A0A060YMU0_ONCMY Loading...

Mediator of RNA polymerase II transcription subunit 19

Component of the Mediator complex, a coactivator involved in the regulated transcription of nearly all RNA polymerase II-dependent genes. Mediator functions as a bridge to convey information from gene-specific regulatory proteins to the basal RNA polymerase II transcription machinery. Mediator is recruited to promoters by direct interactions with regulatory proteins and serves as a scaffold for the assembly of a functional preinitiation complex with RNA polymerase II and the general transcription factors.

AlphaFold DB (A0A1S3RTF9), UniProt , Accession A0A060YMU0, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene med19a, Length 244 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
1M47.7Very low45.3Very low245 Ų245169.2 Ų169.2100%1.20788%0.876SS**  059.80-137.9-173.7-63.600107.2
2T44.3Very low44.9Very low131 Ų131167.1 Ų167.180%0.80487%0.867SS**  trans-122.2146.8-168-39.90000105
3E48.5Very low43.9Very low178 Ų178168.4 Ų168.483%0.83287%0.867SS**  trans9977.5176.2-53.4-178.8157.900117
4M52.1Low43.7Very low182 Ų182163.2 Ų163.290%0.89786%0.861SS**  trans-149.730.9159-62.4-77.9-91.300113.4
5F47.4Very low43Very low208 Ų208165.5 Ų165.591%0.91287%0.866SS**  trans-139.578.7173.1-85.2-80.6000110.9
6S47.2Very low42.7Very low112 Ų112159.5 Ų159.578%0.78386%0.856SS**  trans-164.199.6161.5-79.50000107.8
7N46.3Very low43.2Very low167 Ų167157.4 Ų157.489%0.89385%0.853SS**  trans170.684.8149.9-87.9-1.3000108.8
8L49.4Very low43Very low155 Ų155155.8 Ų155.881%0.81285%0.852SS**SBendtrans-147.213.8156.6-157.950.4000115.4
9Y41.3Very low42.9Very low236 Ų236151.7 Ų151.793%0.92585%0.85SS**  trans-138.6120171.9-78.3-79.8000112
10G36.6Very low42.7Very low74 Ų74149.7 Ų149.776%0.76385%0.846SS**  trans141.294.2160.400000113.3
11Q37.2Very low42.8Very low173 Ų173147.1 Ų147.181%0.80884%0.838SS**  166.3146.6109.1-95.5-72.1-2.200111.3
12N40.3Very low42.4Very low144 Ų144141.1 Ų141.177%0.7782%0.82SS**  trans-129.4108.2-162.1178.9-65000105.9
13E32.3Very low42.3Very low184 Ų184142.6 Ų142.686%0.8682%0.822SS**  trans-145.7139.8169.9-62.9-167.5152.200112.1
14A41.7Very low41.9Very low96 Ų96137.2 Ų137.279%0.79381%0.814SS**  trans-75149.1-169.400000114.2
15Q33.3Very low41.4Very low198 Ų198138.3 Ų138.393%0.92581%0.814SS**  trans-158130.4145.3-115.3177.4-17.400111.4
16G37.2Very low41.2Very low69 Ų69131.2 Ų131.271%0.71180%0.8SS**  trans-75-168.3175.600000114.2
17P51.2Low41.6Very low124 Ų124132.6 Ų132.681%0.80581%0.806SS**  trans-91.7171.9-133.537.1-37.5000114.9
18P40.2Very low41.3Very low128 Ų128128.1 Ų128.183%0.83180%0.799SS**  -133.8146.2117.933.9-21.9000112.7
19G41.9Very low41.4Very low79 Ų79130 Ų13081%0.81480%0.801SS**  trans-58.9136.9-176.700000113.8S21G19-S21 PolarHBondContact O-N 3.45Å
20S38.8Very low42.2Very low110 Ų110124.2 Ų124.277%0.76979%0.792SS**  trans-87104.2166.372.10000109.6
21S43.3Very low43.5Very low97 Ų97126.3 Ų126.368%0.67879%0.792SS**  trans3989.8135.749.10000117G19 L23G19-S21 PolarHBondContact O-N 3.45Å; S21-L23 PolarHBondContact O-N 3.46Å; S21-L23 VanDerWaalsContact O-N 3.08Å
22S39.5Very low44.8Very low118 Ų118123.6 Ų123.683%0.82579%0.79SS**  -3.396.2124.2172.40000113.8G24S22-G24 PolarHBondContact O-N 3.33Å
23L43.3Very low45.7Very low163 Ų163122.9 Ų122.985%0.85379%0.793SS**  trans-82.394.2158-81.6168.4000106.7S21 F25S21-L23 PolarHBondContact O-N 3.46Å; S21-L23 VanDerWaalsContact O-N 3.08Å; L23-F25 PolarHBondContact O-N 3.46Å
24G39.4Very low47.1Very low65 Ų65121.8 Ų121.867%0.6779%0.792SS**  trans-59.3114.8176.600000111.5S22S22-G24 PolarHBondContact O-N 3.33Å
25F41.6Very low48.1Very low205 Ų205122.7 Ų122.790%0.89979%0.79SS**  trans-91.996.8151.6-84.4-88.6000107.1L23L23-F25 PolarHBondContact O-N 3.46Å
26G43.4Very low49.2Very low59 Ų59119 Ų11961%0.60878%0.784SS**  trans-62.1155.7165.100000110.7G28G26-G28 PolarHBondContact O-N 2.9Å
27P55.1Low49.3Very low140 Ų140122.9 Ų122.991%0.90979%0.788SS**  trans-73.391.2178.530.1-32.2000109.5K29P27-K29 PolarHBondContact O-N 3.4Å
28G40.2Very low49Very low73 Ų73124.6 Ų124.675%0.75379%0.785SS**  trans-82.3105175.500000111.6G26G26-G28 PolarHBondContact O-N 2.9Å
29K51.8Low48.9Very low195 Ų195124.1 Ų124.185%0.84878%0.78SS**  trans17.9132.9158.3-66.9176.5177177.80120.3P27P27-K29 PolarHBondContact O-N 3.4Å
30P57.8Low48.6Very low115 Ų115126.8 Ų126.875%0.74778%0.78SS**PPolyproline II helixtrans-69.9156.3172.631.4-34.1000112.4
31P63.7Low48.7Very low117 Ų117129.2 Ų129.276%0.7678%0.781SS**PPolyproline II helixtrans-67.7152.2178.528.5-33.6000112
32P65.8Low48.5Very low117 Ų117129.3 Ų129.376%0.7679%0.788SS**PPolyproline II helixtrans-70.1151.5-179.729.3-33.8000112
33P58.6Low48.5Very low128 Ų128128.2 Ų128.283%0.83179%0.786SS**PPolyproline II helixtrans-73142.2179.130-32.6000111.5
34L61.8Low48.4Very low161 Ų161129.7 Ų129.784%0.84379%0.789SS**PPolyproline II helixtrans-69.7147.3171.7-70.7162.4000110.8
35P62.7Low48.6Very low116 Ų116134.9 Ų134.975%0.75380%0.797SS**PPolyproline II helixtrans-71.5147.8-176.127.8-33.8000113.2
36P56.4Low48.8Very low121 Ų121130.3 Ų130.379%0.78679%0.788SS**PPolyproline II helixtrans-92.7116.6-179.234-28.5000111.2
37N39.8Very low48.9Very low149 Ų149133.3 Ų133.380%0.79780%0.797SS**  trans175.2137.2156.7-110.6-19000108.7
38Q43.3Very low48.3Very low161 Ų161134.1 Ų134.175%0.75279%0.789SS**  cis-145.714121.8-63.7-177.33.500110.3T40Q38-T40 PolarHBondContact O-N 3.38Å
39V38.4Very low48.1Very low118 Ų118138.6 Ų138.672%0.71579%0.79SS**  trans-63.1118.9162.6-160.60000107.2
40T36.6Very low47.6Very low134 Ų134133.1 Ų133.182%0.82279%0.788SS**  trans-94.9108.4165.6-47.50000107.2Q38 A42Q38-T40 PolarHBondContact O-N 3.38Å; T40-A42 PolarHBondContact O-N 3.42Å
41M40Very low46.9Very low162 Ų162135.8 Ų135.880%0.79880%0.796SS**PPolyproline II helixtrans-53.9122.9179.5-20.9-75.1176.200110.3A43M41-A43 PolarHBondContact O-N 3.38Å
42A40Very low46.2Very low98 Ų98139.1 Ų139.181%0.8180%0.802SS**PPolyproline II helixtrans-71.5120.8162.300000108.2T40 Q44T40-A42 PolarHBondContact O-N 3.42Å; A42-Q44 PolarHBondContact O-N 3.4Å
43A39.6Very low44.9Very low96 Ų96136.4 Ų136.479%0.79380%0.795SS**PPolyproline II helixtrans-60.5126.3177.900000111M41M41-A43 PolarHBondContact O-N 3.38Å
44Q41.1Very low44.8Very low194 Ų194136.6 Ų136.691%0.90780%0.797SS**PPolyproline II helixtrans-63.4129166-84.6171.8-1.800110A42A42-Q44 PolarHBondContact O-N 3.4Å
45M42.1Very low43.7Very low173 Ų173133 Ų13385%0.85279%0.79SS**PPolyproline II helixtrans-97.9139.2160.8-70.8-73.4-77.600108.4
46P45.6Very low43.3Very low110 Ų110135.9 Ų135.971%0.71480%0.798SS**PPolyproline II helixtrans-79.1158.7-17431-33.3000113.1
47P47.4Very low43.1Very low121 Ų121141 Ų14179%0.78680%0.802SS**PPolyproline II helixtrans-87.3135.9-179.734.6-29.2000110.4
48Q40.7Very low43.5Very low158 Ų158142.2 Ų142.274%0.73880%0.8SS**  trans-139.1121.7166.6-84-8073.700111.1
49H37.5Very low43.5Very low167 Ų167141.3 Ų141.377%0.77381%0.808SS**  trans76.2121.7141.8-74.845.8000119.3
50G41.2Very low43.9Very low79 Ų79138.9 Ų138.981%0.81481%0.807SS**  trans-92.8176.2174.200000113.9
51D41.7Very low44.5Very low171 Ų171136.2 Ų136.291%0.91480%0.798SS**  trans-166147.1153-170.839000108.1
52E50.1Low45.1Very low187 Ų187137.5 Ų137.587%0.87481%0.805SS**  trans-101139.3-164.2-145.7-137.1121.300112.8
53G38.4Very low45.9Very low61 Ų61140 Ų14063%0.62980%0.804SS**  trans124.7158.4154.800000117.8
54P57Low46.9Very low132 Ų132141.4 Ų141.486%0.85779%0.794SS**  -121.7144-9136.6-28.1000113.2
55A37.5Very low48.1Very low84 Ų84136.2 Ų136.269%0.69478%0.778SS**  trans-170.2117.2145.800000109.6R57A55-R57 PolarHBondContact O-N 3.39Å
56L54.3Low49.3Very low177 Ų177136.4 Ų136.493%0.92777%0.774SS**  trans-3289.3161.2-174.370.7000112.9K58L56-K58 PolarHBondContact O-N 3.29Å
57R52.1Low50.3Low230 Ų230140.8 Ų140.887%0.86878%0.778SS**  trans-91100165.1-70.4-79.5-175.9100.61.9106.6A55A55-R57 PolarHBondContact O-N 3.39Å
58K48Very low51.6Low174 Ų174143.1 Ų143.176%0.75778%0.783SS**  trans-30.4123.9167.3-118177.6174.4-179.50111.3L56 G60L56-K58 PolarHBondContact O-N 3.29Å; K58-G60 PolarHBondContact O-N 3.49Å
59P43.7Very low53.3Low142 Ų142142 Ų14292%0.92278%0.781SS**THydrogen-bonded Turntrans-79.461.9173.734-33.6000109.7
60G48.2Very low55.2Low67 Ų67144.7 Ų144.769%0.69178%0.784SS**THydrogen-bonded Turntrans-157.21.2-17500000115.9K58K58-G60 PolarHBondContact O-N 3.49Å
61A49Very low56.9Low78 Ų78149.5 Ų149.565%0.64579%0.785SS**  trans-112.221.3-176.400000113.6
62M51.6Low58.6Low189 Ų189148.6 Ų148.693%0.93178%0.78SS**SBendtrans-100.411.6177.5-65-60.8-15200113
63N57.8Low60Low151 Ų151145.3 Ų145.381%0.80778%0.775SS**  trans-142.732.1-178.3-145.5-100.9000113P65N63-P65 WeakPolarHBondContact O-CD 3.5Å
64E59Low62Low125 Ų125149.4 Ų149.458%0.58479%0.787SS**  trans-90.7113.7164.1-166.286.6-173.700106.6F66 Y67E64-F66 PolarHBondContact O-N 3.49Å; E64-F66 VanDerWaalsContact O-N 3.12Å; E64-Y67 PolarHBondContact OE1-OH 3.3Å
65P67Low62.8Low85 Ų85146.3 Ų146.355%0.55278%0.78SS**  trans-61.4121173.624.7-29.8000107.5N63 Y67N63-P65 WeakPolarHBondContact O-CD 3.5Å; P65-Y67 PolarHBondContact O-N 2.96Å; P65-Y67 VanDerWaalsContact O-N 3.14Å
66F66.7Low64.9Low176 Ų176148.3 Ų148.377%0.77278%0.779SS**  trans-45.8127169.1-72.1-90.9000107.9E64 L68 L69E64-F66 PolarHBondContact O-N 3.49Å; E64-F66 VanDerWaalsContact O-N 3.12Å; F66-L68 PolarHBondContact O-N 3.44Å; F66-L69 PolarHBondContact O-N 3.31Å
67Y67.9Low66.1Low203 Ų203148.9 Ų148.980%0.79678%0.777SS**THydrogen-bonded Turntrans-58.61.8-172-60.7-73.6000115.5E64 P65E64-Y67 PolarHBondContact OE1-OH 3.3Å; P65-Y67 PolarHBondContact O-N 2.96Å; P65-Y67 VanDerWaalsContact O-N 3.14Å
68L73.6Confident67.9Low170 Ų170140.6 Ų140.689%0.8975%0.749SS**THydrogen-bonded Turntrans-111.6-10175.7-58.5177.6000113.7F66 R70F66-L68 PolarHBondContact O-N 3.44Å; L68-R70 PolarHBondContact O-N 3.08Å; L68-R70 VanDerWaalsContact O-N 3.09Å
69L77Confident69.9Low134 Ų134135.2 Ų135.270%0.70273%0.731SS**  trans-8386.6175.5-164.971.7000108.4F66 E71F66-L69 PolarHBondContact O-N 3.31Å; L69-E71 PolarHBondContact O-N 3.19Å
70R77.1Confident72.2Confident224 Ų224132.8 Ų132.885%0.84573%0.731SS**PPolyproline II helixtrans-64.6133.3169.5-172.1175.9-81.8171.9-5.9108.3L68 L72L68-R70 PolarHBondContact O-N 3.08Å; L68-R70 VanDerWaalsContact O-N 3.09Å; R70-L72 PolarHBondContact O-N 3.09Å
71E76.3Confident74.3Confident179 Ų179136.4 Ų136.484%0.83674%0.735SS**PPolyproline II helixtrans-53.3127.7173.2-171.5158.2-168.600109.3L69L69-E71 PolarHBondContact O-N 3.19Å
72L77.4Confident76.5Confident152 Ų152134.8 Ų134.880%0.79672%0.717SS**PPolyproline II helixtrans-61.3134.1-176-75158.6000108.3R70 V74R70-L72 PolarHBondContact O-N 3.09Å; L72-V74 PolarHBondContact O-N 3.15Å
73P79.8Confident78.5Confident119 Ų119130.1 Ų130.177%0.77370%0.696SS**PPolyproline II helixtrans-52135.1173.7-23.332.1000109.7G75P73-G75 PolarHBondContact O-N 3.35Å; P73-G75 VanDerWaalsContact O-N 3.16Å
74V81.1Confident80.2Confident146 Ų146127 Ų12789%0.88568%0.679SS**PPolyproline II helixtrans-51125.8176.9-164.20000107.9L72 N76L72-V74 PolarHBondContact O-N 3.15Å; V74-N76 PolarHBondContact O-N 3.26Å
75G73.4Confident81.9Confident68 Ų68123.7 Ų123.770%0.70166%0.664SS**PPolyproline II helixtrans-53.2125.7-175.100000110.4P73P73-G75 PolarHBondContact O-N 3.35Å; P73-G75 VanDerWaalsContact O-N 3.16Å
76N82.4Confident83.3Confident126 Ų126122.7 Ų122.767%0.67466%0.657SS**PPolyproline II helixtrans-71.8133.2175.8-162.825.2000108.8V74 L78 T79V74-N76 PolarHBondContact O-N 3.26Å; N76-L78 PolarHBondContact ND2-O 3.19Å; N76-L78 PolarHBondContact O-N 3.28Å; N76-T79 WeakPolarHBondContact O-CG2 3.5Å
77E79.6Confident84.6Confident189 Ų189118.8 Ų118.888%0.88364%0.641SS**SBendtrans-62.1-29.2-177-58.1-147.3129.600112.2
78L89.1Confident85.9Confident55 Ų55115.2 Ų115.229%0.28863%0.627SS.*SBendtrans-103.5112.3176.4-157.770.8000110.7N76 T82 L84N76-L78 PolarHBondContact ND2-O 3.19Å; N76-L78 PolarHBondContact O-N 3.28Å; L78-T82 HydrophobicContact CD1-CG2 3.8Å; L78-L84 HydrophobicContact CD1-CD2 3.63Å; L78-L84 HydrophobicContact CD2-CD2 3.7Å; L78-L84 HydrophobicContact CG-CD2 3.84Å
79T90Very high87Confident62 Ų62113.6 Ų113.638%0.3862%0.619SS.*  trans-115.5161.8-178.253.60000110.9N76 N81 T82N76-T79 WeakPolarHBondContact O-CG2 3.5Å; T79-N81 WeakPolarHBondContact CB-OD1 3.41Å; T79-N81 PolarHBondContact O-N 3.32Å; T79-N81 VanDerWaalsContact O-N 3.16Å; T79-N81 PolarHBondContact OG1-OD1 3.16Å; T79-T82 VanDerWaalsContact O-CB 3.3Å; T79-T82 WeakPolarHBondContact O-CB 3.18Å; T79-T82 PolarHBondContact O-N 3.2Å; T79-T82 PolarHBondContact O-OG1 3.01Å; T79-T82 PolarHBondContact OG1-OG1 3.49Å; T79-T82 VanDerWaalsContact OG1-OG1 3.05Å
80G91.7Very high87.9Confident90 Ų90111.5 Ų111.593%0.92861%0.608SS**THydrogen-bonded Turntrans-63.9-18.6-178.900000115.3T82G80-T82 VanDerWaalsContact C-N 3.32Å
81N93.8Very high88.7Confident144 Ų144104 Ų10477%0.7758%0.583SS**THydrogen-bonded Turntrans-84.6-3.8172.861.7-34.4000113.3T79T79-N81 WeakPolarHBondContact CB-OD1 3.41Å; T79-N81 PolarHBondContact O-N 3.32Å; T79-N81 VanDerWaalsContact O-N 3.16Å; T79-N81 PolarHBondContact OG1-OD1 3.16Å
82T93.4Very high89.5Confident43 Ų43102.3 Ų102.326%0.26457%0.574SS.*SBendtrans-81.9124.4176.4-590000110.1L78 T79 G80 L84 H87L78-T82 HydrophobicContact CD1-CG2 3.8Å; T79-T82 VanDerWaalsContact O-CB 3.3Å; T79-T82 WeakPolarHBondContact O-CB 3.18Å; T79-T82 PolarHBondContact O-N 3.2Å; T79-T82 PolarHBondContact O-OG1 3.01Å; T79-T82 PolarHBondContact OG1-OG1 3.49Å; T79-T82 VanDerWaalsContact OG1-OG1 3.05Å; G80-T82 VanDerWaalsContact C-N 3.32Å; T82-L84 PolarHBondContact O-N 3.25Å; T82-H87 HydrophobicContact CG2-CB 4.01Å
83N94.1Very high90.2Very high92 Ų9297.1 Ų97.149%0.49255%0.554SS.*  trans-69.7104.2172.4-176.5-13.1000109.8I85 T86 H87N83-I85 PolarHBondContact O-N 3.03Å; N83-I85 WeakPolarHBondContact OD1-CB 3.32Å; N83-I85 PolarHBondContact OD1-N 3.17Å; N83-T86 PolarHBondContact ND2-OG1 3.31Å; N83-T86 PolarHBondContact O-N 3.04Å; N83-H87 WeakPolarHBondContact O-CB 3.25Å; N83-H87 PolarHBondContact O-N 3.33Å
84L94.6Very high90.8Very high86 Ų8697 Ų9745%0.4554%0.539SS..Hα-helixtrans-63.6-27.7-178.5-58.3-174.1000113.2L78 T82 Y88L78-L84 HydrophobicContact CD1-CD2 3.63Å; L78-L84 HydrophobicContact CD2-CD2 3.7Å; L78-L84 HydrophobicContact CG-CD2 3.84Å; T82-L84 PolarHBondContact O-N 3.25Å; L84-Y88 HydrophobicContact CB-CD2 4.33Å; L84-Y88 HydrophobicContact CB-CE2 4.46Å; L84-Y88 HydrophobicContact CD2-CE2 4.3Å; L84-Y88 VanDerWaalsContact O-CD2 3.24Å; L84-Y88 WeakPolarHBondContact O-CD2 3.05Å; L84-Y88 PolarHBondContact O-N 3.29Å; L84-Y88 VanDerWaalsContact O-N 3.13Å
85I94.4Very high91.3Very high54 Ų5494.9 Ų94.928%0.27752%0.522SS..Hα-helixtrans-64.9-46.2177.1-60.1174.3000109.1N83 N89 L90 E91 Y94N83-I85 PolarHBondContact O-N 3.03Å; N83-I85 WeakPolarHBondContact OD1-CB 3.32Å; N83-I85 PolarHBondContact OD1-N 3.17Å; I85-N89 PolarHBondContact O-N 3.33Å; I85-L90 HydrophobicContact CG2-CB 4.11Å; I85-L90 PolarHBondContact O-N 3.26Å; I85-E91 HydrophobicContact CG2-CG 4.21Å; I85-Y94 HydrophobicContact CD1-CD2 3.77Å; I85-Y94 HydrophobicContact CD1-CE2 4.07Å; I85-Y94 HydrophobicContact CD1-CG 4.01Å
86T94.9Very high92.1Very high65 Ų6597.3 Ų97.340%0.39951%0.514SS..Hα-helixtrans-71.1-43.8178.2-49.80000112.3N83 Y88 N89 E91N83-T86 PolarHBondContact ND2-OG1 3.31Å; N83-T86 PolarHBondContact O-N 3.04Å; T86-Y88 VanDerWaalsContact C-N 3.27Å; T86-Y88 PolarHBondContact O-N 3.09Å; T86-N89 PolarHBondContact O-N 2.96Å; T86-E91 WeakPolarHBondContact CA-OE1 3.04Å; T86-E91 WeakPolarHBondContact CB-OE1 3.25Å; T86-E91 VanDerWaalsContact CG2-OE1 3.25Å; T86-E91 WeakPolarHBondContact CG2-OE1 3.25Å; T86-E91 PolarHBondContact OG1-OE1 2.88Å
87H94.9Very high92.2Very high93 Ų9397 Ų9743%0.43151%0.507SS..Hα-helixtrans-58.3-38.4-179-178.2-89000112.6T82 N83T82-H87 HydrophobicContact CG2-CB 4.01Å; N83-H87 WeakPolarHBondContact O-CB 3.25Å; N83-H87 PolarHBondContact O-N 3.33Å
88Y95.4Very high92.5Very high129 Ų12992.1 Ų92.151%0.50649%0.492SS..THydrogen-bonded Turntrans-9812.6176.6-63.6-65.8000113.6L84 T86 L90L84-Y88 HydrophobicContact CB-CD2 4.33Å; L84-Y88 HydrophobicContact CB-CE2 4.46Å; L84-Y88 HydrophobicContact CD2-CE2 4.3Å; L84-Y88 VanDerWaalsContact O-CD2 3.24Å; L84-Y88 WeakPolarHBondContact O-CD2 3.05Å; L84-Y88 PolarHBondContact O-N 3.29Å; L84-Y88 VanDerWaalsContact O-N 3.13Å; T86-Y88 VanDerWaalsContact C-N 3.27Å; T86-Y88 PolarHBondContact O-N 3.09Å; Y88-L90 PolarHBondContact O-N 3.38Å
89N95.6Very high92.1Very high135 Ų13592.3 Ų92.372%0.72251%0.508SS*.THydrogen-bonded Turntrans52.935.6-179.5-55108.5000114.2I85 T86 E91I85-N89 PolarHBondContact O-N 3.33Å; T86-N89 PolarHBondContact O-N 2.96Å; N89-E91 VanDerWaalsContact C-N 3.34Å
90L95.8Very high91.8Very high90 Ų9096.9 Ų96.947%0.47152%0.522SS..  trans-87.74.6-179-60177.8000113.1I85 Y88 H92 A93 Y94I85-L90 HydrophobicContact CG2-CB 4.11Å; I85-L90 PolarHBondContact O-N 3.26Å; Y88-L90 PolarHBondContact O-N 3.38Å; L90-H92 PolarHBondContact O-N 2.91Å; L90-A93 PolarHBondContact O-N 3.48Å; L90-A93 VanDerWaalsContact O-N 3.1Å; L90-Y94 PolarHBondContact O-N 3.46Å
91E94.4Very high91.3Very high67 Ų67102.4 Ų102.431%0.31352%0.521SS..Hα-helixtrans-52-43.2-180-84.788.6178.300112.4I85 T86 N89 Y94 N95I85-E91 HydrophobicContact CG2-CG 4.21Å; T86-E91 WeakPolarHBondContact CA-OE1 3.04Å; T86-E91 WeakPolarHBondContact CB-OE1 3.25Å; T86-E91 VanDerWaalsContact CG2-OE1 3.25Å; T86-E91 WeakPolarHBondContact CG2-OE1 3.25Å; T86-E91 PolarHBondContact OG1-OE1 2.88Å; N89-E91 VanDerWaalsContact C-N 3.34Å; E91-Y94 PolarHBondContact O-N 3.1Å; E91-N95 VanDerWaalsContact O-CB 3.32Å; E91-N95 WeakPolarHBondContact O-CB 3.4Å; E91-N95 VanDerWaalsContact O-CG 3.31Å; E91-N95 PolarHBondContact O-N 3.18Å; E91-N95 PolarHBondContact O-ND2 3.18Å
92H93.8Very high90.7Very high143 Ų143100.4 Ų100.466%0.66251%0.513SS*.Hα-helixtrans-66.5-42-177-167.761.4000111.5L90 K96L90-H92 PolarHBondContact O-N 2.91Å; H92-K96 WeakPolarHBondContact O-CB 3.24Å; H92-K96 PolarHBondContact O-N 3.21Å
93A92.2Very high90.1Very high43 Ų43104.4 Ų104.436%0.35553%0.527SS..Hα-helixtrans-65.3-45.9176.600000111.4L90 N95 K96 F97L90-A93 PolarHBondContact O-N 3.48Å; L90-A93 VanDerWaalsContact O-N 3.1Å; A93-N95 PolarHBondContact O-N 2.75Å; A93-K96 PolarHBondContact O-N 2.54Å; A93-F97 HydrophobicContact CB-CD2 4.47Å; A93-F97 VanDerWaalsContact O-CD2 3.24Å; A93-F97 WeakPolarHBondContact O-CD2 3.34Å; A93-F97 PolarHBondContact O-N 3.19Å
94Y92Very high89.5Confident118 Ų118109 Ų10946%0.46355%0.545SS..Hα-helixtrans-58.1-49.9176.6178.6-96.5000111.5I85 L90 E91 K96 F97 C98 G99I85-Y94 HydrophobicContact CD1-CD2 3.77Å; I85-Y94 HydrophobicContact CD1-CE2 4.07Å; I85-Y94 HydrophobicContact CD1-CG 4.01Å; L90-Y94 PolarHBondContact O-N 3.46Å; E91-Y94 PolarHBondContact O-N 3.1Å; Y94-K96 VanDerWaalsContact C-N 3.31Å; Y94-K96 PolarHBondContact O-N 3.24Å; Y94-F97 PolarHBondContact O-N 3.01Å; Y94-C98 HydrophobicContact CD2-CB 3.68Å; Y94-C98 HydrophobicContact CE2-CB 3.67Å; Y94-C98 HydrophobicContact CG-CB 4.26Å; Y94-C98 WeakPolarHBondContact O-CA 3.24Å; Y94-C98 VanDerWaalsContact O-CB 3.25Å; Y94-C98 WeakPolarHBondContact O-CB 3.4Å; Y94-C98 PolarHBondContact O-N 3.29Å; Y94-G99 PolarHBondContact O-N 2.91Å
95N92.1Very high89.1Confident101 Ų101111.1 Ų111.154%0.5455%0.551SS.*Hα-helixtrans-64-36.9179.1-76-48.9000112.6E91 A93E91-N95 VanDerWaalsContact O-CB 3.32Å; E91-N95 WeakPolarHBondContact O-CB 3.4Å; E91-N95 VanDerWaalsContact O-CG 3.31Å; E91-N95 PolarHBondContact O-N 3.18Å; E91-N95 PolarHBondContact O-ND2 3.18Å; A93-N95 PolarHBondContact O-N 2.75Å
96K89.2Confident88.7Confident119 Ų119112.7 Ų112.752%0.51756%0.56SS.*Hα-helixtrans-69.9-41.2-179.3-175.4173.8177.9-178.20112.5H92 A93 Y94H92-K96 WeakPolarHBondContact O-CB 3.24Å; H92-K96 PolarHBondContact O-N 3.21Å; A93-K96 PolarHBondContact O-N 2.54Å; Y94-K96 VanDerWaalsContact C-N 3.31Å; Y94-K96 PolarHBondContact O-N 3.24Å
97F86.2Confident88.3Confident120 Ų120111.2 Ų111.253%0.52655%0.552SS.*Hα-helixtrans-111.4-30.8-167.9-60.7-66000114.6A93 Y94A93-F97 HydrophobicContact CB-CD2 4.47Å; A93-F97 VanDerWaalsContact O-CD2 3.24Å; A93-F97 WeakPolarHBondContact O-CD2 3.34Å; A93-F97 PolarHBondContact O-N 3.19Å; Y94-F97 PolarHBondContact O-N 3.01Å
98C85.8Confident88Confident85 Ų85109.8 Ų109.857%0.57455%0.547SS*.THydrogen-bonded Turntrans-95.2-21.9-179-58.70000113.2Y94 K100Y94-C98 HydrophobicContact CD2-CB 3.68Å; Y94-C98 HydrophobicContact CE2-CB 3.67Å; Y94-C98 HydrophobicContact CG-CB 4.26Å; Y94-C98 WeakPolarHBondContact O-CA 3.24Å; Y94-C98 VanDerWaalsContact O-CB 3.25Å; Y94-C98 WeakPolarHBondContact O-CB 3.4Å; Y94-C98 PolarHBondContact O-N 3.29Å; C98-K100 PolarHBondContact O-N 2.81Å
99G80.6Confident87.7Confident60 Ų60109.6 Ų109.662%0.61955%0.549SS*.SBendtrans-75-7.1178.200000114.9Y94Y94-G99 PolarHBondContact O-N 2.91Å
100K83.3Confident87.4Confident157 Ų157106.4 Ų106.468%0.68353%0.532SS*.SBendtrans-130.5149.7-176.4-63.5175.2-174.8172.50109.5C98 V102C98-K100 PolarHBondContact O-N 2.81Å; K100-V102 PolarHBondContact O-N 3.1Å; K100-V102 VanDerWaalsContact O-N 3.14Å
101K79.9Confident86.8Confident207 Ų207107 Ų10790%0.954%0.541SS*.  trans-58.3121.5170.1-69.3-173.1177.4179.80108.8K103K101-K103 PolarHBondContact O-N 3Å
102V82.8Confident86.4Confident101 Ų101112.6 Ų112.661%0.61257%0.567SS**  trans-64.2131.3178.3176.60000108.5K100 E104K100-V102 PolarHBondContact O-N 3.1Å; K100-V102 VanDerWaalsContact O-N 3.14Å; V102-E104 PolarHBondContact O-N 2.86Å
103K79.7Confident86Confident128 Ų128110.2 Ų110.256%0.55756%0.559SS**  trans-75.6114.4171.5-70.2-171.4-175.8179.30107.5K101 N108 F109K101-K103 PolarHBondContact O-N 3Å; K103-N108 HydrophobicContact CB-CB 3.66Å; K103-N108 HydrophobicContact CD-CB 3.49Å; K103-N108 VanDerWaalsContact CD-CB 3.49Å; K103-N108 HydrophobicContact CG-CB 4.21Å; K103-F109 WeakPolarHBondContact O-CE2 3.38Å; K103-F109 WeakPolarHBondContact O-CZ 3.3Å
104E81.9Confident85.5Confident187 Ų187112.5 Ų112.587%0.87457%0.57SS**  trans-79.4-27-171.8-64.3-178.8171.400113.8V102V102-E104 PolarHBondContact O-N 2.86Å
105K86.8Confident84.9Confident132 Ų132107 Ų10757%0.57455%0.549SS*.SBendtrans-80.5138.3-176.1-54-171168.9-159.30112.2S107 N108K105-S107 PolarHBondContact O-N 3.03Å; K105-N108 WeakPolarHBondContact CB-ND2 3.41Å; K105-N108 PolarHBondContact N-ND2 3.44Å; K105-N108 VanDerWaalsContact O-CB 3.26Å; K105-N108 WeakPolarHBondContact O-CB 3.1Å; K105-N108 PolarHBondContact O-N 2.76Å; K105-N108 PolarHBondContact O-ND2 3.14Å; K105-N108 VanDerWaalsContact O-ND2 3.17Å
106L85.8Confident84.3Confident87 Ų87106 Ų10646%0.45554%0.543SS..G310 helixtrans-58.9-37178.7-17360.4000112N108 F109 L110 I117 D118L106-N108 PolarHBondContact O-N 3.01Å; L106-F109 PolarHBondContact O-N 3.33Å; L106-L110 HydrophobicContact CD1-CD1 3.87Å; L106-L110 HydrophobicContact CD1-CG 4.41Å; L106-L110 HydrophobicContact CD2-CD1 4.19Å; L106-L110 HydrophobicContact CG-CD1 3.84Å; L106-L110 PolarHBondContact O-N 2.96Å; L106-L110 VanDerWaalsContact O-N 3.08Å; L106-I117 WeakPolarHBondContact CD2-O 3Å; L106-I117 HydrophobicContact CG-CD1 4.29Å; L106-D118 PolarHBondContact N-OD1 2.99Å
107S87.3Confident84.1Confident33 Ų33102.5 Ų102.523%0.23153%0.529CS..G310 helixtrans-55.8-22.4174.8580000114.7K105 D118K105-S107 PolarHBondContact O-N 3.03Å; S107-D118 WeakPolarHBondContact CB-OD1 3.12Å; S107-D118 WeakPolarHBondContact CB-OD2 3.5Å; S107-D118 PolarHBondContact N-OD1 3.28Å; S107-D118 VanDerWaalsContact OG-CG 3.27Å; S107-D118 PolarHBondContact OG-OD1 3.13Å; S107-D118 PolarHBondContact OG-OD2 3.05Å
108N88.1Confident84Confident63 Ų6399.9 Ų99.934%0.33752%0.52SS..G310 helixtrans-77-24.9175.3-66.4-60.2000113.9K103 K105 L106K103-N108 HydrophobicContact CB-CB 3.66Å; K103-N108 HydrophobicContact CD-CB 3.49Å; K103-N108 VanDerWaalsContact CD-CB 3.49Å; K103-N108 HydrophobicContact CG-CB 4.21Å; K105-N108 WeakPolarHBondContact CB-ND2 3.41Å; K105-N108 PolarHBondContact N-ND2 3.44Å; K105-N108 VanDerWaalsContact O-CB 3.26Å; K105-N108 WeakPolarHBondContact O-CB 3.1Å; K105-N108 PolarHBondContact O-N 2.76Å; K105-N108 PolarHBondContact O-ND2 3.14Å; K105-N108 VanDerWaalsContact O-ND2 3.17Å; L106-N108 PolarHBondContact O-N 3.01Å
109F88.1Confident83.7Confident126 Ų12698.7 Ų98.755%0.55351%0.512SS*.THydrogen-bonded Turntrans-94.8-22.2178.4-58.6-78.1000111.9K103 L106 P111K103-F109 WeakPolarHBondContact O-CE2 3.38Å; K103-F109 WeakPolarHBondContact O-CZ 3.3Å; L106-F109 PolarHBondContact O-N 3.33Å; F109-P111 VanDerWaalsContact O-CD 3.28Å; F109-P111 WeakPolarHBondContact O-CD 3.37Å
110L89.4Confident83.3Confident67 Ų6799.9 Ų99.935%0.35151%0.509SS..  trans-120.861.6179-56.3174.2000110.8L106 E112 L113 I117L106-L110 HydrophobicContact CD1-CD1 3.87Å; L106-L110 HydrophobicContact CD1-CG 4.41Å; L106-L110 HydrophobicContact CD2-CD1 4.19Å; L106-L110 HydrophobicContact CG-CD1 3.84Å; L106-L110 PolarHBondContact O-N 2.96Å; L106-L110 VanDerWaalsContact O-N 3.08Å; L110-E112 PolarHBondContact O-N 3.45Å; L110-L113 HydrophobicContact CB-CB 4.22Å; L110-L113 HydrophobicContact CB-CD1 3.77Å; L110-L113 HydrophobicContact CB-CG 4.03Å; L110-L113 HydrophobicContact CD1-CD1 3.57Å; L110-L113 HydrophobicContact CD2-CD1 4.26Å; L110-L113 HydrophobicContact CG-CD1 4.06Å; L110-L113 PolarHBondContact O-N 3.4Å; L110-I117 HydrophobicContact CB-CD1 3.56Å; L110-I117 HydrophobicContact CD1-CD1 4.12Å; L110-I117 HydrophobicContact CG-CD1 4.38Å
111P83.9Confident82.5Confident103 Ų10394.5 Ų94.567%0.66950%0.499SS*.THydrogen-bonded Turntrans-67.9-20.2-173.328.9-36.4000113.8F109F109-P111 VanDerWaalsContact O-CD 3.28Å; F109-P111 WeakPolarHBondContact O-CD 3.37Å
112E85.9Confident81.8Confident184 Ų18490.5 Ų90.586%0.8649%0.491SS*.THydrogen-bonded Turntrans-93-9.6-178.9-63.2-175.1174.400112.8L110 P114L110-E112 PolarHBondContact O-N 3.45Å; E112-P114 WeakPolarHBondContact O-CD 3.28Å
113L85.8Confident81Confident94 Ų9492.8 Ų92.849%0.49250%0.496SS..  trans-78.6121.3176.7-71.6-174.7000110.3L110 I117L110-L113 HydrophobicContact CB-CB 4.22Å; L110-L113 HydrophobicContact CB-CD1 3.77Å; L110-L113 HydrophobicContact CB-CG 4.03Å; L110-L113 HydrophobicContact CD1-CD1 3.57Å; L110-L113 HydrophobicContact CD2-CD1 4.26Å; L110-L113 HydrophobicContact CG-CD1 4.06Å; L110-L113 PolarHBondContact O-N 3.4Å; L113-I117 HydrophobicContact CB-CD1 4.33Å; L113-I117 HydrophobicContact CB-CG2 4.41Å
114P81.2Confident80.5Confident90 Ų9091.6 Ų91.658%0.58450%0.495SS*.  trans-69.5158.3172.630.4-34.1000111E112E112-P114 WeakPolarHBondContact O-CD 3.28Å
115G79.6Confident79.9Confident3 Ų385.4 Ų85.43%0.03148%0.482CS..SBendtrans94.8-179.3174.900000115.2I117 M167G115-I117 PolarHBondContact O-N 2.81Å; G115-M167 WeakPolarHBondContact CA-O 3.26Å
116M80.2Confident79.1Confident81 Ų8183 Ų8340%0.39948%0.481SS..  trans-9180.3178.8-59.2-159.4-36.200111.2D118 L166M116-D118 VanDerWaalsContact C-N 3.3Å; M116-D118 PolarHBondContact O-N 2.9Å; M116-L166 HydrophobicContact CE-CB 4.3Å
117I83.8Confident79Confident44 Ų4480.9 Ų80.923%0.22647%0.474CS..THydrogen-bonded Turntrans-80.8-6.2-178.358.5166.2000114.5L106 L110 L113 G115 C119L106-I117 WeakPolarHBondContact CD2-O 3Å; L106-I117 HydrophobicContact CG-CD1 4.29Å; L110-I117 HydrophobicContact CB-CD1 3.56Å; L110-I117 HydrophobicContact CD1-CD1 4.12Å; L110-I117 HydrophobicContact CG-CD1 4.38Å; L113-I117 HydrophobicContact CB-CD1 4.33Å; L113-I117 HydrophobicContact CB-CG2 4.41Å; G115-I117 PolarHBondContact O-N 2.81Å; I117-C119 VanDerWaalsContact C-N 3.27Å; I117-C119 PolarHBondContact O-N 2.94Å
118D83.5Confident79Confident65 Ų6585.1 Ų85.135%0.34849%0.493SS..THydrogen-bonded Turntrans-84.40.7179.6-68-30.7000113.3L106 S107 M116L106-D118 PolarHBondContact N-OD1 2.99Å; S107-D118 WeakPolarHBondContact CB-OD1 3.12Å; S107-D118 WeakPolarHBondContact CB-OD2 3.5Å; S107-D118 PolarHBondContact N-OD1 3.28Å; S107-D118 VanDerWaalsContact OG-CG 3.27Å; S107-D118 PolarHBondContact OG-OD1 3.13Å; S107-D118 PolarHBondContact OG-OD2 3.05Å; M116-D118 VanDerWaalsContact C-N 3.3Å; M116-D118 PolarHBondContact O-N 2.9Å
119C79.4Confident78.9Confident60 Ų6091.6 Ų91.641%0.40551%0.513SS..SBendtrans-71133.7178.3-68.90000110.7I117 G121I117-C119 VanDerWaalsContact C-N 3.27Å; I117-C119 PolarHBondContact O-N 2.94Å; C119-G121 PolarHBondContact O-N 3.16Å
120P73Confident78.9Confident86 Ų8688.2 Ų88.256%0.55851%0.505SS*.  trans-64.8128.617823.7-30.5000111.1T122 Q123P120-T122 PolarHBondContact O-N 3.44Å; P120-Q123 WeakPolarHBondContact O-CG 3.14Å; P120-Q123 PolarHBondContact O-NE2 3.05Å
121G66.1Low78.7Confident44 Ų4489.4 Ų89.445%0.45451%0.511SS..THydrogen-bonded Turntrans-78.215.7179.500000115.1C119C119-G121 PolarHBondContact O-N 3.16Å
122T64.7Low79Confident122 Ų12290.3 Ų90.375%0.74851%0.509SS*.THydrogen-bonded Turntrans-87.6-16.5179-280000112.5P120 D124P120-T122 PolarHBondContact O-N 3.44Å; T122-D124 PolarHBondContact O-N 2.51Å
123Q67.4Low79.1Confident150 Ų15088.1 Ų88.170%0.70150%0.499SS*.THydrogen-bonded Turntrans-79-13.7-167.960.9-171.6-27.500114.8P120P120-Q123 WeakPolarHBondContact O-CG 3.14Å; P120-Q123 PolarHBondContact O-NE2 3.05Å
124D69.3Low79.2Confident103 Ų10390.8 Ų90.855%0.55151%0.507SS*.THydrogen-bonded Turntrans-1234.9-172.662.8-23000113.2T122 S126T122-D124 PolarHBondContact O-N 2.51Å; D124-S126 PolarHBondContact O-N 3.19Å; D124-S126 VanDerWaalsContact O-N 3.13Å; D124-S126 PolarHBondContact OD1-N 2.86Å; D124-S126 PolarHBondContact OD1-OG 3.46Å; D124-S126 VanDerWaalsContact OD2-CB 3.31Å; D124-S126 WeakPolarHBondContact OD2-CB 3.33Å; D124-S126 PolarHBondContact OD2-OG 2.97Å
125G68.9Low79.3Confident57 Ų5790.9 Ų90.959%0.58851%0.507SS*.SBendtrans66.98.4179.700000114.7S127G125-S127 VanDerWaalsContact C-N 3.29Å; G125-S127 PolarHBondContact O-N 3.29Å
126S70.9Confident79.4Confident81 Ų8194.4 Ų94.457%0.56653%0.529SS*.  trans-87.89.8-174.972.30000114D124 L128D124-S126 PolarHBondContact O-N 3.19Å; D124-S126 VanDerWaalsContact O-N 3.13Å; D124-S126 PolarHBondContact OD1-N 2.86Å; D124-S126 PolarHBondContact OD1-OG 3.46Å; D124-S126 VanDerWaalsContact OD2-CB 3.31Å; D124-S126 WeakPolarHBondContact OD2-CB 3.33Å; D124-S126 PolarHBondContact OD2-OG 2.97Å; S126-L128 PolarHBondContact O-N 2.9Å
127S82.6Confident79.3Confident43 Ų4397.6 Ų97.630%0.30155%0.553SS.*  trans-63.4139-170.775.60000112.6G125 R129 S130 L131G125-S127 VanDerWaalsContact C-N 3.29Å; G125-S127 PolarHBondContact O-N 3.29Å; S127-R129 PolarHBondContact O-N 3.26Å; S127-R129 VanDerWaalsContact O-N 3.09Å; S127-S130 WeakPolarHBondContact O-CB 3.38Å; S127-S130 PolarHBondContact O-N 2.71Å; S127-S130 PolarHBondContact OG-N 3.24Å; S127-L131 PolarHBondContact O-N 2.93Å
128L86.9Confident78.5Confident121 Ų12199.3 Ų99.363%0.63457%0.568SS**Hα-helixtrans-53.7-32.1172.1-178.364.4000112S126 S130 L131 I132S126-L128 PolarHBondContact O-N 2.9Å; L128-S130 PolarHBondContact O-N 3.08Å; L128-L131 HydrophobicContact CD1-CD2 4.27Å; L128-L131 WeakPolarHBondContact O-CB 3.41Å; L128-L131 PolarHBondContact O-N 3.5Å; L128-I132 HydrophobicContact CD1-CD1 4.47Å; L128-I132 HydrophobicContact CD2-CD1 4.36Å; L128-I132 HydrophobicContact CG-CD1 3.89Å; L128-I132 HydrophobicContact CG-CG1 4.39Å; L128-I132 WeakPolarHBondContact O-CG1 3.47Å; L128-I132 PolarHBondContact O-N 3.17Å
129R87.2Confident77.7Confident200 Ų20099.3 Ų99.376%0.75558%0.583SS**Hα-helixtrans-62.6-41.9177.3-168.9167.6-176.8136.1-0.3112S127 L131 I132 E133S127-R129 PolarHBondContact O-N 3.26Å; S127-R129 VanDerWaalsContact O-N 3.09Å; R129-L131 VanDerWaalsContact C-N 3.29Å; R129-L131 PolarHBondContact O-N 3.05Å; R129-I132 PolarHBondContact O-N 3.03Å; R129-E133 VanDerWaalsContact O-CB 3.31Å; R129-E133 WeakPolarHBondContact O-CB 3.46Å; R129-E133 PolarHBondContact O-N 3.36Å
130S86.9Confident77.2Confident55 Ų55103.2 Ų103.239%0.38560%0.6SS.*Hα-helixtrans-63-37.5174.7-173.30000111.8S127 L128 K134S127-S130 WeakPolarHBondContact O-CB 3.38Å; S127-S130 PolarHBondContact O-N 2.71Å; S127-S130 PolarHBondContact OG-N 3.24Å; L128-S130 PolarHBondContact O-N 3.08Å; S130-K134 PolarHBondContact O-N 2.9Å
131L86.3Confident77.4Confident91 Ų91104.3 Ų104.348%0.47661%0.61SS.*Hα-helixtrans-68.1-38.9177.1-170.973.2000112S127 L128 R129 K134 P135 P136S127-L131 PolarHBondContact O-N 2.93Å; L128-L131 HydrophobicContact CD1-CD2 4.27Å; L128-L131 WeakPolarHBondContact O-CB 3.41Å; L128-L131 PolarHBondContact O-N 3.5Å; R129-L131 VanDerWaalsContact C-N 3.29Å; R129-L131 PolarHBondContact O-N 3.05Å; L131-K134 CarbonylContact O-C 3.26Å; L131-K134 VanDerWaalsContact O-C 3.26Å; L131-P135 WeakPolarHBondContact O-CA 3.33Å; L131-P135 VanDerWaalsContact O-N 3.13Å; L131-P136 VanDerWaalsContact CD1-CD 3.41Å; L131-P136 HydrophobicContact CD1-CG 3.5Å; L131-P136 VanDerWaalsContact CD1-CG 3.5Å
132I89Confident78.1Confident123 Ų123111.1 Ų111.163%0.63163%0.628SS**Hα-helixtrans-69.5-42.9176.7-67.6165.5000110.8L128 R129L128-I132 HydrophobicContact CD1-CD1 4.47Å; L128-I132 HydrophobicContact CD2-CD1 4.36Å; L128-I132 HydrophobicContact CG-CD1 3.89Å; L128-I132 HydrophobicContact CG-CG1 4.39Å; L128-I132 WeakPolarHBondContact O-CG1 3.47Å; L128-I132 PolarHBondContact O-N 3.17Å; R129-I132 PolarHBondContact O-N 3.03Å
133E88.8Confident79Confident138 Ų138110.4 Ų110.465%0.64563%0.627SS**Hα-helixtrans-69.4-37.7-178.9-173.5-177.8157.100111.9R129R129-E133 VanDerWaalsContact O-CB 3.31Å; R129-E133 WeakPolarHBondContact O-CB 3.46Å; R129-E133 PolarHBondContact O-N 3.36Å
134K86.7Confident79.9Confident150 Ų150108.9 Ų108.965%0.65263%0.63SS**SBendtrans-126.576.9178.6-65.3-179.6-178.3173.90108.6S130 L131S130-K134 PolarHBondContact O-N 2.9Å; L131-K134 CarbonylContact O-C 3.26Å; L131-K134 VanDerWaalsContact O-C 3.26Å
135P83.9Confident80.8Confident92 Ų92109.1 Ų109.160%0.59763%0.631SS**  trans-59.4129.2177.124.9-31.9000108.1L131 V137L131-P135 WeakPolarHBondContact O-CA 3.33Å; L131-P135 VanDerWaalsContact O-N 3.13Å; P135-V137 PolarHBondContact O-N 3.21Å
136P80.9Confident81.8Confident77 Ų77110.9 Ų110.950%0.563%0.63SS.*  trans-55.6137.5173.1-20.731.4000108.2L131 C138L131-P136 VanDerWaalsContact CD1-CD 3.41Å; L131-P136 HydrophobicContact CD1-CG 3.5Å; L131-P136 VanDerWaalsContact CD1-CG 3.5Å; P136-C138 PolarHBondContact O-N 3.23Å
137V78.8Confident82.8Confident148 Ų148109.8 Ų109.890%0.89763%0.632SS**  trans-7183.5177-174.80000107.8P135 G139P135-V137 PolarHBondContact O-N 3.21Å; V137-G139 VanDerWaalsContact C-N 3.29Å; V137-G139 PolarHBondContact O-N 3.16Å
138C66.3Low83.1Confident79 Ų79111.1 Ų111.153%0.53465%0.646SS.*  trans-8079175.4-66.60000108.7P136 N140P136-C138 PolarHBondContact O-N 3.23Å; C138-N140 PolarHBondContact O-N 3.3Å
139G68.5Low83.2Confident65 Ų65107.6 Ų107.667%0.6763%0.631SS**SBendtrans-68.5-23.9172.500000113V137V137-G139 VanDerWaalsContact C-N 3.29Å; V137-G139 PolarHBondContact O-N 3.16Å
140N68.4Low83.4Confident142 Ų142102.3 Ų102.376%0.75962%0.618SS**SBendtrans-139.2150.3-177.7-56.148.3000108.1C138C138-N140 PolarHBondContact O-N 3.3Å
141S76.9Confident83.5Confident110 Ų110103.7 Ų103.777%0.76962%0.624SS**PPolyproline II helixtrans-52.7152.6173.5500000111.6S143S141-S143 PolarHBondContact O-N 3.26Å; S141-S143 VanDerWaalsContact O-N 3.09Å
142F80.9Confident83.5Confident187 Ų187102.6 Ų102.682%0.8263%0.634SS**PPolyproline II helixtrans-54.4120176.5-64.5-77.6000110
143S83.4Confident83.6Confident106 Ų106103.5 Ų103.574%0.74163%0.634SS**PPolyproline II helixtrans-76.3126.7172.8-65.40000108.7S141S141-S143 PolarHBondContact O-N 3.26Å; S141-S143 VanDerWaalsContact O-N 3.09Å
144P86.1Confident83.6Confident118 Ų118106.4 Ų106.477%0.76664%0.639SS**PPolyproline II helixtrans-60.6142.3176.425.3-32.7000109.9T146P144-T146 PolarHBondContact O-N 3.12Å
145L88Confident83.6Confident109 Ų109107.1 Ų107.157%0.57165%0.649SS**PPolyproline II helixtrans-60.6128.3176.1-69176.6000109.9S149 L150 F153L145-S149 WeakPolarHBondContact CB-OG 3.32Å; L145-L150 HydrophobicContact CB-CD2 4.08Å; L145-L150 HydrophobicContact CB-CG 4.35Å; L145-L150 HydrophobicContact CD1-CD2 4.05Å; L145-F153 HydrophobicContact CD1-CE2 4.05Å; L145-F153 HydrophobicContact CD1-CZ 4.18Å
146T90.8Very high83.7Confident93 Ų93111.6 Ų111.657%0.57166%0.662SS**PPolyproline II helixtrans-73.7155.2176.463.50000110.7P144 A148 S149 L150P144-T146 PolarHBondContact O-N 3.12Å; T146-A148 PolarHBondContact O-N 3.03Å; T146-A148 VanDerWaalsContact O-N 3.1Å; T146-S149 PolarHBondContact N-OG 3.32Å; T146-S149 WeakPolarHBondContact O-CA 3.48Å; T146-S149 PolarHBondContact O-N 3.14Å; T146-S149 PolarHBondContact O-OG 2.64Å; T146-L150 PolarHBondContact O-N 3.15Å; T146-L150 VanDerWaalsContact O-N 3.1Å
147G90.9Very high84.1Confident58 Ų58115 Ų11560%0.59868%0.681SS**Hα-helixtrans-54.5-32.8178.900000114L150G147-L150 PolarHBondContact O-N 3.11Å
148A89.6Confident84.6Confident72 Ų72110.8 Ų110.860%0.59567%0.668SS**Hα-helixtrans-65.1-43.1173.400000112.1T146 L150 T151T146-A148 PolarHBondContact O-N 3.03Å; T146-A148 VanDerWaalsContact O-N 3.1Å; A148-L150 VanDerWaalsContact C-N 3.26Å; A148-L150 PolarHBondContact O-N 2.78Å; A148-T151 WeakPolarHBondContact O-CB 3.44Å; A148-T151 WeakPolarHBondContact O-CG2 3.46Å; A148-T151 PolarHBondContact O-N 3.09Å; A148-T151 PolarHBondContact O-OG1 2.81Å
149S88.6Confident85.6Confident47 Ų47113.2 Ų113.233%0.32968%0.683SS.*Hα-helixtrans-66.8-27.1176.3690000113.2L145 T146 T151L145-S149 WeakPolarHBondContact CB-OG 3.32Å; T146-S149 PolarHBondContact N-OG 3.32Å; T146-S149 WeakPolarHBondContact O-CA 3.48Å; T146-S149 PolarHBondContact O-N 3.14Å; T146-S149 PolarHBondContact O-OG 2.64Å; S149-T151 PolarHBondContact O-N 3.48Å
150L91.4Very high86.4Confident89 Ų89114.4 Ų114.447%0.46667%0.673SS.*Hα-helixtrans-70.7-17.2176.1-68.9176.6000113.5L145 T146 G147 A148 G152 F153L145-L150 HydrophobicContact CB-CD2 4.08Å; L145-L150 HydrophobicContact CB-CG 4.35Å; L145-L150 HydrophobicContact CD1-CD2 4.05Å; T146-L150 PolarHBondContact O-N 3.15Å; T146-L150 VanDerWaalsContact O-N 3.1Å; G147-L150 PolarHBondContact O-N 3.11Å; A148-L150 VanDerWaalsContact C-N 3.26Å; A148-L150 PolarHBondContact O-N 2.78Å; L150-G152 PolarHBondContact O-N 3.01Å; L150-F153 HydrophobicContact CD2-CD2 4.12Å; L150-F153 HydrophobicContact CD2-CE2 4.29Å; L150-F153 PolarHBondContact O-N 3.31Å
151T88.6Confident87.2Confident83 Ų83111 Ų11151%0.50966%0.659SS.*G310 helixtrans-61.5-29.4179.462.60000112.9A148 S149 F153 R154A148-T151 WeakPolarHBondContact O-CB 3.44Å; A148-T151 WeakPolarHBondContact O-CG2 3.46Å; A148-T151 PolarHBondContact O-N 3.09Å; A148-T151 PolarHBondContact O-OG1 2.81Å; S149-T151 PolarHBondContact O-N 3.48Å; T151-F153 PolarHBondContact O-N 2.7Å; T151-R154 WeakPolarHBondContact O-CB 3.38Å; T151-R154 WeakPolarHBondContact O-CG 3.31Å; T151-R154 PolarHBondContact O-N 3.14Å
152G87.5Confident87.3Confident68 Ų68112 Ų11270%0.70165%0.652SS**G310 helixtrans-69.8-13.4176.100000114.9L150L150-G152 PolarHBondContact O-N 3.01Å
153F90.4Very high87.2Confident142 Ų142110.4 Ų110.462%0.62365%0.647SS**G310 helixtrans-91.22177.3-63.9-91.6000113.1L145 L150 T151 L155L145-F153 HydrophobicContact CD1-CE2 4.05Å; L145-F153 HydrophobicContact CD1-CZ 4.18Å; L150-F153 HydrophobicContact CD2-CD2 4.12Å; L150-F153 HydrophobicContact CD2-CE2 4.29Å; L150-F153 PolarHBondContact O-N 3.31Å; T151-F153 PolarHBondContact O-N 2.7Å; F153-L155 PolarHBondContact O-N 2.87Å
154R89.6Confident87Confident199 Ų199111.8 Ų111.875%0.75164%0.636SS**  trans-68.9115175.9-69.4176177.1-94.10.1109.2T151T151-R154 WeakPolarHBondContact O-CB 3.38Å; T151-R154 WeakPolarHBondContact O-CG 3.31Å; T151-R154 PolarHBondContact O-N 3.14Å
155L86.4Confident86.5Confident166 Ų166112.2 Ų112.287%0.86962%0.623SS**PPolyproline II helixtrans-76.9137.5177.4-59.3178.5000110.5F153F153-L155 PolarHBondContact O-N 2.87Å
156H86.6Confident85.6Confident186 Ų186111 Ų11186%0.86162%0.616SS**PPolyproline II helixtrans-78.1142.9167.6-67.4-72.1000110.2
157T88.1Confident84.4Confident148 Ų148112.5 Ų112.591%0.90862%0.618SS**SBendtrans-65.5134173.953.80000110.2
158G89.4Confident83.3Confident60 Ų60116.8 Ų116.862%0.61962%0.623SS**SBendtrans161.3172.917900000112.1L160G158-L160 PolarHBondContact O-N 3.45Å
159P87.4Confident82.2Confident129 Ų129117.4 Ų117.484%0.83862%0.615SS**PPolyproline II helixtrans-64.9131.4174.827.3-32.7000110.5
160L84.4Confident80.9Confident91 Ų91120.8 Ų120.848%0.47663%0.626SS.*PPolyproline II helixtrans-65132.3176.9-173.171.7000110G158 Y164 R165G158-L160 PolarHBondContact O-N 3.45Å; L160-Y164 HydrophobicContact CD1-CD2 4.48Å; L160-R165 HydrophobicContact CB-CG 4.5Å; L160-R165 HydrophobicContact CD2-CG 4.46Å
161P86.1Confident79.5Confident71 Ų71120 Ų12046%0.46163%0.626SS.*PPolyproline II helixtrans-52.2145.3177-26.332.8000112.3Q163 Y164 R165P161-Q163 PolarHBondContact O-N 3.38Å; P161-Q163 VanDerWaalsContact O-N 3.12Å; P161-Y164 HydrophobicContact CB-CD2 3.78Å; P161-Y164 HydrophobicContact CB-CE2 4.13Å; P161-Y164 HydrophobicContact CG-CD2 3.94Å; P161-Y164 HydrophobicContact CG-CE2 4.16Å; P161-Y164 PolarHBondContact O-N 3.45Å; P161-R165 PolarHBondContact O-N 3.46Å
162E80Confident78.2Confident131 Ų131121.6 Ų121.661%0.61264%0.637SS**Hα-helixtrans-54.4-39.4-170.5175.5157.6-130.100113.6Y164 R165E162-Y164 VanDerWaalsContact C-N 3.26Å; E162-Y164 PolarHBondContact O-N 3.38Å; E162-R165 VanDerWaalsContact CD-NH2 3.35Å; E162-R165 WeakPolarHBondContact O-CB 3.41Å; E162-R165 PolarHBondContact O-N 2.92Å; E162-R165 IonicContact OE1-NH2 2.92Å; E162-R165 PolarHBondContact OE1-NH2 3.39Å
163Q78.3Confident76.9Confident153 Ų153126.5 Ų126.572%0.71564%0.639SS**Hα-helixtrans-59.6-35.1-179.5-62.2169.3-68.600112.4P161P161-Q163 PolarHBondContact O-N 3.38Å; P161-Q163 VanDerWaalsContact O-N 3.12Å
164Y78.2Confident75.4Confident134 Ų134129.8 Ų129.853%0.52565%0.654SS.*Hα-helixtrans-88.6-14-178.2-54.5-60.8000113.3L160 P161 E162 L166L160-Y164 HydrophobicContact CD1-CD2 4.48Å; P161-Y164 HydrophobicContact CB-CD2 3.78Å; P161-Y164 HydrophobicContact CB-CE2 4.13Å; P161-Y164 HydrophobicContact CG-CD2 3.94Å; P161-Y164 HydrophobicContact CG-CE2 4.16Å; P161-Y164 PolarHBondContact O-N 3.45Å; E162-Y164 VanDerWaalsContact C-N 3.26Å; E162-Y164 PolarHBondContact O-N 3.38Å; Y164-L166 VanDerWaalsContact C-N 3.26Å; Y164-L166 PolarHBondContact O-N 3.28Å
165R77Confident73.7Confident127 Ų127129 Ų12948%0.47966%0.655SS.*Hα-helixtrans-63-36.2175.2-62.7-167.5-63.5-153.1-1.4111.6L160 P161 E162 M167 I169L160-R165 HydrophobicContact CB-CG 4.5Å; L160-R165 HydrophobicContact CD2-CG 4.46Å; P161-R165 PolarHBondContact O-N 3.46Å; E162-R165 VanDerWaalsContact CD-NH2 3.35Å; E162-R165 WeakPolarHBondContact O-CB 3.41Å; E162-R165 PolarHBondContact O-N 2.92Å; E162-R165 IonicContact OE1-NH2 2.92Å; E162-R165 PolarHBondContact OE1-NH2 3.39Å; R165-M167 VanDerWaalsContact C-N 3.35Å; R165-M167 PolarHBondContact O-N 3.18Å; R165-I169 WeakPolarHBondContact O-CD1 3.31Å; R165-I169 WeakPolarHBondContact O-CG1 3.19Å
166L68.7Low72.2Confident84 Ų84126.3 Ų126.344%0.4465%0.651SS.*THydrogen-bonded Turntrans-73.9-21.6-173-64.3164.9000113.8M116 Y164 H168 I169M116-L166 HydrophobicContact CE-CB 4.3Å; Y164-L166 VanDerWaalsContact C-N 3.26Å; Y164-L166 PolarHBondContact O-N 3.28Å; L166-H168 VanDerWaalsContact C-N 3.3Å; L166-H168 PolarHBondContact O-N 3.4Å; L166-I169 HydrophobicContact CD2-CD1 3.92Å; L166-I169 PolarHBondContact O-N 3.27Å
167M66Low70.7Confident124 Ų124125.6 Ų125.661%0.61165%0.645SS**THydrogen-bonded Turntrans-64.1-33.6178.7-76.7-125.564.400113G115 R165G115-M167 WeakPolarHBondContact CA-O 3.26Å; R165-M167 VanDerWaalsContact C-N 3.35Å; R165-M167 PolarHBondContact O-N 3.18Å
168H66.4Low69Low149 Ų149125.2 Ų125.269%0.6964%0.638SS**SBendtrans-95.3-9.6-178.5-58.598.2000113.4L166 Q170L166-H168 VanDerWaalsContact C-N 3.3Å; L166-H168 PolarHBondContact O-N 3.4Å; H168-Q170 PolarHBondContact O-N 3.37Å; H168-Q170 VanDerWaalsContact O-N 3.14Å
169I67.9Low67.3Low84 Ų84130.1 Ų130.143%0.43164%0.642SS.*  trans-72.8112.6-177.9-71.8167.1000108.1R165 L166R165-I169 WeakPolarHBondContact O-CD1 3.31Å; R165-I169 WeakPolarHBondContact O-CG1 3.19Å; L166-I169 HydrophobicContact CD2-CD1 3.92Å; L166-I169 PolarHBondContact O-N 3.27Å
170Q61.4Low65.7Low119 Ų119132.4 Ų132.456%0.55664%0.641SS**  trans-57.1138.5170.3-73.2-176.18.100109.2H168H168-Q170 PolarHBondContact O-N 3.37Å; H168-Q170 VanDerWaalsContact O-N 3.14Å
171P61.6Low63.8Low71 Ų71137.5 Ų137.546%0.46166%0.659SS.*  trans-51.5129.2173.9-22.930.9000109K173P171-K173 PolarHBondContact O-N 3.17Å
172P60.6Low62.1Low117 Ų117142.7 Ų142.776%0.7668%0.677SS**  trans-57.8113.6-176.219.2-29.7000108.9K174P172-K174 PolarHBondContact O-N 3.48Å
173K61.5Low60.4Low171 Ų171144.3 Ų144.374%0.74368%0.684SS**  trans-58110.3174-69.3-175179.7176.30106.6P171 K175P171-K173 PolarHBondContact O-N 3.17Å; K173-K175 PolarHBondContact O-N 3.09Å
174K57.2Low58.6Low211 Ų211147.1 Ų147.192%0.91769%0.688SS**  trans-6384.2175.8-69.7-175179.9-179.80108.5P172 S176P172-K174 PolarHBondContact O-N 3.48Å; K174-S176 PolarHBondContact O-N 3.19Å
175K55.5Low57.1Low182 Ų182145.6 Ų145.679%0.79170%0.695SS**  trans-64.5106.1162.8-67-173.5-178.1-178.10105.2K173 K177K173-K175 PolarHBondContact O-N 3.09Å; K175-K177 PolarHBondContact O-N 2.94Å
176S53.4Low55.5Low111 Ų111147.2 Ų147.278%0.77671%0.708SS**  trans-54.989.9169.9177.30000108.4K174 N178K174-S176 PolarHBondContact O-N 3.19Å; S176-N178 PolarHBondContact O-N 3.44Å
177K54.9Low54Low171 Ų171150.2 Ų150.274%0.74372%0.724SS**  trans-76.686.4166.6-80.5-177.6-179.9171.30105.9K175 K179K175-K177 PolarHBondContact O-N 2.94Å; K177-K179 PolarHBondContact O-N 3Å
178N54.2Low53.2Low139 Ų139150.2 Ų150.274%0.74373%0.734SS**  trans-6880157.1-138.317.2000106.9S176S176-N178 PolarHBondContact O-N 3.44Å
179K53.2Low51.9Low164 Ų164150.8 Ų150.871%0.71374%0.74SS**  trans-101.996.3164.4-75.4-164.9177.2-168.90107K177 K181K177-K179 PolarHBondContact O-N 3Å; K179-K181 VanDerWaalsContact C-N 3.32Å; K179-K181 PolarHBondContact O-N 3.12Å
180H53.8Low50.7Low176 Ų176152.1 Ų152.182%0.81575%0.754SS**  trans-57.5102.3150.8-81.5-67000107.5
181K43.5Very low49.7Very low199 Ų199155.8 Ų155.887%0.86577%0.771SS**  trans-119.998.2157.2-143.7178.6-176-169.20106.4K179K179-K181 VanDerWaalsContact C-N 3.32Å; K179-K181 PolarHBondContact O-N 3.12Å
182H51.2Low48.5Very low180 Ų180161.2 Ų161.283%0.83379%0.791SS**  trans-65.3140.7173-140-84000108.7
183H44.6Very low47.6Very low164 Ų164162.1 Ų162.176%0.75979%0.794SS**  trans-39.2143.9-178.3-90.1-81.8000117.5
184R40.8Very low46.6Very low212 Ų212160.1 Ų160.180%0.880%0.799SS**  -131.3117.3128.6-166.9172.5-170168.82.2107.9
185P46Very low45.7Very low103 Ų103155.9 Ų155.967%0.66980%0.796SS**  trans-73.5123.7163.1-0.719.1000107
186Q42.9Very low44.9Very low161 Ų161154.2 Ų154.275%0.75280%0.795SS**  trans-110.8137.5153.1-87.8-153.5-27.500107.4
187D38.4Very low44.1Very low146 Ų146154.3 Ų154.378%0.78180%0.796SS**PPolyproline II helixtrans-58.4139.8-166.7-58.4-64.5000113.5
188P47.5Very low43.4Very low125 Ų125152.5 Ų152.581%0.81280%0.795SS**PPolyproline II helixtrans-79.4125.2164.1-5.923.7000109.8
189I39.2Very low43.1Very low160 Ų160151.8 Ų151.882%0.82180%0.797SS**PPolyproline II helixtrans-74.9137.7167.1-59.4170.6000108.3
190P42.9Very low42.8Very low112 Ų112152.9 Ų152.973%0.72780%0.802SS**PPolyproline II helixtrans-75.7139-169.9-13.229.8000113.4
191Q41.5Very low42.6Very low196 Ų196154.4 Ų154.492%0.91681%0.806SS**  trans-107.8125157.2-80.2-170.2-30.300108.9
192E36Very low43.1Very low186 Ų186155 Ų15587%0.86981%0.809SS**  trans-76.9128.2-177-53-146.9116.300111.3
193T40.9Very low43Very low135 Ų135156.2 Ų156.283%0.82881%0.812SS**  trans-146.7130.4146.244.10000107.6
194P41.3Very low43.2Very low130 Ų130158.3 Ų158.384%0.84482%0.819SS**  trans-91.2119.7177.233.2-26.4000109.1
195S38.5Very low43.4Very low122 Ų122158 Ų15885%0.85382%0.823SS**  trans-146.8111153.7-163.20000110
196D37.3Very low43.5Very low146 Ų146164.7 Ų164.778%0.78184%0.835SS**  trans-57.1135.8175.9-178.426.5000113.1
197S37.6Very low43.6Very low113 Ų113163.6 Ų163.679%0.7984%0.835SS**  trans171.394147.3-76.20000112.6
198D41.1Very low44.3Very low134 Ų134163.6 Ų163.672%0.71783%0.834SS**  trans36.2122.6142.5-150-8000122.7
199P46.3Very low44.9Very low123 Ų123160.7 Ų160.780%0.79981%0.812SS**  trans-119.5112.3165.535.9-20.6000114.3
200K48.4Very low45.9Very low188 Ų188157.6 Ų157.682%0.81780%0.803SS**  trans-128.7101.4160.1-80-177.1-177.2168.10112.4
201K48.3Very low46.8Very low207 Ų207157.2 Ų157.290%0.979%0.794SS**  trans-179.5103.2133-101.8168.7-176.7175.90113.1
202K53.3Low47.7Very low212 Ų212157.8 Ų157.892%0.92279%0.788SS**  trans27.592.8145.6-70.9-178175176.20118
203K50.3Low49Very low205 Ų205156.6 Ų156.689%0.89178%0.78SS**  trans-94.8111.3147.5-119.1177.6-175.9172.70108.8K205K203-K205 PolarHBondContact O-N 3.21Å
204K48.5Very low50.4Low208 Ų208157.1 Ų157.190%0.90477%0.771SS**  trans-52105.2170.9-136.3172.6-176.11760108.1R206K204-R206 PolarHBondContact O-N 3.33Å; K204-R206 VanDerWaalsContact O-N 3.11Å
205K45.3Very low51.8Low206 Ų206159.1 Ų159.190%0.89677%0.766SS**  trans-59.4115.4165.7-86.1-173176.1-179.40106.3K203 D207K203-K205 PolarHBondContact O-N 3.21Å; K205-D207 PolarHBondContact O-N 3.44Å
206R47.8Very low53.3Low243 Ų243161.5 Ų161.592%0.91776%0.761SS**  trans-70.1115.2171.3-157.8-175.8-165.3-163.86.2105.6K204 D208K204-R206 PolarHBondContact O-N 3.33Å; K204-R206 VanDerWaalsContact O-N 3.11Å; R206-D208 PolarHBondContact O-N 3.2Å
207D45.4Very low55.1Low139 Ų139161.6 Ų161.674%0.74376%0.755SS**  trans-53.898176.4-138.8-91.3000109.6K205 D209K205-D207 PolarHBondContact O-N 3.44Å; D207-D209 PolarHBondContact O-N 3.33Å; D207-D209 VanDerWaalsContact O-N 3.1Å
208D53.8Low56.7Low145 Ų145160.3 Ų160.378%0.77574%0.739SS**  trans-82.670.1167-151-91.1000106.7R206 P210R206-D208 PolarHBondContact O-N 3.2Å; D208-P210 VanDerWaalsContact O-CD 3.25Å; D208-P210 WeakPolarHBondContact O-CD 3.4Å
209D58.3Low58.2Low65 Ų65161 Ų16135%0.34874%0.736SS.*  trans-71.3112.2178.1-176.4-0.3000109.2D207 D211 R212D207-D209 PolarHBondContact O-N 3.33Å; D207-D209 VanDerWaalsContact O-N 3.1Å; D209-D211 PolarHBondContact O-N 3.07Å; D209-D211 VanDerWaalsContact O-N 3.09Å; D209-D211 WeakPolarHBondContact OD1-CB 3.41Å; D209-D211 PolarHBondContact OD1-N 3.32Å; D209-R212 PolarHBondContact O-N 3.39Å
210P61Low59.6Low95 Ų95162.7 Ų162.762%0.61773%0.73SS**Hα-helixtrans-59.6-20.3179.224.8-33.3000112.9D208 K213 K214D208-P210 VanDerWaalsContact O-CD 3.25Å; D208-P210 WeakPolarHBondContact O-CD 3.4Å; P210-K213 PolarHBondContact O-N 3.24Å; P210-K214 PolarHBondContact O-N 3.48Å
211D61.3Low60.7Low104 Ų104160 Ų16056%0.55672%0.719SS**Hα-helixtrans-71.1-35.3-179.6-91.5-63.7000113.6D209 K213 K214 K215D209-D211 PolarHBondContact O-N 3.07Å; D209-D211 VanDerWaalsContact O-N 3.09Å; D209-D211 WeakPolarHBondContact OD1-CB 3.41Å; D209-D211 PolarHBondContact OD1-N 3.32Å; D211-K213 PolarHBondContact O-N 2.61Å; D211-K214 PolarHBondContact O-N 3.13Å; D211-K215 WeakPolarHBondContact O-CB 3.41Å; D211-K215 PolarHBondContact O-N 3.33Å
212R60.8Low61.7Low207 Ų207157.4 Ų157.478%0.78171%0.708SS**Hα-helixtrans-63.8-32.6173.6-94.2-177.5172.5-171.1-0.9112D209 K216D209-R212 PolarHBondContact O-N 3.39Å; R212-K216 PolarHBondContact O-N 2.98Å
213K64Low62.4Low162 Ų162154.9 Ų154.970%0.70470%0.696SS**Hα-helixtrans-73.6-38.6178.9-157.7173.3-175.4175.70111.6P210 D211 K216 K217P210-K213 PolarHBondContact O-N 3.24Å; D211-K213 PolarHBondContact O-N 2.61Å; K213-K216 PolarHBondContact O-N 2.98Å; K213-K217 PolarHBondContact O-N 3.22Å
214K70.3Confident62.9Low146 Ų146151.8 Ų151.864%0.63569%0.69SS**Hα-helixtrans-65.1-44.9174.7-163.2174.7179.7-177.40111.4P210 D211 K216 K217 D218P210-K214 PolarHBondContact O-N 3.48Å; D211-K214 PolarHBondContact O-N 3.13Å; K214-K216 VanDerWaalsContact C-N 3.32Å; K214-K216 PolarHBondContact O-N 3.35Å; K214-K217 PolarHBondContact O-N 3.37Å; K214-K217 VanDerWaalsContact O-N 3.16Å; K214-D218 PolarHBondContact O-N 3.1Å
215K69.9Low63.5Low172 Ų172152.2 Ų152.275%0.74869%0.686SS**Hα-helixtrans-62.5-34.1178.7-153.3169.6-172.1172.30113.2D211 K219D211-K215 WeakPolarHBondContact O-CB 3.41Å; D211-K215 PolarHBondContact O-N 3.33Å; K215-K219 PolarHBondContact O-N 3.49Å
216K71.3Confident64.2Low171 Ų171150.7 Ų150.774%0.74368%0.681SS**Hα-helixtrans-73.1-36.7175.5-166.4173.7-177.5177.80112.7R212 K213 K214 K220R212-K216 PolarHBondContact O-N 2.98Å; K213-K216 PolarHBondContact O-N 2.98Å; K214-K216 VanDerWaalsContact C-N 3.32Å; K214-K216 PolarHBondContact O-N 3.35Å; K216-K220 PolarHBondContact O-N 3.34Å
217K75.2Confident64.2Low148 Ų148144.2 Ų144.264%0.64367%0.673SS**Hα-helixtrans-67.7-39.5176.2-167.5176.8-178.9-1790111.4K213 K214 K220 K221K213-K217 PolarHBondContact O-N 3.22Å; K214-K217 PolarHBondContact O-N 3.37Å; K214-K217 VanDerWaalsContact O-N 3.16Å; K217-K220 PolarHBondContact O-N 3.45Å; K217-K221 PolarHBondContact O-N 2.93Å; K217-K221 VanDerWaalsContact O-N 3.09Å
218D69.7Low64.8Low87 Ų87142.9 Ų142.947%0.46567%0.672SS.*Hα-helixtrans-67.2-42.7177.6-123.9-72.3000112.6K214 K220 K221 K222K214-D218 PolarHBondContact O-N 3.1Å; D218-K220 VanDerWaalsContact C-N 3.25Å; D218-K220 PolarHBondContact O-N 2.9Å; D218-K221 PolarHBondContact O-N 3.09Å; D218-K221 VanDerWaalsContact O-N 3.15Å; D218-K222 PolarHBondContact O-N 3.48Å
219K74.2Confident64.2Low148 Ų148143.6 Ų143.664%0.64368%0.676SS**Hα-helixtrans-62.4-31.9175.5-163.3168.2-175.5174.10112.5K215 K223K215-K219 PolarHBondContact O-N 3.49Å; K219-K223 WeakPolarHBondContact O-CG 3.49Å; K219-K223 PolarHBondContact O-N 2.65Å
220K73.7Confident63.5Low158 Ų158149.5 Ų149.569%0.68770%0.701SS**Hα-helixtrans-73.5-37.9174.9-163.8174.4-178.7-178.20112K216 K217 D218 K223 N224K216-K220 PolarHBondContact O-N 3.34Å; K217-K220 PolarHBondContact O-N 3.45Å; D218-K220 VanDerWaalsContact C-N 3.25Å; D218-K220 PolarHBondContact O-N 2.9Å; K220-K223 PolarHBondContact O-N 3.3Å; K220-N224 PolarHBondContact O-N 2.9Å
221K71.9Confident62.9Low133 Ų133150.6 Ų150.658%0.57871%0.708SS**Hα-helixtrans-66.4-38173.9-79.8-171.4171.8-1710112.9K217 D218 N224 R225K217-K221 PolarHBondContact O-N 2.93Å; K217-K221 VanDerWaalsContact O-N 3.09Å; D218-K221 PolarHBondContact O-N 3.09Å; D218-K221 VanDerWaalsContact O-N 3.15Å; K221-N224 PolarHBondContact O-N 3.1Å; K221-R225 PolarHBondContact O-N 2.65Å
222K69.8Low61.5Low152 Ų152148.8 Ų148.866%0.66171%0.714SS**Hα-helixtrans-66.3-37.5175.8-80.5-171.9174.7-175.10113.1D218 N224 R225D218-K222 PolarHBondContact O-N 3.48Å; K222-N224 VanDerWaalsContact C-N 3.33Å; K222-N224 PolarHBondContact O-N 3.01Å; K222-R225 PolarHBondContact O-N 3.05Å
223K68.6Low60.6Low158 Ų158147.6 Ų147.669%0.68772%0.722SS**Hα-helixtrans-67.8-31.3175.8-73.7-168.3173.6-160.10113.4K219 K220 R225K219-K223 WeakPolarHBondContact O-CG 3.49Å; K219-K223 PolarHBondContact O-N 2.65Å; K220-K223 PolarHBondContact O-N 3.3Å; K223-R225 VanDerWaalsContact C-N 3.3Å; K223-R225 PolarHBondContact O-N 3.36Å
224N60.7Low59.3Low140 Ų140144.7 Ų144.775%0.74973%0.729SS**THydrogen-bonded Turntrans-79.1-5.9176.8-93.541.7000114.5K220 K221 K222K220-N224 PolarHBondContact O-N 2.9Å; K221-N224 PolarHBondContact O-N 3.1Å; K222-N224 VanDerWaalsContact C-N 3.33Å; K222-N224 PolarHBondContact O-N 3.01Å
225R61.5Low57.7Low218 Ų218141.8 Ų141.882%0.82374%0.74SS**THydrogen-bonded Turntrans-98.5-3.5177.2-77.1-171.9178.2-169.3-1.4114.2K221 K222 K223K221-R225 PolarHBondContact O-N 2.65Å; K222-R225 PolarHBondContact O-N 3.05Å; K223-R225 VanDerWaalsContact C-N 3.3Å; K223-R225 PolarHBondContact O-N 3.36Å
226H59.1Low56.3Low174 Ų174139.2 Ų139.281%0.80674%0.744SS**  trans-124.452.6178.5-78.3-43.1000111.9
227S46.9Very low54.9Low106 Ų106139.5 Ų139.574%0.74175%0.748SS**  trans-107115.5150.9-153.90000106.4
228P58.1Low53.7Low112 Ų112137.9 Ų137.973%0.72775%0.752SS**PPolyproline II helixtrans-64.8139171.9-12.127000109.2
229D42.7Very low52.1Low159 Ų159141 Ų14185%0.8577%0.769SS**PPolyproline II helixtrans-48.7133.7168.4-69.9-70000111.6
230H43.4Very low50.7Low189 Ų189138.6 Ų138.688%0.87577%0.77SS**PPolyproline II helixtrans-90118.8157.1-111.8-77000107.5
231P47.3Very low49.1Very low119 Ų119138.6 Ų138.677%0.77378%0.778SS**PPolyproline II helixtrans-85.9142164.433.9-27.9000109.1
232G32.9Very low47.8Very low65 Ų65136.9 Ų136.967%0.6778%0.783SS**  trans137.1100.5153.700000117.3
233L41.3Very low46.6Very low182 Ų182137.4 Ų137.495%0.95379%0.792SS**  trans72.996.7131.7-60.6159.2000118.7
234A36.4Very low45.3Very low102 Ų102145.1 Ų145.184%0.84382%0.817SS**  175.981.9118.100000109.7
235G36.5Very low44.5Very low84 Ų84145.4 Ų145.487%0.86682%0.82SS**  trans-91.6101.3162.900000108.7
236S42.1Very low43.6Very low119 Ų119141.5 Ų141.583%0.83282%0.82SS**PPolyproline II helixtrans-73.8140.9161.348.90000109.4
237Q41.1Very low42.8Very low177 Ų177139.7 Ų139.783%0.82782%0.821SS**PPolyproline II helixtrans-51.1158.4-172.7-76.8-102.3-62.600116.1
238P49.3Very low42.5Very low114 Ų114141.7 Ų141.774%0.7483%0.826SS**PPolyproline II helixtrans-81136.2171.834.4-29.2000109.9
239N36.4Very low41.6Very low152 Ų152143.6 Ų143.681%0.81383%0.832SS**  trans-129.1117.4160.2-157.412.5000110
240S45.7Very low41.5Very low97 Ų97142.5 Ų142.568%0.67883%0.83SS**  trans-74.4131.6169.541.80000110.7
241N39.7Very low41.4Very low158 Ų158139.2 Ų139.285%0.84583%0.827SS**  trans168.2151.2150.8-93.8-15.6000108.4
242S44.8Very low40.9Very low98 Ų98140.8 Ų140.869%0.68583%0.831SS**  cis-165.8163.3-31.3-1680000103.3R244S242-R244 PolarHBondContact O-N 2.76Å
243L43.3Very low41.6Very low162 Ų162147.1 Ų147.185%0.84885%0.845SS**  trans-44.8132.6173.3-74.778.6000113.1
244R42.3Very low41.6Very low320 Ų320143.9 Ų143.9100%1.20884%0.835SS**  -1770118.1-102.7-175.1-178.5-174.51.7111.2S242S242-R244 PolarHBondContact O-N 2.76Å

Retrieved 244 of 244 residues in 137.6 ms (Link to these results)