69.4105.2166-64.3107.1000106.8
31R55Low46Very low169 Ų169123 Ų12364%0.63874%0.737SS**  trans-80.8135.4170.5-114.5-156.1-64-102.99.7108Y29 G33Y29-R31 HydrophobicContact CD2-CB 3.94Å; Y29-R31 HydrophobicContact CD2-CG 3.65Å; Y29-R31 HydrophobicContact CE2-CB 3.87Å; Y29-R31 HydrophobicContact CE2-CG 3.59Å; Y29-R31 PolarHBondContact O-N 3.45Å; Y29-R31 PolarHBondContact OH-NH2 3.34Å; R31-G33 VanDerWaalsContact C-N 3.34Å; R31-G33 PolarHBondContact O-N 3.14Å
32L45.7Very low46.6Very low189 Ų189124.1 Ų124.199%0.9974%0.738SS**THydrogen-bonded Turntrans-62.995.1174.9-162.673000108.3
33G56.7Low47.6Very low70 Ų70128.5 Ų128.572%0.72274%0.744SS**THydrogen-bonded Turntrans157.3-6-174.900000117.2R31 S35R31-G33 VanDerWaalsContact C-N 3.34Å; R31-G33 PolarHBondContact O-N 3.14Å; G33-S35 PolarHBondContact O-N 3.03Å
34D48.1Very low48.1Very low91 Ų91133.4 Ų133.449%0.48775%0.747SS.*  trans-64.5109.8178.6-78.4-5.1000111.3
35S50Low49.1Very low77 Ų77133.7 Ų133.754%0.53875%0.745SS.*  trans-68.9140.7175.6175.80000110.1G33 T37 E38G33-S35 PolarHBondContact O-N 3.03Å; S35-T37 WeakPolarHBondContact CB-OG1 3.15Å; S35-T37 PolarHBondContact O-N 3.22Å; S35-T37 PolarHBondContact OG-OG1 3.34Å; S35-E38 PolarHBondContact O-N 3.04Å
36M47.6Very low50.3Low170 Ų170141 Ų14184%0.83775%0.749SS**G310 helixtrans-57-5.6-178.7-65.6-144-43.600115.6
37T56.9Low52Low122 Ų122141.7 Ų141.775%0.74875%0.747SS**G310 helixtrans-76.5-18.5174.635.50000113.9S35 L39S35-T37 WeakPolarHBondContact CB-OG1 3.15Å; S35-T37 PolarHBondContact O-N 3.22Å; S35-T37 PolarHBondContact OG-OG1 3.34Å; T37-L39 VanDerWaalsContact C-N 3.26Å; T37-L39 PolarHBondContact O-N 3.44Å
38E53.4Low53.2Low148 Ų148144.1 Ų144.169%0.69274%0.74SS**G310 helixtrans-88.321.2-179-148.1-173.917700113.9S35S35-E38 PolarHBondContact O-N 3.04Å
39L47.1Very low54.6Low135 Ų135145.6 Ų145.671%0.70774%0.736SS**G310 helixtrans-101.514.2176.9-69.9178.3000114T37 V41T37-L39 VanDerWaalsContact C-N 3.26Å; T37-L39 PolarHBondContact O-N 3.44Å; L39-V41 HydrophobicContact CB-CG2 3.82Å; L39-V41 WeakPolarHBondContact O-CG2 3.25Å; L39-V41 PolarHBondContact O-N 3.42Å; L39-V41 VanDerWaalsContact O-N 3.1Å
40G49.6Very low55.7Low69 Ų69144.6 Ų144.671%0.71174%0.735SS**  trans59.526.917400000114E42G40-E42 PolarHBondContact O-N 3.35Å
41V47Very low57Low104 Ų104136.7 Ų136.763%0.6371%0.714SS**G310 helixtrans-82.13-178.1-164.70000111.8L39 E43L39-V41 HydrophobicContact CB-CG2 3.82Å; L39-V41 WeakPolarHBondContact O-CG2 3.25Å; L39-V41 PolarHBondContact O-N 3.42Å; L39-V41 VanDerWaalsContact O-N 3.1Å; V41-E43 VanDerWaalsContact C-N 3.34Å; V41-E43 PolarHBondContact O-N 3.49Å
42E52.3Low57.6Low187 Ų187131.9 Ų131.987%0.87471%0.71SS**G310 helixtrans-70.4-22.4-173.1-166.2176.2166.100113.9G40G40-E42 PolarHBondContact O-N 3.35Å
43E57.7Low58.4Low177 Ų177132 Ų13283%0.82770%0.699SS**G310 helixtrans-96.50.4-168.9-144.2-172.1168.400116V41V41-E43 VanDerWaalsContact C-N 3.34Å; V41-E43 PolarHBondContact O-N 3.49Å
44R56Low58.8Low225 Ų225135 Ų13585%0.84970%0.698SS**  trans-138.943.8179.4-58.1-171.4-163.1-89.3-4.7114R46R44-R46 PolarHBondContact O-N 3.27Å
45E59.1Low59.1Low178 Ų178135.9 Ų135.983%0.83270%0.703SS**  trans-77.174.7160.5-74.2-166.2157.700110.5
46R65.2Low59.2Low229 Ų229137 Ų13786%0.86471%0.711SS**  trans-100.9101.6147.2-65.5-163.4-155.8-82.1-0.8105.9R44 I48R44-R46 PolarHBondContact O-N 3.27Å; R46-I48 PolarHBondContact O-N 2.95Å
47A71.4Confident59.2Low94 Ų94133 Ų13378%0.77771%0.705SS**  trans-49.9137.7165.500000108.3D49A47-D49 PolarHBondContact O-N 3.06Å
48I68.7Low58.8Low131 Ų131134.2 Ų134.267%0.67271%0.705SS**  trans-60.7112.8176.2-62.5170.1000106.8R46 F50R46-I48 PolarHBondContact O-N 2.95Å; I48-F50 HydrophobicContact CB-CD2 4.43Å; I48-F50 HydrophobicContact CB-CE2 3.83Å; I48-F50 HydrophobicContact CB-CZ 4.04Å; I48-F50 HydrophobicContact CG2-CD1 4.34Å; I48-F50 HydrophobicContact CG2-CD2 4.18Å; I48-F50 HydrophobicContact CG2-CE1 3.94Å; I48-F50 HydrophobicContact CG2-CE2 3.76Å; I48-F50 HydrophobicContact CG2-CG 4.47Å; I48-F50 HydrophobicContact CG2-CZ 3.62Å; I48-F50 WeakPolarHBondContact O-CD2 3.42Å; I48-F50 WeakPolarHBondContact O-CE2 3.33Å; I48-F50 PolarHBondContact O-N 3.05Å
49D73.6Confident58.4Low113 Ų113135.4 Ų135.460%0.60471%0.71SS**  trans-78100.7178.8-174.65.1000109.5A47 S51A47-D49 PolarHBondContact O-N 3.06Å; D49-S51 PolarHBondContact O-N 3.3Å; D49-S51 WeakPolarHBondContact OD1-CB 3.36Å; D49-S51 PolarHBondContact OD1-N 3.45Å; D49-S51 PolarHBondContact OD1-OG 2.97Å; D49-S51 PolarHBondContact OD2-OG 2.93Å
50F65.5Low58Low135 Ų135134.6 Ų134.659%0.59272%0.715SS**THydrogen-bonded Turntrans-78.5-4.7177.9-67.6-82.3000113I48 A52 Y53 L54I48-F50 HydrophobicContact CB-CD2 4.43Å; I48-F50 HydrophobicContact CB-CE2 3.83Å; I48-F50 HydrophobicContact CB-CZ 4.04Å; I48-F50 HydrophobicContact CG2-CD1 4.34Å; I48-F50 HydrophobicContact CG2-CD2 4.18Å; I48-F50 HydrophobicContact CG2-CE1 3.94Å; I48-F50 HydrophobicContact CG2-CE2 3.76Å; I48-F50 HydrophobicContact CG2-CG 4.47Å; I48-F50 HydrophobicContact CG2-CZ 3.62Å; I48-F50 WeakPolarHBondContact O-CD2 3.42Å; I48-F50 WeakPolarHBondContact O-CE2 3.33Å; I48-F50 PolarHBondContact O-N 3.05Å; F50-A52 VanDerWaalsContact C-N 3.25Å; F50-A52 PolarHBondContact O-N 3.4Å; F50-Y53 PolarHBondContact O-N 3.2Å; F50-L54 PolarHBondContact O-N 3.41Å
51S70.2Confident57.5Low58 Ų58136.6 Ų136.641%0.40672%0.716SS.*Hα-helixtrans-60.9-33.9-179.5660000112.6D49 Y53 L54 D55D49-S51 PolarHBondContact O-N 3.3Å; D49-S51 WeakPolarHBondContact OD1-CB 3.36Å; D49-S51 PolarHBondContact OD1-N 3.45Å; D49-S51 PolarHBondContact OD1-OG 2.97Å; D49-S51 PolarHBondContact OD2-OG 2.93Å; S51-Y53 PolarHBondContact O-N 2.93Å; S51-L54 PolarHBondContact O-N 3.48Å; S51-D55 PolarHBondContact O-N 2.9Å
52A67.1Low57.2Low67 Ų67137.8 Ų137.855%0.55473%0.725SS**Hα-helixtrans-57.6-23.917500000114F50F50-A52 VanDerWaalsContact C-N 3.25Å; F50-A52 PolarHBondContact O-N 3.4Å
53Y63.3Low56.4Low191 Ų191137.9 Ų137.975%0.74973%0.726SS**Hα-helixtrans-99.8-13.2179.3-68.1-81.3000113.6F50 S51F50-Y53 PolarHBondContact O-N 3.2Å; S51-Y53 PolarHBondContact O-N 2.93Å
54L65.7Low55.5Low135 Ų135135.3 Ų135.371%0.70772%0.724SS**Hα-helixtrans-84.6-28.6176.3-65.5177.2000112.2F50 S51 S56F50-L54 PolarHBondContact O-N 3.41Å; S51-L54 PolarHBondContact O-N 3.48Å; L54-S56 VanDerWaalsContact C-N 3.35Å; L54-S56 PolarHBondContact O-N 3.29Å
55D53.9Low54.8Low109 Ų109133.3 Ų133.358%0.58372%0.724SS**G310 helixtrans-80.9-7.8-177.2-100.2-9.6000115.3S51 A57S51-D55 PolarHBondContact O-N 2.9Å; D55-A57 PolarHBondContact O-N 2.96Å
56S52.9Low53.6Low101 Ų101133.5 Ų133.571%0.70673%0.725SS**G310 helixtrans-72.7-6.2177.3-67.30000113.6L54L54-S56 VanDerWaalsContact C-N 3.35Å; L54-S56 PolarHBondContact O-N 3.29Å
57A46.7Very low52.6Low86 Ų86127.7 Ų127.771%0.71172%0.717SS**G310 helixtrans-86.1-6.1179.600000114.8D55D55-A57 PolarHBondContact O-N 2.96Å
58L48.3Very low51Low146 Ų146131.8 Ų131.876%0.76472%0.72SS**SBendtrans-1215.5-170.9-65.9-178.7000116.9C60L58-C60 PolarHBondContact O-N 3.14Å
59H45.1Very low50Low173 Ų173131.2 Ų131.280%0.80173%0.725SS**  trans-102.286.7-179.1-76.386.3000112.8
60C38.7Very low48.7Very low118 Ų118129.2 Ų129.280%0.79773%0.732SS**PPolyproline II helixtrans-103.9134.1163.3-161.70000108.6L58L58-C60 PolarHBondContact O-N 3.14Å
61P38.5Very low47.9Very low112 Ų112129 Ų12973%0.72774%0.737SS**PPolyproline II helixtrans-74.4154.2178.231.9-32.9000110.9
62P40.8Very low47.2Very low128 Ų128130.2 Ų130.283%0.83175%0.75SS**PPolyproline II helixtrans-79.2134.3-17231.9-32.3000111.9
63Q36.4Very low46.4Very low190 Ų190135.9 Ų135.989%0.88876%0.763SS**  trans-122.3152.8157.1-86.7-152.9-12.200109.9
64P39.3Very low45.8Very low123 Ų123130.4 Ų130.480%0.79975%0.752SS**  trans-84133.3-154.732-33.5000115.1
65Q39.7Very low45.2Very low182 Ų182129.7 Ų129.785%0.8575%0.749SS**  trans23.7117.3146.3-58.3-173.1-15.700122.6
66Q35.5Very low45.1Very low182 Ų182131.2 Ų131.285%0.8575%0.751SS**  136.8153.7125.5-80.2-162.4-19.100113.8
67P44Very low45.3Very low107 Ų107131.8 Ų131.870%0.69575%0.745SS**  cis-132.6157.2-36.737.9-21000115.1
68Q36.7Very low45.7Very low180 Ų180129.2 Ų129.284%0.84173%0.727SS**  trans69134.3156.8-59.8-63.76.800123.5
69P48.4Very low45.9Very low120 Ų120126.9 Ų126.978%0.77971%0.712SS**  trans-99127.5-177.537.7-27.6000112.3
70G45.9Very low46.5Very low71 Ų71120.8 Ų120.873%0.73269%0.689SS**  trans-156.6130.4165.200000108.6
71D49.5Very low47.5Very low131 Ų131121.4 Ų121.470%0.70168%0.678SS**SBendtrans80.45169.9-82.7-15.2000122.4F73 S74D71-F73 PolarHBondContact O-N 2.95Å; D71-S74 PolarHBondContact O-N 3.39Å; D71-S74 VanDerWaalsContact O-N 3.14Å
72A54.5Low48.8Very low83 Ų83121.2 Ų121.269%0.68667%0.67SS**Hα-helixtrans-61.7-19.817700000115.5
73F49.8Very low49.9Very low186 Ų186120.9 Ų120.982%0.81666%0.655SS**Hα-helixtrans-84.3-23.1178.5-79.7-83.1000113.8D71D71-F73 PolarHBondContact O-N 2.95Å
74S51.6Low51Low76 Ų76120 Ų12053%0.53164%0.644SS.*Hα-helixtrans-74.6-39.9-179.1-160.60000111.2D71 F76 L77 G78D71-S74 PolarHBondContact O-N 3.39Å; D71-S74 VanDerWaalsContact O-N 3.14Å; S74-F76 PolarHBondContact O-N 3.34Å; S74-L77 PolarHBondContact O-N 3.09Å; S74-G78 PolarHBondContact O-N 3.38Å; S74-G78 VanDerWaalsContact O-N 3.14Å
75D53.3Low52.2Low120 Ų120118.1 Ų118.164%0.64263%0.63SS**Hα-helixtrans-67-36.9-178.2-70.8-21.2000112.8L77 G78 E79D75-L77 PolarHBondContact O-N 3.17Å; D75-G78 PolarHBondContact O-N 3.17Å; D75-E79 WeakPolarHBondContact O-CB 3.41Å; D75-E79 PolarHBondContact O-N 3Å
76F51.8Low53.4Low140 Ų140112.1 Ų112.161%0.61461%0.606SS**Hα-helixtrans-66.8-37.2-179.3-167.4-100000113.2S74 S80S74-F76 PolarHBondContact O-N 3.34Å; F76-S80 WeakPolarHBondContact O-CB 3.46Å; F76-S80 PolarHBondContact O-N 3.1Å; F76-S80 VanDerWaalsContact O-N 3.12Å; F76-S80 PolarHBondContact O-OG 2.88Å
77L56.5Low54.6Low114 Ų114106.1 Ų106.160%0.59759%0.587SS**Hα-helixtrans-74.6-35.2175.7-75.4171.8000111.9S74 D75 S80 K81S74-L77 PolarHBondContact O-N 3.09Å; D75-L77 PolarHBondContact O-N 3.17Å; L77-S80 PolarHBondContact O-N 3.07Å; L77-K81 WeakPolarHBondContact O-CG 3.5Å; L77-K81 PolarHBondContact O-N 3.16Å
78G55Low55.5Low31 Ų31106.5 Ų106.532%0.3258%0.583SS.*Hα-helixtrans-61-49.7171.300000111.6S74 D75 S80 K81 I82S74-G78 PolarHBondContact O-N 3.38Å; S74-G78 VanDerWaalsContact O-N 3.14Å; D75-G78 PolarHBondContact O-N 3.17Å; G78-S80 VanDerWaalsContact C-N 3.29Å; G78-S80 PolarHBondContact O-N 3Å; G78-K81 PolarHBondContact O-N 3.13Å; G78-K81 VanDerWaalsContact O-N 3.16Å; G78-I82 WeakPolarHBondContact O-CD1 3.45Å; G78-I82 VanDerWaalsContact O-CG1 3.26Å; G78-I82 WeakPolarHBondContact O-CG1 3.44Å; G78-I82 PolarHBondContact O-N 3.4Å
79E53.6Low56.6Low98 Ų98103.3 Ų103.346%0.45857%0.568SS.*Hα-helixtrans-58.9-39.3177.2-120.7-171.8-163.600112.4D75 K81 I82 K83D75-E79 WeakPolarHBondContact O-CB 3.41Å; D75-E79 PolarHBondContact O-N 3Å; E79-K81 PolarHBondContact O-N 3.3Å; E79-I82 PolarHBondContact O-N 2.87Å; E79-K83 VanDerWaalsContact O-CB 3.31Å; E79-K83 WeakPolarHBondContact O-CB 3.46Å; E79-K83 WeakPolarHBondContact O-CD 3.43Å; E79-K83 WeakPolarHBondContact O-CG 3.49Å; E79-K83 PolarHBondContact O-N 3.14Å; E79-K83 IonicContact OE2-NZ 2.89Å; E79-K83 PolarHBondContact OE2-NZ 3.36Å
80S56.7Low57.4Low45 Ų45101.3 Ų101.332%0.31555%0.551SS.*Hα-helixtrans-66-37.2178.5-63.30000112.5F76 L77 G78 R84F76-S80 WeakPolarHBondContact O-CB 3.46Å; F76-S80 PolarHBondContact O-N 3.1Å; F76-S80 VanDerWaalsContact O-N 3.12Å; F76-S80 PolarHBondContact O-OG 2.88Å; L77-S80 PolarHBondContact O-N 3.07Å; G78-S80 VanDerWaalsContact C-N 3.29Å; G78-S80 PolarHBondContact O-N 3Å; S80-R84 WeakPolarHBondContact O-CG 3.11Å; S80-R84 PolarHBondContact O-N 3.47Å
81K60.6Low58Low131 Ų131105.9 Ų105.957%0.5755%0.547SS*.Hα-helixtrans-72.2-41.9175.2-69.6175.3-176.1176.60111.5L77 G78 E79 R84 V85L77-K81 WeakPolarHBondContact O-CG 3.5Å; L77-K81 PolarHBondContact O-N 3.16Å; G78-K81 PolarHBondContact O-N 3.13Å; G78-K81 VanDerWaalsContact O-N 3.16Å; E79-K81 PolarHBondContact O-N 3.3Å; K81-R84 PolarHBondContact O-N 3.46Å; K81-V85 WeakPolarHBondContact O-CG2 3.48Å; K81-V85 PolarHBondContact O-N 2.79Å
82I66.1Low58.8Low108 Ų108106.8 Ų106.855%0.55455%0.545SS*.Hα-helixtrans-61.1-48176.3-65.9160.3000109.9G78 E79 R84 V85 T86G78-I82 WeakPolarHBondContact O-CD1 3.45Å; G78-I82 VanDerWaalsContact O-CG1 3.26Å; G78-I82 WeakPolarHBondContact O-CG1 3.44Å; G78-I82 PolarHBondContact O-N 3.4Å; E79-I82 PolarHBondContact O-N 2.87Å; I82-R84 VanDerWaalsContact C-N 3.28Å; I82-R84 PolarHBondContact O-N 3.45Å; I82-V85 PolarHBondContact O-N 2.93Å; I82-V85 VanDerWaalsContact O-N 3.11Å; I82-T86 WeakPolarHBondContact O-CB 3.41Å; I82-T86 PolarHBondContact O-N 3.35Å; I82-T86 PolarHBondContact O-OG1 3.22Å
83K63Low59.4Low121 Ų121107.6 Ų107.653%0.52654%0.538SS..Hα-helixtrans-56.3-38.9175.6-75163.8-179.7163.60112.4E79 A87E79-K83 VanDerWaalsContact O-CB 3.31Å; E79-K83 WeakPolarHBondContact O-CB 3.46Å; E79-K83 WeakPolarHBondContact O-CD 3.43Å; E79-K83 WeakPolarHBondContact O-CG 3.49Å; E79-K83 PolarHBondContact O-N 3.14Å; E79-K83 IonicContact OE2-NZ 2.89Å; E79-K83 PolarHBondContact OE2-NZ 3.36Å; K83-A87 WeakPolarHBondContact O-CB 3.39Å; K83-A87 PolarHBondContact O-N 3.42Å
84R59.8Low59.8Low172 Ų172107.3 Ų107.365%0.64953%0.532SS*.Hα-helixtrans-69.7-40.1175.5-72.5-162.8-58.2-153.64.7113.3S80 K81 I82 A87 L88S80-R84 WeakPolarHBondContact O-CG 3.11Å; S80-R84 PolarHBondContact O-N 3.47Å; K81-R84 PolarHBondContact O-N 3.46Å; I82-R84 VanDerWaalsContact C-N 3.28Å; I82-R84 PolarHBondContact O-N 3.45Å; R84-A87 PolarHBondContact O-N 2.93Å; R84-L88 WeakPolarHBondContact O-CG 3.44Å; R84-L88 PolarHBondContact O-N 3.43Å
85V63.8Low60.6Low82 Ų82106.5 Ų106.550%0.49753%0.526SS..Hα-helixtrans-67.6-43.5176.4173.70000110.7K81 I82 L88 Q89K81-V85 WeakPolarHBondContact O-CG2 3.48Å; K81-V85 PolarHBondContact O-N 2.79Å; I82-V85 PolarHBondContact O-N 2.93Å; I82-V85 VanDerWaalsContact O-N 3.11Å; V85-L88 PolarHBondContact O-N 3.46Å; V85-Q89 WeakPolarHBondContact O-CG 3.26Å; V85-Q89 PolarHBondContact O-N 2.87Å
86T64.5Low61.2Low57 Ų57105.8 Ų105.835%0.3552%0.522SS..Hα-helixtrans-65.3-38.1174.9-52.20000111.4I82 Q89 N90I82-T86 WeakPolarHBondContact O-CB 3.41Å; I82-T86 PolarHBondContact O-N 3.35Å; I82-T86 PolarHBondContact O-OG1 3.22Å; T86-Q89 PolarHBondContact O-N 2.95Å; T86-N90 VanDerWaalsContact O-CB 3.3Å; T86-N90 WeakPolarHBondContact O-CB 3.31Å; T86-N90 PolarHBondContact O-N 2.65Å; T86-N90 PolarHBondContact O-ND2 2.93Å; T86-N90 PolarHBondContact O-OD1 3.42Å
87A61.3Low61.9Low56 Ų56104.3 Ų104.346%0.46352%0.52SS..Hα-helixtrans-63.9-39.8174.300000112.4K83 R84 N90 Y91K83-A87 WeakPolarHBondContact O-CB 3.39Å; K83-A87 PolarHBondContact O-N 3.42Å; R84-A87 PolarHBondContact O-N 2.93Å; A87-N90 PolarHBondContact O-N 3.21Å; A87-Y91 WeakPolarHBondContact O-CB 3.42Å; A87-Y91 PolarHBondContact O-N 2.96Å
88L62.3Low62.1Low115 Ų115104 Ų10460%0.60252%0.519SS*.Hα-helixtrans-67.8-39.1173.8-75.4172.9000112.2R84 V85 N90 Y91 K92R84-L88 WeakPolarHBondContact O-CG 3.44Å; R84-L88 PolarHBondContact O-N 3.43Å; V85-L88 PolarHBondContact O-N 3.46Å; L88-N90 VanDerWaalsContact C-N 3.34Å; L88-Y91 PolarHBondContact O-N 3.5Å; L88-K92 WeakPolarHBondContact O-CG 3.42Å; L88-K92 PolarHBondContact O-N 3.16Å
89Q60.9Low62.6Low112 Ų112108.8 Ų108.852%0.52353%0.533SS..Hα-helixtrans-65.7-37.3172.7-76.7-177-17.800111.9V85 T86 K92 N93V85-Q89 WeakPolarHBondContact O-CG 3.26Å; V85-Q89 PolarHBondContact O-N 2.87Å; T86-Q89 PolarHBondContact O-N 2.95Å; Q89-K92 PolarHBondContact O-N 3.38Å; Q89-N93 PolarHBondContact O-N 2.96Å; Q89-N93 PolarHBondContact O-ND2 2.72Å
90N64.1Low63Low78 Ų78109.1 Ų109.142%0.41754%0.537SS..Hα-helixtrans-68.2-41.2175.6-73.3-12.3000111.3T86 A87 L88 K92 N93 Y94T86-N90 VanDerWaalsContact O-CB 3.3Å; T86-N90 WeakPolarHBondContact O-CB 3.31Å; T86-N90 PolarHBondContact O-N 2.65Å; T86-N90 PolarHBondContact O-ND2 2.93Å; T86-N90 PolarHBondContact O-OD1 3.42Å; A87-N90 PolarHBondContact O-N 3.21Å; L88-N90 VanDerWaalsContact C-N 3.34Å; N90-K92 VanDerWaalsContact C-N 3.33Å; N90-K92 PolarHBondContact O-N 3.01Å; N90-N93 PolarHBondContact O-N 3.16Å; N90-Y94 WeakPolarHBondContact O-CD2 3.37Å; N90-Y94 PolarHBondContact O-N 2.86Å
91Y58.6Low63.1Low168 Ų168112.4 Ų112.466%0.65955%0.548SS*.Hα-helixtrans-59.1-43.9173.1179-100.1000111.8A87 L88 N93 Y94 S95A87-Y91 WeakPolarHBondContact O-CB 3.42Å; A87-Y91 PolarHBondContact O-N 2.96Å; L88-Y91 PolarHBondContact O-N 3.5Å; Y91-N93 VanDerWaalsContact C-N 3.35Å; Y91-N93 PolarHBondContact O-N 3.32Å; Y91-Y94 PolarHBondContact O-N 3.47Å; Y91-S95 WeakPolarHBondContact O-CB 3.42Å; Y91-S95 PolarHBondContact O-N 2.9Å
92K66.1Low62.9Low150 Ų150109 Ų10965%0.65254%0.544SS*.Hα-helixtrans-62.7-39.9174.2-71.2179.2179.5-172.40112.2L88 Q89 N90 S95 L96L88-K92 WeakPolarHBondContact O-CG 3.42Å; L88-K92 PolarHBondContact O-N 3.16Å; Q89-K92 PolarHBondContact O-N 3.38Å; N90-K92 VanDerWaalsContact C-N 3.33Å; N90-K92 PolarHBondContact O-N 3.01Å; K92-S95 PolarHBondContact O-N 2.86Å; K92-L96 WeakPolarHBondContact O-CB 3.46Å; K92-L96 PolarHBondContact O-N 2.99Å
93N67.6Low62.4Low100 Ų100106.2 Ų106.254%0.53553%0.534SS..Hα-helixtrans-65.5-42.9175.8-85.6-69.4000112.6Q89 N90 Y91 S95 L96 L97Q89-N93 PolarHBondContact O-N 2.96Å; Q89-N93 PolarHBondContact O-ND2 2.72Å; N90-N93 PolarHBondContact O-N 3.16Å; Y91-N93 VanDerWaalsContact C-N 3.35Å; Y91-N93 PolarHBondContact O-N 3.32Å; N93-S95 VanDerWaalsContact C-N 3.35Å; N93-L96 PolarHBondContact O-N 3.31Å; N93-L97 VanDerWaalsContact O-CB 3.25Å; N93-L97 WeakPolarHBondContact O-CB 3.42Å; N93-L97 PolarHBondContact O-N 3.49Å
94Y57.9Low61.8Low180 Ų180107.3 Ų107.371%0.70654%0.541SS*.Hα-helixtrans-65.8-37.1175.6-80.2-70000112.4N90 Y91 N98N90-Y94 WeakPolarHBondContact O-CD2 3.37Å; N90-Y94 PolarHBondContact O-N 2.86Å; Y91-Y94 PolarHBondContact O-N 3.47Å; Y94-N98 VanDerWaalsContact O-CB 3.24Å; Y94-N98 WeakPolarHBondContact O-CB 3.48Å; Y94-N98 PolarHBondContact O-N 3.12Å
95S69.3Low60.8Low58 Ų58103.4 Ų103.441%0.40654%0.539SS..Hα-helixtrans-63.2-45.8174.5-166.50000111.7Y91 K92 N93 N98 E99Y91-S95 WeakPolarHBondContact O-CB 3.42Å; Y91-S95 PolarHBondContact O-N 2.9Å; K92-S95 PolarHBondContact O-N 2.86Å; N93-S95 VanDerWaalsContact C-N 3.35Å; S95-N98 PolarHBondContact O-N 3.19Å; S95-E99 PolarHBondContact O-N 2.83Å
96L66.8Low59.8Low105 Ų105104.7 Ų104.755%0.5554%0.54SS..Hα-helixtrans-68.8-37.5179.9-148.4169.4000111.3K92 N93 E99 L100K92-L96 WeakPolarHBondContact O-CB 3.46Å; K92-L96 PolarHBondContact O-N 2.99Å; N93-L96 PolarHBondContact O-N 3.31Å; L96-E99 PolarHBondContact O-N 3.07Å; L96-L100 WeakPolarHBondContact O-CB 3.36Å; L96-L100 PolarHBondContact O-N 2.77Å
97L64.8Low58.7Low109 Ų109108.4 Ų108.457%0.57156%0.557SS**Hα-helixtrans-69.6-34.1176.7-154137.6000111.7N93 L100 E101N93-L97 VanDerWaalsContact O-CB 3.25Å; N93-L97 WeakPolarHBondContact O-CB 3.42Å; N93-L97 PolarHBondContact O-N 3.49Å; L97-L100 PolarHBondContact O-N 3.31Å; L97-E101 VanDerWaalsContact O-CB 3.28Å; L97-E101 WeakPolarHBondContact O-CB 3.41Å; L97-E101 PolarHBondContact O-N 3.12Å
98N62.2Low57.7Low108 Ų108113.8 Ų113.858%0.57858%0.578SS**Hα-helixtrans-69.9-36.2173.3-172.280.5000112.3Y94 S95 A102Y94-N98 VanDerWaalsContact O-CB 3.24Å; Y94-N98 WeakPolarHBondContact O-CB 3.48Å; Y94-N98 PolarHBondContact O-N 3.12Å; S95-N98 PolarHBondContact O-N 3.19Å; N98-A102 VanDerWaalsContact O-CB 3.28Å; N98-A102 WeakPolarHBondContact O-CB 3.32Å; N98-A102 PolarHBondContact O-N 2.8Å
99E65.7Low56.9Low132 Ų132118.6 Ų118.662%0.61759%0.588SS**Hα-helixtrans-68.1-36.9170.3-78.1-175.2157.700112.4S95 L96 S103S95-E99 PolarHBondContact O-N 2.83Å; L96-E99 PolarHBondContact O-N 3.07Å; E99-S103 PolarHBondContact O-N 3.18Å; E99-S103 PolarHBondContact O-OG 2.83Å
100L61.8Low55.6Low105 Ų105119.5 Ų119.555%0.5559%0.592SS.*Hα-helixtrans-71-37.9176.9-161.968.9000112L96 L97 S103 Q104L96-L100 WeakPolarHBondContact O-CB 3.36Å; L96-L100 PolarHBondContact O-N 2.77Å; L97-L100 PolarHBondContact O-N 3.31Å; L100-S103 VanDerWaalsContact CA-OG 3.25Å; L100-S103 WeakPolarHBondContact CA-OG 3.42Å; L100-S103 PolarHBondContact O-N 3.1Å; L100-S103 PolarHBondContact O-OG 2.82Å; L100-Q104 VanDerWaalsContact O-CB 3.28Å; L100-Q104 WeakPolarHBondContact O-CB 3.35Å; L100-Q104 PolarHBondContact O-N 3.41Å
101E58.5Low54.5Low114 Ų114121 Ų12153%0.53361%0.609SS.*Hα-helixtrans-70-36.6175.2-165.4173.6-178.900111.4L97 Q104 C105L97-E101 VanDerWaalsContact O-CB 3.28Å; L97-E101 WeakPolarHBondContact O-CB 3.41Å; L97-E101 PolarHBondContact O-N 3.12Å; E101-Q104 PolarHBondContact O-N 3.2Å; E101-C105 PolarHBondContact O-N 2.97Å; E101-C105 PolarHBondContact O-SG 3.44Å
102A55.4Low53.7Low60 Ų60124 Ų12450%0.49662%0.621SS.*Hα-helixtrans-64-41171.700000112.2N98 E106N98-A102 VanDerWaalsContact O-CB 3.28Å; N98-A102 WeakPolarHBondContact O-CB 3.32Å; N98-A102 PolarHBondContact O-N 2.8Å; A102-E106 PolarHBondContact O-N 2.89Å
103S55.2Low52.3Low49 Ų49119.9 Ų119.934%0.34362%0.62SS.*Hα-helixtrans-74.5-28.9176.445.20000113.2E99 L100 C105 E106 N107E99-S103 PolarHBondContact O-N 3.18Å; E99-S103 PolarHBondContact O-OG 2.83Å; L100-S103 VanDerWaalsContact CA-OG 3.25Å; L100-S103 WeakPolarHBondContact CA-OG 3.42Å; L100-S103 PolarHBondContact O-N 3.1Å; L100-S103 PolarHBondContact O-OG 2.82Å; S103-C105 VanDerWaalsContact C-N 3.33Å; S103-E106 PolarHBondContact O-N 3.05Å; S103-N107 PolarHBondContact O-N 3.32Å; S103-N107 PolarHBondContact O-ND2 3.42Å
104Q50.9Low51Low143 Ų143123.1 Ų123.167%0.66864%0.637SS**Hα-helixtrans-72.3-26.5175.6-162.6168.674.500112.6L100 E101L100-Q104 VanDerWaalsContact O-CB 3.28Å; L100-Q104 WeakPolarHBondContact O-CB 3.35Å; L100-Q104 PolarHBondContact O-N 3.41Å; E101-Q104 PolarHBondContact O-N 3.2Å
105C38.4Very low50.1Low91 Ų91119.3 Ų119.362%0.61564%0.636SS**Hα-helixtrans-76.5-26.8173-67.20000113.6E101 S103E101-C105 PolarHBondContact O-N 2.97Å; E101-C105 PolarHBondContact O-SG 3.44Å; S103-C105 VanDerWaalsContact C-N 3.33Å
106E44.3Very low48.3Very low109 Ų109126.5 Ų126.551%0.50966%0.656SS.*Hα-helixtrans-75.2-35174-74.6-64.2139.100112A102 S103 L108 R109A102-E106 PolarHBondContact O-N 2.89Å; S103-E106 PolarHBondContact O-N 3.05Å; E106-L108 PolarHBondContact O-N 3.01Å; E106-L108 VanDerWaalsContact O-N 3.16Å; E106-R109 PolarHBondContact O-N 2.87Å; E106-R109 VanDerWaalsContact O-N 3.09Å
107N41.3Very low47.3Very low134 Ų134126.7 Ų126.772%0.71767%0.673SS**THydrogen-bonded Turntrans-68.9-13.7-176.8-85.7-85.6000115.2S103S103-N107 PolarHBondContact O-N 3.32Å; S103-N107 PolarHBondContact O-ND2 3.42Å
108L40.4Very low46.2Very low169 Ų169129 Ų12989%0.88568%0.681SS**THydrogen-bonded Turntrans-91.9-8174.8-152.178.5000112.9E106E106-L108 PolarHBondContact O-N 3.01Å; E106-L108 VanDerWaalsContact O-N 3.16Å
109R44.8Very low45.2Very low216 Ų216131.9 Ų131.982%0.81570%0.695SS**THydrogen-bonded Turntrans-102.7-14.4-175.4-156.5176.4-177.3-167-2.1114.4E106E106-R109 PolarHBondContact O-N 2.87Å; E106-R109 VanDerWaalsContact O-N 3.09Å
110E34.4Very low43.8Very low132 Ų132134 Ų13462%0.61771%0.705SS**  trans-12469.1-172.8-66.5-169156.300112.6
111S41.2Very low42.5Very low110 Ų110136.6 Ų136.677%0.76971%0.714SS**SBendtrans-8719.8159.6-176.30000112.4
112Y41.6Very low41.5Very low231 Ų231136.8 Ų136.891%0.90672%0.724SS**SBendtrans-162104.4167.1-87-77.5000109
113G36.9Very low40.9Very low62 Ų62145.1 Ų145.164%0.63974%0.742SS**  trans165.787.8173.400000113.2
114L39.6Very low40Very low168 Ų168149.4 Ų149.488%0.8877%0.766SS**  trans-71.9136.5-179.1-72.3161.9000112.9
115S38Very low39.6Very low100 Ų100149.8 Ų149.870%0.69977%0.772SS**  trans40.3117139.967.40000120.1
116Y33.4Very low39.7Very low209 Ų209151.2 Ų151.282%0.8278%0.783SS**  -166.1102.1125.8-127.7-94.1000110.3E118Y116-E118 WeakPolarHBondContact CE1-O 3.45Å
117A44.8Very low39.8Very low109 Ų109152 Ų15290%0.90180%0.795SS**  trans-126.464.2169.600000108.5
118E41.7Very low39.4Very low159 Ų159153.4 Ų153.474%0.74380%0.802SS**  trans-161.4105.1170.6-163162.8-170.200109.1Y116Y116-E118 WeakPolarHBondContact CE1-O 3.45Å
119L40.5Very low39.3Very low168 Ų168150.1 Ų150.188%0.8879%0.793SS**  trans-169109.9140.8-93.3-174.5000107.5
120Q37.2Very low39.4Very low176 Ų176145.7 Ų145.782%0.82279%0.792SS**  trans-78.3153.6170.7-83-171.2-16.700111.3
121E34.2Very low39.4Very low160 Ų160147.7 Ų147.775%0.74880%0.802SS**  trans92.1118.6146.1-80.4179.4174.600122.6
122T37.2Very low39.2Very low118 Ų118150.2 Ų150.272%0.72481%0.806SS**  trans82.4112.7136.351.40000122.9
123R42.1Very low39Very low235 Ų235145.3 Ų145.389%0.88781%0.805SS**  trans50.9128.1144.6-57.4-177178158.30.5117.7
124V37.4Very low39Very low138 Ų138152.2 Ų152.284%0.83681%0.812SS**  -173.3159.768.3-78.20000110.8
125D42.6Very low38.6Very low151 Ų151154.7 Ų154.781%0.80781%0.811SS**  trans-43.5138.7170.3-106.4-42000115.1
126S40.3Very low38.2Very low121 Ų121162 Ų16285%0.84682%0.823SS**  trans-162112.3149.4-84.10000111.7
127V45.6Very low38.2Very low125 Ų125156.5 Ų156.576%0.75882%0.821SS**  trans-62.4135.5163.4-174.90000109
128L33.4Very low37.6Very low165 Ų165156.2 Ų156.286%0.86482%0.819SS**  trans154.7122.7140.5-80.2159.5000112.6
129S38.8Very low37Very low99 Ų99153.5 Ų153.569%0.69282%0.824SS**  trans-73.8153.1158.1-174.60000109.5
130P45.5Very low36.6Very low123 Ų123150.5 Ų150.580%0.79982%0.823SS**  -152.9155.1108.227.7-5.4000118.1
131E35.3Very low36.4Very low174 Ų174146.6 Ų146.681%0.81382%0.821SS**  trans-57133.7167.3-71.8151.9112.900114.7
132L37.7Very low36.7Very low163 Ų163144.9 Ų144.985%0.85382%0.824SS**  trans-174.6105.5149-118.3140.9000111.8
133S36.5Very low36.6Very low129 Ų129143.3 Ų143.390%0.90282%0.822SS**  trans-166.844.3154.1-85.20000113.2
134R36.3Very low36.1Very low207 Ų207139.2 Ų139.278%0.78182%0.818SS**  trans-79.6147.3152.3-85.2-167.5-81.2-144.3-3.9108.4
135Y32.4Very low36.1Very low220 Ų220144.7 Ų144.786%0.86382%0.824SS**  trans91.185.6174.8-47.9-70.6000117
136R30Very low35.5Very low253 Ų253146 Ų14696%0.95583%0.825SS**  trans-137.9131130.4-168.1172.9-83.3-176.1-4.8110.3
137A32.2Very low35Very low94 Ų94146.7 Ų146.778%0.77782%0.82SS**  trans-88.3165-15700000115.4
138A32.1Very low34.3Very low102 Ų102145.5 Ų145.584%0.84382%0.817SS**  trans-34.6147.516000000117.1
139A29.7Very low34.3Very low103 Ų103145.9 Ų145.985%0.85181%0.814SS**  trans-166.1149.2140.800000111.9
140A32.3Very low34Very low104 Ų104150.2 Ų150.286%0.8682%0.823SS**  trans103.995.3157.300000118.9
141A32.9Very low33.6Very low95 Ų95151.9 Ų151.979%0.78583%0.826SS**  trans-81.7167.314500000109.5
142P40Very low34.1Very low124 Ų124148.6 Ų148.681%0.80583%0.828SS**  -157.9174.580.140.4-19000118.6
143A34.4Very low34.2Very low84 Ų84149.4 Ų149.469%0.69483%0.825SS**  trans84.8117.713900000124.2
144D32Very low34.6Very low150 Ų150151.6 Ų151.680%0.80282%0.823SS**  trans48.3121.4132.6-56.6-26.6000123.1
145R37.9Very low34.6Very low252 Ų252149.6 Ų149.695%0.95182%0.822SS**  -175.5152.5114.3-104.5-177.4158.689.41.9114.2
146E30.8Very low34.7Very low178 Ų178146.4 Ų146.483%0.83282%0.82SS**  trans-89.6159.2-165-145.8-164.2-177.200114.5
147D28.8Very low35Very low137 Ų137137.4 Ų137.473%0.73381%0.806SS**  trans89147.5137.7-145.319.6000123.3
148S31.5Very low35.7Very low99 Ų99139 Ų13969%0.69281%0.811SS**  trans95.181.8162.6-57.60000120.1
149Q32.8Very low36Very low173 Ų173139.6 Ų139.681%0.80881%0.81SS**  -4.5130.6126.1-176.3170.124.200118.7
150E33.5Very low36.6Very low190 Ų190137.9 Ų137.989%0.88880%0.802SS**  -177.1135.5121.652.2-165.5150.900113.9
151D36.3Very low36.8Very low159 Ų159143 Ų14385%0.8581%0.805SS**  trans-71.6139.7178.5-77.5-63.1000112.7
152A45.6Very low37.5Very low104 Ų104145.5 Ų145.586%0.8681%0.805SS**  trans-142.783.4154.700000110.6
153K40.5Very low37.5Very low181 Ų181148.3 Ų148.379%0.78781%0.81SS**  trans-54.7124.3155177-179-178179.20109.2
154M43.8Very low38.1Very low175 Ų175155.2 Ų155.286%0.86282%0.818SS**  trans-157.8112.1133.4-82.4-38.8-132.900111.4
155E36.2Very low38.4Very low165 Ų165153.2 Ų153.277%0.77182%0.816SS**  trans-43.3147.6151.7-176.7-157.8-17700112.8
156N35.3Very low38.5Very low152 Ų152150.6 Ų150.681%0.81381%0.807SS**  142.5137.2124.3-164.538000113.6
157G35.3Very low38.9Very low64 Ų64148.5 Ų148.566%0.6680%0.801SS**  trans115.473.2148.600000117
158S47.9Very low39Very low127 Ų127150.1 Ų150.189%0.88880%0.804SS**  trans-81.8128.8154-176.30000110
159S38.6Very low38.9Very low116 Ų116154.8 Ų154.881%0.81181%0.808SS**  trans-164.7129.9149.763.60000107.1
160G41.3Very low39Very low67 Ų67154.7 Ų154.769%0.69181%0.807SS**  cis99.184.227.600000109
161F36.7Very low39.1Very low212 Ų212149.6 Ų149.693%0.9379%0.793SS**  trans-175.4135.6138-125.7-100000113.3
162D49.2Very low39.2Very low147 Ų147148.4 Ų148.479%0.78679%0.791SS**  trans-64.5149.6167-76.6-62.1000112.6
163M38.4Very low38.8Very low182 Ų182149.4 Ų149.490%0.89779%0.792SS**  trans-148.196.1158.6-157.992.8147.900110.2
164R47.9Very low39.2Very low229 Ų229144.8 Ų144.886%0.86480%0.796SS**  trans-97.3115.3170.9-167.1-177.8-178.1-149.50.9107.5
165S38.6Very low39.2Very low109 Ų109142.2 Ų142.276%0.76280%0.796SS**  trans-113141.3174.5-79.50000112.5
166Y39.2Very low39.7Very low196 Ų196142.4 Ų142.477%0.76980%0.801SS**  trans-82.7153.8-163.6-101.2-117000115
167L39.2Very low39.9Very low135 Ų135138.4 Ų138.471%0.70780%0.796SS**  trans68.6115149.1-67.6168000121.8
168H31.9Very low40.3Very low170 Ų170143 Ų14379%0.78781%0.805SS**  trans-138.7106.2131.5-15075.6000109.3
169Y29.2Very low40.1Very low197 Ų197144.5 Ų144.577%0.77380%0.801SS**  trans-98.6119.8172.5-136.7-92.2000107.2
170Q35.4Very low40.5Very low171 Ų171144 Ų14480%0.79980%0.798SS**  trans-143.2107.2162.7-145.3177.49900107
171S35Very low40.8Very low83 Ų83147.3 Ų147.358%0.5881%0.805SS**  trans-91.2132.4175.8-66.70000109.4
172T38.3Very low41Very low134 Ų134141.5 Ų141.582%0.82280%0.796SS**  trans178.3147.7133.941.70000110.8
173S38Very low40.7Very low125 Ų125139.9 Ų139.987%0.87480%0.796SS**SBendtrans84.6124.617180.70000117.1
174G47.4Very low40.8Very low85 Ų85136.1 Ų136.188%0.87679%0.788SS**  trans-70.5143.6-163.100000114.9
175S43.4Very low40.8Very low121 Ų121132.9 Ų132.985%0.84679%0.788SS**  trans-140.1121.2160.2-173.50000107.9
176L46.8Very low41Very low169 Ų169132.4 Ų132.489%0.88578%0.783SS**  trans-52.5136.2-176.9-64.3160.6000110.9
177G40.5Very low41.1Very low68 Ų68128.7 Ų128.770%0.70179%0.786SS**  trans-58.8136.2177.700000112I179G177-I179 PolarHBondContact O-N 3.06Å
178N43.5Very low41.3Very low160 Ų160127 Ų12786%0.85679%0.786SS**  trans-62.4100164.2-93.5-9.1000109.4S180N178-S180 VanDerWaalsContact C-N 3.32Å; N178-S180 PolarHBondContact O-N 3.23Å
179I43.3Very low42.5Very low159 Ų159124.5 Ų124.582%0.81578%0.784SS**  trans-84.878.515847.9158.4000109G177G177-I179 PolarHBondContact O-N 3.06Å
180S46.8Very low43.7Very low106 Ų106120.8 Ų120.874%0.74178%0.784SS**  trans-100.771.8162-68.70000108.9N178N178-S180 VanDerWaalsContact C-N 3.32Å; N178-S180 PolarHBondContact O-N 3.23Å
181T48.4Very low44.3Very low135 Ų135116.6 Ų116.683%0.82879%0.787SS**  trans-105.974156.848.50000107.6
182A40.2Very low44.9Very low90 Ų90118.6 Ų118.674%0.74480%0.796SS**  trans-103.9107.8161.800000107.5S184A182-S184 PolarHBondContact O-N 3.24Å; A182-S184 VanDerWaalsContact O-N 3.15Å
183S42.4Very low45.3Very low114 Ų114118.5 Ų118.580%0.79780%0.798SS**  trans-47.4108.5174.2-24.60000110.6
184S41.9Very low45.6Very low103 Ų103117 Ų11772%0.7279%0.792SS**  trans-101.6107.7156.8-64.40000106.4A182 C186A182-S184 PolarHBondContact O-N 3.24Å; A182-S184 VanDerWaalsContact O-N 3.15Å; S184-C186 PolarHBondContact O-N 3.26Å
185N46.9Very low45.6Very low161 Ų161118.8 Ų118.886%0.86179%0.789SS**  trans-65.881.5162.8-8542.6000108.1
186C43.3Very low46.1Very low98 Ų98119.2 Ų119.266%0.66279%0.792SS**  trans-105.497.2154.770.30000107.4S184 S188S184-C186 PolarHBondContact O-N 3.26Å; C186-S188 VanDerWaalsContact C-N 3.26Å; C186-S188 PolarHBondContact O-N 2.85Å
187S41.5Very low45.8Very low119 Ų119114.5 Ų114.583%0.83278%0.784SS**  trans-69.589.3168.7-57.30000108.3
188S43.7Very low46.3Very low100 Ų100119.5 Ų119.570%0.69979%0.794SS**PPolyproline II helixtrans-91.5126.5155.5-65.70000107.2C186C186-S188 VanDerWaalsContact C-N 3.26Å; C186-S188 PolarHBondContact O-N 2.85Å
189P57Low46Very low116 Ų116115.2 Ų115.275%0.75379%0.789SS**PPolyproline II helixtrans-68.7146.4177.428.4-31.8000110.1
190P52.8Low46.2Very low119 Ų119119.7 Ų119.777%0.77380%0.795SS**PPolyproline II helixtrans-67.8151.2175.530.3-32.8000110.1T192P190-T192 PolarHBondContact O-N 3.4Å
191G49.2Very low45.9Very low84 Ų84120 Ų12087%0.86680%0.797SS**  trans-45.9131.4-165.600000116.4
192T47.2Very low45.7Very low125 Ų125119 Ų11977%0.76779%0.793SS**  trans-117.2141155.950.50000107.9P190 A194P190-T192 PolarHBondContact O-N 3.4Å; T192-A194 PolarHBondContact O-N 3.01Å
193P47.6Very low45.8Very low132 Ų132120.2 Ų120.286%0.85780%0.796SS**PPolyproline II helixtrans-68.9117.9178.528.1-31.7000109
194A43.2Very low46.2Very low92 Ų92123.5 Ų123.576%0.7680%0.799SS**PPolyproline II helixtrans-72.4137.3177.900000110.9T192T192-A194 PolarHBondContact O-N 3.01Å
195P48.6Very low46.2Very low123 Ų123122 Ų12280%0.79980%0.8SS**PPolyproline II helixtrans-76.1142.9173.131.3-32000110.9G197P195-G197 PolarHBondContact O-N 3.5Å
196S53.3Low45.8Very low131 Ų131117.7 Ų117.792%0.91679%0.793SS**PPolyproline II helixtrans-54.1116.7174.7-64.90000111.8
197G40.1Very low46.3Very low69 Ų69123.3 Ų123.371%0.71181%0.806SS**  trans-133.8108.417400000110.8P195 G199P195-G197 PolarHBondContact O-N 3.5Å; G197-G199 PolarHBondContact O-N 3.02Å
198N51.6Low46.6Very low173 Ų173123 Ų12393%0.92580%0.804SS**  trans-63.299.3174.5-75.59000111.1
199G36Very low47Very low71 Ų71124.2 Ų124.273%0.73281%0.813SS**  trans-107.389.317100000111.7G197 S201G197-G199 PolarHBondContact O-N 3.02Å; G199-S201 PolarHBondContact O-N 3.44Å
200R48.8Very low46.7Very low253 Ų253122 Ų12296%0.95580%0.8SS**  trans-70.5115166.8-81.6176.7157.7-152.1-3109.2
201S40.6Very low46.4Very low111 Ų111119.2 Ų119.278%0.77679%0.793SS**  trans-93.7145.6160.1-68.60000109.9G199 S203G199-S201 PolarHBondContact O-N 3.44Å; S201-S203 PolarHBondContact O-N 3.44Å
202P44.8Very low46.7Very low116 Ų116126 Ų12675%0.75380%0.798SS**  trans-75.1113.8-173.230.6-31.7000110.2H204P202-H204 PolarHBondContact O-N 3.39Å; P202-H204 VanDerWaalsContact O-N 3.1Å
203S42.2Very low46.8Very low115 Ų115123.6 Ų123.680%0.80479%0.786SS**  trans-72.395.1169.3160.90000109.2S201 G205S201-S203 PolarHBondContact O-N 3.44Å; S203-G205 PolarHBondContact O-N 3.1Å
204H48.9Very low47.4Very low183 Ų183127.6 Ų127.685%0.84779%0.79SS**  trans-66.6110155.8-88.2-58.4000108.5P202 G206P202-H204 PolarHBondContact O-N 3.39Å; P202-H204 VanDerWaalsContact O-N 3.1Å; H204-G206 PolarHBondContact O-N 3.06Å; H204-G206 VanDerWaalsContact O-N 3.14Å
205G41.9Very low48.3Very low72 Ų72129.7 Ų129.774%0.74278%0.782SS**  trans-61.8109.8174.700000111.5S203S203-G205 PolarHBondContact O-N 3.1Å
206G40.1Very low49Very low70 Ų70135.6 Ų135.672%0.72279%0.789SS**  trans-111.795.4154.200000107.8H204 S208H204-G206 PolarHBondContact O-N 3.06Å; H204-G206 VanDerWaalsContact O-N 3.14Å; G206-S208 PolarHBondContact O-N 3.33Å
207K53.7Low49.6Very low216 Ų216133 Ų13394%0.93976%0.764SS**  trans-62.5102.8173.4-60.5172.7179.7178.10108.3
208S47.1Very low51.5Low113 Ų113135.1 Ų135.179%0.7976%0.759SS**  trans-145.1108.6149.960.50000108.8G206 S210G206-S208 PolarHBondContact O-N 3.33Å; S208-S210 PolarHBondContact O-N 3.29Å
209S53.4Low53.1Low125 Ų125134 Ų13487%0.87475%0.746SS**  trans-59.5113.6172.650.20000110.8
210S49.5Very low55.5Low69 Ų69137.4 Ų137.448%0.48375%0.747SS.*  trans-165.3102.9141.4-176.40000108.6S208 K215S208-S210 PolarHBondContact O-N 3.29Å; S210-K215 WeakPolarHBondContact OG-CE 3.33Å; S210-K215 PolarHBondContact OG-NZ 3.49Å
211G46.8Very low57.7Low61 Ų61126.9 Ų126.963%0.62971%0.713SS**  trans-48.4147.4170.200000111.9S213G211-S213 PolarHBondContact O-N 3.46Å; G211-S213 PolarHBondContact O-OG 3Å
212K54.9Low60.1Low226 Ų226128.2 Ų128.298%0.98371%0.707SS**SBendtrans-4884.8170.2-73.1162.8176.7166.60110.7
213S50.7Low62.5Low74 Ų74127 Ų12752%0.51769%0.691SS.*  trans-122.3135.1156.740.60000103.9G211 K215G211-S213 PolarHBondContact O-N 3.46Å; G211-S213 PolarHBondContact O-OG 3Å; S213-K215 PolarHBondContact O-N 3.24Å
214K59.7Low65Low216 Ų216125.1 Ų125.194%0.93967%0.667SS**  trans-66.868.1-179.9-165172.1-176.5169.30108.3R216K214-R216 PolarHBondContact O-N 2.94Å
215K61.5Low67.2Low137 Ų137125 Ų12560%0.59666%0.659SS**  trans-62112.3174.9-75.8-177176.1173.30105S210 S213 L217S210-K215 WeakPolarHBondContact OG-CE 3.33Å; S210-K215 PolarHBondContact OG-NZ 3.49Å; S213-K215 PolarHBondContact O-N 3.24Å; K215-L217 PolarHBondContact O-N 2.83Å
216R63.8Low69.8Low247 Ų247124.3 Ų124.393%0.93264%0.638SS**  trans-56.5100.8165.2-74.1-166.2166.3-128.40.5105.5K214 D218K214-R216 PolarHBondContact O-N 2.94Å; R216-D218 PolarHBondContact O-N 3.12Å
217L66.4Low72.5Confident77 Ų77126.7 Ų126.740%0.40363%0.625SS.*  trans-60127.3173-70.4168.7000106.3K215 K219 R227K215-L217 PolarHBondContact O-N 2.83Å; L217-K219 PolarHBondContact O-N 3.03Å; L217-R227 VanDerWaalsContact CD1-NH1 3.33Å
218D79.8Confident74.6Confident112 Ų112121.4 Ų121.460%0.59960%0.599SS**  trans-60.5129.4174.8-170.22.8000108.9R216 D220 S221R216-D218 PolarHBondContact O-N 3.12Å; D218-D220 PolarHBondContact O-N 2.97Å; D218-S221 WeakPolarHBondContact O-CB 3.43Å; D218-S221 PolarHBondContact O-N 2.85Å; D218-S221 PolarHBondContact O-OG 2.92Å
219K85.4Confident77Confident149 Ų149121.2 Ų121.265%0.64859%0.586SS**THydrogen-bonded Turntrans-66.6-25.4-171.1-76176.2169.4-127.90112.1L217 Y224L217-K219 PolarHBondContact O-N 3.03Å; K219-Y224 WeakPolarHBondContact O-CD1 3.19Å
220D86.3Confident79.1Confident143 Ų143122.4 Ų122.477%0.76557%0.571SS**THydrogen-bonded Turntrans-94.51.9-178.5-59.6-37.4000112.7D218D218-D220 PolarHBondContact O-N 2.97Å
221S93.4Very high81.5Confident32 Ų32122.7 Ų122.722%0.22457%0.567CS.*  trans-65.3139173.864.70000111.8D218 E223 Y224 R225D218-S221 WeakPolarHBondContact O-CB 3.43Å; D218-S221 PolarHBondContact O-N 2.85Å; D218-S221 PolarHBondContact O-OG 2.92Å; S221-E223 VanDerWaalsContact C-N 3.26Å; S221-E223 PolarHBondContact O-N 3.3Å; S221-Y224 WeakPolarHBondContact O-CB 3.31Å; S221-Y224 PolarHBondContact O-N 3.11Å; S221-Y224 VanDerWaalsContact O-N 3.08Å; S221-Y224 WeakPolarHBondContact OG-CB 3.41Å; S221-Y224 PolarHBondContact OG-N 3.03Å; S221-R225 PolarHBondContact O-N 2.89Å; S221-R225 VanDerWaalsContact O-N 3.09Å
222E92.5Very high83.9Confident140 Ų140123.2 Ų123.265%0.65456%0.556SS**Hα-helixtrans-59.6-38.1177.6-177.4-100.4-170.200111.7Y224 R225 L226E222-Y224 PolarHBondContact O-N 3.45Å; E222-R225 PolarHBondContact O-N 2.82Å; E222-L226 PolarHBondContact O-N 2.91Å; E222-L226 WeakPolarHBondContact OE1-CD1 3.41Å
223E93.8Very high86Confident91 Ų91116.8 Ų116.843%0.42553%0.531SS..Hα-helixtrans-58-44.6172.6-174.3-173.1-170.700112.5S221 R227S221-E223 VanDerWaalsContact C-N 3.26Å; S221-E223 PolarHBondContact O-N 3.3Å; E223-R227 WeakPolarHBondContact O-CG 3.47Å; E223-R227 PolarHBondContact O-N 3.45Å; E223-R227 IonicContact OE1-CZ 2.84Å; E223-R227 IonicContact OE1-NE 2.66Å; E223-R227 IonicContact OE1-NH1 3.14Å; E223-R227 PolarHBondContact OE1-NH1 3.14Å; E223-R227 IonicContact OE1-NH2 3.3Å; E223-R227 PolarHBondContact OE1-NH2 3.38Å
224Y95.5Very high88.3Confident74 Ų74115.8 Ų115.829%0.2953%0.528SS..Hα-helixtrans-63.2-46176.9177-95.9000111K219 S221 E222 L226 R227 R228K219-Y224 WeakPolarHBondContact O-CD1 3.19Å; S221-Y224 WeakPolarHBondContact O-CB 3.31Å; S221-Y224 PolarHBondContact O-N 3.11Å; S221-Y224 VanDerWaalsContact O-N 3.08Å; S221-Y224 WeakPolarHBondContact OG-CB 3.41Å; S221-Y224 PolarHBondContact OG-N 3.03Å; E222-Y224 PolarHBondContact O-N 3.45Å; Y224-L226 PolarHBondContact O-N 2.98Å; Y224-R227 PolarHBondContact O-N 3.28Å; Y224-R228 HydrophobicContact CD1-CG 3.93Å; Y224-R228 HydrophobicContact CD2-CG 4.31Å; Y224-R228 HydrophobicContact CE1-CG 3.49Å; Y224-R228 VanDerWaalsContact CE1-CG 3.49Å; Y224-R228 HydrophobicContact CE2-CG 3.91Å; Y224-R228 HydrophobicContact CG-CG 4.33Å; Y224-R228 VanDerWaalsContact CZ-CG 3.48Å; Y224-R228 WeakPolarHBondContact O-CG 3.44Å; Y224-R228 PolarHBondContact O-N 2.84Å
225R95.3Very high90.1Very high181 Ų181108.7 Ų108.768%0.68350%0.502SS*.Hα-helixtrans-56.3-50.7177.4-78.3-17858.3140.4-1.8112S221 E222 R227 R228 E229S221-R225 PolarHBondContact O-N 2.89Å; S221-R225 VanDerWaalsContact O-N 3.09Å; E222-R225 PolarHBondContact O-N 2.82Å; R225-R227 VanDerWaalsContact C-N 3.32Å; R225-R227 PolarHBondContact O-N 3.4Å; R225-R228 PolarHBondContact O-N 3.47Å; R225-R228 VanDerWaalsContact O-N 3.16Å; R225-E229 WeakPolarHBondContact O-CB 3.49Å; R225-E229 PolarHBondContact O-N 3.31Å
226L95.8Very high91.9Very high58 Ų58109.2 Ų109.230%0.30450%0.501SS..Hα-helixtrans-61.8-38.6178.9-71175.2000112.2E222 Y224 R230E222-L226 PolarHBondContact O-N 2.91Å; E222-L226 WeakPolarHBondContact OE1-CD1 3.41Å; Y224-L226 PolarHBondContact O-N 2.98Å; L226-R230 WeakPolarHBondContact O-CG 3.3Å; L226-R230 PolarHBondContact O-N 3.17Å; L226-R230 PolarHBondContact O-NH1 3.39Å
227R96.8Very high93.6Very high119 Ų119105.2 Ų105.245%0.44949%0.49SS..Hα-helixtrans-64.3-42.6175-76.3176.2174.9172.31.9111.9L217 E223 Y224 R225 N231L217-R227 VanDerWaalsContact CD1-NH1 3.33Å; E223-R227 WeakPolarHBondContact O-CG 3.47Å; E223-R227 PolarHBondContact O-N 3.45Å; E223-R227 IonicContact OE1-CZ 2.84Å; E223-R227 IonicContact OE1-NE 2.66Å; E223-R227 IonicContact OE1-NH1 3.14Å; E223-R227 PolarHBondContact OE1-NH1 3.14Å; E223-R227 IonicContact OE1-NH2 3.3Å; E223-R227 PolarHBondContact OE1-NH2 3.38Å; Y224-R227 PolarHBondContact O-N 3.28Å; R225-R227 VanDerWaalsContact C-N 3.32Å; R225-R227 PolarHBondContact O-N 3.4Å; R227-N231 WeakPolarHBondContact O-CB 3.42Å; R227-N231 PolarHBondContact O-N 2.99Å
228R97.8Very high95.1Very high106 Ų106105.3 Ų105.340%0.450%0.497SS..Hα-helixtrans-67.1-41.8177.7-68.6-58.2-63.1157.52.1111.8Y224 R225 N231 N232Y224-R228 HydrophobicContact CD1-CG 3.93Å; Y224-R228 HydrophobicContact CD2-CG 4.31Å; Y224-R228 HydrophobicContact CE1-CG 3.49Å; Y224-R228 VanDerWaalsContact CE1-CG 3.49Å; Y224-R228 HydrophobicContact CE2-CG 3.91Å; Y224-R228 HydrophobicContact CG-CG 4.33Å; Y224-R228 VanDerWaalsContact CZ-CG 3.48Å; Y224-R228 WeakPolarHBondContact O-CG 3.44Å; Y224-R228 PolarHBondContact O-N 2.84Å; R225-R228 PolarHBondContact O-N 3.47Å; R225-R228 VanDerWaalsContact O-N 3.16Å; R228-N231 PolarHBondContact NH1-OD1 3.24Å; R228-N231 PolarHBondContact O-N 3.14Å; R228-N232 WeakPolarHBondContact O-CB 3.44Å; R228-N232 PolarHBondContact O-N 3.45Å; R228-N232 PolarHBondContact O-ND2 2.66Å; R228-N232 PolarHBondContact O-OD1 3.29Å
229E97.6Very high96Very high109 Ų109107.8 Ų107.851%0.50950%0.498SS..Hα-helixtrans-60.8-50.3176.7-174.4176.7-174.200111.7R225 N231 N232 L233R225-E229 WeakPolarHBondContact O-CB 3.49Å; R225-E229 PolarHBondContact O-N 3.31Å; E229-N231 VanDerWaalsContact C-N 3.3Å; E229-N231 PolarHBondContact O-N 2.98Å; E229-N232 PolarHBondContact O-N 2.94Å; E229-N232 VanDerWaalsContact O-N 3.17Å; E229-L233 WeakPolarHBondContact O-CG 3.43Å; E229-L233 PolarHBondContact O-N 3.49Å
230R98.6Very high96.7Very high150 Ų150104.3 Ų104.357%0.56649%0.487SS*.Hα-helixtrans-57.9-42.4174.5-71-173.9-154.997.8-5.4112.1L226 L233 A234L226-R230 WeakPolarHBondContact O-CG 3.3Å; L226-R230 PolarHBondContact O-N 3.17Å; L226-R230 PolarHBondContact O-NH1 3.39Å; R230-L233 PolarHBondContact O-N 2.78Å; R230-A234 WeakPolarHBondContact O-CB 3.25Å; R230-A234 PolarHBondContact O-N 3.46Å
231N98.4Very high97.3Very high74 Ų74103.9 Ų103.940%0.39648%0.478SS..Hα-helixtrans-65-42.5177.7-177.7-112.1000111.8R227 R228 E229 L233 A234 V235R227-N231 WeakPolarHBondContact O-CB 3.42Å; R227-N231 PolarHBondContact O-N 2.99Å; R228-N231 PolarHBondContact NH1-OD1 3.24Å; R228-N231 PolarHBondContact O-N 3.14Å; E229-N231 VanDerWaalsContact C-N 3.3Å; E229-N231 PolarHBondContact O-N 2.98Å; N231-L233 VanDerWaalsContact C-N 3.29Å; N231-L233 PolarHBondContact O-N 3.37Å; N231-A234 PolarHBondContact O-N 3.04Å; N231-V235 VanDerWaalsContact O-CG2 3.3Å; N231-V235 WeakPolarHBondContact O-CG2 3.45Å; N231-V235 PolarHBondContact O-N 3.41Å
232N98.6Very high97.5Very high73 Ų73104 Ų10439%0.3948%0.481SS..Hα-helixtrans-61.4-39.4176.5-69.6-17.3000111.5R228 E229 R236R228-N232 WeakPolarHBondContact O-CB 3.44Å; R228-N232 PolarHBondContact O-N 3.45Å; R228-N232 PolarHBondContact O-ND2 2.66Å; R228-N232 PolarHBondContact O-OD1 3.29Å; E229-N232 PolarHBondContact O-N 2.94Å; E229-N232 VanDerWaalsContact O-N 3.17Å; N232-R236 WeakPolarHBondContact O-CG 3.18Å; N232-R236 PolarHBondContact O-N 2.87Å
233L98.5Very high97.8Very high90 Ų90103.2 Ų103.247%0.47148%0.475SS..Hα-helixtrans-64-46.6172.6-69.7170.8000111.7E229 R230 N231 V235 R236 K237E229-L233 WeakPolarHBondContact O-CG 3.43Å; E229-L233 PolarHBondContact O-N 3.49Å; R230-L233 PolarHBondContact O-N 2.78Å; N231-L233 VanDerWaalsContact C-N 3.29Å; N231-L233 PolarHBondContact O-N 3.37Å; L233-V235 VanDerWaalsContact C-N 3.3Å; L233-V235 PolarHBondContact O-N 3.31Å; L233-R236 PolarHBondContact O-N 3.33Å; L233-K237 WeakPolarHBondContact O-CB 3.48Å; L233-K237 PolarHBondContact O-N 2.89Å
234A98.6Very high98.1Very high54 Ų54103.6 Ų103.645%0.44648%0.478SS..Hα-helixtrans-60.8-39.4177.700000112.2R230 N231 S238R230-A234 WeakPolarHBondContact O-CB 3.25Å; R230-A234 PolarHBondContact O-N 3.46Å; N231-A234 PolarHBondContact O-N 3.04Å; A234-S238 VanDerWaalsContact O-CB 3.25Å; A234-S238 WeakPolarHBondContact O-CB 3.45Å; A234-S238 PolarHBondContact O-N 2.99Å
235V98.8Very high98.2Very high66 Ų66106.4 Ų106.440%0.449%0.488SS..Hα-helixtrans-65.3-47.4175.9170.10000110.8N231 L233 K237 S238 R239N231-V235 VanDerWaalsContact O-CG2 3.3Å; N231-V235 WeakPolarHBondContact O-CG2 3.45Å; N231-V235 PolarHBondContact O-N 3.41Å; L233-V235 VanDerWaalsContact C-N 3.3Å; L233-V235 PolarHBondContact O-N 3.31Å; V235-K237 PolarHBondContact O-N 3.44Å; V235-S238 PolarHBondContact O-N 3.45Å; V235-R239 HydrophobicContact CG1-CG 4.48Å; V235-R239 WeakPolarHBondContact O-CG 3.49Å; V235-R239 PolarHBondContact O-N 3.12Å
236R98.8Very high98.4Very high148 Ų148102.8 Ų102.856%0.55848%0.482SS*.Hα-helixtrans-56.2-52.5175.4-77.5-174.2-84.5-179.8-4110.9N232 L233 S238 R239 D240N232-R236 WeakPolarHBondContact O-CG 3.18Å; N232-R236 PolarHBondContact O-N 2.87Å; L233-R236 PolarHBondContact O-N 3.33Å; R236-S238 VanDerWaalsContact C-N 3.32Å; R236-S238 PolarHBondContact O-N 3.18Å; R236-R239 PolarHBondContact O-N 3.34Å; R236-R239 VanDerWaalsContact O-N 3.11Å; R236-D240 PolarHBondContact O-N 3.2Å
237K98.8Very high98.5Very high164 Ų164104.4 Ų104.471%0.71349%0.491SS*.Hα-helixtrans-57-42.2177.2-172.6173.3-175.7172.30112.8L233 V235 K241L233-K237 WeakPolarHBondContact O-CB 3.48Å; L233-K237 PolarHBondContact O-N 2.89Å; V235-K237 PolarHBondContact O-N 3.44Å; K237-K241 WeakPolarHBondContact O-CB 3.37Å; K237-K241 PolarHBondContact O-N 3.05Å
238S98.8Very high98.6Very high78 Ų78103.9 Ų103.955%0.54549%0.493SS..Hα-helixtrans-64.2-43.7177.2-176.20000111.9A234 V235 R236 K241 A242A234-S238 VanDerWaalsContact O-CB 3.25Å; A234-S238 WeakPolarHBondContact O-CB 3.45Å; A234-S238 PolarHBondContact O-N 2.99Å; V235-S238 PolarHBondContact O-N 3.45Å; R236-S238 VanDerWaalsContact C-N 3.32Å; R236-S238 PolarHBondContact O-N 3.18Å; S238-K241 PolarHBondContact O-N 3.5Å; S238-A242 PolarHBondContact O-N 2.94Å
239R98.9Very high98.6Very high164 Ų164102.9 Ų102.962%0.61950%0.499SS*.Hα-helixtrans-63.2-44.8177-71.7177.173.3162.83111.6V235 R236 A242 K243V235-R239 HydrophobicContact CG1-CG 4.48Å; V235-R239 WeakPolarHBondContact O-CG 3.49Å; V235-R239 PolarHBondContact O-N 3.12Å; R236-R239 PolarHBondContact O-N 3.34Å; R236-R239 VanDerWaalsContact O-N 3.11Å; R239-A242 WeakPolarHBondContact O-CB 3.48Å; R239-A242 PolarHBondContact O-N 2.84Å; R239-K243 WeakPolarHBondContact O-CG 3.27Å; R239-K243 PolarHBondContact O-N 2.74Å
240D98.8Very high98.7Very high77 Ų77104 Ų10441%0.41251%0.505SS..Hα-helixtrans-69.5-37.5-179.1-63.3-29.4000111.5R236 A242 K243 M244R236-D240 PolarHBondContact O-N 3.2Å; D240-A242 VanDerWaalsContact C-N 3.3Å; D240-A242 PolarHBondContact O-N 2.84Å; D240-K243 PolarHBondContact O-N 3.15Å; D240-K243 IonicContact OD1-NZ 3.73Å; D240-K243 PolarHBondContact OD1-NZ 3.24Å; D240-M244 WeakPolarHBondContact O-CG 3.3Å; D240-M244 PolarHBondContact O-N 3.32Å
241K98.8Very high98.7Very high133 Ų133101.9 Ų101.958%0.57850%0.501SS*.Hα-helixtrans-59.5-40.5169.6-174.4173.7-176.61750112.1K237 S238 M244 R245K237-K241 WeakPolarHBondContact O-CB 3.37Å; K237-K241 PolarHBondContact O-N 3.05Å; S238-K241 PolarHBondContact O-N 3.5Å; K241-M244 PolarHBondContact O-N 3.02Å; K241-R245 WeakPolarHBondContact O-CG 3.4Å; K241-R245 PolarHBondContact O-N 3.19Å
242A98.7Very high98.7Very high34 Ų34103.3 Ų103.328%0.28150%0.504SS..Hα-helixtrans-66.1-41.7176.500000112.1S238 R239 D240 R245 N246S238-A242 PolarHBondContact O-N 2.94Å; R239-A242 WeakPolarHBondContact O-CB 3.48Å; R239-A242 PolarHBondContact O-N 2.84Å; D240-A242 VanDerWaalsContact C-N 3.3Å; D240-A242 PolarHBondContact O-N 2.84Å; A242-R245 PolarHBondContact O-N 2.9Å; A242-N246 PolarHBondContact O-N 3.17Å; A242-N246 PolarHBondContact O-ND2 3.42Å
243K98.8Very high98.7Very high124 Ų124104.1 Ų104.154%0.53951%0.511SS..Hα-helixtrans-60.9-45.6174.1-68.6173.6-167.6157.80111.8R239 D240 R245 N246 L247R239-K243 WeakPolarHBondContact O-CG 3.27Å; R239-K243 PolarHBondContact O-N 2.74Å; D240-K243 PolarHBondContact O-N 3.15Å; D240-K243 IonicContact OD1-NZ 3.73Å; D240-K243 PolarHBondContact OD1-NZ 3.24Å; K243-R245 PolarHBondContact O-N 3.41Å; K243-N246 WeakPolarHBondContact O-CB 3.36Å; K243-N246 PolarHBondContact O-N 3.49Å; K243-L247 PolarHBondContact O-N 3.45Å
244M98.7Very high98.7Very high99 Ų99105.7 Ų105.749%0.48852%0.52SS..Hα-helixtrans-59.2-47.3177.3-75.9-57.9-58.500111.6D240 K241 N246 L247 E248D240-M244 WeakPolarHBondContact O-CG 3.3Å; D240-M244 PolarHBondContact O-N 3.32Å; K241-M244 PolarHBondContact O-N 3.02Å; M244-N246 VanDerWaalsContact C-N 3.29Å; M244-N246 PolarHBondContact O-N 3.4Å; M244-L247 PolarHBondContact O-N 2.88Å; M244-L247 VanDerWaalsContact O-N 3.12Å; M244-E248 WeakPolarHBondContact O-CB 3.42Å; M244-E248 VanDerWaalsContact O-CG 3.32Å; M244-E248 WeakPolarHBondContact O-CG 3.49Å; M244-E248 PolarHBondContact O-N 2.89Å
245R98.7Very high98.7Very high134 Ų134107.3 Ų107.351%0.50652%0.518SS..Hα-helixtrans-59-39.7175.9-74.1-170.7-59.5-155.32.2113K241 A242 K243 T249K241-R245 WeakPolarHBondContact O-CG 3.4Å; K241-R245 PolarHBondContact O-N 3.19Å; A242-R245 PolarHBondContact O-N 2.9Å; K243-R245 PolarHBondContact O-N 3.41Å; R245-T249 WeakPolarHBondContact O-CB 3.27Å; R245-T249 PolarHBondContact O-N 2.93Å; R245-T249 PolarHBondContact O-OG1 2.92Å
246N98.7Very high98.7Very high104 Ų104109 Ų10956%0.55652%0.524SS*.Hα-helixtrans-64.7-41.9176.7-72.8-22.5000111.6A242 K243 M244 T249 Q250A242-N246 PolarHBondContact O-N 3.17Å; A242-N246 PolarHBondContact O-ND2 3.42Å; K243-N246 WeakPolarHBondContact O-CB 3.36Å; K243-N246 PolarHBondContact O-N 3.49Å; M244-N246 VanDerWaalsContact C-N 3.29Å; M244-N246 PolarHBondContact O-N 3.4Å; N246-T249 PolarHBondContact O-N 2.98Å; N246-Q250 WeakPolarHBondContact O-CG 3.5Å; N246-Q250 PolarHBondContact O-N 2.96Å
247L98.6Very high98.7Very high93 Ų93104.2 Ų104.249%0.48752%0.516SS..Hα-helixtrans-66-45.3177-174.8144.2000111.7K243 M244 T249 Q250 Q251K243-L247 PolarHBondContact O-N 3.45Å; M244-L247 PolarHBondContact O-N 2.88Å; M244-L247 VanDerWaalsContact O-N 3.12Å; L247-T249 PolarHBondContact O-N 3.38Å; L247-Q250 WeakPolarHBondContact O-CB 3.48Å; L247-Q250 PolarHBondContact O-N 2.97Å; L247-Q251 PolarHBondContact O-N 3.03Å
248E98.6Very high98.7Very high107 Ų107101.4 Ų101.450%0.551%0.513SS..Hα-helixtrans-57-40.5173.7-72.6165.5-172.600111.2M244 Q251 K252M244-E248 WeakPolarHBondContact O-CB 3.42Å; M244-E248 VanDerWaalsContact O-CG 3.32Å; M244-E248 WeakPolarHBondContact O-CG 3.49Å; M244-E248 PolarHBondContact O-N 2.89Å; E248-Q251 PolarHBondContact O-N 3.49Å; E248-K252 WeakPolarHBondContact O-CB 3.49Å; E248-K252 PolarHBondContact O-N 3.23Å
249T98.8Very high98.7Very high85 Ų85101.1 Ų101.152%0.52150%0.503SS..Hα-helixtrans-65.8-45.1177.5-58.30000111R245 N246 L247 Q251 K252 V253R245-T249 WeakPolarHBondContact O-CB 3.27Å; R245-T249 PolarHBondContact O-N 2.93Å; R245-T249 PolarHBondContact O-OG1 2.92Å; N246-T249 PolarHBondContact O-N 2.98Å; L247-T249 PolarHBondContact O-N 3.38Å; T249-Q251 VanDerWaalsContact C-N 3.33Å; T249-Q251 PolarHBondContact O-N 2.82Å; T249-K252 PolarHBondContact O-N 3.39Å; T249-V253 WeakPolarHBondContact O-CG2 3.16Å; T249-V253 PolarHBondContact O-N 3.18Å
250Q98.8Very high98.7Very high133 Ų13397.2 Ų97.262%0.62149%0.494SS*.Hα-helixtrans-60-44.6175.4-72.7174.10.700111.5N246 L247 K252 V253 L254N246-Q250 WeakPolarHBondContact O-CG 3.5Å; N246-Q250 PolarHBondContact O-N 2.96Å; L247-Q250 WeakPolarHBondContact O-CB 3.48Å; L247-Q250 PolarHBondContact O-N 2.97Å; Q250-K252 VanDerWaalsContact C-N 3.31Å; Q250-K252 PolarHBondContact O-N 2.88Å; Q250-V253 PolarHBondContact O-N 2.93Å; Q250-L254 PolarHBondContact O-N 3.41Å
251Q98.8Very high98.7Very high105 Ų10597.7 Ų97.749%0.49150%0.496SS..Hα-helixtrans-61.4-41.9175.4-173177.3-14.900111.1L247 E248 T249 V253 L254 E255L247-Q251 PolarHBondContact O-N 3.03Å; E248-Q251 PolarHBondContact O-N 3.49Å; T249-Q251 VanDerWaalsContact C-N 3.33Å; T249-Q251 PolarHBondContact O-N 2.82Å; Q251-V253 VanDerWaalsContact C-N 3.31Å; Q251-V253 PolarHBondContact O-N 2.89Å; Q251-L254 WeakPolarHBondContact O-CB 3.46Å; Q251-L254 PolarHBondContact O-N 2.89Å; Q251-L254 VanDerWaalsContact O-N 3.14Å; Q251-E255 WeakPolarHBondContact O-CG 3.37Å; Q251-E255 PolarHBondContact O-N 3.11Å
252K98.8Very high98.7Very high104 Ų10497.8 Ų97.845%0.45249%0.493SS..Hα-helixtrans-63.9-36.8179.2-169.257.8179.7177.60112.9E248 T249 Q250 L254 E255 L256E248-K252 WeakPolarHBondContact O-CB 3.49Å; E248-K252 PolarHBondContact O-N 3.23Å; T249-K252 PolarHBondContact O-N 3.39Å; Q250-K252 VanDerWaalsContact C-N 3.31Å; Q250-K252 PolarHBondContact O-N 2.88Å; K252-L254 VanDerWaalsContact C-N 3.32Å; K252-E255 VanDerWaalsContact CD-OE2 3.27Å; K252-E255 WeakPolarHBondContact CD-OE2 3.43Å; K252-E255 IonicContact NZ-OE2 3.63Å; K252-E255 PolarHBondContact NZ-OE2 3.5Å; K252-E255 PolarHBondContact O-N 2.92Å; K252-L256 HydrophobicContact CD-CG 4.48Å; K252-L256 HydrophobicContact CG-CD1 4.16Å; K252-L256 HydrophobicContact CG-CG 4.41Å; K252-L256 WeakPolarHBondContact O-CB 3.39Å; K252-L256 VanDerWaalsContact O-CG 3.27Å; K252-L256 WeakPolarHBondContact O-CG 3.39Å; K252-L256 PolarHBondContact O-N 3.39Å
253V98.8Very high98.7Very high91 Ų91100.2 Ų100.255%0.55250%0.501SS*.Hα-helixtrans-60.9-43.4174.2169.80000110.8T249 Q250 Q251 L256 A257T249-V253 WeakPolarHBondContact O-CG2 3.16Å; T249-V253 PolarHBondContact O-N 3.18Å; Q250-V253 PolarHBondContact O-N 2.93Å; Q251-V253 VanDerWaalsContact C-N 3.31Å; Q251-V253 PolarHBondContact O-N 2.89Å; V253-L256 PolarHBondContact O-N 2.96Å; V253-A257 WeakPolarHBondContact O-CB 3.34Å; V253-A257 PolarHBondContact O-N 3.3Å
254L98.8Very high98.7Very high123 Ų12399 Ų9964%0.64450%0.497SS*.Hα-helixtrans-65-44.3177.3-64175.5000111.9Q250 Q251 K252 L256 A257 V258Q250-L254 PolarHBondContact O-N 3.41Å; Q251-L254 WeakPolarHBondContact O-CB 3.46Å; Q251-L254 PolarHBondContact O-N 2.89Å; Q251-L254 VanDerWaalsContact O-N 3.14Å; K252-L254 VanDerWaalsContact C-N 3.32Å; L254-L256 VanDerWaalsContact C-N 3.33Å; L254-L256 PolarHBondContact O-N 3.01Å; L254-A257 PolarHBondContact O-N 3.37Å; L254-V258 WeakPolarHBondContact O-CG2 3.42Å; L254-V258 PolarHBondContact O-N 2.97Å; L254-V258 VanDerWaalsContact O-N 3.1Å
255E98.7Very high98.7Very high87 Ų87101 Ų10141%0.40750%0.503SS..Hα-helixtrans-57.8-46.6175.2-71.4173.5-168.400111.8Q251 K252 A257 V258 E259Q251-E255 WeakPolarHBondContact O-CG 3.37Å; Q251-E255 PolarHBondContact O-N 3.11Å; K252-E255 VanDerWaalsContact CD-OE2 3.27Å; K252-E255 WeakPolarHBondContact CD-OE2 3.43Å; K252-E255 IonicContact NZ-OE2 3.63Å; K252-E255 PolarHBondContact NZ-OE2 3.5Å; K252-E255 PolarHBondContact O-N 2.92Å; E255-A257 VanDerWaalsContact C-N 3.34Å; E255-A257 PolarHBondContact O-N 3.26Å; E255-V258 PolarHBondContact O-N 3.46Å; E255-E259 PolarHBondContact O-N 3.49Å
256L98.8Very high98.7Very high102 Ų102100.1 Ų100.153%0.53450%0.5SS..Hα-helixtrans-66.8-35.1179.6-71.7174.3000112.1K252 V253 L254 E259 N260K252-L256 HydrophobicContact CD-CG 4.48Å; K252-L256 HydrophobicContact CG-CD1 4.16Å; K252-L256 HydrophobicContact CG-CG 4.41Å; K252-L256 WeakPolarHBondContact O-CB 3.39Å; K252-L256 VanDerWaalsContact O-CG 3.27Å; K252-L256 WeakPolarHBondContact O-CG 3.39Å; K252-L256 PolarHBondContact O-N 3.39Å; V253-L256 PolarHBondContact O-N 2.96Å; L254-L256 VanDerWaalsContact C-N 3.33Å; L254-L256 PolarHBondContact O-N 3.01Å; L256-E259 PolarHBondContact O-N 2.87Å; L256-N260 VanDerWaalsContact O-CB 3.25Å; L256-N260 WeakPolarHBondContact O-CB 3.32Å; L256-N260 PolarHBondContact O-N 2.89Å
257A98.6Very high98.7Very high48 Ų4899.5 Ų99.540%0.39750%0.5SS..Hα-helixtrans-62.7-46.9175.200000111.4V253 L254 E255 E259 N260 D261V253-A257 WeakPolarHBondContact O-CB 3.34Å; V253-A257 PolarHBondContact O-N 3.3Å; L254-A257 PolarHBondContact O-N 3.37Å; E255-A257 VanDerWaalsContact C-N 3.34Å; E255-A257 PolarHBondContact O-N 3.26Å; A257-E259 VanDerWaalsContact C-N 3.34Å; A257-E259 PolarHBondContact O-N 3.38Å; A257-N260 WeakPolarHBondContact O-CB 3.49Å; A257-N260 PolarHBondContact O-N 3.02Å; A257-D261 PolarHBondContact O-N 3.27Å
258V98.8Very high98.7Very high105 Ų10599.7 Ų99.764%0.63650%0.498SS*.Hα-helixtrans-61.2-43.8176.7173.50000111.4L254 E255 D261 R262L254-V258 WeakPolarHBondContact O-CG2 3.42Å; L254-V258 PolarHBondContact O-N 2.97Å; L254-V258 VanDerWaalsContact O-N 3.1Å; E255-V258 PolarHBondContact O-N 3.46Å; V258-D261 PolarHBondContact O-N 2.85Å; V258-R262 PolarHBondContact O-N 2.83Å
259E98.6Very high98.7Very high72 Ų7298.1 Ų98.134%0.33649%0.491SS..Hα-helixtrans-67.2-37.3178-177.556.8-160.200112E255 L256 A257 R262 L263E255-E259 PolarHBondContact O-N 3.49Å; L256-E259 PolarHBondContact O-N 2.87Å; A257-E259 VanDerWaalsContact C-N 3.34Å; A257-E259 PolarHBondContact O-N 3.38Å; E259-R262 VanDerWaalsContact CD-NE 3.34Å; E259-R262 WeakPolarHBondContact O-CB 3.25Å; E259-R262 PolarHBondContact O-N 2.96Å; E259-R262 IonicContact OE1-CZ 2.72Å; E259-R262 VanDerWaalsContact OE1-CZ 3.3Å; E259-R262 IonicContact OE1-NE 3.79Å; E259-R262 PolarHBondContact OE1-NE 3.4Å; E259-R262 VanDerWaalsContact OE1-NE 3.14Å; E259-R262 IonicContact OE1-NH2 3.39Å; E259-R262 PolarHBondContact OE1-NH2 2.85Å; E259-R262 IonicContact OE2-CZ 2.98Å; E259-R262 IonicContact OE2-NE 2.59Å; E259-R262 PolarHBondContact OE2-NE 3.01Å; E259-R262 IonicContact OE2-NH2 2.89Å; E259-L263 HydrophobicContact CG-CD1 4.22Å; E259-L263 VanDerWaalsContact O-CG 3.3Å; E259-L263 WeakPolarHBondContact O-CG 3.47Å; E259-L263 PolarHBondContact O-N 3.35Å
260N98.7Very high98.7Very high82 Ų8297.5 Ų97.544%0.43948%0.484SS..Hα-helixtrans-60.9-48.9175.2-162.5-72.8000111L256 A257 R262 L263 Q264L256-N260 VanDerWaalsContact O-CB 3.25Å; L256-N260 WeakPolarHBondContact O-CB 3.32Å; L256-N260 PolarHBondContact O-N 2.89Å; A257-N260 WeakPolarHBondContact O-CB 3.49Å; A257-N260 PolarHBondContact O-N 3.02Å; N260-R262 VanDerWaalsContact C-N 3.27Å; N260-R262 PolarHBondContact O-N 3.37Å; N260-L263 PolarHBondContact O-N 3.44Å; N260-L263 VanDerWaalsContact O-N 3.12Å; N260-Q264 WeakPolarHBondContact O-CG 3.35Å; N260-Q264 PolarHBondContact O-N 3.17Å; N260-Q264 PolarHBondContact OD1-NE2 3.18Å
261D98.7Very high98.7Very high86 Ų8694.3 Ų94.346%0.4648%0.476SS..Hα-helixtrans-58.9-40176.6-72.3-7.3000111.9A257 V258 Q264 K265A257-D261 PolarHBondContact O-N 3.27Å; V258-D261 PolarHBondContact O-N 2.85Å; D261-Q264 PolarHBondContact O-N 3.38Å; D261-K265 WeakPolarHBondContact O-CG 3.42Å; D261-K265 PolarHBondContact O-N 3.27Å; D261-K265 VanDerWaalsContact O-N 3.07Å
262R98.8Very high98.6Very high136 Ų13696.3 Ų96.351%0.51348%0.479SS..Hα-helixtrans-62.3-45.2176-168.5-168.575801.2111.3V258 E259 N260 R266V258-R262 PolarHBondContact O-N 2.83Å; E259-R262 VanDerWaalsContact CD-NE 3.34Å; E259-R262 WeakPolarHBondContact O-CB 3.25Å; E259-R262 PolarHBondContact O-N 2.96Å; E259-R262 IonicContact OE1-CZ 2.72Å; E259-R262 VanDerWaalsContact OE1-CZ 3.3Å; E259-R262 IonicContact OE1-NE 3.79Å; E259-R262 PolarHBondContact OE1-NE 3.4Å; E259-R262 VanDerWaalsContact OE1-NE 3.14Å; E259-R262 IonicContact OE1-NH2 3.39Å; E259-R262 PolarHBondContact OE1-NH2 2.85Å; E259-R262 IonicContact OE2-CZ 2.98Å; E259-R262 IonicContact OE2-NE 2.59Å; E259-R262 PolarHBondContact OE2-NE 3.01Å; E259-R262 IonicContact OE2-NH2 2.89Å; N260-R262 VanDerWaalsContact C-N 3.27Å; N260-R262 PolarHBondContact O-N 3.37Å; R262-R266 PolarHBondContact O-N 2.84Å; R262-R266 VanDerWaalsContact O-N 3.12Å
263L98.8Very high98.6Very high85 Ų8595.3 Ų95.345%0.44548%0.476SS..Hα-helixtrans-66.9-42.3178.4-70.5172.4000111.7E259 N260 K265 R266 V267E259-L263 HydrophobicContact CG-CD1 4.22Å; E259-L263 VanDerWaalsContact O-CG 3.3Å; E259-L263 WeakPolarHBondContact O-CG 3.47Å; E259-L263 PolarHBondContact O-N 3.35Å; N260-L263 PolarHBondContact O-N 3.44Å; N260-L263 VanDerWaalsContact O-N 3.12Å; L263-K265 PolarHBondContact O-N 3.38Å; L263-R266 WeakPolarHBondContact O-CB 3.24Å; L263-R266 PolarHBondContact O-N 3.23Å; L263-R266 VanDerWaalsContact O-N 3.1Å; L263-V267 WeakPolarHBondContact O-CG2 3.42Å; L263-V267 PolarHBondContact O-N 3Å
264Q98.6Very high98.6Very high97 Ų9795.1 Ų95.145%0.45347%0.472SS..Hα-helixtrans-56.5-48.5175-73.3-178.98.200111.3N260 D261 R266 V267 E268N260-Q264 WeakPolarHBondContact O-CG 3.35Å; N260-Q264 PolarHBondContact O-N 3.17Å; N260-Q264 PolarHBondContact OD1-NE2 3.18Å; D261-Q264 PolarHBondContact O-N 3.38Å; Q264-R266 VanDerWaalsContact C-N 3.28Å; Q264-R266 PolarHBondContact O-N 2.78Å; Q264-V267 PolarHBondContact O-N 3.34Å; Q264-E268 WeakPolarHBondContact O-CG 3.38Å; Q264-E268 PolarHBondContact O-N 2.91Å
265K98.7Very high98.5Very high143 Ų14391.3 Ų91.362%0.62246%0.458SS*.Hα-helixtrans-59-38.3175.5-72.6171.2-176.9170.10112.6D261 L263 Q269D261-K265 WeakPolarHBondContact O-CG 3.42Å; D261-K265 PolarHBondContact O-N 3.27Å; D261-K265 VanDerWaalsContact O-N 3.07Å; L263-K265 PolarHBondContact O-N 3.38Å; K265-Q269 WeakPolarHBondContact O-CB 3.25Å; K265-Q269 PolarHBondContact O-N 3.48Å
266R98.5Very high98.4Very high115 Ų11590.8 Ų90.843%0.43446%0.461SS..Hα-helixtrans-68.3-41.5177.6-174.458.2177.4165.84.9111.7R262 L263 Q264 Q269 L270R262-R266 PolarHBondContact O-N 2.84Å; R262-R266 VanDerWaalsContact O-N 3.12Å; L263-R266 WeakPolarHBondContact O-CB 3.24Å; L263-R266 PolarHBondContact O-N 3.23Å; L263-R266 VanDerWaalsContact O-N 3.1Å; Q264-R266 VanDerWaalsContact C-N 3.28Å; Q264-R266 PolarHBondContact O-N 2.78Å; R266-Q269 VanDerWaalsContact NH1-NE2 3.18Å; R266-Q269 PolarHBondContact O-N 3.26Å; R266-L270 HydrophobicContact CG-CD1 4.26Å; R266-L270 WeakPolarHBondContact O-CG 3.3Å; R266-L270 PolarHBondContact O-N 2.99Å
267V98.7Very high98.2Very high91 Ų9190.6 Ų90.655%0.55246%0.46SS*.Hα-helixtrans-60.3-51.3173.9170.40000109.8L263 Q264 Q269 L270 S271L263-V267 WeakPolarHBondContact O-CG2 3.42Å; L263-V267 PolarHBondContact O-N 3Å; Q264-V267 PolarHBondContact O-N 3.34Å; V267-Q269 VanDerWaalsContact C-N 3.31Å; V267-Q269 PolarHBondContact O-N 3.41Å; V267-L270 PolarHBondContact O-N 3.49Å; V267-S271 WeakPolarHBondContact O-CB 3.25Å; V267-S271 PolarHBondContact O-N 2.85Å; V267-S271 PolarHBondContact O-OG 3.43Å
268E98.6Very high98.1Very high96 Ų9696 Ų9645%0.44947%0.47SS..Hα-helixtrans-57.1-42.7177.9-73.9179.5-166.600112.9Q264 S271 R272Q264-E268 WeakPolarHBondContact O-CG 3.38Å; Q264-E268 PolarHBondContact O-N 2.91Å; E268-S271 PolarHBondContact O-N 2.88Å; E268-R272 WeakPolarHBondContact O-CG 3.39Å; E268-R272 PolarHBondContact O-N 3.19Å; E268-R272 IonicContact OE2-NH1 3.65Å; E268-R272 IonicContact OE2-NH2 3.92Å
269Q98.6Very high97.8Very high75 Ų7596.5 Ų96.535%0.3547%0.469SS..Hα-helixtrans-58.8-53.3176178.6-174-8.100111K265 R266 V267 S271 R272 E273K265-Q269 WeakPolarHBondContact O-CB 3.25Å; K265-Q269 PolarHBondContact O-N 3.48Å; R266-Q269 VanDerWaalsContact NH1-NE2 3.18Å; R266-Q269 PolarHBondContact O-N 3.26Å; V267-Q269 VanDerWaalsContact C-N 3.31Å; V267-Q269 PolarHBondContact O-N 3.41Å; Q269-S271 VanDerWaalsContact C-N 3.3Å; Q269-S271 PolarHBondContact O-N 3.16Å; Q269-R272 WeakPolarHBondContact O-CB 3.45Å; Q269-R272 PolarHBondContact O-N 3.37Å; Q269-R272 VanDerWaalsContact O-N 3.16Å; Q269-E273 WeakPolarHBondContact CG-OE1 3.28Å; Q269-E273 PolarHBondContact NE2-OE1 3.06Å; Q269-E273 WeakPolarHBondContact O-CG 3.28Å; Q269-E273 PolarHBondContact O-N 3.09Å
270L98.5Very high97.6Very high71 Ų7198.4 Ų98.437%0.37248%0.481SS..Hα-helixtrans-63.6-37.4-179.4-68.3172.9000111.5R266 V267 R272 E273 L274R266-L270 HydrophobicContact CG-CD1 4.26Å; R266-L270 WeakPolarHBondContact O-CG 3.3Å; R266-L270 PolarHBondContact O-N 2.99Å; V267-L270 PolarHBondContact O-N 3.49Å; L270-R272 PolarHBondContact O-N 3.04Å; L270-E273 PolarHBondContact O-N 2.92Å; L270-L274 WeakPolarHBondContact O-CB 3.28Å; L270-L274 WeakPolarHBondContact O-CG 3.42Å; L270-L274 PolarHBondContact O-N 3.01Å
271S98.2Very high97.4Very high67 Ų6799 Ų9947%0.46948%0.484SS..Hα-helixtrans-61.8-41.8174-63.80000112V267 E268 Q269 A275V267-S271 WeakPolarHBondContact O-CB 3.25Å; V267-S271 PolarHBondContact O-N 2.85Å; V267-S271 PolarHBondContact O-OG 3.43Å; E268-S271 PolarHBondContact O-N 2.88Å; Q269-S271 VanDerWaalsContact C-N 3.3Å; Q269-S271 PolarHBondContact O-N 3.16Å; S271-A275 WeakPolarHBondContact O-CB 3.42Å; S271-A275 PolarHBondContact O-N 2.83Å
272R98.3Very high97Very high147 Ų14799.2 Ų99.256%0.55549%0.492SS*.Hα-helixtrans-63.9-47.4173.8-75.7-174.4-72.8-110.6-3.5111.5E268 Q269 L270 L274 A275 T276E268-R272 WeakPolarHBondContact O-CG 3.39Å; E268-R272 PolarHBondContact O-N 3.19Å; E268-R272 IonicContact OE2-NH1 3.65Å; E268-R272 IonicContact OE2-NH2 3.92Å; Q269-R272 WeakPolarHBondContact O-CB 3.45Å; Q269-R272 PolarHBondContact O-N 3.37Å; Q269-R272 VanDerWaalsContact O-N 3.16Å; L270-R272 PolarHBondContact O-N 3.04Å; R272-L274 PolarHBondContact O-N 3.05Å; R272-A275 PolarHBondContact O-N 3.32Å; R272-T276 WeakPolarHBondContact O-CG2 3.45Å; R272-T276 PolarHBondContact O-N 3.28Å; R272-T276 PolarHBondContact O-OG1 3.37Å
273E97.8Very high96.4Very high82 Ų8296.8 Ų96.838%0.38350%0.501SS..Hα-helixtrans-58-47.8177.3-71.5172.8-163.700111.2Q269 L270 A275 T276 L277Q269-E273 WeakPolarHBondContact CG-OE1 3.28Å; Q269-E273 PolarHBondContact NE2-OE1 3.06Å; Q269-E273 WeakPolarHBondContact O-CG 3.28Å; Q269-E273 PolarHBondContact O-N 3.09Å; L270-E273 PolarHBondContact O-N 2.92Å; E273-A275 PolarHBondContact O-N 3.22Å; E273-T276 WeakPolarHBondContact CA-OG1 3.37Å; E273-T276 PolarHBondContact O-N 3.27Å; E273-T276 PolarHBondContact O-OG1 2.99Å; E273-L277 WeakPolarHBondContact O-CG 3.08Å; E273-L277 PolarHBondContact O-N 3.46Å
274L98Very high95.7Very high88 Ų8897 Ų9746%0.46151%0.506SS..Hα-helixtrans-62.4-40.3176.2-72.5178.5000112.9L270 R272 T276 L277 R278L270-L274 WeakPolarHBondContact O-CB 3.28Å; L270-L274 WeakPolarHBondContact O-CG 3.42Å; L270-L274 PolarHBondContact O-N 3.01Å; R272-L274 PolarHBondContact O-N 3.05Å; L274-T276 VanDerWaalsContact C-N 3.34Å; L274-L277 PolarHBondContact O-N 3.18Å; L274-R278 WeakPolarHBondContact O-CB 3.2Å; L274-R278 VanDerWaalsContact O-CG 3.31Å; L274-R278 WeakPolarHBondContact O-CG 3.34Å; L274-R278 PolarHBondContact O-N 2.7Å
275A97.2Very high94.3Very high43 Ų4395.2 Ų95.236%0.35551%0.513SS..Hα-helixtrans-61.8-43.6175.600000111.1S271 R272 E273 R278 N279S271-A275 WeakPolarHBondContact O-CB 3.42Å; S271-A275 PolarHBondContact O-N 2.83Å; R272-A275 PolarHBondContact O-N 3.32Å; E273-A275 PolarHBondContact O-N 3.22Å; A275-R278 PolarHBondContact O-N 2.8Å; A275-N279 WeakPolarHBondContact O-CB 3.41Å; A275-N279 PolarHBondContact O-N 3.08Å; A275-N279 PolarHBondContact O-ND2 3.35Å
276T96.5Very high92.5Very high76 Ų7695.8 Ų95.847%0.46652%0.518SS..Hα-helixtrans-62.2-44.7175.858.40000112.2R272 E273 L274 R278 N279 L280R272-T276 WeakPolarHBondContact O-CG2 3.45Å; R272-T276 PolarHBondContact O-N 3.28Å; R272-T276 PolarHBondContact O-OG1 3.37Å; E273-T276 WeakPolarHBondContact CA-OG1 3.37Å; E273-T276 PolarHBondContact O-N 3.27Å; E273-T276 PolarHBondContact O-OG1 2.99Å; L274-T276 VanDerWaalsContact C-N 3.34Å; T276-R278 PolarHBondContact O-N 3.39Å; T276-N279 PolarHBondContact O-N 3.41Å; T276-L280 WeakPolarHBondContact O-CG 3.33Å; T276-L280 PolarHBondContact O-N 3.22Å
277L96.1Very high90.2Very high97 Ų9799.4 Ų99.451%0.50856%0.559SS.*Hα-helixtrans-63.6-41.8177.9-69.9174.1000112.2E273 L274 L280 L281E273-L277 WeakPolarHBondContact O-CG 3.08Å; E273-L277 PolarHBondContact O-N 3.46Å; L274-L277 PolarHBondContact O-N 3.18Å; L277-L280 PolarHBondContact O-N 3.29Å; L277-L281 WeakPolarHBondContact O-CG 3.39Å; L277-L281 PolarHBondContact O-N 3.24Å
278R95Very high89.8Confident163 Ų16399.8 Ų99.862%0.61556%0.559SS**Hα-helixtrans-60.6-46.6173.8-76176.6176.8142.8-0.6111.5L274 A275 T276 L280 L281 S282L274-R278 WeakPolarHBondContact O-CB 3.2Å; L274-R278 VanDerWaalsContact O-CG 3.31Å; L274-R278 WeakPolarHBondContact O-CG 3.34Å; L274-R278 PolarHBondContact O-N 2.7Å; A275-R278 PolarHBondContact O-N 2.8Å; T276-R278 PolarHBondContact O-N 3.39Å; R278-L280 VanDerWaalsContact C-N 3.3Å; R278-L280 PolarHBondContact O-N 2.59Å; R278-L281 PolarHBondContact O-N 2.73Å; R278-S282 WeakPolarHBondContact O-CB 3.47Å; R278-S282 PolarHBondContact O-N 3.09Å; R278-S282 PolarHBondContact O-OG 3.35Å; R278-S282 VanDerWaalsContact O-OG 3.09Å
279N94Very high89.3Confident114 Ų114100 Ų10061%0.6157%0.565SS**Hα-helixtrans-60.9-40178-69.9-17.1000111.9A275 T276 A283A275-N279 WeakPolarHBondContact O-CB 3.41Å; A275-N279 PolarHBondContact O-N 3.08Å; A275-N279 PolarHBondContact O-ND2 3.35Å; T276-N279 PolarHBondContact O-N 3.41Å; N279-A283 VanDerWaalsContact O-CB 3.25Å; N279-A283 WeakPolarHBondContact O-CB 3.47Å; N279-A283 PolarHBondContact O-N 3.04Å
280L94.4Very high88.8Confident112 Ų112101.4 Ų101.459%0.58658%0.577SS**Hα-helixtrans-64.7-47.9175.9-70.6173000111.7T276 L277 R278 S282 A283 T284T276-L280 WeakPolarHBondContact O-CG 3.33Å; T276-L280 PolarHBondContact O-N 3.22Å; L277-L280 PolarHBondContact O-N 3.29Å; R278-L280 VanDerWaalsContact C-N 3.3Å; R278-L280 PolarHBondContact O-N 2.59Å; L280-S282 PolarHBondContact O-N 3.16Å; L280-A283 PolarHBondContact O-N 3.21Å; L280-T284 WeakPolarHBondContact O-CG2 3.39Å; L280-T284 PolarHBondContact O-N 3.39Å; L280-T284 PolarHBondContact O-OG1 2.66Å
281L92.5Very high88.2Confident96 Ų96103.2 Ų103.250%0.50359%0.589SS.*Hα-helixtrans-59.9-47.2178.1-75.7163000111.5L277 R278 A283 T284 G285L277-L281 WeakPolarHBondContact O-CG 3.39Å; L277-L281 PolarHBondContact O-N 3.24Å; R278-L281 PolarHBondContact O-N 2.73Å; L281-A283 VanDerWaalsContact C-N 3.32Å; L281-A283 PolarHBondContact O-N 3.3Å; L281-T284 WeakPolarHBondContact CA-OG1 3.34Å; L281-T284 PolarHBondContact O-N 3.14Å; L281-T284 VanDerWaalsContact O-N 3.16Å; L281-T284 PolarHBondContact O-OG1 3.25Å; L281-G285 PolarHBondContact O-N 3.39Å
282S91.3Very high87.6Confident89 Ų89105.4 Ų105.462%0.62260%0.597SS**Hα-helixtrans-61.3-37.9175.6-620000112.6R278 L280 T284 G285R278-S282 WeakPolarHBondContact O-CB 3.47Å; R278-S282 PolarHBondContact O-N 3.09Å; R278-S282 PolarHBondContact O-OG 3.35Å; R278-S282 VanDerWaalsContact O-OG 3.09Å; L280-S282 PolarHBondContact O-N 3.16Å; S282-T284 VanDerWaalsContact C-N 3.35Å; S282-G285 PolarHBondContact O-N 2.93Å
283A87.1Confident86.9Confident86 Ų86102.7 Ų102.771%0.71160%0.599SS**Hα-helixtrans-69.3-31.4176.100000112.8N279 L280 L281 G285N279-A283 VanDerWaalsContact O-CB 3.25Å; N279-A283 WeakPolarHBondContact O-CB 3.47Å; N279-A283 PolarHBondContact O-N 3.04Å; L280-A283 PolarHBondContact O-N 3.21Å; L281-A283 VanDerWaalsContact C-N 3.32Å; L281-A283 PolarHBondContact O-N 3.3Å; A283-G285 VanDerWaalsContact C-N 3.29Å; A283-G285 PolarHBondContact O-N 3.02Å
284T84.2Confident86.1Confident89 Ų89104.1 Ų104.155%0.54662%0.615SS.*THydrogen-bonded Turntrans-81.70.3178.7550000114.7L280 L281 S282 Q286L280-T284 WeakPolarHBondContact O-CG2 3.39Å; L280-T284 PolarHBondContact O-N 3.39Å; L280-T284 PolarHBondContact O-OG1 2.66Å; L281-T284 WeakPolarHBondContact CA-OG1 3.34Å; L281-T284 PolarHBondContact O-N 3.14Å; L281-T284 VanDerWaalsContact O-N 3.16Å; L281-T284 PolarHBondContact O-OG1 3.25Å; S282-T284 VanDerWaalsContact C-N 3.35Å; T284-Q286 PolarHBondContact O-N 3.1Å; T284-Q286 VanDerWaalsContact O-N 3.17Å
285G68.1Low85.2Confident59 Ų59105.4 Ų105.461%0.60863%0.627SS**THydrogen-bonded Turntrans65.917.3171.100000115.4L281 S282 A283 C287L281-G285 PolarHBondContact O-N 3.39Å; S282-G285 PolarHBondContact O-N 2.93Å; A283-G285 VanDerWaalsContact C-N 3.29Å; A283-G285 PolarHBondContact O-N 3.02Å; G285-C287 VanDerWaalsContact C-N 3.32Å; G285-C287 PolarHBondContact O-N 3.18Å; G285-C287 VanDerWaalsContact O-N 3.13Å
286Q61.3Low84.2Confident155 Ų155110.6 Ų110.672%0.72465%0.649SS**  trans-83.482170.8-64.1-177.213.500108.3T284T284-Q286 PolarHBondContact O-N 3.1Å; T284-Q286 VanDerWaalsContact O-N 3.17Å
287C50.4Low83.1Confident191 Ų191113.7 Ų113.7100%1.29167%0.666SS**  trans-105.30166.2-65.50000109.1G285G285-C287 VanDerWaalsContact C-N 3.32Å; G285-C287 PolarHBondContact O-N 3.18Å; G285-C287 VanDerWaalsContact O-N 3.13Å

Retrieved 287 of 287 residues in 146.5 ms (Link to these results)