A0A087XYJ2_POEFO Loading...

Chromosome 1 open reading frame 50

AlphaFold DB , UniProt , Accession A0A087XYJ2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 235 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M42.5Very low39.1Very low244 Ų244155.9 Ų155.9100%1.20284%0.835SS**  0102.10-159.8168.3-153.600106.7
2F30.7Very low38.7Very low194 Ų194157.7 Ų157.785%0.85184%0.842SS**  trans-66149.8170.2-90.2-106.2000109.1
3V36.8Very low38.6Very low119 Ų119154.6 Ų154.672%0.72183%0.833SS**  174.3111.7116.5162.40000107.9L5V3-L5 HydrophobicContact CG1-CD1 4.17Å; V3-L5 HydrophobicContact CG1-CG 4.28Å
4L41.5Very low38.4Very low156 Ų156155.1 Ų155.182%0.81783%0.834SS**  trans-59.7138.7153.5-77.9150.1000109.2
5L40.9Very low37.7Very low156 Ų156151.4 Ų151.482%0.81782%0.823SS**  trans-146.3105.3150.6-99163.4000110.5V3V3-L5 HydrophobicContact CG1-CD1 4.17Å; V3-L5 HydrophobicContact CG1-CG 4.28Å
6T38.6Very low37.3Very low114 Ų114154.4 Ų154.470%0.69983%0.829SS**  trans-62.4143.9157.248.10000111.4
7T46.2Very low37Very low142 Ų142152.1 Ų152.187%0.87182%0.822SS**  trans-154138.9146.4530000112.1
8E35.8Very low36.9Very low193 Ų193151.9 Ų151.990%0.90283%0.827SS**  trans-82.9159.1-171.7-62.1-178.6123.700116
9A34.7Very low36.6Very low89 Ų89155.7 Ų155.774%0.73683%0.828SS**  trans10.4136.7141.400000122.3
10K38.6Very low36.2Very low202 Ų202153.3 Ų153.388%0.87882%0.824SS**  171.3166.5106.6-97.1-175.9179.3166.90113.4
11P44.3Very low36Very low106 Ų106152 Ų15269%0.68883%0.826SS**  trans-104.3164.9-138.540.6-36000115
12L34Very low35.7Very low177 Ų177145.4 Ų145.493%0.92781%0.805SS**  trans-92.8121.7166.1-111129.1000110.2
13V36.6Very low35.9Very low118 Ų118148 Ų14872%0.71581%0.809SS**  trans-107.6128168.9173.90000107.6
14L36.1Very low35.7Very low162 Ų162147.9 Ų147.985%0.84881%0.814SS**  trans-157.6100153.2-134.490.3000104.9
15C28.8Very low35.4Very low99 Ų99146.9 Ų146.967%0.66982%0.816SS**  55.591.677-154.40000112.9
16E31.5Very low34.9Very low199 Ų199143.6 Ų143.693%0.9381%0.812SS**  trans-134.2139.1146.6-96.6-171.317000110.9
17T31.6Very low34.4Very low115 Ų115147.9 Ų147.971%0.70682%0.821SS**  trans-101.8125.7-165.6-68.70000108.5
18V34.8Very low33.5Very low150 Ų150144.6 Ų144.691%0.90982%0.815SS**  trans-134.8127.4153.5175.10000111
19R31.3Very low33.1Very low223 Ų223146.5 Ų146.584%0.84281%0.814SS**  trans-48.4133.5-175.3-83.8168.2172-178.9-2.7117.2
20S29.3Very low33.1Very low108 Ų108152.1 Ų152.176%0.75582%0.822SS**  trans9.6125.613164.70000119.5
21S31.1Very low32.9Very low125 Ų125151.9 Ų151.987%0.87482%0.821SS**  trans-139121.3135.1-168.80000110.1
22S36.3Very low32.4Very low106 Ų106150.4 Ų150.474%0.74183%0.826SS**  trans-78135.5-174.549.70000112.5
23R34.5Very low32.3Very low248 Ų248146 Ų14694%0.93682%0.822SS**  trans-157.3101.6146-105.2170.4-146.3-121.44.3109.3
24S33.6Very low32.1Very low118 Ų118146.6 Ų146.683%0.82582%0.822SS**  trans-81.8155.2161.8-56.60000109.6
25P34.1Very low32Very low134 Ų134146.6 Ų146.687%0.8782%0.822SS**  -121.8147.8127.98.211.6000111.5
26A32Very low32.2Very low88 Ų88150.5 Ų150.573%0.72783%0.827SS**  trans-78.2147.6-172.300000114.1
27F26.6Very low32.2Very low204 Ų204147.2 Ų147.290%0.89582%0.821SS**  trans56.5125142.8-88.3-94.1000122.2
28G28.6Very low32.2Very low73 Ų73146.3 Ų146.375%0.75383%0.826SS**  trans-178.182.6154.500000112K30G28-K30 PolarHBondContact O-N 3.4Å
29W26.8Very low32Very low232 Ų232148.2 Ų148.288%0.87982%0.824SS**  trans-77.1118.5168.2-83.740.8000109.6
30K33.8Very low31.9Very low207 Ų207146.7 Ų146.790%0.982%0.824SS**  trans-120.4120.3154.5-89.7-168.8177.6-170.20109G28G28-K30 PolarHBondContact O-N 3.4Å
31K36Very low32.1Very low197 Ų197151 Ų15186%0.85783%0.829SS**  trans-73.1136.7163.3-73.9-168.3178.4-1780108.8
32G33.3Very low32.1Very low76 Ų76150.2 Ų150.278%0.78482%0.819SS**  trans169.1104165.600000114.3
33G32.5Very low32Very low83 Ų83154.4 Ų154.486%0.85682%0.819SS**  trans41.3100.7148.200000119.4
34N31Very low32.2Very low131 Ų131151.1 Ų151.170%0.70181%0.814SS**  trans-86.6106.8173.6-163.1-6.7000110.4K36N34-K36 WeakPolarHBondContact OD1-CG 3.32Å
35L35.3Very low32.4Very low163 Ų163152 Ų15285%0.85381%0.806SS**  trans-87.6102.5158.2-146.878.1000106.3T37L35-T37 PolarHBondContact O-N 3.37Å; L35-T37 VanDerWaalsContact O-N 3.13Å
36K31.5Very low32.5Very low180 Ų180153.3 Ų153.378%0.78380%0.797SS**  trans-77.296.5-179-69.4-176.5179.5179.90110.1N34N34-K36 WeakPolarHBondContact OD1-CG 3.32Å
37T31.4Very low32.9Very low130 Ų130156.7 Ų156.780%0.79880%0.8SS**  trans-82.7110.4152.724.80000108.1L35 Q39L35-T37 PolarHBondContact O-N 3.37Å; L35-T37 VanDerWaalsContact O-N 3.13Å; T37-Q39 PolarHBondContact O-N 3.37Å
38A32.4Very low33.4Very low97 Ų97152.4 Ų152.480%0.80279%0.787SS**  trans-71.6105170.700000108.7F40A38-F40 PolarHBondContact O-N 3.35Å
39Q30.4Very low34.3Very low189 Ų189158.9 Ų158.988%0.88379%0.788SS**  trans-75.8109.8162-83.8-156.4-46.600108.7T37 K41T37-Q39 PolarHBondContact O-N 3.37Å; Q39-K41 PolarHBondContact O-N 3.12Å; Q39-K41 VanDerWaalsContact O-N 3.15Å
40F29.4Very low35.1Very low192 Ų192151.5 Ų151.584%0.84278%0.776SS**  trans-66.9103.6164.2-129.4-99.7000107.4A38 T42A38-F40 PolarHBondContact O-N 3.35Å; F40-T42 VanDerWaalsContact C-N 3.34Å; F40-T42 PolarHBondContact O-N 2.86Å; F40-T42 VanDerWaalsContact O-N 3.11Å
41K33.1Very low35.4Very low198 Ų198147.9 Ų147.986%0.86177%0.771SS**  trans-79.888.7172.1-167.6169.2-174.21750107.5Q39 R43Q39-K41 PolarHBondContact O-N 3.12Å; Q39-K41 VanDerWaalsContact O-N 3.15Å; K41-R43 PolarHBondContact O-N 3.35Å; K41-R43 VanDerWaalsContact O-N 3.12Å
42T32.6Very low35.8Very low108 Ų108143.4 Ų143.466%0.66377%0.765SS**  trans-59.9112.4169.5-47.10000107.9F40 E44F40-T42 VanDerWaalsContact C-N 3.34Å; F40-T42 PolarHBondContact O-N 2.86Å; F40-T42 VanDerWaalsContact O-N 3.11Å; T42-E44 HydrophobicContact CG2-CG 4.26Å; T42-E44 PolarHBondContact O-N 3.44Å
43R34.2Very low36.3Very low195 Ų195145.6 Ų145.674%0.73676%0.758SS**  trans-78.581.8169.8-170.5177.8170.7158.92.9106.8K41 E45K41-R43 PolarHBondContact O-N 3.35Å; K41-R43 VanDerWaalsContact O-N 3.12Å; R43-E45 HydrophobicContact CG-CB 4.47Å; R43-E45 IonicContact CZ-OE1 3.92Å; R43-E45 IonicContact CZ-OE2 3.32Å; R43-E45 VanDerWaalsContact CZ-OE2 3.32Å; R43-E45 IonicContact NE-OE1 3.9Å; R43-E45 IonicContact NE-OE2 2.85Å; R43-E45 PolarHBondContact NE-OE2 2.84Å; R43-E45 IonicContact NH2-OE1 3.05Å; R43-E45 PolarHBondContact NH2-OE1 3.46Å; R43-E45 IonicContact NH2-OE2 3.12Å; R43-E45 PolarHBondContact NH2-OE2 3.35Å; R43-E45 VanDerWaalsContact NH2-OE2 3.12Å; R43-E45 PolarHBondContact O-N 3.04Å
44E37.6Very low36.9Very low179 Ų179146.7 Ų146.784%0.83675%0.75SS**  trans-69.486.2161.1-81.2-173.814800107.7T42 K46T42-E44 HydrophobicContact CG2-CG 4.26Å; T42-E44 PolarHBondContact O-N 3.44Å; E44-K46 PolarHBondContact O-N 3.3Å; E44-K46 VanDerWaalsContact O-N 3.08Å
45E37.9Very low37.5Very low137 Ų137146.2 Ų146.264%0.6476%0.757SS**  trans-82.480.3169.6-155.2156-163.100107.3R43 M47R43-E45 HydrophobicContact CG-CB 4.47Å; R43-E45 IonicContact CZ-OE1 3.92Å; R43-E45 IonicContact CZ-OE2 3.32Å; R43-E45 VanDerWaalsContact CZ-OE2 3.32Å; R43-E45 IonicContact NE-OE1 3.9Å; R43-E45 IonicContact NE-OE2 2.85Å; R43-E45 PolarHBondContact NE-OE2 2.84Å; R43-E45 IonicContact NH2-OE1 3.05Å; R43-E45 PolarHBondContact NH2-OE1 3.46Å; R43-E45 IonicContact NH2-OE2 3.12Å; R43-E45 PolarHBondContact NH2-OE2 3.35Å; R43-E45 VanDerWaalsContact NH2-OE2 3.12Å; R43-E45 PolarHBondContact O-N 3.04Å; E45-M47 PolarHBondContact O-N 3.37Å
46K35.5Very low37.9Very low160 Ų160146 Ų14670%0.69675%0.752SS**  trans-61.8102.7171.7-168.7-175.5-176-142.90108.2E44 D48E44-K46 PolarHBondContact O-N 3.3Å; E44-K46 VanDerWaalsContact O-N 3.08Å; K46-D48 WeakPolarHBondContact CD-OD2 3.29Å; K46-D48 WeakPolarHBondContact CE-OD1 3.46Å; K46-D48 WeakPolarHBondContact CE-OD2 3.35Å; K46-D48 IonicContact NZ-OD1 3.62Å; K46-D48 IonicContact NZ-OD2 2.72Å; K46-D48 PolarHBondContact NZ-OD2 2.74Å; K46-D48 PolarHBondContact O-N 3.47Å
47M41.3Very low38.7Very low159 Ų159142.5 Ų142.578%0.78375%0.747SS**  trans-79.472.6175.1-17115762.100109.5E45 R49E45-M47 PolarHBondContact O-N 3.37Å; M47-R49 HydrophobicContact CG-CB 3.86Å; M47-R49 PolarHBondContact O-N 3.21Å
48D37.7Very low39.5Very low115 Ų115145.6 Ų145.662%0.61575%0.753SS**  trans-75.165.9159-69.8-28.2000107.5K46 A50K46-D48 WeakPolarHBondContact CD-OD2 3.29Å; K46-D48 WeakPolarHBondContact CE-OD1 3.46Å; K46-D48 WeakPolarHBondContact CE-OD2 3.35Å; K46-D48 IonicContact NZ-OD1 3.62Å; K46-D48 IonicContact NZ-OD2 2.72Å; K46-D48 PolarHBondContact NZ-OD2 2.74Å; K46-D48 PolarHBondContact O-N 3.47Å; D48-A50 PolarHBondContact O-N 3.39Å
49R47Very low40.6Very low209 Ų209149.9 Ų149.979%0.78975%0.753SS**  trans-76.884.1170.2-172.2170.4-177.5150.3-1.3106.7M47 V51M47-R49 HydrophobicContact CG-CB 3.86Å; M47-R49 PolarHBondContact O-N 3.21Å; R49-V51 PolarHBondContact O-N 3.36Å; R49-V51 VanDerWaalsContact O-N 3.09Å
50A42.2Very low42Very low76 Ų76146.6 Ų146.663%0.62875%0.746SS**  trans-47.8120161.800000107.2D48 S52D48-A50 PolarHBondContact O-N 3.39Å; A50-S52 PolarHBondContact O-N 2.74Å
51V40.6Very low43.6Very low131 Ų131140.1 Ų140.179%0.79472%0.722SS**  trans-6983.3168.81770000105.4R49 L53R49-V51 PolarHBondContact O-N 3.36Å; R49-V51 VanDerWaalsContact O-N 3.09Å; V51-L53 PolarHBondContact O-N 2.86Å; V51-L53 VanDerWaalsContact O-N 3.12Å
52S44.3Very low45.2Very low104 Ų104136.1 Ų136.173%0.72772%0.715SS**  trans-66.7110.1169.8-57.50000106.5A50A50-S52 PolarHBondContact O-N 2.74Å
53L44.3Very low47.2Very low122 Ų122133 Ų13364%0.63970%0.695SS**  trans-51.8139.1166.3-10083.3000108.2V51 S55V51-L53 PolarHBondContact O-N 2.86Å; V51-L53 VanDerWaalsContact O-N 3.12Å; L53-S55 PolarHBondContact O-N 3.14Å
54P44.2Very low49.5Very low105 Ų105131.4 Ų131.468%0.68270%0.701SS**  trans-54.2127.3173.120.1-28.7000108.8Q56P54-Q56 PolarHBondContact O-N 2.94Å
55S44.4Very low51.7Low122 Ų122126.9 Ų126.985%0.85368%0.682SS**  trans-56.798.2178.153.50000109.2L53L53-S55 PolarHBondContact O-N 3.14Å
56Q44Very low53.9Low159 Ų159127 Ų12774%0.74369%0.692SS**  trans-68.1141.5167-72.9-76.9-39.400107.7P54 E58P54-Q56 PolarHBondContact O-N 2.94Å; Q56-E58 PolarHBondContact O-N 3.12Å
57P47.7Very low56.3Low105 Ų105128.2 Ų128.268%0.68270%0.7SS**  trans-53.7138172.724.9-32.9000108.4K59P57-K59 VanDerWaalsContact C-N 3.25Å; P57-K59 PolarHBondContact O-N 3.42Å
58E47.7Very low58.3Low196 Ų196125.5 Ų125.592%0.91669%0.692SS**  trans-55.492.7176.6-70.1-177.7179.300108.9Q56 V60Q56-E58 PolarHBondContact O-N 3.12Å; E58-V60 PolarHBondContact O-N 3.36Å; E58-V60 VanDerWaalsContact O-N 3.09Å
59K56.7Low60.6Low187 Ų187123 Ų12381%0.81368%0.684SS**  trans-73.9105.5176.5-169.4-179.7-176.9-171.50104.8P57 T61P57-K59 VanDerWaalsContact C-N 3.25Å; P57-K59 PolarHBondContact O-N 3.42Å; K59-T61 PolarHBondContact O-N 3.18Å
60V59.1Low62.2Low119 Ų119117.4 Ų117.472%0.72167%0.673SS**  trans-50.4117.5172.6-1740000107.1E58 T62E58-V60 PolarHBondContact O-N 3.36Å; E58-V60 VanDerWaalsContact O-N 3.09Å; V60-T62 PolarHBondContact O-N 2.9Å
61T62.6Low64.2Low56 Ų56115.6 Ų115.634%0.34466%0.658SS.*  trans-68.384.2-179.6-48.60000108.1K59 V63 V99 Q100K59-T61 PolarHBondContact O-N 3.18Å; T61-V63 PolarHBondContact O-N 3.37Å; T61-V99 HydrophobicContact CG2-CG1 4.02Å; T61-Q100 PolarHBondContact OG1-OE1 2.85Å
62T67.8Low66.2Low115 Ų115112.2 Ų112.271%0.70664%0.639SS**  trans-73.2108.817252.90000107.2V60 N64V60-T62 PolarHBondContact O-N 2.9Å; T62-N64 PolarHBondContact O-N 3.41Å; T62-N64 VanDerWaalsContact O-N 3.11Å
63V74.1Confident68Low42 Ų42113 Ų11326%0.25565%0.645SS.*  trans-58.8115.4174.5-178.30000108.3T61 L65 L95 A96T61-V63 PolarHBondContact O-N 3.37Å; V63-L65 HydrophobicContact CG1-CD2 3.75Å; V63-L65 HydrophobicContact CG1-CG 4.34Å; V63-L65 PolarHBondContact O-N 3.37Å; V63-L95 HydrophobicContact CG1-CD2 3.46Å; V63-L95 VanDerWaalsContact CG1-CD2 3.46Å; V63-L95 HydrophobicContact CG1-CG 3.73Å; V63-A96 HydrophobicContact CG2-CB 3.53Å
64N82.3Confident69.9Low161 Ų161110.5 Ų110.586%0.86165%0.648SS**  trans-8398.5179.9-16015.4000108.7T62T62-N64 PolarHBondContact O-N 3.41Å; T62-N64 VanDerWaalsContact O-N 3.11Å
65L84.6Confident71.7Confident85 Ų85112.2 Ų112.245%0.44565%0.649SS.*PPolyproline II helixtrans-80.6153.7178.6-61.2177.9000110.4V63 L92 L95V63-L65 HydrophobicContact CG1-CD2 3.75Å; V63-L65 HydrophobicContact CG1-CG 4.34Å; V63-L65 PolarHBondContact O-N 3.37Å; L65-L92 HydrophobicContact CD1-CD2 3.78Å; L65-L92 HydrophobicContact CD2-CD2 3.97Å; L65-L92 HydrophobicContact CG-CD2 4.5Å; L65-L95 HydrophobicContact CD2-CD2 3.76Å
66V84.9Confident73.7Confident139 Ų139114.7 Ų114.784%0.84265%0.647SS**PPolyproline II helixtrans-62.2138.5174.8179.40000109.6
67E85.3Confident75.6Confident186 Ų186109.3 Ų109.387%0.86962%0.623SS**PPolyproline II helixtrans-59.5139.3177.9-63.7-179.3173.600111.3
68T83.5Confident77.4Confident101 Ų101111.9 Ų111.962%0.6264%0.637SS**PPolyproline II helixtrans-88137.7176.556.40000110N84T68-N84 VanDerWaalsContact CB-CG 3.5Å; T68-N84 WeakPolarHBondContact CB-OD1 3.44Å; T68-N84 HydrophobicContact CG2-CB 3.78Å; T68-N84 WeakPolarHBondContact CG2-OD1 3.46Å
69S84.6Confident79Confident63 Ų63104.9 Ų104.944%0.44161%0.609SS.*  trans-119.8132179-177.70000110.5A71 L77S69-A71 PolarHBondContact OG-N 2.89Å; S69-L77 WeakPolarHBondContact O-CD1 3.48Å
70T80.8Confident80Confident91 Ų9198.3 Ų98.356%0.55859%0.587SS**SBendtrans-83.5-14.5175.847.80000113.1L77T70-L77 WeakPolarHBondContact O-CG 3.29Å; T70-L77 PolarHBondContact O-N 2.87Å
71A84.4Confident81Confident38 Ų38100.5 Ų100.531%0.31458%0.583SS.*SBendtrans-141.566.4-178.300000112.3S69 S73 G74 M75S69-A71 PolarHBondContact OG-N 2.89Å; A71-S73 PolarHBondContact O-N 2.95Å; A71-G74 PolarHBondContact O-N 3.14Å; A71-M75 CarbonylContact C-O 3.51Å; A71-M75 WeakPolarHBondContact CA-O 3.49Å
72P82.5Confident81.7Confident61 Ų61105 Ų10540%0.39660%0.6SS.*G310 helixtrans-60.2131.9176.626.5-31.9000109.9G74 M75 L77P72-G74 PolarHBondContact O-N 2.9Å; P72-M75 PolarHBondContact O-N 3.33Å; P72-L77 HydrophobicContact CG-CD1 4.4Å; P72-L77 HydrophobicContact CG-CD2 3.79Å; P72-L77 HydrophobicContact CG-CG 4.14Å
73S82.3Confident82Confident120 Ų120104.1 Ų104.184%0.83960%0.595SS**G310 helixtrans57.623.1-175-47.70000114.8A71 M75A71-S73 PolarHBondContact O-N 2.95Å; S73-M75 VanDerWaalsContact C-N 3.31Å; S73-M75 PolarHBondContact O-N 2.65Å
74G84.2Confident82.2Confident69 Ų69104.9 Ų104.971%0.71160%0.598SS**G310 helixtrans80.35178.200000115.2A71 P72A71-G74 PolarHBondContact O-N 3.14Å; P72-G74 PolarHBondContact O-N 2.9Å
75M82.5Confident81.8Confident142 Ų142105.3 Ų105.370%0.759%0.587SS**PPolyproline II helixtrans-102124.1175.7-71.7-177.2-9800110.5A71 P72 S73A71-M75 CarbonylContact C-O 3.51Å; A71-M75 WeakPolarHBondContact CA-O 3.49Å; P72-M75 PolarHBondContact O-N 3.33Å; S73-M75 VanDerWaalsContact C-N 3.31Å; S73-M75 PolarHBondContact O-N 2.65Å
76E85.9Confident81Confident173 Ų173104.7 Ų104.781%0.80859%0.586SS**PPolyproline II helixtrans-68.3130.2-177.1-170.9170.5-16800111.9
77L84.4Confident80.5Confident47 Ų47100.9 Ų100.925%0.24658%0.576CS.*PPolyproline II helixtrans-71.7131.7177.5-66.4178.5000110.9S69 T70 P72 S79 T83S69-L77 WeakPolarHBondContact O-CD1 3.48Å; T70-L77 WeakPolarHBondContact O-CG 3.29Å; T70-L77 PolarHBondContact O-N 2.87Å; P72-L77 HydrophobicContact CG-CD1 4.4Å; P72-L77 HydrophobicContact CG-CD2 3.79Å; P72-L77 HydrophobicContact CG-CG 4.14Å; L77-S79 PolarHBondContact O-N 3.4Å; L77-T83 HydrophobicContact CD1-CG2 4.28Å
78V84.5Confident80.4Confident159 Ų15996 Ų9696%0.96456%0.556SS**SBendtrans-59.1-29.7175.2-178.20000112.1
79S81.3Confident80.2Confident48 Ų4895.7 Ų95.734%0.33656%0.555SS.*  trans-152.599.4172179.30000110.9L77 Y81 Q82 T83L77-S79 PolarHBondContact O-N 3.4Å; S79-Y81 VanDerWaalsContact C-N 3.29Å; S79-Y81 PolarHBondContact O-N 3.39Å; S79-Q82 PolarHBondContact O-N 3.03Å; S79-Q82 PolarHBondContact OG-N 3.3Å; S79-T83 PolarHBondContact O-N 3Å; S79-T83 PolarHBondContact O-OG1 3.05Å
80S79.3Confident80.3Confident49 Ų4998.1 Ų98.134%0.34356%0.561SS.*Hα-helixtrans-63.3-34.7175.858.30000112.5Q82 N84S80-Q82 PolarHBondContact O-N 2.99Å; S80-N84 VanDerWaalsContact O-CB 3.24Å; S80-N84 WeakPolarHBondContact O-CB 3.47Å; S80-N84 VanDerWaalsContact O-CG 3.27Å; S80-N84 PolarHBondContact O-N 2.8Å; S80-N84 PolarHBondContact O-ND2 3.25Å
81Y79Confident80.5Confident166 Ų16698.5 Ų98.565%0.65156%0.559SS**Hα-helixtrans-62.3-42.9179.3178-100.6000112.3S79 R85S79-Y81 VanDerWaalsContact C-N 3.29Å; S79-Y81 PolarHBondContact O-N 3.39Å; Y81-R85 WeakPolarHBondContact O-CB 3.29Å; Y81-R85 PolarHBondContact O-N 3.22Å; Y81-R85 VanDerWaalsContact O-N 3.08Å
82Q77Confident80.5Confident151 Ų15199.7 Ų99.771%0.70656%0.56SS**Hα-helixtrans-74.4-32.8-175.8-165.216217.500112.3S79 S80S79-Q82 PolarHBondContact O-N 3.03Å; S79-Q82 PolarHBondContact OG-N 3.3Å; S80-Q82 PolarHBondContact O-N 2.99Å
83T74.4Confident80.8Confident96 Ų96100 Ų10059%0.58956%0.561SS**Hα-helixtrans-75.8-35.1176.4-49.70000112.5L77 S79L77-T83 HydrophobicContact CD1-CG2 4.28Å; S79-T83 PolarHBondContact O-N 3Å; S79-T83 PolarHBondContact O-OG1 3.05Å
84N78.4Confident81.1Confident58 Ų5896.8 Ų96.831%0.3154%0.542SS..SBendtrans-94.23.1-178.1-63.1-40.3000113.6T68 S80 V86T68-N84 VanDerWaalsContact CB-CG 3.5Å; T68-N84 WeakPolarHBondContact CB-OD1 3.44Å; T68-N84 HydrophobicContact CG2-CB 3.78Å; T68-N84 WeakPolarHBondContact CG2-OD1 3.46Å; S80-N84 VanDerWaalsContact O-CB 3.24Å; S80-N84 WeakPolarHBondContact O-CB 3.47Å; S80-N84 VanDerWaalsContact O-CG 3.27Å; S80-N84 PolarHBondContact O-N 2.8Å; S80-N84 PolarHBondContact O-ND2 3.25Å; N84-V86 PolarHBondContact O-N 2.89Å
85R74.8Confident81.3Confident170 Ų17096.7 Ų96.764%0.64252%0.524SS*.  trans-66120.5178.8-177.6172.8176.6176.30.9109.1Y81 G87Y81-R85 WeakPolarHBondContact O-CB 3.29Å; Y81-R85 PolarHBondContact O-N 3.22Å; Y81-R85 VanDerWaalsContact O-N 3.08Å; R85-G87 PolarHBondContact O-N 3.41Å
86V68Low81.7Confident71 Ų7191.4 Ų91.443%0.4350%0.503SS..  trans-57.3125.9166.4-177.90000107.5N84 L92N84-V86 PolarHBondContact O-N 2.89Å; V86-L92 HydrophobicContact CG1-CD1 3.72Å; V86-L92 HydrophobicContact CG1-CD2 4.09Å; V86-L92 HydrophobicContact CG1-CG 3.66Å; V86-L92 HydrophobicContact CG2-CD1 4.28Å
87G74Confident81.9Confident60 Ų6088.2 Ų88.262%0.61949%0.488SS*.SBendtrans-60.1-98.7-177.100000112.6R85R85-G87 PolarHBondContact O-N 3.41Å
88D81.9Confident82.3Confident84 Ų8492.6 Ų92.645%0.44951%0.508SS..  trans-88.2126170-173.2-11.8000109M90 D91D88-M90 PolarHBondContact O-N 3.41Å; D88-M90 WeakPolarHBondContact OD1-CB 3.44Å; D88-M90 PolarHBondContact OD1-N 2.63Å; D88-D91 VanDerWaalsContact O-CB 3.31Å; D88-D91 WeakPolarHBondContact O-CB 3.3Å; D88-D91 PolarHBondContact O-N 3.33Å
89P80.2Confident82.6Confident93 Ų9387.8 Ų87.860%0.60448%0.478SS*.Hα-helixtrans-50.6-27.6170.5-27.835.3000114.2D91 L92P89-D91 VanDerWaalsContact C-N 3.25Å; P89-D91 PolarHBondContact O-N 2.87Å; P89-L92 PolarHBondContact O-N 2.88Å
90M85.8Confident83.1Confident115 Ų11588.6 Ų88.657%0.56748%0.477SS*.Hα-helixtrans-65.4-25.5175-68.7-56.5-58.100113.4D88 L92 V93 A94D88-M90 PolarHBondContact O-N 3.41Å; D88-M90 WeakPolarHBondContact OD1-CB 3.44Å; D88-M90 PolarHBondContact OD1-N 2.63Å; M90-L92 VanDerWaalsContact C-N 3.29Å; M90-L92 PolarHBondContact O-N 3.48Å; M90-V93 PolarHBondContact O-N 2.93Å; M90-A94 PolarHBondContact O-N 3.22Å
91D85.8Confident83.8Confident98 Ų9891.8 Ų91.852%0.52448%0.484SS..Hα-helixtrans-65.2-34.6177.3-67.1-28.2000111.6D88 P89 V93 A94 L95D88-D91 VanDerWaalsContact O-CB 3.31Å; D88-D91 WeakPolarHBondContact O-CB 3.3Å; D88-D91 PolarHBondContact O-N 3.33Å; P89-D91 VanDerWaalsContact C-N 3.25Å; P89-D91 PolarHBondContact O-N 2.87Å; D91-V93 VanDerWaalsContact C-N 3.34Å; D91-A94 PolarHBondContact O-N 2.95Å; D91-L95 WeakPolarHBondContact O-CB 3.29Å; D91-L95 PolarHBondContact O-N 3.07Å
92L84.6Confident84.6Confident64 Ų6485.2 Ų85.234%0.33547%0.468SS..Hα-helixtrans-66.8-37.9175.2-67-178.2000111.8L65 V86 P89 M90 A96L65-L92 HydrophobicContact CD1-CD2 3.78Å; L65-L92 HydrophobicContact CD2-CD2 3.97Å; L65-L92 HydrophobicContact CG-CD2 4.5Å; V86-L92 HydrophobicContact CG1-CD1 3.72Å; V86-L92 HydrophobicContact CG1-CD2 4.09Å; V86-L92 HydrophobicContact CG1-CG 3.66Å; V86-L92 HydrophobicContact CG2-CD1 4.28Å; P89-L92 PolarHBondContact O-N 2.88Å; M90-L92 VanDerWaalsContact C-N 3.29Å; M90-L92 PolarHBondContact O-N 3.48Å; L92-A96 WeakPolarHBondContact O-CB 3.47Å; L92-A96 PolarHBondContact O-N 2.8Å
93V87.8Confident85.4Confident68 Ų6881.1 Ų81.141%0.41245%0.45SS..Hα-helixtrans-68.1-45.9176.2-178.50000110M90 D91 L95 A96 E97M90-V93 PolarHBondContact O-N 2.93Å; D91-V93 VanDerWaalsContact C-N 3.34Å; V93-L95 VanDerWaalsContact C-N 3.31Å; V93-L95 PolarHBondContact O-N 3.47Å; V93-A96 WeakPolarHBondContact O-CB 3.2Å; V93-A96 PolarHBondContact O-N 2.81Å; V93-A96 VanDerWaalsContact O-N 3.17Å; V93-E97 WeakPolarHBondContact O-CG 3.31Å; V93-E97 PolarHBondContact O-N 3.03Å
94A89.6Confident86.3Confident52 Ų5280.2 Ų80.243%0.4344%0.442SS..Hα-helixtrans-60-40.9176.400000112.1M90 D91 E97 Q98M90-A94 PolarHBondContact O-N 3.22Å; D91-A94 PolarHBondContact O-N 2.95Å; A94-E97 PolarHBondContact O-N 2.91Å; A94-Q98 WeakPolarHBondContact O-CB 3.18Å; A94-Q98 PolarHBondContact O-N 3.28Å
95L88.9Confident87.2Confident67 Ų6784.2 Ų84.235%0.35146%0.457SS..Hα-helixtrans-63.4-45.4174.2178.558.3000111.6V63 L65 D91 V93 E97 Q98 V99V63-L95 HydrophobicContact CG1-CD2 3.46Å; V63-L95 VanDerWaalsContact CG1-CD2 3.46Å; V63-L95 HydrophobicContact CG1-CG 3.73Å; L65-L95 HydrophobicContact CD2-CD2 3.76Å; D91-L95 WeakPolarHBondContact O-CB 3.29Å; D91-L95 PolarHBondContact O-N 3.07Å; V93-L95 VanDerWaalsContact C-N 3.31Å; V93-L95 PolarHBondContact O-N 3.47Å; L95-E97 VanDerWaalsContact C-N 3.33Å; L95-E97 PolarHBondContact O-N 3.34Å; L95-Q98 PolarHBondContact O-N 2.98Å; L95-V99 HydrophobicContact CD1-CG2 4.25Å; L95-V99 WeakPolarHBondContact O-CG2 3.39Å; L95-V99 PolarHBondContact O-N 2.81Å
96A89.4Confident88.2Confident31 Ų3181.3 Ų81.326%0.25645%0.453SS..Hα-helixtrans-58.3-44.917600000111.8V63 L92 V93 Q98 V99 Q100V63-A96 HydrophobicContact CG2-CB 3.53Å; L92-A96 WeakPolarHBondContact O-CB 3.47Å; L92-A96 PolarHBondContact O-N 2.8Å; V93-A96 WeakPolarHBondContact O-CB 3.2Å; V93-A96 PolarHBondContact O-N 2.81Å; V93-A96 VanDerWaalsContact O-N 3.17Å; A96-Q98 VanDerWaalsContact C-N 3.34Å; A96-Q98 PolarHBondContact O-N 2.83Å; A96-V99 PolarHBondContact O-N 2.96Å; A96-Q100 WeakPolarHBondContact O-CB 3.47Å; A96-Q100 PolarHBondContact O-N 2.84Å
97E91.2Very high89.5Confident106 Ų10683.7 Ų83.750%0.49546%0.458SS..Hα-helixtrans-61.8-40.4175.7-73.1-175.8-17300112.5V93 A94 L95 Q100 K101V93-E97 WeakPolarHBondContact O-CG 3.31Å; V93-E97 PolarHBondContact O-N 3.03Å; A94-E97 PolarHBondContact O-N 2.91Å; L95-E97 VanDerWaalsContact C-N 3.33Å; L95-E97 PolarHBondContact O-N 3.34Å; E97-Q100 PolarHBondContact O-N 3.31Å; E97-K101 WeakPolarHBondContact O-CB 3.45Å; E97-K101 VanDerWaalsContact O-CG 3.29Å; E97-K101 WeakPolarHBondContact O-CG 3.3Å; E97-K101 PolarHBondContact O-N 2.92Å; E97-K101 IonicContact OE2-NZ 3.88Å
98Q92.4Very high90.6Very high139 Ų13983 Ų8365%0.6545%0.446SS*.Hα-helixtrans-67.5-42.3178.7-177.1173.8-24.300111.9A94 L95 A96 Q100 K101 G102A94-Q98 WeakPolarHBondContact O-CB 3.18Å; A94-Q98 PolarHBondContact O-N 3.28Å; L95-Q98 PolarHBondContact O-N 2.98Å; A96-Q98 VanDerWaalsContact C-N 3.34Å; A96-Q98 PolarHBondContact O-N 2.83Å; Q98-Q100 VanDerWaalsContact C-N 3.34Å; Q98-K101 PolarHBondContact O-N 3.41Å; Q98-G102 PolarHBondContact O-N 3.38Å
99V91.9Very high91.3Very high58 Ų5883.3 Ų83.335%0.35245%0.448SS..Hα-helixtrans-60.6-46.8174.51720000110.1T61 L95 A96 K101 G102 D103T61-V99 HydrophobicContact CG2-CG1 4.02Å; L95-V99 HydrophobicContact CD1-CG2 4.25Å; L95-V99 WeakPolarHBondContact O-CG2 3.39Å; L95-V99 PolarHBondContact O-N 2.81Å; A96-V99 PolarHBondContact O-N 2.96Å; V99-K101 PolarHBondContact O-N 3.29Å; V99-G102 WeakPolarHBondContact O-CA 3.24Å; V99-G102 PolarHBondContact O-N 3.17Å; V99-G102 VanDerWaalsContact O-N 3.09Å; V99-D103 PolarHBondContact O-N 3.02Å
100Q90.4Very high92Very high65 Ų6581 Ų8130%0.30444%0.437SS..Hα-helixtrans-59.5-45.5178-173.158.956.600112.2T61 A96 E97 Q98 G102 D103 D104T61-Q100 PolarHBondContact OG1-OE1 2.85Å; A96-Q100 WeakPolarHBondContact O-CB 3.47Å; A96-Q100 PolarHBondContact O-N 2.84Å; E97-Q100 PolarHBondContact O-N 3.31Å; Q98-Q100 VanDerWaalsContact C-N 3.34Å; Q100-G102 VanDerWaalsContact C-N 3.3Å; Q100-G102 PolarHBondContact O-N 3.11Å; Q100-D103 PolarHBondContact O-N 3.28Å; Q100-D104 PolarHBondContact NE2-OD1 3.37Å; Q100-D104 VanDerWaalsContact O-CG 3.25Å; Q100-D104 PolarHBondContact O-N 3.16Å
101K94.7Very high92.5Very high115 Ų11578.1 Ų78.150%0.543%0.427SS..Hα-helixtrans-59.5-41.4174.4-74.7167.3-175.6160.60111.6E97 Q98 V99 D104 F105E97-K101 WeakPolarHBondContact O-CB 3.45Å; E97-K101 VanDerWaalsContact O-CG 3.29Å; E97-K101 WeakPolarHBondContact O-CG 3.3Å; E97-K101 PolarHBondContact O-N 2.92Å; E97-K101 IonicContact OE2-NZ 3.88Å; Q98-K101 PolarHBondContact O-N 3.41Å; V99-K101 PolarHBondContact O-N 3.29Å; K101-D104 PolarHBondContact O-N 3.23Å; K101-F105 HydrophobicContact CB-CE2 4.48Å; K101-F105 WeakPolarHBondContact O-CD2 3.46Å; K101-F105 PolarHBondContact O-N 2.74Å
102G95.1Very high93Very high29 Ų2978.4 Ų78.430%0.29943%0.428SS..Hα-helixtrans-58.4-47.9175.600000112.3Q98 V99 Q100 D104 F105 I106Q98-G102 PolarHBondContact O-N 3.38Å; V99-G102 WeakPolarHBondContact O-CA 3.24Å; V99-G102 PolarHBondContact O-N 3.17Å; V99-G102 VanDerWaalsContact O-N 3.09Å; Q100-G102 VanDerWaalsContact C-N 3.3Å; Q100-G102 PolarHBondContact O-N 3.11Å; G102-D104 VanDerWaalsContact C-N 3.32Å; G102-D104 PolarHBondContact O-N 3.15Å; G102-F105 PolarHBondContact O-N 3.2Å; G102-I106 VanDerWaalsContact O-CG1 3.31Å; G102-I106 WeakPolarHBondContact O-CG1 3.41Å; G102-I106 PolarHBondContact O-N 3.44Å
103D93.6Very high93.6Very high64 Ų6482.7 Ų82.734%0.34244%0.444SS..Hα-helixtrans-61.6-40.3176.8-73.6-16.8000112V99 Q100 I106 K107V99-D103 PolarHBondContact O-N 3.02Å; Q100-D103 PolarHBondContact O-N 3.28Å; D103-I106 PolarHBondContact O-N 3.46Å; D103-K107 WeakPolarHBondContact O-CG 3.49Å; D103-K107 PolarHBondContact O-N 3.13Å
104D93.8Very high94.1Very high78 Ų7884.7 Ų84.742%0.41745%0.452SS..Hα-helixtrans-65-40.4177-66.1-20.5000111.5Q100 K101 G102 K107 A108Q100-D104 PolarHBondContact NE2-OD1 3.37Å; Q100-D104 VanDerWaalsContact O-CG 3.25Å; Q100-D104 PolarHBondContact O-N 3.16Å; K101-D104 PolarHBondContact O-N 3.23Å; G102-D104 VanDerWaalsContact C-N 3.32Å; G102-D104 PolarHBondContact O-N 3.15Å; D104-K107 PolarHBondContact O-N 3.4Å; D104-A108 WeakPolarHBondContact O-CB 3.38Å; D104-A108 PolarHBondContact O-N 3.08Å
105F96.8Very high94.4Very high141 Ų14186 Ų8662%0.61846%0.455SS*.Hα-helixtrans-64.8-40.1172.8-76.3-59.3000112.6K101 G102 A108 N109K101-F105 HydrophobicContact CB-CE2 4.48Å; K101-F105 WeakPolarHBondContact O-CD2 3.46Å; K101-F105 PolarHBondContact O-N 2.74Å; G102-F105 PolarHBondContact O-N 3.2Å; F105-A108 PolarHBondContact O-N 3.37Å; F105-N109 VanDerWaalsContact O-CB 3.26Å; F105-N109 WeakPolarHBondContact O-CB 3.27Å; F105-N109 PolarHBondContact O-N 3.48Å; F105-N109 PolarHBondContact O-ND2 2.92Å
106I96.6Very high94.8Very high110 Ų11086.8 Ų86.856%0.56446%0.463SS*.Hα-helixtrans-62.4-47176.6-69.5165.3000109.9G102 D103 N109 A110G102-I106 VanDerWaalsContact O-CG1 3.31Å; G102-I106 WeakPolarHBondContact O-CG1 3.41Å; G102-I106 PolarHBondContact O-N 3.44Å; D103-I106 PolarHBondContact O-N 3.46Å; I106-N109 PolarHBondContact O-N 3.09Å; I106-A110 WeakPolarHBondContact O-CB 3.34Å; I106-A110 PolarHBondContact O-N 2.94Å
107K96.2Very high95.1Very high121 Ų12189.4 Ų89.453%0.52647%0.471SS..Hα-helixtrans-58.7-49.5175.6-72.6171-171.6164.90111.2D103 D104 N109 A110 C111D103-K107 WeakPolarHBondContact O-CG 3.49Å; D103-K107 PolarHBondContact O-N 3.13Å; D104-K107 PolarHBondContact O-N 3.4Å; K107-N109 VanDerWaalsContact C-N 3.34Å; K107-N109 PolarHBondContact O-N 2.82Å; K107-A110 PolarHBondContact O-N 3.24Å; K107-C111 WeakPolarHBondContact O-CB 3.36Å; K107-C111 PolarHBondContact O-N 3Å; K107-C111 PolarHBondContact O-SG 2.76Å
108A95.5Very high95.3Very high45 Ų4587 Ų8737%0.37247%0.469SS..Hα-helixtrans-59.5-45.117900000111.7D104 F105 C111 N112D104-A108 WeakPolarHBondContact O-CB 3.38Å; D104-A108 PolarHBondContact O-N 3.08Å; F105-A108 PolarHBondContact O-N 3.37Å; A108-C111 PolarHBondContact O-N 2.96Å; A108-N112 WeakPolarHBondContact O-CB 3.42Å; A108-N112 PolarHBondContact O-N 2.9Å; A108-N112 PolarHBondContact O-ND2 3.26Å
109N96.7Very high95.6Very high90 Ų9083.9 Ų83.948%0.48146%0.457SS..Hα-helixtrans-64.3-42.1178.1-75-22.7000112.4F105 I106 K107 N112 K113F105-N109 VanDerWaalsContact O-CB 3.26Å; F105-N109 WeakPolarHBondContact O-CB 3.27Å; F105-N109 PolarHBondContact O-N 3.48Å; F105-N109 PolarHBondContact O-ND2 2.92Å; I106-N109 PolarHBondContact O-N 3.09Å; K107-N109 VanDerWaalsContact C-N 3.34Å; K107-N109 PolarHBondContact O-N 2.82Å; N109-N112 PolarHBondContact O-N 3.39Å; N109-K113 WeakPolarHBondContact O-CG 3.35Å; N109-K113 PolarHBondContact O-N 2.91Å; N109-K113 VanDerWaalsContact O-N 3.11Å
110A96Very high95.9Very high45 Ų4586.5 Ų86.537%0.37247%0.466SS..Hα-helixtrans-63-48175.600000111I106 K107 N112 K113 L114I106-A110 WeakPolarHBondContact O-CB 3.34Å; I106-A110 PolarHBondContact O-N 2.94Å; K107-A110 PolarHBondContact O-N 3.24Å; A110-N112 VanDerWaalsContact C-N 3.34Å; A110-N112 PolarHBondContact O-N 3.43Å; A110-K113 PolarHBondContact O-N 3.08Å; A110-L114 WeakPolarHBondContact O-CB 3.43Å; A110-L114 VanDerWaalsContact O-CG 3.31Å; A110-L114 WeakPolarHBondContact O-CG 3.21Å; A110-L114 PolarHBondContact O-N 3.42Å
111C96.3Very high96.2Very high54 Ų5487.5 Ų87.537%0.36547%0.472SS..Hα-helixtrans-57.6-45.3176-71.30000111.9K107 A108 K113 L114 T115K107-C111 WeakPolarHBondContact O-CB 3.36Å; K107-C111 PolarHBondContact O-N 3Å; K107-C111 PolarHBondContact O-SG 2.76Å; A108-C111 PolarHBondContact O-N 2.96Å; C111-K113 VanDerWaalsContact C-N 3.35Å; C111-K113 PolarHBondContact O-N 2.88Å; C111-L114 PolarHBondContact O-N 3.29Å; C111-T115 PolarHBondContact O-N 3.41Å; C111-T115 PolarHBondContact O-OG1 3.3Å
112N96.3Very high96.3Very high104 Ų10489.8 Ų89.856%0.55648%0.478SS*.Hα-helixtrans-59.7-43.9178.1-70.4-20.4000112A108 N109 A110 T115 V116A108-N112 WeakPolarHBondContact O-CB 3.42Å; A108-N112 PolarHBondContact O-N 2.9Å; A108-N112 PolarHBondContact O-ND2 3.26Å; N109-N112 PolarHBondContact O-N 3.39Å; A110-N112 VanDerWaalsContact C-N 3.34Å; A110-N112 PolarHBondContact O-N 3.43Å; N112-T115 PolarHBondContact O-N 2.93Å; N112-V116 PolarHBondContact O-N 2.8Å
113K96.1Very high96.5Very high154 Ų15495.3 Ų95.367%0.6749%0.49SS*.Hα-helixtrans-66.7-42.8176.9-70176.7-178.2-178.50112.1N109 A110 C111 T115 V116 I117N109-K113 WeakPolarHBondContact O-CG 3.35Å; N109-K113 PolarHBondContact O-N 2.91Å; N109-K113 VanDerWaalsContact O-N 3.11Å; A110-K113 PolarHBondContact O-N 3.08Å; C111-K113 VanDerWaalsContact C-N 3.35Å; C111-K113 PolarHBondContact O-N 2.88Å; K113-T115 VanDerWaalsContact C-N 3.31Å; K113-T115 PolarHBondContact O-N 2.8Å; K113-V116 PolarHBondContact O-N 2.86Å; K113-I117 PolarHBondContact O-N 3.31Å
114L97.8Very high96.7Very high110 Ų11097.6 Ų97.658%0.57650%0.502SS*.Hα-helixtrans-65.2-34.9178.3-71.3174.1000112.1A110 C111 V116 I117 A118A110-L114 WeakPolarHBondContact O-CB 3.43Å; A110-L114 VanDerWaalsContact O-CG 3.31Å; A110-L114 WeakPolarHBondContact O-CG 3.21Å; A110-L114 PolarHBondContact O-N 3.42Å; C111-L114 PolarHBondContact O-N 3.29Å; L114-V116 PolarHBondContact O-N 3.37Å; L114-I117 PolarHBondContact O-N 3.09Å; L114-A118 WeakPolarHBondContact O-CB 3.4Å; L114-A118 PolarHBondContact O-N 3.5Å
115T97.1Very high96.9Very high80 Ų8099.9 Ų99.949%0.49151%0.51SS..Hα-helixtrans-59.9-44.6174.1-62.20000111.6C111 N112 K113 I117 A118 D119C111-T115 PolarHBondContact O-N 3.41Å; C111-T115 PolarHBondContact O-OG1 3.3Å; N112-T115 PolarHBondContact O-N 2.93Å; K113-T115 VanDerWaalsContact C-N 3.31Å; K113-T115 PolarHBondContact O-N 2.8Å; T115-I117 VanDerWaalsContact C-N 3.33Å; T115-I117 PolarHBondContact O-N 2.86Å; T115-A118 PolarHBondContact O-N 3.26Å; T115-D119 PolarHBondContact O-N 3.33Å
116V97.2Very high97Very high84 Ų8497.4 Ų97.451%0.50950%0.501SS..Hα-helixtrans-60.4-44.1177176.30000111.2N112 K113 L114 D119 Q120N112-V116 PolarHBondContact O-N 2.8Å; K113-V116 PolarHBondContact O-N 2.86Å; L114-V116 PolarHBondContact O-N 3.37Å; V116-D119 PolarHBondContact O-N 3.26Å; V116-Q120 WeakPolarHBondContact O-CG 3.34Å; V116-Q120 PolarHBondContact O-N 3.02Å
117I96.3Very high97Very high85 Ų8595.5 Ų95.544%0.43649%0.489SS..Hα-helixtrans-64.3-43.8177.8-64169.7000110.4K113 L114 T115 D119 Q120 I121K113-I117 PolarHBondContact O-N 3.31Å; L114-I117 PolarHBondContact O-N 3.09Å; T115-I117 VanDerWaalsContact C-N 3.33Å; T115-I117 PolarHBondContact O-N 2.86Å; I117-D119 VanDerWaalsContact C-N 3.31Å; I117-D119 PolarHBondContact O-N 2.91Å; I117-Q120 WeakPolarHBondContact O-CB 3.33Å; I117-Q120 PolarHBondContact O-N 3.46Å; I117-I121 HydrophobicContact CG2-CD1 3.89Å; I117-I121 HydrophobicContact CG2-CG1 4.42Å; I117-I121 WeakPolarHBondContact O-CG1 3.13Å; I117-I121 PolarHBondContact O-N 2.83Å
118A95.4Very high97.1Very high55 Ų5592.3 Ų92.346%0.45549%0.485SS..Hα-helixtrans-60.8-40.917800000111.8L114 T115 I121 R122L114-A118 WeakPolarHBondContact O-CB 3.4Å; L114-A118 PolarHBondContact O-N 3.5Å; T115-A118 PolarHBondContact O-N 3.26Å; A118-I121 PolarHBondContact O-N 2.89Å; A118-R122 WeakPolarHBondContact O-CB 3.33Å; A118-R122 PolarHBondContact O-N 3.48Å
119D97.4Very high97.2Very high74 Ų7496.2 Ų96.240%0.39649%0.494SS..Hα-helixtrans-64.4-40175-85-37.5000112.5T115 V116 I117 R122 Y123T115-D119 PolarHBondContact O-N 3.33Å; V116-D119 PolarHBondContact O-N 3.26Å; I117-D119 VanDerWaalsContact C-N 3.31Å; I117-D119 PolarHBondContact O-N 2.91Å; D119-R122 PolarHBondContact O-N 3.27Å; D119-R122 IonicContact OD1-CZ 3.62Å; D119-R122 IonicContact OD1-NE 2.65Å; D119-R122 PolarHBondContact OD1-NE 3.13Å; D119-R122 IonicContact OD1-NH2 2.84Å; D119-R122 PolarHBondContact OD1-NH2 3.41Å; D119-Y123 WeakPolarHBondContact O-CB 3.28Å; D119-Y123 PolarHBondContact O-N 2.97Å
120Q98.1Very high97.3Very high114 Ų11496 Ų9653%0.53349%0.489SS..Hα-helixtrans-63.9-44.4174.4-72.3176-19.700111.9V116 I117 R122 Y123 L124V116-Q120 WeakPolarHBondContact O-CG 3.34Å; V116-Q120 PolarHBondContact O-N 3.02Å; I117-Q120 WeakPolarHBondContact O-CB 3.33Å; I117-Q120 PolarHBondContact O-N 3.46Å; Q120-R122 VanDerWaalsContact C-N 3.34Å; Q120-R122 PolarHBondContact O-N 3.41Å; Q120-Y123 PolarHBondContact O-N 3.45Å; Q120-L124 WeakPolarHBondContact O-CG 3.39Å; Q120-L124 PolarHBondContact O-N 2.95Å
121I97.2Very high97.3Very high85 Ų8598 Ų9844%0.43650%0.496SS..Hα-helixtrans-60.4-46.1176.4-69.3168.3000110.3I117 A118 Y123 L124 Q125I117-I121 HydrophobicContact CG2-CD1 3.89Å; I117-I121 HydrophobicContact CG2-CG1 4.42Å; I117-I121 WeakPolarHBondContact O-CG1 3.13Å; I117-I121 PolarHBondContact O-N 2.83Å; A118-I121 PolarHBondContact O-N 2.89Å; I121-Y123 VanDerWaalsContact C-N 3.33Å; I121-Y123 PolarHBondContact O-N 3.28Å; I121-L124 PolarHBondContact O-N 2.89Å; I121-Q125 HydrophobicContact CG2-CG 4.38Å; I121-Q125 VanDerWaalsContact O-CG 3.3Å; I121-Q125 WeakPolarHBondContact O-CG 3.47Å; I121-Q125 PolarHBondContact O-N 2.9Å
122R97.5Very high97.4Very high163 Ų163101.2 Ų101.262%0.61551%0.509SS*.Hα-helixtrans-60.4-43.1177.4-178.1174.962.3103.2-2.7111.7A118 D119 Q120 Q125 E126A118-R122 WeakPolarHBondContact O-CB 3.33Å; A118-R122 PolarHBondContact O-N 3.48Å; D119-R122 PolarHBondContact O-N 3.27Å; D119-R122 IonicContact OD1-CZ 3.62Å; D119-R122 IonicContact OD1-NE 2.65Å; D119-R122 PolarHBondContact OD1-NE 3.13Å; D119-R122 IonicContact OD1-NH2 2.84Å; D119-R122 PolarHBondContact OD1-NH2 3.41Å; Q120-R122 VanDerWaalsContact C-N 3.34Å; Q120-R122 PolarHBondContact O-N 3.41Å; R122-Q125 PolarHBondContact O-N 3.38Å; R122-E126 PolarHBondContact O-N 2.9Å
123Y98.1Very high97.4Very high145 Ų145102.3 Ų102.357%0.56951%0.511SS*.Hα-helixtrans-60.2-47.1175.3175.5-98000111.5D119 Q120 I121 Q125 E126 Q127D119-Y123 WeakPolarHBondContact O-CB 3.28Å; D119-Y123 PolarHBondContact O-N 2.97Å; Q120-Y123 PolarHBondContact O-N 3.45Å; I121-Y123 VanDerWaalsContact C-N 3.33Å; I121-Y123 PolarHBondContact O-N 3.28Å; Y123-Q125 VanDerWaalsContact C-N 3.34Å; Y123-Q125 PolarHBondContact O-N 2.98Å; Y123-E126 WeakPolarHBondContact O-CB 3.13Å; Y123-E126 PolarHBondContact O-N 3.09Å; Y123-Q127 HydrophobicContact CD1-CG 4.14Å; Y123-Q127 HydrophobicContact CE1-CG 3.7Å; Y123-Q127 HydrophobicContact CE2-CG 4.26Å; Y123-Q127 WeakPolarHBondContact O-CG 2.98Å; Y123-Q127 PolarHBondContact O-N 3.01Å
124L98.3Very high97.4Very high112 Ų11299.6 Ų99.659%0.58650%0.501SS*.Hα-helixtrans-62.7-39.8177.9-70173.6000112.4Q120 I121 E126 Q127 A128Q120-L124 WeakPolarHBondContact O-CG 3.39Å; Q120-L124 PolarHBondContact O-N 2.95Å; I121-L124 PolarHBondContact O-N 2.89Å; L124-E126 VanDerWaalsContact C-N 3.33Å; L124-E126 PolarHBondContact O-N 3.37Å; L124-Q127 PolarHBondContact O-N 3.48Å; L124-A128 WeakPolarHBondContact O-CB 3.18Å; L124-A128 PolarHBondContact O-N 3.33Å
125Q98.1Very high97.3Very high127 Ų12797 Ų9759%0.59350%0.495SS*.Hα-helixtrans-60.9-42.9174.7-73.8173.1-12.100111.7I121 R122 Y123 A128 K129I121-Q125 HydrophobicContact CG2-CG 4.38Å; I121-Q125 VanDerWaalsContact O-CG 3.3Å; I121-Q125 WeakPolarHBondContact O-CG 3.47Å; I121-Q125 PolarHBondContact O-N 2.9Å; R122-Q125 PolarHBondContact O-N 3.38Å; Y123-Q125 VanDerWaalsContact C-N 3.34Å; Y123-Q125 PolarHBondContact O-N 2.98Å; Q125-A128 PolarHBondContact O-N 3.39Å; Q125-K129 PolarHBondContact O-N 3.16Å
126E98.1Very high97.3Very high89 Ų8999.9 Ų99.942%0.41650%0.501SS..Hα-helixtrans-65.5-41.6176.8-173.959.4-151.300111.7R122 Y123 L124 K129 K130R122-E126 PolarHBondContact O-N 2.9Å; Y123-E126 WeakPolarHBondContact O-CB 3.13Å; Y123-E126 PolarHBondContact O-N 3.09Å; L124-E126 VanDerWaalsContact C-N 3.33Å; L124-E126 PolarHBondContact O-N 3.37Å; E126-K129 WeakPolarHBondContact O-CB 3.32Å; E126-K129 PolarHBondContact O-N 2.97Å; E126-K130 WeakPolarHBondContact O-CG 3.4Å; E126-K130 PolarHBondContact O-N 3.32Å; E126-K130 WeakPolarHBondContact OE1-CE 3.16Å
127Q98.3Very high97.3Very high69 Ų6999.5 Ų99.532%0.32249%0.49SS..Hα-helixtrans-60.7-46.2173.7-67.2-57-51.600111.6Y123 L124 K129 K130 V131Y123-Q127 HydrophobicContact CD1-CG 4.14Å; Y123-Q127 HydrophobicContact CE1-CG 3.7Å; Y123-Q127 HydrophobicContact CE2-CG 4.26Å; Y123-Q127 WeakPolarHBondContact O-CG 2.98Å; Y123-Q127 PolarHBondContact O-N 3.01Å; L124-Q127 PolarHBondContact O-N 3.48Å; Q127-K129 VanDerWaalsContact C-N 3.29Å; Q127-K129 PolarHBondContact O-N 3.29Å; Q127-K130 PolarHBondContact O-N 3.09Å; Q127-V131 WeakPolarHBondContact O-CG2 3.26Å; Q127-V131 PolarHBondContact O-N 3.42Å
128A97.7Very high97.3Very high54 Ų5496.8 Ų96.845%0.44648%0.476SS..Hα-helixtrans-60.7-40.1177.700000111.9L124 Q125 V131 L132L124-A128 WeakPolarHBondContact O-CB 3.18Å; L124-A128 PolarHBondContact O-N 3.33Å; Q125-A128 PolarHBondContact O-N 3.39Å; A128-V131 PolarHBondContact O-N 3.24Å; A128-L132 WeakPolarHBondContact O-CG 3.33Å; A128-L132 PolarHBondContact O-N 3.03Å; A128-L132 VanDerWaalsContact O-N 3.09Å
129K98.1Very high97.3Very high127 Ų12796 Ų9655%0.55247%0.47SS*.Hα-helixtrans-59.9-47.8175.4-123.7-178.9-178.9-179.30112Q125 E126 Q127 V131 L132 E133Q125-K129 PolarHBondContact O-N 3.16Å; E126-K129 WeakPolarHBondContact O-CB 3.32Å; E126-K129 PolarHBondContact O-N 2.97Å; Q127-K129 VanDerWaalsContact C-N 3.29Å; Q127-K129 PolarHBondContact O-N 3.29Å; K129-V131 PolarHBondContact O-N 3.2Å; K129-L132 PolarHBondContact O-N 3.14Å; K129-E133 WeakPolarHBondContact O-CG 3.28Å; K129-E133 PolarHBondContact O-N 3.24Å
130K97.1Very high97.2Very high87 Ų8797.3 Ų97.338%0.37848%0.477SS..Hα-helixtrans-58.8-47.7177.5-71.8174.3-179.4179.20111.6E126 Q127 L132 E133 E134E126-K130 WeakPolarHBondContact O-CG 3.4Å; E126-K130 PolarHBondContact O-N 3.32Å; E126-K130 WeakPolarHBondContact OE1-CE 3.16Å; Q127-K130 PolarHBondContact O-N 3.09Å; K130-L132 VanDerWaalsContact C-N 3.27Å; K130-L132 PolarHBondContact O-N 2.87Å; K130-E133 PolarHBondContact O-N 3.21Å; K130-E133 VanDerWaalsContact O-N 3.16Å; K130-E134 WeakPolarHBondContact O-CB 3.48Å; K130-E134 VanDerWaalsContact O-CG 3.25Å; K130-E134 WeakPolarHBondContact O-CG 3.36Å; K130-E134 PolarHBondContact O-N 2.94Å
131V97Very high97.1Very high86 Ų8692.4 Ų92.452%0.52146%0.455SS..Hα-helixtrans-57-41.8177.3172.50000111.6Q127 A128 K129 A135Q127-V131 WeakPolarHBondContact O-CG2 3.26Å; Q127-V131 PolarHBondContact O-N 3.42Å; A128-V131 PolarHBondContact O-N 3.24Å; K129-V131 PolarHBondContact O-N 3.2Å; V131-A135 VanDerWaalsContact O-CB 3.28Å; V131-A135 WeakPolarHBondContact O-CB 3.38Å; V131-A135 PolarHBondContact O-N 3.48Å
132L97.4Very high97Very high122 Ų12291.5 Ų91.564%0.63945%0.448SS*.Hα-helixtrans-67.9-41.1177.9-70.5172.1000112.9A128 K129 K130 K136A128-L132 WeakPolarHBondContact O-CG 3.33Å; A128-L132 PolarHBondContact O-N 3.03Å; A128-L132 VanDerWaalsContact O-N 3.09Å; K129-L132 PolarHBondContact O-N 3.14Å; K130-L132 VanDerWaalsContact C-N 3.27Å; K130-L132 PolarHBondContact O-N 2.87Å; L132-K136 WeakPolarHBondContact O-CB 3.45Å; L132-K136 PolarHBondContact O-N 3.41Å
133E97.3Very high96.9Very high126 Ų12691.5 Ų91.559%0.58946%0.455SS*.Hα-helixtrans-64.6-42.2176-72.2179.3175.800111.5K129 K130 K136 R137K129-E133 WeakPolarHBondContact O-CG 3.28Å; K129-E133 PolarHBondContact O-N 3.24Å; K130-E133 PolarHBondContact O-N 3.21Å; K130-E133 VanDerWaalsContact O-N 3.16Å; E133-K136 PolarHBondContact O-N 3.19Å; E133-R137 WeakPolarHBondContact O-CB 3.4Å; E133-R137 PolarHBondContact O-N 3.37Å
134E95.6Very high96.7Very high98 Ų9885.3 Ų85.346%0.45843%0.434SS..Hα-helixtrans-62.9-48.3175.4-69.2178-17800111.6K130 K136 R137 D138K130-E134 WeakPolarHBondContact O-CB 3.48Å; K130-E134 VanDerWaalsContact O-CG 3.25Å; K130-E134 WeakPolarHBondContact O-CG 3.36Å; K130-E134 PolarHBondContact O-N 2.94Å; E134-K136 VanDerWaalsContact C-N 3.33Å; E134-K136 PolarHBondContact O-N 2.91Å; E134-R137 VanDerWaalsContact CA-NH2 3.3Å; E134-R137 VanDerWaalsContact CB-NH2 3.34Å; E134-R137 VanDerWaalsContact CG-NH2 3.34Å; E134-R137 PolarHBondContact O-N 2.89Å; E134-D138 WeakPolarHBondContact O-CB 3.35Å; E134-D138 PolarHBondContact O-N 3.38Å
135A96.4Very high96.6Very high55 Ų5581.5 Ų81.546%0.45542%0.418SS..Hα-helixtrans-61.4-40.8177.800000112.1V131 D138 A139V131-A135 VanDerWaalsContact O-CB 3.28Å; V131-A135 WeakPolarHBondContact O-CB 3.38Å; V131-A135 PolarHBondContact O-N 3.48Å; A135-D138 PolarHBondContact O-N 3.45Å; A135-A139 WeakPolarHBondContact O-CB 3.25Å; A135-A139 PolarHBondContact O-N 3.05Å
136K97Very high96.3Very high141 Ų14177.2 Ų77.261%0.61340%0.402SS*.Hα-helixtrans-62.8-48175.7-178.7-177.3177-177.60111.2L132 E133 E134 D138 A139 D140L132-K136 WeakPolarHBondContact O-CB 3.45Å; L132-K136 PolarHBondContact O-N 3.41Å; E133-K136 PolarHBondContact O-N 3.19Å; E134-K136 VanDerWaalsContact C-N 3.33Å; E134-K136 PolarHBondContact O-N 2.91Å; K136-D138 VanDerWaalsContact C-N 3.34Å; K136-D138 PolarHBondContact O-N 3.23Å; K136-A139 WeakPolarHBondContact O-CB 3.43Å; K136-A139 PolarHBondContact O-N 3.38Å; K136-D140 PolarHBondContact O-N 2.93Å
137R95.9Very high96Very high76 Ų7680.7 Ų80.729%0.28742%0.424SS..Hα-helixtrans-61.6-44177.9177.6-174.344.152.62.3110.9E133 E134 A139 D140 L141 W196E133-R137 WeakPolarHBondContact O-CB 3.4Å; E133-R137 PolarHBondContact O-N 3.37Å; E134-R137 VanDerWaalsContact CA-NH2 3.3Å; E134-R137 VanDerWaalsContact CB-NH2 3.34Å; E134-R137 VanDerWaalsContact CG-NH2 3.34Å; E134-R137 PolarHBondContact O-N 2.89Å; R137-A139 VanDerWaalsContact C-N 3.33Å; R137-A139 PolarHBondContact O-N 3.06Å; R137-D140 PolarHBondContact O-N 3.27Å; R137-L141 HydrophobicContact CG-CD1 4.06Å; R137-L141 VanDerWaalsContact O-CG 3.26Å; R137-L141 WeakPolarHBondContact O-CG 3.38Å; R137-L141 PolarHBondContact O-N 2.91Å; R137-W196 PolarHBondContact NH1-O 3.09Å
138D96.3Very high95.7Very high27 Ų2780.6 Ų80.614%0.14443%0.425CS..Hα-helixtrans-61.1-43176.1-79.8-5.1000111.4E134 A135 K136 L141 H142 S195 W196E134-D138 WeakPolarHBondContact O-CB 3.35Å; E134-D138 PolarHBondContact O-N 3.38Å; A135-D138 PolarHBondContact O-N 3.45Å; K136-D138 VanDerWaalsContact C-N 3.34Å; K136-D138 PolarHBondContact O-N 3.23Å; D138-L141 PolarHBondContact O-N 3.03Å; D138-H142 WeakPolarHBondContact O-CB 3.34Å; D138-H142 PolarHBondContact O-CD2 3.26Å; D138-H142 PolarHBondContact O-N 3.28Å; D138-S195 WeakPolarHBondContact OD2-CA 3.38Å; D138-W196 WeakPolarHBondContact OD1-CB 3.46Å; D138-W196 PolarHBondContact OD1-N 3.44Å; D138-W196 VanDerWaalsContact OD1-N 3.08Å
139A96.3Very high95.4Very high40 Ų4083.8 Ų83.833%0.33144%0.438SS..Hα-helixtrans-60.5-48.3174.100000111.4A135 K136 R137 L141 H142 H143A135-A139 WeakPolarHBondContact O-CB 3.25Å; A135-A139 PolarHBondContact O-N 3.05Å; K136-A139 WeakPolarHBondContact O-CB 3.43Å; K136-A139 PolarHBondContact O-N 3.38Å; R137-A139 VanDerWaalsContact C-N 3.33Å; R137-A139 PolarHBondContact O-N 3.06Å; A139-L141 VanDerWaalsContact C-N 3.31Å; A139-L141 PolarHBondContact O-N 3.47Å; A139-H142 PolarHBondContact O-N 3.41Å; A139-H143 PolarHBondContact O-N 2.93Å; A139-H143 PolarHBondContact O-ND1 3.48Å
140D95.2Very high95.2Very high100 Ų10079.8 Ų79.854%0.53542%0.421SS..Hα-helixtrans-59.2-41.5178.6-72.9-17.9000111.8K136 R137 H143 A144K136-D140 PolarHBondContact O-N 2.93Å; R137-D140 PolarHBondContact O-N 3.27Å; D140-H143 PolarHBondContact O-N 3.23Å; D140-A144 PolarHBondContact O-N 3.23Å
141L95.9Very high95.1Very high12 Ų1281.8 Ų81.86%0.06343%0.43CS..Hα-helixtrans-70.6-39.1176.8-65.4171.3000111.5R137 D138 A139 H143 A144 K150 L158 F168 F188 W196R137-L141 HydrophobicContact CG-CD1 4.06Å; R137-L141 VanDerWaalsContact O-CG 3.26Å; R137-L141 WeakPolarHBondContact O-CG 3.38Å; R137-L141 PolarHBondContact O-N 2.91Å; D138-L141 PolarHBondContact O-N 3.03Å; A139-L141 VanDerWaalsContact C-N 3.31Å; A139-L141 PolarHBondContact O-N 3.47Å; L141-H143 VanDerWaalsContact C-N 3.29Å; L141-H143 PolarHBondContact O-N 3.11Å; L141-A144 WeakPolarHBondContact O-CB 3.36Å; L141-A144 PolarHBondContact O-N 2.85Å; L141-K150 PolarHBondContact O-NZ 2.89Å; L141-L158 HydrophobicContact CD2-CD2 4.04Å; L141-F168 HydrophobicContact CB-CE2 4.11Å; L141-F168 HydrophobicContact CB-CZ 4.04Å; L141-F168 HydrophobicContact CD2-CE1 4.41Å; L141-F168 HydrophobicContact CD2-CE2 4.35Å; L141-F168 HydrophobicContact CD2-CZ 3.65Å; L141-F168 HydrophobicContact CG-CZ 4.34Å; L141-F168 WeakPolarHBondContact O-CE2 3.47Å; L141-F188 HydrophobicContact CD1-CD1 3.89Å; L141-F188 HydrophobicContact CD1-CE1 4.05Å; L141-F188 HydrophobicContact CD1-CG 4.19Å; L141-F188 HydrophobicContact CD1-CZ 4.47Å; L141-F188 HydrophobicContact CD2-CD2 4.24Å; L141-F188 HydrophobicContact CD2-CE2 4.05Å; L141-F188 HydrophobicContact CD2-CZ 4.27Å; L141-W196 HydrophobicContact CB-CD2 4.06Å; L141-W196 HydrophobicContact CB-CG 3.92Å; L141-W196 HydrophobicContact CD1-CB 3.49Å; L141-W196 VanDerWaalsContact CD1-CB 3.49Å; L141-W196 HydrophobicContact CD1-CD2 4.17Å; L141-W196 HydrophobicContact CD1-CG 3.59Å; L141-W196 HydrophobicContact CG-CG 4.42Å
142H96Very high95.1Very high66 Ų6680.3 Ų80.331%0.30642%0.421SS..Hα-helixtrans-61.7-38.4173.9-82.2-52.2000112.4D138 A139 K150 M194 W196D138-H142 WeakPolarHBondContact O-CB 3.34Å; D138-H142 PolarHBondContact O-CD2 3.26Å; D138-H142 PolarHBondContact O-N 3.28Å; A139-H142 PolarHBondContact O-N 3.41Å; H142-K150 PolarHBondContact O-NZ 2.89Å; H142-M194 PolarHBondContact CE1-O 2.85Å; H142-M194 PolarHBondContact NE2-O 3.12Å; H142-W196 AromaticContact CD2-NE1 3.48Å; H142-W196 PolarHBondContact CD2-NE1 2.94Å; H142-W196 AromaticContact CE1-CE2 3.89Å; H142-W196 AromaticContact CE1-NE1 3.22Å; H142-W196 PolarHBondContact CE1-NE1 3.46Å; H142-W196 AromaticContact CG-NE1 3.57Å; H142-W196 AromaticContact ND1-NE1 3.41Å; H142-W196 PolarHBondContact ND1-NE1 3.29Å; H142-W196 AromaticContact NE2-CD1 3.76Å; H142-W196 AromaticContact NE2-NE1 3.25Å; H142-W196 PolarHBondContact NE2-NE1 3.41Å
143H94.6Very high94.9Very high163 Ų16376 Ų7676%0.75541%0.407SS*.Hα-helixtrans-81-13.7177.4-69.388.5000114.3A139 D140 L141 A145A139-H143 PolarHBondContact O-N 2.93Å; A139-H143 PolarHBondContact O-ND1 3.48Å; D140-H143 PolarHBondContact O-N 3.23Å; L141-H143 VanDerWaalsContact C-N 3.29Å; L141-H143 PolarHBondContact O-N 3.11Å; H143-A145 PolarHBondContact O-N 3.4Å
144A94.8Very high94.8Very high15 Ų1573.4 Ų73.412%0.12440%0.397CS..SBendtrans-57.8137.3176.500000111.1D140 L141 C146 L158 F168D140-A144 PolarHBondContact O-N 3.23Å; L141-A144 WeakPolarHBondContact O-CB 3.36Å; L141-A144 PolarHBondContact O-N 2.85Å; A144-C146 PolarHBondContact O-N 3.29Å; A144-L158 HydrophobicContact CB-CD1 4.1Å; A144-F168 HydrophobicContact CB-CD2 4.01Å; A144-F168 HydrophobicContact CB-CE2 4.09Å
145A94.8Very high94.9Very high31 Ų3171.2 Ų71.226%0.25639%0.387SS..BIsolated β-bridgetrans-58.3134.8-174.900000110.8H143 Q165 K166 Y167 F168H143-A145 PolarHBondContact O-N 3.4Å; A145-Q165 HydrophobicContact CB-CG 4.43Å; A145-K166 PolarHBondContact N-O 3.39Å; A145-Y167 CarbonylContact O-C 3.6Å; A145-Y167 WeakPolarHBondContact O-CA 3.35Å; A145-Y167 WeakPolarHBondContact O-CB 3.31Å; A145-F168 PolarHBondContact O-N 3.42Å
146C92.1Very high94.9Very high37 Ų3768.7 Ų68.725%0.2537%0.366CS..  trans-151.9124.6-175.2-1610000109.4A144 I148 F168A144-C146 PolarHBondContact O-N 3.29Å; C146-I148 VanDerWaalsContact C-N 3.29Å; C146-I148 WeakPolarHBondContact SG-CG1 3.5Å; C146-I148 PolarHBondContact SG-O 3.49Å; C146-I148 VanDerWaalsContact SG-O 3.36Å; C146-F168 HydrophobicContact CB-CB 4.47Å
147N92.8Very high94.8Very high163 Ų16364.2 Ų64.287%0.87235%0.346SS*.SBendtrans-939.5177.9-65.7-10.3000112.3
148I90.9Very high94.8Very high67 Ų6761.2 Ų61.234%0.34434%0.335SS..SBendtrans-128.1151.8-178.457173.9000109.5C146 K150 Y156 I170C146-I148 VanDerWaalsContact C-N 3.29Å; C146-I148 WeakPolarHBondContact SG-CG1 3.5Å; C146-I148 PolarHBondContact SG-O 3.49Å; C146-I148 VanDerWaalsContact SG-O 3.36Å; I148-K150 PolarHBondContact O-N 2.93Å; I148-Y156 HydrophobicContact CD1-CD1 4.14Å; I148-Y156 HydrophobicContact CD1-CE1 3.85Å; I148-I170 HydrophobicContact CD1-CB 4.34Å; I148-I170 HydrophobicContact CD1-CG1 4.42Å; I148-I170 HydrophobicContact CD1-CG2 3.35Å
149V91.8Very high94.8Very high121 Ų12159.9 Ų59.973%0.73333%0.328SS*.  trans-73.4122.8173.8-179.40000108.9K151V149-K151 PolarHBondContact O-N 3.5Å
150K93.8Very high94.8Very high42 Ų4261.3 Ų61.318%0.18333%0.328CS..  trans-70.7109.9176.7-64173177.6179.60109.3L141 H142 I148 Y156 L190 W196L141-K150 PolarHBondContact O-NZ 2.89Å; H142-K150 PolarHBondContact O-NZ 2.89Å; I148-K150 PolarHBondContact O-N 2.93Å; K150-Y156 WeakPolarHBondContact CA-OH 3.38Å; K150-L190 HydrophobicContact CB-CD2 3.82Å; K150-W196 HydrophobicContact CD-CH2 4.18Å; K150-W196 HydrophobicContact CD-CZ2 3.9Å
151K95.4Very high94.7Very high130 Ų13061.1 Ų61.157%0.56532%0.32SS*.  trans-99.4131172.1-60.3-174.6-179.2-177.50110.6V149 Y156V149-K151 PolarHBondContact O-N 3.5Å; K151-Y156 PolarHBondContact N-OH 2.84Å; K151-Y156 PolarHBondContact O-OH 2.87Å
152P96Very high94.6Very high54 Ų5466.7 Ų66.735%0.35136%0.356SS..THydrogen-bonded Turntrans-55.8152.5169.4-26.435.9000112.8N154 L190 M194P152-N154 PolarHBondContact O-N 3.29Å; P152-L190 CarbonylContact C-O 3.58Å; P152-M194 HydrophobicContact CG-SD 3.84Å
153G94.5Very high94.5Very high32 Ų3268.1 Ų68.133%0.3337%0.374SS..THydrogen-bonded Turntrans84.5-18.5-176.600000114.5L190G153-L190 PolarHBondContact N-O 3.11Å
154N95.4Very high94.4Very high72 Ų7262.2 Ų62.239%0.38536%0.357SS..  trans-86.4153.4-177.7-70.1-7.7000112.9P152 Y156 K189 L190P152-N154 PolarHBondContact O-N 3.29Å; N154-Y156 HydrophobicContact CB-CE2 3.66Å; N154-Y156 WeakPolarHBondContact O-CD2 3.49Å; N154-Y156 WeakPolarHBondContact O-CE2 3.38Å; N154-K189 WeakPolarHBondContact O-CA 3.5Å; N154-L190 PolarHBondContact O-N 3.12Å; N154-L190 VanDerWaalsContact O-N 3.07Å
155M96Very high94.4Very high51 Ų5166.4 Ų66.425%0.25137%0.374SS..EExtended strand (participates in β ladder)trans-89.3137.8170.7-16665.266.600110.5Y157 A187 K189 V199 V202M155-Y157 HydrophobicContact CB-CE2 4.36Å; M155-Y157 HydrophobicContact CG-CE1 4.13Å; M155-Y157 HydrophobicContact CG-CE2 3.93Å; M155-A187 HydrophobicContact SD-CB 4.34Å; M155-K189 HydrophobicContact CE-CB 4.02Å; M155-K189 HydrophobicContact SD-CB 4.16Å; M155-V199 HydrophobicContact CE-CB 4.46Å; M155-V199 HydrophobicContact CE-CG2 3.94Å; M155-V199 HydrophobicContact SD-CB 4.34Å; M155-V199 HydrophobicContact SD-CG2 4.3Å; M155-V202 HydrophobicContact CE-CG2 4.33Å
156Y96.5Very high94.4Very high2 Ų270.3 Ų70.31%0.00839%0.385CS..EExtended strand (participates in β ladder)trans-128.3140.5176.6-59.6-92.1000109.9I148 K150 K151 N154 I170 A187 F188 L190 W196I148-Y156 HydrophobicContact CD1-CD1 4.14Å; I148-Y156 HydrophobicContact CD1-CE1 3.85Å; K150-Y156 WeakPolarHBondContact CA-OH 3.38Å; K151-Y156 PolarHBondContact N-OH 2.84Å; K151-Y156 PolarHBondContact O-OH 2.87Å; N154-Y156 HydrophobicContact CB-CE2 3.66Å; N154-Y156 WeakPolarHBondContact O-CD2 3.49Å; N154-Y156 WeakPolarHBondContact O-CE2 3.38Å; Y156-I170 HydrophobicContact CD1-CG2 4.35Å; Y156-I170 HydrophobicContact CE1-CG2 4.22Å; Y156-A187 CarbonylContact O-C 3.51Å; Y156-A187 WeakPolarHBondContact O-CA 3.42Å; Y156-F188 PolarHBondContact N-O 3.03Å; Y156-F188 PolarHBondContact O-N 3.46Å; Y156-L190 HydrophobicContact CD2-CB 4.17Å; Y156-L190 HydrophobicContact CE2-CB 3.78Å; Y156-L190 HydrophobicContact CE2-CD2 4.43Å; Y156-W196 AromaticContact CD2-CH2 3.81Å; Y156-W196 HydrophobicContact CD2-CH2 3.81Å; Y156-W196 AromaticContact CD2-CZ3 3.49Å; Y156-W196 HydrophobicContact CD2-CZ3 3.49Å; Y156-W196 VanDerWaalsContact CD2-CZ3 3.49Å; Y156-W196 HydrophobicContact CE2-CH2 4.3Å; Y156-W196 HydrophobicContact CE2-CZ3 4.26Å; Y156-W196 HydrophobicContact CG-CH2 4.09Å; Y156-W196 AromaticContact CG-CZ3 3.93Å; Y156-W196 HydrophobicContact CG-CZ3 3.93Å
157Y96.1Very high94.6Very high48 Ų4869.9 Ų69.919%0.18838%0.379CS..EExtended strand (participates in β ladder)trans-113.4122.1-176.8-58.5-86.5000108.9M155 Y159 F168 S169 I170 F184 A187M155-Y157 HydrophobicContact CB-CE2 4.36Å; M155-Y157 HydrophobicContact CG-CE1 4.13Å; M155-Y157 HydrophobicContact CG-CE2 3.93Å; Y157-Y159 WeakPolarHBondContact O-CD2 3.3Å; Y157-F168 WeakPolarHBondContact O-CA 3.46Å; Y157-S169 PolarHBondContact N-O 3.35Å; Y157-S169 PolarHBondContact O-N 3.46Å; Y157-I170 WeakPolarHBondContact CE2-O 3.26Å; Y157-F184 AromaticContact CD1-CE2 3.92Å; Y157-F184 HydrophobicContact CD1-CE2 3.92Å; Y157-F184 HydrophobicContact CD1-CZ 4.41Å; Y157-A187 HydrophobicContact CD1-CB 3.54Å; Y157-A187 HydrophobicContact CE1-CB 3.63Å
158L95.9Very high94.8Very high12 Ų1262.4 Ų62.46%0.06334%0.339CS..EExtended strand (participates in β ladder)trans-91.1128.2-177.6-168.770.3000110L141 A144 K166 F168 L185 G186 F188L141-L158 HydrophobicContact CD2-CD2 4.04Å; A144-L158 HydrophobicContact CB-CD1 4.1Å; L158-K166 HydrophobicContact CD1-CB 4.19Å; L158-K166 HydrophobicContact CD2-CD 4.43Å; L158-F168 HydrophobicContact CB-CD1 4.03Å; L158-F168 HydrophobicContact CB-CE1 3.83Å; L158-F168 HydrophobicContact CD1-CD1 3.82Å; L158-F168 HydrophobicContact CD1-CD2 4.47Å; L158-F168 HydrophobicContact CD1-CE1 3.84Å; L158-F168 HydrophobicContact CD1-CG 4.17Å; L158-F168 HydrophobicContact CD1-CZ 4.22Å; L158-F168 HydrophobicContact CG-CE1 4.39Å; L158-L185 HydrophobicContact CB-CB 4.35Å; L158-L185 HydrophobicContact CD2-CB 4.17Å; L158-L185 HydrophobicContact CD2-CD1 4.11Å; L158-L185 HydrophobicContact CG-CB 4.27Å; L158-L185 HydrophobicContact CG-CD1 4.25Å; L158-L185 PolarHBondContact O-N 2.86Å; L158-G186 PolarHBondContact N-O 2.72Å; L158-F188 HydrophobicContact CB-CD2 4.47Å; L158-F188 HydrophobicContact CB-CE2 4.16Å; L158-F188 HydrophobicContact CD2-CE2 4.29Å
159Y95.7Very high94.9Very high0 Ų060 Ų600%033%0.328CS..EExtended strand (participates in β ladder)trans-127.4162.4178.8-64.2-85.7000111.1Y157 K166 Y167 I171 S172 P173 W176 H182 P183 F184Y157-Y159 WeakPolarHBondContact O-CD2 3.3Å; Y159-K166 WeakPolarHBondContact O-CA 3.41Å; Y159-Y167 HydrophobicContact CD2-CE2 4.48Å; Y159-Y167 PolarHBondContact N-O 3.17Å; Y159-Y167 PolarHBondContact O-N 3.27Å; Y159-I171 PolarHBondContact OH-O 3.28Å; Y159-S172 VanDerWaalsContact OH-C 3.27Å; Y159-P173 HydrophobicContact CE1-CG 4.28Å; Y159-P173 WeakPolarHBondContact OH-CD 3.43Å; Y159-P173 WeakPolarHBondContact OH-CG 3.4Å; Y159-W176 AromaticContact CZ-CD1 3.99Å; Y159-H182 HydrophobicContact CD1-CB 4.41Å; Y159-H182 WeakPolarHBondContact CD1-O 3.31Å; Y159-P183 WeakPolarHBondContact CA-O 3.47Å; Y159-F184 HydrophobicContact CD1-CB 4.16Å; Y159-F184 HydrophobicContact CD1-CD2 4.35Å; Y159-F184 HydrophobicContact CE1-CB 3.9Å; Y159-F184 AromaticContact CE1-CD2 3.87Å; Y159-F184 HydrophobicContact CE1-CD2 3.87Å; Y159-F184 HydrophobicContact CE1-CG 4.36Å
160Q95.7Very high95Very high70 Ų7059 Ų5933%0.32732%0.317SS..EExtended strand (participates in β ladder)trans-118.9127175.8-163.8172.62500112G164 H182 P183 L185Q160-G164 PolarHBondContact NE2-O 2.91Å; Q160-G164 VanDerWaalsContact NE2-O 3.14Å; Q160-H182 WeakPolarHBondContact O-CB 3.45Å; Q160-P183 PolarHBondContact N-O 3.42Å; Q160-P183 VanDerWaalsContact N-O 3.09Å; Q160-P183 WeakPolarHBondContact O-CD 3.39Å; Q160-L185 HydrophobicContact CB-CD1 4.04Å; Q160-L185 HydrophobicContact CB-CD2 4.46Å; Q160-L185 HydrophobicContact CB-CG 4.29Å
161R94.6Very high95Very high95 Ų9559.9 Ų59.936%0.35832%0.323SS..  trans-74.1161171.6-69.3-175.7-179.8-88.92.1111.2S163 G164 Q165 Y167R161-S163 PolarHBondContact O-N 3.41Å; R161-S163 VanDerWaalsContact O-N 3.13Å; R161-G164 WeakPolarHBondContact O-CA 3.38Å; R161-G164 PolarHBondContact O-N 3.27Å; R161-Q165 PolarHBondContact N-O 2.95Å; R161-Y167 HydrophobicContact CG-CD1 3.79Å; R161-Y167 HydrophobicContact CG-CE1 3.72Å
162P93.5Very high94.9Very high129 Ų12954.3 Ų54.384%0.83830%0.3SS*.THydrogen-bonded Turntrans-59.4-24173.1-22.434.9000113.1G164P162-G164 PolarHBondContact O-N 3.41Å
163S93.9Very high94.8Very high96 Ų9653.6 Ų53.667%0.67130%0.296SS*.THydrogen-bonded Turntrans-69.4-6.3172.262.30000114.2R161 Q165R161-S163 PolarHBondContact O-N 3.41Å; R161-S163 VanDerWaalsContact O-N 3.13Å; S163-Q165 VanDerWaalsContact C-N 3.3Å
164G92.2Very high94.7Very high39 Ų3961.3 Ų61.340%0.40232%0.32SS..SBendtrans87.5-10.2-174.200000114.3Q160 R161 P162 K166Q160-G164 PolarHBondContact NE2-O 2.91Å; Q160-G164 VanDerWaalsContact NE2-O 3.14Å; R161-G164 WeakPolarHBondContact O-CA 3.38Å; R161-G164 PolarHBondContact O-N 3.27Å; P162-G164 PolarHBondContact O-N 3.41Å; G164-K166 PolarHBondContact O-N 2.88Å
165Q94.6Very high94.6Very high103 Ų10364.2 Ų64.248%0.48133%0.332SS..  trans-67.6126.5-179.5-171.4179.641.200111.5A145 R161 S163A145-Q165 HydrophobicContact CB-CG 4.43Å; R161-Q165 PolarHBondContact N-O 2.95Å; S163-Q165 VanDerWaalsContact C-N 3.3Å
166K95.8Very high94.3Very high113 Ų11365.5 Ų65.549%0.49133%0.334SS..EExtended strand (participates in β ladder)trans-85.5135.9172.6-60.7-179.7-176.1174.80110.2A145 L158 Y159 G164 L185A145-K166 PolarHBondContact N-O 3.39Å; L158-K166 HydrophobicContact CD1-CB 4.19Å; L158-K166 HydrophobicContact CD2-CD 4.43Å; Y159-K166 WeakPolarHBondContact O-CA 3.41Å; G164-K166 PolarHBondContact O-N 2.88Å; K166-L185 HydrophobicContact CD-CD1 3.95Å; K166-L185 HydrophobicContact CG-CD1 3.9Å
167Y95.6Very high93.9Very high28 Ų2867 Ų6711%0.1135%0.349CS..EExtended strand (participates in β ladder)trans-144.5151.917875.4-79.7000112A145 Y159 R161 H182A145-Y167 CarbonylContact O-C 3.6Å; A145-Y167 WeakPolarHBondContact O-CA 3.35Å; A145-Y167 WeakPolarHBondContact O-CB 3.31Å; Y159-Y167 HydrophobicContact CD2-CE2 4.48Å; Y159-Y167 PolarHBondContact N-O 3.17Å; Y159-Y167 PolarHBondContact O-N 3.27Å; R161-Y167 HydrophobicContact CG-CD1 3.79Å; R161-Y167 HydrophobicContact CG-CE1 3.72Å; Y167-H182 HydrophobicContact CE1-CB 4.36Å; Y167-H182 AromaticContact CE1-ND1 3.84Å; Y167-H182 AromaticContact CZ-ND1 3.66Å; Y167-H182 PolarHBondContact OH-ND1 3.05Å
168F96.1Very high93.3Very high7 Ų771.4 Ų71.43%0.03138%0.384CS..EExtended strand (participates in β ladder)trans-92.5144.2175.7-82.9-55.5000112.5L141 A144 A145 C146 Y157 L158 F188 W196L141-F168 HydrophobicContact CB-CE2 4.11Å; L141-F168 HydrophobicContact CB-CZ 4.04Å; L141-F168 HydrophobicContact CD2-CE1 4.41Å; L141-F168 HydrophobicContact CD2-CE2 4.35Å; L141-F168 HydrophobicContact CD2-CZ 3.65Å; L141-F168 HydrophobicContact CG-CZ 4.34Å; L141-F168 WeakPolarHBondContact O-CE2 3.47Å; A144-F168 HydrophobicContact CB-CD2 4.01Å; A144-F168 HydrophobicContact CB-CE2 4.09Å; A145-F168 PolarHBondContact O-N 3.42Å; C146-F168 HydrophobicContact CB-CB 4.47Å; Y157-F168 WeakPolarHBondContact O-CA 3.46Å; L158-F168 HydrophobicContact CB-CD1 4.03Å; L158-F168 HydrophobicContact CB-CE1 3.83Å; L158-F168 HydrophobicContact CD1-CD1 3.82Å; L158-F168 HydrophobicContact CD1-CD2 4.47Å; L158-F168 HydrophobicContact CD1-CE1 3.84Å; L158-F168 HydrophobicContact CD1-CG 4.17Å; L158-F168 HydrophobicContact CD1-CZ 4.22Å; L158-F168 HydrophobicContact CG-CE1 4.39Å; F168-F188 HydrophobicContact CE1-CD2 4.05Å; F168-F188 HydrophobicContact CZ-CD2 4.42Å; F168-W196 HydrophobicContact CD2-CH2 4.34Å; F168-W196 HydrophobicContact CE1-CZ3 4.45Å; F168-W196 AromaticContact CE2-CH2 3.7Å; F168-W196 HydrophobicContact CE2-CH2 3.7Å; F168-W196 AromaticContact CE2-CZ2 3.87Å; F168-W196 HydrophobicContact CE2-CZ2 3.87Å; F168-W196 HydrophobicContact CE2-CZ3 4.17Å; F168-W196 HydrophobicContact CZ-CE3 4.24Å; F168-W196 AromaticContact CZ-CH2 3.9Å; F168-W196 HydrophobicContact CZ-CH2 3.9Å; F168-W196 HydrophobicContact CZ-CZ2 4.28Å; F168-W196 AromaticContact CZ-CZ3 3.87Å; F168-W196 HydrophobicContact CZ-CZ3 3.87Å
169S93.9Very high92.7Very high17 Ų1775 Ų7512%0.11941%0.411CS..EExtended strand (participates in β ladder)trans-131.2155.2169-1770000110Y157 I171Y157-S169 PolarHBondContact N-O 3.35Å; Y157-S169 PolarHBondContact O-N 3.46Å; S169-I171 PolarHBondContact OG-N 3.33Å; S169-I171 VanDerWaalsContact OG-N 3.14Å
170I94.1Very high92.2Very high98 Ų9877.2 Ų77.250%0.50343%0.426SS..SBendtrans-84.3-15.7169.247.7166.2000112.8I148 Y156 Y157I148-I170 HydrophobicContact CD1-CB 4.34Å; I148-I170 HydrophobicContact CD1-CG1 4.42Å; I148-I170 HydrophobicContact CD1-CG2 3.35Å; Y156-I170 HydrophobicContact CD1-CG2 4.35Å; Y156-I170 HydrophobicContact CE1-CG2 4.22Å; Y157-I170 WeakPolarHBondContact CE2-O 3.26Å
171I93.4Very high91.6Very high62 Ų6277.1 Ų77.132%0.31843%0.431SS..SBendtrans-87.1127.1-177.5-54.6177000108.9Y159 S169 E175 W176Y159-I171 PolarHBondContact OH-O 3.28Å; S169-I171 PolarHBondContact OG-N 3.33Å; S169-I171 VanDerWaalsContact OG-N 3.14Å; I171-E175 WeakPolarHBondContact CA-OE2 3.42Å; I171-E175 HydrophobicContact CG2-CB 3.65Å; I171-W176 HydrophobicContact CB-CZ2 4.31Å; I171-W176 HydrophobicContact CD1-CH2 4.31Å; I171-W176 HydrophobicContact CD1-CZ2 3.86Å; I171-W176 HydrophobicContact CG2-CD2 4.03Å; I171-W176 HydrophobicContact CG2-CG 3.9Å; I171-W176 HydrophobicContact CG2-CZ2 4.43Å
172S94.2Very high91.5Very high12 Ų1274 Ų748%0.08442%0.421CS..  trans-76.7158.6-179.874.80000112.7Y159 K174 E175 W176Y159-S172 VanDerWaalsContact OH-C 3.27Å; S172-K174 PolarHBondContact O-N 2.96Å; S172-K174 VanDerWaalsContact O-N 3.15Å; S172-E175 PolarHBondContact N-OE2 3.43Å; S172-E175 PolarHBondContact O-N 2.9Å; S172-E175 VanDerWaalsContact O-N 3.11Å; S172-E175 VanDerWaalsContact OG-CG 3.29Å; S172-E175 WeakPolarHBondContact OG-CG 3.45Å; S172-E175 PolarHBondContact OG-N 3.26Å; S172-E175 PolarHBondContact OG-OE2 2.89Å; S172-W176 PolarHBondContact O-N 2.91Å
173P93.2Very high91.6Very high39 Ų3972 Ų7225%0.25341%0.407SS..Hα-helixtrans-58.4-29.6175.3-23.732.9000113.2Y159 G177 F184Y159-P173 HydrophobicContact CE1-CG 4.28Å; Y159-P173 WeakPolarHBondContact OH-CD 3.43Å; Y159-P173 WeakPolarHBondContact OH-CG 3.4Å; P173-G177 PolarHBondContact O-N 3.23Å; P173-F184 HydrophobicContact CB-CG 4.45Å; P173-F184 HydrophobicContact CG-CB 3.99Å; P173-F184 HydrophobicContact CG-CD1 3.93Å; P173-F184 HydrophobicContact CG-CD2 3.31Å; P173-F184 HydrophobicContact CG-CE1 4.2Å; P173-F184 HydrophobicContact CG-CE2 3.61Å; P173-F184 HydrophobicContact CG-CG 3.46Å; P173-F184 VanDerWaalsContact CG-CG 3.46Å; P173-F184 HydrophobicContact CG-CZ 4.04Å
174K91.7Very high91.6Very high194 Ų19471.9 Ų71.984%0.84340%0.395SS*.Hα-helixtrans-70.5-41.2177.6-65.4-178.9-180178.20111.6S172 G177S172-K174 PolarHBondContact O-N 2.96Å; S172-K174 VanDerWaalsContact O-N 3.15Å; K174-G177 PolarHBondContact O-N 3.27Å
175E93.1Very high91.8Very high134 Ų13473.7 Ų73.763%0.62640%0.395SS*.Hα-helixtrans-70.5-33.8177.4-72.2167.1163.100112.5I171 S172 G177I171-E175 WeakPolarHBondContact CA-OE2 3.42Å; I171-E175 HydrophobicContact CG2-CB 3.65Å; S172-E175 PolarHBondContact N-OE2 3.43Å; S172-E175 PolarHBondContact O-N 2.9Å; S172-E175 VanDerWaalsContact O-N 3.11Å; S172-E175 VanDerWaalsContact OG-CG 3.29Å; S172-E175 WeakPolarHBondContact OG-CG 3.45Å; S172-E175 PolarHBondContact OG-N 3.26Å; S172-E175 PolarHBondContact OG-OE2 2.89Å; E175-G177 PolarHBondContact O-N 2.95Å
176W90.7Very high91.8Very high77 Ų7769.3 Ų69.329%0.29238%0.377SS..Hα-helixtrans-64.2-28.7170.8-81.7112.5000113.3Y159 I171 S172 S179 C180 P181Y159-W176 AromaticContact CZ-CD1 3.99Å; I171-W176 HydrophobicContact CB-CZ2 4.31Å; I171-W176 HydrophobicContact CD1-CH2 4.31Å; I171-W176 HydrophobicContact CD1-CZ2 3.86Å; I171-W176 HydrophobicContact CG2-CD2 4.03Å; I171-W176 HydrophobicContact CG2-CG 3.9Å; I171-W176 HydrophobicContact CG2-CZ2 4.43Å; S172-W176 PolarHBondContact O-N 2.91Å; W176-S179 PolarHBondContact O-N 3.43Å; W176-S179 VanDerWaalsContact O-N 3.13Å; W176-C180 HydrophobicContact CB-CB 3.8Å; W176-C180 HydrophobicContact CG-CB 4.41Å; W176-P181 HydrophobicContact CE3-CG 4.42Å; W176-P181 HydrophobicContact CH2-CG 4.23Å; W176-P181 HydrophobicContact CZ2-CG 4.35Å; W176-P181 HydrophobicContact CZ3-CG 4.26Å
177G87.9Confident91.9Very high33 Ų3364.3 Ų64.334%0.3436%0.357SS..G310 helixtrans53.3-140.1-176.900000112.4P173 K174 E175 S179 C180P173-G177 PolarHBondContact O-N 3.23Å; K174-G177 PolarHBondContact O-N 3.27Å; E175-G177 PolarHBondContact O-N 2.95Å; G177-S179 PolarHBondContact O-N 3.09Å; G177-S179 VanDerWaalsContact O-N 3.16Å; G177-C180 PolarHBondContact O-N 2.94Å
178P83.9Confident91.9Very high141 Ų14164.3 Ų64.392%0.91636%0.358SS*.G310 helixtrans-68.1-11.6179.928.9-34.1000113.5C180P178-C180 VanDerWaalsContact C-N 3.33Å
179S83.5Confident92Very high89 Ų8965.4 Ų65.462%0.62236%0.362SS*.G310 helixtrans-93.416.5-179.6-58.60000113W176 G177 P181W176-S179 PolarHBondContact O-N 3.43Å; W176-S179 VanDerWaalsContact O-N 3.13Å; G177-S179 PolarHBondContact O-N 3.09Å; G177-S179 VanDerWaalsContact O-N 3.16Å; S179-P181 WeakPolarHBondContact O-CD 3.46Å; S179-P181 VanDerWaalsContact O-N 3.07Å
180C85.1Confident92.1Very high46 Ų4664.6 Ų64.631%0.31136%0.357SS..  trans-60.1111177.2-169.20000110.3W176 G177 P178 H182W176-C180 HydrophobicContact CB-CB 3.8Å; W176-C180 HydrophobicContact CG-CB 4.41Å; G177-C180 PolarHBondContact O-N 2.94Å; P178-C180 VanDerWaalsContact C-N 3.33Å; C180-H182 VanDerWaalsContact C-N 3.27Å; C180-H182 PolarHBondContact O-N 2.95Å; C180-H182 PolarHBondContact SG-O 3.12Å
181P83.1Confident92.2Very high68 Ų6860.2 Ų60.244%0.44233%0.334SS..  trans-75.9-18.4-166.526.9-32.1000113.1W176 S179W176-P181 HydrophobicContact CE3-CG 4.42Å; W176-P181 HydrophobicContact CH2-CG 4.23Å; W176-P181 HydrophobicContact CZ2-CG 4.35Å; W176-P181 HydrophobicContact CZ3-CG 4.26Å; S179-P181 WeakPolarHBondContact O-CD 3.46Å; S179-P181 VanDerWaalsContact O-N 3.07Å
182H92.6Very high92.2Very high30 Ų3064.6 Ų64.614%0.13935%0.353CS..SBendtrans-144.6149.1-167.3-63.2109.6000111.4Y159 Q160 Y167 C180 F184Y159-H182 HydrophobicContact CD1-CB 4.41Å; Y159-H182 WeakPolarHBondContact CD1-O 3.31Å; Q160-H182 WeakPolarHBondContact O-CB 3.45Å; Y167-H182 HydrophobicContact CE1-CB 4.36Å; Y167-H182 AromaticContact CE1-ND1 3.84Å; Y167-H182 AromaticContact CZ-ND1 3.66Å; Y167-H182 PolarHBondContact OH-ND1 3.05Å; C180-H182 VanDerWaalsContact C-N 3.27Å; C180-H182 PolarHBondContact O-N 2.95Å; C180-H182 PolarHBondContact SG-O 3.12Å; H182-F184 PolarHBondContact O-N 2.85Å
183P94.6Very high92.2Very high86 Ų8669.1 Ų69.156%0.55838%0.376SS*.  trans-55.1132.4172-2734.7000112.6Y159 Q160Y159-P183 WeakPolarHBondContact CA-O 3.47Å; Q160-P183 PolarHBondContact N-O 3.42Å; Q160-P183 VanDerWaalsContact N-O 3.09Å; Q160-P183 WeakPolarHBondContact O-CD 3.39Å
184F95.3Very high92.2Very high93 Ų9371.5 Ų71.541%0.40839%0.385SS..EExtended strand (participates in β ladder)trans-82.3131.4175.8174.7-113.1000110.6Y157 Y159 P173 H182 G186 A187Y157-F184 AromaticContact CD1-CE2 3.92Å; Y157-F184 HydrophobicContact CD1-CE2 3.92Å; Y157-F184 HydrophobicContact CD1-CZ 4.41Å; Y159-F184 HydrophobicContact CD1-CB 4.16Å; Y159-F184 HydrophobicContact CD1-CD2 4.35Å; Y159-F184 HydrophobicContact CE1-CB 3.9Å; Y159-F184 AromaticContact CE1-CD2 3.87Å; Y159-F184 HydrophobicContact CE1-CD2 3.87Å; Y159-F184 HydrophobicContact CE1-CG 4.36Å; P173-F184 HydrophobicContact CB-CG 4.45Å; P173-F184 HydrophobicContact CG-CB 3.99Å; P173-F184 HydrophobicContact CG-CD1 3.93Å; P173-F184 HydrophobicContact CG-CD2 3.31Å; P173-F184 HydrophobicContact CG-CE1 4.2Å; P173-F184 HydrophobicContact CG-CE2 3.61Å; P173-F184 HydrophobicContact CG-CG 3.46Å; P173-F184 VanDerWaalsContact CG-CG 3.46Å; P173-F184 HydrophobicContact CG-CZ 4.04Å; H182-F184 PolarHBondContact O-N 2.85Å; F184-G186 WeakPolarHBondContact CE2-O 3.33Å; F184-G186 VanDerWaalsContact CZ-CA 3.46Å; F184-A187 HydrophobicContact CE2-CB 4.34Å; F184-A187 HydrophobicContact CZ-CB 3.95Å
185L94.9Very high92.3Very high77 Ų7763.2 Ų63.240%0.40335%0.351SS..EExtended strand (participates in β ladder)trans-105.8-33.2-179.8-62.9-175.4000113.2L158 Q160 K166L158-L185 HydrophobicContact CB-CB 4.35Å; L158-L185 HydrophobicContact CD2-CB 4.17Å; L158-L185 HydrophobicContact CD2-CD1 4.11Å; L158-L185 HydrophobicContact CG-CB 4.27Å; L158-L185 HydrophobicContact CG-CD1 4.25Å; L158-L185 PolarHBondContact O-N 2.86Å; Q160-L185 HydrophobicContact CB-CD1 4.04Å; Q160-L185 HydrophobicContact CB-CD2 4.46Å; Q160-L185 HydrophobicContact CB-CG 4.29Å; K166-L185 HydrophobicContact CD-CD1 3.95Å; K166-L185 HydrophobicContact CG-CD1 3.9Å
186G95.6Very high92.5Very high11 Ų1157 Ų5711%0.11332%0.322CS..EExtended strand (participates in β ladder)trans169.3162.1-17800000113.2L158 F184L158-G186 PolarHBondContact N-O 2.72Å; F184-G186 WeakPolarHBondContact CE2-O 3.33Å; F184-G186 VanDerWaalsContact CZ-CA 3.46Å
187A96.8Very high92.8Very high8 Ų853.5 Ų53.57%0.06631%0.31CS..EExtended strand (participates in β ladder)trans-117.5137.8176.100000109.6M155 Y156 Y157 F184 V199M155-A187 HydrophobicContact SD-CB 4.34Å; Y156-A187 CarbonylContact O-C 3.51Å; Y156-A187 WeakPolarHBondContact O-CA 3.42Å; Y157-A187 HydrophobicContact CD1-CB 3.54Å; Y157-A187 HydrophobicContact CE1-CB 3.63Å; F184-A187 HydrophobicContact CE2-CB 4.34Å; F184-A187 HydrophobicContact CZ-CB 3.95Å; A187-V199 HydrophobicContact CB-CB 3.82Å; A187-V199 HydrophobicContact CB-CG1 3.85Å; A187-V199 HydrophobicContact CB-CG2 4.44Å; A187-V199 PolarHBondContact O-N 2.97Å
188F97.1Very high93.2Very high29 Ų2953.4 Ų53.413%0.12730%0.303CS..EExtended strand (participates in β ladder)trans-140.4134.8-174-55.9-91.1000110.3L141 Y156 L158 F168 W196 T197 P198L141-F188 HydrophobicContact CD1-CD1 3.89Å; L141-F188 HydrophobicContact CD1-CE1 4.05Å; L141-F188 HydrophobicContact CD1-CG 4.19Å; L141-F188 HydrophobicContact CD1-CZ 4.47Å; L141-F188 HydrophobicContact CD2-CD2 4.24Å; L141-F188 HydrophobicContact CD2-CE2 4.05Å; L141-F188 HydrophobicContact CD2-CZ 4.27Å; Y156-F188 PolarHBondContact N-O 3.03Å; Y156-F188 PolarHBondContact O-N 3.46Å; L158-F188 HydrophobicContact CB-CD2 4.47Å; L158-F188 HydrophobicContact CB-CE2 4.16Å; L158-F188 HydrophobicContact CD2-CE2 4.29Å; F168-F188 HydrophobicContact CE1-CD2 4.05Å; F168-F188 HydrophobicContact CZ-CD2 4.42Å; F188-W196 HydrophobicContact CB-CE3 3.7Å; F188-W196 HydrophobicContact CB-CZ3 4.3Å; F188-T197 CarbonylContact C-O 3.55Å; F188-T197 VanDerWaalsContact CA-O 3.28Å; F188-T197 WeakPolarHBondContact CA-O 3.22Å; F188-P198 HydrophobicContact CD1-CB 4.34Å; F188-P198 HydrophobicContact CD1-CG 4.3Å; F188-P198 HydrophobicContact CE1-CB 4.34Å; F188-P198 HydrophobicContact CE1-CG 4.21Å
189K97Very high93.7Very high29 Ų2949.6 Ų49.613%0.12628%0.277CS..EExtended strand (participates in β ladder)trans-90.4130.3169.2-174.8-180175.2-165.50108.9N154 M155 T197 V202 D206N154-K189 WeakPolarHBondContact O-CA 3.5Å; M155-K189 HydrophobicContact CE-CB 4.02Å; M155-K189 HydrophobicContact SD-CB 4.16Å; K189-T197 PolarHBondContact N-O 3.08Å; K189-T197 PolarHBondContact O-N 3Å; K189-V202 HydrophobicContact CB-CG2 3.58Å; K189-V202 HydrophobicContact CD-CB 4.45Å; K189-V202 HydrophobicContact CD-CG1 3.5Å; K189-V202 HydrophobicContact CD-CG2 4.03Å; K189-V202 HydrophobicContact CG-CG2 4.48Å; K189-D206 IonicContact NZ-OD1 3.62Å; K189-D206 PolarHBondContact NZ-OD1 3.2Å; K189-D206 IonicContact NZ-OD2 2.95Å; K189-D206 PolarHBondContact NZ-OD2 3.06Å
190L96.8Very high94.3Very high0 Ų052.6 Ų52.60%029%0.286CS..EExtended strand (participates in β ladder)trans-81.3116.9169.3-178.159.7000108.4K150 P152 G153 N154 Y156 M194 W196K150-L190 HydrophobicContact CB-CD2 3.82Å; P152-L190 CarbonylContact C-O 3.58Å; G153-L190 PolarHBondContact N-O 3.11Å; N154-L190 PolarHBondContact O-N 3.12Å; N154-L190 VanDerWaalsContact O-N 3.07Å; Y156-L190 HydrophobicContact CD2-CB 4.17Å; Y156-L190 HydrophobicContact CE2-CB 3.78Å; Y156-L190 HydrophobicContact CE2-CD2 4.43Å; L190-M194 HydrophobicContact CD2-CE 4.4Å; L190-M194 HydrophobicContact CD2-SD 4.47Å; L190-W196 HydrophobicContact CB-CE3 4.1Å; L190-W196 HydrophobicContact CB-CH2 4.05Å; L190-W196 HydrophobicContact CB-CZ3 3.8Å; L190-W196 HydrophobicContact CD1-CD2 4.04Å; L190-W196 HydrophobicContact CD1-CE3 4.34Å; L190-W196 HydrophobicContact CD1-CH2 4.27Å; L190-W196 HydrophobicContact CD1-CZ2 3.93Å; L190-W196 HydrophobicContact CD1-CZ3 4.46Å; L190-W196 HydrophobicContact CD2-CH2 4.37Å; L190-W196 HydrophobicContact CD2-CZ2 4.47Å; L190-W196 HydrophobicContact CG-CH2 4.48Å
191Q95.6Very high94.7Very high6 Ų655.6 Ų55.63%0.02830%0.295CS..PPolyproline II helixtrans-80.6168.5-179.5-62.5-64.6-2.900111.9D193 M194 S195 T197Q191-D193 WeakPolarHBondContact CB-OD1 3.03Å; Q191-D193 PolarHBondContact O-N 3.33Å; Q191-M194 PolarHBondContact O-N 3.42Å; Q191-S195 WeakPolarHBondContact CB-O 3.44Å; Q191-S195 PolarHBondContact N-O 3.44Å; Q191-T197 WeakPolarHBondContact CG-OG1 3.36Å; Q191-T197 PolarHBondContact NE2-OG1 3.41Å
192H94.2Very high95.3Very high155 Ų15553.1 Ų53.172%0.71828%0.279SS*.THydrogen-bonded Turntrans-66.9-24.7-179-67.288.3000113.6M194H192-M194 PolarHBondContact O-N 3.15Å
193D92.6Very high95.4Very high107 Ų10759.6 Ų59.657%0.57231%0.309SS*.THydrogen-bonded Turntrans-85.59.4173.165.3-5.3000113Q191 S195Q191-D193 WeakPolarHBondContact CB-OD1 3.03Å; Q191-D193 PolarHBondContact O-N 3.33Å; D193-S195 PolarHBondContact O-N 3.31Å; D193-S195 VanDerWaalsContact OD1-CB 3.31Å; D193-S195 WeakPolarHBondContact OD1-CB 3.15Å; D193-S195 PolarHBondContact OD1-N 2.8Å; D193-S195 PolarHBondContact OD1-OG 3.19Å; D193-S195 PolarHBondContact OD2-OG 2.93Å
194M93.9Very high95.4Very high89 Ų8962.3 Ų62.344%0.43831%0.312SS..SBendtrans66.810.9-176.1-55.9-66.5-69.300115.3H142 P152 L190 Q191 H192H142-M194 PolarHBondContact CE1-O 2.85Å; H142-M194 PolarHBondContact NE2-O 3.12Å; P152-M194 HydrophobicContact CG-SD 3.84Å; L190-M194 HydrophobicContact CD2-CE 4.4Å; L190-M194 HydrophobicContact CD2-SD 4.47Å; Q191-M194 PolarHBondContact O-N 3.42Å; H192-M194 PolarHBondContact O-N 3.15Å
195S94.9Very high95.3Very high19 Ų1962.2 Ų62.213%0.13331%0.309CS..  trans-77.7156.117068.20000111.6D138 Q191 D193D138-S195 WeakPolarHBondContact OD2-CA 3.38Å; Q191-S195 WeakPolarHBondContact CB-O 3.44Å; Q191-S195 PolarHBondContact N-O 3.44Å; D193-S195 PolarHBondContact O-N 3.31Å; D193-S195 VanDerWaalsContact OD1-CB 3.31Å; D193-S195 WeakPolarHBondContact OD1-CB 3.15Å; D193-S195 PolarHBondContact OD1-N 2.8Å; D193-S195 PolarHBondContact OD1-OG 3.19Å; D193-S195 PolarHBondContact OD2-OG 2.93Å
196W96.4Very high95.1Very high4 Ų461.1 Ų61.12%0.01530%0.304CS..EExtended strand (participates in β ladder)trans-102.8125.5175-65.291.2000111R137 D138 L141 H142 K150 Y156 F168 F188 L190R137-W196 PolarHBondContact NH1-O 3.09Å; D138-W196 WeakPolarHBondContact OD1-CB 3.46Å; D138-W196 PolarHBondContact OD1-N 3.44Å; D138-W196 VanDerWaalsContact OD1-N 3.08Å; L141-W196 HydrophobicContact CB-CD2 4.06Å; L141-W196 HydrophobicContact CB-CG 3.92Å; L141-W196 HydrophobicContact CD1-CB 3.49Å; L141-W196 VanDerWaalsContact CD1-CB 3.49Å; L141-W196 HydrophobicContact CD1-CD2 4.17Å; L141-W196 HydrophobicContact CD1-CG 3.59Å; L141-W196 HydrophobicContact CG-CG 4.42Å; H142-W196 AromaticContact CD2-NE1 3.48Å; H142-W196 PolarHBondContact CD2-NE1 2.94Å; H142-W196 AromaticContact CE1-CE2 3.89Å; H142-W196 AromaticContact CE1-NE1 3.22Å; H142-W196 PolarHBondContact CE1-NE1 3.46Å; H142-W196 AromaticContact CG-NE1 3.57Å; H142-W196 AromaticContact ND1-NE1 3.41Å; H142-W196 PolarHBondContact ND1-NE1 3.29Å; H142-W196 AromaticContact NE2-CD1 3.76Å; H142-W196 AromaticContact NE2-NE1 3.25Å; H142-W196 PolarHBondContact NE2-NE1 3.41Å; K150-W196 HydrophobicContact CD-CH2 4.18Å; K150-W196 HydrophobicContact CD-CZ2 3.9Å; Y156-W196 AromaticContact CD2-CH2 3.81Å; Y156-W196 HydrophobicContact CD2-CH2 3.81Å; Y156-W196 AromaticContact CD2-CZ3 3.49Å; Y156-W196 HydrophobicContact CD2-CZ3 3.49Å; Y156-W196 VanDerWaalsContact CD2-CZ3 3.49Å; Y156-W196 HydrophobicContact CE2-CH2 4.3Å; Y156-W196 HydrophobicContact CE2-CZ3 4.26Å; Y156-W196 HydrophobicContact CG-CH2 4.09Å; Y156-W196 AromaticContact CG-CZ3 3.93Å; Y156-W196 HydrophobicContact CG-CZ3 3.93Å; F168-W196 HydrophobicContact CD2-CH2 4.34Å; F168-W196 HydrophobicContact CE1-CZ3 4.45Å; F168-W196 AromaticContact CE2-CH2 3.7Å; F168-W196 HydrophobicContact CE2-CH2 3.7Å; F168-W196 AromaticContact CE2-CZ2 3.87Å; F168-W196 HydrophobicContact CE2-CZ2 3.87Å; F168-W196 HydrophobicContact CE2-CZ3 4.17Å; F168-W196 HydrophobicContact CZ-CE3 4.24Å; F168-W196 AromaticContact CZ-CH2 3.9Å; F168-W196 HydrophobicContact CZ-CH2 3.9Å; F168-W196 HydrophobicContact CZ-CZ2 4.28Å; F168-W196 AromaticContact CZ-CZ3 3.87Å; F168-W196 HydrophobicContact CZ-CZ3 3.87Å; F188-W196 HydrophobicContact CB-CE3 3.7Å; F188-W196 HydrophobicContact CB-CZ3 4.3Å; L190-W196 HydrophobicContact CB-CE3 4.1Å; L190-W196 HydrophobicContact CB-CH2 4.05Å; L190-W196 HydrophobicContact CB-CZ3 3.8Å; L190-W196 HydrophobicContact CD1-CD2 4.04Å; L190-W196 HydrophobicContact CD1-CE3 4.34Å; L190-W196 HydrophobicContact CD1-CH2 4.27Å; L190-W196 HydrophobicContact CD1-CZ2 3.93Å; L190-W196 HydrophobicContact CD1-CZ3 4.46Å; L190-W196 HydrophobicContact CD2-CH2 4.37Å; L190-W196 HydrophobicContact CD2-CZ2 4.47Å; L190-W196 HydrophobicContact CG-CH2 4.48Å
197T96.5Very high95.1Very high4 Ų463.5 Ų63.53%0.02532%0.322CS..EExtended strand (participates in β ladder)trans-108.3124.3173.9-50.80000110F188 K189 Q191 E201 V202 R205F188-T197 CarbonylContact C-O 3.55Å; F188-T197 VanDerWaalsContact CA-O 3.28Å; F188-T197 WeakPolarHBondContact CA-O 3.22Å; K189-T197 PolarHBondContact N-O 3.08Å; K189-T197 PolarHBondContact O-N 3Å; Q191-T197 WeakPolarHBondContact CG-OG1 3.36Å; Q191-T197 PolarHBondContact NE2-OG1 3.41Å; T197-E201 HydrophobicContact CG2-CB 3.84Å; T197-V202 HydrophobicContact CG2-CG2 3.97Å; T197-R205 HydrophobicContact CG2-CB 4.01Å; T197-R205 HydrophobicContact CG2-CG 4.3Å
198P96.5Very high94.9Very high31 Ų3166.9 Ų66.920%0.20134%0.337CS..EExtended strand (participates in β ladder)trans-56.8144.1171.3-21.132.1000111.1F188 D200 E201 V202F188-P198 HydrophobicContact CD1-CB 4.34Å; F188-P198 HydrophobicContact CD1-CG 4.3Å; F188-P198 HydrophobicContact CE1-CB 4.34Å; F188-P198 HydrophobicContact CE1-CG 4.21Å; P198-D200 PolarHBondContact O-N 3.42Å; P198-D200 VanDerWaalsContact O-N 3.08Å; P198-E201 PolarHBondContact O-N 3.39Å; P198-V202 WeakPolarHBondContact O-CG2 3.38Å; P198-V202 PolarHBondContact O-N 2.95Å
199V95.1Very high94.5Very high60 Ų6069.1 Ų69.136%0.36435%0.349SS..G310 helixtrans-51.4-37.5-175.5660000113.5M155 A187 E201 V202M155-V199 HydrophobicContact CE-CB 4.46Å; M155-V199 HydrophobicContact CE-CG2 3.94Å; M155-V199 HydrophobicContact SD-CB 4.34Å; M155-V199 HydrophobicContact SD-CG2 4.3Å; A187-V199 HydrophobicContact CB-CB 3.82Å; A187-V199 HydrophobicContact CB-CG1 3.85Å; A187-V199 HydrophobicContact CB-CG2 4.44Å; A187-V199 PolarHBondContact O-N 2.97Å; V199-E201 PolarHBondContact O-N 2.96Å; V199-V202 PolarHBondContact O-N 3.46Å
200D95.3Very high94.3Very high152 Ų15270 Ų7081%0.81336%0.361SS*.G310 helixtrans-70.2-20.5-178.3-55.5-39.4000113P198P198-D200 PolarHBondContact O-N 3.42Å; P198-D200 VanDerWaalsContact O-N 3.08Å
201E94.9Very high94.1Very high110 Ų11072.4 Ų72.451%0.51438%0.381SS..G310 helixtrans-102.6-9.5-178.4-66.2179.7-165.600113.1T197 P198 V199 E203 K204 R205T197-E201 HydrophobicContact CG2-CB 3.84Å; P198-E201 PolarHBondContact O-N 3.39Å; V199-E201 PolarHBondContact O-N 2.96Å; E201-E203 PolarHBondContact O-N 3.4Å; E201-K204 PolarHBondContact O-N 2.99Å; E201-R205 WeakPolarHBondContact O-CB 3.29Å; E201-R205 PolarHBondContact O-N 3.23Å
202V94.6Very high93.8Very high15 Ų1578.2 Ų78.29%0.09141%0.41CS..Hα-helixtrans-56.5-49.3-174.7168.30000111.9M155 K189 T197 P198 V199 K204 R205 D206M155-V202 HydrophobicContact CE-CG2 4.33Å; K189-V202 HydrophobicContact CB-CG2 3.58Å; K189-V202 HydrophobicContact CD-CB 4.45Å; K189-V202 HydrophobicContact CD-CG1 3.5Å; K189-V202 HydrophobicContact CD-CG2 4.03Å; K189-V202 HydrophobicContact CG-CG2 4.48Å; T197-V202 HydrophobicContact CG2-CG2 3.97Å; P198-V202 WeakPolarHBondContact O-CG2 3.38Å; P198-V202 PolarHBondContact O-N 2.95Å; V199-V202 PolarHBondContact O-N 3.46Å; V202-K204 VanDerWaalsContact C-N 3.33Å; V202-K204 PolarHBondContact O-N 3.31Å; V202-R205 PolarHBondContact O-N 3.05Å; V202-D206 WeakPolarHBondContact CG1-OD2 3.48Å; V202-D206 VanDerWaalsContact O-CB 3.3Å; V202-D206 WeakPolarHBondContact O-CB 3.47Å; V202-D206 PolarHBondContact O-N 3.13Å
203E94.4Very high93.6Very high167 Ų16774.4 Ų74.478%0.7840%0.401SS*.Hα-helixtrans-62.3-43-176.6-64-176.1172.100111.7E201 A207E201-E203 PolarHBondContact O-N 3.4Å; E203-A207 VanDerWaalsContact O-CB 3.27Å; E203-A207 WeakPolarHBondContact O-CB 3.44Å; E203-A207 PolarHBondContact O-N 2.95Å
204K94.9Very high93.5Very high142 Ų14275.7 Ų75.762%0.61740%0.402SS*.Hα-helixtrans-63.5-49177.2179.4-178.1169.4-172.20110.9E201 V202 A207 E208E201-K204 PolarHBondContact O-N 2.99Å; V202-K204 VanDerWaalsContact C-N 3.33Å; V202-K204 PolarHBondContact O-N 3.31Å; K204-A207 PolarHBondContact O-N 3.2Å; K204-E208 WeakPolarHBondContact CE-OE1 3.36Å; K204-E208 WeakPolarHBondContact O-CG 3.47Å; K204-E208 PolarHBondContact O-N 2.95Å
205R92.5Very high93.2Very high92 Ų9276.7 Ų76.735%0.34741%0.408SS..Hα-helixtrans-61.5-45.7-179.8-162.192.3179.9102.82111.3T197 E201 V202 A207 E208 I209T197-R205 HydrophobicContact CG2-CB 4.01Å; T197-R205 HydrophobicContact CG2-CG 4.3Å; E201-R205 WeakPolarHBondContact O-CB 3.29Å; E201-R205 PolarHBondContact O-N 3.23Å; V202-R205 PolarHBondContact O-N 3.05Å; R205-A207 VanDerWaalsContact C-N 3.33Å; R205-A207 PolarHBondContact O-N 2.96Å; R205-E208 IonicContact NH1-OE2 3.5Å; R205-E208 PolarHBondContact O-N 3.19Å; R205-I209 HydrophobicContact CG-CD1 4.11Å; R205-I209 WeakPolarHBondContact O-CB 3.4Å; R205-I209 WeakPolarHBondContact O-CD1 3.33Å; R205-I209 VanDerWaalsContact O-CG1 3.24Å; R205-I209 WeakPolarHBondContact O-CG1 3.42Å; R205-I209 PolarHBondContact O-N 3.11Å
206D92.1Very high92.8Very high54 Ų5482.6 Ų82.629%0.28944%0.437SS..Hα-helixtrans-63.3-40.2178-72.4-10.4000110.9K189 V202 I209 A210K189-D206 IonicContact NZ-OD1 3.62Å; K189-D206 PolarHBondContact NZ-OD1 3.2Å; K189-D206 IonicContact NZ-OD2 2.95Å; K189-D206 PolarHBondContact NZ-OD2 3.06Å; V202-D206 WeakPolarHBondContact CG1-OD2 3.48Å; V202-D206 VanDerWaalsContact O-CB 3.3Å; V202-D206 WeakPolarHBondContact O-CB 3.47Å; V202-D206 PolarHBondContact O-N 3.13Å; D206-I209 PolarHBondContact O-N 2.78Å; D206-A210 VanDerWaalsContact O-CB 3.29Å; D206-A210 WeakPolarHBondContact O-CB 3.46Å; D206-A210 PolarHBondContact O-N 2.69Å
207A94.1Very high92.2Very high61 Ų6186.7 Ų86.750%0.50447%0.467SS..Hα-helixtrans-66-41.9175.900000112.7E203 K204 R205 A210 A211E203-A207 VanDerWaalsContact O-CB 3.27Å; E203-A207 WeakPolarHBondContact O-CB 3.44Å; E203-A207 PolarHBondContact O-N 2.95Å; K204-A207 PolarHBondContact O-N 3.2Å; R205-A207 VanDerWaalsContact C-N 3.33Å; R205-A207 PolarHBondContact O-N 2.96Å; A207-A210 PolarHBondContact O-N 3.39Å; A207-A211 WeakPolarHBondContact O-CB 3.43Å; A207-A211 PolarHBondContact O-N 3.2Å
208E92.5Very high91.4Very high79 Ų7993.5 Ų93.537%0.36950%0.498SS..Hα-helixtrans-60.5-48.7174-74.4171.8-176.900111.1K204 R205 A210 A211 M212K204-E208 WeakPolarHBondContact CE-OE1 3.36Å; K204-E208 WeakPolarHBondContact O-CG 3.47Å; K204-E208 PolarHBondContact O-N 2.95Å; R205-E208 IonicContact NH1-OE2 3.5Å; R205-E208 PolarHBondContact O-N 3.19Å; E208-A210 VanDerWaalsContact C-N 3.32Å; E208-A210 PolarHBondContact O-N 3.17Å; E208-A211 PolarHBondContact O-N 3.2Å; E208-M212 VanDerWaalsContact O-CG 3.3Å; E208-M212 WeakPolarHBondContact O-CG 3.44Å; E208-M212 PolarHBondContact O-N 3.19Å
209I90.6Very high90Very high76 Ų7698.3 Ų98.339%0.3952%0.518SS..Hα-helixtrans-60.8-42.6177.3-68.3164.9000110.6R205 D206 M212 S213R205-I209 HydrophobicContact CG-CD1 4.11Å; R205-I209 WeakPolarHBondContact O-CB 3.4Å; R205-I209 WeakPolarHBondContact O-CD1 3.33Å; R205-I209 VanDerWaalsContact O-CG1 3.24Å; R205-I209 WeakPolarHBondContact O-CG1 3.42Å; R205-I209 PolarHBondContact O-N 3.11Å; D206-I209 PolarHBondContact O-N 2.78Å; I209-M212 PolarHBondContact O-N 3.03Å; I209-S213 VanDerWaalsContact O-CB 3.29Å; I209-S213 WeakPolarHBondContact O-CB 3.46Å; I209-S213 PolarHBondContact O-N 3.45Å
210A91.8Very high88.2Confident46 Ų46101 Ų10138%0.3854%0.535SS..Hα-helixtrans-64.6-39.9177.500000112.2D206 A207 E208 K214D206-A210 VanDerWaalsContact O-CB 3.29Å; D206-A210 WeakPolarHBondContact O-CB 3.46Å; D206-A210 PolarHBondContact O-N 2.69Å; A207-A210 PolarHBondContact O-N 3.39Å; E208-A210 VanDerWaalsContact C-N 3.32Å; E208-A210 PolarHBondContact O-N 3.17Å; A210-K214 VanDerWaalsContact O-CG 3.32Å; A210-K214 WeakPolarHBondContact O-CG 3.24Å; A210-K214 PolarHBondContact O-N 2.98Å
211A91.9Very high86.4Confident51 Ų5198.8 Ų98.842%0.42154%0.537SS..Hα-helixtrans-64.7-45.2174.900000111.5A207 E208 K214 L215A207-A211 WeakPolarHBondContact O-CB 3.43Å; A207-A211 PolarHBondContact O-N 3.2Å; E208-A211 PolarHBondContact O-N 3.2Å; A211-K214 PolarHBondContact O-N 3.17Å; A211-L215 WeakPolarHBondContact O-CG 3.35Å; A211-L215 PolarHBondContact O-N 3.46Å; A211-L215 VanDerWaalsContact O-N 3.14Å
212M89.9Confident84.7Confident128 Ų128101 Ų10163%0.63155%0.552SS**Hα-helixtrans-63.4-42.5177.2-69.9175.67200112.3E208 I209 K214 L215 L216E208-M212 VanDerWaalsContact O-CG 3.3Å; E208-M212 WeakPolarHBondContact O-CG 3.44Å; E208-M212 PolarHBondContact O-N 3.19Å; I209-M212 PolarHBondContact O-N 3.03Å; M212-K214 VanDerWaalsContact C-N 3.32Å; M212-K214 PolarHBondContact O-N 3.39Å; M212-L215 PolarHBondContact O-N 2.9Å; M212-L215 VanDerWaalsContact O-N 3.12Å; M212-L216 PolarHBondContact O-N 3.43Å
213S89.3Confident83.3Confident75 Ų75105.3 Ų105.352%0.52458%0.58SS.*Hα-helixtrans-59.8-41.4177.3179.10000112I209 L216 S217I209-S213 VanDerWaalsContact O-CB 3.29Å; I209-S213 WeakPolarHBondContact O-CB 3.46Å; I209-S213 PolarHBondContact O-N 3.45Å; S213-L216 PolarHBondContact O-N 2.89Å; S213-S217 PolarHBondContact O-N 3.44Å
214K90.4Very high81.8Confident135 Ų135103.3 Ų103.359%0.58758%0.581SS**Hα-helixtrans-61.4-43.9172.8-69.3168.8-174.4177.70111.7A210 A211 M212 L216 S217 H218A210-K214 VanDerWaalsContact O-CG 3.32Å; A210-K214 WeakPolarHBondContact O-CG 3.24Å; A210-K214 PolarHBondContact O-N 2.98Å; A211-K214 PolarHBondContact O-N 3.17Å; M212-K214 VanDerWaalsContact C-N 3.32Å; M212-K214 PolarHBondContact O-N 3.39Å; K214-L216 VanDerWaalsContact C-N 3.33Å; K214-L216 PolarHBondContact O-N 3.41Å; K214-S217 PolarHBondContact O-N 3.45Å; K214-S217 PolarHBondContact O-OG 3.47Å; K214-H218 PolarHBondContact O-CD2 2.92Å; K214-H218 PolarHBondContact O-N 3.09Å
215L88.8Confident80Confident110 Ų110102.5 Ų102.558%0.57659%0.592SS**Hα-helixtrans-62.9-42178-67.3172.1000111.9A211 M212 S217 H218 Q219A211-L215 WeakPolarHBondContact O-CG 3.35Å; A211-L215 PolarHBondContact O-N 3.46Å; A211-L215 VanDerWaalsContact O-N 3.14Å; M212-L215 PolarHBondContact O-N 2.9Å; M212-L215 VanDerWaalsContact O-N 3.12Å; L215-S217 VanDerWaalsContact C-N 3.31Å; L215-S217 PolarHBondContact O-N 3Å; L215-H218 PolarHBondContact O-N 3.28Å; L215-H218 VanDerWaalsContact O-N 3.12Å; L215-Q219 PolarHBondContact O-N 3.08Å
216L85.7Confident78.8Confident143 Ų143104.7 Ų104.775%0.74962%0.616SS**Hα-helixtrans-64.8-34.7178.9-169.469.3000112.4M212 S213 K214 H218M212-L216 PolarHBondContact O-N 3.43Å; S213-L216 PolarHBondContact O-N 2.89Å; K214-L216 VanDerWaalsContact C-N 3.33Å; K214-L216 PolarHBondContact O-N 3.41Å; L216-H218 PolarHBondContact O-N 3.42Å
217S85.4Confident77.8Confident90 Ų90104.6 Ų104.663%0.62963%0.627SS**Hα-helixtrans-72.2-16.8175.868.20000113.5S213 K214 L215S213-S217 PolarHBondContact O-N 3.44Å; K214-S217 PolarHBondContact O-N 3.45Å; K214-S217 PolarHBondContact O-OG 3.47Å; L215-S217 VanDerWaalsContact C-N 3.31Å; L215-S217 PolarHBondContact O-N 3Å
218H78Confident76.3Confident146 Ų146106.5 Ų106.568%0.67664%0.635SS**Hα-helixtrans-100-16.2-175.1-71.3-52.1000115.7K214 L215 L216K214-H218 PolarHBondContact O-CD2 2.92Å; K214-H218 PolarHBondContact O-N 3.09Å; L215-H218 PolarHBondContact O-N 3.28Å; L215-H218 VanDerWaalsContact O-N 3.12Å; L216-H218 PolarHBondContact O-N 3.42Å
219Q67.3Low75.1Confident132 Ų132108.4 Ų108.462%0.61765%0.647SS**  trans-133.8113-174.1-77.4-178.151.700111.5L215L215-Q219 PolarHBondContact O-N 3.08Å
220T57.6Low73.7Confident118 Ų118111.7 Ų111.772%0.72466%0.659SS**  62.212187.753.20000115.2L222T220-L222 PolarHBondContact O-N 3.22Å
221A58.5Low72.3Confident104 Ų104120.1 Ų120.186%0.8668%0.681SS**PPolyproline II helixtrans-50.5121.1-178.400000112.4
222L59.6Low70.6Confident158 Ų158120.6 Ų120.683%0.82769%0.691SS**PPolyproline II helixtrans-69137.2167-67.3171.7000108.8T220T220-L222 PolarHBondContact O-N 3.22Å
223P63.5Low69.1Low104 Ų104121.1 Ų121.168%0.67570%0.696SS**PPolyproline II helixtrans-59.7151.2172.624.2-31.6000110.4C225P223-C225 PolarHBondContact O-N 3.06Å
224P63.5Low67.7Low125 Ų125125.4 Ų125.481%0.81271%0.713SS**  trans-57.6114.9-177.6-19.930.2000110.8T226P224-T226 PolarHBondContact O-N 2.91Å
225C58.1Low65.4Low126 Ų126131.2 Ų131.285%0.85174%0.742SS**  trans-69.399.817322.50000108.6P223 G227P223-C225 PolarHBondContact O-N 3.06Å; C225-G227 PolarHBondContact O-N 3.34Å
226T66.5Low64.3Low138 Ų138132.3 Ų132.385%0.84775%0.75SS**  trans-67.3122.9165.3-52.10000106.5P224P224-T226 PolarHBondContact O-N 2.91Å
227G69.9Low63.1Low51 Ų51131.7 Ų131.753%0.52675%0.75SS.*  trans-56165.1-17100000114.2C225 N229C225-G227 PolarHBondContact O-N 3.34Å; G227-N229 PolarHBondContact O-N 3.39Å
228P64.3Low61.9Low101 Ų101134 Ų13466%0.65676%0.757SS**  trans-57.5114.5177.323.5-32.3000109.8F230P228-F230 HydrophobicContact CB-CD2 4.24Å; P228-F230 HydrophobicContact CB-CE2 3.67Å; P228-F230 HydrophobicContact CB-CZ 3.85Å; P228-F230 HydrophobicContact CG-CD2 4.3Å; P228-F230 HydrophobicContact CG-CE2 3.53Å; P228-F230 HydrophobicContact CG-CZ 4Å; P228-F230 WeakPolarHBondContact O-CD2 3.31Å; P228-F230 PolarHBondContact O-N 3.41Å; P228-F230 VanDerWaalsContact O-N 3.09Å
229N66.1Low61Low119 Ų119133.3 Ų133.364%0.63676%0.762SS**  trans-78.692.6-179.4-1677.5000108.3G227 R231G227-N229 PolarHBondContact O-N 3.39Å; N229-R231 PolarHBondContact O-N 3.19Å; N229-R231 WeakPolarHBondContact OD1-CB 3.47Å; N229-R231 PolarHBondContact OD1-NE 2.93Å
230F62.6Low60.6Low146 Ų146133.4 Ų133.464%0.6477%0.771SS**  trans-81.712.3176.2-64.8-74.3000113.6P228 G232 L233P228-F230 HydrophobicContact CB-CD2 4.24Å; P228-F230 HydrophobicContact CB-CE2 3.67Å; P228-F230 HydrophobicContact CB-CZ 3.85Å; P228-F230 HydrophobicContact CG-CD2 4.3Å; P228-F230 HydrophobicContact CG-CE2 3.53Å; P228-F230 HydrophobicContact CG-CZ 4Å; P228-F230 WeakPolarHBondContact O-CD2 3.31Å; P228-F230 PolarHBondContact O-N 3.41Å; P228-F230 VanDerWaalsContact O-N 3.09Å; F230-G232 PolarHBondContact O-N 3.5Å; F230-L233 HydrophobicContact CD1-CD1 4.17Å
231R60.6Low60.8Low222 Ų222134.4 Ų134.484%0.83877%0.774SS**THydrogen-bonded Turntrans-65107.1174.6-84.4-171.8-90.7-134.2-0.4109.4N229N229-R231 PolarHBondContact O-N 3.19Å; N229-R231 WeakPolarHBondContact OD1-CB 3.47Å; N229-R231 PolarHBondContact OD1-NE 2.93Å
232G56.4Low60.9Low61 Ų61136.6 Ų136.663%0.62977%0.768SS**THydrogen-bonded Turntrans132.212.8172.600000116.7F230F230-G232 PolarHBondContact O-N 3.5Å
233L58.5Low61Low139 Ų139134.9 Ų134.973%0.72876%0.763SS**SBendtrans-97.33.3175.6-67178000114.4F230F230-L233 HydrophobicContact CD1-CD1 4.17Å
234D60.8Low60.8Low165 Ų165137.5 Ų137.588%0.88277%0.77SS**  trans-111.314.1-176.3-61.9-46.4000113.9
235E42.6Very low60.6Low257 Ų257138.6 Ų138.6100%1.20177%0.767SS**  trans-104.70175.8-96.7-173.2136.600113.5

Retrieved 235 of 235 residues in 139.6 ms (Link to these results)