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Large ribosomal subunit protein uL1m

AlphaFold DB , UniProt , Accession Q99N96, Species MOUSE (Mus musculus, Mouse), Gene Mrpl1, Length 336 aa.

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(Predicted Aligned Error values between residue pairs)
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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M43.5Very low49Very low225 Ų225132.4 Ų132.4100%1.10870%0.697SS**  0-39.90-71.2-68.3-143.400114.4A3M1-A3 PolarHBondContact O-N 3.1Å
2A48.8Very low48.8Very low82 Ų82130.8 Ų130.868%0.67869%0.688SS**Hα-helixtrans-72.4-22.6-173.200000116.8
3A48.8Very low48.8Very low85 Ų85128.8 Ų128.870%0.70268%0.677SS**Hα-helixtrans-71.9-32.6-178.500000113.3M1 V5M1-A3 PolarHBondContact O-N 3.1Å; A3-V5 PolarHBondContact O-N 2.93Å
4A49.5Very low48.2Very low65 Ų65130.8 Ų130.854%0.53768%0.68SS.*Hα-helixtrans-70.1-30.1-17800000113.1R6 C7A4-R6 PolarHBondContact O-N 3.08Å; A4-C7 PolarHBondContact O-N 3.42Å
5V52.3Low47.5Very low101 Ų101131.3 Ų131.361%0.61268%0.678SS**Hα-helixtrans-72.5-28.9-177.6-177.50000112.2A3 R9A3-V5 PolarHBondContact O-N 2.93Å; V5-R9 PolarHBondContact O-N 2.86Å
6R50.7Low46.9Very low206 Ų206133.3 Ų133.378%0.77768%0.683SS**Hα-helixtrans-72.4-31.8177.8-73.9-174.4-171.4157.83.1113A4A4-R6 PolarHBondContact O-N 3.08Å
7C50.8Low46.4Very low90 Ų90138.3 Ų138.361%0.60869%0.691SS**Hα-helixtrans-70.7-40.6177.1-74.40000111.8A4 R9 R10 V11A4-C7 PolarHBondContact O-N 3.42Å; C7-R9 PolarHBondContact O-N 2.97Å; C7-R10 PolarHBondContact O-N 3.36Å; C7-V11 WeakPolarHBondContact O-CG2 3.48Å; C7-V11 PolarHBondContact O-N 3.39Å
8L48.3Very low45.7Very low117 Ų117139.7 Ų139.761%0.61370%0.695SS**Hα-helixtrans-66.8-34.5179.2-73.2166.1000112.8R10 V11 L12L8-R10 VanDerWaalsContact C-N 3.35Å; L8-R10 PolarHBondContact O-N 3.47Å; L8-V11 PolarHBondContact O-N 2.78Å; L8-L12 PolarHBondContact O-N 3.44Å
9R45.1Very low44.9Very low192 Ų192138.2 Ų138.273%0.72570%0.698SS**Hα-helixtrans-69.2-30.7177.7-155.4178.2-174.2-1601.8113V5 C7 I13V5-R9 PolarHBondContact O-N 2.86Å; C7-R9 PolarHBondContact O-N 2.97Å; R9-I13 WeakPolarHBondContact O-CD1 3.48Å; R9-I13 WeakPolarHBondContact O-CG1 3.35Å; R9-I13 PolarHBondContact O-N 3.47Å
10R48.9Very low44.1Very low205 Ų205139.9 Ų139.977%0.77471%0.708SS**Hα-helixtrans-72.8-34.3175.6-78-172.2176.7-173.2-0.4112.6C7 L8C7-R10 PolarHBondContact O-N 3.36Å; L8-R10 VanDerWaalsContact C-N 3.35Å; L8-R10 PolarHBondContact O-N 3.47Å
11V52.1Low43.5Very low88 Ų88139.5 Ų139.553%0.53372%0.717SS.*Hα-helixtrans-71.2-38.6178.9178.50000111.4C7 L8 H14 H15C7-V11 WeakPolarHBondContact O-CG2 3.48Å; C7-V11 PolarHBondContact O-N 3.39Å; L8-V11 PolarHBondContact O-N 2.78Å; V11-H14 PolarHBondContact O-N 3.31Å; V11-H15 PolarHBondContact O-N 3.47Å
12L47.5Very low42.7Very low113 Ų113138.9 Ų138.959%0.59271%0.708SS**Hα-helixtrans-72.3-31.2-178.4-70.1170000113.9L8 H14 H15 Q16L8-L12 PolarHBondContact O-N 3.44Å; L12-H14 VanDerWaalsContact C-N 3.28Å; L12-H14 PolarHBondContact O-N 3.38Å; L12-H15 PolarHBondContact O-N 3.33Å; L12-Q16 PolarHBondContact O-N 3.45Å
13I48.8Very low42Very low106 Ų106143.9 Ų143.954%0.54472%0.719SS.*Hα-helixtrans-69-30.9175.6-63.9168.1000110.8R9R9-I13 WeakPolarHBondContact O-CD1 3.48Å; R9-I13 WeakPolarHBondContact O-CG1 3.35Å; R9-I13 PolarHBondContact O-N 3.47Å
14H39.9Very low41Very low156 Ų156144 Ų14472%0.72272%0.721SS**Hα-helixtrans-75.9-31.9176.5-113.4-39.2000113V11 L12V11-H14 PolarHBondContact O-N 3.31Å; L12-H14 VanDerWaalsContact C-N 3.28Å; L12-H14 PolarHBondContact O-N 3.38Å
15H37.5Very low40.1Very low138 Ų138146.1 Ų146.164%0.63973%0.732SS**Hα-helixtrans-78.2-26.2178.9-105.9-48.6000114.4V11 L12 R17 H18V11-H15 PolarHBondContact O-N 3.47Å; L12-H15 PolarHBondContact O-N 3.33Å; H15-R17 PolarHBondContact O-N 3.42Å; H15-H18 PolarHBondContact O-N 3.22Å
16Q38.8Very low39.3Very low163 Ų163150.7 Ų150.776%0.76275%0.746SS**THydrogen-bonded Turntrans-73.3-3.2-178.1-83-169.7-24.800115.4L12L12-Q16 PolarHBondContact O-N 3.45Å
17R37.9Very low38.3Very low219 Ų219145.9 Ų145.983%0.82675%0.751SS**THydrogen-bonded Turntrans-97.4-0.1175.6-69.3-170.6177-170.7-1.3115H15H15-R17 PolarHBondContact O-N 3.42Å
18H34.4Very low37.6Very low164 Ų164147.3 Ų147.376%0.75976%0.761SS**SBendtrans-108.416.3177.7-71.4-64.7000114.6H15H15-H18 PolarHBondContact O-N 3.22Å
19C28.9Very low36.7Very low110 Ų110149.2 Ų149.274%0.74377%0.772SS**  trans-124.5102.4167.9-98.60000108.8
20L29.9Very low36.1Very low172 Ų172151 Ų15190%0.90178%0.78SS**  trans164.796.7141.1-86.2168.1000107.9
21C30.7Very low35.5Very low133 Ų133147 Ų14790%0.89978%0.78SS**  trans-170.286.3143.4-99.80000107.9M23C21-M23 PolarHBondContact O-N 3.5Å
22K26.6Very low34.7Very low211 Ų211149.2 Ų149.292%0.91780%0.798SS**  trans-66.9118.1158.7-75.6173172.7177.10107.2
23M34Very low34.4Very low187 Ų187148.8 Ų148.892%0.92181%0.805SS**  trans-139118.1153.4-88.5-69.2174.300107.5C21C21-M23 PolarHBondContact O-N 3.5Å
24A29.5Very low34.1Very low89 Ų89150.3 Ų150.374%0.73682%0.818SS**  trans-75.9148178.300000111
25S30.5Very low34Very low109 Ų109149.4 Ų149.476%0.76282%0.819SS**  trans44.2109.7149.562.30000119.3
26Q35Very low34Very low197 Ų197147.6 Ų147.692%0.92182%0.822SS**  -167.9140102.6-100.6177.25.400110.4
27A29.2Very low34Very low105 Ų105146.8 Ų146.887%0.86882%0.822SS**  trans-77136.2-173.900000112.2
28S35.9Very low34Very low119 Ų119143.6 Ų143.683%0.83282%0.821SS**  trans-152.9123148.2-174.70000108.7Y30S28-Y30 PolarHBondContact O-N 3.49Å
29L30.1Very low34Very low158 Ų158143.8 Ų143.883%0.82782%0.822SS**  trans-74.4111.3179.5-67.6158.9000108.5
30Y32.6Very low34.4Very low229 Ų229144.8 Ų144.890%0.89882%0.819SS**  trans170.5100.2148-84.9-63.4000108.6S28S28-Y30 PolarHBondContact O-N 3.49Å
31P35.1Very low35Very low121 Ų121147 Ų14779%0.78682%0.816SS**  trans-119.4100.9173.734.4-18.6000111
32C36.2Very low35.5Very low135 Ų135148.8 Ų148.891%0.91281%0.811SS**  trans-148.354.1162.7-86.80000110.6
33S41.8Very low36.5Very low104 Ų104147.8 Ų147.873%0.72781%0.807SS**  trans-99.1102.6156.950.30000108.3N35S33-N35 VanDerWaalsContact C-N 3.32Å; S33-N35 PolarHBondContact O-N 3.04Å
34V41.7Very low36.6Very low137 Ų137144 Ų14483%0.8381%0.805SS**  trans-70.292.6171.3178.30000107.1S36V34-S36 PolarHBondContact O-N 2.99Å
35N37.3Very low36.9Very low137 Ų137144.4 Ų144.473%0.73381%0.809SS**  trans-66.3101.6164.7-84.4-19.5000107.7S33 L37S33-N35 VanDerWaalsContact C-N 3.32Å; S33-N35 PolarHBondContact O-N 3.04Å; N35-L37 VanDerWaalsContact C-N 3.26Å; N35-L37 PolarHBondContact O-N 3.46Å
36S38.4Very low37.1Very low100 Ų100143.9 Ų143.970%0.69981%0.811SS**  trans-66.389.5168.1460000108.8V34 L38V34-S36 PolarHBondContact O-N 2.99Å; S36-L38 PolarHBondContact O-N 3.39Å
37L37.6Very low37.2Very low146 Ų146139.5 Ų139.576%0.76481%0.808SS**  trans-65.682.7164.8-76.4163.8000108.1N35 H39N35-L37 VanDerWaalsContact C-N 3.26Å; N35-L37 PolarHBondContact O-N 3.46Å; L37-H39 PolarHBondContact O-N 3.22Å; L37-H39 PolarHBondContact O-ND1 3.23Å
38L37.5Very low37.7Very low152 Ų152139.1 Ų139.180%0.79681%0.805SS**  trans-56.3107.9160-80.1166.4000106.5S36 N40S36-L38 PolarHBondContact O-N 3.39Å; L38-N40 VanDerWaalsContact C-N 3.28Å; L38-N40 PolarHBondContact O-N 3.45Å
39H34.9Very low37.6Very low169 Ų169137 Ų13778%0.78280%0.795SS**  trans-66.689.4177.8-76.562.7000108.5L37 R41L37-H39 PolarHBondContact O-N 3.22Å; L37-H39 PolarHBondContact O-ND1 3.23Å; H39-R41 VanDerWaalsContact C-N 3.3Å; H39-R41 PolarHBondContact O-N 3.32Å
40N38.3Very low37.7Very low130 Ų130134.6 Ų134.670%0.69580%0.798SS**  trans-63.695.5165.7-89.2-15.9000108L38 H42L38-N40 VanDerWaalsContact C-N 3.28Å; L38-N40 PolarHBondContact O-N 3.45Å; N40-H42 PolarHBondContact O-CD2 3.21Å; N40-H42 PolarHBondContact O-N 2.88Å
41R43.1Very low37.8Very low219 Ų219130 Ų13083%0.82679%0.793SS**  trans-67.195.9169.2-71.7-174.1172.2-170.1-1.7107.8H39 F43H39-R41 VanDerWaalsContact C-N 3.3Å; H39-R41 PolarHBondContact O-N 3.32Å; R41-F43 PolarHBondContact O-N 2.94Å
42H41.1Very low37.5Very low170 Ų170133.8 Ų133.879%0.78780%0.798SS**  trans-66101.7168.9-66.3-72.7000108.6N40 A44N40-H42 PolarHBondContact O-CD2 3.21Å; N40-H42 PolarHBondContact O-N 2.88Å; H42-A44 PolarHBondContact O-N 3.4Å
43F47.7Very low37.1Very low190 Ų190133.8 Ų133.883%0.83380%0.796SS**  trans-62.6116.8165.5-77-82.8000108.2R41 A45R41-F43 PolarHBondContact O-N 2.94Å; F43-A45 PolarHBondContact O-N 3.31Å
44A35.7Very low36.5Very low107 Ų107133.5 Ų133.588%0.88480%0.8SS**  trans-72.777.6174.900000110.1H42H42-A44 PolarHBondContact O-N 3.4Å
45A35.2Very low35.5Very low99 Ų99137.9 Ų137.982%0.81880%0.801SS**  trans-99.470.316600000109.4F43F43-A45 PolarHBondContact O-N 3.31Å
46A34.2Very low34.8Very low98 Ų98139.5 Ų139.581%0.8180%0.802SS**  trans-16471.9171.400000112.2
47A37.4Very low34Very low104 Ų104141.1 Ų141.186%0.8680%0.801SS**  trans-156.87.2164.300000115.9
48A40.6Very low33.2Very low97 Ų97143.3 Ų143.380%0.80281%0.805SS**SBendtrans-123.374.316700000107.6
49A33.3Very low32.3Very low76 Ų76146.3 Ų146.363%0.62881%0.811SS**  52.385.495.900000110T51A49-T51 VanDerWaalsContact C-N 3.3Å; A49-T51 PolarHBondContact O-N 3.49Å
50A32.3Very low31.7Very low107 Ų107141.6 Ų141.688%0.88481%0.809SS**  41.856.469.900000112.4
51T33.8Very low31Very low131 Ų131140.4 Ų140.480%0.80482%0.817SS**  trans-133.5134.8154.843.50000109.9A49A49-T51 VanDerWaalsContact C-N 3.3Å; A49-T51 PolarHBondContact O-N 3.49Å
52K28.9Very low30Very low202 Ų202138.8 Ų138.888%0.87882%0.816SS**  trans-71.5157.5-162.9-65173.1174.2175.10113.4
53P28.4Very low29.3Very low134 Ų134138.3 Ų138.387%0.8781%0.814SS**  trans-85.8123.7176.633.4-29.5000111.2
54A28.4Very low28.1Very low98 Ų98138.9 Ų138.981%0.8182%0.816SS**  trans-132.4104.5170.600000111.2
55R21.3Very low27.4Very low229 Ų229139.5 Ų139.586%0.86481%0.809SS**  trans17.8131.3143.7-82.2176.5172.5173.9-1.3120.6
56K21.8Very low27.1Very low172 Ų172139.3 Ų139.375%0.74880%0.801SS**  trans95.3114.4131.1-77.9-176.2176.5-172.10120.7
57I22.1Very low26.9Very low133 Ų133141.6 Ų141.668%0.68280%0.8SS**  88.4109.8126.1-63170.3000119.8
58K21Very low26.8Very low192 Ų192145 Ų14584%0.83580%0.798SS**  trans56.8128.1135.5-66.2-177.5176179.20122.5
59K19.6Very low26.5Very low216 Ų216148.4 Ų148.494%0.93980%0.795SS**  trans96.1123.7132.9-120.3-179.3179.7-174.80118.5
60G21.5Very low27.3Very low70 Ų70149.9 Ų149.972%0.72280%0.798SS**  trans123.777.7168.200000112.1
61A22.8Very low27.9Very low105 Ų105148.6 Ų148.687%0.86878%0.779SS**  50.481.587.600000114.5
62K23.8Very low28.8Very low185 Ų185146.7 Ų146.780%0.80476%0.764SS**  -171.3133.5129.7-134.1174.4172.5-1800111.4
63E25.4Very low30Very low159 Ų159142.2 Ų142.274%0.74375%0.75SS**  trans42.296.4159.3-88.5160.5135.800118.6T65E63-T65 VanDerWaalsContact C-N 3.35Å; E63-T65 PolarHBondContact O-N 3.27Å; E63-T65 VanDerWaalsContact O-N 3.1Å
64K23.1Very low31.2Very low203 Ų203140.8 Ų140.888%0.88373%0.734SS**  trans-71.492.2155.2-68.1179.1178.5179.60108.2S66K64-S66 PolarHBondContact O-N 3.42Å; K64-S66 VanDerWaalsContact O-N 3.08Å
65T21.4Very low32.5Very low119 Ų119141.6 Ų141.673%0.7372%0.721SS**  trans-63.797140.1410000105.1E63 D67E63-T65 VanDerWaalsContact C-N 3.35Å; E63-T65 PolarHBondContact O-N 3.27Å; E63-T65 VanDerWaalsContact O-N 3.1Å; T65-D67 VanDerWaalsContact C-N 3.3Å; T65-D67 PolarHBondContact O-N 3.01Å
66S28.2Very low34Very low95 Ų95137.2 Ų137.266%0.66471%0.708SS**  trans-64.699.6170.446.40000106.9K64 E68K64-S66 PolarHBondContact O-N 3.42Å; K64-S66 VanDerWaalsContact O-N 3.08Å; S66-E68 VanDerWaalsContact C-N 3.26Å; S66-E68 PolarHBondContact O-N 3.18Å
67D29.1Very low35.5Very low147 Ų147133.7 Ų133.779%0.78670%0.696SS**  trans-52.797.5158.9-68.4-52.2000107.2T65 K69T65-D67 VanDerWaalsContact C-N 3.3Å; T65-D67 PolarHBondContact O-N 3.01Å; D67-K69 PolarHBondContact O-N 2.96Å
68E35.9Very low37.2Very low176 Ų176135 Ų13582%0.82270%0.697SS**  trans-61.9102.4167.1-75.9-178.3167.500106.6S66S66-E68 VanDerWaalsContact C-N 3.26Å; S66-E68 PolarHBondContact O-N 3.18Å
69K34.7Very low39.3Very low167 Ų167130 Ų13073%0.72669%0.686SS**  trans-58.7139.7175.3-72.3174.8176.5175.50108.8D67 V71D67-K69 PolarHBondContact O-N 2.96Å; K69-V71 HydrophobicContact CB-CG2 4.4Å; K69-V71 PolarHBondContact O-N 2.89Å
70P48.7Very low41.4Very low108 Ų108125.3 Ų125.370%0.70166%0.663SS**THydrogen-bonded Turntrans-78.755.8-172.633.9-36.8000112.7
71V46.2Very low44.3Very low79 Ų79128 Ų12848%0.47967%0.666SS.*THydrogen-bonded Turntrans-93.1-24176.7-1770000111.3K69K69-V71 HydrophobicContact CB-CG2 4.4Å; K69-V71 PolarHBondContact O-N 2.89Å
72D52.7Low47.2Very low92 Ų92129.9 Ų129.949%0.49265%0.652SS.*Hα-helixtrans-80.8-29.2-168.2-63.2-6.6000114.4E75 K76D72-E75 PolarHBondContact O-N 3.14Å; D72-K76 WeakPolarHBondContact O-CB 3.31Å; D72-K76 WeakPolarHBondContact O-CG 3.15Å; D72-K76 PolarHBondContact O-N 2.93Å
73D53.9Low50.1Low107 Ų107125.4 Ų125.457%0.57264%0.635SS**Hα-helixtrans-72.2-34.9-178.7-67.9-24.5000112E75 K76 I77D73-E75 VanDerWaalsContact C-N 3.32Å; D73-E75 PolarHBondContact O-N 3.49Å; D73-K76 PolarHBondContact O-N 3.49Å; D73-I77 VanDerWaalsContact O-CD1 3.31Å; D73-I77 WeakPolarHBondContact O-CD1 3.46Å; D73-I77 WeakPolarHBondContact O-CG1 3.37Å; D73-I77 PolarHBondContact O-N 2.89Å
74I53.6Low52.7Low104 Ų104127.4 Ų127.453%0.53364%0.644SS.*Hα-helixtrans-68.9-34.4178.8-59.8174000110.5K78I74-K78 WeakPolarHBondContact O-CG 3.46Å
75E55.6Low55.7Low116 Ų116121 Ų12154%0.54263%0.625SS.*Hα-helixtrans-77.1-39.5176.9-66.4-172.2173.300112.1D72 D73 I77 K78D72-E75 PolarHBondContact O-N 3.14Å; D73-E75 VanDerWaalsContact C-N 3.32Å; D73-E75 PolarHBondContact O-N 3.49Å; E75-I77 PolarHBondContact O-N 3.47Å; E75-K78 WeakPolarHBondContact O-CB 3.22Å; E75-K78 PolarHBondContact O-N 3.34Å
76K52.9Low58.7Low137 Ų137121.6 Ų121.660%0.59662%0.624SS**Hα-helixtrans-60.3-32.3171.5-76.8173.3-176168.70112.8D72 D73 K78 S79D72-K76 WeakPolarHBondContact O-CB 3.31Å; D72-K76 WeakPolarHBondContact O-CG 3.15Å; D72-K76 PolarHBondContact O-N 2.93Å; D73-K76 PolarHBondContact O-N 3.49Å; K76-K78 PolarHBondContact O-N 3.48Å; K76-S79 PolarHBondContact O-OG 2.93Å
77I53.4Low61.6Low97 Ų97118 Ų11850%0.49760%0.598SS.*THydrogen-bonded Turntrans-67.1-24.1173.2-70.6162.5000112.2D73 E75 Y80D73-I77 VanDerWaalsContact O-CD1 3.31Å; D73-I77 WeakPolarHBondContact O-CD1 3.46Å; D73-I77 WeakPolarHBondContact O-CG1 3.37Å; D73-I77 PolarHBondContact O-N 2.89Å; E75-I77 PolarHBondContact O-N 3.47Å; I77-Y80 HydrophobicContact CB-CE2 4.36Å; I77-Y80 HydrophobicContact CG2-CE2 4.22Å; I77-Y80 WeakPolarHBondContact O-CD2 3.42Å; I77-Y80 WeakPolarHBondContact O-CE2 3.1Å
78K57.6Low64.3Low161 Ų161119.7 Ų119.770%0.760%0.601SS**THydrogen-bonded Turntrans-83.8-17.6-178.1-69.2172.8-174.1172.70113.6I74 E75 K76I74-K78 WeakPolarHBondContact O-CG 3.46Å; E75-K78 WeakPolarHBondContact O-CB 3.22Å; E75-K78 PolarHBondContact O-N 3.34Å; K76-K78 PolarHBondContact O-N 3.48Å
79S65.1Low66.9Low87 Ų87116.9 Ų116.961%0.60859%0.592SS**  trans-109.435.1-172.468.90000113.6K76 T81K76-S79 PolarHBondContact O-OG 2.93Å; S79-T81 PolarHBondContact O-N 2.83Å
80Y64.8Low69.5Low118 Ų118116.9 Ų116.946%0.46360%0.6SS.*PPolyproline II helixtrans-67.2121.3167.9-66.9-72.1000109I77I77-Y80 HydrophobicContact CB-CE2 4.36Å; I77-Y80 HydrophobicContact CG2-CE2 4.22Å; I77-Y80 WeakPolarHBondContact O-CD2 3.42Å; I77-Y80 WeakPolarHBondContact O-CE2 3.1Å
81T80.8Confident71.5Confident127 Ų127118 Ų11878%0.77960%0.604SS**PPolyproline II helixtrans-65.9131.6163.1-46.70000107.8S79S79-T81 PolarHBondContact O-N 2.83Å
82Y83.9Confident73.6Confident143 Ų143117.9 Ų117.956%0.56160%0.596SS**PPolyproline II helixtrans-61.1144.4173.6-70.1-62.3000110.3E84 Y97 P98Y82-E84 PolarHBondContact O-N 2.97Å; Y82-Y97 VanDerWaalsContact CD1-C 3.41Å; Y82-Y97 WeakPolarHBondContact CE1-O 3.27Å; Y82-P98 HydrophobicContact CG-CB 4.38Å
83M84.4Confident75.3Confident91 Ų91118.4 Ų118.445%0.44860%0.598SS.*PPolyproline II helixtrans-63.2134166.8-62-62.2177.400108.8L96 Y97M83-L96 HydrophobicContact CG-CB 4.37Å; M83-L96 PolarHBondContact N-O 2.98Å; M83-Y97 HydrophobicContact CB-CD1 4.02Å; M83-Y97 HydrophobicContact CB-CE1 3.79Å; M83-Y97 HydrophobicContact CG-CE1 4.31Å
84E81.7Confident76.9Confident201 Ų201119.5 Ų119.594%0.93960%0.598SS**SBendtrans-77.4-30179.2-65.6-178174.800112.1Y82Y82-E84 PolarHBondContact O-N 2.97Å
85S85.2Confident78.5Confident70 Ų70122.3 Ų122.349%0.4960%0.602SS.*SBendtrans-78.7151.7177.659.80000111.7Y97S85-Y97 WeakPolarHBondContact O-CD1 3.44Å; S85-Y97 VanDerWaalsContact O-CE1 3.27Å; S85-Y97 WeakPolarHBondContact O-CE1 3.46Å
86D84.8Confident80Confident131 Ų131118.6 Ų118.670%0.70159%0.585SS**PPolyproline II helixtrans-63.1152.2164.3-77.8-42.8000110.3E88D86-E88 PolarHBondContact O-N 3.31Å
87P88.5Confident81.7Confident19 Ų19114.2 Ų114.212%0.12357%0.565CS.*PPolyproline II helixtrans-64.4128.3176.526.6-33.6000110.2Y92 Y97P87-Y92 HydrophobicContact CB-CD1 3.48Å; P87-Y92 VanDerWaalsContact CB-CD1 3.48Å; P87-Y92 HydrophobicContact CB-CD2 4.02Å; P87-Y92 HydrophobicContact CB-CE1 4.04Å; P87-Y92 HydrophobicContact CB-CG 3.46Å; P87-Y92 VanDerWaalsContact CB-CG 3.46Å; P87-Y92 HydrophobicContact CG-CD1 3.58Å; P87-Y92 HydrophobicContact CG-CD2 4.14Å; P87-Y92 HydrophobicContact CG-CE1 3.58Å; P87-Y92 HydrophobicContact CG-CE2 4.12Å; P87-Y92 HydrophobicContact CG-CG 3.87Å; P87-Y97 HydrophobicContact CB-CD1 4.35Å; P87-Y97 HydrophobicContact CB-CE1 3.85Å; P87-Y97 HydrophobicContact CB-CE2 4.08Å; P87-Y97 HydrophobicContact CG-CD1 4.49Å; P87-Y97 HydrophobicContact CG-CE1 4.41Å
88E86.9Confident83.4Confident182 Ų182113 Ų11385%0.8556%0.564SS**SBendtrans-68.6-37178.6-62.9178.8179.800111.7D86D86-E88 PolarHBondContact O-N 3.31Å
89D89.8Confident84.8Confident118 Ų118111.5 Ų111.563%0.63155%0.554SS**SBendtrans-98.5153.4-179.1-65.8-41000112.5V91 Y92D89-V91 PolarHBondContact O-N 3.47Å; D89-Y92 WeakPolarHBondContact O-CD1 3.46Å
90D88.1Confident86.1Confident166 Ų166112.5 Ų112.589%0.88854%0.544SS*.SBendtrans-62.1-29.6171.2-70.4-33.4000112.6
91V91.1Very high87.5Confident131 Ų131111.4 Ų111.479%0.79455%0.545SS*.SBendtrans-108.5105.2-179.1-177.30000109.2D89D89-V91 PolarHBondContact O-N 3.47Å
92Y89.9Confident88.2Confident78 Ų78107.8 Ų107.831%0.30652%0.518SS..  trans-135157.6-17961.2-88.3000111.9P87 D89 K94 Y97 R100P87-Y92 HydrophobicContact CB-CD1 3.48Å; P87-Y92 VanDerWaalsContact CB-CD1 3.48Å; P87-Y92 HydrophobicContact CB-CD2 4.02Å; P87-Y92 HydrophobicContact CB-CE1 4.04Å; P87-Y92 HydrophobicContact CB-CG 3.46Å; P87-Y92 VanDerWaalsContact CB-CG 3.46Å; P87-Y92 HydrophobicContact CG-CD1 3.58Å; P87-Y92 HydrophobicContact CG-CD2 4.14Å; P87-Y92 HydrophobicContact CG-CE1 3.58Å; P87-Y92 HydrophobicContact CG-CE2 4.12Å; P87-Y92 HydrophobicContact CG-CG 3.87Å; D89-Y92 WeakPolarHBondContact O-CD1 3.46Å; Y92-K94 PolarHBondContact O-N 3.42Å; Y92-K94 VanDerWaalsContact O-N 3.14Å; Y92-Y97 AromaticContact CD2-CD2 3.48Å; Y92-Y97 HydrophobicContact CD2-CD2 3.48Å; Y92-Y97 VanDerWaalsContact CD2-CD2 3.48Å; Y92-Y97 AromaticContact CD2-CE2 3.86Å; Y92-Y97 HydrophobicContact CD2-CE2 3.86Å; Y92-Y97 HydrophobicContact CD2-CG 4.17Å; Y92-Y97 HydrophobicContact CE2-CD2 4.16Å; Y92-Y97 HydrophobicContact CE2-CG 4.45Å; Y92-Y97 HydrophobicContact CG-CD2 4.27Å; Y92-Y97 HydrophobicContact CG-CE2 4.19Å; Y92-R100 VanDerWaalsContact OH-CZ 3.25Å; Y92-R100 PolarHBondContact OH-NE 3.26Å; Y92-R100 PolarHBondContact OH-NH2 3.11Å
93L89.6Confident88.7Confident103 Ų103104.4 Ų104.454%0.53951%0.507SS..  trans-75.6104177-64.2176.1000110R95 L96L93-R95 HydrophobicContact CB-CG 4.49Å; L93-R95 PolarHBondContact O-N 2.8Å; L93-L96 HydrophobicContact CB-CD1 3.97Å; L93-L96 HydrophobicContact CB-CG 4.04Å; L93-L96 HydrophobicContact CD1-CD1 3.95Å; L93-L96 PolarHBondContact O-N 2.87Å
94K87.3Confident89.2Confident130 Ų130101 Ų10157%0.56549%0.491SS*.G310 helixtrans-47.6-29.8-179.7-173.4173.7-176.2170.80115Y92 L96 E306Y92-K94 PolarHBondContact O-N 3.42Å; Y92-K94 VanDerWaalsContact O-N 3.14Å; K94-L96 VanDerWaalsContact C-N 3.32Å; K94-L96 PolarHBondContact O-N 2.62Å; K94-E306 IonicContact NZ-OE1 3.83Å; K94-E306 IonicContact NZ-OE2 2.76Å; K94-E306 PolarHBondContact NZ-OE2 3.34Å
95R86.3Confident89.9Confident162 Ų16298.6 Ų98.661%0.61148%0.48SS*.G310 helixtrans-71.3-20.4179.469.8179.6180-1790.2114.8L93L93-R95 HydrophobicContact CB-CG 4.49Å; L93-R95 PolarHBondContact O-N 2.8Å
96L87.8Confident90.4Very high38 Ų38100.7 Ų100.720%0.19948%0.48CS..G310 helixtrans-88.4-12.7-176.8-62.2-178.4000112.8M83 L93 K94M83-L96 HydrophobicContact CG-CB 4.37Å; M83-L96 PolarHBondContact N-O 2.98Å; L93-L96 HydrophobicContact CB-CD1 3.97Å; L93-L96 HydrophobicContact CB-CG 4.04Å; L93-L96 HydrophobicContact CD1-CD1 3.95Å; L93-L96 PolarHBondContact O-N 2.87Å; K94-L96 VanDerWaalsContact C-N 3.32Å; K94-L96 PolarHBondContact O-N 2.62Å
97Y89Confident91Very high46 Ų4694.4 Ų94.418%0.1845%0.447CS..SBendtrans-118.9148.5-174.4-65.2-88.3000110.5Y82 M83 S85 P87 Y92Y82-Y97 VanDerWaalsContact CD1-C 3.41Å; Y82-Y97 WeakPolarHBondContact CE1-O 3.27Å; M83-Y97 HydrophobicContact CB-CD1 4.02Å; M83-Y97 HydrophobicContact CB-CE1 3.79Å; M83-Y97 HydrophobicContact CG-CE1 4.31Å; S85-Y97 WeakPolarHBondContact O-CD1 3.44Å; S85-Y97 VanDerWaalsContact O-CE1 3.27Å; S85-Y97 WeakPolarHBondContact O-CE1 3.46Å; P87-Y97 HydrophobicContact CB-CD1 4.35Å; P87-Y97 HydrophobicContact CB-CE1 3.85Å; P87-Y97 HydrophobicContact CB-CE2 4.08Å; P87-Y97 HydrophobicContact CG-CD1 4.49Å; P87-Y97 HydrophobicContact CG-CE1 4.41Å; Y92-Y97 AromaticContact CD2-CD2 3.48Å; Y92-Y97 HydrophobicContact CD2-CD2 3.48Å; Y92-Y97 VanDerWaalsContact CD2-CD2 3.48Å; Y92-Y97 AromaticContact CD2-CE2 3.86Å; Y92-Y97 HydrophobicContact CD2-CE2 3.86Å; Y92-Y97 HydrophobicContact CD2-CG 4.17Å; Y92-Y97 HydrophobicContact CE2-CD2 4.16Å; Y92-Y97 HydrophobicContact CE2-CG 4.45Å; Y92-Y97 HydrophobicContact CG-CD2 4.27Å; Y92-Y97 HydrophobicContact CG-CE2 4.19Å
98P88.4Confident91.3Very high71 Ų7193.6 Ų93.646%0.46144%0.441SS..PPolyproline II helixtrans-64.6155.9174.829.5-33.7000110.4Y82 R100Y82-P98 HydrophobicContact CG-CB 4.38Å; P98-R100 PolarHBondContact O-N 2.68Å
99R88.6Confident91.8Very high129 Ų12989.6 Ų89.649%0.48742%0.423SS..PPolyproline II helixtrans-67124176.9-164.9173.2-171.2176.1-0.1109.4G307R99-G307 PolarHBondContact NH2-O 3.38Å
100R91.2Very high92.1Very high108 Ų10886 Ų8641%0.40840%0.403SS..PPolyproline II helixtrans-61.4139.2178.6-68.2-176.9174.8177.2-1.7111.4Y92 P98 Y102Y92-R100 VanDerWaalsContact OH-CZ 3.25Å; Y92-R100 PolarHBondContact OH-NE 3.26Å; Y92-R100 PolarHBondContact OH-NH2 3.11Å; P98-R100 PolarHBondContact O-N 2.68Å; R100-Y102 HydrophobicContact CB-CE1 4.41Å; R100-Y102 HydrophobicContact CB-CE2 3.72Å
101I93.7Very high92.5Very high96 Ų9678.1 Ų78.149%0.49236%0.361SS..EExtended strand (participates in β ladder)trans-106.5122.6176.6-47.2178.3000108.2L309 K311I101-L309 HydrophobicContact CG1-CD2 3.92Å; I101-L309 HydrophobicContact CG1-CG 4.32Å; I101-L309 HydrophobicContact CG2-CG 4.35Å; I101-K311 HydrophobicContact CB-CG 4.33Å; I101-K311 HydrophobicContact CG2-CB 4.14Å; I101-K311 HydrophobicContact CG2-CG 3.42Å; I101-K311 VanDerWaalsContact CG2-CG 3.42Å
102Y95.3Very high92.7Very high51 Ų5174.4 Ų74.420%0.233%0.334CS..EExtended strand (participates in β ladder)trans-106147.4-173.7-62.6-83.1000111.9R100 L110 L308 L309 L310 K311R100-Y102 HydrophobicContact CB-CE1 4.41Å; R100-Y102 HydrophobicContact CB-CE2 3.72Å; Y102-L110 HydrophobicContact CD1-CD1 3.64Å; Y102-L110 HydrophobicContact CE1-CD1 3.36Å; Y102-L110 HydrophobicContact CG-CD1 4.36Å; Y102-L308 HydrophobicContact CD2-CB 4.11Å; Y102-L308 HydrophobicContact CD2-CD2 4.18Å; Y102-L308 HydrophobicContact CE2-CD2 3.83Å; Y102-L309 PolarHBondContact N-O 3.34Å; Y102-L310 CarbonylContact O-C 3.58Å; Y102-L310 WeakPolarHBondContact O-CA 3.2Å; Y102-K311 PolarHBondContact O-N 3.08Å
103E95.7Very high93Very high71 Ų7175.7 Ų75.733%0.33234%0.341SS..  trans-68.7154.2161-77.6146.9-151.800110.2E105 K106 A107 K311E103-E105 PolarHBondContact O-N 3.41Å; E103-K106 HydrophobicContact CB-CB 4.45Å; E103-K106 HydrophobicContact CB-CD 4.34Å; E103-K106 HydrophobicContact CB-CG 4.45Å; E103-K106 PolarHBondContact O-N 3.36Å; E103-K106 IonicContact OE1-NZ 2.81Å; E103-K106 WeakPolarHBondContact OE2-CE 3.21Å; E103-K106 IonicContact OE2-NZ 3.78Å; E103-K106 PolarHBondContact OE2-NZ 3.03Å; E103-A107 WeakPolarHBondContact O-CB 3.39Å; E103-A107 PolarHBondContact O-N 2.96Å; E103-K311 HydrophobicContact CG-CD 4Å; E103-K311 IonicContact OE1-NZ 2.73Å; E103-K311 PolarHBondContact OE1-NZ 3.42Å
104V95.2Very high93.3Very high19 Ų1972.9 Ų72.912%0.11533%0.325CS..Hα-helixtrans-56.7-49.7-175.3179.10000111.6K106 A107 I108 A273 L276 L315V104-K106 PolarHBondContact O-N 2.97Å; V104-A107 PolarHBondContact O-N 3.05Å; V104-I108 HydrophobicContact CG1-CD1 3.8Å; V104-I108 VanDerWaalsContact O-CG1 3.3Å; V104-I108 WeakPolarHBondContact O-CG1 3.28Å; V104-I108 PolarHBondContact O-N 2.83Å; V104-A273 HydrophobicContact CG1-CB 4.13Å; V104-L276 HydrophobicContact CG1-CD1 4.23Å; V104-L315 HydrophobicContact CG2-CD1 3.86Å; V104-L315 HydrophobicContact CG2-CD2 3.76Å; V104-L315 HydrophobicContact CG2-CG 4.02Å
105E95.2Very high93.6Very high152 Ų15268.3 Ų68.371%0.7131%0.305SS*.Hα-helixtrans-61.1-45.8-179.7-63.8175.2-172.800111.9E103 A107 I108 H109E103-E105 PolarHBondContact O-N 3.41Å; E105-A107 VanDerWaalsContact C-N 3.35Å; E105-A107 PolarHBondContact O-N 3.28Å; E105-I108 PolarHBondContact O-N 3.32Å; E105-H109 WeakPolarHBondContact O-CB 3.26Å; E105-H109 PolarHBondContact O-N 2.92Å
106K95.9Very high94Very high113 Ų11365 Ų6549%0.49130%0.303SS..Hα-helixtrans-62.5-42176.9-70.3177.5179.3148.50111.2E103 V104 H109 L110E103-K106 HydrophobicContact CB-CB 4.45Å; E103-K106 HydrophobicContact CB-CD 4.34Å; E103-K106 HydrophobicContact CB-CG 4.45Å; E103-K106 PolarHBondContact O-N 3.36Å; E103-K106 IonicContact OE1-NZ 2.81Å; E103-K106 WeakPolarHBondContact OE2-CE 3.21Å; E103-K106 IonicContact OE2-NZ 3.78Å; E103-K106 PolarHBondContact OE2-NZ 3.03Å; V104-K106 PolarHBondContact O-N 2.97Å; K106-H109 PolarHBondContact O-N 3.11Å; K106-L110 WeakPolarHBondContact O-CB 3.35Å; K106-L110 VanDerWaalsContact O-CG 3.32Å; K106-L110 WeakPolarHBondContact O-CG 3.16Å; K106-L110 PolarHBondContact O-N 2.8Å
107A96.8Very high94.4Very high0 Ų069 Ų690%032%0.324CS..Hα-helixtrans-63.3-46.6177.700000111.5E103 V104 E105 H109 L110 L111 L300 L308 L310E103-A107 WeakPolarHBondContact O-CB 3.39Å; E103-A107 PolarHBondContact O-N 2.96Å; V104-A107 PolarHBondContact O-N 3.05Å; E105-A107 VanDerWaalsContact C-N 3.35Å; E105-A107 PolarHBondContact O-N 3.28Å; A107-H109 VanDerWaalsContact C-N 3.33Å; A107-H109 PolarHBondContact O-N 2.97Å; A107-L110 PolarHBondContact O-N 2.79Å; A107-L111 WeakPolarHBondContact O-CG 3.21Å; A107-L111 PolarHBondContact O-N 2.89Å; A107-L300 HydrophobicContact CB-CD2 4.17Å; A107-L308 HydrophobicContact CB-CB 4.4Å; A107-L308 HydrophobicContact CB-CD1 4.05Å; A107-L308 WeakPolarHBondContact O-CD1 3.48Å; A107-L310 HydrophobicContact CB-CD2 3.42Å; A107-L310 VanDerWaalsContact CB-CD2 3.42Å
108I96.6Very high94.6Very high2 Ų271 Ų711%0.0134%0.338CS..Hα-helixtrans-60.3-44.7177.5-66.5163.8000110.7V104 E105 L110 L111 K112 I272 A273 L300V104-I108 HydrophobicContact CG1-CD1 3.8Å; V104-I108 VanDerWaalsContact O-CG1 3.3Å; V104-I108 WeakPolarHBondContact O-CG1 3.28Å; V104-I108 PolarHBondContact O-N 2.83Å; E105-I108 PolarHBondContact O-N 3.32Å; I108-L110 PolarHBondContact O-N 2.86Å; I108-L111 PolarHBondContact O-N 2.82Å; I108-K112 PolarHBondContact O-N 2.87Å; I108-I272 HydrophobicContact CD1-CB 4.04Å; I108-I272 HydrophobicContact CD1-CG2 3.84Å; I108-I272 HydrophobicContact CG1-CG2 4.01Å; I108-I272 HydrophobicContact CG2-CD1 3.98Å; I108-A273 HydrophobicContact CD1-CB 4.1Å; I108-L300 HydrophobicContact CG1-CD2 3.82Å
109H96.5Very high94.9Very high98 Ų9876.7 Ų76.745%0.45436%0.356SS..Hα-helixtrans-62.5-40.7177.1176.2-114.4000112.6E105 K106 A107 K112 K113E105-H109 WeakPolarHBondContact O-CB 3.26Å; E105-H109 PolarHBondContact O-N 2.92Å; K106-H109 PolarHBondContact O-N 3.11Å; A107-H109 VanDerWaalsContact C-N 3.33Å; A107-H109 PolarHBondContact O-N 2.97Å; H109-K112 PolarHBondContact O-N 2.86Å; H109-K113 WeakPolarHBondContact CE1-CE 3.5Å; H109-K113 PolarHBondContact CE1-NZ 2.73Å; H109-K113 WeakPolarHBondContact NE2-CE 3.32Å; H109-K113 WeakPolarHBondContact O-CG 3.48Å; H109-K113 PolarHBondContact O-N 3.18Å
110L96.3Very high95.2Very high41 Ų4172 Ų7222%0.21534%0.341CS..Hα-helixtrans-64.1-41.9174.5-74.4173.9000112.3Y102 K106 A107 I108 K112 K113 F114 L308Y102-L110 HydrophobicContact CD1-CD1 3.64Å; Y102-L110 HydrophobicContact CE1-CD1 3.36Å; Y102-L110 HydrophobicContact CG-CD1 4.36Å; K106-L110 WeakPolarHBondContact O-CB 3.35Å; K106-L110 VanDerWaalsContact O-CG 3.32Å; K106-L110 WeakPolarHBondContact O-CG 3.16Å; K106-L110 PolarHBondContact O-N 2.8Å; A107-L110 PolarHBondContact O-N 2.79Å; I108-L110 PolarHBondContact O-N 2.86Å; L110-K112 VanDerWaalsContact C-N 3.31Å; L110-K112 PolarHBondContact O-N 3.19Å; L110-K113 CarbonylContact O-C 3.54Å; L110-K113 WeakPolarHBondContact O-CB 3.15Å; L110-K113 PolarHBondContact O-N 2.9Å; L110-K113 VanDerWaalsContact O-N 3.12Å; L110-F114 HydrophobicContact CB-CE2 4.39Å; L110-F114 HydrophobicContact CB-CZ 4.3Å; L110-F114 WeakPolarHBondContact O-CG 3.45Å; L110-F114 PolarHBondContact O-N 2.89Å; L110-L308 HydrophobicContact CB-CD1 3.78Å; L110-L308 HydrophobicContact CD1-CD1 4.26Å
111L96.6Very high95.4Very high1 Ų171.8 Ų71.81%0.00535%0.348CS..Hα-helixtrans-61.5-39.9176.5-67.6177.4000112.3A107 I108 F114 Q115 V126 L265 L300 S305 L308A107-L111 WeakPolarHBondContact O-CG 3.21Å; A107-L111 PolarHBondContact O-N 2.89Å; I108-L111 PolarHBondContact O-N 2.82Å; L111-F114 HydrophobicContact CD2-CD2 4.15Å; L111-F114 PolarHBondContact O-N 3.3Å; L111-Q115 PolarHBondContact O-N 2.9Å; L111-V126 HydrophobicContact CD1-CG1 4.45Å; L111-L265 HydrophobicContact CB-CD2 3.89Å; L111-L300 HydrophobicContact CD1-CB 4.3Å; L111-L300 HydrophobicContact CD1-CD2 3.61Å; L111-L300 HydrophobicContact CD1-CG 3.58Å; L111-S305 WeakPolarHBondContact CD2-OG 3.43Å; L111-L308 HydrophobicContact CD2-CD1 3.94Å; L111-L308 HydrophobicContact CD2-CG 4.26Å; L111-L308 HydrophobicContact CG-CD1 3.96Å
112K95.7Very high95.4Very high54 Ų5470.4 Ų70.424%0.23535%0.345CS..Hα-helixtrans-63.4-41.5173-72.1-178.9173.7179.80111.5I108 H109 L110 Q115 V116 L265 M267 S269I108-K112 PolarHBondContact O-N 2.87Å; H109-K112 PolarHBondContact O-N 2.86Å; L110-K112 VanDerWaalsContact C-N 3.31Å; L110-K112 PolarHBondContact O-N 3.19Å; K112-Q115 WeakPolarHBondContact O-CB 3.29Å; K112-Q115 PolarHBondContact O-N 3.47Å; K112-V116 WeakPolarHBondContact O-CG2 3.39Å; K112-V116 PolarHBondContact O-N 2.78Å; K112-L265 VanDerWaalsContact CE-O 3.23Å; K112-L265 WeakPolarHBondContact CE-O 3.19Å; K112-L265 HydrophobicContact CG-CD2 4.36Å; K112-M267 WeakPolarHBondContact CE-O 3.36Å; K112-M267 PolarHBondContact NZ-O 3.38Å; K112-S269 PolarHBondContact NZ-OG 3.23Å; K112-S269 VanDerWaalsContact NZ-OG 3.1Å
113K95.4Very high95.2Very high104 Ų10474.5 Ų74.545%0.45236%0.364SS..Hα-helixtrans-63.3-44.8174.4-76.3-179.4165.8-176.80112.6H109 L110 Q115 V116 L117H109-K113 WeakPolarHBondContact CE1-CE 3.5Å; H109-K113 PolarHBondContact CE1-NZ 2.73Å; H109-K113 WeakPolarHBondContact NE2-CE 3.32Å; H109-K113 WeakPolarHBondContact O-CG 3.48Å; H109-K113 PolarHBondContact O-N 3.18Å; L110-K113 CarbonylContact O-C 3.54Å; L110-K113 WeakPolarHBondContact O-CB 3.15Å; L110-K113 PolarHBondContact O-N 2.9Å; L110-K113 VanDerWaalsContact O-N 3.12Å; K113-Q115 VanDerWaalsContact C-N 3.28Å; K113-Q115 PolarHBondContact O-N 3.38Å; K113-V116 PolarHBondContact O-N 3.32Å; K113-V116 VanDerWaalsContact O-N 3.16Å; K113-L117 WeakPolarHBondContact O-CG 3.48Å; K113-L117 PolarHBondContact O-N 3.33Å
114F95.2Very high95.2Very high44 Ų4471.7 Ų71.719%0.19335%0.351CS..Hα-helixtrans-59-42.2176.1-62.6-23.8000111.1L110 L111 V116 L117 D118 E306 L308L110-F114 HydrophobicContact CB-CE2 4.39Å; L110-F114 HydrophobicContact CB-CZ 4.3Å; L110-F114 WeakPolarHBondContact O-CG 3.45Å; L110-F114 PolarHBondContact O-N 2.89Å; L111-F114 HydrophobicContact CD2-CD2 4.15Å; L111-F114 PolarHBondContact O-N 3.3Å; F114-V116 VanDerWaalsContact C-N 3.29Å; F114-V116 PolarHBondContact O-N 2.81Å; F114-L117 PolarHBondContact O-N 3.28Å; F114-D118 VanDerWaalsContact O-CB 3.26Å; F114-D118 WeakPolarHBondContact O-CB 3.43Å; F114-D118 VanDerWaalsContact O-CG 3.26Å; F114-D118 PolarHBondContact O-N 2.98Å; F114-E306 HydrophobicContact CE2-CG 4.26Å; F114-L308 HydrophobicContact CE2-CD1 4.13Å; F114-L308 HydrophobicContact CE2-CD2 3.91Å; F114-L308 HydrophobicContact CE2-CG 4.27Å; F114-L308 HydrophobicContact CZ-CD2 4.31Å
115Q94.8Very high95.2Very high34 Ų3471 Ų7116%0.15935%0.348CS..Hα-helixtrans-56.9-42.7176176.4-83.3-38.800112.6L111 K112 K113 F119 T120 L265L111-Q115 PolarHBondContact O-N 2.9Å; K112-Q115 WeakPolarHBondContact O-CB 3.29Å; K112-Q115 PolarHBondContact O-N 3.47Å; K113-Q115 VanDerWaalsContact C-N 3.28Å; K113-Q115 PolarHBondContact O-N 3.38Å; Q115-F119 PolarHBondContact O-N 2.79Å; Q115-T120 WeakPolarHBondContact CA-OG1 3.4Å; Q115-T120 PolarHBondContact NE2-O 3.23Å; Q115-T120 PolarHBondContact O-N 3.16Å; Q115-T120 VanDerWaalsContact O-N 3.09Å; Q115-T120 PolarHBondContact O-OG1 2.85Å; Q115-L265 HydrophobicContact CB-CD1 3.73Å; Q115-L265 HydrophobicContact CG-CD1 4.08Å
116V95Very high95.2Very high93 Ų9363.9 Ų63.956%0.56432%0.315SS*.Hα-helixtrans-67.8-45177.21760000111.6K112 K113 F114 F119K112-V116 WeakPolarHBondContact O-CG2 3.39Å; K112-V116 PolarHBondContact O-N 2.78Å; K113-V116 PolarHBondContact O-N 3.32Å; K113-V116 VanDerWaalsContact O-N 3.16Å; F114-V116 VanDerWaalsContact C-N 3.29Å; F114-V116 PolarHBondContact O-N 2.81Å; V116-F119 PolarHBondContact O-N 3.28Å
117L95Very high95.3Very high121 Ų12161.6 Ų61.663%0.63430%0.304SS*.Hα-helixtrans-69.1-36.1-178.2-68.1173.3000112.9K113 F114 F119K113-L117 WeakPolarHBondContact O-CG 3.48Å; K113-L117 PolarHBondContact O-N 3.33Å; F114-L117 PolarHBondContact O-N 3.28Å; L117-F119 VanDerWaalsContact C-N 3.28Å; L117-F119 VanDerWaalsContact O-CD2 3.28Å; L117-F119 WeakPolarHBondContact O-CD2 3.49Å; L117-F119 WeakPolarHBondContact O-CE2 3.44Å
118D94.2Very high95.3Very high89 Ų8961.6 Ų61.648%0.47630%0.304SS..THydrogen-bonded Turntrans-85.4-2.4179.8-63.3-22.6000112.4F114 T120F114-D118 VanDerWaalsContact O-CB 3.26Å; F114-D118 WeakPolarHBondContact O-CB 3.43Å; F114-D118 VanDerWaalsContact O-CG 3.26Å; F114-D118 PolarHBondContact O-N 2.98Å; D118-T120 VanDerWaalsContact C-N 3.25Å; D118-T120 HydrophobicContact CB-CG2 3.73Å; D118-T120 PolarHBondContact O-N 2.9Å
119F94.7Very high95.3Very high191 Ų19162.4 Ų62.484%0.83831%0.308SS*.THydrogen-bonded Turntrans52.341.6-176.3-59.4-88.2000113.2Q115 V116 L117Q115-F119 PolarHBondContact O-N 2.79Å; V116-F119 PolarHBondContact O-N 3.28Å; L117-F119 VanDerWaalsContact C-N 3.28Å; L117-F119 VanDerWaalsContact O-CD2 3.28Å; L117-F119 WeakPolarHBondContact O-CD2 3.49Å; L117-F119 WeakPolarHBondContact O-CE2 3.44Å
120T95.1Very high95.2Very high29 Ų2957.7 Ų57.718%0.17829%0.286CS..  trans-94.7165.6-176.755.10000111.7Q115 D118 Q124 T304Q115-T120 WeakPolarHBondContact CA-OG1 3.4Å; Q115-T120 PolarHBondContact NE2-O 3.23Å; Q115-T120 PolarHBondContact O-N 3.16Å; Q115-T120 VanDerWaalsContact O-N 3.09Å; Q115-T120 PolarHBondContact O-OG1 2.85Å; D118-T120 VanDerWaalsContact C-N 3.25Å; D118-T120 HydrophobicContact CB-CG2 3.73Å; D118-T120 PolarHBondContact O-N 2.9Å; T120-Q124 PolarHBondContact OG1-NE2 2.95Å; T120-Q124 VanDerWaalsContact OG1-NE2 3.1Å; T120-T304 HydrophobicContact CG2-CG2 3.76Å; T120-T304 WeakPolarHBondContact CG2-OG1 3.02Å; T120-T304 PolarHBondContact OG1-OG1 3.06Å
121N94.7Very high95Very high105 Ų10557.3 Ų57.356%0.56129%0.285SS*.  trans-59.4124.7-178.4-177.6-3.6000110.9K123 Q124N121-K123 PolarHBondContact O-N 3.09Å; N121-K123 PolarHBondContact OD1-N 3.41Å; N121-Q124 WeakPolarHBondContact O-CB 3.5Å; N121-Q124 VanDerWaalsContact O-CG 3.28Å; N121-Q124 WeakPolarHBondContact O-CG 3.28Å; N121-Q124 PolarHBondContact O-N 3.25Å
122P92.7Very high94.8Very high66 Ų6657.5 Ų57.543%0.42929%0.286SS..THydrogen-bonded Turntrans-62.1-28.8178.424.3-34.9000113.3Q124 L265 D266P122-Q124 PolarHBondContact O-N 3.37Å; P122-L265 WeakPolarHBondContact O-CB 3.02Å; P122-D266 PolarHBondContact O-N 2.79Å
123K92.7Very high94.5Very high138 Ų13858.1 Ų58.160%0.629%0.292SS*.THydrogen-bonded Turntrans-84.120.7178.3-58.9-164171.2-176.40113.9N121 D266N121-K123 PolarHBondContact O-N 3.09Å; N121-K123 PolarHBondContact OD1-N 3.41Å; K123-D266 HydrophobicContact CG-CB 4.41Å; K123-D266 WeakPolarHBondContact CG-OD2 3.39Å
124Q94Very high94Very high12 Ų1253.3 Ų53.36%0.05627%0.271CS..PPolyproline II helixtrans-68.4152.1-179.664.4173.5-45.300112.1T120 N121 P122 T264 L265 S302 S303 T304T120-Q124 PolarHBondContact OG1-NE2 2.95Å; T120-Q124 VanDerWaalsContact OG1-NE2 3.1Å; N121-Q124 WeakPolarHBondContact O-CB 3.5Å; N121-Q124 VanDerWaalsContact O-CG 3.28Å; N121-Q124 WeakPolarHBondContact O-CG 3.28Å; N121-Q124 PolarHBondContact O-N 3.25Å; P122-Q124 PolarHBondContact O-N 3.37Å; Q124-T264 CarbonylContact O-C 3.59Å; Q124-T264 VanDerWaalsContact O-CA 3.28Å; Q124-T264 WeakPolarHBondContact O-CA 3.44Å; Q124-L265 VanDerWaalsContact CD-CD1 3.49Å; Q124-L265 HydrophobicContact CG-CB 4.1Å; Q124-L265 HydrophobicContact CG-CD1 3.37Å; Q124-L265 HydrophobicContact CG-CG 3.82Å; Q124-L265 PolarHBondContact O-N 3.35Å; Q124-S302 VanDerWaalsContact OE1-CB 3.25Å; Q124-S302 PolarHBondContact OE1-OG 3.24Å; Q124-S303 VanDerWaalsContact OE1-N 3.07Å; Q124-T304 PolarHBondContact NE2-OG1 2.89Å; Q124-T304 VanDerWaalsContact OE1-N 3.15Å; Q124-T304 PolarHBondContact OE1-OG1 3.31Å
125G95.4Very high93.5Very high5 Ų553.1 Ų53.15%0.05228%0.278CS..EExtended strand (participates in β ladder)trans-71.5140.5178.200000112.4S302 S303G125-S302 CarbonylContact O-C 3.58Å; G125-S302 WeakPolarHBondContact O-CA 3.15Å; G125-S303 PolarHBondContact N-OG 3.41Å; G125-S303 VanDerWaalsContact N-OG 3.09Å; G125-S303 PolarHBondContact O-N 3.28Å; G125-S303 PolarHBondContact O-OG 3.44Å; G125-S303 VanDerWaalsContact O-OG 3.04Å
126V96.8Very high92.7Very high1 Ų154.3 Ų54.31%0.00629%0.285CS..EExtended strand (participates in β ladder)trans-98.5126.2167.9-176.40000107.9L111 K261 I262 A263 L265 I272 L300 R301L111-V126 HydrophobicContact CD1-CG1 4.45Å; V126-K261 CarbonylContact O-C 3.52Å; V126-K261 WeakPolarHBondContact O-CA 3.28Å; V126-I262 HydrophobicContact CB-CG1 4.27Å; V126-I262 HydrophobicContact CG1-CD1 4.15Å; V126-I262 HydrophobicContact CG1-CG1 4.01Å; V126-I262 PolarHBondContact O-N 3.02Å; V126-A263 HydrophobicContact CB-CB 4.25Å; V126-A263 HydrophobicContact CG2-CB 4.47Å; V126-A263 PolarHBondContact N-O 3.02Å; V126-L265 HydrophobicContact CG2-CB 4.38Å; V126-L265 HydrophobicContact CG2-CD2 3.39Å; V126-L265 HydrophobicContact CG2-CG 3.65Å; V126-I272 HydrophobicContact CG1-CG2 4.48Å; V126-L300 HydrophobicContact CG1-CD1 3.71Å; V126-L300 HydrophobicContact CG1-CG 4.13Å; V126-R301 CarbonylContact C-O 3.53Å; V126-R301 WeakPolarHBondContact CA-O 3.41Å
127Y97.2Very high91.7Very high66 Ų6652.1 Ų52.126%0.25928%0.282SS..EExtended strand (participates in β ladder)trans-113.5137.5-178.7-61.3-94.6000110.4T260 K261 R301 S303Y127-T260 CarbonylContact C-O 3.53Å; Y127-T260 VanDerWaalsContact CA-O 3.26Å; Y127-T260 WeakPolarHBondContact CA-O 3.35Å; Y127-K261 HydrophobicContact CD1-CB 3.89Å; Y127-K261 HydrophobicContact CE1-CB 3.72Å; Y127-K261 HydrophobicContact CE1-CG 4.24Å; Y127-R301 VanDerWaalsContact CB-CZ 3.48Å; Y127-R301 PolarHBondContact N-O 3.43Å; Y127-R301 PolarHBondContact O-N 3.35Å; Y127-S303 WeakPolarHBondContact CE2-OG 3.38Å
128L97Very high90.7Very high0 Ų057 Ų570%030%0.297CS..EExtended strand (participates in β ladder)trans-103.2121.4169.4-177.168.1000108.2L130 S259 T260 I262 L276 V279 I280 L300 L310L128-L130 HydrophobicContact CD1-CD2 3.84Å; L128-L130 HydrophobicContact CD2-CD1 4.06Å; L128-L130 HydrophobicContact CD2-CD2 4.04Å; L128-L130 HydrophobicContact CD2-CG 4.07Å; L128-L130 HydrophobicContact CG-CD1 4.49Å; L128-L130 HydrophobicContact CG-CD2 3.79Å; L128-L130 HydrophobicContact CG-CG 3.94Å; L128-S259 WeakPolarHBondContact O-CA 3.48Å; L128-T260 PolarHBondContact N-O 3.39Å; L128-T260 PolarHBondContact O-N 3.17Å; L128-I262 HydrophobicContact CB-CD1 4.36Å; L128-I262 HydrophobicContact CB-CG2 3.63Å; L128-I262 HydrophobicContact CD2-CG2 4.33Å; L128-L276 HydrophobicContact CD1-CD1 4.15Å; L128-L276 HydrophobicContact CD1-CG 4.24Å; L128-L276 HydrophobicContact CD2-CG 4.34Å; L128-V279 HydrophobicContact CD2-CB 4.27Å; L128-V279 HydrophobicContact CD2-CG1 3.84Å; L128-I280 HydrophobicContact CD2-CG1 4.17Å; L128-L300 HydrophobicContact CD1-CD1 4.4Å; L128-L310 HydrophobicContact CD1-CD1 4.4Å
129D95.7Very high89.9Confident18 Ų1862.4 Ų62.410%0.09632%0.317CS..EExtended strand (participates in β ladder)trans-114.3108.6-179.9-73.1-12.2000108.2F257 L258 S259 F299 R301D129-F257 HydrophobicContact CB-CE2 3.78Å; D129-F257 HydrophobicContact CB-CZ 3.54Å; D129-L258 CarbonylContact C-O 3.54Å; D129-L258 WeakPolarHBondContact CA-O 3.14Å; D129-S259 VanDerWaalsContact OD1-CB 3.3Å; D129-S259 WeakPolarHBondContact OD1-CB 3.37Å; D129-S259 PolarHBondContact OD1-OG 3.09Å; D129-F299 HydrophobicContact CB-CB 4.01Å; D129-F299 PolarHBondContact N-O 3Å; D129-F299 PolarHBondContact O-N 3.08Å; D129-R301 IonicContact OD1-CZ 3.59Å; D129-R301 IonicContact OD1-NE 3.89Å; D129-R301 IonicContact OD1-NH2 3.7Å; D129-R301 PolarHBondContact OD1-NH2 2.91Å; D129-R301 WeakPolarHBondContact OD2-CD 3.5Å; D129-R301 IonicContact OD2-CZ 3.14Å; D129-R301 IonicContact OD2-NE 2.62Å; D129-R301 PolarHBondContact OD2-NE 3Å; D129-R301 IonicContact OD2-NH2 2.83Å
130L95.1Very high89.3Confident0 Ų060.4 Ų60.40%031%0.308CS..EExtended strand (participates in β ladder)trans-107.7138.6-178.6-56.5-177.7000110.8L128 L132 F257 L258 I280 V283 V295 R297 A298L128-L130 HydrophobicContact CD1-CD2 3.84Å; L128-L130 HydrophobicContact CD2-CD1 4.06Å; L128-L130 HydrophobicContact CD2-CD2 4.04Å; L128-L130 HydrophobicContact CD2-CG 4.07Å; L128-L130 HydrophobicContact CG-CD1 4.49Å; L128-L130 HydrophobicContact CG-CD2 3.79Å; L128-L130 HydrophobicContact CG-CG 3.94Å; L130-L132 HydrophobicContact CB-CD2 4.07Å; L130-F257 WeakPolarHBondContact O-CA 3.43Å; L130-F257 WeakPolarHBondContact O-CD2 3.42Å; L130-L258 HydrophobicContact CB-CB 4.28Å; L130-L258 HydrophobicContact CB-CD2 4.38Å; L130-L258 HydrophobicContact CD1-CD2 4.18Å; L130-L258 HydrophobicContact CG-CD2 4.26Å; L130-L258 PolarHBondContact N-O 2.93Å; L130-L258 PolarHBondContact O-N 2.95Å; L130-I280 HydrophobicContact CD1-CG1 4.4Å; L130-V283 HydrophobicContact CD1-CG1 4.41Å; L130-V283 HydrophobicContact CD1-CG2 4.37Å; L130-V295 HydrophobicContact CD2-CG1 4.05Å; L130-R297 WeakPolarHBondContact CA-O 3.5Å; L130-A298 HydrophobicContact CD2-CB 3.47Å; L130-A298 VanDerWaalsContact CD2-CB 3.47Å
131T92.8Very high88.7Confident33 Ų3363.9 Ų63.920%0.20233%0.329CS..EExtended strand (participates in β ladder)trans-106.8120.7165.9-51.60000108.2V296 R297T131-V296 PolarHBondContact O-N 2.61Å; T131-R297 PolarHBondContact N-O 3.18Å; T131-R297 PolarHBondContact O-N 3.4Å
132L91.7Very high88.2Confident5 Ų559.8 Ų59.83%0.02631%0.308CS..EExtended strand (participates in β ladder)trans-106.5141.1-172.8-54.8178.2000111.5L130 M134 F145 V250 N256 L258 V283 F294 V295L130-L132 HydrophobicContact CB-CD2 4.07Å; L132-M134 HydrophobicContact CB-SD 4.1Å; L132-M134 HydrophobicContact CD1-SD 4.5Å; L132-M134 PolarHBondContact O-N 3.1Å; L132-F145 HydrophobicContact CD1-CZ 4.35Å; L132-V250 HydrophobicContact CD1-CG1 4.31Å; L132-V250 HydrophobicContact CD1-CG2 3.64Å; L132-N256 PolarHBondContact N-O 3.3Å; L132-N256 WeakPolarHBondContact O-CB 3.19Å; L132-L258 HydrophobicContact CD1-CB 4.4Å; L132-L258 HydrophobicContact CD1-CD1 4.11Å; L132-V283 HydrophobicContact CD1-CG1 3.96Å; L132-V283 HydrophobicContact CD2-CG1 3.68Å; L132-F294 WeakPolarHBondContact CA-O 3.26Å; L132-F294 HydrophobicContact CB-CE2 3.94Å; L132-F294 HydrophobicContact CB-CZ 4.02Å; L132-F294 HydrophobicContact CD1-CE1 4.09Å; L132-F294 HydrophobicContact CD1-CZ 3.76Å; L132-F294 HydrophobicContact CD2-CD1 4.44Å; L132-F294 HydrophobicContact CD2-CE1 4.19Å; L132-F294 HydrophobicContact CD2-CZ 4.31Å; L132-F294 HydrophobicContact CG-CZ 4.24Å; L132-V295 HydrophobicContact CD2-CB 4.49Å; L132-V295 HydrophobicContact CD2-CG2 3.94Å
133D88.4Confident87.9Confident66 Ų6664.4 Ų64.435%0.35332%0.324SS..  trans-89.7100.4168-173.19.8000109.8A135 F294 V296D133-A135 PolarHBondContact O-N 3.01Å; D133-A135 WeakPolarHBondContact OD1-CB 2.93Å; D133-A135 PolarHBondContact OD1-N 3.24Å; D133-F294 PolarHBondContact N-O 3.16Å; D133-F294 VanDerWaalsContact O-CD2 3.26Å; D133-F294 WeakPolarHBondContact O-CD2 3.31Å; D133-F294 WeakPolarHBondContact O-CE2 3.45Å; D133-V296 HydrophobicContact CB-CG2 3.63Å
134M86.4Confident87.6Confident3 Ų360.4 Ų60.42%0.01531%0.312CS..  trans-79.21178.7-56.2-62.4-98.100112.3L132 L136 T141 V142 E143 F145 V250 N256 F294L132-M134 HydrophobicContact CB-SD 4.1Å; L132-M134 HydrophobicContact CD1-SD 4.5Å; L132-M134 PolarHBondContact O-N 3.1Å; M134-L136 PolarHBondContact O-N 3.4Å; M134-T141 HydrophobicContact CB-CG2 3.81Å; M134-T141 CarbonylContact O-C 3.56Å; M134-T141 WeakPolarHBondContact O-CA 3.46Å; M134-T141 VanDerWaalsContact O-CG2 3.28Å; M134-T141 WeakPolarHBondContact O-CG2 3.39Å; M134-V142 HydrophobicContact CB-CB 4.32Å; M134-V142 HydrophobicContact CE-CB 4.27Å; M134-V142 HydrophobicContact CE-CG1 4.04Å; M134-V142 PolarHBondContact O-N 3.36Å; M134-V142 HydrophobicContact SD-CB 4.26Å; M134-V142 HydrophobicContact SD-CG1 4.34Å; M134-E143 WeakPolarHBondContact CE-O 3.4Å; M134-F145 HydrophobicContact CE-CD1 4.26Å; M134-F145 HydrophobicContact CE-CE1 4.2Å; M134-V250 HydrophobicContact CE-CG1 4.1Å; M134-N256 HydrophobicContact CG-CB 3.64Å; M134-N256 WeakPolarHBondContact CG-ND2 3.48Å; M134-F294 HydrophobicContact SD-CE2 3.65Å; M134-F294 HydrophobicContact SD-CZ 3.78Å
135A83.7Confident87.3Confident41 Ų4160.9 Ų60.934%0.33931%0.314SS..BIsolated β-bridgetrans-70.7121.7176.400000111.1D133 R287D133-A135 PolarHBondContact O-N 3.01Å; D133-A135 WeakPolarHBondContact OD1-CB 2.93Å; D133-A135 PolarHBondContact OD1-N 3.24Å; A135-R287 PolarHBondContact O-NE 3.42Å; A135-R287 PolarHBondContact O-NH2 2.95Å
136L77.6Confident87Confident59 Ų5961.4 Ų61.431%0.30932%0.317SS..SBendtrans-97.8-9.6168.7-160.378.4000111M134 K140 V142 R287 L291M134-L136 PolarHBondContact O-N 3.4Å; L136-K140 WeakPolarHBondContact CA-O 3.48Å; L136-K140 HydrophobicContact CB-CB 4.14Å; L136-K140 VanDerWaalsContact CB-O 3.31Å; L136-K140 WeakPolarHBondContact CB-O 3.45Å; L136-K140 HydrophobicContact CD2-CB 4.17Å; L136-K140 PolarHBondContact N-O 3.28Å; L136-V142 HydrophobicContact CB-CG2 4.4Å; L136-V142 HydrophobicContact CD1-CG2 4.16Å; L136-R287 HydrophobicContact CD1-CG 4.33Å; L136-L291 HydrophobicContact CB-CD2 4.21Å; L136-L291 HydrophobicContact CD1-CD1 3.92Å; L136-L291 HydrophobicContact CD1-CD2 3.44Å; L136-L291 VanDerWaalsContact CD1-CD2 3.44Å; L136-L291 HydrophobicContact CD1-CG 4.22Å; L136-L291 HydrophobicContact CG-CD2 3.51Å; L136-L291 WeakPolarHBondContact O-CD2 3.5Å
137G74.5Confident86.7Confident47 Ų4761.5 Ų61.549%0.48532%0.318SS..SBendtrans155.9-174.1-178.900000110.7K139 K140G137-K139 PolarHBondContact O-N 2.81Å; G137-K140 PolarHBondContact N-O 3.04Å
138K73.5Confident86.5Confident222 Ų22259.7 Ų59.797%0.96531%0.314SS*.SBendtrans-59.5-23.7-172.4-63.7-177.9-179.5179.80115.2
139K78.2Confident86.3Confident203 Ų20360.4 Ų60.488%0.88332%0.318SS*.SBendtrans-129.1-9-174.3-65.4-172.7178.4-177.40114.8G137G137-K139 PolarHBondContact O-N 2.81Å
140K82.2Confident86.2Confident150 Ų15062.1 Ų62.165%0.65234%0.335SS*.  trans-119.3130-176.4-65.8-172.6180-177.30108.5L136 G137L136-K140 WeakPolarHBondContact CA-O 3.48Å; L136-K140 HydrophobicContact CB-CB 4.14Å; L136-K140 VanDerWaalsContact CB-O 3.31Å; L136-K140 WeakPolarHBondContact CB-O 3.45Å; L136-K140 HydrophobicContact CD2-CB 4.17Å; L136-K140 PolarHBondContact N-O 3.28Å; G137-K140 PolarHBondContact N-O 3.04Å
141T83.3Confident86.1Confident101 Ų10162.8 Ų62.862%0.6234%0.338SS*.BIsolated β-bridgetrans-119141.2177.2-51.10000107.3M134 E143M134-T141 HydrophobicContact CB-CG2 3.81Å; M134-T141 CarbonylContact O-C 3.56Å; M134-T141 WeakPolarHBondContact O-CA 3.46Å; M134-T141 VanDerWaalsContact O-CG2 3.28Å; M134-T141 WeakPolarHBondContact O-CG2 3.39Å; T141-E143 PolarHBondContact O-N 3.09Å
142V83.2Confident86.2Confident20 Ų2064.9 Ų64.912%0.12135%0.352CS..PPolyproline II helixtrans-65126.2169.41800000107.5M134 L136 F145 R287M134-V142 HydrophobicContact CB-CB 4.32Å; M134-V142 HydrophobicContact CE-CB 4.27Å; M134-V142 HydrophobicContact CE-CG1 4.04Å; M134-V142 PolarHBondContact O-N 3.36Å; M134-V142 HydrophobicContact SD-CB 4.26Å; M134-V142 HydrophobicContact SD-CG1 4.34Å; L136-V142 HydrophobicContact CB-CG2 4.4Å; L136-V142 HydrophobicContact CD1-CG2 4.16Å; V142-F145 HydrophobicContact CG1-CD1 4.34Å; V142-R287 HydrophobicContact CG2-CG 4.19Å
143E86.1Confident86.4Confident163 Ų16367.6 Ų67.676%0.76237%0.365SS*.PPolyproline II helixtrans-65150.6175.7-77.6-173.5-171.200111.2M134 T141 F145M134-E143 WeakPolarHBondContact CE-O 3.4Å; T141-E143 PolarHBondContact O-N 3.09Å; E143-F145 PolarHBondContact O-N 3Å; E143-F145 VanDerWaalsContact O-N 3.16Å
144P86.3Confident86.7Confident54 Ų5469.2 Ų69.235%0.35137%0.373SS..PPolyproline II helixtrans-62.5122.7-178.829.9-38.6000111.2E252P144-E252 VanDerWaalsContact CB-CD 3.43Å; P144-E252 HydrophobicContact CB-CG 3.38Å; P144-E252 WeakPolarHBondContact CB-OE1 3.17Å; P144-E252 WeakPolarHBondContact CD-OE1 3.45Å; P144-E252 HydrophobicContact CG-CG 3.85Å; P144-E252 WeakPolarHBondContact CG-OE1 3.39Å
145F88.4Confident86.9Confident21 Ų2171.2 Ų71.29%0.09238%0.381CS..PPolyproline II helixtrans-61.7138173.795-84.1000118.9L132 M134 V142 E143 V250 V283 H286 F294L132-F145 HydrophobicContact CD1-CZ 4.35Å; M134-F145 HydrophobicContact CE-CD1 4.26Å; M134-F145 HydrophobicContact CE-CE1 4.2Å; V142-F145 HydrophobicContact CG1-CD1 4.34Å; E143-F145 PolarHBondContact O-N 3Å; E143-F145 VanDerWaalsContact O-N 3.16Å; F145-V250 HydrophobicContact CD1-CG2 4.5Å; F145-V250 HydrophobicContact CD2-CG2 4.45Å; F145-V250 HydrophobicContact CE1-CG2 4.15Å; F145-V250 HydrophobicContact CE2-CG2 4.08Å; F145-V250 HydrophobicContact CZ-CG2 3.92Å; F145-V250 PolarHBondContact O-N 3.46Å; F145-V283 HydrophobicContact CZ-CG1 4.28Å; F145-H286 HydrophobicContact CD1-CB 3.54Å; F145-H286 AromaticContact CD1-CG 3.66Å; F145-H286 HydrophobicContact CD2-CB 4.15Å; F145-H286 AromaticContact CD2-CD2 3.18Å; F145-H286 WeakPolarHBondContact CD2-CD2 3.43Å; F145-H286 AromaticContact CD2-CE1 3.55Å; F145-H286 AromaticContact CD2-CG 3.39Å; F145-H286 AromaticContact CD2-ND1 3.62Å; F145-H286 AromaticContact CD2-NE2 3.27Å; F145-H286 VanDerWaalsContact CD2-NE2 3.27Å; F145-H286 WeakPolarHBondContact CD2-NE2 3.41Å; F145-H286 HydrophobicContact CE1-CB 3.36Å; F145-H286 AromaticContact CE1-CG 3.74Å; F145-H286 HydrophobicContact CE2-CB 4.03Å; F145-H286 AromaticContact CE2-CD2 3.04Å; F145-H286 WeakPolarHBondContact CE2-CD2 3.13Å; F145-H286 AromaticContact CE2-CG 3.51Å; F145-H286 AromaticContact CE2-NE2 3.54Å; F145-H286 HydrophobicContact CG-CB 3.92Å; F145-H286 AromaticContact CG-CD2 3.8Å; F145-H286 AromaticContact CG-CE1 3.85Å; F145-H286 AromaticContact CG-CG 3.47Å; F145-H286 VanDerWaalsContact CG-CG 3.47Å; F145-H286 AromaticContact CG-ND1 3.52Å; F145-H286 HydrophobicContact CZ-CB 3.63Å; F145-H286 AromaticContact CZ-CD2 3.53Å; F145-H286 AromaticContact CZ-CG 3.68Å; F145-F294 HydrophobicContact CE1-CE1 4.07Å; F145-F294 AromaticContact CE1-CZ 3.72Å; F145-F294 HydrophobicContact CE1-CZ 3.72Å; F145-F294 AromaticContact CZ-CE1 3.93Å; F145-F294 HydrophobicContact CZ-CE1 3.93Å; F145-F294 AromaticContact CZ-CZ 3.99Å; F145-F294 HydrophobicContact CZ-CZ 3.99Å
146A88.4Confident87Confident16 Ų1671.8 Ų71.813%0.13238%0.383CS..EExtended strand (participates in β ladder)trans-142.8124.9140.100000110.1R228 I248 M249A146-R228 VanDerWaalsContact O-CG 3.27Å; A146-R228 WeakPolarHBondContact O-CG 3.46Å; A146-R228 PolarHBondContact O-NE 2.68Å; A146-I248 CarbonylContact C-O 3.4Å; A146-I248 VanDerWaalsContact CA-O 3.24Å; A146-I248 WeakPolarHBondContact CA-O 3.4Å; A146-M249 HydrophobicContact CB-CB 4.29Å; A146-M249 HydrophobicContact CB-CG 4.2Å
147S90.9Very high87.2Confident3 Ų375 Ų752%0.02141%0.41CS..EExtended strand (participates in β ladder)trans-123.7161.4-176.554.70000110.7I248 H286S147-I248 PolarHBondContact N-O 3.06Å; S147-I248 PolarHBondContact O-N 2.91Å; S147-H286 VanDerWaalsContact CB-NE2 3.3Å; S147-H286 WeakPolarHBondContact CB-NE2 3.28Å; S147-H286 PolarHBondContact OG-NE2 2.88Å
148V92.7Very high87.8Confident28 Ų2880.5 Ų80.517%0.1742%0.424CS..EExtended strand (participates in β ladder)trans-126.4124.7-178.6-179.50000107.5F201 R228 F242 A245 H246V148-F201 HydrophobicContact CG1-CE1 4.41Å; V148-F201 HydrophobicContact CG2-CE1 4.17Å; V148-R228 HydrophobicContact CG2-CB 4.25Å; V148-R228 HydrophobicContact CG2-CG 4.41Å; V148-F242 HydrophobicContact CB-CE1 4.3Å; V148-F242 HydrophobicContact CG1-CD1 4.25Å; V148-F242 HydrophobicContact CG1-CE1 3.91Å; V148-F242 HydrophobicContact CG2-CE1 4.1Å; V148-A245 HydrophobicContact CG1-CB 3.32Å; V148-H246 WeakPolarHBondContact CA-O 3.47Å
149I93.2Very high88.6Confident15 Ų1574.6 Ų74.68%0.07741%0.406CS..EExtended strand (participates in β ladder)trans-122.8139.6-176.2-50.6177.3000109.4H246 I248 E282I149-H246 PolarHBondContact N-O 3.32Å; I149-H246 PolarHBondContact O-N 2.73Å; I149-I248 HydrophobicContact CB-CD1 4.44Å; I149-I248 HydrophobicContact CD1-CD1 3.04Å; I149-I248 HydrophobicContact CG1-CD1 3.73Å; I149-E282 HydrophobicContact CD1-CB 3.11Å; I149-E282 HydrophobicContact CD1-CG 3.41Å; I149-E282 VanDerWaalsContact CD1-CG 3.41Å; I149-E282 HydrophobicContact CG1-CB 3.76Å; I149-E282 HydrophobicContact CG1-CG 3.48Å; I149-E282 VanDerWaalsContact CG1-CG 3.48Å
150A92.9Very high89.3Confident55 Ų5566.9 Ų66.946%0.45537%0.374SS..  trans-83.5113.416100000109.2
151L94.5Very high89.9Confident14 Ų1465.5 Ų65.57%0.07337%0.368CS..  trans-71.2139.5177.6-66.7175.8000110.3H153 F155 H246 N275 V279L151-H153 PolarHBondContact O-N 3.12Å; L151-F155 HydrophobicContact CD1-CD1 4.04Å; L151-F155 HydrophobicContact CD1-CE1 3.59Å; L151-H246 HydrophobicContact CD1-CB 3.95Å; L151-H246 HydrophobicContact CG-CB 3.97Å; L151-N275 HydrophobicContact CD2-CB 4.5Å; L151-V279 HydrophobicContact CD2-CG2 3.78Å
152P94.8Very high90.5Very high77 Ų7760.9 Ų60.950%0.534%0.34SS..SBendtrans-57.2-35.6176.8-25.633.4000113.6N275 A278P152-N275 WeakPolarHBondContact CD-OD1 3.27Å; P152-A278 HydrophobicContact CG-CB 3.93Å
153H95.5Very high91.1Very high62 Ų6259.9 Ų59.929%0.28733%0.334SS..SBendtrans-124.9118.5179-54-66.3000110.3L151 M267 Q271 N275L151-H153 PolarHBondContact O-N 3.12Å; H153-M267 HydrophobicContact CB-CE 3.74Å; H153-Q271 HydrophobicContact CB-CB 4.04Å; H153-Q271 HydrophobicContact CB-CG 4.24Å; H153-N275 PolarHBondContact N-OD1 2.97Å; H153-N275 PolarHBondContact O-ND2 3Å; H153-N275 PolarHBondContact O-OD1 3.41Å
154L93.8Very high91.6Very high100 Ų10052.1 Ų52.152%0.52430%0.298SS..  trans-75.3134.5177.6-56.8177.8000110.1T244L154-T244 HydrophobicContact CD1-CG2 3.95Å
155F91.6Very high92.1Very high44 Ų4449.6 Ų49.619%0.19328%0.281CS..  trans-109.7-10.8176.564.4-102.2000113.1L151 K261 I262 T264 M267L151-F155 HydrophobicContact CD1-CD1 4.04Å; L151-F155 HydrophobicContact CD1-CE1 3.59Å; F155-K261 HydrophobicContact CD2-CD 4.32Å; F155-K261 WeakPolarHBondContact CE1-O 3.32Å; F155-K261 HydrophobicContact CE2-CD 3.6Å; F155-K261 HydrophobicContact CE2-CG 3.99Å; F155-K261 HydrophobicContact CZ-CB 4.31Å; F155-K261 HydrophobicContact CZ-CD 4.01Å; F155-K261 HydrophobicContact CZ-CG 3.94Å; F155-K261 WeakPolarHBondContact CZ-O 3.06Å; F155-I262 WeakPolarHBondContact CD1-O 3.42Å; F155-T264 HydrophobicContact CB-CG2 4.33Å; F155-T264 HydrophobicContact CD2-CG2 4.27Å; F155-M267 HydrophobicContact CB-CE 4.36Å; F155-M267 HydrophobicContact CB-SD 3.43Å; F155-M267 WeakPolarHBondContact CB-SD 3.46Å
156S86Confident92.5Very high54 Ų5448.6 Ų48.638%0.37828%0.277SS..  trans-115.3136.9176-168.60000108.9E158S156-E158 VanDerWaalsContact C-N 3.31Å; S156-E158 PolarHBondContact OG-N 3.06Å
157S82Confident92.7Very high126 Ų12650.6 Ų50.688%0.88129%0.293SS*.  trans-85.8-9.8170-52.40000112.2V159S157-V159 PolarHBondContact O-N 3.39Å
158E85.9Confident92.8Very high163 Ų16353.4 Ų53.476%0.76231%0.308SS*.PPolyproline II helixtrans-73.6121.6177.8-64.3177.8-176.300109.6S156S156-E158 VanDerWaalsContact C-N 3.31Å; S156-E158 PolarHBondContact OG-N 3.06Å
159V90.1Very high92.8Very high97 Ų9755.3 Ų55.359%0.58833%0.327SS*.PPolyproline II helixtrans-81.8131.2174.5-167.30000108.1S157 K243S157-V159 PolarHBondContact O-N 3.39Å; V159-K243 HydrophobicContact CG1-CB 3.7Å; V159-K243 HydrophobicContact CG1-CD 4.31Å; V159-K243 HydrophobicContact CG1-CG 3.85Å
160N93.6Very high92.9Very high41 Ų4158.9 Ų58.922%0.21935%0.353CS..PPolyproline II helixtrans-64.2140.1178.9-59.1-39.4000110.6V162 D200 F201 F242 K243 A245N160-V162 PolarHBondContact O-N 3.38Å; N160-D200 HydrophobicContact CB-CB 4.36Å; N160-F201 HydrophobicContact CB-CD2 3.76Å; N160-F201 HydrophobicContact CB-CE2 3.96Å; N160-F201 VanDerWaalsContact ND2-CE2 3.27Å; N160-F201 WeakPolarHBondContact ND2-CE2 3.34Å; N160-F242 WeakPolarHBondContact CB-O 3.26Å; N160-F242 PolarHBondContact ND2-O 3.29Å; N160-K243 PolarHBondContact N-O 2.98Å; N160-K243 PolarHBondContact ND2-O 2.93Å; N160-A245 PolarHBondContact ND2-O 3.24Å
161K94.5Very high92.9Very high122 Ų12258.2 Ų58.253%0.5334%0.341SS..PPolyproline II helixtrans-76.7123.3170.8-65178.7-1771770108.4A181 V199 D200 F201K161-A181 HydrophobicContact CB-CB 4.19Å; K161-V199 HydrophobicContact CB-CG1 4.19Å; K161-V199 WeakPolarHBondContact O-CG1 3.24Å; K161-D200 PolarHBondContact N-OD2 3.07Å; K161-D200 PolarHBondContact O-N 3.37Å; K161-D200 VanDerWaalsContact O-N 3.12Å; K161-F201 PolarHBondContact O-N 3.3Å; K161-F201 VanDerWaalsContact O-N 3.12Å
162V95.9Very high92.9Very high3 Ų359.3 Ų59.32%0.01835%0.346CS..EExtended strand (participates in β ladder)trans-117.8130.9-180-1700000109.9N160 A181 F201 V203 L239 F242 K243N160-V162 PolarHBondContact O-N 3.38Å; V162-A181 PolarHBondContact O-N 2.79Å; V162-F201 WeakPolarHBondContact CA-O 3.27Å; V162-F201 HydrophobicContact CG1-CB 4.38Å; V162-F201 HydrophobicContact CG2-CB 4.33Å; V162-V203 HydrophobicContact CG1-CB 4.43Å; V162-V203 HydrophobicContact CG1-CG2 3.68Å; V162-L239 HydrophobicContact CB-CD2 4Å; V162-L239 HydrophobicContact CG1-CD2 3.78Å; V162-F242 HydrophobicContact CG1-CB 4.08Å; V162-F242 HydrophobicContact CG2-CB 3.8Å; V162-K243 HydrophobicContact CG2-CG 4.37Å
163A96.4Very high92.9Very high0 Ų061.9 Ų61.90%035%0.35CS..EExtended strand (participates in β ladder)trans-106135.5172.400000110.2F182 L188 V199 F201 Y202 V203A163-F182 CarbonylContact C-O 3.44Å; A163-F182 VanDerWaalsContact CA-O 3.28Å; A163-F182 WeakPolarHBondContact CA-O 3.44Å; A163-F182 HydrophobicContact CB-CB 4.33Å; A163-L188 HydrophobicContact CB-CD2 4.36Å; A163-V199 HydrophobicContact CB-CB 4.29Å; A163-V199 HydrophobicContact CB-CG1 3.77Å; A163-V199 HydrophobicContact CB-CG2 3.99Å; A163-F201 PolarHBondContact N-O 3.37Å; A163-Y202 HydrophobicContact CB-CD1 4.04Å; A163-Y202 HydrophobicContact CB-CE1 4.35Å; A163-V203 PolarHBondContact O-N 3Å
164V97Very high92.9Very high0 Ų062.1 Ų62.10%035%0.352CS..EExtended strand (participates in β ladder)trans-112.2123.9-178.4-179.30000109.6T166 A175 A180 F182 A183 G184 V203 I235 L239V164-T166 HydrophobicContact CG1-CG2 3.83Å; V164-A175 HydrophobicContact CB-CB 3.96Å; V164-A175 HydrophobicContact CG1-CB 3.97Å; V164-A175 HydrophobicContact CG2-CB 4.05Å; V164-A180 HydrophobicContact CG2-CB 3.85Å; V164-F182 PolarHBondContact N-O 3.48Å; V164-A183 HydrophobicContact CB-CB 4.48Å; V164-A183 WeakPolarHBondContact O-CA 3.42Å; V164-G184 PolarHBondContact O-N 2.77Å; V164-G184 VanDerWaalsContact O-N 3.08Å; V164-V203 CarbonylContact C-O 3.56Å; V164-V203 WeakPolarHBondContact CA-O 3.3Å; V164-V203 HydrophobicContact CG2-CB 4.39Å; V164-I235 HydrophobicContact CG1-CD1 4.42Å; V164-I235 HydrophobicContact CG1-CG1 4.47Å; V164-I235 HydrophobicContact CG1-CG2 4.03Å; V164-I235 HydrophobicContact CG2-CG2 4.39Å; V164-L239 HydrophobicContact CG2-CD1 4.26Å; V164-L239 HydrophobicContact CG2-CD2 3.58Å; V164-L239 HydrophobicContact CG2-CG 4.12Å
165F96.6Very high93Very high0 Ų057.4 Ų57.40%033%0.327CS..EExtended strand (participates in β ladder)trans-99117.3175.1-62.8-70.4000111G184 L188 V189 I192 Y202 V203 A204 V205 I208 L212 L215 P224F165-G184 WeakPolarHBondContact CA-O 3.28Å; F165-L188 HydrophobicContact CD1-CD2 4.01Å; F165-L188 HydrophobicContact CD1-CG 4.46Å; F165-L188 HydrophobicContact CE1-CB 4.36Å; F165-L188 HydrophobicContact CE1-CD2 3.86Å; F165-L188 HydrophobicContact CE1-CG 3.97Å; F165-V189 HydrophobicContact CD1-CG2 4.36Å; F165-V189 HydrophobicContact CE1-CG2 4.1Å; F165-I192 HydrophobicContact CE1-CD1 3.69Å; F165-I192 HydrophobicContact CZ-CD1 3.41Å; F165-I192 VanDerWaalsContact CZ-CD1 3.41Å; F165-Y202 AromaticContact CE2-CD1 3.57Å; F165-Y202 HydrophobicContact CE2-CD1 3.57Å; F165-Y202 HydrophobicContact CE2-CG 4.16Å; F165-Y202 AromaticContact CZ-CD1 3.86Å; F165-Y202 HydrophobicContact CZ-CD1 3.86Å; F165-Y202 HydrophobicContact CZ-CE1 4.4Å; F165-V203 PolarHBondContact N-O 3.22Å; F165-A204 HydrophobicContact CB-CB 4.1Å; F165-A204 HydrophobicContact CD2-CB 4.38Å; F165-V205 PolarHBondContact O-N 2.94Å; F165-I208 HydrophobicContact CB-CG2 3.84Å; F165-I208 VanDerWaalsContact O-CG2 3.3Å; F165-I208 WeakPolarHBondContact O-CG2 3.46Å; F165-L212 HydrophobicContact CB-CD1 3.89Å; F165-L212 HydrophobicContact CB-CD2 3.96Å; F165-L212 HydrophobicContact CB-CG 4.49Å; F165-L212 HydrophobicContact CD1-CD2 3.56Å; F165-L212 HydrophobicContact CD2-CD1 3.82Å; F165-L212 HydrophobicContact CD2-CD2 4.01Å; F165-L212 HydrophobicContact CE1-CD2 3.93Å; F165-L212 HydrophobicContact CE2-CD1 4.48Å; F165-L212 HydrophobicContact CE2-CD2 4.32Å; F165-L212 HydrophobicContact CG-CD1 3.93Å; F165-L212 HydrophobicContact CG-CD2 3.59Å; F165-L212 HydrophobicContact CG-CG 4.42Å; F165-L212 HydrophobicContact CZ-CD2 4.27Å; F165-L215 HydrophobicContact CE1-CD1 4.07Å; F165-L215 HydrophobicContact CE2-CD1 4.41Å; F165-L215 HydrophobicContact CZ-CD1 3.67Å; F165-P224 HydrophobicContact CD2-CG 4.5Å
166T95.4Very high93.2Very high0 Ų060.8 Ų60.80%034%0.344CS..  trans-145.8143.1-179.849.20000110.2V164 E171 I172 G184 G185 V205 I235V164-T166 HydrophobicContact CG1-CG2 3.83Å; T166-E171 HydrophobicContact CG2-CB 3.84Å; T166-E171 VanDerWaalsContact CG2-OE2 3.28Å; T166-E171 WeakPolarHBondContact CG2-OE2 3.37Å; T166-I172 WeakPolarHBondContact OG1-CG1 3.34Å; T166-G184 PolarHBondContact N-O 2.86Å; T166-G184 CarbonylContact O-C 3.5Å; T166-G185 WeakPolarHBondContact O-CA 3.23Å; T166-G185 PolarHBondContact O-N 3.49Å; T166-V205 HydrophobicContact CG2-CB 4.18Å; T166-V205 HydrophobicContact CG2-CG2 3.54Å; T166-I235 HydrophobicContact CG2-CD1 3.63Å
167A93Very high93.6Very high58 Ų5865.6 Ų65.648%0.47936%0.36SS..SBendtrans-86.8-26.9171.800000111.6
168N93.8Very high94.2Very high62 Ų6262 Ų6233%0.33233%0.331SS..  trans-83.8122.6-174.3-62.8-36.2000111.3S170 E171 I172 E207N168-S170 VanDerWaalsContact C-N 3.26Å; N168-S170 PolarHBondContact O-N 3.42Å; N168-E171 HydrophobicContact CB-CB 4.16Å; N168-E171 HydrophobicContact CB-CG 4.02Å; N168-E171 PolarHBondContact ND2-OE1 3.42Å; N168-E171 VanDerWaalsContact ND2-OE1 3.07Å; N168-E171 WeakPolarHBondContact O-CB 3.38Å; N168-E171 PolarHBondContact O-N 2.94Å; N168-E171 VanDerWaalsContact O-N 3.13Å; N168-I172 WeakPolarHBondContact O-CG1 3.23Å; N168-I172 PolarHBondContact O-N 3.37Å; N168-E207 PolarHBondContact ND2-OE2 3Å
169A92.8Very high94.5Very high69 Ų6956.4 Ų56.457%0.5732%0.317SS*.Hα-helixtrans-61.8-30.6179.800000113.7I172 K173A169-I172 PolarHBondContact O-N 3.24Å; A169-K173 PolarHBondContact O-N 2.85Å
170S94.1Very high94.7Very high90 Ų9052.4 Ų52.463%0.62930%0.295SS*.Hα-helixtrans-66-39.7175.6-54.50000112.1N168 I172 K173 I174N168-S170 VanDerWaalsContact C-N 3.26Å; N168-S170 PolarHBondContact O-N 3.42Å; S170-I172 VanDerWaalsContact C-N 3.35Å; S170-K173 PolarHBondContact O-N 3.47Å; S170-I174 WeakPolarHBondContact O-CG1 3.14Å; S170-I174 PolarHBondContact O-N 2.98Å
171E94.2Very high94.8Very high41 Ų4152.7 Ų52.719%0.19230%0.302CS..Hα-helixtrans-70.2-31.9177.9-74.3173.4-165.200112.4T166 N168 I174 A175 I235T166-E171 HydrophobicContact CG2-CB 3.84Å; T166-E171 VanDerWaalsContact CG2-OE2 3.28Å; T166-E171 WeakPolarHBondContact CG2-OE2 3.37Å; N168-E171 HydrophobicContact CB-CB 4.16Å; N168-E171 HydrophobicContact CB-CG 4.02Å; N168-E171 PolarHBondContact ND2-OE1 3.42Å; N168-E171 VanDerWaalsContact ND2-OE1 3.07Å; N168-E171 WeakPolarHBondContact O-CB 3.38Å; N168-E171 PolarHBondContact O-N 2.94Å; N168-E171 VanDerWaalsContact O-N 3.13Å; E171-I174 PolarHBondContact O-N 2.57Å; E171-A175 WeakPolarHBondContact O-CB 3.47Å; E171-A175 PolarHBondContact O-N 2.87Å; E171-I235 HydrophobicContact CB-CD1 3.53Å; E171-I235 HydrophobicContact CG-CD1 3.83Å
172I94.5Very high94.8Very high36 Ų3650.7 Ų50.719%0.18529%0.294CS..Hα-helixtrans-59.5-48172.7-64.7173.7000110.1T166 N168 A169 S170 I174 A175 E176 A183T166-I172 WeakPolarHBondContact OG1-CG1 3.34Å; N168-I172 WeakPolarHBondContact O-CG1 3.23Å; N168-I172 PolarHBondContact O-N 3.37Å; A169-I172 PolarHBondContact O-N 3.24Å; S170-I172 VanDerWaalsContact C-N 3.35Å; I172-I174 VanDerWaalsContact C-N 3.34Å; I172-I174 PolarHBondContact O-N 2.77Å; I172-A175 WeakPolarHBondContact O-CB 3.24Å; I172-A175 PolarHBondContact O-N 2.82Å; I172-A175 VanDerWaalsContact O-N 3.13Å; I172-E176 WeakPolarHBondContact O-CG 3.28Å; I172-E176 PolarHBondContact O-N 3.26Å; I172-A183 HydrophobicContact CG2-CB 3.87Å
173K95.4Very high94.8Very high132 Ų13251.5 Ų51.557%0.57430%0.301SS*.Hα-helixtrans-60.3-44177.8-65.6-179.8-178.7-176.80111.9A169 S170 A175 E176 E177A169-K173 PolarHBondContact O-N 2.85Å; S170-K173 PolarHBondContact O-N 3.47Å; K173-A175 VanDerWaalsContact C-N 3.3Å; K173-A175 PolarHBondContact O-N 3.46Å; K173-E176 PolarHBondContact O-N 2.76Å; K173-E177 WeakPolarHBondContact O-CB 3.47Å; K173-E177 VanDerWaalsContact O-CG 3.29Å; K173-E177 WeakPolarHBondContact O-CG 3.49Å; K173-E177 PolarHBondContact O-N 3.34Å
174I95.4Very high94.7Very high67 Ų6752 Ų5234%0.34431%0.305SS..Hα-helixtrans-60.3-42.3175.9-65.3167.1000110.5S170 E171 I172 N178 P236S170-I174 WeakPolarHBondContact O-CG1 3.14Å; S170-I174 PolarHBondContact O-N 2.98Å; E171-I174 PolarHBondContact O-N 2.57Å; I172-I174 VanDerWaalsContact C-N 3.34Å; I172-I174 PolarHBondContact O-N 2.77Å; I174-N178 WeakPolarHBondContact O-CB 3.34Å; I174-N178 PolarHBondContact O-N 3.16Å; I174-N178 PolarHBondContact O-ND2 2.94Å; I174-P236 HydrophobicContact CG2-CG 3.81Å
175A95.4Very high94.6Very high0 Ų052.6 Ų52.60%031%0.312CS..Hα-helixtrans-63.2-44177.800000112V164 E171 I172 K173 N178 G179 A180 A183 I235 L239V164-A175 HydrophobicContact CB-CB 3.96Å; V164-A175 HydrophobicContact CG1-CB 3.97Å; V164-A175 HydrophobicContact CG2-CB 4.05Å; E171-A175 WeakPolarHBondContact O-CB 3.47Å; E171-A175 PolarHBondContact O-N 2.87Å; I172-A175 WeakPolarHBondContact O-CB 3.24Å; I172-A175 PolarHBondContact O-N 2.82Å; I172-A175 VanDerWaalsContact O-N 3.13Å; K173-A175 VanDerWaalsContact C-N 3.3Å; K173-A175 PolarHBondContact O-N 3.46Å; A175-N178 CarbonylContact O-C 3.6Å; A175-N178 PolarHBondContact O-N 3.4Å; A175-G179 PolarHBondContact O-N 3.16Å; A175-A180 HydrophobicContact CB-CB 4.02Å; A175-A180 WeakPolarHBondContact O-CB 3.4Å; A175-A180 PolarHBondContact O-N 3.22Å; A175-A183 HydrophobicContact CB-CB 3.77Å; A175-I235 HydrophobicContact CB-CG2 3.93Å; A175-L239 HydrophobicContact CB-CD1 4.41Å
176E94.9Very high94.4Very high115 Ų11555.6 Ų55.654%0.53733%0.331SS..Hα-helixtrans-64.7-45.2177.9-70.5176.1170.500112.1I172 K173 N178 G179 A183I172-E176 WeakPolarHBondContact O-CG 3.28Å; I172-E176 PolarHBondContact O-N 3.26Å; K173-E176 PolarHBondContact O-N 2.76Å; E176-N178 PolarHBondContact O-N 2.99Å; E176-G179 PolarHBondContact O-N 3.29Å; E176-A183 HydrophobicContact CG-CB 4.09Å
177E95.4Very high94.3Very high156 Ų15660.7 Ų60.773%0.72936%0.358SS*.Hα-helixtrans-59.8-37175.2-74.2171-17300111.9K173 G179K173-E177 WeakPolarHBondContact O-CB 3.47Å; K173-E177 VanDerWaalsContact O-CG 3.29Å; K173-E177 WeakPolarHBondContact O-CG 3.49Å; K173-E177 PolarHBondContact O-N 3.34Å; E177-G179 PolarHBondContact O-N 3.41Å
178N94.7Very high94.4Very high50 Ų5058.4 Ų58.427%0.26734%0.337SS..THydrogen-bonded Turntrans-82.111.7175.5-74.6-74.7000113I174 A175 E176 L239 K243I174-N178 WeakPolarHBondContact O-CB 3.34Å; I174-N178 PolarHBondContact O-N 3.16Å; I174-N178 PolarHBondContact O-ND2 2.94Å; A175-N178 CarbonylContact O-C 3.6Å; A175-N178 PolarHBondContact O-N 3.4Å; E176-N178 PolarHBondContact O-N 2.99Å; N178-L239 HydrophobicContact CB-CD1 3.58Å; N178-K243 VanDerWaalsContact O-CE 3.23Å; N178-K243 WeakPolarHBondContact O-CE 3.27Å; N178-K243 PolarHBondContact O-NZ 3.32Å
179G92.5Very high94.4Very high45 Ų4555.9 Ų55.946%0.46432%0.324SS..THydrogen-bonded Turntrans71.733.6173.700000114.6A175 E176 E177A175-G179 PolarHBondContact O-N 3.16Å; E176-G179 PolarHBondContact O-N 3.29Å; E177-G179 PolarHBondContact O-N 3.41Å
180A94.2Very high94.5Very high14 Ų1458.5 Ų58.512%0.11632%0.323CS..  trans-61.7137.4161.700000109.6V164 A175 F182 L239V164-A180 HydrophobicContact CG2-CB 3.85Å; A175-A180 HydrophobicContact CB-CB 4.02Å; A175-A180 WeakPolarHBondContact O-CB 3.4Å; A175-A180 PolarHBondContact O-N 3.22Å; A180-F182 VanDerWaalsContact C-N 3.31Å; A180-L239 HydrophobicContact CB-CD1 4.15Å; A180-L239 HydrophobicContact CB-CD2 4.02Å
181A94.9Very high94.5Very high46 Ų4659 Ų5938%0.3831%0.313SS..SBendtrans-68.3-36.4178.600000111.3K161 V162K161-A181 HydrophobicContact CB-CB 4.19Å; V162-A181 PolarHBondContact O-N 2.79Å
182F95.3Very high94.5Very high81 Ų8157.2 Ų57.236%0.35531%0.305SS..EExtended strand (participates in β ladder)trans-145.2137.1175.9-57-79.9000109.3A163 V164 A180 L188 V197 V199A163-F182 CarbonylContact C-O 3.44Å; A163-F182 VanDerWaalsContact CA-O 3.28Å; A163-F182 WeakPolarHBondContact CA-O 3.44Å; A163-F182 HydrophobicContact CB-CB 4.33Å; V164-F182 PolarHBondContact N-O 3.48Å; A180-F182 VanDerWaalsContact C-N 3.31Å; F182-L188 HydrophobicContact CB-CD1 3.8Å; F182-L188 HydrophobicContact CB-CD2 4.14Å; F182-L188 HydrophobicContact CG-CD1 4.38Å; F182-V197 HydrophobicContact CD1-CG1 4.26Å; F182-V197 HydrophobicContact CD1-CG2 4.38Å; F182-V197 HydrophobicContact CD2-CG1 3.48Å; F182-V197 VanDerWaalsContact CD2-CG1 3.48Å; F182-V197 HydrophobicContact CE1-CG1 4.31Å; F182-V197 HydrophobicContact CE1-CG2 4.16Å; F182-V197 HydrophobicContact CE2-CG1 3.54Å; F182-V197 HydrophobicContact CG-CG1 3.86Å; F182-V197 HydrophobicContact CZ-CG1 3.96Å; F182-V197 HydrophobicContact CZ-CG2 4.33Å; F182-V199 HydrophobicContact CD2-CG2 3.79Å; F182-V199 HydrophobicContact CE2-CG2 4.1Å
183A95.5Very high94.4Very high20 Ų2059.7 Ų59.717%0.16532%0.317CS..EExtended strand (participates in β ladder)trans-131.9138173.400000109.4V164 I172 A175 E176V164-A183 HydrophobicContact CB-CB 4.48Å; V164-A183 WeakPolarHBondContact O-CA 3.42Å; I172-A183 HydrophobicContact CG2-CB 3.87Å; A175-A183 HydrophobicContact CB-CB 3.77Å; E176-A183 HydrophobicContact CG-CB 4.09Å
184G94.9Very high94.3Very high9 Ų958.6 Ų58.69%0.09332%0.317CS..EExtended strand (participates in β ladder)trans165.8178178.300000114.5V164 F165 T166V164-G184 PolarHBondContact O-N 2.77Å; V164-G184 VanDerWaalsContact O-N 3.08Å; F165-G184 WeakPolarHBondContact CA-O 3.28Å; T166-G184 PolarHBondContact N-O 2.86Å; T166-G184 CarbonylContact O-C 3.5Å
185G93.3Very high94.2Very high14 Ų1460.7 Ų60.714%0.14433%0.33CS..SBendtrans-104.8-126.2179.900000113.4T166 D187 L188 V189T166-G185 WeakPolarHBondContact O-CA 3.23Å; T166-G185 PolarHBondContact O-N 3.49Å; G185-D187 PolarHBondContact O-N 3.17Å; G185-L188 PolarHBondContact O-N 3Å; G185-L188 VanDerWaalsContact O-N 3.09Å; G185-V189 PolarHBondContact O-N 3.21Å
186T92.9Very high94Very high63 Ų6367.1 Ų67.139%0.38736%0.36SS..Hα-helixtrans-55-31.3178.757.70000114.5V189 K190 E211T186-V189 WeakPolarHBondContact O-CB 3.42Å; T186-V189 PolarHBondContact O-N 3.3Å; T186-K190 WeakPolarHBondContact O-CG 3.3Å; T186-K190 PolarHBondContact O-N 3.21Å; T186-K190 VanDerWaalsContact O-N 3.13Å; T186-E211 HydrophobicContact CG2-CB 4.35Å; T186-E211 HydrophobicContact CG2-CG 4.32Å; T186-E211 WeakPolarHBondContact CG2-OE2 3.43Å
187D93.4Very high93.9Very high107 Ų10762.2 Ų62.257%0.57234%0.337SS*.Hα-helixtrans-67-40.4177.8-64.4-32.7000111.9G185 V189 K190 K191G185-D187 PolarHBondContact O-N 3.17Å; D187-V189 VanDerWaalsContact C-N 3.32Å; D187-K190 PolarHBondContact O-N 3.28Å; D187-K191 WeakPolarHBondContact O-CG 3.32Å; D187-K191 PolarHBondContact O-N 2.83Å
188L94.5Very high93.6Very high10 Ų1059.8 Ų59.85%0.05233%0.333CS..Hα-helixtrans-68.9-35.7176.2-174.161.9000111A163 F165 F182 G185 K190 K191 I192 V197A163-L188 HydrophobicContact CB-CD2 4.36Å; F165-L188 HydrophobicContact CD1-CD2 4.01Å; F165-L188 HydrophobicContact CD1-CG 4.46Å; F165-L188 HydrophobicContact CE1-CB 4.36Å; F165-L188 HydrophobicContact CE1-CD2 3.86Å; F165-L188 HydrophobicContact CE1-CG 3.97Å; F182-L188 HydrophobicContact CB-CD1 3.8Å; F182-L188 HydrophobicContact CB-CD2 4.14Å; F182-L188 HydrophobicContact CG-CD1 4.38Å; G185-L188 PolarHBondContact O-N 3Å; G185-L188 VanDerWaalsContact O-N 3.09Å; L188-K190 VanDerWaalsContact C-N 3.33Å; L188-K190 PolarHBondContact O-N 3.23Å; L188-K191 PolarHBondContact O-N 2.9Å; L188-I192 HydrophobicContact CD1-CD1 4.3Å; L188-I192 HydrophobicContact CG-CD1 3.89Å; L188-I192 VanDerWaalsContact O-CG1 3.3Å; L188-I192 WeakPolarHBondContact O-CG1 3.46Å; L188-I192 PolarHBondContact O-N 3.41Å; L188-V197 HydrophobicContact CD1-CG1 4.41Å
189V94.1Very high93.6Very high9 Ų957.4 Ų57.46%0.05532%0.32CS..Hα-helixtrans-57.2-46.6173.8172.30000111.2F165 G185 T186 D187 I192 M193 L212 L215F165-V189 HydrophobicContact CD1-CG2 4.36Å; F165-V189 HydrophobicContact CE1-CG2 4.1Å; G185-V189 PolarHBondContact O-N 3.21Å; T186-V189 WeakPolarHBondContact O-CB 3.42Å; T186-V189 PolarHBondContact O-N 3.3Å; D187-V189 VanDerWaalsContact C-N 3.32Å; V189-I192 PolarHBondContact O-N 3.16Å; V189-M193 WeakPolarHBondContact O-CG 3.23Å; V189-M193 PolarHBondContact O-N 2.9Å; V189-L212 HydrophobicContact CG2-CD2 3.49Å; V189-L212 VanDerWaalsContact CG2-CD2 3.49Å; V189-L215 HydrophobicContact CB-CD1 4.28Å; V189-L215 HydrophobicContact CG1-CD1 4.04Å; V189-L215 HydrophobicContact CG1-CD2 4.21Å; V189-L215 HydrophobicContact CG1-CG 3.85Å; V189-L215 HydrophobicContact CG2-CD1 3.92Å
190K94.6Very high93.6Very high124 Ų12458.5 Ų58.554%0.53932%0.315SS..Hα-helixtrans-61.5-49.4177.7-67.9170.4-172.81660111.7T186 D187 L188 I192 M193 D194T186-K190 WeakPolarHBondContact O-CG 3.3Å; T186-K190 PolarHBondContact O-N 3.21Å; T186-K190 VanDerWaalsContact O-N 3.13Å; D187-K190 PolarHBondContact O-N 3.28Å; L188-K190 VanDerWaalsContact C-N 3.33Å; L188-K190 PolarHBondContact O-N 3.23Å; K190-I192 VanDerWaalsContact C-N 3.28Å; K190-I192 PolarHBondContact O-N 3.02Å; K190-M193 CarbonylContact O-C 3.55Å; K190-M193 WeakPolarHBondContact O-CA 3.4Å; K190-M193 WeakPolarHBondContact O-CB 3.4Å; K190-M193 PolarHBondContact O-N 2.82Å; K190-D194 PolarHBondContact O-N 2.9Å
191K94.8Very high93.6Very high99 Ų9958.7 Ų58.743%0.4331%0.314SS..Hα-helixtrans-57.3-39.3177.7-66.1179.9178.7178.70113.1D187 L188 D194 D195 E196 V197D187-K191 WeakPolarHBondContact O-CG 3.32Å; D187-K191 PolarHBondContact O-N 2.83Å; L188-K191 PolarHBondContact O-N 2.9Å; K191-D194 PolarHBondContact O-N 3.03Å; K191-D195 PolarHBondContact O-N 3.48Å; K191-E196 HydrophobicContact CB-CB 4.39Å; K191-E196 WeakPolarHBondContact CG-OE2 3.5Å; K191-E196 PolarHBondContact O-N 2.9Å; K191-V197 HydrophobicContact CB-CG2 3.94Å; K191-V197 HydrophobicContact CD-CG2 4.45Å
192I94.6Very high93.6Very high4 Ų457.2 Ų57.22%0.02130%0.298CS..Hα-helixtrans-71.3-36.4175.3-65.8164.8000110.6F165 L188 V189 K190 D194 D195 V197 Y202 L215 K218 L219F165-I192 HydrophobicContact CE1-CD1 3.69Å; F165-I192 HydrophobicContact CZ-CD1 3.41Å; F165-I192 VanDerWaalsContact CZ-CD1 3.41Å; L188-I192 HydrophobicContact CD1-CD1 4.3Å; L188-I192 HydrophobicContact CG-CD1 3.89Å; L188-I192 VanDerWaalsContact O-CG1 3.3Å; L188-I192 WeakPolarHBondContact O-CG1 3.46Å; L188-I192 PolarHBondContact O-N 3.41Å; V189-I192 PolarHBondContact O-N 3.16Å; K190-I192 VanDerWaalsContact C-N 3.28Å; K190-I192 PolarHBondContact O-N 3.02Å; I192-D194 VanDerWaalsContact C-N 3.25Å; I192-D194 PolarHBondContact O-N 3.24Å; I192-D195 PolarHBondContact O-N 3.14Å; I192-V197 HydrophobicContact CG1-CB 4.09Å; I192-V197 HydrophobicContact CG1-CG1 4.15Å; I192-Y202 HydrophobicContact CD1-CD1 4.43Å; I192-Y202 HydrophobicContact CD1-CE1 3.85Å; I192-L215 HydrophobicContact CB-CD2 4.12Å; I192-L215 HydrophobicContact CG2-CD2 3.74Å; I192-K218 VanDerWaalsContact O-CE 3.29Å; I192-K218 WeakPolarHBondContact O-CE 3.32Å; I192-K218 PolarHBondContact O-NZ 3.12Å; I192-L219 HydrophobicContact CG2-CD2 4.35Å
193M92.6Very high93.6Very high88 Ų8853.3 Ų53.343%0.43328%0.281SS..Hα-helixtrans-64.4-30173.2-74.1-163.174.600113V189 K190 P214 L215 K218V189-M193 WeakPolarHBondContact O-CG 3.23Å; V189-M193 PolarHBondContact O-N 2.9Å; K190-M193 CarbonylContact O-C 3.55Å; K190-M193 WeakPolarHBondContact O-CA 3.4Å; K190-M193 WeakPolarHBondContact O-CB 3.4Å; K190-M193 PolarHBondContact O-N 2.82Å; M193-P214 HydrophobicContact CE-CB 4.29Å; M193-P214 HydrophobicContact SD-CB 3.74Å; M193-L215 HydrophobicContact CG-CD2 3.66Å; M193-K218 PolarHBondContact O-NZ 3.43Å
194D93.7Very high93.7Very high109 Ų10952.4 Ų52.458%0.58327%0.274SS*.THydrogen-bonded Turntrans-89.12.7177.8-62.1-30.2000113.6K190 K191 I192 E196K190-D194 PolarHBondContact O-N 2.9Å; K191-D194 PolarHBondContact O-N 3.03Å; I192-D194 VanDerWaalsContact C-N 3.25Å; I192-D194 PolarHBondContact O-N 3.24Å; D194-E196 HydrophobicContact CB-CG 4.14Å; D194-E196 PolarHBondContact O-N 3.17Å
195D91.4Very high93.7Very high112 Ų11252 Ų5260%0.59927%0.27SS*.THydrogen-bonded Turntrans61.420.1-177.8-67.4-54.6000114.5K191 I192 V197 K218K191-D195 PolarHBondContact O-N 3.48Å; I192-D195 PolarHBondContact O-N 3.14Å; D195-V197 VanDerWaalsContact C-N 3.27Å; D195-V197 PolarHBondContact O-N 2.71Å; D195-K218 WeakPolarHBondContact OD1-CE 3.43Å; D195-K218 IonicContact OD1-NZ 3.63Å; D195-K218 PolarHBondContact OD1-NZ 3.25Å; D195-K218 IonicContact OD2-NZ 3.38Å; D195-K218 PolarHBondContact OD2-NZ 2.69Å
196E93Very high93.8Very high135 Ų13554.2 Ų54.263%0.63128%0.281SS*.  trans-71-27.5174.5-62.4-174.2166.600112.1K191 D194K191-E196 HydrophobicContact CB-CB 4.39Å; K191-E196 WeakPolarHBondContact CG-OE2 3.5Å; K191-E196 PolarHBondContact O-N 2.9Å; D194-E196 HydrophobicContact CB-CG 4.14Å; D194-E196 PolarHBondContact O-N 3.17Å
197V92Very high93.8Very high11 Ų1157 Ų577%0.06729%0.29CS..  trans-122.6116.5-172.3173.30000109.8F182 L188 K191 I192 D195 V199F182-V197 HydrophobicContact CD1-CG1 4.26Å; F182-V197 HydrophobicContact CD1-CG2 4.38Å; F182-V197 HydrophobicContact CD2-CG1 3.48Å; F182-V197 VanDerWaalsContact CD2-CG1 3.48Å; F182-V197 HydrophobicContact CE1-CG1 4.31Å; F182-V197 HydrophobicContact CE1-CG2 4.16Å; F182-V197 HydrophobicContact CE2-CG1 3.54Å; F182-V197 HydrophobicContact CG-CG1 3.86Å; F182-V197 HydrophobicContact CZ-CG1 3.96Å; F182-V197 HydrophobicContact CZ-CG2 4.33Å; L188-V197 HydrophobicContact CD1-CG1 4.41Å; K191-V197 HydrophobicContact CB-CG2 3.94Å; K191-V197 HydrophobicContact CD-CG2 4.45Å; I192-V197 HydrophobicContact CG1-CB 4.09Å; I192-V197 HydrophobicContact CG1-CG1 4.15Å; D195-V197 VanDerWaalsContact C-N 3.27Å; D195-V197 PolarHBondContact O-N 2.71Å; V197-V199 HydrophobicContact CG1-CG2 3.49Å; V197-V199 VanDerWaalsContact CG1-CG2 3.49Å
198V89.5Confident93.9Very high106 Ų10652 Ų5264%0.64226%0.263SS*.  trans-111.2124.2177.1-176.60000109.8
199V93.2Very high93.8Very high0 Ų053.6 Ų53.60%027%0.271CS..  trans-139.1148.7-171.3-168.20000109.9K161 A163 F182 V197 F201 Y202K161-V199 HydrophobicContact CB-CG1 4.19Å; K161-V199 WeakPolarHBondContact O-CG1 3.24Å; A163-V199 HydrophobicContact CB-CB 4.29Å; A163-V199 HydrophobicContact CB-CG1 3.77Å; A163-V199 HydrophobicContact CB-CG2 3.99Å; F182-V199 HydrophobicContact CD2-CG2 3.79Å; F182-V199 HydrophobicContact CE2-CG2 4.1Å; V197-V199 HydrophobicContact CG1-CG2 3.49Å; V197-V199 VanDerWaalsContact CG1-CG2 3.49Å; V199-F201 VanDerWaalsContact CG1-O 3.24Å; V199-F201 WeakPolarHBondContact CG1-O 3.45Å; V199-Y202 HydrophobicContact CB-CE1 4Å; V199-Y202 HydrophobicContact CG2-CE1 4.42Å
200D93.1Very high93.7Very high67 Ų6755.6 Ų55.636%0.35829%0.294SS..SBendtrans-81.8-50.5-178.8-54.3-49.8000110.8N160 K161N160-D200 HydrophobicContact CB-CB 4.36Å; K161-D200 PolarHBondContact N-OD2 3.07Å; K161-D200 PolarHBondContact O-N 3.37Å; K161-D200 VanDerWaalsContact O-N 3.12Å
201F94.6Very high93.6Very high19 Ų1953.9 Ų53.98%0.08329%0.288CS..EExtended strand (participates in β ladder)trans-123.1148.6-179-67.2-82.6000113.2V148 N160 K161 V162 A163 V199 F242 A245 E247V148-F201 HydrophobicContact CG1-CE1 4.41Å; V148-F201 HydrophobicContact CG2-CE1 4.17Å; N160-F201 HydrophobicContact CB-CD2 3.76Å; N160-F201 HydrophobicContact CB-CE2 3.96Å; N160-F201 VanDerWaalsContact ND2-CE2 3.27Å; N160-F201 WeakPolarHBondContact ND2-CE2 3.34Å; K161-F201 PolarHBondContact O-N 3.3Å; K161-F201 VanDerWaalsContact O-N 3.12Å; V162-F201 WeakPolarHBondContact CA-O 3.27Å; V162-F201 HydrophobicContact CG1-CB 4.38Å; V162-F201 HydrophobicContact CG2-CB 4.33Å; A163-F201 PolarHBondContact N-O 3.37Å; V199-F201 VanDerWaalsContact CG1-O 3.24Å; V199-F201 WeakPolarHBondContact CG1-O 3.45Å; F201-F242 HydrophobicContact CB-CB 4.37Å; F201-F242 HydrophobicContact CB-CD1 3.87Å; F201-F242 HydrophobicContact CB-CG 4.43Å; F201-F242 AromaticContact CD1-CD1 3.6Å; F201-F242 HydrophobicContact CD1-CD1 3.6Å; F201-F242 AromaticContact CD1-CE1 3.95Å; F201-F242 HydrophobicContact CD1-CE1 3.95Å; F201-F242 HydrophobicContact CE1-CD1 4.3Å; F201-F242 AromaticContact CG-CD1 3.78Å; F201-F242 HydrophobicContact CG-CD1 3.78Å; F201-A245 HydrophobicContact CE2-CB 4.43Å; F201-A245 HydrophobicContact CZ-CB 4.24Å; F201-E247 HydrophobicContact CE1-CB 3.98Å; F201-E247 HydrophobicContact CZ-CB 3.98Å
202Y95Very high93.6Very high14 Ų1449.2 Ų49.26%0.05527%0.267CS..EExtended strand (participates in β ladder)trans-122.3125.2178.9-60.1-83.7000109.8A163 F165 I192 V199 L219 R222 S230A163-Y202 HydrophobicContact CB-CD1 4.04Å; A163-Y202 HydrophobicContact CB-CE1 4.35Å; F165-Y202 AromaticContact CE2-CD1 3.57Å; F165-Y202 HydrophobicContact CE2-CD1 3.57Å; F165-Y202 HydrophobicContact CE2-CG 4.16Å; F165-Y202 AromaticContact CZ-CD1 3.86Å; F165-Y202 HydrophobicContact CZ-CD1 3.86Å; F165-Y202 HydrophobicContact CZ-CE1 4.4Å; I192-Y202 HydrophobicContact CD1-CD1 4.43Å; I192-Y202 HydrophobicContact CD1-CE1 3.85Å; V199-Y202 HydrophobicContact CB-CE1 4Å; V199-Y202 HydrophobicContact CG2-CE1 4.42Å; Y202-L219 HydrophobicContact CD1-CD1 4.22Å; Y202-L219 HydrophobicContact CD2-CD1 3.94Å; Y202-L219 HydrophobicContact CD2-CD2 4.41Å; Y202-L219 HydrophobicContact CE1-CD1 4.21Å; Y202-L219 HydrophobicContact CE1-CD2 4.35Å; Y202-L219 HydrophobicContact CE2-CD1 3.96Å; Y202-L219 HydrophobicContact CE2-CD2 3.62Å; Y202-L219 HydrophobicContact CE2-CG 4.39Å; Y202-L219 HydrophobicContact CG-CD1 4.07Å; Y202-R222 HydrophobicContact CD2-CB 4.31Å; Y202-R222 WeakPolarHBondContact CD2-O 3.27Å; Y202-R222 HydrophobicContact CE2-CB 4.19Å; Y202-S230 WeakPolarHBondContact O-CB 3.04Å
203V95.8Very high93.5Very high0 Ų053.6 Ų53.60%029%0.291CS..EExtended strand (participates in β ladder)trans-114.4138.2176176.40000108.1V162 A163 V164 F165 S230 M238 F242V162-V203 HydrophobicContact CG1-CB 4.43Å; V162-V203 HydrophobicContact CG1-CG2 3.68Å; A163-V203 PolarHBondContact O-N 3Å; V164-V203 CarbonylContact C-O 3.56Å; V164-V203 WeakPolarHBondContact CA-O 3.3Å; V164-V203 HydrophobicContact CG2-CB 4.39Å; F165-V203 PolarHBondContact N-O 3.22Å; V203-S230 WeakPolarHBondContact CA-O 3.18Å; V203-M238 HydrophobicContact CG1-CB 3.93Å; V203-M238 HydrophobicContact CG1-CE 3.51Å; V203-M238 HydrophobicContact CG1-CG 4.43Å; V203-M238 HydrophobicContact CG1-SD 3.66Å; V203-F242 HydrophobicContact CG2-CB 4.35Å; V203-F242 HydrophobicContact CG2-CD2 3.43Å; V203-F242 VanDerWaalsContact CG2-CD2 3.43Å; V203-F242 HydrophobicContact CG2-CE2 3.9Å; V203-F242 HydrophobicContact CG2-CG 3.9Å
204A96Very high93.5Very high0 Ų052.6 Ų52.60%029%0.291CS..EExtended strand (participates in β ladder)trans-134.7144.1-17900000112F165 M209 L212 P224 S230 I231 G232F165-A204 HydrophobicContact CB-CB 4.1Å; F165-A204 HydrophobicContact CD2-CB 4.38Å; A204-M209 HydrophobicContact CB-SD 3.89Å; A204-L212 HydrophobicContact CB-CD1 3.64Å; A204-P224 HydrophobicContact CB-CB 4.07Å; A204-P224 HydrophobicContact CB-CG 4.19Å; A204-S230 PolarHBondContact N-O 3.48Å; A204-I231 VanDerWaalsContact O-CA 3.27Å; A204-I231 WeakPolarHBondContact O-CA 3.4Å; A204-G232 PolarHBondContact O-N 2.96Å; A204-G232 VanDerWaalsContact O-N 3.17Å
205V95.7Very high93.5Very high2 Ų247.4 Ų47.41%0.01226%0.263CS..  trans-81.2141165.5172.80000109.1F165 T166 E207 I208 I235F165-V205 PolarHBondContact O-N 2.94Å; T166-V205 HydrophobicContact CG2-CB 4.18Å; T166-V205 HydrophobicContact CG2-CG2 3.54Å; V205-E207 HydrophobicContact CG1-CB 4.27Å; V205-E207 HydrophobicContact CG1-CG 4.23Å; V205-E207 PolarHBondContact O-N 3.04Å; V205-I208 VanDerWaalsContact O-CG2 3.27Å; V205-I208 WeakPolarHBondContact O-CG2 3.3Å; V205-I208 PolarHBondContact O-N 3.33Å; V205-I235 HydrophobicContact CG2-CD1 4.05Å; V205-I235 HydrophobicContact CG2-CG1 4.09Å
206P94.4Very high93.6Very high60 Ų6050 Ų5039%0.3926%0.264SS..G310 helixtrans-53.6-30.3-176.5-2833.3000114.8I208 M209 I231 G232P206-I208 PolarHBondContact O-N 3.47Å; P206-M209 WeakPolarHBondContact O-CB 3.36Å; P206-M209 WeakPolarHBondContact O-CG 3.43Å; P206-M209 PolarHBondContact O-N 3.2Å; P206-I231 HydrophobicContact CB-CG2 4.32Å; P206-I231 HydrophobicContact CG-CG2 3.79Å; P206-G232 WeakPolarHBondContact CD-O 3.32Å
207E93.8Very high93.5Very high121 Ų12152.4 Ų52.457%0.56527%0.273SS*.G310 helixtrans-63.8-36.7-177-62.1178.5179.100113N168 V205N168-E207 PolarHBondContact ND2-OE2 3Å; V205-E207 HydrophobicContact CG1-CB 4.27Å; V205-E207 HydrophobicContact CG1-CG 4.23Å; V205-E207 PolarHBondContact O-N 3.04Å
208I94.6Very high93.5Very high1 Ų155.3 Ų55.31%0.00529%0.285CS..G310 helixtrans-87.1-6.6-177.2-167.6158.4000113.5F165 V205 P206 G210 E211 L212F165-I208 HydrophobicContact CB-CG2 3.84Å; F165-I208 VanDerWaalsContact O-CG2 3.3Å; F165-I208 WeakPolarHBondContact O-CG2 3.46Å; V205-I208 VanDerWaalsContact O-CG2 3.27Å; V205-I208 WeakPolarHBondContact O-CG2 3.3Å; V205-I208 PolarHBondContact O-N 3.33Å; P206-I208 PolarHBondContact O-N 3.47Å; I208-G210 PolarHBondContact O-N 2.96Å; I208-E211 WeakPolarHBondContact CD1-OE2 3.46Å; I208-E211 HydrophobicContact CG1-CB 3.99Å; I208-E211 HydrophobicContact CG1-CG 4.32Å; I208-E211 WeakPolarHBondContact CG1-OE2 3Å; I208-E211 WeakPolarHBondContact O-CB 3.49Å; I208-E211 PolarHBondContact O-N 3.3Å; I208-L212 HydrophobicContact CG1-CD2 4.45Å; I208-L212 HydrophobicContact CG1-CG 4.46Å; I208-L212 HydrophobicContact CG2-CD1 4.22Å; I208-L212 HydrophobicContact CG2-CG 4.46Å; I208-L212 PolarHBondContact O-N 3.42Å
209M92.9Very high93.6Very high44 Ų4451.2 Ų51.222%0.21726%0.259CS..G310 helixtrans-55.3-30.3-174.7-73.7-66.3-62.200113.6A204 P206 E211 L212 F223 I231A204-M209 HydrophobicContact CB-SD 3.89Å; P206-M209 WeakPolarHBondContact O-CB 3.36Å; P206-M209 WeakPolarHBondContact O-CG 3.43Å; P206-M209 PolarHBondContact O-N 3.2Å; M209-E211 VanDerWaalsContact C-N 3.32Å; M209-E211 PolarHBondContact O-N 3.26Å; M209-L212 PolarHBondContact O-N 3.41Å; M209-L212 HydrophobicContact SD-CD1 4.03Å; M209-F223 HydrophobicContact CE-CE1 3.73Å; M209-F223 HydrophobicContact CE-CZ 3.85Å; M209-I231 HydrophobicContact CE-CD1 3.51Å; M209-I231 HydrophobicContact CE-CG1 4.44Å; M209-I231 HydrophobicContact CG-CG2 4.49Å; M209-I231 HydrophobicContact SD-CD1 3.71Å; M209-I231 HydrophobicContact SD-CG1 4.04Å
210G93Very high93.4Very high52 Ų5258.8 Ų58.854%0.53629%0.292SS..G310 helixtrans-63.1-35.417500000113.7I208 N213I208-G210 PolarHBondContact O-N 2.96Å; G210-N213 PolarHBondContact O-ND2 3.28Å
211E92.9Very high93.1Very high88 Ų8860.7 Ų60.741%0.41130%0.297SS..THydrogen-bonded Turntrans-80.2-24179.3-56.9-176.2166.900112.3T186 I208 M209 N213 P214T186-E211 HydrophobicContact CG2-CB 4.35Å; T186-E211 HydrophobicContact CG2-CG 4.32Å; T186-E211 WeakPolarHBondContact CG2-OE2 3.43Å; I208-E211 WeakPolarHBondContact CD1-OE2 3.46Å; I208-E211 HydrophobicContact CG1-CB 3.99Å; I208-E211 HydrophobicContact CG1-CG 4.32Å; I208-E211 WeakPolarHBondContact CG1-OE2 3Å; I208-E211 WeakPolarHBondContact O-CB 3.49Å; I208-E211 PolarHBondContact O-N 3.3Å; M209-E211 VanDerWaalsContact C-N 3.32Å; M209-E211 PolarHBondContact O-N 3.26Å; E211-N213 PolarHBondContact O-N 2.9Å; E211-P214 WeakPolarHBondContact O-CD 3.03Å
212L94Very high92.9Very high0 Ų065.7 Ų65.70%032%0.315CS..THydrogen-bonded Turntrans-77.7-5.7179.5-57-177.1000113.7F165 V189 A204 I208 M209 L215 F223F165-L212 HydrophobicContact CB-CD1 3.89Å; F165-L212 HydrophobicContact CB-CD2 3.96Å; F165-L212 HydrophobicContact CB-CG 4.49Å; F165-L212 HydrophobicContact CD1-CD2 3.56Å; F165-L212 HydrophobicContact CD2-CD1 3.82Å; F165-L212 HydrophobicContact CD2-CD2 4.01Å; F165-L212 HydrophobicContact CE1-CD2 3.93Å; F165-L212 HydrophobicContact CE2-CD1 4.48Å; F165-L212 HydrophobicContact CE2-CD2 4.32Å; F165-L212 HydrophobicContact CG-CD1 3.93Å; F165-L212 HydrophobicContact CG-CD2 3.59Å; F165-L212 HydrophobicContact CG-CG 4.42Å; F165-L212 HydrophobicContact CZ-CD2 4.27Å; V189-L212 HydrophobicContact CG2-CD2 3.49Å; V189-L212 VanDerWaalsContact CG2-CD2 3.49Å; A204-L212 HydrophobicContact CB-CD1 3.64Å; I208-L212 HydrophobicContact CG1-CD2 4.45Å; I208-L212 HydrophobicContact CG1-CG 4.46Å; I208-L212 HydrophobicContact CG2-CD1 4.22Å; I208-L212 HydrophobicContact CG2-CG 4.46Å; I208-L212 PolarHBondContact O-N 3.42Å; M209-L212 PolarHBondContact O-N 3.41Å; M209-L212 HydrophobicContact SD-CD1 4.03Å; L212-L215 HydrophobicContact CD2-CD1 4.16Å; L212-L215 WeakPolarHBondContact O-CB 3.29Å; L212-L215 PolarHBondContact O-N 3.45Å; L212-F223 HydrophobicContact CB-CE2 3.99Å; L212-F223 HydrophobicContact CB-CZ 4.18Å; L212-F223 WeakPolarHBondContact O-CE2 3.38Å
213N93.4Very high92.8Very high96 Ų9665.9 Ų65.951%0.51332%0.316SS..THydrogen-bonded Turntrans-50.8-41.4-178.8-79.2-32.6000115.1G210 E211 L215 R216G210-N213 PolarHBondContact O-ND2 3.28Å; E211-N213 PolarHBondContact O-N 2.9Å; N213-L215 VanDerWaalsContact C-N 3.26Å; N213-L215 PolarHBondContact O-N 3.49Å; N213-R216 VanDerWaalsContact O-CB 3.28Å; N213-R216 WeakPolarHBondContact O-CB 3.35Å; N213-R216 PolarHBondContact O-N 3.24Å
214P92.2Very high92.7Very high67 Ų6766 Ų6644%0.43532%0.317SS..THydrogen-bonded Turntrans-60.4-33.4176.4-2436000113.4M193 E211 R216M193-P214 HydrophobicContact CE-CB 4.29Å; M193-P214 HydrophobicContact SD-CB 3.74Å; E211-P214 WeakPolarHBondContact O-CD 3.03Å; P214-R216 PolarHBondContact O-N 3.38Å
215L93.5Very high92.5Very high1 Ų170.4 Ų70.41%0.00534%0.336CS..Hα-helixtrans-70.7-18.5-179.9-66.8176.7000113.3F165 V189 I192 M193 L212 N213 K217 K218 L219 F223F165-L215 HydrophobicContact CE1-CD1 4.07Å; F165-L215 HydrophobicContact CE2-CD1 4.41Å; F165-L215 HydrophobicContact CZ-CD1 3.67Å; V189-L215 HydrophobicContact CB-CD1 4.28Å; V189-L215 HydrophobicContact CG1-CD1 4.04Å; V189-L215 HydrophobicContact CG1-CD2 4.21Å; V189-L215 HydrophobicContact CG1-CG 3.85Å; V189-L215 HydrophobicContact CG2-CD1 3.92Å; I192-L215 HydrophobicContact CB-CD2 4.12Å; I192-L215 HydrophobicContact CG2-CD2 3.74Å; M193-L215 HydrophobicContact CG-CD2 3.66Å; L212-L215 HydrophobicContact CD2-CD1 4.16Å; L212-L215 WeakPolarHBondContact O-CB 3.29Å; L212-L215 PolarHBondContact O-N 3.45Å; N213-L215 VanDerWaalsContact C-N 3.26Å; N213-L215 PolarHBondContact O-N 3.49Å; L215-K217 VanDerWaalsContact C-N 3.27Å; L215-K217 PolarHBondContact O-N 3.29Å; L215-K218 PolarHBondContact O-N 3.42Å; L215-L219 HydrophobicContact CB-CD1 4.1Å; L215-L219 HydrophobicContact CB-CG 4.31Å; L215-L219 HydrophobicContact CD1-CD1 4.42Å; L215-L219 PolarHBondContact O-N 2.9Å; L215-F223 HydrophobicContact CB-CE2 4.49Å
216R92.5Very high92.2Very high166 Ų16673.6 Ų73.663%0.62636%0.363SS*.Hα-helixtrans-56.7-39.9-177.6-172173.8179156.3-0.4112.6N213 P214 K220 F223N213-R216 VanDerWaalsContact O-CB 3.28Å; N213-R216 WeakPolarHBondContact O-CB 3.35Å; N213-R216 PolarHBondContact O-N 3.24Å; P214-R216 PolarHBondContact O-N 3.38Å; R216-K220 WeakPolarHBondContact O-CA 3.32Å; R216-K220 PolarHBondContact O-N 3.48Å; R216-F223 HydrophobicContact CB-CD2 4.3Å; R216-F223 HydrophobicContact CB-CE2 4.33Å
217K91.4Very high91.9Very high185 Ų18575.9 Ų75.980%0.80438%0.376SS*.Hα-helixtrans-71.8-33.6177.6-70.3-176-179.6178.20112.6L215 K220L215-K217 VanDerWaalsContact C-N 3.27Å; L215-K217 PolarHBondContact O-N 3.29Å; K217-K220 VanDerWaalsContact O-CG 3.23Å; K217-K220 WeakPolarHBondContact O-CG 3.49Å
218K92.1Very high91.7Very high73 Ų7371 Ų7132%0.31735%0.352SS..Hα-helixtrans-78.2-54.1-177.4-171.9168.5-168.8169.60111.8I192 M193 D195 L215I192-K218 VanDerWaalsContact O-CE 3.29Å; I192-K218 WeakPolarHBondContact O-CE 3.32Å; I192-K218 PolarHBondContact O-NZ 3.12Å; M193-K218 PolarHBondContact O-NZ 3.43Å; D195-K218 WeakPolarHBondContact OD1-CE 3.43Å; D195-K218 IonicContact OD1-NZ 3.63Å; D195-K218 PolarHBondContact OD1-NZ 3.25Å; D195-K218 IonicContact OD2-NZ 3.38Å; D195-K218 PolarHBondContact OD2-NZ 2.69Å; L215-K218 PolarHBondContact O-N 3.42Å
219L91.4Very high91.5Very high19 Ų1976.5 Ų76.510%0.09938%0.382CS..Hα-helixtrans-74.6-27-177-62.4-177.9000112.7I192 Y202 L215 K221 R222 F223I192-L219 HydrophobicContact CG2-CD2 4.35Å; Y202-L219 HydrophobicContact CD1-CD1 4.22Å; Y202-L219 HydrophobicContact CD2-CD1 3.94Å; Y202-L219 HydrophobicContact CD2-CD2 4.41Å; Y202-L219 HydrophobicContact CE1-CD1 4.21Å; Y202-L219 HydrophobicContact CE1-CD2 4.35Å; Y202-L219 HydrophobicContact CE2-CD1 3.96Å; Y202-L219 HydrophobicContact CE2-CD2 3.62Å; Y202-L219 HydrophobicContact CE2-CG 4.39Å; Y202-L219 HydrophobicContact CG-CD1 4.07Å; L215-L219 HydrophobicContact CB-CD1 4.1Å; L215-L219 HydrophobicContact CB-CG 4.31Å; L215-L219 HydrophobicContact CD1-CD1 4.42Å; L215-L219 PolarHBondContact O-N 2.9Å; L219-K221 PolarHBondContact O-N 2.74Å; L219-R222 HydrophobicContact CB-CB 4.28Å; L219-R222 PolarHBondContact O-N 2.84Å; L219-F223 HydrophobicContact CB-CB 4.17Å; L219-F223 HydrophobicContact CD1-CD2 4.48Å
220K89.9Confident91.5Very high159 Ų15974.6 Ų74.669%0.69137%0.373SS*.G310 helixtrans47.5-102.5-179.4-59.6-178.7-178.3176.70112.1R216 K217 R222 F223R216-K220 WeakPolarHBondContact O-CA 3.32Å; R216-K220 PolarHBondContact O-N 3.48Å; K217-K220 VanDerWaalsContact O-CG 3.23Å; K217-K220 WeakPolarHBondContact O-CG 3.49Å; K220-R222 VanDerWaalsContact C-N 3.34Å; K220-F223 PolarHBondContact O-N 3.25Å
221K86.8Confident91.6Very high108 Ų10874.1 Ų74.147%0.4736%0.357SS..G310 helixtrans-69.6-29.4179.9-57-165.9-174.2-177.40111.8L219 F223 R228 M249 D251L219-K221 PolarHBondContact O-N 2.74Å; K221-F223 VanDerWaalsContact C-N 3.31Å; K221-F223 PolarHBondContact O-N 3.18Å; K221-R228 PolarHBondContact O-NH1 2.56Å; K221-R228 PolarHBondContact O-NH2 2.7Å; K221-M249 HydrophobicContact CB-SD 4.35Å; K221-M249 HydrophobicContact CD-CE 4.22Å; K221-M249 HydrophobicContact CD-SD 3.23Å; K221-M249 WeakPolarHBondContact CD-SD 3.4Å; K221-M249 HydrophobicContact CG-SD 4.4Å; K221-D251 IonicContact NZ-OD1 2.71Å
222R89.6Confident91.7Very high124 Ų12470.8 Ų70.847%0.46835%0.347SS..G310 helixtrans-81.5-3.5179.8-62.7-172.6177.4-169.1-0.5114.5Y202 L219 K220Y202-R222 HydrophobicContact CD2-CB 4.31Å; Y202-R222 WeakPolarHBondContact CD2-O 3.27Å; Y202-R222 HydrophobicContact CE2-CB 4.19Å; L219-R222 HydrophobicContact CB-CB 4.28Å; L219-R222 PolarHBondContact O-N 2.84Å; K220-R222 VanDerWaalsContact C-N 3.34Å
223F92.8Very high91.6Very high18 Ų1880 Ų808%0.07938%0.381CS..SBendtrans-62.1141-179.1-175.6-100000110.9M209 L212 L215 R216 L219 K220 K221 K225M209-F223 HydrophobicContact CE-CE1 3.73Å; M209-F223 HydrophobicContact CE-CZ 3.85Å; L212-F223 HydrophobicContact CB-CE2 3.99Å; L212-F223 HydrophobicContact CB-CZ 4.18Å; L212-F223 WeakPolarHBondContact O-CE2 3.38Å; L215-F223 HydrophobicContact CB-CE2 4.49Å; R216-F223 HydrophobicContact CB-CD2 4.3Å; R216-F223 HydrophobicContact CB-CE2 4.33Å; L219-F223 HydrophobicContact CB-CB 4.17Å; L219-F223 HydrophobicContact CD1-CD2 4.48Å; K220-F223 PolarHBondContact O-N 3.25Å; K221-F223 VanDerWaalsContact C-N 3.31Å; K221-F223 PolarHBondContact O-N 3.18Å; F223-K225 PolarHBondContact O-N 3.28Å
224P93.6Very high91.7Very high2 Ų280.6 Ų80.61%0.01339%0.385CS..  trans-53.1130.8175.6-27.233.9000112.6F165 A204 S230 I231F165-P224 HydrophobicContact CD2-CG 4.5Å; A204-P224 HydrophobicContact CB-CB 4.07Å; A204-P224 HydrophobicContact CB-CG 4.19Å; P224-S230 WeakPolarHBondContact CA-OG 3.49Å; P224-I231 HydrophobicContact CB-CG1 4.05Å
225K92.5Very high91.8Very high93 Ų9377.6 Ų77.640%0.40437%0.365SS..  trans-134.6140.8179.3-71.9-176.5-179.5-173.50110.8F223 T227 R228 S230F223-K225 PolarHBondContact O-N 3.28Å; K225-T227 PolarHBondContact O-N 3.1Å; K225-R228 HydrophobicContact CB-CG 4.34Å; K225-R228 PolarHBondContact O-N 2.83Å; K225-R228 VanDerWaalsContact O-N 3.09Å; K225-S230 PolarHBondContact N-OG 2.82Å; K225-S230 PolarHBondContact O-N 3.43Å; K225-S230 PolarHBondContact O-OG 2.89Å
226A90Very high91.9Very high68 Ų6879.8 Ų79.856%0.56238%0.379SS*.G310 helixtrans-61.1-34.8174.200000111.8R228 N229 I231A226-R228 PolarHBondContact O-N 2.71Å; A226-R228 VanDerWaalsContact O-N 3.17Å; A226-N229 PolarHBondContact O-N 3.26Å; A226-I231 HydrophobicContact CB-CD1 4.43Å
227T86.9Confident92Very high109 Ų10978.1 Ų78.167%0.66938%0.376SS*.G310 helixtrans-63.1-21177.160.10000113.9K225K225-T227 PolarHBondContact O-N 3.1Å
228R89Confident92.1Very high17 Ų1770 Ų706%0.06434%0.342CS..G310 helixtrans-97.53.6176.6-65.4-177.2-177.2-1721.4112.7A146 V148 K221 K225 A226 S230 E247A146-R228 VanDerWaalsContact O-CG 3.27Å; A146-R228 WeakPolarHBondContact O-CG 3.46Å; A146-R228 PolarHBondContact O-NE 2.68Å; V148-R228 HydrophobicContact CG2-CB 4.25Å; V148-R228 HydrophobicContact CG2-CG 4.41Å; K221-R228 PolarHBondContact O-NH1 2.56Å; K221-R228 PolarHBondContact O-NH2 2.7Å; K225-R228 HydrophobicContact CB-CG 4.34Å; K225-R228 PolarHBondContact O-N 2.83Å; K225-R228 VanDerWaalsContact O-N 3.09Å; A226-R228 PolarHBondContact O-N 2.71Å; A226-R228 VanDerWaalsContact O-N 3.17Å; R228-S230 PolarHBondContact O-N 3.39Å; R228-S230 VanDerWaalsContact O-N 3.16Å; R228-E247 IonicContact CZ-OE1 3.16Å; R228-E247 IonicContact NH1-OE1 2.73Å; R228-E247 PolarHBondContact NH1-OE1 2.89Å; R228-E247 IonicContact NH2-OE1 3.92Å; R228-E247 PolarHBondContact NH2-OE1 3.28Å; R228-E247 VanDerWaalsContact NH2-OE1 3.14Å
229N90.6Very high92.2Very high118 Ų11866.6 Ų66.663%0.63133%0.327SS*.THydrogen-bonded Turntrans55.826.2-171.1-53.8-45.8000113.5A226 I231A226-N229 PolarHBondContact O-N 3.26Å; N229-I231 VanDerWaalsContact C-N 3.33Å
230S93.2Very high92.3Very high4 Ų471.7 Ų71.73%0.02835%0.35CS..  trans-92.44.1178.180.80000112.9Y202 V203 A204 P224 K225 R228 F242Y202-S230 WeakPolarHBondContact O-CB 3.04Å; V203-S230 WeakPolarHBondContact CA-O 3.18Å; A204-S230 PolarHBondContact N-O 3.48Å; P224-S230 WeakPolarHBondContact CA-OG 3.49Å; K225-S230 PolarHBondContact N-OG 2.82Å; K225-S230 PolarHBondContact O-N 3.43Å; K225-S230 PolarHBondContact O-OG 2.89Å; R228-S230 PolarHBondContact O-N 3.39Å; R228-S230 VanDerWaalsContact O-N 3.16Å; S230-F242 VanDerWaalsContact CB-CZ 3.42Å
231I95.2Very high92.5Very high42 Ų4268.2 Ų68.222%0.21534%0.339CS..BIsolated β-bridgetrans-121.5117.6173.7-55.5171.3000107.7A204 P206 M209 P224 A226 N229A204-I231 VanDerWaalsContact O-CA 3.27Å; A204-I231 WeakPolarHBondContact O-CA 3.4Å; P206-I231 HydrophobicContact CB-CG2 4.32Å; P206-I231 HydrophobicContact CG-CG2 3.79Å; M209-I231 HydrophobicContact CE-CD1 3.51Å; M209-I231 HydrophobicContact CE-CG1 4.44Å; M209-I231 HydrophobicContact CG-CG2 4.49Å; M209-I231 HydrophobicContact SD-CD1 3.71Å; M209-I231 HydrophobicContact SD-CG1 4.04Å; P224-I231 HydrophobicContact CB-CG1 4.05Å; A226-I231 HydrophobicContact CB-CD1 4.43Å; N229-I231 VanDerWaalsContact C-N 3.33Å
232G94.4Very high92.8Very high18 Ų1863.4 Ų63.419%0.18632%0.318CS..  trans-169.5170.8-175.200000112.1A204 P206 M238A204-G232 PolarHBondContact O-N 2.96Å; A204-G232 VanDerWaalsContact O-N 3.17Å; P206-G232 WeakPolarHBondContact CD-O 3.32Å; G232-M238 VanDerWaalsContact O-CE 3.3Å; G232-M238 WeakPolarHBondContact O-CE 3.45Å
233R93.4Very high93Very high192 Ų19260.1 Ų60.173%0.72531%0.307SS*.SBendtrans-93.6-28.2177.3-65.1-179.9177.5174.1-1.9112.4I235R233-I235 PolarHBondContact O-N 3.3Å
234D94.6Very high92.9Very high110 Ų11062.2 Ų62.259%0.58832%0.321SS*.  trans-84.181.6-177.5-60.3-26.3000111.5K237 M238D234-K237 HydrophobicContact CB-CB 4.2Å; D234-M238 WeakPolarHBondContact O-CE 3.27Å; D234-M238 WeakPolarHBondContact O-CG 3.28Å; D234-M238 PolarHBondContact O-N 3.16Å; D234-M238 VanDerWaalsContact O-N 3.14Å
235I94.4Very high92.8Very high4 Ų462.5 Ų62.52%0.02132%0.324CS..Hα-helixtrans-57.3-46.9-178.1-61.5165.8000113.2V164 T166 E171 A175 V205 R233 K237 M238 L239V164-I235 HydrophobicContact CG1-CD1 4.42Å; V164-I235 HydrophobicContact CG1-CG1 4.47Å; V164-I235 HydrophobicContact CG1-CG2 4.03Å; V164-I235 HydrophobicContact CG2-CG2 4.39Å; T166-I235 HydrophobicContact CG2-CD1 3.63Å; E171-I235 HydrophobicContact CB-CD1 3.53Å; E171-I235 HydrophobicContact CG-CD1 3.83Å; A175-I235 HydrophobicContact CB-CG2 3.93Å; V205-I235 HydrophobicContact CG2-CD1 4.05Å; V205-I235 HydrophobicContact CG2-CG1 4.09Å; R233-I235 PolarHBondContact O-N 3.3Å; I235-K237 PolarHBondContact O-N 3.29Å; I235-M238 HydrophobicContact CG1-CE 4.35Å; I235-M238 PolarHBondContact O-N 3.48Å; I235-L239 HydrophobicContact CG2-CD1 3.74Å; I235-L239 HydrophobicContact CG2-CG 4.17Å; I235-L239 WeakPolarHBondContact O-CB 3.43Å; I235-L239 WeakPolarHBondContact O-CG 3.45Å; I235-L239 PolarHBondContact O-N 3Å
236P95Very high92.9Very high46 Ų4659.5 Ų59.530%0.29931%0.311SS..Hα-helixtrans-60.1-46.4-177.1-23.834.6000112.4I174 M238 L239 E240I174-P236 HydrophobicContact CG2-CG 3.81Å; P236-M238 PolarHBondContact O-N 3.24Å; P236-L239 PolarHBondContact O-N 2.84Å; P236-E240 WeakPolarHBondContact O-CG 3.44Å; P236-E240 PolarHBondContact O-N 3.32Å
237K94.5Very high93Very high131 Ų13158.9 Ų58.957%0.5730%0.297SS*.Hα-helixtrans-63.5-41.1179.3-175.4178.3179.6179.70112.1D234 I235 L241D234-K237 HydrophobicContact CB-CB 4.2Å; I235-K237 PolarHBondContact O-N 3.29Å; K237-L241 WeakPolarHBondContact O-CG 3.35Å; K237-L241 PolarHBondContact O-N 3Å
238M94.5Very high93.3Very high15 Ų1553.7 Ų53.77%0.07427%0.265CS..Hα-helixtrans-64.5-44.2175.2-70.3-173.8-66.500110.8V203 G232 D234 I235 P236 E240 L241 F242V203-M238 HydrophobicContact CG1-CB 3.93Å; V203-M238 HydrophobicContact CG1-CE 3.51Å; V203-M238 HydrophobicContact CG1-CG 4.43Å; V203-M238 HydrophobicContact CG1-SD 3.66Å; G232-M238 VanDerWaalsContact O-CE 3.3Å; G232-M238 WeakPolarHBondContact O-CE 3.45Å; D234-M238 WeakPolarHBondContact O-CE 3.27Å; D234-M238 WeakPolarHBondContact O-CG 3.28Å; D234-M238 PolarHBondContact O-N 3.16Å; D234-M238 VanDerWaalsContact O-N 3.14Å; I235-M238 HydrophobicContact CG1-CE 4.35Å; I235-M238 PolarHBondContact O-N 3.48Å; P236-M238 PolarHBondContact O-N 3.24Å; M238-E240 PolarHBondContact O-N 3.47Å; M238-L241 PolarHBondContact O-N 3.45Å; M238-F242 HydrophobicContact CB-CD2 4.29Å; M238-F242 WeakPolarHBondContact O-CD2 3.37Å; M238-F242 PolarHBondContact O-N 2.88Å
239L94.6Very high93.4Very high1 Ų155.7 Ų55.71%0.00528%0.275CS..Hα-helixtrans-60.2-43.3178.7-77.7174.3000112.6V162 V164 A175 N178 A180 I235 P236 L241 F242 K243V162-L239 HydrophobicContact CB-CD2 4Å; V162-L239 HydrophobicContact CG1-CD2 3.78Å; V164-L239 HydrophobicContact CG2-CD1 4.26Å; V164-L239 HydrophobicContact CG2-CD2 3.58Å; V164-L239 HydrophobicContact CG2-CG 4.12Å; A175-L239 HydrophobicContact CB-CD1 4.41Å; N178-L239 HydrophobicContact CB-CD1 3.58Å; A180-L239 HydrophobicContact CB-CD1 4.15Å; A180-L239 HydrophobicContact CB-CD2 4.02Å; I235-L239 HydrophobicContact CG2-CD1 3.74Å; I235-L239 HydrophobicContact CG2-CG 4.17Å; I235-L239 WeakPolarHBondContact O-CB 3.43Å; I235-L239 WeakPolarHBondContact O-CG 3.45Å; I235-L239 PolarHBondContact O-N 3Å; P236-L239 PolarHBondContact O-N 2.84Å; L239-L241 VanDerWaalsContact C-N 3.3Å; L239-L241 PolarHBondContact O-N 2.96Å; L239-F242 PolarHBondContact O-N 3.32Å; L239-K243 VanDerWaalsContact O-CB 3.32Å; L239-K243 WeakPolarHBondContact O-CB 3.3Å; L239-K243 WeakPolarHBondContact O-CD 3.02Å; L239-K243 WeakPolarHBondContact O-CG 3.24Å; L239-K243 PolarHBondContact O-N 3.31Å
240E93.1Very high93.5Very high127 Ų12750.2 Ų50.259%0.59325%0.246SC*.Hα-helixtrans-57.4-43.3175.6-73.3174.5-178.400112.3P236 M238P236-E240 WeakPolarHBondContact O-CG 3.44Å; P236-E240 PolarHBondContact O-N 3.32Å; M238-E240 PolarHBondContact O-N 3.47Å
241L92.8Very high93.3Very high86 Ų8651.9 Ų51.945%0.4526%0.255SS..Hα-helixtrans-69-48.8177.9-66.3173.2000111.9K237 M238 L239 K243 T244 A245K237-L241 WeakPolarHBondContact O-CG 3.35Å; K237-L241 PolarHBondContact O-N 3Å; M238-L241 PolarHBondContact O-N 3.45Å; L239-L241 VanDerWaalsContact C-N 3.3Å; L239-L241 PolarHBondContact O-N 2.96Å; L241-K243 VanDerWaalsContact C-N 3.33Å; L241-K243 PolarHBondContact O-N 3.19Å; L241-T244 PolarHBondContact O-N 3.35Å; L241-A245 WeakPolarHBondContact O-CA 3.48Å; L241-A245 WeakPolarHBondContact O-CB 3.41Å; L241-A245 PolarHBondContact O-N 3.01Å
242F94.3Very high92.7Very high7 Ų755.3 Ų55.33%0.03127%0.27CS..Hα-helixtrans-72.5-23.9-174-80.3-74.9000113.9V148 N160 V162 F201 V203 S230 M238 L239 T244 A245V148-F242 HydrophobicContact CB-CE1 4.3Å; V148-F242 HydrophobicContact CG1-CD1 4.25Å; V148-F242 HydrophobicContact CG1-CE1 3.91Å; V148-F242 HydrophobicContact CG2-CE1 4.1Å; N160-F242 WeakPolarHBondContact CB-O 3.26Å; N160-F242 PolarHBondContact ND2-O 3.29Å; V162-F242 HydrophobicContact CG1-CB 4.08Å; V162-F242 HydrophobicContact CG2-CB 3.8Å; F201-F242 HydrophobicContact CB-CB 4.37Å; F201-F242 HydrophobicContact CB-CD1 3.87Å; F201-F242 HydrophobicContact CB-CG 4.43Å; F201-F242 AromaticContact CD1-CD1 3.6Å; F201-F242 HydrophobicContact CD1-CD1 3.6Å; F201-F242 AromaticContact CD1-CE1 3.95Å; F201-F242 HydrophobicContact CD1-CE1 3.95Å; F201-F242 HydrophobicContact CE1-CD1 4.3Å; F201-F242 AromaticContact CG-CD1 3.78Å; F201-F242 HydrophobicContact CG-CD1 3.78Å; V203-F242 HydrophobicContact CG2-CB 4.35Å; V203-F242 HydrophobicContact CG2-CD2 3.43Å; V203-F242 VanDerWaalsContact CG2-CD2 3.43Å; V203-F242 HydrophobicContact CG2-CE2 3.9Å; V203-F242 HydrophobicContact CG2-CG 3.9Å; S230-F242 VanDerWaalsContact CB-CZ 3.42Å; M238-F242 HydrophobicContact CB-CD2 4.29Å; M238-F242 WeakPolarHBondContact O-CD2 3.37Å; M238-F242 PolarHBondContact O-N 2.88Å; L239-F242 PolarHBondContact O-N 3.32Å; F242-T244 VanDerWaalsContact C-N 3.32Å; F242-T244 PolarHBondContact O-N 3.44Å; F242-A245 HydrophobicContact CD1-CB 4.34Å
243K92.7Very high92.3Very high55 Ų5563.8 Ų63.824%0.23931%0.305CS..Hα-helixtrans-63.1-35.5174.8-83.4174.6-178.9-173.10113.7V159 N160 V162 N178 L239 L241V159-K243 HydrophobicContact CG1-CB 3.7Å; V159-K243 HydrophobicContact CG1-CD 4.31Å; V159-K243 HydrophobicContact CG1-CG 3.85Å; N160-K243 PolarHBondContact N-O 2.98Å; N160-K243 PolarHBondContact ND2-O 2.93Å; V162-K243 HydrophobicContact CG2-CG 4.37Å; N178-K243 VanDerWaalsContact O-CE 3.23Å; N178-K243 WeakPolarHBondContact O-CE 3.27Å; N178-K243 PolarHBondContact O-NZ 3.32Å; L239-K243 VanDerWaalsContact O-CB 3.32Å; L239-K243 WeakPolarHBondContact O-CB 3.3Å; L239-K243 WeakPolarHBondContact O-CD 3.02Å; L239-K243 WeakPolarHBondContact O-CG 3.24Å; L239-K243 PolarHBondContact O-N 3.31Å; L241-K243 VanDerWaalsContact C-N 3.33Å; L241-K243 PolarHBondContact O-N 3.19Å
244T92Very high92Very high61 Ų6162.4 Ų62.437%0.37430%0.3SS..Hα-helixtrans-113.5-0.1-178.560.30000113L154 L241 F242L154-T244 HydrophobicContact CD1-CG2 3.95Å; L241-T244 PolarHBondContact O-N 3.35Å; F242-T244 VanDerWaalsContact C-N 3.32Å; F242-T244 PolarHBondContact O-N 3.44Å
245A91.2Very high91.5Very high8 Ų865 Ų657%0.06631%0.308CS..  trans-55.3144.4179.500000113.6V148 N160 F201 L241 F242V148-A245 HydrophobicContact CG1-CB 3.32Å; N160-A245 PolarHBondContact ND2-O 3.24Å; F201-A245 HydrophobicContact CE2-CB 4.43Å; F201-A245 HydrophobicContact CZ-CB 4.24Å; L241-A245 WeakPolarHBondContact O-CA 3.48Å; L241-A245 WeakPolarHBondContact O-CB 3.41Å; L241-A245 PolarHBondContact O-N 3.01Å; F242-A245 HydrophobicContact CD1-CB 4.34Å
246H93.5Very high91.2Very high31 Ų3167 Ų6714%0.14432%0.319CS..EExtended strand (participates in β ladder)trans-112.3123.7168.1-17165.2000109.7V148 I149 L151 K261V148-H246 WeakPolarHBondContact CA-O 3.47Å; I149-H246 PolarHBondContact N-O 3.32Å; I149-H246 PolarHBondContact O-N 2.73Å; L151-H246 HydrophobicContact CD1-CB 3.95Å; L151-H246 HydrophobicContact CG-CB 3.97Å; H246-K261 PolarHBondContact CE1-O 2.72Å; H246-K261 PolarHBondContact NE2-O 3.19Å; H246-K261 VanDerWaalsContact NE2-O 3.16Å
247E92.1Very high91.1Very high55 Ų5566.9 Ų66.926%0.25731%0.314SS..EExtended strand (participates in β ladder)trans-87.1132.1176.3-172176.3-161.300110.5F201 R228F201-E247 HydrophobicContact CE1-CB 3.98Å; F201-E247 HydrophobicContact CZ-CB 3.98Å; R228-E247 IonicContact CZ-OE1 3.16Å; R228-E247 IonicContact NH1-OE1 2.73Å; R228-E247 PolarHBondContact NH1-OE1 2.89Å; R228-E247 IonicContact NH2-OE1 3.92Å; R228-E247 PolarHBondContact NH2-OE1 3.28Å; R228-E247 VanDerWaalsContact NH2-OE1 3.14Å
248I93.5Very high91.1Very high0 Ų060.7 Ų60.70%029%0.287CS..EExtended strand (participates in β ladder)trans-120.1132173-67.8145.9000108.4A146 S147 I149 L258 T260 V279 V283A146-I248 CarbonylContact C-O 3.4Å; A146-I248 VanDerWaalsContact CA-O 3.24Å; A146-I248 WeakPolarHBondContact CA-O 3.4Å; S147-I248 PolarHBondContact N-O 3.06Å; S147-I248 PolarHBondContact O-N 2.91Å; I149-I248 HydrophobicContact CB-CD1 4.44Å; I149-I248 HydrophobicContact CD1-CD1 3.04Å; I149-I248 HydrophobicContact CG1-CD1 3.73Å; I248-L258 HydrophobicContact CG2-CD1 3.27Å; I248-L258 HydrophobicContact CG2-CD2 3.86Å; I248-L258 HydrophobicContact CG2-CG 3.61Å; I248-T260 HydrophobicContact CB-CG2 4.08Å; I248-T260 HydrophobicContact CG1-CG2 3.71Å; I248-T260 HydrophobicContact CG2-CG2 3.96Å; I248-V279 HydrophobicContact CD1-CB 4.4Å; I248-V279 HydrophobicContact CD1-CG1 3.85Å; I248-V279 HydrophobicContact CD1-CG2 4.06Å; I248-V279 HydrophobicContact CG1-CG1 4.45Å; I248-V283 HydrophobicContact CG2-CG2 4.35Å
249M91.9Very high91.1Very high58 Ų5862 Ų6229%0.28630%0.297SS..EExtended strand (participates in β ladder)trans-135.1137.1-175.7-178.3173.566.400110.2A146 K221A146-M249 HydrophobicContact CB-CB 4.29Å; A146-M249 HydrophobicContact CB-CG 4.2Å; K221-M249 HydrophobicContact CB-SD 4.35Å; K221-M249 HydrophobicContact CD-CE 4.22Å; K221-M249 HydrophobicContact CD-SD 3.23Å; K221-M249 WeakPolarHBondContact CD-SD 3.4Å; K221-M249 HydrophobicContact CG-SD 4.4Å
250V91.9Very high91.1Very high3 Ų362.4 Ų62.42%0.01830%0.3CS..EExtended strand (participates in β ladder)trans-91125.5172.5-176.20000108.6L132 M134 F145 N256 L258L132-V250 HydrophobicContact CD1-CG1 4.31Å; L132-V250 HydrophobicContact CD1-CG2 3.64Å; M134-V250 HydrophobicContact CE-CG1 4.1Å; F145-V250 HydrophobicContact CD1-CG2 4.5Å; F145-V250 HydrophobicContact CD2-CG2 4.45Å; F145-V250 HydrophobicContact CE1-CG2 4.15Å; F145-V250 HydrophobicContact CE2-CG2 4.08Å; F145-V250 HydrophobicContact CZ-CG2 3.92Å; F145-V250 PolarHBondContact O-N 3.46Å; V250-N256 HydrophobicContact CG1-CB 4.26Å; V250-L258 HydrophobicContact CG2-CB 4.48Å; V250-L258 HydrophobicContact CG2-CD1 4.09Å
251D89.4Confident91.3Very high40 Ų4059.3 Ų59.321%0.21429%0.285CS..EExtended strand (participates in β ladder)trans-93.5106.6174.8-72-32.5000110.3K221 R254 N256 F257K221-D251 IonicContact NZ-OD1 2.71Å; D251-R254 HydrophobicContact CB-CB 4.22Å; D251-R254 HydrophobicContact CB-CG 4.45Å; D251-R254 PolarHBondContact O-N 3.43Å; D251-N256 WeakPolarHBondContact O-CA 3.41Å; D251-N256 PolarHBondContact O-N 3.12Å; D251-F257 WeakPolarHBondContact CB-O 3.47Å; D251-F257 PolarHBondContact N-O 3.34Å; D251-F257 PolarHBondContact O-N 2.89Å
252E83.9Confident91.4Very high113 Ų11355.2 Ų55.253%0.52826%0.263SS..G310 helixtrans-62.9-41.4176.8-61.6-17312500112.7P144 R254 Q255P144-E252 VanDerWaalsContact CB-CD 3.43Å; P144-E252 HydrophobicContact CB-CG 3.38Å; P144-E252 WeakPolarHBondContact CB-OE1 3.17Å; P144-E252 WeakPolarHBondContact CD-OE1 3.45Å; P144-E252 HydrophobicContact CG-CG 3.85Å; P144-E252 WeakPolarHBondContact CG-OE1 3.39Å; E252-R254 PolarHBondContact O-N 3.48Å; E252-R254 VanDerWaalsContact O-N 3.08Å; E252-Q255 PolarHBondContact O-N 3.28Å; E252-Q255 VanDerWaalsContact O-N 3.11Å
253E85.3Confident91.5Very high197 Ų19754.9 Ų54.992%0.92126%0.262SS*.G310 helixtrans-59.6-25-178-63.8179.8-179.100112.3
254R85.9Confident91.7Very high163 Ų16352.9 Ų52.962%0.61525%0.254SS*.G310 helixtrans-101.531.6-179.6-66.2-175.6177-173.11.1112.8D251 E252 F257D251-R254 HydrophobicContact CB-CB 4.22Å; D251-R254 HydrophobicContact CB-CG 4.45Å; D251-R254 PolarHBondContact O-N 3.43Å; E252-R254 PolarHBondContact O-N 3.48Å; E252-R254 VanDerWaalsContact O-N 3.08Å; R254-F257 HydrophobicContact CB-CB 3.82Å; R254-F257 WeakPolarHBondContact O-CB 3.15Å
255Q85.2Confident91.8Very high165 Ų16550.4 Ų50.477%0.77124%0.238SC*.THydrogen-bonded Turntrans64.447.1179.7-50.8175.4-19.700112.8E252 F257E252-Q255 PolarHBondContact O-N 3.28Å; E252-Q255 VanDerWaalsContact O-N 3.11Å; Q255-F257 VanDerWaalsContact C-N 3.3Å; Q255-F257 PolarHBondContact O-N 2.95Å
256N88.3Confident92Very high45 Ų4553.9 Ų53.924%0.24126%0.256CS..SBendtrans57.643.7-179.5-49.7-39.3000112.6L132 M134 V250 D251L132-N256 PolarHBondContact N-O 3.3Å; L132-N256 WeakPolarHBondContact O-CB 3.19Å; M134-N256 HydrophobicContact CG-CB 3.64Å; M134-N256 WeakPolarHBondContact CG-ND2 3.48Å; V250-N256 HydrophobicContact CG1-CB 4.26Å; D251-N256 WeakPolarHBondContact O-CA 3.41Å; D251-N256 PolarHBondContact O-N 3.12Å
257F92.6Very high92.1Very high44 Ų4453.1 Ų53.119%0.19325%0.253CS..EExtended strand (participates in β ladder)trans-90.9135.1-179.2-174.9-108.4000110.1D129 L130 D251 R254 Q255D129-F257 HydrophobicContact CB-CE2 3.78Å; D129-F257 HydrophobicContact CB-CZ 3.54Å; L130-F257 WeakPolarHBondContact O-CA 3.43Å; L130-F257 WeakPolarHBondContact O-CD2 3.42Å; D251-F257 WeakPolarHBondContact CB-O 3.47Å; D251-F257 PolarHBondContact N-O 3.34Å; D251-F257 PolarHBondContact O-N 2.89Å; R254-F257 HydrophobicContact CB-CB 3.82Å; R254-F257 WeakPolarHBondContact O-CB 3.15Å; Q255-F257 VanDerWaalsContact C-N 3.3Å; Q255-F257 PolarHBondContact O-N 2.95Å
258L94.5Very high92.3Very high0 Ų053.5 Ų53.50%026%0.26CS..EExtended strand (participates in β ladder)trans-120120.6176175.4167.7000107D129 L130 L132 I248 V250 T260 V283D129-L258 CarbonylContact C-O 3.54Å; D129-L258 WeakPolarHBondContact CA-O 3.14Å; L130-L258 HydrophobicContact CB-CB 4.28Å; L130-L258 HydrophobicContact CB-CD2 4.38Å; L130-L258 HydrophobicContact CD1-CD2 4.18Å; L130-L258 HydrophobicContact CG-CD2 4.26Å; L130-L258 PolarHBondContact N-O 2.93Å; L130-L258 PolarHBondContact O-N 2.95Å; L132-L258 HydrophobicContact CD1-CB 4.4Å; L132-L258 HydrophobicContact CD1-CD1 4.11Å; I248-L258 HydrophobicContact CG2-CD1 3.27Å; I248-L258 HydrophobicContact CG2-CD2 3.86Å; I248-L258 HydrophobicContact CG2-CG 3.61Å; V250-L258 HydrophobicContact CG2-CB 4.48Å; V250-L258 HydrophobicContact CG2-CD1 4.09Å; L258-T260 HydrophobicContact CD2-CG2 3.86Å; L258-T260 HydrophobicContact CG-CG2 4.45Å; L258-V283 HydrophobicContact CD1-CG1 4.47Å; L258-V283 HydrophobicContact CD1-CG2 3.57Å
259S94.5Very high92.4Very high42 Ų4255.5 Ų55.529%0.29427%0.274SS..EExtended strand (participates in β ladder)trans-125.1118.2177-172.80000109.4L128 D129 R301L128-S259 WeakPolarHBondContact O-CA 3.48Å; D129-S259 VanDerWaalsContact OD1-CB 3.3Å; D129-S259 WeakPolarHBondContact OD1-CB 3.37Å; D129-S259 PolarHBondContact OD1-OG 3.09Å; S259-R301 PolarHBondContact OG-NH2 3.2Å
260T95.3Very high92.6Very high10 Ų1058.9 Ų58.96%0.06129%0.293CS..EExtended strand (participates in β ladder)trans-140.6147.3-177.257.60000112.2Y127 L128 I248 L258Y127-T260 CarbonylContact C-O 3.53Å; Y127-T260 VanDerWaalsContact CA-O 3.26Å; Y127-T260 WeakPolarHBondContact CA-O 3.35Å; L128-T260 PolarHBondContact N-O 3.39Å; L128-T260 PolarHBondContact O-N 3.17Å; I248-T260 HydrophobicContact CB-CG2 4.08Å; I248-T260 HydrophobicContact CG1-CG2 3.71Å; I248-T260 HydrophobicContact CG2-CG2 3.96Å; L258-T260 HydrophobicContact CD2-CG2 3.86Å; L258-T260 HydrophobicContact CG-CG2 4.45Å
261K95.7Very high92.9Very high63 Ų6361.9 Ų61.927%0.27431%0.307SS..EExtended strand (participates in β ladder)trans-85.3118.5176-176.7-177.7170.3-176.80108.7V126 Y127 F155 H246 A263V126-K261 CarbonylContact O-C 3.52Å; V126-K261 WeakPolarHBondContact O-CA 3.28Å; Y127-K261 HydrophobicContact CD1-CB 3.89Å; Y127-K261 HydrophobicContact CE1-CB 3.72Å; Y127-K261 HydrophobicContact CE1-CG 4.24Å; F155-K261 HydrophobicContact CD2-CD 4.32Å; F155-K261 WeakPolarHBondContact CE1-O 3.32Å; F155-K261 HydrophobicContact CE2-CD 3.6Å; F155-K261 HydrophobicContact CE2-CG 3.99Å; F155-K261 HydrophobicContact CZ-CB 4.31Å; F155-K261 HydrophobicContact CZ-CD 4.01Å; F155-K261 HydrophobicContact CZ-CG 3.94Å; F155-K261 WeakPolarHBondContact CZ-O 3.06Å; H246-K261 PolarHBondContact CE1-O 2.72Å; H246-K261 PolarHBondContact NE2-O 3.19Å; H246-K261 VanDerWaalsContact NE2-O 3.16Å; K261-A263 WeakPolarHBondContact CE-O 3.47Å
262I96Very high93.2Very high0 Ų060 Ų600%030%0.297CS..EExtended strand (participates in β ladder)trans-101.4-24-174.360.7163000113.6V126 L128 F155 I272 N275 L276 V279 L300V126-I262 HydrophobicContact CB-CG1 4.27Å; V126-I262 HydrophobicContact CG1-CD1 4.15Å; V126-I262 HydrophobicContact CG1-CG1 4.01Å; V126-I262 PolarHBondContact O-N 3.02Å; L128-I262 HydrophobicContact CB-CD1 4.36Å; L128-I262 HydrophobicContact CB-CG2 3.63Å; L128-I262 HydrophobicContact CD2-CG2 4.33Å; F155-I262 WeakPolarHBondContact CD1-O 3.42Å; I262-I272 HydrophobicContact CD1-CG2 4.22Å; I262-N275 PolarHBondContact O-ND2 3.26Å; I262-L276 HydrophobicContact CD1-CB 3.79Å; I262-L276 HydrophobicContact CD1-CD1 4.09Å; I262-L276 HydrophobicContact CD1-CG 4.22Å; I262-V279 HydrophobicContact CG2-CG2 4.03Å; I262-L300 HydrophobicContact CD1-CD1 3.82Å
263A96.6Very high93.8Very high0 Ų055.9 Ų55.90%028%0.282CS..EExtended strand (participates in β ladder)trans-164.4179-173.300000111.3V126 K261 M267 I272V126-A263 HydrophobicContact CB-CB 4.25Å; V126-A263 HydrophobicContact CG2-CB 4.47Å; V126-A263 PolarHBondContact N-O 3.02Å; K261-A263 WeakPolarHBondContact CE-O 3.47Å; A263-M267 HydrophobicContact CB-SD 3.71Å; A263-I272 HydrophobicContact CB-CB 4.3Å; A263-I272 HydrophobicContact CB-CG1 3.79Å; A263-I272 HydrophobicContact CB-CG2 4.12Å
264T96Very high94.3Very high13 Ų1348 Ų488%0.0825%0.251CS..EExtended strand (participates in β ladder)trans-111.4151.1161.349.70000109.8Q124 F155 D266 M267Q124-T264 CarbonylContact O-C 3.59Å; Q124-T264 VanDerWaalsContact O-CA 3.28Å; Q124-T264 WeakPolarHBondContact O-CA 3.44Å; F155-T264 HydrophobicContact CB-CG2 4.33Å; F155-T264 HydrophobicContact CD2-CG2 4.27Å; T264-D266 WeakPolarHBondContact CB-OD1 3.41Å; T264-D266 PolarHBondContact O-N 3.26Å; T264-D266 PolarHBondContact OG1-OD1 2.94Å; T264-M267 WeakPolarHBondContact O-CB 3.37Å; T264-M267 WeakPolarHBondContact O-CG 3.49Å; T264-M267 PolarHBondContact O-N 2.99Å
265L94.8Very high94.8Very high8 Ų840.2 Ų40.24%0.04222%0.221CC..THydrogen-bonded Turntrans-67.2-20.6-174.7-84.1-173.6000114.4L111 K112 Q115 P122 Q124 V126 M267L111-L265 HydrophobicContact CB-CD2 3.89Å; K112-L265 VanDerWaalsContact CE-O 3.23Å; K112-L265 WeakPolarHBondContact CE-O 3.19Å; K112-L265 HydrophobicContact CG-CD2 4.36Å; Q115-L265 HydrophobicContact CB-CD1 3.73Å; Q115-L265 HydrophobicContact CG-CD1 4.08Å; P122-L265 WeakPolarHBondContact O-CB 3.02Å; Q124-L265 VanDerWaalsContact CD-CD1 3.49Å; Q124-L265 HydrophobicContact CG-CB 4.1Å; Q124-L265 HydrophobicContact CG-CD1 3.37Å; Q124-L265 HydrophobicContact CG-CG 3.82Å; Q124-L265 PolarHBondContact O-N 3.35Å; V126-L265 HydrophobicContact CG2-CB 4.38Å; V126-L265 HydrophobicContact CG2-CD2 3.39Å; V126-L265 HydrophobicContact CG2-CG 3.65Å; L265-M267 PolarHBondContact O-N 2.91Å
266D94.5Very high95.3Very high82 Ų8232.4 Ų32.444%0.43919%0.185SC..THydrogen-bonded Turntrans-71.4-14.7175.262.2-29.3000113.1P122 K123 T264P122-D266 PolarHBondContact O-N 2.79Å; K123-D266 HydrophobicContact CG-CB 4.41Å; K123-D266 WeakPolarHBondContact CG-OD2 3.39Å; T264-D266 WeakPolarHBondContact CB-OD1 3.41Å; T264-D266 PolarHBondContact O-N 3.26Å; T264-D266 PolarHBondContact OG1-OD1 2.94Å
267M95.6Very high95.6Very high15 Ų1534.9 Ų34.97%0.07420%0.195CC..SBendtrans-67.7150.3175.7-65.1179.677.100112.2K112 H153 F155 A263 T264 L265 Q271 I272K112-M267 WeakPolarHBondContact CE-O 3.36Å; K112-M267 PolarHBondContact NZ-O 3.38Å; H153-M267 HydrophobicContact CB-CE 3.74Å; F155-M267 HydrophobicContact CB-CE 4.36Å; F155-M267 HydrophobicContact CB-SD 3.43Å; F155-M267 WeakPolarHBondContact CB-SD 3.46Å; A263-M267 HydrophobicContact CB-SD 3.71Å; T264-M267 WeakPolarHBondContact O-CB 3.37Å; T264-M267 WeakPolarHBondContact O-CG 3.49Å; T264-M267 PolarHBondContact O-N 2.99Å; L265-M267 PolarHBondContact O-N 2.91Å; M267-Q271 HydrophobicContact CE-CB 3.98Å; M267-I272 HydrophobicContact CB-CD1 4.24Å; M267-I272 HydrophobicContact CB-CG1 3.9Å
268P96.5Very high95.7Very high62 Ų6233.8 Ų33.840%0.40319%0.194SC..  trans-62.2147.8172.228.4-35.6000110.6D270 Q271 I272P268-D270 PolarHBondContact O-N 3.2Å; P268-Q271 HydrophobicContact CG-CB 3.97Å; P268-Q271 HydrophobicContact CG-CG 3.56Å; P268-Q271 PolarHBondContact O-N 3.12Å; P268-Q271 VanDerWaalsContact O-N 3.16Å; P268-I272 PolarHBondContact O-N 3.34Å
269S96Very high95.8Very high43 Ų4333.8 Ų33.830%0.30119%0.194SC..Hα-helixtrans-61.1-35-170.6-55.40000112.6K112 Q271 I272 A273K112-S269 PolarHBondContact NZ-OG 3.23Å; K112-S269 VanDerWaalsContact NZ-OG 3.1Å; S269-Q271 PolarHBondContact O-N 2.87Å; S269-I272 PolarHBondContact O-N 3.02Å; S269-A273 PolarHBondContact O-N 3.37Å
270D96.7Very high95.7Very high129 Ų12931.9 Ų31.969%0.6918%0.18SC*.Hα-helixtrans-65.6-38.9179.8-49.5-31000111.9P268 A273 A274P268-D270 PolarHBondContact O-N 3.2Å; D270-A273 PolarHBondContact O-N 2.86Å; D270-A274 WeakPolarHBondContact O-CB 3.47Å; D270-A274 PolarHBondContact O-N 2.78Å
271Q97Very high95.6Very high66 Ų6634.2 Ų34.231%0.30819%0.193SC..Hα-helixtrans-68.3-37.8177.6-68.8-179.85.900111.7H153 M267 P268 S269 A273 A274 N275H153-Q271 HydrophobicContact CB-CB 4.04Å; H153-Q271 HydrophobicContact CB-CG 4.24Å; M267-Q271 HydrophobicContact CE-CB 3.98Å; P268-Q271 HydrophobicContact CG-CB 3.97Å; P268-Q271 HydrophobicContact CG-CG 3.56Å; P268-Q271 PolarHBondContact O-N 3.12Å; P268-Q271 VanDerWaalsContact O-N 3.16Å; S269-Q271 PolarHBondContact O-N 2.87Å; Q271-A273 VanDerWaalsContact C-N 3.34Å; Q271-A274 PolarHBondContact O-N 3.12Å; Q271-N275 WeakPolarHBondContact O-CB 3.27Å; Q271-N275 PolarHBondContact O-N 3.41Å
272I96.9Very high95.4Very high0 Ų033 Ų330%019%0.188CC..Hα-helixtrans-63.3-44.7174.9-59.1174.3000109.7I108 V126 I262 A263 M267 P268 S269 N275 L276I108-I272 HydrophobicContact CD1-CB 4.04Å; I108-I272 HydrophobicContact CD1-CG2 3.84Å; I108-I272 HydrophobicContact CG1-CG2 4.01Å; I108-I272 HydrophobicContact CG2-CD1 3.98Å; V126-I272 HydrophobicContact CG1-CG2 4.48Å; I262-I272 HydrophobicContact CD1-CG2 4.22Å; A263-I272 HydrophobicContact CB-CB 4.3Å; A263-I272 HydrophobicContact CB-CG1 3.79Å; A263-I272 HydrophobicContact CB-CG2 4.12Å; M267-I272 HydrophobicContact CB-CD1 4.24Å; M267-I272 HydrophobicContact CB-CG1 3.9Å; P268-I272 PolarHBondContact O-N 3.34Å; S269-I272 PolarHBondContact O-N 3.02Å; I272-N275 PolarHBondContact O-N 3.45Å; I272-L276 WeakPolarHBondContact O-CB 3.39Å; I272-L276 PolarHBondContact O-N 2.9Å
273A96Very high95.3Very high27 Ų2733 Ų3322%0.22319%0.188CC..Hα-helixtrans-63.7-43177.800000112.1V104 I108 S269 D270 Q271 L276 Q277V104-A273 HydrophobicContact CG1-CB 4.13Å; I108-A273 HydrophobicContact CD1-CB 4.1Å; S269-A273 PolarHBondContact O-N 3.37Å; D270-A273 PolarHBondContact O-N 2.86Å; Q271-A273 VanDerWaalsContact C-N 3.34Å; A273-L276 WeakPolarHBondContact O-CB 3.23Å; A273-L276 PolarHBondContact O-N 2.81Å; A273-Q277 WeakPolarHBondContact O-CB 3.47Å; A273-Q277 PolarHBondContact O-N 2.99Å
274A96.3Very high95Very high31 Ų3133.3 Ų33.326%0.25619%0.19SC..Hα-helixtrans-62.5-44.4176.900000112.3D270 Q271 Q277 A278D270-A274 WeakPolarHBondContact O-CB 3.47Å; D270-A274 PolarHBondContact O-N 2.78Å; Q271-A274 PolarHBondContact O-N 3.12Å; A274-Q277 PolarHBondContact O-N 3.36Å; A274-A278 PolarHBondContact O-N 3.32Å
275N96.9Very high94.6Very high0 Ų039.9 Ų39.90%022%0.217CC..Hα-helixtrans-63.1-43.6175.2-77.4-1.1000111.9L151 P152 H153 I262 Q271 I272 Q277 A278 V279L151-N275 HydrophobicContact CD2-CB 4.5Å; P152-N275 WeakPolarHBondContact CD-OD1 3.27Å; H153-N275 PolarHBondContact N-OD1 2.97Å; H153-N275 PolarHBondContact O-ND2 3Å; H153-N275 PolarHBondContact O-OD1 3.41Å; I262-N275 PolarHBondContact O-ND2 3.26Å; Q271-N275 WeakPolarHBondContact O-CB 3.27Å; Q271-N275 PolarHBondContact O-N 3.41Å; I272-N275 PolarHBondContact O-N 3.45Å; N275-Q277 VanDerWaalsContact C-N 3.31Å; N275-Q277 PolarHBondContact O-N 3.37Å; N275-A278 PolarHBondContact O-N 3.13Å; N275-V279 WeakPolarHBondContact O-CG2 3.15Å; N275-V279 PolarHBondContact O-N 3.22Å
276L95.7Very high94.3Very high0 Ų042.4 Ų42.40%023%0.229CC..Hα-helixtrans-57-46.8175.9-176154.9000111V104 L128 I262 I272 A273 V279 I280 L300 L310 L315V104-L276 HydrophobicContact CG1-CD1 4.23Å; L128-L276 HydrophobicContact CD1-CD1 4.15Å; L128-L276 HydrophobicContact CD1-CG 4.24Å; L128-L276 HydrophobicContact CD2-CG 4.34Å; I262-L276 HydrophobicContact CD1-CB 3.79Å; I262-L276 HydrophobicContact CD1-CD1 4.09Å; I262-L276 HydrophobicContact CD1-CG 4.22Å; I272-L276 WeakPolarHBondContact O-CB 3.39Å; I272-L276 PolarHBondContact O-N 2.9Å; A273-L276 WeakPolarHBondContact O-CB 3.23Å; A273-L276 PolarHBondContact O-N 2.81Å; L276-V279 PolarHBondContact O-N 3.27Å; L276-I280 HydrophobicContact CD2-CD1 3.48Å; L276-I280 VanDerWaalsContact CD2-CD1 3.48Å; L276-I280 HydrophobicContact CD2-CG1 4.36Å; L276-I280 HydrophobicContact CG-CD1 4.39Å; L276-I280 WeakPolarHBondContact O-CG1 3.45Å; L276-I280 PolarHBondContact O-N 3.39Å; L276-I280 VanDerWaalsContact O-N 3.07Å; L276-L300 HydrophobicContact CD1-CD1 3.83Å; L276-L310 HydrophobicContact CD1-CD1 3.86Å; L276-L315 HydrophobicContact CD2-CD1 3.87Å; L276-L315 HydrophobicContact CD2-CD2 3.5Å; L276-L315 HydrophobicContact CD2-CG 4.31Å
277Q94.7Very high93.8Very high97 Ų9739 Ų3945%0.45321%0.21SC..Hα-helixtrans-65.6-39.4179.8-160.21789.600111.7A273 A274 N275 V279 I280 N281A273-Q277 WeakPolarHBondContact O-CB 3.47Å; A273-Q277 PolarHBondContact O-N 2.99Å; A274-Q277 PolarHBondContact O-N 3.36Å; N275-Q277 VanDerWaalsContact C-N 3.31Å; N275-Q277 PolarHBondContact O-N 3.37Å; Q277-V279 VanDerWaalsContact C-N 3.35Å; Q277-V279 PolarHBondContact O-N 3.33Å; Q277-I280 PolarHBondContact O-N 2.93Å; Q277-N281 VanDerWaalsContact O-CB 3.32Å; Q277-N281 WeakPolarHBondContact O-CB 3.33Å; Q277-N281 PolarHBondContact O-N 2.92Å; Q277-N281 PolarHBondContact O-ND2 3.36Å
278A94.7Very high93.1Very high21 Ų2141.8 Ų41.817%0.17423%0.229CC..Hα-helixtrans-60.1-43175.100000112.4P152 A274 N275 N281 E282P152-A278 HydrophobicContact CG-CB 3.93Å; A274-A278 PolarHBondContact O-N 3.32Å; N275-A278 PolarHBondContact O-N 3.13Å; A278-N281 PolarHBondContact O-N 3.47Å; A278-E282 PolarHBondContact O-N 2.87Å; A278-E282 VanDerWaalsContact O-N 3.12Å
279V95.4Very high92.2Very high0 Ų042.2 Ų42.20%023%0.227CC..Hα-helixtrans-64.1-47177.1172.70000111.3L128 L151 I248 I262 N275 L276 Q277 N281 E282 V283L128-V279 HydrophobicContact CD2-CB 4.27Å; L128-V279 HydrophobicContact CD2-CG1 3.84Å; L151-V279 HydrophobicContact CD2-CG2 3.78Å; I248-V279 HydrophobicContact CD1-CB 4.4Å; I248-V279 HydrophobicContact CD1-CG1 3.85Å; I248-V279 HydrophobicContact CD1-CG2 4.06Å; I248-V279 HydrophobicContact CG1-CG1 4.45Å; I262-V279 HydrophobicContact CG2-CG2 4.03Å; N275-V279 WeakPolarHBondContact O-CG2 3.15Å; N275-V279 PolarHBondContact O-N 3.22Å; L276-V279 PolarHBondContact O-N 3.27Å; Q277-V279 VanDerWaalsContact C-N 3.35Å; Q277-V279 PolarHBondContact O-N 3.33Å; V279-N281 VanDerWaalsContact C-N 3.35Å; V279-N281 PolarHBondContact O-N 3.16Å; V279-E282 PolarHBondContact O-N 2.98Å; V279-V283 HydrophobicContact CG1-CG2 4.49Å; V279-V283 VanDerWaalsContact O-CG2 3.27Å; V279-V283 WeakPolarHBondContact O-CG2 3.37Å; V279-V283 PolarHBondContact O-N 3.33Å
280I93.7Very high91.4Very high2 Ų246.8 Ų46.81%0.0125%0.248CC..Hα-helixtrans-63.3-42.9179-68.1177.6000111.1L128 L130 L276 Q277 E282 V283 C284 L315L128-I280 HydrophobicContact CD2-CG1 4.17Å; L130-I280 HydrophobicContact CD1-CG1 4.4Å; L276-I280 HydrophobicContact CD2-CD1 3.48Å; L276-I280 VanDerWaalsContact CD2-CD1 3.48Å; L276-I280 HydrophobicContact CD2-CG1 4.36Å; L276-I280 HydrophobicContact CG-CD1 4.39Å; L276-I280 WeakPolarHBondContact O-CG1 3.45Å; L276-I280 PolarHBondContact O-N 3.39Å; L276-I280 VanDerWaalsContact O-N 3.07Å; Q277-I280 PolarHBondContact O-N 2.93Å; I280-E282 VanDerWaalsContact C-N 3.33Å; I280-E282 PolarHBondContact O-N 3.44Å; I280-V283 PolarHBondContact O-N 2.88Å; I280-C284 WeakPolarHBondContact O-CB 3.42Å; I280-C284 PolarHBondContact O-N 3.45Å; I280-C284 PolarHBondContact O-SG 2.94Å; I280-L315 HydrophobicContact CD1-CB 3.8Å; I280-L315 HydrophobicContact CD1-CD1 3.62Å; I280-L315 HydrophobicContact CD1-CD2 4.16Å; I280-L315 HydrophobicContact CD1-CG 4.07Å; I280-L315 HydrophobicContact CG2-CB 4.49Å
281N92.4Very high90.4Very high60 Ų6043.7 Ų43.732%0.32123%0.232SC..Hα-helixtrans-60-43.3179-75.3-18.8000111.8Q277 A278 V279 C284 K285Q277-N281 VanDerWaalsContact O-CB 3.32Å; Q277-N281 WeakPolarHBondContact O-CB 3.33Å; Q277-N281 PolarHBondContact O-N 2.92Å; Q277-N281 PolarHBondContact O-ND2 3.36Å; A278-N281 PolarHBondContact O-N 3.47Å; V279-N281 VanDerWaalsContact C-N 3.35Å; V279-N281 PolarHBondContact O-N 3.16Å; N281-C284 PolarHBondContact O-N 3.41Å; N281-K285 WeakPolarHBondContact O-CG 3.4Å; N281-K285 PolarHBondContact O-N 3.35Å
282E92.2Very high89.5Confident37 Ų3742.4 Ų42.417%0.17324%0.236CC..Hα-helixtrans-65.8-45.2176.2-172.974.8-171.900112.2I149 A278 V279 I280 C284 K285 H286I149-E282 HydrophobicContact CD1-CB 3.11Å; I149-E282 HydrophobicContact CD1-CG 3.41Å; I149-E282 VanDerWaalsContact CD1-CG 3.41Å; I149-E282 HydrophobicContact CG1-CB 3.76Å; I149-E282 HydrophobicContact CG1-CG 3.48Å; I149-E282 VanDerWaalsContact CG1-CG 3.48Å; A278-E282 PolarHBondContact O-N 2.87Å; A278-E282 VanDerWaalsContact O-N 3.12Å; V279-E282 PolarHBondContact O-N 2.98Å; I280-E282 VanDerWaalsContact C-N 3.33Å; I280-E282 PolarHBondContact O-N 3.44Å; E282-C284 PolarHBondContact O-N 3.18Å; E282-K285 WeakPolarHBondContact O-CB 3.49Å; E282-K285 PolarHBondContact O-N 3.09Å; E282-K285 WeakPolarHBondContact OE2-CD 3.46Å; E282-K285 WeakPolarHBondContact OE2-CE 3.39Å; E282-K285 IonicContact OE2-NZ 2.72Å; E282-K285 PolarHBondContact OE2-NZ 3.18Å; E282-H286 PolarHBondContact O-CD2 3.41Å
283V92.5Very high88.7Confident0 Ų046.8 Ų46.80%026%0.264CS..Hα-helixtrans-55.2-45.1177168.90000109.6L130 L132 F145 I248 L258 V279 I280 K285 H286 F294L130-V283 HydrophobicContact CD1-CG1 4.41Å; L130-V283 HydrophobicContact CD1-CG2 4.37Å; L132-V283 HydrophobicContact CD1-CG1 3.96Å; L132-V283 HydrophobicContact CD2-CG1 3.68Å; F145-V283 HydrophobicContact CZ-CG1 4.28Å; I248-V283 HydrophobicContact CG2-CG2 4.35Å; L258-V283 HydrophobicContact CD1-CG1 4.47Å; L258-V283 HydrophobicContact CD1-CG2 3.57Å; V279-V283 HydrophobicContact CG1-CG2 4.49Å; V279-V283 VanDerWaalsContact O-CG2 3.27Å; V279-V283 WeakPolarHBondContact O-CG2 3.37Å; V279-V283 PolarHBondContact O-N 3.33Å; I280-V283 PolarHBondContact O-N 2.88Å; V283-K285 VanDerWaalsContact C-N 3.28Å; V283-K285 PolarHBondContact O-N 2.85Å; V283-H286 PolarHBondContact O-N 3.41Å; V283-F294 HydrophobicContact CG1-CD1 3.83Å; V283-F294 HydrophobicContact CG1-CE1 3.43Å; V283-F294 VanDerWaalsContact CG1-CE1 3.43Å; V283-F294 HydrophobicContact CG1-CZ 4.44Å; V283-F294 WeakPolarHBondContact O-CD1 3.47Å; V283-F294 WeakPolarHBondContact O-CE1 3.3Å
284C90.2Very high88.3Confident6 Ų645.9 Ų45.94%0.04126%0.256CS..Hα-helixtrans-65.2-21.1176.6-69.30000114.7I280 N281 E282 H286 R287 P317I280-C284 WeakPolarHBondContact O-CB 3.42Å; I280-C284 PolarHBondContact O-N 3.45Å; I280-C284 PolarHBondContact O-SG 2.94Å; N281-C284 PolarHBondContact O-N 3.41Å; E282-C284 PolarHBondContact O-N 3.18Å; C284-H286 PolarHBondContact O-N 3.01Å; C284-R287 PolarHBondContact O-N 3.4Å; C284-P317 HydrophobicContact CB-CG 3.9Å
285K88.5Confident88Confident152 Ų15244.7 Ų44.766%0.66125%0.245SC*.Hα-helixtrans-68.3-24.5175.2-69.7173.2-167.3166.70113.1N281 E282 V283 R287N281-K285 WeakPolarHBondContact O-CG 3.4Å; N281-K285 PolarHBondContact O-N 3.35Å; E282-K285 WeakPolarHBondContact O-CB 3.49Å; E282-K285 PolarHBondContact O-N 3.09Å; E282-K285 WeakPolarHBondContact OE2-CD 3.46Å; E282-K285 WeakPolarHBondContact OE2-CE 3.39Å; E282-K285 IonicContact OE2-NZ 2.72Å; E282-K285 PolarHBondContact OE2-NZ 3.18Å; V283-K285 VanDerWaalsContact C-N 3.28Å; V283-K285 PolarHBondContact O-N 2.85Å; K285-R287 VanDerWaalsContact C-N 3.29Å; K285-R287 PolarHBondContact O-N 2.8Å
286H87.8Confident87.7Confident60 Ų6048.1 Ų48.128%0.27827%0.266SS..THydrogen-bonded Turntrans-77.1-14.7-177.2-68.2-78000113.8F145 S147 E282 V283 C284F145-H286 HydrophobicContact CD1-CB 3.54Å; F145-H286 AromaticContact CD1-CG 3.66Å; F145-H286 HydrophobicContact CD2-CB 4.15Å; F145-H286 AromaticContact CD2-CD2 3.18Å; F145-H286 WeakPolarHBondContact CD2-CD2 3.43Å; F145-H286 AromaticContact CD2-CE1 3.55Å; F145-H286 AromaticContact CD2-CG 3.39Å; F145-H286 AromaticContact CD2-ND1 3.62Å; F145-H286 AromaticContact CD2-NE2 3.27Å; F145-H286 VanDerWaalsContact CD2-NE2 3.27Å; F145-H286 WeakPolarHBondContact CD2-NE2 3.41Å; F145-H286 HydrophobicContact CE1-CB 3.36Å; F145-H286 AromaticContact CE1-CG 3.74Å; F145-H286 HydrophobicContact CE2-CB 4.03Å; F145-H286 AromaticContact CE2-CD2 3.04Å; F145-H286 WeakPolarHBondContact CE2-CD2 3.13Å; F145-H286 AromaticContact CE2-CG 3.51Å; F145-H286 AromaticContact CE2-NE2 3.54Å; F145-H286 HydrophobicContact CG-CB 3.92Å; F145-H286 AromaticContact CG-CD2 3.8Å; F145-H286 AromaticContact CG-CE1 3.85Å; F145-H286 AromaticContact CG-CG 3.47Å; F145-H286 VanDerWaalsContact CG-CG 3.47Å; F145-H286 AromaticContact CG-ND1 3.52Å; F145-H286 HydrophobicContact CZ-CB 3.63Å; F145-H286 AromaticContact CZ-CD2 3.53Å; F145-H286 AromaticContact CZ-CG 3.68Å; S147-H286 VanDerWaalsContact CB-NE2 3.3Å; S147-H286 WeakPolarHBondContact CB-NE2 3.28Å; S147-H286 PolarHBondContact OG-NE2 2.88Å; E282-H286 PolarHBondContact O-CD2 3.41Å; V283-H286 PolarHBondContact O-N 3.41Å; C284-H286 PolarHBondContact O-N 3.01Å
287R84.8Confident87.5Confident12 Ų1255 Ų555%0.04529%0.292CS..SBendtrans-125.6130.1176.6-171.7173.3179.1-94.911.5109.7A135 L136 V142 C284 K285 L289 L291 G292 F294A135-R287 PolarHBondContact O-NE 3.42Å; A135-R287 PolarHBondContact O-NH2 2.95Å; L136-R287 HydrophobicContact CD1-CG 4.33Å; V142-R287 HydrophobicContact CG2-CG 4.19Å; C284-R287 PolarHBondContact O-N 3.4Å; K285-R287 VanDerWaalsContact C-N 3.29Å; K285-R287 PolarHBondContact O-N 2.8Å; R287-L289 PolarHBondContact O-N 3.01Å; R287-L291 PolarHBondContact NH1-O 3.45Å; R287-L291 PolarHBondContact NH2-O 3.21Å; R287-G292 PolarHBondContact NH1-O 3.17Å; R287-F294 HydrophobicContact CB-CB 4.42Å; R287-F294 HydrophobicContact CB-CD1 4.16Å; R287-F294 HydrophobicContact CB-CD2 3.93Å; R287-F294 HydrophobicContact CB-CE1 4.43Å; R287-F294 HydrophobicContact CB-CE2 4.21Å; R287-F294 HydrophobicContact CB-CG 3.9Å; R287-F294 HydrophobicContact CB-CZ 4.47Å; R287-F294 HydrophobicContact CG-CD2 4.19Å; R287-F294 HydrophobicContact CG-CG 4.45Å
288P80.2Confident87.5Confident72 Ų7250.4 Ų50.447%0.46827%0.27SS..  trans-58.2138.3175.1-17.327.7000111N290 L291P288-N290 VanDerWaalsContact C-N 3.26Å; P288-N290 PolarHBondContact O-N 3.3Å; P288-L291 HydrophobicContact CB-CD1 3.74Å; P288-L291 HydrophobicContact CG-CD1 4.04Å; P288-L291 PolarHBondContact O-N 2.87Å
289L77.5Confident87.6Confident71 Ų7150.9 Ų50.937%0.37227%0.269SS..G310 helixtrans-61.9-34.4-175-60.1178.7000112.7R287 L291 G292 P317 E319R287-L289 PolarHBondContact O-N 3.01Å; L289-L291 PolarHBondContact O-N 3.38Å; L289-G292 PolarHBondContact O-N 3.04Å; L289-G292 VanDerWaalsContact O-N 3.16Å; L289-P317 HydrophobicContact CD2-CB 4.47Å; L289-P317 HydrophobicContact CD2-CG 3.64Å; L289-E319 HydrophobicContact CB-CG 3.87Å; L289-E319 HydrophobicContact CD1-CG 4.43Å; L289-E319 VanDerWaalsContact O-OE1 3.08Å
290N79.2Confident87.7Confident139 Ų13950.9 Ų50.974%0.74327%0.269SS*.G310 helixtrans-58-12.4-175.8-53.6-3.1000115.3P288 E319P288-N290 VanDerWaalsContact C-N 3.26Å; P288-N290 PolarHBondContact O-N 3.3Å; N290-E319 VanDerWaalsContact CA-OE1 3.24Å; N290-E319 WeakPolarHBondContact CA-OE1 3.3Å; N290-E319 PolarHBondContact N-OE1 3.21Å; N290-E319 VanDerWaalsContact N-OE1 3.17Å
291L76.9Confident87.8Confident65 Ų6553.6 Ų53.634%0.3428%0.279SS..G310 helixtrans-96.912.1-177.1-69.198.8000113.7L136 R287 P288 L289L136-L291 HydrophobicContact CB-CD2 4.21Å; L136-L291 HydrophobicContact CD1-CD1 3.92Å; L136-L291 HydrophobicContact CD1-CD2 3.44Å; L136-L291 VanDerWaalsContact CD1-CD2 3.44Å; L136-L291 HydrophobicContact CD1-CG 4.22Å; L136-L291 HydrophobicContact CG-CD2 3.51Å; L136-L291 WeakPolarHBondContact O-CD2 3.5Å; R287-L291 PolarHBondContact NH1-O 3.45Å; R287-L291 PolarHBondContact NH2-O 3.21Å; P288-L291 HydrophobicContact CB-CD1 3.74Å; P288-L291 HydrophobicContact CG-CD1 4.04Å; P288-L291 PolarHBondContact O-N 2.87Å; L289-L291 PolarHBondContact O-N 3.38Å
292G77.7Confident88Confident39 Ų3950.8 Ų50.840%0.40226%0.264SS..  trans88.2-167.8177.500000113.5R287 L289 F294R287-G292 PolarHBondContact NH1-O 3.17Å; L289-G292 PolarHBondContact O-N 3.04Å; L289-G292 VanDerWaalsContact O-N 3.16Å; G292-F294 PolarHBondContact O-N 2.92Å
293P80Confident88.1Confident91 Ų9152 Ų5259%0.59128%0.276SS*.  trans-67.4118.9-169.627.3-34.1000111.5L316P293-L316 HydrophobicContact CB-CD1 4.27Å
294F87.5Confident88.1Confident9 Ų955.5 Ų55.54%0.03930%0.298CS..SBendtrans-77.2-37.2178-177.2-139.5000112.8L132 D133 M134 F145 V283 R287 G292L132-F294 WeakPolarHBondContact CA-O 3.26Å; L132-F294 HydrophobicContact CB-CE2 3.94Å; L132-F294 HydrophobicContact CB-CZ 4.02Å; L132-F294 HydrophobicContact CD1-CE1 4.09Å; L132-F294 HydrophobicContact CD1-CZ 3.76Å; L132-F294 HydrophobicContact CD2-CD1 4.44Å; L132-F294 HydrophobicContact CD2-CE1 4.19Å; L132-F294 HydrophobicContact CD2-CZ 4.31Å; L132-F294 HydrophobicContact CG-CZ 4.24Å; D133-F294 PolarHBondContact N-O 3.16Å; D133-F294 VanDerWaalsContact O-CD2 3.26Å; D133-F294 WeakPolarHBondContact O-CD2 3.31Å; D133-F294 WeakPolarHBondContact O-CE2 3.45Å; M134-F294 HydrophobicContact SD-CE2 3.65Å; M134-F294 HydrophobicContact SD-CZ 3.78Å; F145-F294 HydrophobicContact CE1-CE1 4.07Å; F145-F294 AromaticContact CE1-CZ 3.72Å; F145-F294 HydrophobicContact CE1-CZ 3.72Å; F145-F294 AromaticContact CZ-CE1 3.93Å; F145-F294 HydrophobicContact CZ-CE1 3.93Å; F145-F294 AromaticContact CZ-CZ 3.99Å; F145-F294 HydrophobicContact CZ-CZ 3.99Å; V283-F294 HydrophobicContact CG1-CD1 3.83Å; V283-F294 HydrophobicContact CG1-CE1 3.43Å; V283-F294 VanDerWaalsContact CG1-CE1 3.43Å; V283-F294 HydrophobicContact CG1-CZ 4.44Å; V283-F294 WeakPolarHBondContact O-CD1 3.47Å; V283-F294 WeakPolarHBondContact O-CE1 3.3Å; R287-F294 HydrophobicContact CB-CB 4.42Å; R287-F294 HydrophobicContact CB-CD1 4.16Å; R287-F294 HydrophobicContact CB-CD2 3.93Å; R287-F294 HydrophobicContact CB-CE1 4.43Å; R287-F294 HydrophobicContact CB-CE2 4.21Å; R287-F294 HydrophobicContact CB-CG 3.9Å; R287-F294 HydrophobicContact CB-CZ 4.47Å; R287-F294 HydrophobicContact CG-CD2 4.19Å; R287-F294 HydrophobicContact CG-CG 4.45Å; G292-F294 PolarHBondContact O-N 2.92Å
295V90.3Very high88.2Confident5 Ų556.1 Ų56.13%0.0330%0.302CS..EExtended strand (participates in β ladder)trans-91.7112.1177.5-177.30000108.6L130 L132 A298 T312 L316L130-V295 HydrophobicContact CD2-CG1 4.05Å; L132-V295 HydrophobicContact CD2-CB 4.49Å; L132-V295 HydrophobicContact CD2-CG2 3.94Å; V295-A298 HydrophobicContact CG1-CB 4.3Å; V295-T312 HydrophobicContact CG1-CG2 4.2Å; V295-L316 HydrophobicContact CB-CD2 4.13Å; V295-L316 HydrophobicContact CG2-CD2 4.02Å
296V89.9Confident88.3Confident73 Ų7353.3 Ų53.344%0.44229%0.291SS..EExtended strand (participates in β ladder)trans-78.5-42.3178.6-173.60000110.6T131 D133T131-V296 PolarHBondContact O-N 2.61Å; D133-V296 HydrophobicContact CB-CG2 3.63Å
297R92Very high88.5Confident144 Ų14451.2 Ų51.254%0.54329%0.286SS..EExtended strand (participates in β ladder)trans-146.5142.1-179.6-55.9-179.6-165.5158.85.1109.9L130 T131 F299 L309L130-R297 WeakPolarHBondContact CA-O 3.5Å; T131-R297 PolarHBondContact N-O 3.18Å; T131-R297 PolarHBondContact O-N 3.4Å; R297-F299 HydrophobicContact CB-CE2 4.12Å; R297-L309 HydrophobicContact CB-CD1 4.47Å
298A94.9Very high89.1Confident0 Ų050.8 Ų50.80%029%0.285CS..EExtended strand (participates in β ladder)trans-126.3124.5172.900000109.7L130 V295 L310 T312L130-A298 HydrophobicContact CD2-CB 3.47Å; L130-A298 VanDerWaalsContact CD2-CB 3.47Å; V295-A298 HydrophobicContact CG1-CB 4.3Å; A298-L310 HydrophobicContact CB-CB 4.18Å; A298-L310 HydrophobicContact CB-CD1 4.42Å; A298-L310 PolarHBondContact O-N 3.41Å; A298-T312 HydrophobicContact CB-CG2 4.06Å
299F95.8Very high89.8Confident32 Ų3248.8 Ų48.814%0.1427%0.27CS..EExtended strand (participates in β ladder)trans-113.5135.8173.7-70.4-80.4000110.2D129 R297 L308 L309D129-F299 HydrophobicContact CB-CB 4.01Å; D129-F299 PolarHBondContact N-O 3Å; D129-F299 PolarHBondContact O-N 3.08Å; R297-F299 HydrophobicContact CB-CE2 4.12Å; F299-L308 CarbonylContact C-O 3.52Å; F299-L308 VanDerWaalsContact CA-O 3.29Å; F299-L308 WeakPolarHBondContact CA-O 3.37Å; F299-L309 HydrophobicContact CD1-CB 4.12Å; F299-L309 HydrophobicContact CD1-CD1 4.25Å; F299-L309 HydrophobicContact CE1-CB 3.69Å; F299-L309 HydrophobicContact CE1-CD1 3.75Å; F299-L309 HydrophobicContact CE1-CG 4.21Å; F299-L309 HydrophobicContact CE2-CD1 4.26Å; F299-L309 HydrophobicContact CZ-CB 4.48Å; F299-L309 HydrophobicContact CZ-CD1 3.77Å
300L97.1Very high90.7Very high0 Ų045.6 Ų45.60%025%0.253CS..EExtended strand (participates in β ladder)trans-109.3127.2170.3-163.167.8000108.9A107 I108 L111 V126 L128 I262 L276 L308 L310A107-L300 HydrophobicContact CB-CD2 4.17Å; I108-L300 HydrophobicContact CG1-CD2 3.82Å; L111-L300 HydrophobicContact CD1-CB 4.3Å; L111-L300 HydrophobicContact CD1-CD2 3.61Å; L111-L300 HydrophobicContact CD1-CG 3.58Å; V126-L300 HydrophobicContact CG1-CD1 3.71Å; V126-L300 HydrophobicContact CG1-CG 4.13Å; L128-L300 HydrophobicContact CD1-CD1 4.4Å; I262-L300 HydrophobicContact CD1-CD1 3.82Å; L276-L300 HydrophobicContact CD1-CD1 3.83Å; L300-L308 PolarHBondContact N-O 2.95Å; L300-L308 PolarHBondContact O-N 3.26Å; L300-L310 HydrophobicContact CB-CD1 4.01Å; L300-L310 HydrophobicContact CB-CD2 4.02Å; L300-L310 HydrophobicContact CB-CG 4.08Å
301R96.4Very high91.3Very high59 Ų5943 Ų4322%0.22324%0.235CC..EExtended strand (participates in β ladder)trans-139.1156177.865.7176.4174.476.28.5111.1V126 Y127 D129 S259V126-R301 CarbonylContact C-O 3.53Å; V126-R301 WeakPolarHBondContact CA-O 3.41Å; Y127-R301 VanDerWaalsContact CB-CZ 3.48Å; Y127-R301 PolarHBondContact N-O 3.43Å; Y127-R301 PolarHBondContact O-N 3.35Å; D129-R301 IonicContact OD1-CZ 3.59Å; D129-R301 IonicContact OD1-NE 3.89Å; D129-R301 IonicContact OD1-NH2 3.7Å; D129-R301 PolarHBondContact OD1-NH2 2.91Å; D129-R301 WeakPolarHBondContact OD2-CD 3.5Å; D129-R301 IonicContact OD2-CZ 3.14Å; D129-R301 IonicContact OD2-NE 2.62Å; D129-R301 PolarHBondContact OD2-NE 3Å; D129-R301 IonicContact OD2-NH2 2.83Å; S259-R301 PolarHBondContact OG-NH2 3.2Å
302S95.9Very high91.7Very high1 Ų141.3 Ų41.31%0.00723%0.227CC..EExtended strand (participates in β ladder)trans-87.8-174.3162.580.80000110.7Q124 G125 T304 S305Q124-S302 VanDerWaalsContact OE1-CB 3.25Å; Q124-S302 PolarHBondContact OE1-OG 3.24Å; G125-S302 CarbonylContact O-C 3.58Å; G125-S302 WeakPolarHBondContact O-CA 3.15Å; S302-T304 PolarHBondContact OG-N 3.14Å; S302-S305 PolarHBondContact N-OG 3.31Å; S302-S305 WeakPolarHBondContact OG-CB 3.29Å; S302-S305 PolarHBondContact OG-N 2.95Å; S302-S305 PolarHBondContact OG-OG 3.34Å; S302-S305 VanDerWaalsContact OG-OG 3.11Å
303S94.4Very high92Very high62 Ų6245.7 Ų45.743%0.43424%0.241SC..SBendtrans-69.9-27.2175.6-530000111.5Q124 G125 Y127Q124-S303 VanDerWaalsContact OE1-N 3.07Å; G125-S303 PolarHBondContact N-OG 3.41Å; G125-S303 VanDerWaalsContact N-OG 3.09Å; G125-S303 PolarHBondContact O-N 3.28Å; G125-S303 PolarHBondContact O-OG 3.44Å; G125-S303 VanDerWaalsContact O-OG 3.04Å; Y127-S303 WeakPolarHBondContact CE2-OG 3.38Å
304T93.9Very high92.1Very high74 Ų7445 Ų4545%0.45424%0.239SC..SBendtrans-115.4-20.6-173.861.80000114.3T120 Q124 S302T120-T304 HydrophobicContact CG2-CG2 3.76Å; T120-T304 WeakPolarHBondContact CG2-OG1 3.02Å; T120-T304 PolarHBondContact OG1-OG1 3.06Å; Q124-T304 PolarHBondContact NE2-OG1 2.89Å; Q124-T304 VanDerWaalsContact OE1-N 3.15Å; Q124-T304 PolarHBondContact OE1-OG1 3.31Å; S302-T304 PolarHBondContact OG-N 3.14Å
305S91Very high91.7Very high19 Ų1945.3 Ų45.313%0.13324%0.241CC..SBendtrans-82.5168-174.4780000113L111 S302L111-S305 WeakPolarHBondContact CD2-OG 3.43Å; S302-S305 PolarHBondContact N-OG 3.31Å; S302-S305 WeakPolarHBondContact OG-CB 3.29Å; S302-S305 PolarHBondContact OG-N 2.95Å; S302-S305 PolarHBondContact OG-OG 3.34Å; S302-S305 VanDerWaalsContact OG-OG 3.11Å
306E90.1Very high91.3Very high93 Ų9346.8 Ų46.844%0.43525%0.248SC..PPolyproline II helixtrans-66.1157.916063.5173-164.900112.2K94 F114K94-E306 IonicContact NZ-OE1 3.83Å; K94-E306 IonicContact NZ-OE2 2.76Å; K94-E306 PolarHBondContact NZ-OE2 3.34Å; F114-E306 HydrophobicContact CE2-CG 4.26Å
307G94Very high90.7Very high16 Ų1645.6 Ų45.617%0.16524%0.242CC..PPolyproline II helixtrans-79.1131.2172.800000112.2R99R99-G307 PolarHBondContact NH2-O 3.38Å
308L95.9Very high89.8Confident3 Ų347.6 Ų47.62%0.01626%0.255CS..EExtended strand (participates in β ladder)trans-96.6128.3174.6-61-179.2000109.5Y102 A107 L110 L111 F114 F299 L300Y102-L308 HydrophobicContact CD2-CB 4.11Å; Y102-L308 HydrophobicContact CD2-CD2 4.18Å; Y102-L308 HydrophobicContact CE2-CD2 3.83Å; A107-L308 HydrophobicContact CB-CB 4.4Å; A107-L308 HydrophobicContact CB-CD1 4.05Å; A107-L308 WeakPolarHBondContact O-CD1 3.48Å; L110-L308 HydrophobicContact CB-CD1 3.78Å; L110-L308 HydrophobicContact CD1-CD1 4.26Å; L111-L308 HydrophobicContact CD2-CD1 3.94Å; L111-L308 HydrophobicContact CD2-CG 4.26Å; L111-L308 HydrophobicContact CG-CD1 3.96Å; F114-L308 HydrophobicContact CE2-CD1 4.13Å; F114-L308 HydrophobicContact CE2-CD2 3.91Å; F114-L308 HydrophobicContact CE2-CG 4.27Å; F114-L308 HydrophobicContact CZ-CD2 4.31Å; F299-L308 CarbonylContact C-O 3.52Å; F299-L308 VanDerWaalsContact CA-O 3.29Å; F299-L308 WeakPolarHBondContact CA-O 3.37Å; L300-L308 PolarHBondContact N-O 2.95Å; L300-L308 PolarHBondContact O-N 3.26Å
309L95.5Very high88.2Confident30 Ų3052.1 Ų52.116%0.15728%0.276CS..EExtended strand (participates in β ladder)trans-76125.7176.6-178.155.8000109.1I101 Y102 R297 F299I101-L309 HydrophobicContact CG1-CD2 3.92Å; I101-L309 HydrophobicContact CG1-CG 4.32Å; I101-L309 HydrophobicContact CG2-CG 4.35Å; Y102-L309 PolarHBondContact N-O 3.34Å; R297-L309 HydrophobicContact CB-CD1 4.47Å; F299-L309 HydrophobicContact CD1-CB 4.12Å; F299-L309 HydrophobicContact CD1-CD1 4.25Å; F299-L309 HydrophobicContact CE1-CB 3.69Å; F299-L309 HydrophobicContact CE1-CD1 3.75Å; F299-L309 HydrophobicContact CE1-CG 4.21Å; F299-L309 HydrophobicContact CE2-CD1 4.26Å; F299-L309 HydrophobicContact CZ-CB 4.48Å; F299-L309 HydrophobicContact CZ-CD1 3.77Å
310L95.5Very high86Confident3 Ų355.2 Ų55.22%0.01631%0.307CS..EExtended strand (participates in β ladder)trans-92.7148.5179.6-61.6-176.4000111.7Y102 A107 L128 L276 A298 L300 T312 L315Y102-L310 CarbonylContact O-C 3.58Å; Y102-L310 WeakPolarHBondContact O-CA 3.2Å; A107-L310 HydrophobicContact CB-CD2 3.42Å; A107-L310 VanDerWaalsContact CB-CD2 3.42Å; L128-L310 HydrophobicContact CD1-CD1 4.4Å; L276-L310 HydrophobicContact CD1-CD1 3.86Å; A298-L310 HydrophobicContact CB-CB 4.18Å; A298-L310 HydrophobicContact CB-CD1 4.42Å; A298-L310 PolarHBondContact O-N 3.41Å; L300-L310 HydrophobicContact CB-CD1 4.01Å; L300-L310 HydrophobicContact CB-CD2 4.02Å; L300-L310 HydrophobicContact CB-CG 4.08Å; L310-T312 PolarHBondContact O-N 3.13Å; L310-L315 HydrophobicContact CD1-CD1 4.3Å
311K92.6Very high83.4Confident86 Ų8663.9 Ų63.937%0.37435%0.345SS..  trans-67.5115.3163.8-66.3-173.2-171.7173.40108.5I101 Y102 E103 S314I101-K311 HydrophobicContact CB-CG 4.33Å; I101-K311 HydrophobicContact CG2-CB 4.14Å; I101-K311 HydrophobicContact CG2-CG 3.42Å; I101-K311 VanDerWaalsContact CG2-CG 3.42Å; Y102-K311 PolarHBondContact O-N 3.08Å; E103-K311 HydrophobicContact CG-CD 4Å; E103-K311 IonicContact OE1-NZ 2.73Å; E103-K311 PolarHBondContact OE1-NZ 3.42Å; K311-S314 PolarHBondContact O-OG 2.9Å
312T85.7Confident80.4Confident28 Ų2866.3 Ų66.317%0.17237%0.367CS..SBendtrans-77.8-33-17842.90000112.7V295 A298 L310 S314 L315 L316V295-T312 HydrophobicContact CG1-CG2 4.2Å; A298-T312 HydrophobicContact CB-CG2 4.06Å; L310-T312 PolarHBondContact O-N 3.13Å; T312-S314 PolarHBondContact O-N 3.38Å; T312-S314 VanDerWaalsContact O-N 3.16Å; T312-L315 WeakPolarHBondContact O-CB 3.41Å; T312-L315 PolarHBondContact O-N 2.76Å; T312-L316 PolarHBondContact O-N 3.22Å
313D84.2Confident77.3Confident131 Ų13171.4 Ų71.470%0.70140%0.398SS*.THydrogen-bonded Turntrans-62.8-29.2-169.6-52.7-27.4000113.4L315D313-L315 VanDerWaalsContact C-N 3.34Å
314S81.2Confident74.4Confident77 Ų7775.6 Ų75.654%0.53841%0.411SS..THydrogen-bonded Turntrans-78.2-17.2176.752.60000114K311 T312K311-S314 PolarHBondContact O-OG 2.9Å; T312-S314 PolarHBondContact O-N 3.38Å; T312-S314 VanDerWaalsContact O-N 3.16Å
315L79.9Confident71.6Confident15 Ų1576.6 Ų76.68%0.07943%0.426CS..THydrogen-bonded Turntrans-100.7-23.3-172.2-71.7167.8000113.2V104 L276 I280 L310 T312 D313V104-L315 HydrophobicContact CG2-CD1 3.86Å; V104-L315 HydrophobicContact CG2-CD2 3.76Å; V104-L315 HydrophobicContact CG2-CG 4.02Å; L276-L315 HydrophobicContact CD2-CD1 3.87Å; L276-L315 HydrophobicContact CD2-CD2 3.5Å; L276-L315 HydrophobicContact CD2-CG 4.31Å; I280-L315 HydrophobicContact CD1-CB 3.8Å; I280-L315 HydrophobicContact CD1-CD1 3.62Å; I280-L315 HydrophobicContact CD1-CD2 4.16Å; I280-L315 HydrophobicContact CD1-CG 4.07Å; I280-L315 HydrophobicContact CG2-CB 4.49Å; L310-L315 HydrophobicContact CD1-CD1 4.3Å; T312-L315 WeakPolarHBondContact O-CB 3.41Å; T312-L315 PolarHBondContact O-N 2.76Å; D313-L315 VanDerWaalsContact C-N 3.34Å
316L81.6Confident68.9Low36 Ų3683.5 Ų83.519%0.18846%0.456CS..SBendtrans-73.4141.9-178.3-66.3176000110.6P293 V295 T312 K318P293-L316 HydrophobicContact CB-CD1 4.27Å; V295-L316 HydrophobicContact CB-CD2 4.13Å; V295-L316 HydrophobicContact CG2-CD2 4.02Å; T312-L316 PolarHBondContact O-N 3.22Å; L316-K318 PolarHBondContact O-N 3.2Å; L316-K318 VanDerWaalsContact O-N 3.12Å
317P76.7Confident66.3Low49 Ų4983.8 Ų83.832%0.31847%0.465SS..PPolyproline II helixtrans-59.2120.3168.525.5-32.8000108.1C284 L289 E319C284-P317 HydrophobicContact CB-CG 3.9Å; L289-P317 HydrophobicContact CD2-CB 4.47Å; L289-P317 HydrophobicContact CD2-CG 3.64Å; P317-E319 PolarHBondContact O-N 3.04Å
318K74.1Confident63.5Low185 Ų18591 Ų9180%0.80449%0.494SS*.PPolyproline II helixtrans-69.5129.2172.4-64.5179.4-178176.80106.8L316 A320L316-K318 PolarHBondContact O-N 3.2Å; L316-K318 VanDerWaalsContact O-N 3.12Å; K318-A320 PolarHBondContact O-N 3.13Å
319E61Low60.7Low96 Ų9699 Ų9945%0.44953%0.532SS..PPolyproline II helixtrans-51.8132158.7-68.7-179.7174.800106.4L289 N290 P317 K321L289-E319 HydrophobicContact CB-CG 3.87Å; L289-E319 HydrophobicContact CD1-CG 4.43Å; L289-E319 VanDerWaalsContact O-OE1 3.08Å; N290-E319 VanDerWaalsContact CA-OE1 3.24Å; N290-E319 WeakPolarHBondContact CA-OE1 3.3Å; N290-E319 PolarHBondContact N-OE1 3.21Å; N290-E319 VanDerWaalsContact N-OE1 3.17Å; P317-E319 PolarHBondContact O-N 3.04Å; E319-K321 PolarHBondContact O-N 3.45Å
320A50.2Low58Low96 Ų96102.9 Ų102.979%0.79356%0.556SS**  trans-59.892.1163.600000105K318 T322K318-A320 PolarHBondContact O-N 3.13Å; A320-T322 VanDerWaalsContact C-N 3.27Å; A320-T322 PolarHBondContact O-N 3.25Å
321K42.5Very low55.6Low183 Ų183110.6 Ų110.680%0.79659%0.592SS**  trans-53.1110.1157.9-69.8-175.8178.1-175.50102.6E319 T323E319-K321 PolarHBondContact O-N 3.45Å; K321-T323 PolarHBondContact O-N 3.06Å
322T31.7Very low53.2Low110 Ų110111.9 Ų111.968%0.67561%0.607SS**  trans-51.498.3166.1-1.80000104.9A320 E324A320-T322 VanDerWaalsContact C-N 3.27Å; A320-T322 PolarHBondContact O-N 3.25Å; T322-E324 HydrophobicContact CG2-CG 4.06Å; T322-E324 PolarHBondContact O-N 3.07Å
323T31.3Very low51.3Low108 Ų108114.5 Ų114.566%0.66363%0.632SS**  trans-6970.2160.1390000105.6K321 A325K321-T323 PolarHBondContact O-N 3.06Å; T323-A325 VanDerWaalsContact C-N 3.26Å
324E33.8Very low49.4Very low150 Ų150117.3 Ų117.370%0.70164%0.641SS**  trans-89.51.9157.9-74.6-175.7170.500110.4T322T322-E324 HydrophobicContact CG2-CG 4.06Å; T322-E324 PolarHBondContact O-N 3.07Å
325A34.8Very low47.8Very low94 Ų94118 Ų11878%0.77765%0.651SS**THydrogen-bonded Turntrans-93.48.717600000114.9T323T323-A325 VanDerWaalsContact C-N 3.26Å
326E35Very low46.5Very low165 Ų165124.8 Ų124.877%0.77171%0.709SS**THydrogen-bonded Turntrans-113.712.1171.9-73.6-172.8178.100113.8
327T35.1Very low44.7Very low99 Ų99129.2 Ų129.261%0.60774%0.735SS**SBendtrans-110.88173.8150000115.6
328E35.6Very low43Very low167 Ų167133.4 Ų133.478%0.7876%0.757SS**SBendtrans-108-5.5176.5-73.4-165.4162.700115.9
329E35.7Very low41.3Very low172 Ų172130.6 Ų130.680%0.80476%0.755SS**SBendtrans-102.4-5.7178-69.4-167.3170.400115.4
330T39.7Very low40.2Very low110 Ų110132.6 Ų132.668%0.67577%0.773SS**SBendtrans-91.90.8172.736.60000114.8
331Q45.1Very low39.5Very low166 Ų166134.9 Ų134.978%0.77677%0.771SS**SBendtrans-104.9-1.2177.2-68.5-168.32.200115.6
332T41.6Very low39.3Very low112 Ų112131.7 Ų131.769%0.68777%0.77SS**SBendtrans-110.1-3.5176.747.90000114.7
333A46.2Very low39.9Very low83 Ų83133.2 Ų133.269%0.68678%0.777SS**SBendtrans-92.4-8.8177.800000115.1
334E45.6Very low40.5Very low190 Ų190135.2 Ų135.289%0.88879%0.785SS**SBendtrans-107.210.5177.8-83.9-170.7158.500114.4
335A46.6Very low41.1Very low91 Ų91133.9 Ų133.975%0.75279%0.792SS**  trans-124.718.6-176.700000115.9
336A52.2Low41.7Very low158 Ų158137.5 Ų137.5100%1.30679%0.794SS**  trans-137.10170.300000110

Retrieved 336 of 336 residues in 635.3 ms (Link to these results)