A0A061ILR1_CRIGR Loading...

Neurexophilin

May be signaling molecules that resemble neuropeptides.

AlphaFold DB , UniProt , Accession A0A061ILR1, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene LOC113832924, Length 305 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
1M37.9Very low56.2Low243 Ų243148.7 Ų148.7100%1.19772%0.72SS**  0119.30-74178.8175.700108.7
2R46.5Very low56.3Low238 Ų238145.7 Ų145.790%0.89870%0.701SS**  trans53.794.2156.7-59.2-171.9174.4174.3-0.9119.2L4R2-L4 PolarHBondContact O-N 3.35Å
3L52.9Low56.7Low178 Ų178136.5 Ų136.593%0.93267%0.668SS**PPolyproline II helixtrans-55.1117.1152.2-75.9148.1000109.1
4L60.7Low57.1Low140 Ų140133.4 Ų133.473%0.73366%0.664SS**PPolyproline II helixtrans-70.7133168.6-111.786.9000108.6R2R2-L4 PolarHBondContact O-N 3.35Å
5P60.3Low56.9Low68 Ų68136.4 Ų136.444%0.44266%0.664SS.*PPolyproline II helixtrans-86.5129.6-174.536.1-37.4000111.2W7 L8P5-W7 VanDerWaalsContact CB-CD1 3.41Å; P5-W7 PolarHBondContact O-N 2.88Å; P5-L8 PolarHBondContact O-N 3.37Å
6E58.7Low56.9Low156 Ų156134.8 Ų134.873%0.72966%0.659SS**THydrogen-bonded Turntrans-49.8-15.2-176.4-74.5-95.310100115.9L8 L9E6-L8 VanDerWaalsContact C-N 3.27Å; E6-L8 PolarHBondContact O-N 3.44Å; E6-L9 PolarHBondContact O-N 3.39Å
7W60.3Low56.9Low152 Ų152134.5 Ų134.558%0.57666%0.66SS**Hα-helixtrans-70.4-20.1178.367.1-91.6000113.9P5 L9 L10 L11P5-W7 VanDerWaalsContact CB-CD1 3.41Å; P5-W7 PolarHBondContact O-N 2.88Å; W7-L9 VanDerWaalsContact C-N 3.3Å; W7-L9 PolarHBondContact O-N 3.2Å; W7-L10 PolarHBondContact O-N 3.35Å; W7-L11 HydrophobicContact CE3-CD1 3.46Å; W7-L11 VanDerWaalsContact CE3-CD1 3.46Å; W7-L11 HydrophobicContact CZ3-CD1 3.51Å; W7-L11 PolarHBondContact O-N 3.4Å
8L59.7Low56.4Low71 Ų71138.6 Ų138.637%0.37267%0.667SS.*Hα-helixtrans-68.2-31.2179.1-144.179.8000111.9P5 E6 F12P5-L8 PolarHBondContact O-N 3.37Å; E6-L8 VanDerWaalsContact C-N 3.27Å; E6-L8 PolarHBondContact O-N 3.44Å; L8-F12 HydrophobicContact CD1-CE2 4.43Å; L8-F12 HydrophobicContact CG-CD2 4.24Å; L8-F12 HydrophobicContact CG-CE2 4.28Å; L8-F12 WeakPolarHBondContact O-CD2 3.38Å; L8-F12 PolarHBondContact O-N 3.47Å
9L58.6Low55.9Low129 Ų129139.4 Ų139.468%0.67567%0.667SS**Hα-helixtrans-74.1-29.1178.4-71.7166.9000112.5E6 W7 G13E6-L9 PolarHBondContact O-N 3.39Å; W7-L9 VanDerWaalsContact C-N 3.3Å; W7-L9 PolarHBondContact O-N 3.2Å; L9-G13 PolarHBondContact O-N 3.16Å
10L60.5Low55.5Low145 Ų145135.7 Ų135.776%0.75966%0.661SS**Hα-helixtrans-76.4-29.4178.4-69.8170.5000113.1W7W7-L10 PolarHBondContact O-N 3.35Å
11L62.1Low55.1Low116 Ų116134.7 Ų134.761%0.60766%0.663SS**Hα-helixtrans-82-31.4177.8-74.4172.8000113.5W7W7-L11 HydrophobicContact CE3-CD1 3.46Å; W7-L11 VanDerWaalsContact CE3-CD1 3.46Å; W7-L11 HydrophobicContact CZ3-CD1 3.51Å; W7-L11 PolarHBondContact O-N 3.4Å
12F57.7Low55.4Low112 Ų112128.4 Ų128.449%0.49164%0.643SS.*Hα-helixtrans-99.6-14.2-178.3-72.1-79.2000114.5L8 W15 L16L8-F12 HydrophobicContact CD1-CE2 4.43Å; L8-F12 HydrophobicContact CG-CD2 4.24Å; L8-F12 HydrophobicContact CG-CE2 4.28Å; L8-F12 WeakPolarHBondContact O-CD2 3.38Å; L8-F12 PolarHBondContact O-N 3.47Å; F12-W15 PolarHBondContact O-N 3.05Å; F12-W15 VanDerWaalsContact O-N 3.16Å; F12-L16 PolarHBondContact O-N 3.12Å; F12-L16 VanDerWaalsContact O-N 3.12Å
13G60.8Low55.3Low26 Ų26119.9 Ų119.927%0.26863%0.628SS.*Hα-helixtrans-54.1-47.3178.100000114.9L9 W15 L16 L17L9-G13 PolarHBondContact O-N 3.16Å; G13-W15 VanDerWaalsContact C-N 3.25Å; G13-W15 PolarHBondContact O-N 3.2Å; G13-L16 PolarHBondContact O-N 3.4Å; G13-L17 PolarHBondContact O-N 3.3Å
14P62.5Low54.7Low94 Ų94119.3 Ų119.361%0.6162%0.621SS**Hα-helixtrans-67.4-24.6179.3-20.132000113.7
15W54.5Low53.9Low178 Ų178120.7 Ų120.767%0.67463%0.627SS**Hα-helixtrans-81.4-35.6-179.8-151.771.2000111.8F12 G13 K19F12-W15 PolarHBondContact O-N 3.05Å; F12-W15 VanDerWaalsContact O-N 3.16Å; G13-W15 VanDerWaalsContact C-N 3.25Å; G13-W15 PolarHBondContact O-N 3.2Å; W15-K19 PolarHBondContact O-N 3.47Å
16L56.9Low52.5Low110 Ų110122 Ų12258%0.57664%0.644SS**Hα-helixtrans-73.8-37.5177.2-70.7169.6000112.7F12 G13 R18 K19 A20F12-L16 PolarHBondContact O-N 3.12Å; F12-L16 VanDerWaalsContact O-N 3.12Å; G13-L16 PolarHBondContact O-N 3.4Å; L16-R18 VanDerWaalsContact C-N 3.31Å; L16-R18 PolarHBondContact O-N 3.19Å; L16-K19 PolarHBondContact O-N 3.45Å; L16-A20 PolarHBondContact O-N 3.4Å
17L56.2Low51.4Low131 Ų131123.6 Ų123.669%0.68665%0.652SS**Hα-helixtrans-64.2-34.4175-101.586.7000112.8G13 K19 A20 V21G13-L17 PolarHBondContact O-N 3.3Å; L17-K19 VanDerWaalsContact C-N 3.3Å; L17-K19 PolarHBondContact O-N 3.18Å; L17-A20 PolarHBondContact O-N 3.32Å; L17-V21 PolarHBondContact O-N 3.47Å
18R49Very low50Low207 Ų207122.3 Ų122.378%0.78167%0.666SS**Hα-helixtrans-67.5-29.3175.5-112.4-179.4-174.6-118.42.3112.9L16L16-R18 VanDerWaalsContact C-N 3.31Å; L16-R18 PolarHBondContact O-N 3.19Å
19K46.7Very low48.7Very low154 Ų154122.2 Ų122.267%0.6768%0.682SS**Hα-helixtrans-79.6-31.4178.4-132-174.9-175.3-1720112.5W15 L16 L17W15-K19 PolarHBondContact O-N 3.47Å; L16-K19 PolarHBondContact O-N 3.45Å; L17-K19 VanDerWaalsContact C-N 3.3Å; L17-K19 PolarHBondContact O-N 3.18Å
20A48Very low47.7Very low66 Ų66127.5 Ų127.555%0.54569%0.693SS.*Hα-helixtrans-71.6-34.7176.700000113L16 L17 G23L16-A20 PolarHBondContact O-N 3.4Å; L17-A20 PolarHBondContact O-N 3.32Å; A20-G23 PolarHBondContact O-N 3.47Å
21V46.6Very low46.4Very low115 Ų115126.7 Ų126.770%0.69770%0.696SS**Hα-helixtrans-77.5-17.6-179.6151.30000114.3L17L17-V21 PolarHBondContact O-N 3.47Å
22S45.1Very low45.3Very low111 Ų111129.9 Ų129.978%0.77671%0.708SS**THydrogen-bonded Turntrans-87.1-7.9173.5-87.30000114.1
23G44.2Very low43.9Very low58 Ų58134.9 Ų134.960%0.59873%0.725SS**SBendtrans-99.83.3-177.300000115.9A20A20-G23 PolarHBondContact O-N 3.47Å
24Q40.6Very low42.3Very low167 Ų167141.9 Ų141.978%0.7875%0.751SS**SBendtrans-127.620.8-168.8-78-65.9-46.700114.9
25I42.7Very low40.8Very low168 Ų168144.1 Ų144.186%0.86276%0.757SS**  trans-115.876.3166.1-51.2176.7000108.5
26A31.2Very low39.7Very low96 Ų96142.9 Ų142.979%0.79376%0.758SS**SBendtrans-144.499.2158.400000108.4
27E34.7Very low38.3Very low190 Ų190145.2 Ų145.289%0.88877%0.77SS**  trans45.2113.8147.9-147.880.287.200120
28S31.4Very low37.1Very low125 Ų125150.5 Ų150.587%0.87478%0.781SS**  trans-141.8107.6154.4-177.30000111.1
29G33Very low36.2Very low68 Ų68146.2 Ų146.270%0.70178%0.781SS**  trans95.978.7139.200000119.6
30R36.8Very low35.3Very low240 Ų240143.9 Ų143.991%0.90679%0.79SS**PPolyproline II helixtrans-77.2153.6141.6-75.6-176.7-174.41801.6109.7
31P34.1Very low34.6Very low129 Ų129149.8 Ų149.884%0.83881%0.808SS**PPolyproline II helixtrans-92.8137.4144.129.1-17.5000110.7
32Q37.7Very low33.9Very low182 Ų182149.2 Ų149.285%0.8582%0.815SS**PPolyproline II helixtrans-71.5149.8179.5-70.6-166.2-41.600113.3
33Y28.5Very low33.2Very low217 Ų217147.5 Ų147.585%0.85182%0.815SS**  -168.7118.6109.644.9-100.6000109.7
34H27.7Very low32.5Very low174 Ų174148.9 Ų148.981%0.80683%0.83SS**  174.6125.5123.7-132.8-124.3000111
35L31.6Very low31.9Very low141 Ų141144.7 Ų144.774%0.73883%0.831SS**  trans-18.4153.7158.6-96.746.9000116.2
36E31.5Very low31.2Very low151 Ų151141.6 Ų141.671%0.70683%0.831SS**  cis175.8159.4-7.6179.8178.813300104.7
37L27.6Very low31Very low159 Ų159148.1 Ų148.183%0.83284%0.835SS**  trans122.8106.1155.1-64.3160.9000113.4
38R31.2Very low30.6Very low242 Ų242143.4 Ų143.491%0.91382%0.823SS**PPolyproline II helixtrans-88.7138.8-176.9-178.6-179.8-175.2138.1-0.6110.3
39P29.6Very low30.6Very low118 Ų118146.6 Ų146.677%0.76682%0.824SS**PPolyproline II helixtrans-86135.6168.931.6-28.1000110.9
40A28.4Very low30.2Very low104 Ų104151.7 Ų151.786%0.8683%0.829SS**PPolyproline II helixtrans-88.3137.5173.200000111.1
41M32.3Very low29.8Very low190 Ų190147.4 Ų147.494%0.93682%0.823SS**PPolyproline II helixtrans-73.5143171.9-176.5178.1-172.700110.5
42A31.4Very low30.1Very low103 Ų103146.8 Ų146.885%0.85182%0.82SS**  trans-158126154.400000110.7
43G31.6Very low29.7Very low75 Ų75142.3 Ų142.377%0.77381%0.814SS**  trans-98.5161.5166.100000111.8
44G29.8Very low29.9Very low88 Ų88138.3 Ų138.391%0.90781%0.814SS**  trans81.5120.9151.900000119
45G28.1Very low29.9Very low78 Ų78133.7 Ų133.780%0.80481%0.813SS**  trans113.1100.9139.900000119.8
46A26.2Very low29.8Very low103 Ų103132.4 Ų132.485%0.85182%0.816SS**  trans69.7119.9134.900000124.2
47R27.7Very low29.7Very low233 Ų233129.7 Ų129.788%0.87981%0.814SS**  89.1114.7126.1-160.6165.6173.8175.9-4.3122.1
48S26.9Very low29.8Very low91 Ų91131.7 Ų131.764%0.63682%0.819SS**  trans65.9119.1144.3-72.90000122.1
49Q30.3Very low29.7Very low193 Ų193123.6 Ų123.690%0.90281%0.811SS**  178.2107.5113.6-90.516462.100109
50H25.3Very low29.7Very low175 Ų175126.7 Ų126.781%0.8182%0.82SS**  74.894.996.3-136-63.3000115.5
51L28.1Very low29.8Very low149 Ų149125.2 Ų125.278%0.7882%0.815SS**  trans16.3158.8146.1-73.8148.4000122.3
52P40.6Very low30.1Very low117 Ų117122.6 Ų122.676%0.7681%0.81SS**  cis-133.516614.334.8-14.3000117.1
53A29.8Very low30.2Very low88 Ų88122.5 Ų122.573%0.72781%0.809SS**PPolyproline II helixtrans-89147.816600000111
54P31.6Very low30.7Very low133 Ų133129.1 Ų129.186%0.86481%0.811SS**PPolyproline II helixtrans-87.2128.7158.632.5-24.9000109.4
55G29.4Very low30.6Very low76 Ų76130 Ų13078%0.78480%0.802SS**PPolyproline II helixtrans-99150.3171.800000111.9
56S27.7Very low31.2Very low114 Ų114135.8 Ų135.880%0.79780%0.8SS**  trans170.8144.1140.867.60000106.9
57S30.1Very low31.8Very low95 Ų95135.7 Ų135.766%0.66479%0.793SS**  cis-175133.3-13.741.70000103.6
58E30.5Very low32.8Very low201 Ų201134.3 Ų134.394%0.93979%0.788SS**  trans43.4117.5142.5-55.5-177.7113.500119.8
59G28.1Very low33.6Very low72 Ų72133.9 Ų133.974%0.74279%0.79SS**  trans163.795.6156.300000116.7
60L30.8Very low34.7Very low182 Ų182134.2 Ų134.295%0.95378%0.784SS**  trans65.5120.8144.9-107.265.2000120.9
61G30.6Very low35.4Very low73 Ų73132 Ų13275%0.75378%0.784SS**  trans93.782139.400000116.3A63G61-A63 PolarHBondContact O-N 3.38Å
62T36.6Very low36Very low136 Ų136128.4 Ų128.483%0.83477%0.772SS**  trans-59.6103.4159.229.60000109.7R64T62-R64 PolarHBondContact O-N 3.11Å
63A34.7Very low35.9Very low100 Ų100130.4 Ų130.483%0.82678%0.776SS**  trans-57.1102.7161.400000108.3G61 S65G61-A63 PolarHBondContact O-N 3.38Å; A63-S65 PolarHBondContact O-N 3.47Å
64R41.5Very low36.6Very low215 Ų215134.2 Ų134.281%0.81178%0.779SS**  trans-66.6105.6169.6-75.3-175.2-157.3-144.82.2107.9T62 W66T62-R64 PolarHBondContact O-N 3.11Å; R64-W66 PolarHBondContact O-N 2.79Å
65S29Very low37.3Very low105 Ų105134.7 Ų134.773%0.73478%0.78SS**  trans-53.4115.9154.7168.80000108.7A63 S67A63-S65 PolarHBondContact O-N 3.47Å; S65-S67 PolarHBondContact O-N 3.22Å; S65-S67 VanDerWaalsContact O-N 3.15Å
66W40.2Very low37.7Very low200 Ų200134.1 Ų134.176%0.75877%0.773SS**  trans-79.495.5-179.9-695.1000110R64 W68R64-W66 PolarHBondContact O-N 2.79Å; W66-W68 HydrophobicContact CE3-CH2 4.16Å; W66-W68 AromaticContact CE3-CZ2 3.99Å; W66-W68 HydrophobicContact CE3-CZ2 3.99Å
67S38.4Very low38.4Very low101 Ų101133.3 Ų133.371%0.70677%0.773SS**  trans-77.4116.1170.6-60.20000110.5S65 A69S65-S67 PolarHBondContact O-N 3.22Å; S65-S67 VanDerWaalsContact O-N 3.15Å; S67-A69 PolarHBondContact O-N 2.76Å; S67-A69 VanDerWaalsContact O-N 3.12Å
68W48.2Very low38.7Very low204 Ų204137.5 Ų137.577%0.77379%0.788SS**  trans-81.529.9-177.9-62.7101.5000114.8W66W66-W68 HydrophobicContact CE3-CH2 4.16Å; W66-W68 AromaticContact CE3-CZ2 3.99Å; W66-W68 HydrophobicContact CE3-CZ2 3.99Å
69A43.7Very low38.9Very low82 Ų82132.4 Ų132.468%0.67878%0.78SS**  trans-82.3120.1173.900000109.4S67S67-A69 PolarHBondContact O-N 2.76Å; S67-A69 VanDerWaalsContact O-N 3.12Å
70W52.9Low39.3Very low201 Ų201138.4 Ų138.476%0.76179%0.786SS**  trans-67.9144177.746.291.7000111.1S72W70-S72 PolarHBondContact O-N 3.2Å; W70-S72 VanDerWaalsContact O-N 3.11Å
71P41.4Very low39.6Very low127 Ų127135.9 Ų135.983%0.82578%0.78SS**  trans-68.2106.7165.1-13.427.7000109.4N73P71-N73 PolarHBondContact O-N 2.61Å
72S41.1Very low39.7Very low75 Ų75136 Ų13652%0.52478%0.781SS.*  trans-72.9117.4164.4-64.20000108.4W70 H74W70-S72 PolarHBondContact O-N 3.2Å; W70-S72 VanDerWaalsContact O-N 3.11Å; S72-H74 VanDerWaalsContact C-N 3.34Å; S72-H74 PolarHBondContact O-N 2.99Å; S72-H74 PolarHBondContact O-ND1 3.22Å
73N38.6Very low39.4Very low159 Ų159134.8 Ų134.885%0.8579%0.785SS**  trans-6493.1170.5-99.6-32.3000109.4P71 T75P71-N73 PolarHBondContact O-N 2.61Å; N73-T75 PolarHBondContact O-N 3.16Å
74H43.5Very low39.4Very low167 Ų167135 Ų13577%0.77379%0.787SS**  trans-87.581.8165.144-81.8000107.8S72 G76S72-H74 VanDerWaalsContact C-N 3.34Å; S72-H74 PolarHBondContact O-N 2.99Å; S72-H74 PolarHBondContact O-ND1 3.22Å; H74-G76 PolarHBondContact O-N 3.37Å; H74-G76 VanDerWaalsContact O-N 3.11Å
75T46.9Very low39.1Very low144 Ų144128.9 Ų128.988%0.88379%0.791SS**  trans-81.468.7153.8-31.90000106.8N73N73-T75 PolarHBondContact O-N 3.16Å
76G38.3Very low39.3Very low63 Ų63127.7 Ų127.765%0.64979%0.794SS**  trans-117.199.3-175.300000110.2H74H74-G76 PolarHBondContact O-N 3.37Å; H74-G76 VanDerWaalsContact O-N 3.11Å
77A41.3Very low39.2Very low97 Ų97126.4 Ų126.480%0.80280%0.801SS**  trans0.6114.5161.600000118
78L36.8Very low39.2Very low184 Ų184127.5 Ų127.596%0.96381%0.806SS**  trans-113.584.3146.1-151.896.6000107.7
79A34.4Very low38.9Very low94 Ų94122.1 Ų122.178%0.77781%0.806SS**  trans-118.7105.9166.400000107.6
80K36.4Very low38.7Very low198 Ų198124.1 Ų124.186%0.86181%0.812SS**  trans-70140.3171.4-166.2165.6-177.1169.20108.5
81P36.8Very low38.3Very low128 Ų128126.4 Ų126.483%0.83182%0.82SS**  trans-84130.3-17932.8-29.6000109.7
82G32.8Very low38.3Very low75 Ų75126.6 Ų126.677%0.77382%0.819SS**  trans154.3122.3165.700000114
83A31.6Very low38.5Very low112 Ų112133 Ų13393%0.92684%0.837SS**  trans108.2134.3161.600000116.6
84A34.1Very low38.9Very low105 Ų105136.8 Ų136.887%0.86884%0.84SS**  trans-90.8161.1-155.300000114.7
85G35.6Very low39Very low86 Ų86137.8 Ų137.889%0.88784%0.842SS**  trans89.6105.114600000117.3
86G32Very low38.7Very low79 Ų79136.9 Ų136.981%0.81484%0.839SS**  trans173.2115.4163.100000113.1
87L37.7Very low38.8Very low173 Ų173138.9 Ų138.991%0.90684%0.842SS**PPolyproline II helixtrans-61.6157.6-179-81.8103.4000114.2
88P38.7Very low39.6Very low124 Ų124142.3 Ų142.381%0.80585%0.845SS**PPolyproline II helixtrans-80.7125.6-171.231.8-32.7000112.8
89A41.5Very low39.9Very low92 Ų92142.8 Ų142.876%0.7684%0.84SS**PPolyproline II helixtrans-81.9141.2171.500000111.7R91A89-R91 PolarHBondContact O-N 2.86Å
90P40.6Very low40.2Very low124 Ų124142.1 Ų142.181%0.80583%0.834SS**PPolyproline II helixtrans-73.8127.2-171.628.4-33000112.4T92P90-T92 PolarHBondContact O-N 3.45Å; P90-T92 VanDerWaalsContact O-N 3.11Å
91R43.7Very low40.7Very low249 Ų249137.8 Ų137.894%0.9484%0.835SS**  trans-63.2104.9171.3-87177.7165139.9-4.4110.4A89 K93A89-R91 PolarHBondContact O-N 2.86Å; R91-K93 PolarHBondContact O-N 3.42Å
92T42.2Very low41.2Very low130 Ų130142.3 Ų142.380%0.79884%0.836SS**  trans-68.6120.3160.130.10000109.2P90 R94P90-T92 PolarHBondContact O-N 3.45Å; P90-T92 VanDerWaalsContact O-N 3.11Å; T92-R94 PolarHBondContact O-N 2.9Å
93K46Very low41.8Very low210 Ų210143.2 Ų143.291%0.91384%0.835SS**  trans-54.895.3172.3-88.1-170.7175.3-178.80110.2R91 K95R91-K93 PolarHBondContact O-N 3.42Å; K93-K95 PolarHBondContact O-N 3.06Å
94R45.9Very low42.7Very low238 Ų238146.8 Ų146.890%0.89883%0.83SS**  trans-77.2108.8158.7-83.9-177.3169.8172.2-2.4108T92T92-R94 PolarHBondContact O-N 2.9Å
95K45.2Very low43.6Very low189 Ų189148.4 Ų148.482%0.82282%0.818SS**  trans-50.9137.3163.1-67.6168.2178.2177.60108.1K93 S97K93-K95 PolarHBondContact O-N 3.06Å; K95-S97 PolarHBondContact O-N 2.96Å
96P40.5Very low44.8Very low125 Ų125147.7 Ų147.781%0.81279%0.793SS**  trans-62.4111.4173.4-12.125.5000107.5I98P96-I98 PolarHBondContact O-N 2.82Å; P96-I98 VanDerWaalsContact O-N 3.11Å
97S42.1Very low46.3Very low104 Ų104144.5 Ų144.573%0.72776%0.757SS**  trans-63.5114.5173.455.40000107.8K95 K99K95-S97 PolarHBondContact O-N 2.96Å; S97-K99 PolarHBondContact O-N 3Å
98I57.2Low47.5Very low169 Ų169138.7 Ų138.787%0.86774%0.738SS**  trans-63.779.1163.5-64.9167.6000106.9P96P96-I98 PolarHBondContact O-N 2.82Å; P96-I98 VanDerWaalsContact O-N 3.11Å
99K43.3Very low48.7Very low195 Ų195134.4 Ų134.485%0.84871%0.706SS**  trans-140.351.5162.9-81.3-167178-179.50108.5S97S97-K99 PolarHBondContact O-N 3Å
100A40Very low50.2Low80 Ų80131.6 Ų131.666%0.66169%0.686SS**  trans-82.5100.8143.900000105.1R102A100-R102 PolarHBondContact O-N 2.03Å
101A47Very low52.3Low106 Ų106132 Ų13288%0.87668%0.681SS**  trans-58.692153.100000104.9A103A101-A103 PolarHBondContact O-N 3.27Å; A101-A103 VanDerWaalsContact O-N 3.09Å
102R47.1Very low54.3Low224 Ų224121.4 Ų121.485%0.84564%0.642SS**  trans-56.8117.6-171.2-71.6-177.2175-166-1.1106.7A100 K104A100-R102 PolarHBondContact O-N 2.03Å; R102-K104 PolarHBondContact O-N 2.8Å
103A46.3Very low56.5Low93 Ų93121.7 Ų121.777%0.76963%0.63SS**  trans-45.5115.4152.400000105.5A101 K105A101-A103 PolarHBondContact O-N 3.27Å; A101-A103 VanDerWaalsContact O-N 3.09Å; A103-K105 PolarHBondContact O-N 3.49Å
104K50.9Low58.6Low187 Ų187112.9 Ų112.981%0.81359%0.591SS**  trans-65.591.1-171.6-170.3168-176.7176.20106.6R102 I106R102-K104 PolarHBondContact O-N 2.8Å; K104-I106 WeakPolarHBondContact O-CG1 3.4Å; K104-I106 PolarHBondContact O-N 3.06Å
105K53.2Low60.7Low139 Ų139107.4 Ų107.460%0.60457%0.571SS**  trans-67.3105.2176-161.3-161.4177.9-175.40105.9A103 F107 G108A103-K105 PolarHBondContact O-N 3.49Å; K105-F107 WeakPolarHBondContact CD-O 3.49Å; K105-F107 WeakPolarHBondContact CE-O 3.23Å; K105-F107 WeakPolarHBondContact CG-O 3.4Å; K105-F107 PolarHBondContact O-N 3.08Å; K105-G108 PolarHBondContact NZ-O 3.16Å
106I60.1Low62.7Low72 Ų72100.1 Ų100.137%0.36954%0.542SS..SBendtrans-78.1-17.4-166.9-17.1173.9000111.6K104 D131K104-I106 WeakPolarHBondContact O-CG1 3.4Å; K104-I106 PolarHBondContact O-N 3.06Å; I106-D131 HydrophobicContact CD1-CB 3.28Å; I106-D131 WeakPolarHBondContact CD1-OD1 3.33Å; I106-D131 WeakPolarHBondContact CD1-OD2 3.11Å; I106-D131 HydrophobicContact CG1-CB 4.49Å
107F63.6Low64.9Low12 Ų1298.8 Ų98.85%0.05353%0.525CS..SBendtrans-128.3138.3173-70.4-72.1000109.1K105 W109 I129 F137K105-F107 WeakPolarHBondContact CD-O 3.49Å; K105-F107 WeakPolarHBondContact CE-O 3.23Å; K105-F107 WeakPolarHBondContact CG-O 3.4Å; K105-F107 PolarHBondContact O-N 3.08Å; F107-W109 HydrophobicContact CB-CG 4.46Å; F107-W109 HydrophobicContact CD1-CZ2 4.1Å; F107-W109 AromaticContact CD1-NE1 3.67Å; F107-W109 HydrophobicContact CG-CZ2 4.37Å; F107-W109 PolarHBondContact O-N 3.43Å; F107-I129 HydrophobicContact CB-CD1 4.17Å; F107-I129 HydrophobicContact CD2-CD1 4.36Å; F107-I129 HydrophobicContact CD2-CG2 4.32Å; F107-I129 HydrophobicContact CG-CD1 4.35Å; F107-F137 HydrophobicContact CE1-CZ 4.46Å; F107-F137 AromaticContact CE2-CD1 3.77Å; F107-F137 HydrophobicContact CE2-CD1 3.77Å; F107-F137 AromaticContact CE2-CD2 3.95Å; F107-F137 HydrophobicContact CE2-CD2 3.95Å; F107-F137 AromaticContact CE2-CE1 3.77Å; F107-F137 HydrophobicContact CE2-CE1 3.77Å; F107-F137 AromaticContact CE2-CE2 3.94Å; F107-F137 HydrophobicContact CE2-CE2 3.94Å; F107-F137 AromaticContact CE2-CG 3.85Å; F107-F137 HydrophobicContact CE2-CG 3.85Å; F107-F137 AromaticContact CE2-CZ 3.84Å; F107-F137 HydrophobicContact CE2-CZ 3.84Å; F107-F137 HydrophobicContact CZ-CD1 4.01Å; F107-F137 HydrophobicContact CZ-CD2 4.42Å; F107-F137 AromaticContact CZ-CE1 3.51Å; F107-F137 HydrophobicContact CZ-CE1 3.51Å; F107-F137 AromaticContact CZ-CE2 3.97Å; F107-F137 HydrophobicContact CZ-CE2 3.97Å; F107-F137 HydrophobicContact CZ-CG 4.43Å; F107-F137 AromaticContact CZ-CZ 3.47Å; F107-F137 HydrophobicContact CZ-CZ 3.47Å; F107-F137 VanDerWaalsContact CZ-CZ 3.47Å
108G61.7Low66.9Low50 Ų5096.3 Ų96.352%0.51551%0.505SS..SBendtrans-64.5-20-18000000112.9K105 D294K105-G108 PolarHBondContact NZ-O 3.16Å; G108-D294 PolarHBondContact N-OD1 2.86Å
109W65.7Low68.1Low34 Ų3496.4 Ų96.413%0.12951%0.507CS..  trans-108.1144.4-177.449.4-70.2000110.3F107 I129 I274 I276 P293 D294F107-W109 HydrophobicContact CB-CG 4.46Å; F107-W109 HydrophobicContact CD1-CZ2 4.1Å; F107-W109 AromaticContact CD1-NE1 3.67Å; F107-W109 HydrophobicContact CG-CZ2 4.37Å; F107-W109 PolarHBondContact O-N 3.43Å; W109-I129 HydrophobicContact CD2-CD1 3.79Å; W109-I129 HydrophobicContact CE3-CD1 3.46Å; W109-I129 VanDerWaalsContact CE3-CD1 3.46Å; W109-I129 HydrophobicContact CE3-CG1 4.31Å; W109-I129 HydrophobicContact CH2-CD1 3.47Å; W109-I129 VanDerWaalsContact CH2-CD1 3.47Å; W109-I129 HydrophobicContact CH2-CG1 4.15Å; W109-I129 HydrophobicContact CZ2-CD1 3.8Å; W109-I129 HydrophobicContact CZ3-CD1 3.29Å; W109-I129 HydrophobicContact CZ3-CG1 3.84Å; W109-I274 HydrophobicContact CH2-CD1 3.61Å; W109-I274 HydrophobicContact CH2-CG1 3.94Å; W109-I274 HydrophobicContact CZ2-CD1 3.68Å; W109-I274 HydrophobicContact CZ2-CG1 3.58Å; W109-I276 HydrophobicContact CZ3-CD1 4.01Å; W109-P293 HydrophobicContact CB-CB 3.85Å; W109-P293 HydrophobicContact CD2-CB 3.61Å; W109-P293 HydrophobicContact CD2-CG 3.66Å; W109-P293 HydrophobicContact CE3-CB 4.3Å; W109-P293 HydrophobicContact CE3-CG 3.9Å; W109-P293 HydrophobicContact CG-CB 3.34Å; W109-P293 HydrophobicContact CG-CG 3.96Å; W109-P293 HydrophobicContact CZ2-CG 4.41Å; W109-P293 HydrophobicContact CZ3-CG 4.38Å; W109-D294 VanDerWaalsContact CD1-OD1 3.29Å; W109-D294 VanDerWaalsContact NE1-CG 3.33Å; W109-D294 PolarHBondContact NE1-OD2 3.48Å
110G72.9Confident69.7Low33 Ų3394 Ų9434%0.3450%0.496SS..  trans-104.9-98.3179.700000109.6
111D83.4Confident71.9Confident133 Ų13390.5 Ų90.571%0.71147%0.466SS*.  trans-87.3136.3-179.9-55.4-43.1000111G127D111-G127 WeakPolarHBondContact CA-O 3.31Å
112F86.4Confident73.8Confident26 Ų2687 Ų8711%0.11444%0.435CS..EExtended strand (participates in β ladder)trans-96.7135.9174.2172.3-100.4000109.8F114 V125 T126 G127 I276 V278 V291F112-F114 HydrophobicContact CE1-CB 3.66Å; F112-F114 HydrophobicContact CE2-CB 4.36Å; F112-F114 HydrophobicContact CZ-CB 3.48Å; F112-F114 VanDerWaalsContact CZ-CB 3.48Å; F112-F114 HydrophobicContact CZ-CG 4.34Å; F112-V125 HydrophobicContact CD1-CG1 4.36Å; F112-V125 HydrophobicContact CE1-CB 4.29Å; F112-V125 HydrophobicContact CE1-CG1 3.87Å; F112-T126 CarbonylContact O-C 3.59Å; F112-T126 VanDerWaalsContact O-CA 3.32Å; F112-T126 WeakPolarHBondContact O-CA 3.39Å; F112-G127 PolarHBondContact N-O 2.9Å; F112-G127 PolarHBondContact O-N 2.75Å; F112-I276 HydrophobicContact CB-CD1 4.08Å; F112-I276 HydrophobicContact CD1-CD1 4.2Å; F112-I276 HydrophobicContact CD2-CD1 3.7Å; F112-I276 HydrophobicContact CE1-CG2 4.35Å; F112-I276 HydrophobicContact CE2-CD1 4.14Å; F112-I276 HydrophobicContact CG-CD1 3.72Å; F112-I276 HydrophobicContact CZ-CG2 4.35Å; F112-V278 HydrophobicContact CZ-CG2 4.48Å; F112-V291 HydrophobicContact CE2-CB 4.46Å; F112-V291 HydrophobicContact CE2-CG1 4.45Å; F112-V291 HydrophobicContact CE2-CG2 4.38Å
113Y89Confident75.9Confident137 Ų13776.3 Ų76.354%0.53739%0.394SS..EExtended strand (participates in β ladder)trans-139.8123.3177.7-173.2-93000110.2R115 L124 T126Y113-R115 HydrophobicContact CE1-CB 3.76Å; Y113-R115 PolarHBondContact OH-NE 3.11Å; Y113-R115 PolarHBondContact OH-NH2 2.97Å; Y113-L124 HydrophobicContact CD2-CD1 4.02Å; Y113-L124 HydrophobicContact CE1-CD1 4.25Å; Y113-L124 HydrophobicContact CE2-CD1 3.3Å; Y113-L124 VanDerWaalsContact CZ-CD1 3.45Å; Y113-T126 HydrophobicContact CD2-CG2 3.87Å; Y113-T126 HydrophobicContact CE2-CG2 4.2Å
114F89Confident78.1Confident25 Ų2574 Ų7411%0.1137%0.369CS..EExtended strand (participates in β ladder)trans-134.6125.6177.5174.7-107.8000109.7F112 V116 L123 L124 V125 V278 L287 Q289F112-F114 HydrophobicContact CE1-CB 3.66Å; F112-F114 HydrophobicContact CE2-CB 4.36Å; F112-F114 HydrophobicContact CZ-CB 3.48Å; F112-F114 VanDerWaalsContact CZ-CB 3.48Å; F112-F114 HydrophobicContact CZ-CG 4.34Å; F114-V116 HydrophobicContact CE1-CG2 3.64Å; F114-V116 HydrophobicContact CE2-CG2 3.78Å; F114-V116 HydrophobicContact CZ-CG2 3.19Å; F114-L123 HydrophobicContact CD1-CD2 4.25Å; F114-L123 HydrophobicContact CE1-CD2 3.81Å; F114-L124 CarbonylContact O-C 3.57Å; F114-V125 HydrophobicContact CB-CB 4.23Å; F114-V125 HydrophobicContact CD1-CB 4.33Å; F114-V125 HydrophobicContact CD1-CG2 4.09Å; F114-V125 PolarHBondContact N-O 2.63Å; F114-V125 PolarHBondContact O-N 2.9Å; F114-V278 HydrophobicContact CD1-CG1 4.27Å; F114-V278 HydrophobicContact CE1-CG1 4.1Å; F114-L287 HydrophobicContact CE1-CD2 3.66Å; F114-L287 HydrophobicContact CZ-CD2 3.57Å; F114-Q289 VanDerWaalsContact CD2-OE1 3.26Å
115R89.3Confident80.1Confident123 Ų12365 Ų6546%0.46433%0.33SS..EExtended strand (participates in β ladder)trans-135.8130.2-176.1175.9179.7-76.5-124.310.7109.7Y113 H117 L123 L124Y113-R115 HydrophobicContact CE1-CB 3.76Å; Y113-R115 PolarHBondContact OH-NE 3.11Å; Y113-R115 PolarHBondContact OH-NH2 2.97Å; R115-H117 VanDerWaalsContact CD-CD2 3.43Å; R115-H117 WeakPolarHBondContact CD-CD2 3.08Å; R115-H117 WeakPolarHBondContact CD-NE2 3.37Å; R115-H117 WeakPolarHBondContact CG-CD2 3.43Å; R115-H117 WeakPolarHBondContact CG-NE2 3.06Å; R115-H117 PolarHBondContact NH1-NE2 3.22Å; R115-H117 VanDerWaalsContact NH1-NE2 3.16Å; R115-L123 CarbonylContact C-O 3.58Å; R115-L123 VanDerWaalsContact CA-O 3.3Å; R115-L123 WeakPolarHBondContact CA-O 3.39Å; R115-L124 HydrophobicContact CB-CD1 4.22Å
116V88.2Confident82Confident36 Ų3660.6 Ų60.622%0.21832%0.315CS..EExtended strand (participates in β ladder)trans-130.3129.71741790000108.2F114 T118 F121 S122 L123 L287F114-V116 HydrophobicContact CE1-CG2 3.64Å; F114-V116 HydrophobicContact CE2-CG2 3.78Å; F114-V116 HydrophobicContact CZ-CG2 3.19Å; V116-T118 HydrophobicContact CG1-CG2 4.35Å; V116-F121 HydrophobicContact CB-CE1 4.15Å; V116-F121 HydrophobicContact CG1-CD1 4.21Å; V116-F121 HydrophobicContact CG1-CE1 3.81Å; V116-S122 WeakPolarHBondContact O-CA 3.3Å; V116-L123 PolarHBondContact N-O 3.3Å; V116-L123 PolarHBondContact O-N 3.11Å; V116-L287 HydrophobicContact CG2-CD2 4.29Å
117H87.3Confident83.5Confident97 Ų9757.5 Ų57.545%0.44930%0.301SS..EExtended strand (participates in β ladder)trans-128.1134.1174.9-71.9-80.8000109.4R115 F121 S122R115-H117 VanDerWaalsContact CD-CD2 3.43Å; R115-H117 WeakPolarHBondContact CD-CD2 3.08Å; R115-H117 WeakPolarHBondContact CD-NE2 3.37Å; R115-H117 WeakPolarHBondContact CG-CD2 3.43Å; R115-H117 WeakPolarHBondContact CG-NE2 3.06Å; R115-H117 PolarHBondContact NH1-NE2 3.22Å; R115-H117 VanDerWaalsContact NH1-NE2 3.16Å; H117-F121 CarbonylContact C-O 3.48Å; H117-S122 PolarHBondContact CE1-OG 2.83Å; H117-S122 WeakPolarHBondContact ND1-CB 3.15Å; H117-S122 PolarHBondContact ND1-OG 3.26Å
118T83.6Confident84.7Confident51 Ų5162.4 Ų62.431%0.31332%0.322SS..  trans-138.4178.9175.367.60000108.1V116 K120 F121 Y285V116-T118 HydrophobicContact CG1-CG2 4.35Å; T118-K120 PolarHBondContact O-N 2.76Å; T118-F121 HydrophobicContact CG2-CD1 4.24Å; T118-F121 PolarHBondContact N-O 3.29Å; T118-F121 WeakPolarHBondContact OG1-CA 3.17Å; T118-F121 VanDerWaalsContact OG1-CB 3.23Å; T118-F121 WeakPolarHBondContact OG1-CB 3.43Å; T118-F121 PolarHBondContact OG1-N 3.15Å; T118-F121 PolarHBondContact OG1-O 3.1Å; T118-Y285 HydrophobicContact CG2-CD1 4.37Å; T118-Y285 HydrophobicContact CG2-CE1 4.02Å
119L81.4Confident86Confident172 Ų17261.6 Ų61.690%0.90131%0.305SS*.SBendtrans-58.6-32.7-177.2-61.7175000114
120K78.5Confident87.1Confident145 Ų14562.2 Ų62.263%0.6331%0.313SS*.SBendtrans-124.9-7.6-176-63.1-175.3-176.1172.20113.9T118 S147 D284T118-K120 PolarHBondContact O-N 2.76Å; K120-S147 WeakPolarHBondContact O-CB 3.3Å; K120-D284 IonicContact NZ-OD2 3.82Å
121F84.5Confident87.8Confident6 Ų663.8 Ų63.83%0.02631%0.314CS..  trans-129.9125.7-175.9160.5-113.8000111.1V116 H117 T118 L123 S147 F280 Y285V116-F121 HydrophobicContact CB-CE1 4.15Å; V116-F121 HydrophobicContact CG1-CD1 4.21Å; V116-F121 HydrophobicContact CG1-CE1 3.81Å; H117-F121 CarbonylContact C-O 3.48Å; T118-F121 HydrophobicContact CG2-CD1 4.24Å; T118-F121 PolarHBondContact N-O 3.29Å; T118-F121 WeakPolarHBondContact OG1-CA 3.17Å; T118-F121 VanDerWaalsContact OG1-CB 3.23Å; T118-F121 WeakPolarHBondContact OG1-CB 3.43Å; T118-F121 PolarHBondContact OG1-N 3.15Å; T118-F121 PolarHBondContact OG1-O 3.1Å; F121-L123 HydrophobicContact CD2-CB 4.41Å; F121-L123 HydrophobicContact CE1-CB 3.99Å; F121-L123 HydrophobicContact CE2-CB 3.49Å; F121-L123 VanDerWaalsContact CE2-CB 3.49Å; F121-L123 HydrophobicContact CE2-CD2 4.47Å; F121-L123 HydrophobicContact CE2-CG 4.44Å; F121-L123 HydrophobicContact CZ-CB 3.25Å; F121-L123 HydrophobicContact CZ-CD2 3.75Å; F121-L123 HydrophobicContact CZ-CG 4.07Å; F121-S147 WeakPolarHBondContact CD2-OG 3.49Å; F121-F280 HydrophobicContact CD1-CD1 4.48Å; F121-F280 HydrophobicContact CD1-CE1 4.13Å; F121-F280 HydrophobicContact CD2-CD1 4.32Å; F121-F280 AromaticContact CD2-CE1 3.54Å; F121-F280 HydrophobicContact CD2-CE1 3.54Å; F121-F280 HydrophobicContact CD2-CE2 4.18Å; F121-F280 AromaticContact CD2-CZ 3.46Å; F121-F280 HydrophobicContact CD2-CZ 3.46Å; F121-F280 VanDerWaalsContact CD2-CZ 3.46Å; F121-F280 AromaticContact CE1-CD1 3.85Å; F121-F280 HydrophobicContact CE1-CD1 3.85Å; F121-F280 AromaticContact CE1-CE1 3.91Å; F121-F280 HydrophobicContact CE1-CE1 3.91Å; F121-F280 AromaticContact CE2-CD1 3.61Å; F121-F280 HydrophobicContact CE2-CD1 3.61Å; F121-F280 AromaticContact CE2-CD2 3.84Å; F121-F280 HydrophobicContact CE2-CD2 3.84Å; F121-F280 AromaticContact CE2-CE1 3.21Å; F121-F280 HydrophobicContact CE2-CE1 3.21Å; F121-F280 AromaticContact CE2-CE2 3.49Å; F121-F280 HydrophobicContact CE2-CE2 3.49Å; F121-F280 VanDerWaalsContact CE2-CE2 3.49Å; F121-F280 AromaticContact CE2-CG 3.89Å; F121-F280 HydrophobicContact CE2-CG 3.89Å; F121-F280 AromaticContact CE2-CZ 3.16Å; F121-F280 HydrophobicContact CE2-CZ 3.16Å; F121-F280 AromaticContact CG-CE1 3.91Å; F121-F280 HydrophobicContact CG-CE1 3.91Å; F121-F280 HydrophobicContact CG-CZ 4.26Å; F121-F280 HydrophobicContact CZ-CB 4.41Å; F121-F280 AromaticContact CZ-CD1 3.3Å; F121-F280 HydrophobicContact CZ-CD1 3.3Å; F121-F280 HydrophobicContact CZ-CD2 4.04Å; F121-F280 AromaticContact CZ-CE1 3.39Å; F121-F280 HydrophobicContact CZ-CE1 3.39Å; F121-F280 HydrophobicContact CZ-CE2 4.13Å; F121-F280 AromaticContact CZ-CG 3.63Å; F121-F280 HydrophobicContact CZ-CG 3.63Å; F121-F280 AromaticContact CZ-CZ 3.82Å; F121-F280 HydrophobicContact CZ-CZ 3.82Å; F121-Y285 HydrophobicContact CB-CD2 4.15Å; F121-Y285 HydrophobicContact CB-CE2 4.45Å
122S88.8Confident87.9Confident31 Ų3160.2 Ų60.222%0.21729%0.292CS..EExtended strand (participates in β ladder)trans-122.1125.9170.4153.30000107V116 H117 S145 S146V116-S122 WeakPolarHBondContact O-CA 3.3Å; H117-S122 PolarHBondContact CE1-OG 2.83Å; H117-S122 WeakPolarHBondContact ND1-CB 3.15Å; H117-S122 PolarHBondContact ND1-OG 3.26Å; S122-S145 VanDerWaalsContact O-CA 3.24Å; S122-S145 WeakPolarHBondContact O-CA 3.26Å; S122-S146 PolarHBondContact O-N 2.92Å
123L89.9Confident87.6Confident0 Ų066 Ų660%033%0.329CS..EExtended strand (participates in β ladder)trans-127.8133.1173.8172.165.7000109.9F114 R115 V116 F121 V125 N144 L151 L287F114-L123 HydrophobicContact CD1-CD2 4.25Å; F114-L123 HydrophobicContact CE1-CD2 3.81Å; R115-L123 CarbonylContact C-O 3.58Å; R115-L123 VanDerWaalsContact CA-O 3.3Å; R115-L123 WeakPolarHBondContact CA-O 3.39Å; V116-L123 PolarHBondContact N-O 3.3Å; V116-L123 PolarHBondContact O-N 3.11Å; F121-L123 HydrophobicContact CD2-CB 4.41Å; F121-L123 HydrophobicContact CE1-CB 3.99Å; F121-L123 HydrophobicContact CE2-CB 3.49Å; F121-L123 VanDerWaalsContact CE2-CB 3.49Å; F121-L123 HydrophobicContact CE2-CD2 4.47Å; F121-L123 HydrophobicContact CE2-CG 4.44Å; F121-L123 HydrophobicContact CZ-CB 3.25Å; F121-L123 HydrophobicContact CZ-CD2 3.75Å; F121-L123 HydrophobicContact CZ-CG 4.07Å; L123-V125 HydrophobicContact CD1-CG2 3.8Å; L123-V125 HydrophobicContact CD2-CG2 4.17Å; L123-V125 HydrophobicContact CG-CG2 4Å; L123-N144 WeakPolarHBondContact CA-O 3.07Å; L123-L151 HydrophobicContact CD1-CD1 3.63Å; L123-L151 HydrophobicContact CD1-CD2 3.49Å; L123-L151 VanDerWaalsContact CD1-CD2 3.49Å; L123-L151 HydrophobicContact CD1-CG 4.18Å; L123-L151 HydrophobicContact CD2-CD1 3.47Å; L123-L151 VanDerWaalsContact CD2-CD1 3.47Å; L123-L151 HydrophobicContact CG-CD1 4.2Å; L123-L287 HydrophobicContact CD2-CD2 4.35Å
124L92.6Very high87.4Confident44 Ų4466.4 Ų66.423%0.2334%0.341CS..EExtended strand (participates in β ladder)trans-130119169.9174.662.1000108.8Y113 F114 R115 T126 H143 N144Y113-L124 HydrophobicContact CD2-CD1 4.02Å; Y113-L124 HydrophobicContact CE1-CD1 4.25Å; Y113-L124 HydrophobicContact CE2-CD1 3.3Å; Y113-L124 VanDerWaalsContact CZ-CD1 3.45Å; F114-L124 CarbonylContact O-C 3.57Å; R115-L124 HydrophobicContact CB-CD1 4.22Å; L124-T126 HydrophobicContact CD1-CG2 4.15Å; L124-T126 HydrophobicContact CG-CG2 4.25Å; L124-H143 CarbonylContact O-C 3.58Å; L124-H143 WeakPolarHBondContact O-CA 3.41Å; L124-N144 PolarHBondContact N-O 3.48Å; L124-N144 PolarHBondContact O-N 2.8Å
125V92.6Very high87.1Confident0 Ų066.5 Ų66.50%035%0.349CS..EExtended strand (participates in β ladder)trans-114.8128.2172.1-175.40000108.3F112 F114 L123 H143 L151 V153 V278F112-V125 HydrophobicContact CD1-CG1 4.36Å; F112-V125 HydrophobicContact CE1-CB 4.29Å; F112-V125 HydrophobicContact CE1-CG1 3.87Å; F114-V125 HydrophobicContact CB-CB 4.23Å; F114-V125 HydrophobicContact CD1-CB 4.33Å; F114-V125 HydrophobicContact CD1-CG2 4.09Å; F114-V125 PolarHBondContact N-O 2.63Å; F114-V125 PolarHBondContact O-N 2.9Å; L123-V125 HydrophobicContact CD1-CG2 3.8Å; L123-V125 HydrophobicContact CD2-CG2 4.17Å; L123-V125 HydrophobicContact CG-CG2 4Å; V125-H143 HydrophobicContact CB-CB 4.48Å; V125-H143 HydrophobicContact CG2-CB 3.96Å; V125-L151 HydrophobicContact CG2-CD2 4.16Å; V125-V153 HydrophobicContact CG1-CG1 4.22Å; V125-V153 HydrophobicContact CG1-CG2 3.89Å; V125-V153 HydrophobicContact CG2-CG2 4.16Å; V125-V278 HydrophobicContact CG2-CG1 4.39Å
126T92.9Very high87.1Confident46 Ų4662.2 Ų62.228%0.28234%0.337SS..EExtended strand (participates in β ladder)trans-123.8137.9174.959.40000109.4F112 Y113 L124 F141 R142F112-T126 CarbonylContact O-C 3.59Å; F112-T126 VanDerWaalsContact O-CA 3.32Å; F112-T126 WeakPolarHBondContact O-CA 3.39Å; Y113-T126 HydrophobicContact CD2-CG2 3.87Å; Y113-T126 HydrophobicContact CE2-CG2 4.2Å; L124-T126 HydrophobicContact CD1-CG2 4.15Å; L124-T126 HydrophobicContact CG-CG2 4.25Å; T126-F141 CarbonylContact O-C 3Å; T126-F141 WeakPolarHBondContact O-CA 3.5Å; T126-R142 PolarHBondContact N-O 2.87Å; T126-R142 PolarHBondContact O-N 3.18Å; T126-R142 PolarHBondContact OG1-O 2.85Å
127G92.3Very high87.1Confident7 Ų760.5 Ų60.57%0.07233%0.326CS..EExtended strand (participates in β ladder)trans-125.9139.1177.400000111.3D111 F112 Y140D111-G127 WeakPolarHBondContact CA-O 3.31Å; F112-G127 PolarHBondContact N-O 2.9Å; F112-G127 PolarHBondContact O-N 2.75Å; G127-Y140 CarbonylContact C-O 3.52Å; G127-Y140 VanDerWaalsContact CA-O 3.23Å; G127-Y140 WeakPolarHBondContact CA-O 3.38Å
128K89.3Confident87.3Confident114 Ų11456 Ų5650%0.49631%0.305SS..EExtended strand (participates in β ladder)trans-129.3134.1172.8-177.5179.4-179.9-178.50110.3V139 Y140K128-V139 CarbonylContact O-C 3.48Å; K128-V139 WeakPolarHBondContact O-CA 3.45Å; K128-Y140 PolarHBondContact N-O 3.33Å; K128-Y140 PolarHBondContact O-N 3.1Å
129I88.4Confident87.6Confident33 Ų3353.6 Ų53.617%0.16929%0.291CS..EExtended strand (participates in β ladder)trans-98.3135.4174.1-47.1173000109.3F107 W109 F137 S138 V139F107-I129 HydrophobicContact CB-CD1 4.17Å; F107-I129 HydrophobicContact CD2-CD1 4.36Å; F107-I129 HydrophobicContact CD2-CG2 4.32Å; F107-I129 HydrophobicContact CG-CD1 4.35Å; W109-I129 HydrophobicContact CD2-CD1 3.79Å; W109-I129 HydrophobicContact CE3-CD1 3.46Å; W109-I129 VanDerWaalsContact CE3-CD1 3.46Å; W109-I129 HydrophobicContact CE3-CG1 4.31Å; W109-I129 HydrophobicContact CH2-CD1 3.47Å; W109-I129 VanDerWaalsContact CH2-CD1 3.47Å; W109-I129 HydrophobicContact CH2-CG1 4.15Å; W109-I129 HydrophobicContact CZ2-CD1 3.8Å; W109-I129 HydrophobicContact CZ3-CD1 3.29Å; W109-I129 HydrophobicContact CZ3-CG1 3.84Å; I129-F137 HydrophobicContact CG2-CB 4.42Å; I129-F137 HydrophobicContact CG2-CD2 4.03Å; I129-S138 WeakPolarHBondContact CA-O 3.27Å; I129-V139 HydrophobicContact CG1-CG2 4.44Å; I129-V139 HydrophobicContact CG2-CG2 4.5Å
130V88.1Confident88.2Confident48 Ų4850.2 Ų50.229%0.29127%0.267SS..EExtended strand (participates in β ladder)trans-125.7118.9171.5-179.30000107F137 S138 Y140V130-F137 CarbonylContact O-C 3.59Å; V130-F137 VanDerWaalsContact O-CA 3.26Å; V130-F137 WeakPolarHBondContact O-CA 3.45Å; V130-F137 WeakPolarHBondContact O-CB 3.24Å; V130-S138 PolarHBondContact N-O 2.85Å; V130-S138 PolarHBondContact O-N 3.02Å; V130-Y140 HydrophobicContact CB-CE2 4.13Å; V130-Y140 HydrophobicContact CG2-CD2 4.02Å; V130-Y140 HydrophobicContact CG2-CE2 3.74Å
131D87.6Confident88.9Confident66 Ų6643.5 Ų43.535%0.35324%0.238SC..EExtended strand (participates in β ladder)trans-82.8133.6170.5-171.259.2000109.8I106 K269I106-D131 HydrophobicContact CD1-CB 3.28Å; I106-D131 WeakPolarHBondContact CD1-OD1 3.33Å; I106-D131 WeakPolarHBondContact CD1-OD2 3.11Å; I106-D131 HydrophobicContact CG1-CB 4.49Å; D131-K269 WeakPolarHBondContact OD1-CE 3.46Å; D131-K269 IonicContact OD1-NZ 2.65Å; D131-K269 PolarHBondContact OD1-NZ 2.83Å; D131-K269 IonicContact OD2-NZ 2.78Å; D131-K269 PolarHBondContact OD2-NZ 3.09Å
132H85.6Confident89.4Confident57 Ų5749.4 Ų49.426%0.26426%0.26SS..  trans-94.2138.4168-56.8-78.8000108N134 G135 T136 S138H132-N134 PolarHBondContact O-N 2.78Å; H132-G135 PolarHBondContact O-N 2.87Å; H132-T136 WeakPolarHBondContact CA-O 3.32Å; H132-T136 VanDerWaalsContact CB-O 3.32Å; H132-T136 WeakPolarHBondContact CB-O 3.2Å; H132-T136 PolarHBondContact N-O 2.82Å; H132-T136 VanDerWaalsContact O-O 3.12Å; H132-S138 WeakPolarHBondContact NE2-CB 3.33Å; H132-S138 PolarHBondContact NE2-OG 2.88Å
133V81.4Confident89.6Confident147 Ų14748.3 Ų48.389%0.89125%0.251SS*.THydrogen-bonded Turntrans-60-16.3178.4-173.90000111.8G135V133-G135 PolarHBondContact O-N 2.86Å
134N83.4Confident89.6Confident146 Ų14650.6 Ų50.678%0.78126%0.263SS*.THydrogen-bonded Turntrans-75.75.3-179.4-58.5-14.6000114.4H132 T136H132-N134 PolarHBondContact O-N 2.78Å; N134-T136 VanDerWaalsContact C-N 3.34Å
135G83.8Confident89.5Confident27 Ų2748.5 Ų48.528%0.27825%0.252SS..SBendtrans84.27.4-17900000114.5H132 V133 K269H132-G135 PolarHBondContact O-N 2.87Å; V133-G135 PolarHBondContact O-N 2.86Å; G135-K269 VanDerWaalsContact O-CB 3.31Å; G135-K269 WeakPolarHBondContact O-CB 3.26Å; G135-K269 WeakPolarHBondContact O-CD 3.45Å; G135-K269 VanDerWaalsContact O-CG 3.29Å; G135-K269 WeakPolarHBondContact O-CG 3.17Å; G135-K269 PolarHBondContact O-N 2.94Å; G135-K269 VanDerWaalsContact O-N 3.1Å
136T88.1Confident89.2Confident34 Ų3451 Ų5121%0.20927%0.27CS..EExtended strand (participates in β ladder)trans-109.9160.1170.359.60000110.1H132 N134 C267 A268H132-T136 WeakPolarHBondContact CA-O 3.32Å; H132-T136 VanDerWaalsContact CB-O 3.32Å; H132-T136 WeakPolarHBondContact CB-O 3.2Å; H132-T136 PolarHBondContact N-O 2.82Å; H132-T136 VanDerWaalsContact O-O 3.12Å; N134-T136 VanDerWaalsContact C-N 3.34Å; T136-C267 CarbonylContact C-O 3.6Å; T136-C267 WeakPolarHBondContact CA-O 3.02Å; T136-C267 WeakPolarHBondContact CB-O 3.47Å; T136-A268 HydrophobicContact CG2-CB 4.26Å
137F89Confident88.3Confident0 Ų049.4 Ų49.40%026%0.26CS..EExtended strand (participates in β ladder)trans-134.2141.9170.163.9-86000109.4F107 I129 V130 V139 C267 I274F107-F137 HydrophobicContact CE1-CZ 4.46Å; F107-F137 AromaticContact CE2-CD1 3.77Å; F107-F137 HydrophobicContact CE2-CD1 3.77Å; F107-F137 AromaticContact CE2-CD2 3.95Å; F107-F137 HydrophobicContact CE2-CD2 3.95Å; F107-F137 AromaticContact CE2-CE1 3.77Å; F107-F137 HydrophobicContact CE2-CE1 3.77Å; F107-F137 AromaticContact CE2-CE2 3.94Å; F107-F137 HydrophobicContact CE2-CE2 3.94Å; F107-F137 AromaticContact CE2-CG 3.85Å; F107-F137 HydrophobicContact CE2-CG 3.85Å; F107-F137 AromaticContact CE2-CZ 3.84Å; F107-F137 HydrophobicContact CE2-CZ 3.84Å; F107-F137 HydrophobicContact CZ-CD1 4.01Å; F107-F137 HydrophobicContact CZ-CD2 4.42Å; F107-F137 AromaticContact CZ-CE1 3.51Å; F107-F137 HydrophobicContact CZ-CE1 3.51Å; F107-F137 AromaticContact CZ-CE2 3.97Å; F107-F137 HydrophobicContact CZ-CE2 3.97Å; F107-F137 HydrophobicContact CZ-CG 4.43Å; F107-F137 AromaticContact CZ-CZ 3.47Å; F107-F137 HydrophobicContact CZ-CZ 3.47Å; F107-F137 VanDerWaalsContact CZ-CZ 3.47Å; I129-F137 HydrophobicContact CG2-CB 4.42Å; I129-F137 HydrophobicContact CG2-CD2 4.03Å; V130-F137 CarbonylContact O-C 3.59Å; V130-F137 VanDerWaalsContact O-CA 3.26Å; V130-F137 WeakPolarHBondContact O-CA 3.45Å; V130-F137 WeakPolarHBondContact O-CB 3.24Å; F137-V139 HydrophobicContact CD2-CG2 3.79Å; F137-V139 HydrophobicContact CE2-CG2 3.77Å; F137-C267 HydrophobicContact CD1-CB 3.92Å; F137-C267 HydrophobicContact CD2-CB 3.96Å; F137-C267 HydrophobicContact CE1-CB 3.41Å; F137-C267 VanDerWaalsContact CE1-CB 3.41Å; F137-C267 HydrophobicContact CE2-CB 3.47Å; F137-C267 VanDerWaalsContact CE2-CB 3.47Å; F137-C267 HydrophobicContact CG-CB 4.18Å; F137-C267 HydrophobicContact CZ-CB 3.17Å; F137-C267 PolarHBondContact N-O 3.33Å; F137-C267 PolarHBondContact O-N 2.92Å; F137-I274 HydrophobicContact CE2-CD1 3.77Å; F137-I274 HydrophobicContact CZ-CD1 4.02Å
138S90.6Very high87.4Confident1 Ų152.2 Ų52.21%0.00727%0.273CS..EExtended strand (participates in β ladder)trans-100.9140.9173-65.50000110.5I129 V130 H132 W265 L266I129-S138 WeakPolarHBondContact CA-O 3.27Å; V130-S138 PolarHBondContact N-O 2.85Å; V130-S138 PolarHBondContact O-N 3.02Å; H132-S138 WeakPolarHBondContact NE2-CB 3.33Å; H132-S138 PolarHBondContact NE2-OG 2.88Å; S138-W265 CarbonylContact C-O 3.46Å; S138-W265 WeakPolarHBondContact CA-O 3.31Å; S138-L266 WeakPolarHBondContact OG-CD1 3.38Å
139V91.5Very high86.7Confident2 Ų247.2 Ų47.21%0.01225%0.254CS..EExtended strand (participates in β ladder)trans-118.1119.8172.9-172.40000108.4K128 I129 F137 F141 I155 A264 W265K128-V139 CarbonylContact O-C 3.48Å; K128-V139 WeakPolarHBondContact O-CA 3.45Å; I129-V139 HydrophobicContact CG1-CG2 4.44Å; I129-V139 HydrophobicContact CG2-CG2 4.5Å; F137-V139 HydrophobicContact CD2-CG2 3.79Å; F137-V139 HydrophobicContact CE2-CG2 3.77Å; V139-F141 HydrophobicContact CB-CE2 4.34Å; V139-F141 HydrophobicContact CB-CZ 4.49Å; V139-F141 HydrophobicContact CG1-CD2 4.37Å; V139-F141 HydrophobicContact CG1-CE1 3.96Å; V139-F141 HydrophobicContact CG1-CE2 3.69Å; V139-F141 HydrophobicContact CG1-CZ 3.46Å; V139-F141 VanDerWaalsContact CG1-CZ 3.46Å; V139-I155 HydrophobicContact CB-CD1 3.84Å; V139-I155 HydrophobicContact CG1-CD1 4.33Å; V139-I155 HydrophobicContact CG2-CD1 3.82Å; V139-A264 WeakPolarHBondContact O-CA 3.49Å; V139-W265 HydrophobicContact CB-CB 4.45Å; V139-W265 PolarHBondContact N-O 2.88Å; V139-W265 PolarHBondContact O-N 2.84Å
140Y92.8Very high86.4Confident100 Ų10050.6 Ų50.639%0.39227%0.273SS..EExtended strand (participates in β ladder)trans-102118.1179.7-60.9-82.5000109.4G127 K128 V130 A263 A264G127-Y140 CarbonylContact C-O 3.52Å; G127-Y140 VanDerWaalsContact CA-O 3.23Å; G127-Y140 WeakPolarHBondContact CA-O 3.38Å; K128-Y140 PolarHBondContact N-O 3.33Å; K128-Y140 PolarHBondContact O-N 3.1Å; V130-Y140 HydrophobicContact CB-CE2 4.13Å; V130-Y140 HydrophobicContact CG2-CD2 4.02Å; V130-Y140 HydrophobicContact CG2-CE2 3.74Å; Y140-A263 CarbonylContact C-O 3.47Å; Y140-A263 WeakPolarHBondContact CA-O 3.19Å; Y140-A264 HydrophobicContact CD1-CB 3.62Å; Y140-A264 HydrophobicContact CE1-CB 3.62Å
141F94.6Very high86.4Confident5 Ų549.4 Ų49.42%0.02227%0.265CS..EExtended strand (participates in β ladder)trans-100.9135.7170-62.3-68.9000110.2T126 V139 V153 I155 Q262 A263 W265 I276T126-F141 CarbonylContact O-C 3Å; T126-F141 WeakPolarHBondContact O-CA 3.5Å; V139-F141 HydrophobicContact CB-CE2 4.34Å; V139-F141 HydrophobicContact CB-CZ 4.49Å; V139-F141 HydrophobicContact CG1-CD2 4.37Å; V139-F141 HydrophobicContact CG1-CE1 3.96Å; V139-F141 HydrophobicContact CG1-CE2 3.69Å; V139-F141 HydrophobicContact CG1-CZ 3.46Å; V139-F141 VanDerWaalsContact CG1-CZ 3.46Å; F141-V153 HydrophobicContact CB-CG1 4.27Å; F141-V153 HydrophobicContact CD1-CG1 3.75Å; F141-V153 HydrophobicContact CD2-CG1 4.06Å; F141-V153 HydrophobicContact CE1-CG1 4.05Å; F141-V153 HydrophobicContact CE2-CG1 4.34Å; F141-V153 HydrophobicContact CG-CG1 3.75Å; F141-V153 HydrophobicContact CZ-CG1 4.33Å; F141-I155 HydrophobicContact CE2-CD1 4.09Å; F141-I155 HydrophobicContact CE2-CG1 3.72Å; F141-I155 HydrophobicContact CZ-CD1 4.46Å; F141-I155 HydrophobicContact CZ-CG1 4.08Å; F141-Q262 CarbonylContact O-C 3.49Å; F141-Q262 VanDerWaalsContact O-CA 3.31Å; F141-Q262 WeakPolarHBondContact O-CA 3.38Å; F141-A263 HydrophobicContact CB-CB 4.45Å; F141-A263 PolarHBondContact N-O 2.84Å; F141-A263 PolarHBondContact O-N 3.28Å; F141-W265 AromaticContact CD2-CD1 3.7Å; F141-W265 AromaticContact CE2-CD1 3.76Å; F141-W265 HydrophobicContact CE2-CG 4.45Å; F141-I276 HydrophobicContact CE1-CD1 4.12Å; F141-I276 HydrophobicContact CE1-CG1 4.33Å; F141-I276 HydrophobicContact CE1-CG2 3.98Å; F141-I276 HydrophobicContact CZ-CD1 4.36Å; F141-I276 HydrophobicContact CZ-CG1 4.15Å; F141-I276 HydrophobicContact CZ-CG2 4.11Å
142R93.8Very high86.4Confident130 Ų13048.8 Ų48.849%0.49127%0.266SS..EExtended strand (participates in β ladder)trans-125.1128.6165.8-177.6-179.8-176.4-173.61.1107.7T126 Q260 S261 Q262T126-R142 PolarHBondContact N-O 2.87Å; T126-R142 PolarHBondContact O-N 3.18Å; T126-R142 PolarHBondContact OG1-O 2.85Å; R142-Q260 VanDerWaalsContact NH2-NE2 3.1Å; R142-S261 WeakPolarHBondContact CA-O 3.31Å; R142-Q262 HydrophobicContact CG-CG 4.35Å
143H92.4Very high86.7Confident8 Ų846.7 Ų46.74%0.03726%0.257CS..EExtended strand (participates in β ladder)trans-127.9145.2174.668.3-114.8000112L124 V125 L151 Q260 S261L124-H143 CarbonylContact O-C 3.58Å; L124-H143 WeakPolarHBondContact O-CA 3.41Å; V125-H143 HydrophobicContact CB-CB 4.48Å; V125-H143 HydrophobicContact CG2-CB 3.96Å; H143-L151 HydrophobicContact CB-CD2 3.49Å; H143-L151 VanDerWaalsContact CB-CD2 3.49Å; H143-L151 WeakPolarHBondContact CD2-CD2 3.39Å; H143-L151 WeakPolarHBondContact NE2-CD2 3.43Å; H143-Q260 WeakPolarHBondContact O-CA 3.45Å; H143-S261 WeakPolarHBondContact CE1-CB 3.39Å; H143-S261 PolarHBondContact CE1-OG 2.83Å; H143-S261 VanDerWaalsContact CE1-OG 3.28Å; H143-S261 PolarHBondContact N-O 3.22Å; H143-S261 WeakPolarHBondContact ND1-CB 3.37Å; H143-S261 WeakPolarHBondContact NE2-CB 3.5Å; H143-S261 PolarHBondContact O-N 2.98Å
144N91.2Very high87.1Confident47 Ų4741 Ų4125%0.25122%0.224SC..EExtended strand (participates in β ladder)trans-131.2125.7175.4-175.2-22.4000108.4L123 L124 H258 T259L123-N144 WeakPolarHBondContact CA-O 3.07Å; L124-N144 PolarHBondContact N-O 3.48Å; L124-N144 PolarHBondContact O-N 2.8Å; N144-H258 VanDerWaalsContact CG-CE1 3.49Å; N144-H258 VanDerWaalsContact CG-NE2 3.31Å; N144-H258 PolarHBondContact ND2-CE1 3.14Å; N144-H258 PolarHBondContact ND2-NE2 3.44Å; N144-H258 PolarHBondContact OD1-CD2 2.77Å; N144-H258 PolarHBondContact OD1-CE1 2.87Å; N144-H258 PolarHBondContact OD1-NE2 3.12Å; N144-T259 WeakPolarHBondContact CA-O 3.04Å
145S90.1Very high87.4Confident0 Ų034.3 Ų34.30%019%0.188CC..EExtended strand (participates in β ladder)trans-128.1143.5175.260.20000111.7S122 H258 T259S122-S145 VanDerWaalsContact O-CA 3.24Å; S122-S145 WeakPolarHBondContact O-CA 3.26Å; S145-H258 CarbonylContact O-C 3.57Å; S145-H258 WeakPolarHBondContact O-CA 3.22Å; S145-T259 PolarHBondContact N-O 2.89Å; S145-T259 PolarHBondContact O-N 3.11Å; S145-T259 WeakPolarHBondContact OG-CB 3.41Å; S145-T259 PolarHBondContact OG-O 2.66Å
146S85.6Confident87.7Confident53 Ų5333.8 Ų33.837%0.37118%0.179SC..  trans-108.28.2-176.4-47.80000114.6S122 E257S122-S146 PolarHBondContact O-N 2.92Å; S146-E257 CarbonylContact C-O 3.59Å; S146-E257 VanDerWaalsContact O-O 3.08Å
147S74.7Confident87.6Confident12 Ų1234 Ų348%0.08418%0.181CC..SBendtrans-125.3158.7-179.667.80000111.6K120 F121 G149 E257 F280K120-S147 WeakPolarHBondContact O-CB 3.3Å; F121-S147 WeakPolarHBondContact CD2-OG 3.49Å; S147-G149 PolarHBondContact O-N 2.93Å; S147-E257 PolarHBondContact N-O 2.77Å; S147-F280 VanDerWaalsContact OG-CZ 3.27Å; S147-F280 WeakPolarHBondContact OG-CZ 3.5Å
148L72.8Confident87.1Confident66 Ų6635.8 Ų35.835%0.34619%0.193SC..SBendtrans-62.3115.4170.4-169.294.2000110.3F255 E257 S282L148-F255 HydrophobicContact CB-CE2 3.9Å; L148-F255 HydrophobicContact CD1-CD2 4.04Å; L148-F255 HydrophobicContact CD1-CE2 3.26Å; L148-F255 HydrophobicContact CD1-CZ 3.9Å; L148-F255 HydrophobicContact CD2-CE2 4.01Å; L148-F255 HydrophobicContact CD2-CZ 4.07Å; L148-F255 HydrophobicContact CG-CE2 3.88Å; L148-F255 HydrophobicContact CG-CZ 4.42Å; L148-E257 HydrophobicContact CD1-CB 4.46Å; L148-S282 VanDerWaalsContact O-CB 3.31Å; L148-S282 WeakPolarHBondContact O-CB 3.31Å; L148-S282 PolarHBondContact O-OG 3.26Å
149G75.8Confident86.4Confident9 Ų940.7 Ų40.79%0.09323%0.227CC..EExtended strand (participates in β ladder)trans174.4159.7177.800000113.3S147 L281S147-G149 PolarHBondContact O-N 2.93Å; G149-L281 CarbonylContact C-O 3.6Å; G149-L281 WeakPolarHBondContact CA-O 3.12Å
150N82.1Confident85.6Confident105 Ų10545.1 Ų45.156%0.56125%0.246SC*.EExtended strand (participates in β ladder)trans-93.4111174.8-66.7-35.8000108.5F280 L281N150-F280 WeakPolarHBondContact O-CA 2.94Å; N150-L281 PolarHBondContact N-O 2.87Å; N150-L281 PolarHBondContact O-N 2.86Å
151L87Confident84.4Confident22 Ų2249.4 Ų49.412%0.11526%0.262CS..EExtended strand (participates in β ladder)trans-97.7133.3168.1-168.287.3000109.5L123 V125 H143 V153 V278 S279 F280L123-L151 HydrophobicContact CD1-CD1 3.63Å; L123-L151 HydrophobicContact CD1-CD2 3.49Å; L123-L151 VanDerWaalsContact CD1-CD2 3.49Å; L123-L151 HydrophobicContact CD1-CG 4.18Å; L123-L151 HydrophobicContact CD2-CD1 3.47Å; L123-L151 VanDerWaalsContact CD2-CD1 3.47Å; L123-L151 HydrophobicContact CG-CD1 4.2Å; V125-L151 HydrophobicContact CG2-CD2 4.16Å; H143-L151 HydrophobicContact CB-CD2 3.49Å; H143-L151 VanDerWaalsContact CB-CD2 3.49Å; H143-L151 WeakPolarHBondContact CD2-CD2 3.39Å; H143-L151 WeakPolarHBondContact NE2-CD2 3.43Å; L151-V153 HydrophobicContact CD2-CG2 4Å; L151-V153 HydrophobicContact CG-CG2 4.5Å; L151-V278 HydrophobicContact CD1-CG1 4.33Å; L151-S279 CarbonylContact C-O 3.53Å; L151-S279 WeakPolarHBondContact CA-O 3.26Å; L151-F280 HydrophobicContact CB-CD2 4.02Å; L151-F280 HydrophobicContact CD1-CB 3.65Å; L151-F280 HydrophobicContact CD1-CD2 3.61Å; L151-F280 HydrophobicContact CD1-CG 4.02Å; L151-F280 HydrophobicContact CG-CD2 4.46Å
152S88.6Confident83.2Confident54 Ų5452.4 Ų52.438%0.37828%0.28SS..EExtended strand (participates in β ladder)trans-127.6140.4165680000110.7S279S152-S279 PolarHBondContact N-O 2.8Å; S152-S279 PolarHBondContact O-N 2.82Å; S152-S279 PolarHBondContact OG-OG 2.88Å
153V90.8Very high81.9Confident13 Ų1351 Ų518%0.07928%0.279CS..EExtended strand (participates in β ladder)trans-127.2119.7174-176.50000107.3V125 F141 L151 I276 F277 V278V125-V153 HydrophobicContact CG1-CG1 4.22Å; V125-V153 HydrophobicContact CG1-CG2 3.89Å; V125-V153 HydrophobicContact CG2-CG2 4.16Å; F141-V153 HydrophobicContact CB-CG1 4.27Å; F141-V153 HydrophobicContact CD1-CG1 3.75Å; F141-V153 HydrophobicContact CD2-CG1 4.06Å; F141-V153 HydrophobicContact CE1-CG1 4.05Å; F141-V153 HydrophobicContact CE2-CG1 4.34Å; F141-V153 HydrophobicContact CG-CG1 3.75Å; F141-V153 HydrophobicContact CZ-CG1 4.33Å; L151-V153 HydrophobicContact CD2-CG2 4Å; L151-V153 HydrophobicContact CG-CG2 4.5Å; V153-I276 HydrophobicContact CG1-CG2 4.08Å; V153-F277 WeakPolarHBondContact CA-O 3.04Å; V153-V278 HydrophobicContact CG1-CG2 4.38Å; V153-V278 HydrophobicContact CG2-CG1 4.43Å; V153-V278 HydrophobicContact CG2-CG2 4.45Å
154S90.7Very high80Confident28 Ų2857.1 Ų57.120%0.19631%0.306CS..EExtended strand (participates in β ladder)trans-135.4156.7-17760.70000112F277S154-F277 PolarHBondContact N-O 2.8Å; S154-F277 PolarHBondContact O-N 3.3Å
155I90.3Very high78.1Confident4 Ų457.9 Ų57.92%0.02133%0.325CS..EExtended strand (participates in β ladder)trans-92.5129.8168.2-49-175.2000107V139 F141 F228 W265 I274 C275V139-I155 HydrophobicContact CB-CD1 3.84Å; V139-I155 HydrophobicContact CG1-CD1 4.33Å; V139-I155 HydrophobicContact CG2-CD1 3.82Å; F141-I155 HydrophobicContact CE2-CD1 4.09Å; F141-I155 HydrophobicContact CE2-CG1 3.72Å; F141-I155 HydrophobicContact CZ-CD1 4.46Å; F141-I155 HydrophobicContact CZ-CG1 4.08Å; I155-F228 HydrophobicContact CB-CZ 4.14Å; I155-F228 HydrophobicContact CG2-CZ 3.81Å; I155-F228 WeakPolarHBondContact O-CE1 3.44Å; I155-F228 VanDerWaalsContact O-CZ 3.31Å; I155-F228 WeakPolarHBondContact O-CZ 3.14Å; I155-W265 HydrophobicContact CB-CD2 4.22Å; I155-W265 HydrophobicContact CB-CE3 4.11Å; I155-W265 HydrophobicContact CB-CZ3 4.46Å; I155-W265 HydrophobicContact CD1-CB 3.45Å; I155-W265 VanDerWaalsContact CD1-CB 3.45Å; I155-W265 HydrophobicContact CD1-CD2 4.06Å; I155-W265 HydrophobicContact CD1-CE3 4.39Å; I155-W265 HydrophobicContact CD1-CG 3.66Å; I155-W265 HydrophobicContact CG1-CB 4.16Å; I155-W265 HydrophobicContact CG1-CD2 3.82Å; I155-W265 HydrophobicContact CG1-CE3 4.19Å; I155-W265 HydrophobicContact CG1-CG 3.8Å; I155-I274 HydrophobicContact CD1-CD1 4.44Å; I155-I274 HydrophobicContact CG2-CB 3.76Å; I155-I274 HydrophobicContact CG2-CD1 3.98Å; I155-I274 HydrophobicContact CG2-CG1 4.38Å; I155-I274 HydrophobicContact CG2-CG2 4.16Å; I155-C275 CarbonylContact C-O 3.57Å; I155-C275 WeakPolarHBondContact CA-O 3.45Å
156V89.1Confident76.1Confident16 Ų1661.8 Ų61.810%0.09737%0.365CS..EExtended strand (participates in β ladder)trans-129.9152.2-179.3-59.40000110.4K160 C275 F277 K290V156-K160 HydrophobicContact CB-CB 3.89Å; V156-K160 HydrophobicContact CB-CG 4.06Å; V156-K160 HydrophobicContact CG1-CG 4.27Å; V156-K160 HydrophobicContact CG2-CB 4.05Å; V156-K160 HydrophobicContact CG2-CG 4.35Å; V156-C275 HydrophobicContact CG2-CB 3.89Å; V156-C275 PolarHBondContact N-O 2.03Å; V156-C275 PolarHBondContact O-N 3.15Å; V156-F277 HydrophobicContact CG1-CB 3.83Å; V156-F277 HydrophobicContact CG1-CG 4.48Å; V156-F277 HydrophobicContact CG2-CB 3.84Å; V156-K290 HydrophobicContact CG2-CD 4.33Å; V156-K290 HydrophobicContact CG2-CG 4.47Å
157P86.2Confident73.7Confident40 Ų4064.3 Ų64.326%0.2638%0.378SS..  trans-66.2154.2171.627.5-33.7000110.8S159 K160 F228P157-S159 PolarHBondContact O-N 2.94Å; P157-S159 VanDerWaalsContact O-N 3.17Å; P157-K160 HydrophobicContact CG-CB 4.32Å; P157-K160 VanDerWaalsContact O-CB 3.28Å; P157-K160 WeakPolarHBondContact O-CB 3.37Å; P157-K160 PolarHBondContact O-N 2.85Å; P157-F228 HydrophobicContact CB-CD2 4Å; P157-F228 HydrophobicContact CB-CE2 4.12Å; P157-F228 HydrophobicContact CG-CD2 4.19Å; P157-F228 HydrophobicContact CG-CE2 4.42Å
158P79.4Confident71.6Confident37 Ų3774.1 Ų74.124%0.2441%0.413CS..THydrogen-bonded Turntrans-56.7-32.5179.2-26.134.9000114.7K160 V273 C275 K290 Y295P158-K160 PolarHBondContact O-N 3.2Å; P158-V273 HydrophobicContact CG-CB 4.01Å; P158-V273 HydrophobicContact CG-CG1 3.67Å; P158-C275 VanDerWaalsContact CA-SG 3.53Å; P158-K290 PolarHBondContact O-NZ 3.08Å; P158-Y295 HydrophobicContact CB-CD2 4.36Å; P158-Y295 HydrophobicContact CB-CE2 4.3Å
159S75.8Confident69.7Low104 Ų10477.7 Ų77.773%0.72743%0.432SS*.THydrogen-bonded Turntrans-65.6-16.817653.40000113.7P157 R161P157-S159 PolarHBondContact O-N 2.94Å; P157-S159 VanDerWaalsContact O-N 3.17Å; S159-R161 PolarHBondContact O-N 2.99Å
160K73.9Confident67.7Low95 Ų9581.8 Ų81.841%0.41346%0.457SS..  trans-67120177.8-172.158.6177.8160.60109.7V156 P157 P158 E163 K290V156-K160 HydrophobicContact CB-CB 3.89Å; V156-K160 HydrophobicContact CB-CG 4.06Å; V156-K160 HydrophobicContact CG1-CG 4.27Å; V156-K160 HydrophobicContact CG2-CB 4.05Å; V156-K160 HydrophobicContact CG2-CG 4.35Å; P157-K160 HydrophobicContact CG-CB 4.32Å; P157-K160 VanDerWaalsContact O-CB 3.28Å; P157-K160 WeakPolarHBondContact O-CB 3.37Å; P157-K160 PolarHBondContact O-N 2.85Å; P158-K160 PolarHBondContact O-N 3.2Å; K160-E163 IonicContact NZ-OE2 3.15Å; K160-K290 WeakPolarHBondContact O-CD 3.39Å; K160-K290 PolarHBondContact O-NZ 3.1Å
161R68.2Low65.3Low190 Ų19079 Ų7972%0.71745%0.454SS*.  trans-70.7149.8175.7-66.9-172.6174.6-159-1.2110.6S159 E163S159-R161 PolarHBondContact O-N 2.99Å; R161-E163 HydrophobicContact CB-CG 4.1Å; R161-E163 PolarHBondContact O-N 3.29Å
162V70.1Confident63Low68 Ų6883.8 Ų83.841%0.41249%0.486SS..  trans-8096.8174.5-172.50000107F277 V288 K290V162-F277 HydrophobicContact CG1-CE2 4.17Å; V162-V288 HydrophobicContact CG1-CB 4.21Å; V162-V288 HydrophobicContact CG1-CG1 3.45Å; V162-V288 VanDerWaalsContact CG1-CG1 3.45Å; V162-K290 HydrophobicContact CG2-CB 3.44Å; V162-K290 VanDerWaalsContact CG2-CB 3.44Å; V162-K290 HydrophobicContact CG2-CD 4.13Å; V162-K290 HydrophobicContact CG2-CG 4.39Å
163E66.4Low60.5Low99 Ų9984.8 Ų84.846%0.46350%0.497SS..  trans-111.8132-177.2-70.6167.618000109.4K160 R161 G165K160-E163 IonicContact NZ-OE2 3.15Å; R161-E163 HydrophobicContact CB-CG 4.1Å; R161-E163 PolarHBondContact O-N 3.29Å; E163-G165 VanDerWaalsContact C-N 3.28Å; E163-G165 PolarHBondContact O-N 3.36Å
164F51.3Low57.8Low137 Ų13790.2 Ų90.260%0.60153%0.533SS*.SBendtrans-74.788.8167-77.3-91000107.8G166 K286 V288F164-G166 PolarHBondContact O-N 3.41Å; F164-K286 HydrophobicContact CE1-CB 4.28Å; F164-V288 HydrophobicContact CD1-CB 4.32Å; F164-V288 HydrophobicContact CD1-CG2 3.41Å; F164-V288 VanDerWaalsContact CD1-CG2 3.41Å; F164-V288 HydrophobicContact CD2-CG2 4.46Å; F164-V288 HydrophobicContact CE1-CB 3.97Å; F164-V288 HydrophobicContact CE1-CG2 3.4Å; F164-V288 HydrophobicContact CE2-CB 4.38Å; F164-V288 HydrophobicContact CE2-CG2 4.44Å; F164-V288 HydrophobicContact CG-CG2 3.98Å; F164-V288 HydrophobicContact CZ-CB 3.99Å; F164-V288 HydrophobicContact CZ-CG2 3.94Å
165G52.4Low55.2Low64 Ų6496.5 Ų96.566%0.6656%0.559SS**THydrogen-bonded Turntrans31.276.8166.900000116.2E163 V167E163-G165 VanDerWaalsContact C-N 3.28Å; E163-G165 PolarHBondContact O-N 3.36Å; G165-V167 PolarHBondContact O-N 2.76Å
166G46.6Very low52.5Low81 Ų81102.7 Ų102.784%0.83560%0.599SS**THydrogen-bonded Turntrans51.84.7147.200000120.5F164F164-G166 PolarHBondContact O-N 3.41Å
167V35.5Very low49.8Very low106 Ų106109.1 Ų109.164%0.64263%0.632SS**  trans-110.4101.8178.2175.30000107G165 L169G165-V167 PolarHBondContact O-N 2.76Å; V167-L169 HydrophobicContact CG1-CD2 4.35Å; V167-L169 HydrophobicContact CG1-CG 4.45Å; V167-L169 PolarHBondContact O-N 2.92Å
168W30.9Very low47.2Very low218 Ų218116 Ų11683%0.82666%0.661SS**  trans-56.297.8152.2-15976.1000106.3P170W168-P170 HydrophobicContact CE3-CB 3.97Å; W168-P170 HydrophobicContact CH2-CB 4.33Å; W168-P170 HydrophobicContact CZ3-CB 3.61Å; W168-P170 WeakPolarHBondContact O-CD 3.48Å
169L32.4Very low44.9Very low141 Ų141119.1 Ų119.174%0.73868%0.684SS**  trans-63.4121.6154.9-71.4171000104.2V167 G171V167-L169 HydrophobicContact CG1-CD2 4.35Å; V167-L169 HydrophobicContact CG1-CG 4.45Å; V167-L169 PolarHBondContact O-N 2.92Å; L169-G171 VanDerWaalsContact C-N 3.26Å; L169-G171 PolarHBondContact O-N 3.4Å
170P34.9Very low42.9Very low95 Ų95120.6 Ų120.662%0.61769%0.689SS**  trans-59.9100.2169.623.4-29.3000106.5W168W168-P170 HydrophobicContact CE3-CB 3.97Å; W168-P170 HydrophobicContact CH2-CB 4.33Å; W168-P170 HydrophobicContact CZ3-CB 3.61Å; W168-P170 WeakPolarHBondContact O-CD 3.48Å
171G31.3Very low41Very low48 Ų48124 Ų12450%0.49571%0.711SS.*PPolyproline II helixtrans-58.2141.9167.100000107.7L169 A173L169-G171 VanDerWaalsContact C-N 3.26Å; L169-G171 PolarHBondContact O-N 3.4Å; G171-A173 PolarHBondContact O-N 3.35Å; G171-A173 VanDerWaalsContact O-N 3.15Å
172P38.3Very low39.3Very low122 Ų122119.5 Ų119.579%0.79271%0.714SS**PPolyproline II helixtrans-57.3126.2-178.6-8.119.4000108.3
173A36.6Very low37.4Very low74 Ų74123.5 Ų123.561%0.61273%0.732SS**PPolyproline II helixtrans-52.413017700000109.4G171 H175G171-A173 PolarHBondContact O-N 3.35Å; G171-A173 VanDerWaalsContact O-N 3.15Å; A173-H175 PolarHBondContact O-CE1 3.3Å; A173-H175 VanDerWaalsContact O-CE1 3.29Å; A173-H175 PolarHBondContact O-N 3.23Å; A173-H175 PolarHBondContact O-ND1 3.29Å
174P33.8Very low35.5Very low127 Ų127127.6 Ų127.683%0.82575%0.751SS**PPolyproline II helixtrans-68.1121.5170.826.3-28.4000108
175H35.6Very low34.5Very low161 Ų161124.2 Ų124.275%0.74576%0.755SS**PPolyproline II helixtrans-74.1128.9177.4-48.222.3000106.2A173 L177A173-H175 PolarHBondContact O-CE1 3.3Å; A173-H175 VanDerWaalsContact O-CE1 3.29Å; A173-H175 PolarHBondContact O-N 3.23Å; A173-H175 PolarHBondContact O-ND1 3.29Å; H175-L177 PolarHBondContact O-N 3.2Å
176P32.7Very low33.5Very low134 Ų134128.4 Ų128.487%0.8777%0.768SS**  trans-79.792.6169.730.4-27.5000107.8Q178P176-Q178 PolarHBondContact O-N 2.03Å
177L33.4Very low32.9Very low151 Ų151132.2 Ų132.279%0.79177%0.768SS**  trans-86.794.6159.7-123.5177.3000107.3H175H175-L177 PolarHBondContact O-N 3.2Å
178Q32.3Very low33.5Very low183 Ų183133.2 Ų133.286%0.85578%0.777SS**  trans-129.2100.2152.1-118.3179.4-23.900107.4P176 T180P176-Q178 PolarHBondContact O-N 2.03Å; Q178-T180 PolarHBondContact O-N 2.76Å
179S30.7Very low33.6Very low103 Ų103126.2 Ų126.272%0.7277%0.773SS**  trans-64.1122.7162.5-74.10000108.4
180T33.6Very low33.7Very low136 Ų136128.4 Ų128.483%0.83478%0.784SS**  trans-136.6119.4148.1-66.20000106.9Q178Q178-T180 PolarHBondContact O-N 2.76Å
181L33.9Very low33.6Very low167 Ų167127.3 Ų127.387%0.87479%0.79SS**  trans-62131.6178.3-76.3153.5000112
182A32.5Very low34.6Very low95 Ų95130.9 Ų130.979%0.78581%0.805SS**  trans-167.588.4147.400000106.5
183L29.6Very low35.3Very low151 Ų151130.1 Ų130.179%0.79180%0.799SS**  60.2109.993.6-143.584.9000114
184E27.8Very low35.2Very low185 Ų185135 Ų13586%0.86481%0.814SS**  trans34.3136.3152.7-80.7151.582.800120.9
185G30.5Very low35.2Very low67 Ų67132.6 Ų132.669%0.69181%0.813SS**  cis173.7-173.99.300000112.8
186V30.8Very low35.4Very low152 Ų152133.4 Ų133.492%0.92182%0.819SS**  trans86.1110.1157-167.90000119.3
187L33.8Very low35.3Very low161 Ų161134.2 Ų134.284%0.84382%0.822SS**  trans-85.2177.4156.7-75.8165.9000110
188P48.9Very low35.4Very low126 Ų126130.3 Ų130.382%0.81882%0.818SS**  cis-151.6-173.119.639.4-15.2000118.4
189G31.3Very low35.6Very low72 Ų72131.6 Ų131.674%0.74282%0.824SS**  trans107.3137.8152.800000115.7
190L35.8Very low35.9Very low186 Ų186129.7 Ų129.797%0.97482%0.82SS**  cis-159.2158.724.5-88.4144.7000109.7
191G32.6Very low36.1Very low73 Ų73132.3 Ų132.375%0.75383%0.828SS**  trans-84.6-168-16300000120.8
192P51.3Low36.1Very low123 Ų123127.8 Ų127.880%0.79982%0.822SS**  trans-96.7179.7-175.544.2-36.6000111.5
193P52.9Low36.3Very low105 Ų105127.1 Ų127.168%0.68283%0.825SS**  -163.1-178.861.943.7-18.9000120
194L36.3Very low36.8Very low176 Ų176127 Ų12792%0.92183%0.825SS**  trans59.1137142.4-73.6158.3000123.3
195G33Very low37.2Very low77 Ų77125.7 Ų125.779%0.79482%0.823SS**  trans155.2101.6147.700000117
196M38.8Very low37.5Very low178 Ų178126 Ų12688%0.87783%0.827SS**  trans-91.2143.2168.8-69.9-91.593.900111.6
197T32.2Very low37.7Very low152 Ų152124.9 Ų124.993%0.93383%0.825SS**  trans179.6147.414546.60000106.9
198G35Very low37.8Very low69 Ų69121.2 Ų121.271%0.71182%0.818SS**  cis141.6118.7500000110
199Q37.1Very low37.6Very low210 Ų210123.8 Ų123.898%0.98182%0.824SS**  trans57.7149.9154.7-68.5166.27.600119.6
200G35.6Very low37.8Very low62 Ų62125.3 Ų125.364%0.63983%0.83SS**  cis159.9171.57.800000109.7
201L37.5Very low37.7Very low191 Ų191120 Ų120100%182%0.819SS**  trans81.2137.6168.8-60.4146.3000117.3
202G34.8Very low38.4Very low73 Ų73122.1 Ų122.175%0.75382%0.82SS**  cis172.61602.500000110
203G36.8Very low37.7Very low81 Ų81124.7 Ų124.784%0.83583%0.826SS**  trans1.9162.8173.100000123.8
204N39Very low36.8Very low149 Ų149123.6 Ų123.680%0.79783%0.834SS**  cis-176.8161.333.5-158.314.6000111.7
205L37.8Very low36.8Very low156 Ų156119 Ų11982%0.81783%0.829SS**  trans62.6127.4151.3-74.3159000124.2
206G35.2Very low37Very low75 Ų75119.7 Ų119.777%0.77383%0.828SS**  trans165.899.615300000116.1
207S36.1Very low37.1Very low127 Ų127118.6 Ų118.689%0.88882%0.824SS**  trans-23.8163.4158.8-61.90000117.3
208A36.3Very low37.3Very low84 Ų84115.1 Ų115.169%0.69482%0.819SS**  cis-178.2155.7-9.100000104.2
209L43.4Very low37.8Very low181 Ų181117 Ų11795%0.94882%0.816SS**  trans162.3145.2135.3-84.6170.7000111.8
210A35.4Very low38.1Very low104 Ų104112.8 Ų112.886%0.8681%0.807SS**  trans-73.8157.9-166.400000115.5
211G33.8Very low38.3Very low73 Ų73112.8 Ų112.875%0.75381%0.807SS**  trans170.7123.1165.200000112.5
212P47.6Very low38.6Very low118 Ų118107.7 Ų107.777%0.76679%0.792SS**  trans-98.4160.2-15638.3-35.2000115.3
213L37.9Very low39.1Very low177 Ų177114.3 Ų114.393%0.92780%0.801SS**  trans47.4114.1142.1-71.9158.1000118.9
214G32.7Very low39.7Very low83 Ų83119.5 Ų119.586%0.85680%0.803SS**  trans143.2121.9138.800000115.4
215G37.7Very low40.1Very low79 Ų79116.8 Ų116.881%0.81480%0.796SS**  trans107.170.3154.700000115.6
216A37.1Very low41Very low92 Ų92121.4 Ų121.476%0.7680%0.803SS**  trans-56.7138.8156.400000110.9
217L40.1Very low42.1Very low154 Ų154122.1 Ų122.181%0.80680%0.801SS**  trans52.671.9145.1-68.7159.1000116.4V219L217-V219 PolarHBondContact O-N 2.84Å
218G35.9Very low43.9Very low79 Ų79118.7 Ų118.781%0.81477%0.77SS**  trans-70.475.2153.400000110.7P220G218-P220 WeakPolarHBondContact O-CD 3.39Å
219V45.1Very low46.3Very low109 Ų109118.3 Ų118.366%0.66176%0.757SS**  trans-58.3126.1159.6176.20000107L217 G221L217-V219 PolarHBondContact O-N 2.84Å; V219-G221 PolarHBondContact O-N 2.82Å
220P43.8Very low48.4Very low121 Ų121110.1 Ų110.179%0.78671%0.714SS**  trans-68.982.4165.6-12.728000108.2G218 A222G218-P220 WeakPolarHBondContact O-CD 3.39Å; P220-A222 PolarHBondContact O-N 2.92Å
221G39.3Very low51.1Low63 Ų63110 Ų11065%0.64970%0.696SS**  trans-61.3121.9169.500000109.2V219V219-G221 PolarHBondContact O-N 2.82Å
222A44Very low53.9Low83 Ų83109.6 Ų109.669%0.68668%0.678SS**  trans49.870.1159.800000115.7P220 E224P220-A222 PolarHBondContact O-N 2.92Å; A222-E224 PolarHBondContact O-N 2.82Å
223K46.3Very low56.1Low212 Ų212109.5 Ų109.592%0.92267%0.668SS**SBendtrans-78.847.5160.6-143.8-175.6-169-171.70111.4
224E48.4Very low58.6Low190 Ų190106.2 Ų106.289%0.88864%0.644SS**SBendtrans-158.962.8171.4-155.5149.4-165.100113.2A222A222-E224 PolarHBondContact O-N 2.82Å
225S47.5Very low61.5Low92 Ų92108.3 Ų108.364%0.64363%0.631SS**  trans-152.77.5161.761.10000113.7A227S225-A227 PolarHBondContact O-N 2.94Å; S225-A227 VanDerWaalsContact O-N 3.08Å
226R56.9Low64.1Low254 Ų254110 Ų11096%0.95862%0.616SS**THydrogen-bonded Turntrans-79.517.3-178.9-142.7-179.3-166.3-171.54.2114.3
227A59.5Low66.7Low90 Ų90108.3 Ų108.374%0.74460%0.596SS**THydrogen-bonded Turntrans-136.9-3.6-169.200000115.9S225S225-A227 PolarHBondContact O-N 2.94Å; S225-A227 VanDerWaalsContact O-N 3.08Å
228F74.2Confident69.1Low55 Ų55105.3 Ų105.324%0.24158%0.581CS.*  trans-138.6103.6-179.3-165.5-120.1000110.8I155 P157 C230 W265I155-F228 HydrophobicContact CB-CZ 4.14Å; I155-F228 HydrophobicContact CG2-CZ 3.81Å; I155-F228 WeakPolarHBondContact O-CE1 3.44Å; I155-F228 VanDerWaalsContact O-CZ 3.31Å; I155-F228 WeakPolarHBondContact O-CZ 3.14Å; P157-F228 HydrophobicContact CB-CD2 4Å; P157-F228 HydrophobicContact CB-CE2 4.12Å; P157-F228 HydrophobicContact CG-CD2 4.19Å; P157-F228 HydrophobicContact CG-CE2 4.42Å; F228-C230 HydrophobicContact CD1-CB 3.87Å; F228-C230 WeakPolarHBondContact CD1-O 3.14Å; F228-C230 HydrophobicContact CE1-CB 3.4Å; F228-C230 VanDerWaalsContact CE1-CB 3.4Å; F228-C230 HydrophobicContact CE2-CB 4.23Å; F228-C230 HydrophobicContact CG-CB 4.48Å; F228-C230 HydrophobicContact CZ-CB 3.59Å; F228-C230 PolarHBondContact O-N 2.98Å; F228-C230 VanDerWaalsContact O-N 3.1Å; F228-W265 HydrophobicContact CE1-CZ3 4.39Å
229N85.4Confident71.7Confident76 Ų76108.1 Ų108.141%0.40657%0.567SS.*  trans-85.430.8-176.4-36.8-53.7000111.9C267 A268 F271N229-C267 CarbonylContact O-C 3.49Å; N229-C267 WeakPolarHBondContact O-CA 2.95Å; N229-A268 HydrophobicContact CB-CB 4.06Å; N229-A268 PolarHBondContact O-N 2.72Å; N229-F271 HydrophobicContact CB-CE2 3.3Å; N229-F271 HydrophobicContact CB-CZ 3.44Å; N229-F271 VanDerWaalsContact CB-CZ 3.44Å; N229-F271 WeakPolarHBondContact ND2-CE2 3.38Å; N229-F271 WeakPolarHBondContact ND2-CZ 3.12Å
230C88.6Confident73.8Confident8 Ų8105.4 Ų105.45%0.05456%0.556CS.*EExtended strand (participates in β ladder)trans-118.6128173.1-71.60000108.2F228 W265 L266 C267F228-C230 HydrophobicContact CD1-CB 3.87Å; F228-C230 WeakPolarHBondContact CD1-O 3.14Å; F228-C230 HydrophobicContact CE1-CB 3.4Å; F228-C230 VanDerWaalsContact CE1-CB 3.4Å; F228-C230 HydrophobicContact CE2-CB 4.23Å; F228-C230 HydrophobicContact CG-CB 4.48Å; F228-C230 HydrophobicContact CZ-CB 3.59Å; F228-C230 PolarHBondContact O-N 2.98Å; F228-C230 VanDerWaalsContact O-N 3.1Å; C230-W265 HydrophobicContact CB-CE3 4.37Å; C230-L266 VanDerWaalsContact CA-O 3.32Å; C230-L266 WeakPolarHBondContact CA-O 3.2Å; C230-C267 HydrophobicContact CB-CB 4.13Å; C230-C267 WeakPolarHBondContact CB-SG 3.45Å; C230-C267 WeakPolarHBondContact SG-CB 3.02Å; C230-C267 CovalentContact SG-SG 2.03Å; C230-C267 PolarHBondContact SG-SG 2.76Å
231H90.9Very high75.9Confident103 Ų103107.3 Ų107.348%0.47755%0.548SS..EExtended strand (participates in β ladder)trans-136.3159.4177.959.3-82000110.5E233 W265 L266H231-E233 PolarHBondContact O-N 2.73Å; H231-W265 CarbonylContact O-C 3.6Å; H231-W265 WeakPolarHBondContact O-CA 3.14Å; H231-L266 PolarHBondContact N-O 2.82Å; H231-L266 PolarHBondContact ND1-O 2.87Å; H231-L266 PolarHBondContact O-N 2.88Å
232V92.3Very high78.2Confident63 Ų63109.9 Ų109.938%0.38254%0.541SS..EExtended strand (participates in β ladder)trans-76.2122.8174.6-177.70000108E235 W265V232-E235 HydrophobicContact CG1-CB 4.14Å; V232-W265 HydrophobicContact CG2-CD2 3.92Å; V232-W265 HydrophobicContact CG2-CE3 4.06Å; V232-W265 HydrophobicContact CG2-CH2 3.57Å; V232-W265 HydrophobicContact CG2-CZ2 3.38Å; V232-W265 HydrophobicContact CG2-CZ3 3.91Å
233E93.8Very high80.3Confident117 Ų117112.2 Ų112.255%0.54754%0.537SS..EExtended strand (participates in β ladder)trans-91.2-39.5173.7-176.8-175.7-179.800110.4H231 A264 L266H231-E233 PolarHBondContact O-N 2.73Å; E233-A264 PolarHBondContact N-O 3.02Å; E233-L266 HydrophobicContact CB-CB 4.34Å
234Y91.5Very high82.1Confident107 Ų107108.4 Ų108.442%0.4252%0.517SS..EExtended strand (participates in β ladder)trans-146.4137.9-177.2176.1-102.5000110.6K236 Q262 A263 A264Y234-K236 HydrophobicContact CE1-CB 3.7Å; Y234-K236 HydrophobicContact CE2-CB 4.34Å; Y234-K236 VanDerWaalsContact OH-CB 3.26Å; Y234-K236 WeakPolarHBondContact OH-CB 3.2Å; Y234-K236 WeakPolarHBondContact OH-CD 3.22Å; Y234-Q262 HydrophobicContact CE1-CB 4.41Å; Y234-A263 CarbonylContact O-C 3.56Å; Y234-A263 VanDerWaalsContact O-CA 3.3Å; Y234-A263 WeakPolarHBondContact O-CA 3.23Å; Y234-A264 PolarHBondContact N-O 2.75Å; Y234-A264 PolarHBondContact O-N 3.45Å
235E93.1Very high84Confident127 Ų127104 Ų10459%0.59351%0.505SS*.EExtended strand (participates in β ladder)trans-140.7132.7167.9-173.1175-172.500109.5V232 Q262 A263V232-E235 HydrophobicContact CG1-CB 4.14Å; E235-Q262 CarbonylContact C-O 3.58Å; E235-Q262 WeakPolarHBondContact CA-O 3.42Å; E235-A263 HydrophobicContact CG-CB 4.46Å
236K92.8Very high85.9Confident114 Ų114100.6 Ų100.650%0.49648%0.481SS..EExtended strand (participates in β ladder)trans-139.2124.5173.5177.7170.1-179.8174.60109.6Y234 S261 Q262Y234-K236 HydrophobicContact CE1-CB 3.7Å; Y234-K236 HydrophobicContact CE2-CB 4.34Å; Y234-K236 VanDerWaalsContact OH-CB 3.26Å; Y234-K236 WeakPolarHBondContact OH-CB 3.2Å; Y234-K236 WeakPolarHBondContact OH-CD 3.22Å; K236-S261 CarbonylContact O-C 3.56Å; K236-S261 VanDerWaalsContact O-CA 3.23Å; K236-S261 WeakPolarHBondContact O-CA 3.01Å; K236-S261 PolarHBondContact O-OG 3.28Å; K236-Q262 PolarHBondContact N-O 2.97Å; K236-Q262 PolarHBondContact O-N 2.84Å
237T91.6Very high87.2Confident57 Ų5795.8 Ų95.835%0.3547%0.474SS..EExtended strand (participates in β ladder)trans-120.5122176.6-63.40000109.2R239 T259 S261T237-R239 HydrophobicContact CG2-CG 4.16Å; T237-T259 HydrophobicContact CG2-CG2 3.75Å; T237-S261 WeakPolarHBondContact OG1-CB 3.39Å; T237-S261 PolarHBondContact OG1-OG 2.94Å
238N90.4Very high88.3Confident91 Ų91102.1 Ų102.149%0.48748%0.48SS..EExtended strand (participates in β ladder)trans-107.8124173.2-173.3-27.1000108.8T259 Q260N238-T259 WeakPolarHBondContact O-CA 3.28Å; N238-Q260 PolarHBondContact N-O 3.17Å; N238-Q260 PolarHBondContact O-N 3.21Å; N238-Q260 VanDerWaalsContact O-O 3.13Å
239R90.2Very high89.1Confident138 Ų138101.9 Ų101.952%0.52148%0.481SS..EExtended strand (participates in β ladder)trans-114.8126.6176-61.7-167.9175.9118.2-5109.3T237 T259T237-R239 HydrophobicContact CG2-CG 4.16Å; R239-T259 HydrophobicContact CG-CG2 3.96Å
240A89.1Confident89.2Confident52 Ų52103.4 Ų103.443%0.4350%0.495SS..EExtended strand (participates in β ladder)trans-118.5124173.200000109.4H258A240-H258 PolarHBondContact N-O 2.75Å; A240-H258 PolarHBondContact O-N 2.88Å
241R88.4Confident89.2Confident162 Ų162107.8 Ų107.861%0.61153%0.526SS*.EExtended strand (participates in β ladder)trans-108.3135174.9-69.8-179.4-178.9179.9-2.6109.9T256 E257R241-T256 WeakPolarHBondContact CA-O 3.46Å; R241-E257 HydrophobicContact CG-CB 4.19Å; R241-E257 HydrophobicContact CG-CG 3.95Å; R241-E257 IonicContact CZ-OE2 3.62Å; R241-E257 IonicContact NE-OE2 2.8Å; R241-E257 PolarHBondContact NE-OE2 2.9Å; R241-E257 IonicContact NH2-OE2 3.3Å; R241-E257 PolarHBondContact NH2-OE2 2.83Å
242K87.6Confident89.1Confident116 Ų116108.3 Ų108.350%0.50453%0.529SS..EExtended strand (participates in β ladder)trans-125.1119.9173.7-172.5173-172172.40110R244 T256K242-R244 VanDerWaalsContact NZ-NH2 3.19Å; K242-T256 PolarHBondContact N-O 2.85Å; K242-T256 PolarHBondContact O-N 2.9Å; K242-T256 PolarHBondContact O-OG1 3.44Å; K242-T256 VanDerWaalsContact O-OG1 3.1Å
243H88.4Confident88.9Confident132 Ų132110.1 Ų110.161%0.61154%0.54SS*.EExtended strand (participates in β ladder)trans-73137.9174.5-66.3-86.2000110.5V253 C254H243-V253 HydrophobicContact CB-CG1 3.87Å; H243-C254 WeakPolarHBondContact CA-O 3.45Å
244R84.3Confident88.5Confident133 Ų133107.2 Ų107.250%0.50253%0.531SS..EExtended strand (participates in β ladder)trans-145.9141.9177.7-67.3-65.2-164.5161.98.3108.7K242 C254K242-R244 VanDerWaalsContact NZ-NH2 3.19Å; R244-C254 PolarHBondContact N-O 2.84Å; R244-C254 CarbonylContact O-C 3.6Å; R244-C254 VanDerWaalsContact O-CA 3.3Å; R244-C254 WeakPolarHBondContact O-CA 3.02Å; R244-C254 WeakPolarHBondContact O-CB 3.46Å; R244-C254 PolarHBondContact O-N 2.86Å
245P87.3Confident88.2Confident97 Ų97106.9 Ų106.963%0.6353%0.532SS*.EExtended strand (participates in β ladder)trans-56141.5169-22.833.7000110.8
246C87.6Confident87.8Confident20 Ų20104.5 Ų104.514%0.13553%0.526CS..  trans-69.3148.7177-58.50000111D249 Q252 C254C246-D249 WeakPolarHBondContact CB-O 3.23Å; C246-D249 CarbonylContact O-C 3.55Å; C246-Q252 HydrophobicContact CB-CB 4.43Å; C246-Q252 PolarHBondContact N-O 2.87Å; C246-Q252 VanDerWaalsContact N-O 3.08Å; C246-Q252 PolarHBondContact SG-O 2.88Å; C246-C254 VanDerWaalsContact CA-SG 3.57Å; C246-C254 HydrophobicContact CB-CB 4.08Å; C246-C254 WeakPolarHBondContact CB-SG 3.47Å; C246-C254 VanDerWaalsContact SG-CA 3.57Å; C246-C254 WeakPolarHBondContact SG-CB 3.39Å; C246-C254 PolarHBondContact SG-N 2.9Å; C246-C254 CovalentContact SG-SG 2.03Å; C246-C254 PolarHBondContact SG-SG 3.24Å
247L83.5Confident87.5Confident154 Ų15499.4 Ų99.481%0.80650%0.504SS*.SBendtrans-66.9-38.7-177.1-175.968000113
248Y83.4Confident87.4Confident222 Ų222100.4 Ų100.487%0.87151%0.505SS*.SBendtrans-92.7-16.1-174.4-63.3-77.4000113.5
249D90.9Very high87.4Confident51 Ų5196.3 Ų96.327%0.27348%0.483SS..  trans-150.399.7177.6-177.4-1.8000109.9C246 S251 Q252C246-D249 WeakPolarHBondContact CB-O 3.23Å; C246-D249 CarbonylContact O-C 3.55Å; D249-S251 VanDerWaalsContact CG-OG 3.25Å; D249-S251 PolarHBondContact O-N 2.76Å; D249-S251 WeakPolarHBondContact OD1-CB 3.34Å; D249-S251 PolarHBondContact OD1-N 3.2Å; D249-S251 PolarHBondContact OD1-OG 3.48Å; D249-S251 PolarHBondContact OD2-OG 2.78Å; D249-Q252 HydrophobicContact CB-CG 4.43Å; D249-Q252 PolarHBondContact O-N 2.68Å; D249-Q252 VanDerWaalsContact O-N 3.16Å; D249-Q252 WeakPolarHBondContact OD2-CG 3.44Å; D249-Q252 PolarHBondContact OD2-NE2 2.65Å
250P87.6Confident87.4Confident108 Ų10892.5 Ų92.570%0.70147%0.471SS*.THydrogen-bonded Turntrans-70.3-10.4-178.229-34.5000113.6Q252P250-Q252 VanDerWaalsContact C-N 3.26Å
251S89.4Confident87.6Confident100 Ų10090.1 Ų90.170%0.69945%0.451SS*.THydrogen-bonded Turntrans-75.8-16.9173.275.90000112.6D249D249-S251 VanDerWaalsContact CG-OG 3.25Å; D249-S251 PolarHBondContact O-N 2.76Å; D249-S251 WeakPolarHBondContact OD1-CB 3.34Å; D249-S251 PolarHBondContact OD1-N 3.2Å; D249-S251 PolarHBondContact OD1-OG 3.48Å; D249-S251 PolarHBondContact OD2-OG 2.78Å
252Q88.8Confident87.8Confident114 Ų11486 Ų8653%0.53344%0.439SS..SBendtrans-98141.9176.7-66.6-177.838.900112C246 D249 P250C246-Q252 HydrophobicContact CB-CB 4.43Å; C246-Q252 PolarHBondContact N-O 2.87Å; C246-Q252 VanDerWaalsContact N-O 3.08Å; C246-Q252 PolarHBondContact SG-O 2.88Å; D249-Q252 HydrophobicContact CB-CG 4.43Å; D249-Q252 PolarHBondContact O-N 2.68Å; D249-Q252 VanDerWaalsContact O-N 3.16Å; D249-Q252 WeakPolarHBondContact OD2-CG 3.44Å; D249-Q252 PolarHBondContact OD2-NE2 2.65Å; P250-Q252 VanDerWaalsContact C-N 3.26Å
253V87.8Confident88.1Confident101 Ų10180.9 Ų80.961%0.61242%0.418SS*.EExtended strand (participates in β ladder)trans-95.3111.1175.9-176.70000109.5H243H243-V253 HydrophobicContact CB-CG1 3.87Å
254C85.8Confident88.3Confident55 Ų5574.8 Ų74.837%0.37239%0.391SS..EExtended strand (participates in β ladder)trans-86.7162168.5-81.20000110.4H243 R244 C246H243-C254 WeakPolarHBondContact CA-O 3.45Å; R244-C254 PolarHBondContact N-O 2.84Å; R244-C254 CarbonylContact O-C 3.6Å; R244-C254 VanDerWaalsContact O-CA 3.3Å; R244-C254 WeakPolarHBondContact O-CA 3.02Å; R244-C254 WeakPolarHBondContact O-CB 3.46Å; R244-C254 PolarHBondContact O-N 2.86Å; C246-C254 VanDerWaalsContact CA-SG 3.57Å; C246-C254 HydrophobicContact CB-CB 4.08Å; C246-C254 WeakPolarHBondContact CB-SG 3.47Å; C246-C254 VanDerWaalsContact SG-CA 3.57Å; C246-C254 WeakPolarHBondContact SG-CB 3.39Å; C246-C254 PolarHBondContact SG-N 2.9Å; C246-C254 CovalentContact SG-SG 2.03Å; C246-C254 PolarHBondContact SG-SG 3.24Å
255F85.1Confident88.8Confident101 Ų10169.9 Ų69.944%0.44337%0.372SS..EExtended strand (participates in β ladder)trans-127.3145.6173.556.4-94.3000110.4L148L148-F255 HydrophobicContact CB-CE2 3.9Å; L148-F255 HydrophobicContact CD1-CD2 4.04Å; L148-F255 HydrophobicContact CD1-CE2 3.26Å; L148-F255 HydrophobicContact CD1-CZ 3.9Å; L148-F255 HydrophobicContact CD2-CE2 4.01Å; L148-F255 HydrophobicContact CD2-CZ 4.07Å; L148-F255 HydrophobicContact CG-CE2 3.88Å; L148-F255 HydrophobicContact CG-CZ 4.42Å
256T83.4Confident89Confident76 Ų7667 Ų6747%0.46635%0.352SS..EExtended strand (participates in β ladder)trans-111.2125.2167.2520000107R241 K242R241-T256 WeakPolarHBondContact CA-O 3.46Å; K242-T256 PolarHBondContact N-O 2.85Å; K242-T256 PolarHBondContact O-N 2.9Å; K242-T256 PolarHBondContact O-OG1 3.44Å; K242-T256 VanDerWaalsContact O-OG1 3.1Å
257E87.3Confident89.1Confident8 Ų866.1 Ų66.14%0.03735%0.345CS..EExtended strand (participates in β ladder)trans-110.4129.1178.7-175176.483.500109S146 S147 L148 R241S146-E257 CarbonylContact C-O 3.59Å; S146-E257 VanDerWaalsContact O-O 3.08Å; S147-E257 PolarHBondContact N-O 2.77Å; L148-E257 HydrophobicContact CD1-CB 4.46Å; R241-E257 HydrophobicContact CG-CB 4.19Å; R241-E257 HydrophobicContact CG-CG 3.95Å; R241-E257 IonicContact CZ-OE2 3.62Å; R241-E257 IonicContact NE-OE2 2.8Å; R241-E257 PolarHBondContact NE-OE2 2.9Å; R241-E257 IonicContact NH2-OE2 3.3Å; R241-E257 PolarHBondContact NH2-OE2 2.83Å
258H89.1Confident89.3Confident78 Ų7860.4 Ų60.436%0.36132%0.321SS..EExtended strand (participates in β ladder)trans-115.9118.5172.2-177.4-78.8000108.7N144 S145 A240N144-H258 VanDerWaalsContact CG-CE1 3.49Å; N144-H258 VanDerWaalsContact CG-NE2 3.31Å; N144-H258 PolarHBondContact ND2-CE1 3.14Å; N144-H258 PolarHBondContact ND2-NE2 3.44Å; N144-H258 PolarHBondContact OD1-CD2 2.77Å; N144-H258 PolarHBondContact OD1-CE1 2.87Å; N144-H258 PolarHBondContact OD1-NE2 3.12Å; S145-H258 CarbonylContact O-C 3.57Å; S145-H258 WeakPolarHBondContact O-CA 3.22Å; A240-H258 PolarHBondContact N-O 2.75Å; A240-H258 PolarHBondContact O-N 2.88Å
259T89.9Confident89Confident4 Ų453.4 Ų53.43%0.02530%0.295CS..EExtended strand (participates in β ladder)trans-111.6121.1179.4-63.10000109.3N144 S145 T237 N238 R239N144-T259 WeakPolarHBondContact CA-O 3.04Å; S145-T259 PolarHBondContact N-O 2.89Å; S145-T259 PolarHBondContact O-N 3.11Å; S145-T259 WeakPolarHBondContact OG-CB 3.41Å; S145-T259 PolarHBondContact OG-O 2.66Å; T237-T259 HydrophobicContact CG2-CG2 3.75Å; N238-T259 WeakPolarHBondContact O-CA 3.28Å; R239-T259 HydrophobicContact CG-CG2 3.96Å
260Q91.4Very high87.7Confident59 Ų5956.5 Ų56.528%0.27632%0.318SS..EExtended strand (participates in β ladder)trans-112.3128.7170.5178178.579.800108.7R142 H143 N238R142-Q260 VanDerWaalsContact NH2-NE2 3.1Å; H143-Q260 WeakPolarHBondContact O-CA 3.45Å; N238-Q260 PolarHBondContact N-O 3.17Å; N238-Q260 PolarHBondContact O-N 3.21Å; N238-Q260 VanDerWaalsContact O-O 3.13Å
261S91.6Very high86.6Confident1 Ų153.7 Ų53.71%0.00729%0.294CS..EExtended strand (participates in β ladder)trans-133.8154.2176.1-178.40000111.5R142 H143 K236 T237R142-S261 WeakPolarHBondContact CA-O 3.31Å; H143-S261 WeakPolarHBondContact CE1-CB 3.39Å; H143-S261 PolarHBondContact CE1-OG 2.83Å; H143-S261 VanDerWaalsContact CE1-OG 3.28Å; H143-S261 PolarHBondContact N-O 3.22Å; H143-S261 WeakPolarHBondContact ND1-CB 3.37Å; H143-S261 WeakPolarHBondContact NE2-CB 3.5Å; H143-S261 PolarHBondContact O-N 2.98Å; K236-S261 CarbonylContact O-C 3.56Å; K236-S261 VanDerWaalsContact O-CA 3.23Å; K236-S261 WeakPolarHBondContact O-CA 3.01Å; K236-S261 PolarHBondContact O-OG 3.28Å; T237-S261 WeakPolarHBondContact OG1-CB 3.39Å; T237-S261 PolarHBondContact OG1-OG 2.94Å
262Q93.2Very high85.3Confident75 Ų7556.6 Ų56.635%0.3529%0.294SS..EExtended strand (participates in β ladder)trans-133.7126.8178.4-65.6175.7-26.400107.2F141 R142 Y234 E235 K236F141-Q262 CarbonylContact O-C 3.49Å; F141-Q262 VanDerWaalsContact O-CA 3.31Å; F141-Q262 WeakPolarHBondContact O-CA 3.38Å; R142-Q262 HydrophobicContact CG-CG 4.35Å; Y234-Q262 HydrophobicContact CE1-CB 4.41Å; E235-Q262 CarbonylContact C-O 3.58Å; E235-Q262 WeakPolarHBondContact CA-O 3.42Å; K236-Q262 PolarHBondContact N-O 2.97Å; K236-Q262 PolarHBondContact O-N 2.84Å
263A93.5Very high84.7Confident9 Ų951.9 Ų51.97%0.07427%0.273CS..EExtended strand (participates in β ladder)trans-130.3135.1174.900000109.3Y140 F141 Y234 E235Y140-A263 CarbonylContact C-O 3.47Å; Y140-A263 WeakPolarHBondContact CA-O 3.19Å; F141-A263 HydrophobicContact CB-CB 4.45Å; F141-A263 PolarHBondContact N-O 2.84Å; F141-A263 PolarHBondContact O-N 3.28Å; Y234-A263 CarbonylContact O-C 3.56Å; Y234-A263 VanDerWaalsContact O-CA 3.3Å; Y234-A263 WeakPolarHBondContact O-CA 3.23Å; E235-A263 HydrophobicContact CG-CB 4.46Å
264A93.5Very high84.5Confident4 Ų447.2 Ų47.23%0.03325%0.245CC..EExtended strand (participates in β ladder)trans-115.5125.6171.900000108.6V139 Y140 E233 Y234V139-A264 WeakPolarHBondContact O-CA 3.49Å; Y140-A264 HydrophobicContact CD1-CB 3.62Å; Y140-A264 HydrophobicContact CE1-CB 3.62Å; E233-A264 PolarHBondContact N-O 3.02Å; Y234-A264 PolarHBondContact N-O 2.75Å; Y234-A264 PolarHBondContact O-N 3.45Å
265W93.7Very high84.6Confident31 Ų3144.6 Ų44.612%0.11723%0.227CC..EExtended strand (participates in β ladder)trans-108.5135.1175-72.674.3000109S138 V139 F141 I155 F228 C230 H231 V232S138-W265 CarbonylContact C-O 3.46Å; S138-W265 WeakPolarHBondContact CA-O 3.31Å; V139-W265 HydrophobicContact CB-CB 4.45Å; V139-W265 PolarHBondContact N-O 2.88Å; V139-W265 PolarHBondContact O-N 2.84Å; F141-W265 AromaticContact CD2-CD1 3.7Å; F141-W265 AromaticContact CE2-CD1 3.76Å; F141-W265 HydrophobicContact CE2-CG 4.45Å; I155-W265 HydrophobicContact CB-CD2 4.22Å; I155-W265 HydrophobicContact CB-CE3 4.11Å; I155-W265 HydrophobicContact CB-CZ3 4.46Å; I155-W265 HydrophobicContact CD1-CB 3.45Å; I155-W265 VanDerWaalsContact CD1-CB 3.45Å; I155-W265 HydrophobicContact CD1-CD2 4.06Å; I155-W265 HydrophobicContact CD1-CE3 4.39Å; I155-W265 HydrophobicContact CD1-CG 3.66Å; I155-W265 HydrophobicContact CG1-CB 4.16Å; I155-W265 HydrophobicContact CG1-CD2 3.82Å; I155-W265 HydrophobicContact CG1-CE3 4.19Å; I155-W265 HydrophobicContact CG1-CG 3.8Å; F228-W265 HydrophobicContact CE1-CZ3 4.39Å; C230-W265 HydrophobicContact CB-CE3 4.37Å; H231-W265 CarbonylContact O-C 3.6Å; H231-W265 WeakPolarHBondContact O-CA 3.14Å; V232-W265 HydrophobicContact CG2-CD2 3.92Å; V232-W265 HydrophobicContact CG2-CE3 4.06Å; V232-W265 HydrophobicContact CG2-CH2 3.57Å; V232-W265 HydrophobicContact CG2-CZ2 3.38Å; V232-W265 HydrophobicContact CG2-CZ3 3.91Å
266L92Very high84.9Confident37 Ų3739.8 Ų39.819%0.19421%0.206CC..EExtended strand (participates in β ladder)trans-107.6124.4172.4-175.566000108.9S138 C230 H231 E233S138-L266 WeakPolarHBondContact OG-CD1 3.38Å; C230-L266 VanDerWaalsContact CA-O 3.32Å; C230-L266 WeakPolarHBondContact CA-O 3.2Å; H231-L266 PolarHBondContact N-O 2.82Å; H231-L266 PolarHBondContact ND1-O 2.87Å; H231-L266 PolarHBondContact O-N 2.88Å; E233-L266 HydrophobicContact CB-CB 4.34Å
267C89.9Confident85.2Confident0 Ų037.5 Ų37.50%019%0.19CC..EExtended strand (participates in β ladder)trans-120.9134.9-179.3-69.50000110.8T136 F137 N229 C230T136-C267 CarbonylContact C-O 3.6Å; T136-C267 WeakPolarHBondContact CA-O 3.02Å; T136-C267 WeakPolarHBondContact CB-O 3.47Å; F137-C267 HydrophobicContact CD1-CB 3.92Å; F137-C267 HydrophobicContact CD2-CB 3.96Å; F137-C267 HydrophobicContact CE1-CB 3.41Å; F137-C267 VanDerWaalsContact CE1-CB 3.41Å; F137-C267 HydrophobicContact CE2-CB 3.47Å; F137-C267 VanDerWaalsContact CE2-CB 3.47Å; F137-C267 HydrophobicContact CG-CB 4.18Å; F137-C267 HydrophobicContact CZ-CB 3.17Å; F137-C267 PolarHBondContact N-O 3.33Å; F137-C267 PolarHBondContact O-N 2.92Å; N229-C267 CarbonylContact O-C 3.49Å; N229-C267 WeakPolarHBondContact O-CA 2.95Å; C230-C267 HydrophobicContact CB-CB 4.13Å; C230-C267 WeakPolarHBondContact CB-SG 3.45Å; C230-C267 WeakPolarHBondContact SG-CB 3.02Å; C230-C267 CovalentContact SG-SG 2.03Å; C230-C267 PolarHBondContact SG-SG 2.76Å
268A88.2Confident85.3Confident35 Ų3537.1 Ų37.129%0.28919%0.188SC..EExtended strand (participates in β ladder)trans-97.2138.3173.900000111.6T136 N229 F271T136-A268 HydrophobicContact CG2-CB 4.26Å; N229-A268 HydrophobicContact CB-CB 4.06Å; N229-A268 PolarHBondContact O-N 2.72Å; A268-F271 WeakPolarHBondContact O-CD2 3.3Å; A268-F271 WeakPolarHBondContact O-CE2 2.82Å
269K77.6Confident85.4Confident75 Ų7534.8 Ų34.833%0.32618%0.18SC..SBendtrans-60.9152.7168-72.6168.7-167.6157.30109.6D131 G135D131-K269 WeakPolarHBondContact OD1-CE 3.46Å; D131-K269 IonicContact OD1-NZ 2.65Å; D131-K269 PolarHBondContact OD1-NZ 2.83Å; D131-K269 IonicContact OD2-NZ 2.78Å; D131-K269 PolarHBondContact OD2-NZ 3.09Å; G135-K269 VanDerWaalsContact O-CB 3.31Å; G135-K269 WeakPolarHBondContact O-CB 3.26Å; G135-K269 WeakPolarHBondContact O-CD 3.45Å; G135-K269 VanDerWaalsContact O-CG 3.29Å; G135-K269 WeakPolarHBondContact O-CG 3.17Å; G135-K269 PolarHBondContact O-N 2.94Å; G135-K269 VanDerWaalsContact O-N 3.1Å
270P62.4Low85.2Confident116 Ų11634.8 Ų34.875%0.75318%0.18SC*.SBendcis-106.18418.237.8-30.7000113.2
271F65.1Low85Confident48 Ų4836.4 Ų36.421%0.21119%0.19CC..  trans-102.3130.4170.6-62.1-54.7000111.7N229 A268 I274N229-F271 HydrophobicContact CB-CE2 3.3Å; N229-F271 HydrophobicContact CB-CZ 3.44Å; N229-F271 VanDerWaalsContact CB-CZ 3.44Å; N229-F271 WeakPolarHBondContact ND2-CE2 3.38Å; N229-F271 WeakPolarHBondContact ND2-CZ 3.12Å; A268-F271 WeakPolarHBondContact O-CD2 3.3Å; A268-F271 WeakPolarHBondContact O-CE2 2.82Å; F271-I274 HydrophobicContact CB-CG2 4.4Å
272K62.8Low84.6Confident162 Ų16237.3 Ų37.370%0.70420%0.196SC*.SBendtrans-100.1-26.3174.3-63.7-178.3-179.1177.40112.3
273V75.1Confident83.9Confident14 Ų1442.5 Ų42.59%0.08522%0.218CC..  trans-139.1121.8-177.9-170.80000110.2P158 D294 Q298P158-V273 HydrophobicContact CG-CB 4.01Å; P158-V273 HydrophobicContact CG-CG1 3.67Å; V273-D294 HydrophobicContact CG2-CB 4.34Å; V273-Q298 HydrophobicContact CG2-CG 4Å
274I84.1Confident83.4Confident3 Ų346 Ų462%0.01524%0.236CC..  trans-122.3152.1168.255.6168.8000108.6W109 F137 I155 F271W109-I274 HydrophobicContact CH2-CD1 3.61Å; W109-I274 HydrophobicContact CH2-CG1 3.94Å; W109-I274 HydrophobicContact CZ2-CD1 3.68Å; W109-I274 HydrophobicContact CZ2-CG1 3.58Å; F137-I274 HydrophobicContact CE2-CD1 3.77Å; F137-I274 HydrophobicContact CZ-CD1 4.02Å; I155-I274 HydrophobicContact CD1-CD1 4.44Å; I155-I274 HydrophobicContact CG2-CB 3.76Å; I155-I274 HydrophobicContact CG2-CD1 3.98Å; I155-I274 HydrophobicContact CG2-CG1 4.38Å; I155-I274 HydrophobicContact CG2-CG2 4.16Å; F271-I274 HydrophobicContact CB-CG2 4.4Å
275C87.8Confident82.7Confident0 Ų049.6 Ų49.60%025%0.249CC..EExtended strand (participates in β ladder)trans-116.6142.6175.2-570000110.2I155 V156 P158 K290 V291 C292I155-C275 CarbonylContact C-O 3.57Å; I155-C275 WeakPolarHBondContact CA-O 3.45Å; V156-C275 HydrophobicContact CG2-CB 3.89Å; V156-C275 PolarHBondContact N-O 2.03Å; V156-C275 PolarHBondContact O-N 3.15Å; P158-C275 VanDerWaalsContact CA-SG 3.53Å; C275-K290 HydrophobicContact CB-CD 4.14Å; C275-K290 HydrophobicContact CB-CG 3.84Å; C275-V291 CarbonylContact C-O 3.37Å; C275-V291 WeakPolarHBondContact CA-O 3.22Å; C275-C292 HydrophobicContact CB-CB 4.09Å; C275-C292 WeakPolarHBondContact CB-SG 3.41Å; C275-C292 WeakPolarHBondContact SG-CB 3.32Å; C275-C292 CovalentContact SG-SG 2.03Å; C275-C292 PolarHBondContact SG-SG 2.96Å
276I90.3Very high82.4Confident1 Ų155.4 Ų55.41%0.00528%0.275CS..EExtended strand (participates in β ladder)trans-94.2122.8172.9-55.4170000106.7W109 F112 F141 V153 V278 K290 V291W109-I276 HydrophobicContact CZ3-CD1 4.01Å; F112-I276 HydrophobicContact CB-CD1 4.08Å; F112-I276 HydrophobicContact CD1-CD1 4.2Å; F112-I276 HydrophobicContact CD2-CD1 3.7Å; F112-I276 HydrophobicContact CE1-CG2 4.35Å; F112-I276 HydrophobicContact CE2-CD1 4.14Å; F112-I276 HydrophobicContact CG-CD1 3.72Å; F112-I276 HydrophobicContact CZ-CG2 4.35Å; F141-I276 HydrophobicContact CE1-CD1 4.12Å; F141-I276 HydrophobicContact CE1-CG1 4.33Å; F141-I276 HydrophobicContact CE1-CG2 3.98Å; F141-I276 HydrophobicContact CZ-CD1 4.36Å; F141-I276 HydrophobicContact CZ-CG1 4.15Å; F141-I276 HydrophobicContact CZ-CG2 4.11Å; V153-I276 HydrophobicContact CG1-CG2 4.08Å; I276-V278 HydrophobicContact CG2-CG2 4.15Å; I276-K290 CarbonylContact O-C 3.56Å; I276-K290 WeakPolarHBondContact O-CA 3.29Å; I276-V291 PolarHBondContact N-O 2.92Å; I276-V291 PolarHBondContact O-N 3.1Å
277F91.1Very high82.1Confident28 Ų2855.8 Ų55.812%0.12328%0.277CS..EExtended strand (participates in β ladder)trans-107.1120.3174.9-173.2-98.9000109.1V153 S154 V156 V162 V288 Q289 K290V153-F277 WeakPolarHBondContact CA-O 3.04Å; S154-F277 PolarHBondContact N-O 2.8Å; S154-F277 PolarHBondContact O-N 3.3Å; V156-F277 HydrophobicContact CG1-CB 3.83Å; V156-F277 HydrophobicContact CG1-CG 4.48Å; V156-F277 HydrophobicContact CG2-CB 3.84Å; V162-F277 HydrophobicContact CG1-CE2 4.17Å; F277-V288 HydrophobicContact CD2-CG1 4.41Å; F277-V288 HydrophobicContact CE1-CG1 4.19Å; F277-V288 HydrophobicContact CE2-CG1 3.35Å; F277-V288 HydrophobicContact CZ-CG1 3.22Å; F277-Q289 CarbonylContact C-O 3.53Å; F277-Q289 WeakPolarHBondContact CA-O 3.46Å; F277-K290 HydrophobicContact CD2-CB 4.15Å
278V90.1Very high82.1Confident0 Ų057.1 Ų57.10%029%0.285CS..EExtended strand (participates in β ladder)trans-113.3121.6176.1-176.80000107.2F112 F114 V125 L151 V153 I276 V288 Q289F112-V278 HydrophobicContact CZ-CG2 4.48Å; F114-V278 HydrophobicContact CD1-CG1 4.27Å; F114-V278 HydrophobicContact CE1-CG1 4.1Å; V125-V278 HydrophobicContact CG2-CG1 4.39Å; L151-V278 HydrophobicContact CD1-CG1 4.33Å; V153-V278 HydrophobicContact CG1-CG2 4.38Å; V153-V278 HydrophobicContact CG2-CG1 4.43Å; V153-V278 HydrophobicContact CG2-CG2 4.45Å; I276-V278 HydrophobicContact CG2-CG2 4.15Å; V278-V288 CarbonylContact O-C 3.49Å; V278-V288 WeakPolarHBondContact O-CA 3.34Å; V278-Q289 PolarHBondContact N-O 3.03Å; V278-Q289 PolarHBondContact O-N 3.25Å
279S89.3Confident82.1Confident28 Ų2858.7 Ų58.720%0.19629%0.286CS..EExtended strand (participates in β ladder)trans-125.9136.6171.378.80000110.7L151 S152 L287L151-S279 CarbonylContact C-O 3.53Å; L151-S279 WeakPolarHBondContact CA-O 3.26Å; S152-S279 PolarHBondContact N-O 2.8Å; S152-S279 PolarHBondContact O-N 2.82Å; S152-S279 PolarHBondContact OG-OG 2.88Å; S279-L287 CarbonylContact C-O 3.56Å; S279-L287 WeakPolarHBondContact CA-O 3.32Å
280F87.6Confident82.6Confident4 Ų458.1 Ų58.12%0.01828%0.284CS..EExtended strand (participates in β ladder)trans-132.7124.7177.1-178-110.5000109.1F121 S147 N150 L151 S282 K286 L287F121-F280 HydrophobicContact CD1-CD1 4.48Å; F121-F280 HydrophobicContact CD1-CE1 4.13Å; F121-F280 HydrophobicContact CD2-CD1 4.32Å; F121-F280 AromaticContact CD2-CE1 3.54Å; F121-F280 HydrophobicContact CD2-CE1 3.54Å; F121-F280 HydrophobicContact CD2-CE2 4.18Å; F121-F280 AromaticContact CD2-CZ 3.46Å; F121-F280 HydrophobicContact CD2-CZ 3.46Å; F121-F280 VanDerWaalsContact CD2-CZ 3.46Å; F121-F280 AromaticContact CE1-CD1 3.85Å; F121-F280 HydrophobicContact CE1-CD1 3.85Å; F121-F280 AromaticContact CE1-CE1 3.91Å; F121-F280 HydrophobicContact CE1-CE1 3.91Å; F121-F280 AromaticContact CE2-CD1 3.61Å; F121-F280 HydrophobicContact CE2-CD1 3.61Å; F121-F280 AromaticContact CE2-CD2 3.84Å; F121-F280 HydrophobicContact CE2-CD2 3.84Å; F121-F280 AromaticContact CE2-CE1 3.21Å; F121-F280 HydrophobicContact CE2-CE1 3.21Å; F121-F280 AromaticContact CE2-CE2 3.49Å; F121-F280 HydrophobicContact CE2-CE2 3.49Å; F121-F280 VanDerWaalsContact CE2-CE2 3.49Å; F121-F280 AromaticContact CE2-CG 3.89Å; F121-F280 HydrophobicContact CE2-CG 3.89Å; F121-F280 AromaticContact CE2-CZ 3.16Å; F121-F280 HydrophobicContact CE2-CZ 3.16Å; F121-F280 AromaticContact CG-CE1 3.91Å; F121-F280 HydrophobicContact CG-CE1 3.91Å; F121-F280 HydrophobicContact CG-CZ 4.26Å; F121-F280 HydrophobicContact CZ-CB 4.41Å; F121-F280 AromaticContact CZ-CD1 3.3Å; F121-F280 HydrophobicContact CZ-CD1 3.3Å; F121-F280 HydrophobicContact CZ-CD2 4.04Å; F121-F280 AromaticContact CZ-CE1 3.39Å; F121-F280 HydrophobicContact CZ-CE1 3.39Å; F121-F280 HydrophobicContact CZ-CE2 4.13Å; F121-F280 AromaticContact CZ-CG 3.63Å; F121-F280 HydrophobicContact CZ-CG 3.63Å; F121-F280 AromaticContact CZ-CZ 3.82Å; F121-F280 HydrophobicContact CZ-CZ 3.82Å; S147-F280 VanDerWaalsContact OG-CZ 3.27Å; S147-F280 WeakPolarHBondContact OG-CZ 3.5Å; N150-F280 WeakPolarHBondContact O-CA 2.94Å; L151-F280 HydrophobicContact CB-CD2 4.02Å; L151-F280 HydrophobicContact CD1-CB 3.65Å; L151-F280 HydrophobicContact CD1-CD2 3.61Å; L151-F280 HydrophobicContact CD1-CG 4.02Å; L151-F280 HydrophobicContact CG-CD2 4.46Å; F280-S282 VanDerWaalsContact CZ-CB 3.46Å; F280-K286 WeakPolarHBondContact O-CA 3.33Å; F280-L287 HydrophobicContact CB-CB 4.15Å; F280-L287 PolarHBondContact N-O 2.83Å; F280-L287 PolarHBondContact O-N 2.81Å
281L85.6Confident83.8Confident94 Ų9454.5 Ų54.549%0.49226%0.259SS..EExtended strand (participates in β ladder)trans-123.4109.5174.9-17660.1000109.1G149 N150 K286G149-L281 CarbonylContact C-O 3.6Å; G149-L281 WeakPolarHBondContact CA-O 3.12Å; N150-L281 PolarHBondContact N-O 2.87Å; N150-L281 PolarHBondContact O-N 2.86Å; L281-K286 HydrophobicContact CD1-CD 3.82Å; L281-K286 HydrophobicContact CD1-CG 3.7Å
282S83.1Confident84.9Confident19 Ų1953.6 Ų53.613%0.13326%0.259CS..EExtended strand (participates in β ladder)trans-114.3178.5169.8-174.10000110.2L148 F280 Y285L148-S282 VanDerWaalsContact O-CB 3.31Å; L148-S282 WeakPolarHBondContact O-CB 3.31Å; L148-S282 PolarHBondContact O-OG 3.26Å; F280-S282 VanDerWaalsContact CZ-CB 3.46Å; S282-Y285 PolarHBondContact N-O 2.76Å
283F80.2Confident85.7Confident184 Ų18448.1 Ų48.181%0.80724%0.24SC*.SBendtrans-67.7-43.9173.3-176.1-100.3000111.6
284D81.4Confident85.7Confident84 Ų8448 Ų4845%0.44924%0.239SC..SBendtrans-94.9-20.3-175.3-67-35.6000113.4K120K120-D284 IonicContact NZ-OD2 3.82Å
285Y80.2Confident85Confident79 Ų7954.2 Ų54.231%0.3126%0.263SS..  trans-138.8141-170.4-60.5-83.7000112.3T118 F121 S282T118-Y285 HydrophobicContact CG2-CD1 4.37Å; T118-Y285 HydrophobicContact CG2-CE1 4.02Å; F121-Y285 HydrophobicContact CB-CD2 4.15Å; F121-Y285 HydrophobicContact CB-CE2 4.45Å; S282-Y285 PolarHBondContact N-O 2.76Å
286K87.3Confident83.7Confident153 Ų15360.1 Ų60.167%0.66530%0.295SS*.EExtended strand (participates in β ladder)trans-126.3131.3171.3-54.2-170.8-1791760108.8F164 F280 L281F164-K286 HydrophobicContact CE1-CB 4.28Å; F280-K286 WeakPolarHBondContact O-CA 3.33Å; L281-K286 HydrophobicContact CD1-CD 3.82Å; L281-K286 HydrophobicContact CD1-CG 3.7Å
287L85Confident82Confident44 Ų4467.2 Ų67.223%0.2333%0.325CS..EExtended strand (participates in β ladder)trans-138132.8177171.381.3000108.6F114 V116 L123 S279 F280F114-L287 HydrophobicContact CE1-CD2 3.66Å; F114-L287 HydrophobicContact CZ-CD2 3.57Å; V116-L287 HydrophobicContact CG2-CD2 4.29Å; L123-L287 HydrophobicContact CD2-CD2 4.35Å; S279-L287 CarbonylContact C-O 3.56Å; S279-L287 WeakPolarHBondContact CA-O 3.32Å; F280-L287 HydrophobicContact CB-CB 4.15Å; F280-L287 PolarHBondContact N-O 2.83Å; F280-L287 PolarHBondContact O-N 2.81Å
288V89.6Confident80.3Confident28 Ų2871 Ų7117%0.1734%0.343CS..EExtended strand (participates in β ladder)trans-136.9126.1169.1-1750000107.8V162 F164 F277 V278V162-V288 HydrophobicContact CG1-CB 4.21Å; V162-V288 HydrophobicContact CG1-CG1 3.45Å; V162-V288 VanDerWaalsContact CG1-CG1 3.45Å; F164-V288 HydrophobicContact CD1-CB 4.32Å; F164-V288 HydrophobicContact CD1-CG2 3.41Å; F164-V288 VanDerWaalsContact CD1-CG2 3.41Å; F164-V288 HydrophobicContact CD2-CG2 4.46Å; F164-V288 HydrophobicContact CE1-CB 3.97Å; F164-V288 HydrophobicContact CE1-CG2 3.4Å; F164-V288 HydrophobicContact CE2-CB 4.38Å; F164-V288 HydrophobicContact CE2-CG2 4.44Å; F164-V288 HydrophobicContact CG-CG2 3.98Å; F164-V288 HydrophobicContact CZ-CB 3.99Å; F164-V288 HydrophobicContact CZ-CG2 3.94Å; F277-V288 HydrophobicContact CD2-CG1 4.41Å; F277-V288 HydrophobicContact CE1-CG1 4.19Å; F277-V288 HydrophobicContact CE2-CG1 3.35Å; F277-V288 HydrophobicContact CZ-CG1 3.22Å; V278-V288 CarbonylContact O-C 3.49Å; V278-V288 WeakPolarHBondContact O-CA 3.34Å
289Q88.4Confident78.4Confident68 Ų6875.2 Ų75.232%0.31837%0.373SS..EExtended strand (participates in β ladder)trans-138.2129.2-179.5-166.2178.641.100110.5F114 F277 V278 V291F114-Q289 VanDerWaalsContact CD2-OE1 3.26Å; F277-Q289 CarbonylContact C-O 3.53Å; F277-Q289 WeakPolarHBondContact CA-O 3.46Å; V278-Q289 PolarHBondContact N-O 3.03Å; V278-Q289 PolarHBondContact O-N 3.25Å; Q289-V291 HydrophobicContact CG-CG2 3.92Å
290K89.4Confident76.1Confident63 Ų6381.7 Ų81.727%0.27440%0.4SS..EExtended strand (participates in β ladder)trans-109.9123.1167.9-174.2179.771.2169.50108.7V156 P158 K160 V162 C275 I276 F277V156-K290 HydrophobicContact CG2-CD 4.33Å; V156-K290 HydrophobicContact CG2-CG 4.47Å; P158-K290 PolarHBondContact O-NZ 3.08Å; K160-K290 WeakPolarHBondContact O-CD 3.39Å; K160-K290 PolarHBondContact O-NZ 3.1Å; V162-K290 HydrophobicContact CG2-CB 3.44Å; V162-K290 VanDerWaalsContact CG2-CB 3.44Å; V162-K290 HydrophobicContact CG2-CD 4.13Å; V162-K290 HydrophobicContact CG2-CG 4.39Å; C275-K290 HydrophobicContact CB-CD 4.14Å; C275-K290 HydrophobicContact CB-CG 3.84Å; I276-K290 CarbonylContact O-C 3.56Å; I276-K290 WeakPolarHBondContact O-CA 3.29Å; F277-K290 HydrophobicContact CD2-CB 4.15Å
291V87.4Confident74.1Confident40 Ų4088.3 Ų88.324%0.24243%0.431CS..EExtended strand (participates in β ladder)trans-116.4124.5177.2-176.10000108F112 C275 I276 Q289 P293F112-V291 HydrophobicContact CE2-CB 4.46Å; F112-V291 HydrophobicContact CE2-CG1 4.45Å; F112-V291 HydrophobicContact CE2-CG2 4.38Å; C275-V291 CarbonylContact C-O 3.37Å; C275-V291 WeakPolarHBondContact CA-O 3.22Å; I276-V291 PolarHBondContact N-O 2.92Å; I276-V291 PolarHBondContact O-N 3.1Å; Q289-V291 HydrophobicContact CG-CG2 3.92Å; V291-P293 HydrophobicContact CG1-CG 4.36Å; V291-P293 WeakPolarHBondContact O-CD 3.41Å
292C88.1Confident72.1Confident29 Ų2988 Ų8820%0.19644%0.435CS..  trans-119.788.8179-57.20000108.7C275 D294 Y295C275-C292 HydrophobicContact CB-CB 4.09Å; C275-C292 WeakPolarHBondContact CB-SG 3.41Å; C275-C292 WeakPolarHBondContact SG-CB 3.32Å; C275-C292 CovalentContact SG-SG 2.03Å; C275-C292 PolarHBondContact SG-SG 2.96Å; C292-D294 VanDerWaalsContact C-N 3.27Å; C292-D294 PolarHBondContact O-N 3.45Å; C292-Y295 HydrophobicContact CB-CD2 4.39Å; C292-Y295 HydrophobicContact CB-CG 4.36Å; C292-Y295 WeakPolarHBondContact O-CB 3.4Å; C292-Y295 PolarHBondContact O-N 2.85Å
293P79.3Confident69.8Low47 Ų4798.3 Ų98.331%0.30547%0.472SS..THydrogen-bonded Turntrans-61.9-30.3-167.5-26.336.2000114.8W109 V291W109-P293 HydrophobicContact CB-CB 3.85Å; W109-P293 HydrophobicContact CD2-CB 3.61Å; W109-P293 HydrophobicContact CD2-CG 3.66Å; W109-P293 HydrophobicContact CE3-CB 4.3Å; W109-P293 HydrophobicContact CE3-CG 3.9Å; W109-P293 HydrophobicContact CG-CB 3.34Å; W109-P293 HydrophobicContact CG-CG 3.96Å; W109-P293 HydrophobicContact CZ2-CG 4.41Å; W109-P293 HydrophobicContact CZ3-CG 4.38Å; V291-P293 HydrophobicContact CG1-CG 4.36Å; V291-P293 WeakPolarHBondContact O-CD 3.41Å
294D74.9Confident67.8Low12 Ų1298.8 Ų98.86%0.06447%0.474CS..THydrogen-bonded Turntrans-107.116.9-179-69-36.5000113.6G108 W109 V273 C292 N296 F297G108-D294 PolarHBondContact N-OD1 2.86Å; W109-D294 VanDerWaalsContact CD1-OD1 3.29Å; W109-D294 VanDerWaalsContact NE1-CG 3.33Å; W109-D294 PolarHBondContact NE1-OD2 3.48Å; V273-D294 HydrophobicContact CG2-CB 4.34Å; C292-D294 VanDerWaalsContact C-N 3.27Å; C292-D294 PolarHBondContact O-N 3.45Å; D294-N296 VanDerWaalsContact C-N 3.29Å; D294-N296 PolarHBondContact O-N 3.18Å; D294-F297 HydrophobicContact CB-CD2 4.15Å; D294-F297 PolarHBondContact O-N 2.95Å
295Y69.7Low65.8Low134 Ų134101.6 Ų101.653%0.52552%0.524SS..THydrogen-bonded Turntrans-61.1-36-176.5-168.9-101.3000113.1P158 C292 F297 Q298P158-Y295 HydrophobicContact CB-CD2 4.36Å; P158-Y295 HydrophobicContact CB-CE2 4.3Å; C292-Y295 HydrophobicContact CB-CD2 4.39Å; C292-Y295 HydrophobicContact CB-CG 4.36Å; C292-Y295 WeakPolarHBondContact O-CB 3.4Å; C292-Y295 PolarHBondContact O-N 2.85Å; Y295-F297 VanDerWaalsContact C-N 3.31Å; Y295-F297 PolarHBondContact O-N 2.8Å; Y295-Q298 PolarHBondContact O-N 2.96Å
296N60.4Low65.1Low124 Ų124102.8 Ų102.866%0.66353%0.534SS*.Hα-helixtrans-71.6-17.6-178.2-73.4-17000114.4D294 Q298 S299D294-N296 VanDerWaalsContact C-N 3.29Å; D294-N296 PolarHBondContact O-N 3.18Å; N296-Q298 PolarHBondContact O-N 3.23Å; N296-S299 PolarHBondContact O-OG 2.96Å; N296-S299 VanDerWaalsContact O-OG 3.1Å
297F54.4Low64Low149 Ų149100.1 Ų100.165%0.65453%0.528SS*.Hα-helixtrans-75-5.8177.6-73.2-76.3000113.5D294 Y295D294-F297 HydrophobicContact CB-CD2 4.15Å; D294-F297 PolarHBondContact O-N 2.95Å; Y295-F297 VanDerWaalsContact C-N 3.31Å; Y295-F297 PolarHBondContact O-N 2.8Å
298Q54.1Low62.8Low107 Ų107103.2 Ų103.250%0.554%0.544SS..Hα-helixtrans-102.4-25.4175.8-71.7-168.6-5.300113.8V273 Y295 N296 E300V273-Q298 HydrophobicContact CG2-CG 4Å; Y295-Q298 PolarHBondContact O-N 2.96Å; N296-Q298 PolarHBondContact O-N 3.23Å; Q298-E300 PolarHBondContact O-N 3.03Å
299S51.1Low61.2Low89 Ų89107.6 Ų107.662%0.62257%0.566SS**Hα-helixtrans-69-24.817554.60000112.3N296 H301N296-S299 PolarHBondContact O-OG 2.96Å; N296-S299 VanDerWaalsContact O-OG 3.1Å; S299-H301 PolarHBondContact O-N 3.28Å
300E41.9Very low59.5Low165 Ų165110.1 Ų110.177%0.77158%0.582SS**  trans-92.172.9169.4-66.4-162.4171.400110.6Q298Q298-E300 PolarHBondContact O-N 3.03Å
301H44.3Very low57.5Low142 Ų142113.3 Ų113.366%0.65760%0.602SS**  trans-109130139.2-79.662.5000107.2S299S299-H301 PolarHBondContact O-N 3.28Å
302P43.7Very low55.4Low89 Ų89118.5 Ų118.558%0.57863%0.628SS**  trans-68.8140.6-167.131-33.5000108.3F304P302-F304 VanDerWaalsContact C-N 3.25Å; P302-F304 HydrophobicContact CG-CD2 4.27Å; P302-F304 HydrophobicContact CG-CE2 4.17Å; P302-F304 PolarHBondContact O-N 2.77Å
303Y34.7Very low52.9Low234 Ų234125.4 Ų125.492%0.91866%0.661SS**  trans-53.9104.5151.7-70.6-89.2000105.9G305Y303-G305 PolarHBondContact O-N 2.93Å
304F38.2Very low50.7Low194 Ų194131.9 Ų131.985%0.85169%0.691SS**  trans-6397.4162.7-87.4-89.3000105.4P302P302-F304 VanDerWaalsContact C-N 3.25Å; P302-F304 HydrophobicContact CG-CD2 4.27Å; P302-F304 HydrophobicContact CG-CE2 4.17Å; P302-F304 PolarHBondContact O-N 2.77Å
305G40.8Very low48.5Very low144 Ų144142.8 Ų142.8100%1.48575%0.748SS**  trans-760154.200000110.1Y303Y303-G305 PolarHBondContact O-N 2.93Å

Retrieved 305 of 305 residues in 101.8 ms (Link to these results)