A0A3B3VN18_9TELE Loading...

Mitochondrial translational initiation factor 3

AlphaFold DB , UniProt , Accession A0A3B3VN18, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 280 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M37.4Very low45Very low244 Ų244157.7 Ų157.7100%1.20286%0.86SS**  0131.30-65.4166.485.800107.5
2S40Very low45.1Very low119 Ų119158.3 Ų158.383%0.83285%0.851SS**  trans55.7105.7176.9-86.60000118.1
3A43.4Very low45.8Very low108 Ų108157.4 Ų157.489%0.89386%0.855SS**  66.9111.960.700000114
4G46.9Very low45.4Very low79 Ų79154.4 Ų154.481%0.81484%0.844SS**  trans-171.670.2173.700000112.6
5R46.5Very low45Very low250 Ų250157.3 Ų157.394%0.94384%0.838SS**  trans-71.5135.7166-89179.7-179.2179.6-0109.2
6V48.5Very low44.6Very low135 Ų135153.6 Ų153.682%0.81884%0.836SS**  trans-128.7124.3156-1700000109.4
7R42.9Very low44.5Very low198 Ų198152.9 Ų152.975%0.74783%0.828SS**  trans-104.3125-171.6164.5175.5134.4179.9-3106.8L9R7-L9 HydrophobicContact CG-CG 4.47Å
8W42.1Very low44.2Very low240 Ų240151.7 Ų151.791%0.90983%0.831SS**PPolyproline II helixtrans-99.7123.5166.8-89.883.2000109.5
9L54.9Low43.6Very low124 Ų124148.1 Ų148.165%0.64983%0.832SS**PPolyproline II helixtrans-88.4137.6-175.6-81154.8000110.5R7R7-L9 HydrophobicContact CG-CG 4.47Å
10L46.7Very low43.1Very low159 Ų159144.6 Ų144.683%0.83283%0.831SS**PPolyproline II helixtrans-66127.8161.7-88.973.4000109.5
11G45.2Very low42.8Very low79 Ų79142.9 Ų142.981%0.81483%0.828SS**  trans-97.2100.5166.100000110.6
12H46.3Very low43Very low164 Ų164137.6 Ų137.676%0.75981%0.809SS**  trans-87.7129156.5-107.3-97.2000107.8
13T55.1Low43Very low147 Ų147135.4 Ų135.490%0.90281%0.805SS**  trans-129.514615653.80000110.5
14V39.9Very low43.5Very low116 Ų116136.3 Ų136.370%0.70380%0.802SS**  trans-125.3133.4-155.9146.80000107.3
15R39.2Very low43.1Very low198 Ų198135 Ų13575%0.74779%0.788SS**  trans56.6128.8132.4-163.6180-164143.62.7120.6M17R15-M17 HydrophobicContact CG-CB 4.2Å; R15-M17 HydrophobicContact CG-SD 4.45Å; R15-M17 PolarHBondContact NE-SD 2.9Å
16A38.3Very low43Very low98 Ų98133.2 Ų133.281%0.8178%0.783SS**  trans-151.3123134.700000105.3
17M43.1Very low42.5Very low142 Ų142138 Ų13870%0.779%0.787SS**  cis75.1102.933.2-136.9166.5171.200114.3R15R15-M17 HydrophobicContact CG-CB 4.2Å; R15-M17 HydrophobicContact CG-SD 4.45Å; R15-M17 PolarHBondContact NE-SD 2.9Å
18C39.1Very low43Very low130 Ų130133.9 Ų133.988%0.87878%0.784SS**  trans-167110.5144.5-900000104.5
19G32.1Very low43.9Very low83 Ų83128 Ų12886%0.85678%0.776SS**  81.4113.479.900000107.9
20G34.9Very low43.4Very low78 Ų78126 Ų12680%0.80478%0.778SS**  cis122.1120.826.500000106.9
21S36Very low43.4Very low110 Ų110125.5 Ų125.577%0.76978%0.775SS**  trans-177.7118.4155.6-150.30000112.7
22T41.9Very low43.1Very low132 Ų132127.3 Ų127.381%0.8177%0.77SS**  trans31.1119.3136.658.70000119.3
23G39.1Very low42.9Very low73 Ų73124.8 Ų124.875%0.75377%0.771SS**  127.9169.77400000110.8
24P55Low42.3Very low128 Ų128123 Ų12383%0.83177%0.771SS**  trans-117.3165.8-134.239.4-29.9000116.7
25G38.9Very low42.1Very low50 Ų50121.4 Ų121.452%0.51578%0.779SS.*  trans97.8112.2132.700000122.1
26Y43Very low42.1Very low213 Ų213119.2 Ų119.284%0.83578%0.781SS**  64.8152.9129.1-31.8-76.9000124.4
27W37.8Very low41.9Very low237 Ų237120.7 Ų120.790%0.89878%0.784SS**  trans80.6130.9168.7-68.870.8000115.7
28T54.1Low41.8Very low111 Ų111120.4 Ų120.468%0.68178%0.781SS**  cis-171179.911.7110000109.9
29P60.5Low41.8Very low116 Ų116122.9 Ų122.975%0.75377%0.772SS**  trans-111.4-171.7-152.945-40.1000116.8
30A44.6Very low42.2Very low83 Ų83126.6 Ų126.669%0.68677%0.766SS**  trans81.5150.3153.200000117.2
31L46.6Very low42.2Very low148 Ų148126 Ų12678%0.77576%0.76SS**  cis-167.6150.530.3-154.488.6000110.7
32T39.8Very low42.6Very low116 Ų116128.2 Ų128.271%0.71276%0.762SS**  trans58125.1140.447.50000125.5
33S42Very low42.8Very low111 Ų111129.4 Ų129.478%0.77676%0.762SS**  -175.2117.397.742.70000108.4
34A41.5Very low42.9Very low109 Ų109131.3 Ų131.390%0.90176%0.764SS**  62.3112.679.700000114
35G36.9Very low42.4Very low84 Ų84130.3 Ų130.387%0.86676%0.76SS**  trans175.358175.400000113.7
36L38.2Very low42.6Very low152 Ų152132.9 Ų132.980%0.79677%0.77SS**  trans-76.8130.7165.9-176.582.1000108.9
37C35.4Very low42.4Very low128 Ų128134.9 Ų134.987%0.86578%0.776SS**  trans-155.9102.7147-148.70000110.2
38E39.8Very low42.6Very low136 Ų136134.5 Ų134.564%0.63678%0.775SS**  trans-59.6160.7150.1-69.4169.496.300108.3
39R40.1Very low42.2Very low183 Ų183140.5 Ų140.569%0.69179%0.785SS**  cis176.9157.441.9-149.9166.6-166.9-1154.2108.7
40H39.7Very low41.6Very low160 Ų160140.4 Ų140.474%0.74179%0.787SS**  trans72.7136.5162.2-51.3-79.9000116.8
41G36.1Very low41.6Very low65 Ų65140.7 Ų140.767%0.6779%0.789SS**  cis138.9136.813.800000108.5
42I44.2Very low41Very low157 Ų157142.9 Ų142.981%0.80579%0.793SS**  trans91.8107.8157.6-57.1173.6000118.3
43L46Very low40.8Very low158 Ų158142.4 Ų142.483%0.82779%0.794SS**  trans40.7119.7136.4-70.9120.8000120.4
44S41.2Very low40.9Very low112 Ų112142 Ų14278%0.78379%0.787SS**  -157.4118125-1760000111S46S44-S46 PolarHBondContact O-N 3.36Å
45S43.9Very low40.9Very low108 Ų108144.9 Ų144.976%0.75578%0.782SS**  trans-57.4113.3162.941.50000111.3
46S43Very low41.2Very low104 Ų104146 Ų14673%0.72777%0.772SS**  trans-114.197.5156.671.10000108.9S44 R48S44-S46 PolarHBondContact O-N 3.36Å; S46-R48 VanDerWaalsContact C-N 3.3Å; S46-R48 PolarHBondContact O-N 3.27Å
47W38.3Very low41.6Very low254 Ų254144 Ų14496%0.96277%0.768SS**  trans-56.697.1158.3-86-3.3000108.5R49W47-R49 PolarHBondContact O-N 3.06Å
48R42.2Very low41.9Very low229 Ų229145.6 Ų145.686%0.86476%0.763SS**  trans-85.5103.4163.6-156.2-165.3-76.1-96.37.9106.9S46 S50S46-R48 VanDerWaalsContact C-N 3.3Å; S46-R48 PolarHBondContact O-N 3.27Å; R48-S50 PolarHBondContact O-N 3.4Å
49R45.2Very low41.9Very low238 Ų238147.4 Ų147.490%0.89877%0.771SS**  trans-55.9107.2164.2-72.4-178.8176.6-140.9-0.1107.7W47W47-R49 PolarHBondContact O-N 3.06Å
50S49.4Very low41.6Very low114 Ų114143.9 Ų143.980%0.79777%0.77SS**  trans-83.5124.7161.5-174.30000107.5R48R48-S50 PolarHBondContact O-N 3.4Å
51A44.8Very low41.9Very low88 Ų88142 Ų14273%0.72777%0.772SS**  trans-57.9136.717700000110.4S53A51-S53 PolarHBondContact O-N 3.12Å; A51-S53 VanDerWaalsContact O-N 3.12Å
52F34.2Very low42.2Very low195 Ų195145 Ų14586%0.85578%0.777SS**  trans-54.6104168-158.3-99.4000108.5T54F52-T54 WeakPolarHBondContact CD1-OG1 3.27Å; F52-T54 VanDerWaalsContact CE1-OG1 3.27Å; F52-T54 WeakPolarHBondContact CE1-OG1 3.33Å
53S34.8Very low42.2Very low106 Ų106143.1 Ų143.174%0.74178%0.776SS**  trans-105.4100.6168.2-152.80000107.4A51 E55A51-S53 PolarHBondContact O-N 3.12Å; A51-S53 VanDerWaalsContact O-N 3.12Å; S53-E55 PolarHBondContact O-N 3.35Å; S53-E55 VanDerWaalsContact O-N 3.09Å
54T44Very low42.2Very low101 Ų101140 Ų14062%0.6277%0.772SS**  trans-75.387.6174.5-44.60000108.8F52F52-T54 WeakPolarHBondContact CD1-OG1 3.27Å; F52-T54 VanDerWaalsContact CE1-OG1 3.27Å; F52-T54 WeakPolarHBondContact CE1-OG1 3.33Å
55E42.1Very low42.4Very low170 Ų170141 Ų14179%0.79477%0.774SS**  trans-133100.1156.6-64.8-170.3-161.600106.2S53 P57S53-E55 PolarHBondContact O-N 3.35Å; S53-E55 VanDerWaalsContact O-N 3.09Å; E55-P57 VanDerWaalsContact O-CD 3.29Å; E55-P57 WeakPolarHBondContact O-CD 3.29Å
56V43.3Very low42.2Very low109 Ų109145.2 Ų145.266%0.66178%0.778SS**  trans-87.4108170.6178.20000105.9E58V56-E58 HydrophobicContact CG1-CG 4.09Å; V56-E58 PolarHBondContact O-N 3.45Å
57P45.7Very low42Very low109 Ų109149.8 Ų149.871%0.70879%0.785SS**  trans-77.599.2162.9-0.320.5000106.2E55 E59E55-P57 VanDerWaalsContact O-CD 3.29Å; E55-P57 WeakPolarHBondContact O-CD 3.29Å; P57-E59 PolarHBondContact O-N 3.09Å
58E41.1Very low42Very low161 Ų161146.2 Ų146.275%0.75278%0.776SS**  trans-67.371.9161.6-81.2-79.8157.800108.5V56 T60V56-E58 HydrophobicContact CG1-CG 4.09Å; V56-E58 PolarHBondContact O-N 3.45Å; E58-T60 PolarHBondContact O-N 3.2Å
59E40.3Very low41.9Very low175 Ų175144.5 Ų144.582%0.81878%0.775SS**  trans-87.496.2159.2-72.4-162.4173.300107.6P57 P61P57-E59 PolarHBondContact O-N 3.09Å; E59-P61 WeakPolarHBondContact O-CD 3.37Å
60T33.8Very low41.8Very low109 Ų109141 Ų14167%0.66977%0.769SS**  trans-69.1114.9163.743.10000108E58 T62E58-T60 PolarHBondContact O-N 3.2Å; T60-T62 PolarHBondContact O-N 3.1Å
61P46Very low41.7Very low120 Ų120140.6 Ų140.678%0.77976%0.758SS**  trans-68.1109.3169.926.7-31.3000107.8E59E59-P61 WeakPolarHBondContact O-CD 3.37Å
62T42.7Very low42.2Very low127 Ų127141.8 Ų141.878%0.77976%0.758SS**  trans-49.1124.8166.936.60000109T60 A64T60-T62 PolarHBondContact O-N 3.1Å; T62-A64 PolarHBondContact O-N 3.34Å; T62-A64 VanDerWaalsContact O-N 3.08Å
63P44.1Very low43Very low119 Ų119140.8 Ų140.877%0.77376%0.756SS**  trans-63.1119.6179.924.4-31.7000108.6V65P63-V65 PolarHBondContact O-N 2.98Å
64A46.9Very low43.6Very low91 Ų91138.7 Ų138.775%0.75275%0.745SS**  trans-51.1114.3173.200000109.3T62 K66T62-A64 PolarHBondContact O-N 3.34Å; T62-A64 VanDerWaalsContact O-N 3.08Å; A64-K66 PolarHBondContact O-N 3.49Å
65V44.5Very low44Very low134 Ų134139.4 Ų139.481%0.81275%0.745SS**  trans-59103.6173.7176.90000107P63 K67P63-V65 PolarHBondContact O-N 2.98Å; V65-K67 PolarHBondContact O-N 3.12Å
66K38.8Very low44.9Very low196 Ų196134.9 Ų134.985%0.85274%0.737SS**  trans-56.8108.4172.3-68.5-177.9-179.8177.90106.8A64 K68A64-K66 PolarHBondContact O-N 3.49Å; K66-K68 VanDerWaalsContact C-N 3.34Å; K66-K68 PolarHBondContact O-N 3.39Å
67K39.7Very low46.4Very low200 Ų200133.3 Ų133.387%0.8773%0.731SS**  trans-56.5102.5169.4-76.7-177.3178175.60107V65 K69V65-K67 PolarHBondContact O-N 3.12Å; K67-K69 PolarHBondContact O-N 2.69Å
68K38.8Very low48.3Very low180 Ų180130.3 Ų130.378%0.78371%0.708SS**  trans-59.9108.1174-171.2176-178179.50106.2K66 Q70K66-K68 VanDerWaalsContact C-N 3.34Å; K66-K68 PolarHBondContact O-N 3.39Å; K68-Q70 PolarHBondContact O-N 2.86Å
69K38.7Very low50.5Low192 Ų192125.7 Ų125.784%0.83569%0.693SS**  trans-55.5108.3172.9-160.9175.1-174.5-179.90105.7K67 D71K67-K69 PolarHBondContact O-N 2.69Å; K69-D71 PolarHBondContact O-N 3.17Å
70Q43Very low53Low165 Ų165119.5 Ų119.577%0.77167%0.67SS**  trans-62120.7-178.9-79.6175.1-13.900107.5K68K68-Q70 PolarHBondContact O-N 2.86Å
71D48.4Very low55.7Low106 Ų106116.5 Ų116.557%0.56765%0.651SS**  trans-59.4126.5172.6-63.1-68.4000108K69 H73 A74K69-D71 PolarHBondContact O-N 3.17Å; D71-H73 PolarHBondContact O-N 2.87Å; D71-A74 VanDerWaalsContact O-CB 3.31Å; D71-A74 WeakPolarHBondContact O-CB 3.27Å; D71-A74 PolarHBondContact O-N 3.24Å
72P54.7Low57.8Low113 Ų113112.4 Ų112.473%0.73463%0.63SS**THydrogen-bonded Turntrans-61.5-15.1-178.522.9-32.3000113
73H51.2Low60Low173 Ų173115.4 Ų115.480%0.80163%0.628SS**THydrogen-bonded Turntrans-88.2-4.9174.6-74.4-62.9000115D71 N75D71-H73 PolarHBondContact O-N 2.87Å; H73-N75 PolarHBondContact O-N 3.22Å
74A48.3Very low62.3Low62 Ų62118.6 Ų118.651%0.51263%0.629SS.*G310 helixtrans-69.6-13.5177.500000113.3D71 A76D71-A74 VanDerWaalsContact O-CB 3.31Å; D71-A74 WeakPolarHBondContact O-CB 3.27Å; D71-A74 PolarHBondContact O-N 3.24Å; A74-A76 VanDerWaalsContact C-N 3.32Å; A74-A76 PolarHBondContact O-N 3.35Å
75N52.6Low64.4Low116 Ų116114.7 Ų114.762%0.6260%0.596SS**G310 helixtrans-85.75.1-175.6-63.5-13.9000114.3H73 S77H73-N75 PolarHBondContact O-N 3.22Å; N75-S77 PolarHBondContact O-N 2.81Å
76A61.3Low66.6Low75 Ų75112.8 Ų112.862%0.6259%0.586SS**G310 helixtrans-78.37.9179.100000114.1A74 I78A74-A76 VanDerWaalsContact C-N 3.32Å; A74-A76 PolarHBondContact O-N 3.35Å; A76-I78 PolarHBondContact O-N 2.81Å
77S73.4Confident69.2Low77 Ų77107.1 Ų107.154%0.53856%0.562SS.*SBendtrans-83.4111.3172.958.70000109.9N75 S79N75-S77 PolarHBondContact O-N 2.81Å; S77-S79 PolarHBondContact O-N 2.95Å; S77-S79 PolarHBondContact O-OG 3.16Å
78I85.4Confident71.8Confident46 Ų46106.4 Ų106.424%0.23655%0.554CS.*  trans-52.1116.4169.1-66.9174.5000108A76 V120 E142 Q143 L146A76-I78 PolarHBondContact O-N 2.81Å; I78-V120 HydrophobicContact CG2-CG1 3.65Å; I78-E142 HydrophobicContact CD1-CB 4.37Å; I78-Q143 WeakPolarHBondContact O-CG 3.46Å; I78-Q143 PolarHBondContact O-NE2 2.8Å; I78-L146 HydrophobicContact CB-CD1 4.09Å; I78-L146 HydrophobicContact CD1-CD1 3.27Å; I78-L146 HydrophobicContact CD1-CG 4.1Å; I78-L146 HydrophobicContact CG1-CD1 3.42Å; I78-L146 VanDerWaalsContact CG1-CD1 3.42Å
79S88.6Confident74.4Confident63 Ų63103.5 Ų103.544%0.44154%0.543SS..  trans-141.5157.4-179610000109.8S77S77-S79 PolarHBondContact O-N 2.95Å; S77-S79 PolarHBondContact O-OG 3.16Å
80S91.6Very high77.1Confident46 Ų4694.3 Ų94.332%0.32250%0.504SS..BIsolated β-bridgetrans-81.8132.4176.9-175.90000110.1G82 L119S80-G82 VanDerWaalsContact C-N 3.3Å; S80-L119 VanDerWaalsContact CA-O 3.32Å; S80-L119 WeakPolarHBondContact CA-O 3.49Å; S80-L119 PolarHBondContact OG-O 2.73Å; S80-L119 VanDerWaalsContact OG-O 3.07Å
81V90.7Very high79.6Confident45 Ų4588.9 Ų88.927%0.27348%0.478SS..  trans-74-25.7178.6-178.60000111.4L119 L121 Y131V81-L119 PolarHBondContact N-O 3.01Å; V81-L121 HydrophobicContact CG2-CB 3.84Å; V81-L121 HydrophobicContact CG2-CD2 4.47Å; V81-Y131 HydrophobicContact CG2-CE1 4.12Å
82G90Very high81.9Confident34 Ų3483.8 Ų83.835%0.35145%0.451SS..THydrogen-bonded Turntrans71.5-146.9-175.100000112.5S80S80-G82 VanDerWaalsContact C-N 3.3Å
83R89.9Confident83.8Confident190 Ų19080.1 Ų80.172%0.71743%0.425SS*.THydrogen-bonded Turntrans-85.9-17.4-174.9-59.4-178.5-170.3176.32.8114I85R83-I85 PolarHBondContact O-N 3.43Å
84K91.3Very high85.9Confident187 Ų18772.1 Ų72.181%0.81339%0.388SS*.  trans-9082.8-175.1-170.3178.4179.2179.10110.1
85I92.5Very high88Confident9 Ų973.5 Ų73.55%0.04638%0.384CS..  trans-90.4123.5179.4-53.7169.8000109.2R83 I90 R105 I109 L119R83-I85 PolarHBondContact O-N 3.43Å; I85-I90 HydrophobicContact CD1-CD1 4.22Å; I85-I90 HydrophobicContact CG2-CD1 4.34Å; I85-I90 HydrophobicContact CG2-CG2 4.25Å; I85-R105 HydrophobicContact CB-CB 4.35Å; I85-R105 HydrophobicContact CD1-CB 4.26Å; I85-R105 HydrophobicContact CG2-CB 4.36Å; I85-I109 HydrophobicContact CD1-CD1 4.46Å; I85-I109 HydrophobicContact CD1-CG1 4.11Å; I85-L119 HydrophobicContact CD1-CD2 3.51Å; I85-L119 HydrophobicContact CG1-CD2 3.89Å
86P90.6Very high89.9Confident94 Ų9474 Ų7461%0.6139%0.386SS*.SBendtrans-72.7-33.8-177.324.1-28.8000113.1
87H92.4Very high91.2Very high76 Ų7672.7 Ų72.735%0.35238%0.381SS..  trans-87.7147.1-176.3-51.1100.2000111.9I90 R105 P129 Y131H87-I90 HydrophobicContact CB-CG2 3.72Å; H87-R105 WeakPolarHBondContact O-CD 3.46Å; H87-P129 HydrophobicContact CB-CG 3.99Å; H87-P129 VanDerWaalsContact CG-CG 3.43Å; H87-P129 VanDerWaalsContact ND1-CG 3.34Å; H87-P129 WeakPolarHBondContact ND1-CG 3.48Å; H87-Y131 PolarHBondContact ND1-OH 2.94Å
88R93.5Very high92.2Very high186 Ų18675.1 Ų75.170%0.70238%0.383SS*.SBendtrans-77.9-46.2176.8-72-176.9172.9-165-2.5112H104 R105R88-H104 WeakPolarHBondContact O-CA 3.44Å; R88-H104 PolarHBondContact O-CD2 3.31Å; R88-R105 PolarHBondContact O-N 3.09Å
89E94.3Very high92.6Very high118 Ų11877.7 Ų77.755%0.55140%0.398SS*.EExtended strand (participates in β ladder)trans-113.8131.5-179.6-74.3175-166.700109.2L102E89-L102 HydrophobicContact CB-CD2 3.79Å; E89-L102 HydrophobicContact CG-CD2 4Å
90I95.6Very high92.8Very high0 Ų077.7 Ų77.70%039%0.393CS..EExtended strand (participates in β ladder)trans-140145.8-175.457.9170000110.3I85 H87 V92 M103 V108 L119 P129 Y131I85-I90 HydrophobicContact CD1-CD1 4.22Å; I85-I90 HydrophobicContact CG2-CD1 4.34Å; I85-I90 HydrophobicContact CG2-CG2 4.25Å; H87-I90 HydrophobicContact CB-CG2 3.72Å; I90-V92 HydrophobicContact CD1-CG2 3.92Å; I90-V92 HydrophobicContact CG1-CG2 3.91Å; I90-M103 PolarHBondContact N-O 3.21Å; I90-M103 PolarHBondContact O-N 3.07Å; I90-V108 HydrophobicContact CD1-CB 4.06Å; I90-V108 HydrophobicContact CD1-CG1 3.92Å; I90-V108 HydrophobicContact CD1-CG2 3.77Å; I90-V108 HydrophobicContact CG1-CG2 3.97Å; I90-L119 HydrophobicContact CD1-CD2 4.43Å; I90-P129 HydrophobicContact CG2-CG 4.3Å; I90-Y131 HydrophobicContact CB-CD2 3.67Å; I90-Y131 HydrophobicContact CB-CE2 3.78Å; I90-Y131 HydrophobicContact CD1-CD2 3.96Å; I90-Y131 HydrophobicContact CD1-CE2 4.31Å; I90-Y131 HydrophobicContact CD1-CG 4.33Å; I90-Y131 HydrophobicContact CG1-CD2 4.39Å; I90-Y131 HydrophobicContact CG2-CD2 3.83Å; I90-Y131 HydrophobicContact CG2-CE2 3.37Å
91Q95.9Very high92.9Very high50 Ų5076.5 Ų76.523%0.23439%0.388CS..EExtended strand (participates in β ladder)trans-88.2127.6171.5-171.7169.133.500109G101 P128 P129 L130 Y131Q91-G101 WeakPolarHBondContact CA-O 3.33Å; Q91-P128 HydrophobicContact CB-CG 4.49Å; Q91-P129 PolarHBondContact N-O 3.09Å; Q91-L130 HydrophobicContact CB-CD1 3.84Å; Q91-L130 HydrophobicContact CG-CD1 3.63Å; Q91-Y131 PolarHBondContact O-N 2.93Å
92V95.6Very high93.1Very high0 Ų079.2 Ų79.20%040%0.4CS..EExtended strand (participates in β ladder)trans-120.2133.9-174.6-173.40000111.6I90 N99 L100 G101 V108 Y131 L133I90-V92 HydrophobicContact CD1-CG2 3.92Å; I90-V92 HydrophobicContact CG1-CG2 3.91Å; V92-N99 PolarHBondContact O-OD1 3Å; V92-L100 HydrophobicContact CB-CB 4.43Å; V92-L100 HydrophobicContact CG1-CD1 4.08Å; V92-L100 PolarHBondContact O-N 3.44Å; V92-G101 PolarHBondContact N-O 3.47Å; V92-V108 HydrophobicContact CG2-CB 4.49Å; V92-V108 HydrophobicContact CG2-CG1 4.07Å; V92-V108 HydrophobicContact CG2-CG2 3.58Å; V92-Y131 WeakPolarHBondContact CA-O 3.43Å; V92-L133 HydrophobicContact CG1-CD1 4.17Å; V92-L133 HydrophobicContact CG1-CG 3.99Å
93I95.8Very high93.4Very high35 Ų3579.5 Ų79.518%0.17939%0.393CS..EExtended strand (participates in β ladder)trans-108.6136.7169.4-57.8172.3000108.2E98 L122 L130 Y131 Q132 L133I93-E98 CarbonylContact C-O 3.56Å; I93-E98 WeakPolarHBondContact CA-O 3.34Å; I93-L122 HydrophobicContact CD1-CD1 4.3Å; I93-L130 HydrophobicContact CD1-CD1 3.86Å; I93-L130 HydrophobicContact CD1-CD2 4.09Å; I93-L130 HydrophobicContact CD1-CG 4.24Å; I93-L130 HydrophobicContact CG1-CD1 4.01Å; I93-Y131 PolarHBondContact N-O 3.11Å; I93-Q132 HydrophobicContact CB-CB 4.26Å; I93-Q132 HydrophobicContact CB-CG 4.28Å; I93-Q132 HydrophobicContact CG2-CG 4.4Å; I93-Q132 CarbonylContact O-C 3.58Å; I93-Q132 WeakPolarHBondContact O-CA 3.44Å; I93-L133 PolarHBondContact O-N 3.2Å
94D94.6Very high93.7Very high6 Ų674.3 Ų74.33%0.03238%0.376CS..  trans-75.3176.2176.9-148.1-4.8000112.2D96 G97 E98 L100 K115D94-D96 VanDerWaalsContact C-N 3.33Å; D94-D96 PolarHBondContact O-N 2.73Å; D94-G97 PolarHBondContact O-N 3.2Å; D94-E98 HydrophobicContact CB-CB 4.28Å; D94-E98 PolarHBondContact N-O 2.8Å; D94-L100 HydrophobicContact CB-CD1 4.31Å; D94-L100 HydrophobicContact CB-CD2 4.46Å; D94-L100 HydrophobicContact CB-CG 4.25Å; D94-K115 IonicContact OD1-NZ 2.62Å; D94-K115 PolarHBondContact OD1-NZ 2.97Å; D94-K115 IonicContact OD2-NZ 3.13Å; D94-K115 PolarHBondContact OD2-NZ 2.9Å
95E93.4Very high93.8Very high90 Ų9070.1 Ų70.142%0.42136%0.355SS..THydrogen-bonded Turntrans-66.1-34.6177.767.2-176.6162.500113.3G97 L117 L133E95-G97 PolarHBondContact O-N 3.14Å; E95-L117 HydrophobicContact CB-CD1 4.21Å; E95-L117 HydrophobicContact CG-CD1 4.23Å; E95-L117 WeakPolarHBondContact OE2-CD2 3.35Å; E95-L133 WeakPolarHBondContact CA-O 3.44Å
96D91Very high94Very high126 Ų12671.6 Ų71.667%0.67437%0.369SS*.THydrogen-bonded Turntrans-75.9-4.3177.7-59.3-60.1000113.3D94 E98D94-D96 VanDerWaalsContact C-N 3.33Å; D94-D96 PolarHBondContact O-N 2.73Å; D96-E98 HydrophobicContact CB-CG 4.47Å
97G89.8Confident94.2Very high49 Ų4970.1 Ų70.151%0.50536%0.356SS..SBendtrans86.85.1-176.300000114.2D94 E95D94-G97 PolarHBondContact O-N 3.2Å; E95-G97 PolarHBondContact O-N 3.14Å
98E94Very high94.3Very high127 Ų12766.5 Ų66.559%0.59334%0.339SS*.  trans-67.5137.1171.9-63-167.8166.200111.1I93 D94 D96 L100I93-E98 CarbonylContact C-O 3.56Å; I93-E98 WeakPolarHBondContact CA-O 3.34Å; D94-E98 HydrophobicContact CB-CB 4.28Å; D94-E98 PolarHBondContact N-O 2.8Å; D96-E98 HydrophobicContact CB-CG 4.47Å; E98-L100 PolarHBondContact O-N 3.11Å
99N93.8Very high94.4Very high100 Ų10059.8 Ų59.854%0.53532%0.317SS..EExtended strand (participates in β ladder)trans-89.1106.8179-1729.4000109.5V92 G101V92-N99 PolarHBondContact O-OD1 3Å; N99-G101 PolarHBondContact O-N 2.85Å; N99-G101 PolarHBondContact OD1-N 2.94Å; N99-G101 VanDerWaalsContact OD1-N 3.12Å
100L93Very high94.4Very high64 Ų6461.6 Ų61.634%0.33532%0.319SS..EExtended strand (participates in β ladder)trans-72.3-8.3175.6-58.3177.5000112.2V92 D94 E98 M103 I111 L133V92-L100 HydrophobicContact CB-CB 4.43Å; V92-L100 HydrophobicContact CG1-CD1 4.08Å; V92-L100 PolarHBondContact O-N 3.44Å; D94-L100 HydrophobicContact CB-CD1 4.31Å; D94-L100 HydrophobicContact CB-CD2 4.46Å; D94-L100 HydrophobicContact CB-CG 4.25Å; E98-L100 PolarHBondContact O-N 3.11Å; L100-M103 HydrophobicContact CB-SD 3.83Å; L100-M103 HydrophobicContact CD1-SD 4.41Å; L100-I111 HydrophobicContact CD1-CD1 4.33Å; L100-L133 HydrophobicContact CD1-CD1 4.27Å
101G93.8Very high94.3Very high21 Ų2162.9 Ų62.922%0.21633%0.325CS..EExtended strand (participates in β ladder)trans82.1-150.917600000112.4Q91 V92 N99Q91-G101 WeakPolarHBondContact CA-O 3.33Å; V92-G101 PolarHBondContact N-O 3.47Å; N99-G101 PolarHBondContact O-N 2.85Å; N99-G101 PolarHBondContact OD1-N 2.94Å; N99-G101 VanDerWaalsContact OD1-N 3.12Å
102L95.3Very high94.3Very high102 Ų10261.4 Ų61.453%0.53432%0.319SS..EExtended strand (participates in β ladder)trans-93117.7-175.3-158163.2000108.5E89 P128E89-L102 HydrophobicContact CB-CD2 3.79Å; E89-L102 HydrophobicContact CG-CD2 4Å; L102-P128 HydrophobicContact CD1-CG 3.82Å; L102-P128 HydrophobicContact CG-CG 4.1Å
103M94.9Very high94.2Very high40 Ų4065 Ų6520%0.19734%0.338CS..EExtended strand (participates in β ladder)trans-129.4152.1-174.1-59.6-171.67300111.2I90 L100 D107 V108 I111I90-M103 PolarHBondContact N-O 3.21Å; I90-M103 PolarHBondContact O-N 3.07Å; L100-M103 HydrophobicContact CB-SD 3.83Å; L100-M103 HydrophobicContact CD1-SD 4.41Å; M103-D107 HydrophobicContact CE-CB 3.84Å; M103-V108 HydrophobicContact CB-CG2 3.74Å; M103-V108 HydrophobicContact SD-CG2 4.43Å; M103-I111 HydrophobicContact CE-CD1 3.48Å; M103-I111 VanDerWaalsContact CE-CD1 3.48Å; M103-I111 HydrophobicContact SD-CD1 3.96Å
104H96.1Very high94.2Very high80 Ų8070.1 Ų70.137%0.3736%0.361SS..EExtended strand (participates in β ladder)trans-76.3143.2171.4-173.9-105.5000110R88 A106 D107 V108R88-H104 WeakPolarHBondContact O-CA 3.44Å; R88-H104 PolarHBondContact O-CD2 3.31Å; H104-A106 WeakPolarHBondContact ND1-CB 3.5Å; H104-A106 PolarHBondContact ND1-N 3.11Å; H104-A106 PolarHBondContact O-N 3.19Å; H104-D107 PolarHBondContact O-N 3.46Å; H104-V108 PolarHBondContact O-N 3.29Å
105R95Very high94.1Very high99 Ų9974 Ų7437%0.37438%0.378SS..Hα-helixtrans-51.5-29.8-177.666.3178-178.2179.51.5114.3I85 H87 R88 I109I85-R105 HydrophobicContact CB-CB 4.35Å; I85-R105 HydrophobicContact CD1-CB 4.26Å; I85-R105 HydrophobicContact CG2-CB 4.36Å; H87-R105 WeakPolarHBondContact O-CD 3.46Å; R88-R105 PolarHBondContact O-N 3.09Å; R105-I109 WeakPolarHBondContact O-CD1 3.19Å; R105-I109 VanDerWaalsContact O-CG1 3.26Å; R105-I109 WeakPolarHBondContact O-CG1 3.17Å; R105-I109 PolarHBondContact O-N 3.29Å; R105-I109 VanDerWaalsContact O-N 3.11Å
106A94.9Very high94.1Very high40 Ų4076.3 Ų76.333%0.33139%0.393SS..Hα-helixtrans-67.8-42.4-179.800000111.9H104 V108 I109 R110H104-A106 WeakPolarHBondContact ND1-CB 3.5Å; H104-A106 PolarHBondContact ND1-N 3.11Å; H104-A106 PolarHBondContact O-N 3.19Å; A106-V108 VanDerWaalsContact C-N 3.33Å; A106-I109 PolarHBondContact O-N 3.05Å; A106-R110 WeakPolarHBondContact O-CG 3.29Å; A106-R110 PolarHBondContact O-N 3.07Å
107D95Very high94.2Very high63 Ų6371.1 Ų71.134%0.33737%0.365SS..Hα-helixtrans-69.5-37.6179.9-55.7-41.3000110.4M103 H104 I109 R110 I111M103-D107 HydrophobicContact CE-CB 3.84Å; H104-D107 PolarHBondContact O-N 3.46Å; D107-I109 VanDerWaalsContact C-N 3.33Å; D107-I109 PolarHBondContact O-N 2.96Å; D107-R110 WeakPolarHBondContact O-CB 3.36Å; D107-R110 PolarHBondContact O-N 3.31Å; D107-R110 VanDerWaalsContact O-N 3.07Å; D107-I111 WeakPolarHBondContact O-CG1 3.06Å; D107-I111 PolarHBondContact O-N 3Å
108V95.3Very high94.4Very high1 Ų173.6 Ų73.61%0.00636%0.362CS..Hα-helixtrans-62.7-40.3175.4-177.30000111.5I90 V92 M103 H104 A106 R110 I111 I112 L119I90-V108 HydrophobicContact CD1-CB 4.06Å; I90-V108 HydrophobicContact CD1-CG1 3.92Å; I90-V108 HydrophobicContact CD1-CG2 3.77Å; I90-V108 HydrophobicContact CG1-CG2 3.97Å; V92-V108 HydrophobicContact CG2-CB 4.49Å; V92-V108 HydrophobicContact CG2-CG1 4.07Å; V92-V108 HydrophobicContact CG2-CG2 3.58Å; M103-V108 HydrophobicContact CB-CG2 3.74Å; M103-V108 HydrophobicContact SD-CG2 4.43Å; H104-V108 PolarHBondContact O-N 3.29Å; A106-V108 VanDerWaalsContact C-N 3.33Å; V108-R110 VanDerWaalsContact C-N 3.28Å; V108-R110 PolarHBondContact O-N 3.08Å; V108-I111 PolarHBondContact O-N 2.86Å; V108-I112 HydrophobicContact CG1-CD1 3.99Å; V108-I112 WeakPolarHBondContact O-CB 3.2Å; V108-I112 WeakPolarHBondContact O-CD1 3.43Å; V108-I112 WeakPolarHBondContact O-CG1 3.38Å; V108-I112 PolarHBondContact O-N 2.92Å; V108-L119 HydrophobicContact CG1-CD1 3.91Å; V108-L119 HydrophobicContact CG1-CD2 4.27Å
109I95.3Very high94.4Very high45 Ų4567.7 Ų67.723%0.23133%0.334CS..Hα-helixtrans-63-35.8174.3-68.9164000111.4I85 R105 A106 D107 N113I85-I109 HydrophobicContact CD1-CD1 4.46Å; I85-I109 HydrophobicContact CD1-CG1 4.11Å; R105-I109 WeakPolarHBondContact O-CD1 3.19Å; R105-I109 VanDerWaalsContact O-CG1 3.26Å; R105-I109 WeakPolarHBondContact O-CG1 3.17Å; R105-I109 PolarHBondContact O-N 3.29Å; R105-I109 VanDerWaalsContact O-N 3.11Å; A106-I109 PolarHBondContact O-N 3.05Å; D107-I109 VanDerWaalsContact C-N 3.33Å; D107-I109 PolarHBondContact O-N 2.96Å; I109-N113 VanDerWaalsContact O-CG 3.23Å; I109-N113 PolarHBondContact O-N 3.23Å; I109-N113 PolarHBondContact O-ND2 3.32Å
110R95.1Very high94.5Very high156 Ų15663 Ų6359%0.58931%0.309SS*.Hα-helixtrans-63.9-50175.1-66.2173.5179.7-178.3-1.7110.9A106 D107 V108 I112 N113 E114A106-R110 WeakPolarHBondContact O-CG 3.29Å; A106-R110 PolarHBondContact O-N 3.07Å; D107-R110 WeakPolarHBondContact O-CB 3.36Å; D107-R110 PolarHBondContact O-N 3.31Å; D107-R110 VanDerWaalsContact O-N 3.07Å; V108-R110 VanDerWaalsContact C-N 3.28Å; V108-R110 PolarHBondContact O-N 3.08Å; R110-I112 VanDerWaalsContact C-N 3.3Å; R110-I112 PolarHBondContact O-N 2.99Å; R110-N113 PolarHBondContact O-N 3.48Å; R110-E114 WeakPolarHBondContact O-CG 3.49Å; R110-E114 PolarHBondContact O-N 3Å
111I93.8Very high94.4Very high27 Ų2761.9 Ų61.914%0.13830%0.303CS..Hα-helixtrans-58.9-42.1178.5-63.7167.4000111.5L100 M103 D107 V108 N113 E114 K115 L133L100-I111 HydrophobicContact CD1-CD1 4.33Å; M103-I111 HydrophobicContact CE-CD1 3.48Å; M103-I111 VanDerWaalsContact CE-CD1 3.48Å; M103-I111 HydrophobicContact SD-CD1 3.96Å; D107-I111 WeakPolarHBondContact O-CG1 3.06Å; D107-I111 PolarHBondContact O-N 3Å; V108-I111 PolarHBondContact O-N 2.86Å; I111-N113 VanDerWaalsContact C-N 3.28Å; I111-N113 PolarHBondContact O-N 2.73Å; I111-E114 PolarHBondContact O-N 3.09Å; I111-K115 HydrophobicContact CG2-CD 4.07Å; I111-K115 HydrophobicContact CG2-CG 4.33Å; I111-K115 WeakPolarHBondContact O-CB 3.42Å; I111-K115 PolarHBondContact O-N 3Å; I111-L133 HydrophobicContact CG2-CD1 3.65Å
112I94.8Very high94.3Very high19 Ų1964.6 Ų64.610%0.09731%0.313CS..Hα-helixtrans-56.2-43.2174.8-75.2163.7000111.4V108 R110 N116 L117 L119 L133V108-I112 HydrophobicContact CG1-CD1 3.99Å; V108-I112 WeakPolarHBondContact O-CB 3.2Å; V108-I112 WeakPolarHBondContact O-CD1 3.43Å; V108-I112 WeakPolarHBondContact O-CG1 3.38Å; V108-I112 PolarHBondContact O-N 2.92Å; R110-I112 VanDerWaalsContact C-N 3.3Å; R110-I112 PolarHBondContact O-N 2.99Å; I112-N116 CarbonylContact O-C 3.58Å; I112-N116 WeakPolarHBondContact O-CA 3.47Å; I112-N116 PolarHBondContact O-N 2.69Å; I112-L117 WeakPolarHBondContact CG2-O 3.31Å; I112-L117 PolarHBondContact O-N 2.88Å; I112-L119 HydrophobicContact CD1-CB 3.67Å; I112-L119 HydrophobicContact CD1-CD1 4.35Å; I112-L119 HydrophobicContact CD1-CD2 4.16Å; I112-L119 HydrophobicContact CD1-CG 4.28Å; I112-L119 HydrophobicContact CG1-CB 4.44Å; I112-L133 HydrophobicContact CD1-CD2 4.39Å; I112-L133 HydrophobicContact CG1-CD2 3.64Å
113N93.9Very high94.1Very high76 Ų7665.1 Ų65.141%0.40631%0.31SS..Hα-helixtrans-76.1-38.6-179.1-64-36.9000112.1I109 R110 I111I109-N113 VanDerWaalsContact O-CG 3.23Å; I109-N113 PolarHBondContact O-N 3.23Å; I109-N113 PolarHBondContact O-ND2 3.32Å; R110-N113 PolarHBondContact O-N 3.48Å; I111-N113 VanDerWaalsContact C-N 3.28Å; I111-N113 PolarHBondContact O-N 2.73Å
114E94.6Very high93.8Very high142 Ų14269.2 Ų69.266%0.66433%0.329SS*.Hα-helixtrans-64.3-47.8178.5-73.1166.7-164.100111.2R110 I111R110-E114 WeakPolarHBondContact O-CG 3.49Å; R110-E114 PolarHBondContact O-N 3Å; I111-E114 PolarHBondContact O-N 3.09Å
115K93.1Very high93.5Very high87 Ų8773.4 Ų73.438%0.37835%0.354SS..Hα-helixtrans-88.4-7.3-179.1-58.1-169.2178.8-1670113.7D94 I111 L117D94-K115 IonicContact OD1-NZ 2.62Å; D94-K115 PolarHBondContact OD1-NZ 2.97Å; D94-K115 IonicContact OD2-NZ 3.13Å; D94-K115 PolarHBondContact OD2-NZ 2.9Å; I111-K115 HydrophobicContact CG2-CD 4.07Å; I111-K115 HydrophobicContact CG2-CG 4.33Å; I111-K115 WeakPolarHBondContact O-CB 3.42Å; I111-K115 PolarHBondContact O-N 3Å; K115-L117 HydrophobicContact CB-CD1 3.77Å; K115-L117 HydrophobicContact CB-CG 3.72Å; K115-L117 HydrophobicContact CD-CD1 3.94Å; K115-L117 PolarHBondContact O-N 2.86Å
116N92.9Very high93.1Very high139 Ų13973.1 Ų73.174%0.74336%0.356SS*.THydrogen-bonded Turntrans53.535.5-174.2-65.5-77000114.1I112I112-N116 CarbonylContact O-C 3.58Å; I112-N116 WeakPolarHBondContact O-CA 3.47Å; I112-N116 PolarHBondContact O-N 2.69Å
117L94Very high92.8Very high16 Ų1680.8 Ų80.88%0.08439%0.385CS..  trans-95172.5-178.8-62.4178.1000112E95 I112 K115 L133E95-L117 HydrophobicContact CB-CD1 4.21Å; E95-L117 HydrophobicContact CG-CD1 4.23Å; E95-L117 WeakPolarHBondContact OE2-CD2 3.35Å; I112-L117 WeakPolarHBondContact CG2-O 3.31Å; I112-L117 PolarHBondContact O-N 2.88Å; K115-L117 HydrophobicContact CB-CD1 3.77Å; K115-L117 HydrophobicContact CB-CG 3.72Å; K115-L117 HydrophobicContact CD-CD1 3.94Å; K115-L117 PolarHBondContact O-N 2.86Å; L117-L133 HydrophobicContact CB-CB 4.46Å; L117-L133 HydrophobicContact CD1-CB 4.08Å
118K93.9Very high92.7Very high102 Ų10279.7 Ų79.744%0.44338%0.381SS..EExtended strand (participates in β ladder)trans-111.1134.7175.4-69.1-171.3178.5178.20110.7M134 L139K118-M134 WeakPolarHBondContact CB-O 3.43Å; K118-M134 PolarHBondContact N-O 3.3Å; K118-M134 PolarHBondContact O-N 3.05Å; K118-L139 HydrophobicContact CB-CD1 4.48Å; K118-L139 HydrophobicContact CD-CD1 4.29Å
119L94.8Very high92.6Very high2 Ų280.1 Ų80.11%0.0138%0.384CS..EExtended strand (participates in β ladder)trans-81.3125.8171.7-16569.1000110.3S80 V81 I85 I90 V108 I112 Y131 L133S80-L119 VanDerWaalsContact CA-O 3.32Å; S80-L119 WeakPolarHBondContact CA-O 3.49Å; S80-L119 PolarHBondContact OG-O 2.73Å; S80-L119 VanDerWaalsContact OG-O 3.07Å; V81-L119 PolarHBondContact N-O 3.01Å; I85-L119 HydrophobicContact CD1-CD2 3.51Å; I85-L119 HydrophobicContact CG1-CD2 3.89Å; I90-L119 HydrophobicContact CD1-CD2 4.43Å; V108-L119 HydrophobicContact CG1-CD1 3.91Å; V108-L119 HydrophobicContact CG1-CD2 4.27Å; I112-L119 HydrophobicContact CD1-CB 3.67Å; I112-L119 HydrophobicContact CD1-CD1 4.35Å; I112-L119 HydrophobicContact CD1-CD2 4.16Å; I112-L119 HydrophobicContact CD1-CG 4.28Å; I112-L119 HydrophobicContact CG1-CB 4.44Å; L119-Y131 HydrophobicContact CD1-CD1 4.31Å; L119-Y131 HydrophobicContact CD1-CG 4.27Å; L119-Y131 HydrophobicContact CD2-CD1 3.78Å; L119-Y131 HydrophobicContact CD2-CE1 4.28Å; L119-Y131 HydrophobicContact CD2-CG 4.27Å; L119-Y131 HydrophobicContact CG-CD1 3.8Å; L119-Y131 HydrophobicContact CG-CG 4.26Å; L119-L133 HydrophobicContact CD1-CD2 3.74Å
120V94.1Very high92.6Very high2 Ų278.6 Ų78.61%0.01238%0.376CS..EExtended strand (participates in β ladder)trans-120.3136.5178.4178.40000109.1I78 Y131 Q132 M134 L139I78-V120 HydrophobicContact CG2-CG1 3.65Å; V120-Y131 CarbonylContact O-C 3.55Å; V120-Y131 VanDerWaalsContact O-CA 3.3Å; V120-Y131 WeakPolarHBondContact O-CA 3.37Å; V120-Q132 PolarHBondContact N-O 3.32Å; V120-Q132 PolarHBondContact O-N 3.37Å; V120-M134 HydrophobicContact CB-SD 4.37Å; V120-M134 HydrophobicContact CG2-CB 4.21Å; V120-M134 HydrophobicContact CG2-CG 4.28Å; V120-M134 HydrophobicContact CG2-SD 4.11Å; V120-L139 HydrophobicContact CG2-CD1 3.58Å; V120-L139 HydrophobicContact CG2-CG 4.43Å
121L92.4Very high92.5Very high40 Ų4071.2 Ų71.221%0.20935%0.349CS..EExtended strand (participates in β ladder)trans-87.8117.3177.6-178.647000109.6V81 E124 Y131V81-L121 HydrophobicContact CG2-CB 3.84Å; V81-L121 HydrophobicContact CG2-CD2 4.47Å; L121-E124 HydrophobicContact CD1-CG 3.86Å; L121-E124 HydrophobicContact CD2-CG 3.46Å; L121-E124 VanDerWaalsContact CD2-CG 3.46Å; L121-E124 WeakPolarHBondContact CD2-OE1 3.37Å; L121-E124 HydrophobicContact CG-CG 3.7Å; L121-Y131 HydrophobicContact CB-CD1 4.1Å; L121-Y131 HydrophobicContact CB-CE1 4Å; L121-Y131 HydrophobicContact CD1-CD1 3.99Å; L121-Y131 HydrophobicContact CD1-CD2 4.44Å; L121-Y131 HydrophobicContact CD1-CE1 3.67Å; L121-Y131 HydrophobicContact CD1-CE2 4.14Å; L121-Y131 HydrophobicContact CD1-CG 4.38Å; L121-Y131 HydrophobicContact CD2-CE1 4.25Å; L121-Y131 HydrophobicContact CG-CE1 4.2Å
122L90.5Very high92.6Very high78 Ų7871.7 Ų71.741%0.40835%0.35SS..EExtended strand (participates in β ladder)trans-91.7-51.8179.6-79.4159.6000111.5I93 L130 Q132I93-L122 HydrophobicContact CD1-CD1 4.3Å; L122-L130 HydrophobicContact CB-CD2 4.44Å; L122-L130 HydrophobicContact CB-CG 4.46Å; L122-L130 HydrophobicContact CD1-CD2 4.22Å; L122-L130 HydrophobicContact CD1-CG 4.22Å; L122-L130 PolarHBondContact N-O 2.89Å; L122-Q132 HydrophobicContact CD1-CB 3.34Å; L122-Q132 HydrophobicContact CD1-CG 4.36Å; L122-Q132 HydrophobicContact CG-CB 4.02Å
123K90.6Very high92.6Very high113 Ų11370.8 Ų70.849%0.49135%0.345SS..EExtended strand (participates in β ladder)trans-139.3110.5-174.4-60.4-178.8-179.81780110.2K126 L130K123-K126 HydrophobicContact CB-CG 4.49Å; K123-K126 HydrophobicContact CD-CD 4.43Å; K123-L130 HydrophobicContact CB-CB 4.16Å; K123-L130 HydrophobicContact CD-CD2 4.28Å; K123-L130 PolarHBondContact N-O 2.92Å; K123-L130 PolarHBondContact O-N 2.66Å
124E89.4Confident92.6Very high127 Ų12768.6 Ų68.659%0.59333%0.333SS*.SBendtrans-76.2-28.9172.1-72.9175.9-167.800112.6L121 K126L121-E124 HydrophobicContact CD1-CG 3.86Å; L121-E124 HydrophobicContact CD2-CG 3.46Å; L121-E124 VanDerWaalsContact CD2-CG 3.46Å; L121-E124 WeakPolarHBondContact CD2-OE1 3.37Å; L121-E124 HydrophobicContact CG-CG 3.7Å; E124-K126 PolarHBondContact O-N 2.9Å; E124-K126 VanDerWaalsContact O-N 3.1Å
125N88.9Confident92.6Very high167 Ų16763.7 Ų63.789%0.89332%0.315SS*.SBendtrans-74.2-0.3-172-60.3-20.1000114.9
126K88.6Confident92.6Very high93 Ų9361.2 Ų61.240%0.40431%0.313SS..SBendtrans-97.9139.6177.9-71.3-171.1169.7-1650109K123 E124 P128 P129 L130K123-K126 HydrophobicContact CB-CG 4.49Å; K123-K126 HydrophobicContact CD-CD 4.43Å; E124-K126 PolarHBondContact O-N 2.9Å; E124-K126 VanDerWaalsContact O-N 3.1Å; K126-P128 CarbonylContact C-O 3.56Å; K126-P128 WeakPolarHBondContact CB-O 3.26Å; K126-P128 CarbonylContact O-C 3.56Å; K126-P129 WeakPolarHBondContact O-CA 3.29Å; K126-L130 HydrophobicContact CD-CB 4.45Å
127E88.6Confident92.6Very high201 Ų20162 Ų6294%0.93931%0.31SS*.SBendtrans-109.8105.4168.6-66.9-176173.900107.8
128P90.9Very high92.5Very high41 Ų4166.6 Ų66.627%0.26633%0.331SS..SBendcis-78.4154.82.432.2-36.2000114.5Q91 L102 K126Q91-P128 HydrophobicContact CB-CG 4.49Å; L102-P128 HydrophobicContact CD1-CG 3.82Å; L102-P128 HydrophobicContact CG-CG 4.1Å; K126-P128 CarbonylContact C-O 3.56Å; K126-P128 WeakPolarHBondContact CB-O 3.26Å; K126-P128 CarbonylContact O-C 3.56Å
129P94.4Very high92.5Very high10 Ų1062.3 Ų62.37%0.06531%0.313CS..PPolyproline II helixtrans-68.9147.2-17618.7-23.4000112.4H87 I90 Q91 K126 Y131H87-P129 HydrophobicContact CB-CG 3.99Å; H87-P129 VanDerWaalsContact CG-CG 3.43Å; H87-P129 VanDerWaalsContact ND1-CG 3.34Å; H87-P129 WeakPolarHBondContact ND1-CG 3.48Å; I90-P129 HydrophobicContact CG2-CG 4.3Å; Q91-P129 PolarHBondContact N-O 3.09Å; K126-P129 WeakPolarHBondContact O-CA 3.29Å; P129-Y131 HydrophobicContact CB-CE2 3.86Å; P129-Y131 HydrophobicContact CG-CE2 3.96Å
130L94.1Very high92.4Very high13 Ų1367.1 Ų67.17%0.06834%0.335CS..EExtended strand (participates in β ladder)trans-100.3121.1-173-174.267.4000111.6Q91 I93 L122 K123 K126Q91-L130 HydrophobicContact CB-CD1 3.84Å; Q91-L130 HydrophobicContact CG-CD1 3.63Å; I93-L130 HydrophobicContact CD1-CD1 3.86Å; I93-L130 HydrophobicContact CD1-CD2 4.09Å; I93-L130 HydrophobicContact CD1-CG 4.24Å; I93-L130 HydrophobicContact CG1-CD1 4.01Å; L122-L130 HydrophobicContact CB-CD2 4.44Å; L122-L130 HydrophobicContact CB-CG 4.46Å; L122-L130 HydrophobicContact CD1-CD2 4.22Å; L122-L130 HydrophobicContact CD1-CG 4.22Å; L122-L130 PolarHBondContact N-O 2.89Å; K123-L130 HydrophobicContact CB-CB 4.16Å; K123-L130 HydrophobicContact CD-CD2 4.28Å; K123-L130 PolarHBondContact N-O 2.92Å; K123-L130 PolarHBondContact O-N 2.66Å; K126-L130 HydrophobicContact CD-CB 4.45Å
131Y94.8Very high92.4Very high1 Ų172.4 Ų72.40%0.00436%0.36CS..EExtended strand (participates in β ladder)trans-116.9154.3175.8-62.5-99.6000110.8V81 H87 I90 Q91 V92 I93 L119 V120 L121 P129V81-Y131 HydrophobicContact CG2-CE1 4.12Å; H87-Y131 PolarHBondContact ND1-OH 2.94Å; I90-Y131 HydrophobicContact CB-CD2 3.67Å; I90-Y131 HydrophobicContact CB-CE2 3.78Å; I90-Y131 HydrophobicContact CD1-CD2 3.96Å; I90-Y131 HydrophobicContact CD1-CE2 4.31Å; I90-Y131 HydrophobicContact CD1-CG 4.33Å; I90-Y131 HydrophobicContact CG1-CD2 4.39Å; I90-Y131 HydrophobicContact CG2-CD2 3.83Å; I90-Y131 HydrophobicContact CG2-CE2 3.37Å; Q91-Y131 PolarHBondContact O-N 2.93Å; V92-Y131 WeakPolarHBondContact CA-O 3.43Å; I93-Y131 PolarHBondContact N-O 3.11Å; L119-Y131 HydrophobicContact CD1-CD1 4.31Å; L119-Y131 HydrophobicContact CD1-CG 4.27Å; L119-Y131 HydrophobicContact CD2-CD1 3.78Å; L119-Y131 HydrophobicContact CD2-CE1 4.28Å; L119-Y131 HydrophobicContact CD2-CG 4.27Å; L119-Y131 HydrophobicContact CG-CD1 3.8Å; L119-Y131 HydrophobicContact CG-CG 4.26Å; V120-Y131 CarbonylContact O-C 3.55Å; V120-Y131 VanDerWaalsContact O-CA 3.3Å; V120-Y131 WeakPolarHBondContact O-CA 3.37Å; L121-Y131 HydrophobicContact CB-CD1 4.1Å; L121-Y131 HydrophobicContact CB-CE1 4Å; L121-Y131 HydrophobicContact CD1-CD1 3.99Å; L121-Y131 HydrophobicContact CD1-CD2 4.44Å; L121-Y131 HydrophobicContact CD1-CE1 3.67Å; L121-Y131 HydrophobicContact CD1-CE2 4.14Å; L121-Y131 HydrophobicContact CD1-CG 4.38Å; L121-Y131 HydrophobicContact CD2-CE1 4.25Å; L121-Y131 HydrophobicContact CG-CE1 4.2Å; P129-Y131 HydrophobicContact CB-CE2 3.86Å; P129-Y131 HydrophobicContact CG-CE2 3.96Å
132Q94.4Very high92.4Very high36 Ų3673.2 Ų73.217%0.16836%0.362CS..EExtended strand (participates in β ladder)trans-130.2140.1173.2175.9171.918.200110.4I93 V120 L122 M134I93-Q132 HydrophobicContact CB-CB 4.26Å; I93-Q132 HydrophobicContact CB-CG 4.28Å; I93-Q132 HydrophobicContact CG2-CG 4.4Å; I93-Q132 CarbonylContact O-C 3.58Å; I93-Q132 WeakPolarHBondContact O-CA 3.44Å; V120-Q132 PolarHBondContact N-O 3.32Å; V120-Q132 PolarHBondContact O-N 3.37Å; L122-Q132 HydrophobicContact CD1-CB 3.34Å; L122-Q132 HydrophobicContact CD1-CG 4.36Å; L122-Q132 HydrophobicContact CG-CB 4.02Å; Q132-M134 VanDerWaalsContact CD-CE 3.42Å; Q132-M134 HydrophobicContact CG-CE 4.07Å; Q132-M134 HydrophobicContact CG-CG 4Å
133L94.9Very high92.5Very high0 Ų071.6 Ų71.60%035%0.353CS..EExtended strand (participates in β ladder)trans-81.5129169.9-62.1174.6000108.7V92 I93 E95 L100 I111 I112 L117 L119V92-L133 HydrophobicContact CG1-CD1 4.17Å; V92-L133 HydrophobicContact CG1-CG 3.99Å; I93-L133 PolarHBondContact O-N 3.2Å; E95-L133 WeakPolarHBondContact CA-O 3.44Å; L100-L133 HydrophobicContact CD1-CD1 4.27Å; I111-L133 HydrophobicContact CG2-CD1 3.65Å; I112-L133 HydrophobicContact CD1-CD2 4.39Å; I112-L133 HydrophobicContact CG1-CD2 3.64Å; L117-L133 HydrophobicContact CB-CB 4.46Å; L117-L133 HydrophobicContact CD1-CB 4.08Å; L119-L133 HydrophobicContact CD1-CD2 3.74Å
134M94Very high92.6Very high31 Ų3169.9 Ų69.915%0.15335%0.349CS..EExtended strand (participates in β ladder)trans-138.1144.6179-66.1-170.5164.800110.3K118 V120 Q132K118-M134 WeakPolarHBondContact CB-O 3.43Å; K118-M134 PolarHBondContact N-O 3.3Å; K118-M134 PolarHBondContact O-N 3.05Å; V120-M134 HydrophobicContact CB-SD 4.37Å; V120-M134 HydrophobicContact CG2-CB 4.21Å; V120-M134 HydrophobicContact CG2-CG 4.28Å; V120-M134 HydrophobicContact CG2-SD 4.11Å; Q132-M134 VanDerWaalsContact CD-CE 3.42Å; Q132-M134 HydrophobicContact CG-CE 4.07Å; Q132-M134 HydrophobicContact CG-CG 4Å
135S94.7Very high92.7Very high39 Ų3969.8 Ų69.827%0.27334%0.343SS..  trans-69.2151.8166.9167.90000111.3K137 H138 L139S135-K137 PolarHBondContact O-N 2.83Å; S135-H138 PolarHBondContact O-N 3.23Å; S135-L139 PolarHBondContact O-N 3.41Å; S135-L139 VanDerWaalsContact O-N 3.08Å
136G92.8Very high92.8Very high34 Ų3463.6 Ų63.635%0.35131%0.31SS..Hα-helixtrans-60.8-29.3-177.800000114.1H140G136-H140 PolarHBondContact O-N 3.01Å
137K93.1Very high92.8Very high157 Ų15765.5 Ų65.568%0.68331%0.314SS*.Hα-helixtrans-68.7-51.2176.6-65.6-177.4-179.9179.10111.2S135 L139 H140 E141S135-K137 PolarHBondContact O-N 2.83Å; K137-L139 VanDerWaalsContact C-N 3.3Å; K137-L139 PolarHBondContact O-N 2.99Å; K137-H140 WeakPolarHBondContact O-CB 3.49Å; K137-H140 PolarHBondContact O-N 3.25Å; K137-E141 PolarHBondContact O-N 2.98Å
138H93.1Very high92.9Very high111 Ų11161.1 Ų61.151%0.51429%0.294SS..Hα-helixtrans-59.1-40176.9-72.5-85.7000112.4S135 H140 E141 E142S135-H138 PolarHBondContact O-N 3.23Å; H138-H140 VanDerWaalsContact C-N 3.29Å; H138-H140 PolarHBondContact O-N 3.04Å; H138-E141 PolarHBondContact O-N 2.94Å; H138-E142 WeakPolarHBondContact O-CB 3.42Å; H138-E142 PolarHBondContact O-N 2.96Å
139L93Very high92.8Very high12 Ų1263.2 Ų63.26%0.06330%0.299CS..Hα-helixtrans-59.6-41.4174.9-175.5157000111.5K118 V120 S135 K137 Q143K118-L139 HydrophobicContact CB-CD1 4.48Å; K118-L139 HydrophobicContact CD-CD1 4.29Å; V120-L139 HydrophobicContact CG2-CD1 3.58Å; V120-L139 HydrophobicContact CG2-CG 4.43Å; S135-L139 PolarHBondContact O-N 3.41Å; S135-L139 VanDerWaalsContact O-N 3.08Å; K137-L139 VanDerWaalsContact C-N 3.3Å; K137-L139 PolarHBondContact O-N 2.99Å; L139-Q143 VanDerWaalsContact CD2-CD 3.5Å; L139-Q143 HydrophobicContact CD2-CG 4.14Å; L139-Q143 VanDerWaalsContact CD2-NE2 3.25Å; L139-Q143 WeakPolarHBondContact O-CB 3.36Å; L139-Q143 VanDerWaalsContact O-CG 3.24Å; L139-Q143 WeakPolarHBondContact O-CG 3.43Å; L139-Q143 PolarHBondContact O-N 3.26Å
140H93.2Very high92.4Very high104 Ų10466.6 Ų66.648%0.48132%0.316SS..Hα-helixtrans-67.3-43.2178-174.668.2000112.4G136 K137 H138 Q143 L144G136-H140 PolarHBondContact O-N 3.01Å; K137-H140 WeakPolarHBondContact O-CB 3.49Å; K137-H140 PolarHBondContact O-N 3.25Å; H138-H140 VanDerWaalsContact C-N 3.29Å; H138-H140 PolarHBondContact O-N 3.04Å; H140-Q143 WeakPolarHBondContact O-CB 3.5Å; H140-Q143 PolarHBondContact O-N 3.25Å; H140-L144 PolarHBondContact O-N 3.17Å
141E94.3Very high92Very high113 Ų11374.5 Ų74.553%0.52835%0.35SS..Hα-helixtrans-61.2-46.3176.6-70.5168.5-169.200111.5K137 H138 Q143 L144 R145K137-E141 PolarHBondContact O-N 2.98Å; H138-E141 PolarHBondContact O-N 2.94Å; E141-Q143 VanDerWaalsContact C-N 3.34Å; E141-Q143 PolarHBondContact O-N 2.87Å; E141-L144 PolarHBondContact O-N 3.32Å; E141-R145 WeakPolarHBondContact O-CB 3.28Å; E141-R145 PolarHBondContact O-N 3.45Å
142E92.4Very high91.5Very high56 Ų5678.7 Ų78.726%0.26239%0.385SS..Hα-helixtrans-65.1-37.3176-80.4-62.6142.400112I78 H138 R145 L146I78-E142 HydrophobicContact CD1-CB 4.37Å; H138-E142 WeakPolarHBondContact O-CB 3.42Å; H138-E142 PolarHBondContact O-N 2.96Å; E142-R145 PolarHBondContact O-N 2.94Å; E142-R145 IonicContact OE1-NH1 3.06Å; E142-R145 PolarHBondContact OE1-NH1 3Å; E142-R145 IonicContact OE2-NH1 2.97Å; E142-L146 WeakPolarHBondContact O-CB 3.38Å; E142-L146 WeakPolarHBondContact O-CG 3.23Å; E142-L146 PolarHBondContact O-N 2.79Å
143Q92.3Very high91Very high44 Ų4483.2 Ų83.221%0.20640%0.404CS..Hα-helixtrans-61.4-43.6171.5-79.3179.3-6.100112.3I78 L139 H140 E141 L146 R147I78-Q143 WeakPolarHBondContact O-CG 3.46Å; I78-Q143 PolarHBondContact O-NE2 2.8Å; L139-Q143 VanDerWaalsContact CD2-CD 3.5Å; L139-Q143 HydrophobicContact CD2-CG 4.14Å; L139-Q143 VanDerWaalsContact CD2-NE2 3.25Å; L139-Q143 WeakPolarHBondContact O-CB 3.36Å; L139-Q143 VanDerWaalsContact O-CG 3.24Å; L139-Q143 WeakPolarHBondContact O-CG 3.43Å; L139-Q143 PolarHBondContact O-N 3.26Å; H140-Q143 WeakPolarHBondContact O-CB 3.5Å; H140-Q143 PolarHBondContact O-N 3.25Å; E141-Q143 VanDerWaalsContact C-N 3.34Å; E141-Q143 PolarHBondContact O-N 2.87Å; Q143-L146 PolarHBondContact O-N 3.33Å; Q143-R147 VanDerWaalsContact O-CG 3.24Å; Q143-R147 WeakPolarHBondContact O-CG 3.46Å; Q143-R147 PolarHBondContact O-N 2.77Å
144L92.8Very high90.1Very high78 Ų7887.3 Ų87.341%0.40844%0.438SS..Hα-helixtrans-64.5-47.6178.4-17564000110.5H140 E141 L146 R147 E148H140-L144 PolarHBondContact O-N 3.17Å; E141-L144 PolarHBondContact O-N 3.32Å; L144-L146 VanDerWaalsContact C-N 3.29Å; L144-L146 PolarHBondContact O-N 2.88Å; L144-R147 WeakPolarHBondContact O-CB 3.32Å; L144-R147 PolarHBondContact O-N 3.19Å; L144-E148 WeakPolarHBondContact O-CG 3.37Å; L144-E148 PolarHBondContact O-N 3.14Å
145R92.1Very high89.5Confident125 Ų12589.8 Ų89.847%0.47246%0.458SS..Hα-helixtrans-56.2-42.5175.2-173.2-175.4-177.8-169.93.4111.9E141 E142 K149E141-R145 WeakPolarHBondContact O-CB 3.28Å; E141-R145 PolarHBondContact O-N 3.45Å; E142-R145 PolarHBondContact O-N 2.94Å; E142-R145 IonicContact OE1-NH1 3.06Å; E142-R145 PolarHBondContact OE1-NH1 3Å; E142-R145 IonicContact OE2-NH1 2.97Å; R145-K149 HydrophobicContact CG-CD 4.34Å; R145-K149 VanDerWaalsContact NE-NZ 3.18Å; R145-K149 WeakPolarHBondContact O-CB 3.28Å; R145-K149 WeakPolarHBondContact O-CG 3.42Å; R145-K149 PolarHBondContact O-N 2.72Å
146L90.6Very high88.9Confident37 Ų3792.6 Ų92.619%0.19448%0.475CS..Hα-helixtrans-67.3-39.6175-77.2-173000112.8I78 E142 Q143 L144 K149 N150I78-L146 HydrophobicContact CB-CD1 4.09Å; I78-L146 HydrophobicContact CD1-CD1 3.27Å; I78-L146 HydrophobicContact CD1-CG 4.1Å; I78-L146 HydrophobicContact CG1-CD1 3.42Å; I78-L146 VanDerWaalsContact CG1-CD1 3.42Å; E142-L146 WeakPolarHBondContact O-CB 3.38Å; E142-L146 WeakPolarHBondContact O-CG 3.23Å; E142-L146 PolarHBondContact O-N 2.79Å; Q143-L146 PolarHBondContact O-N 3.33Å; L144-L146 VanDerWaalsContact C-N 3.29Å; L144-L146 PolarHBondContact O-N 2.88Å; L146-K149 HydrophobicContact CD2-CD 4.35Å; L146-K149 PolarHBondContact O-N 3.34Å; L146-N150 VanDerWaalsContact O-CB 3.3Å; L146-N150 WeakPolarHBondContact O-CB 3.38Å; L146-N150 PolarHBondContact O-N 3.33Å; L146-N150 PolarHBondContact O-ND2 3.45Å
147R88.9Confident88.6Confident133 Ų13394.5 Ų94.550%0.50248%0.48SS..Hα-helixtrans-62.5-44.6175.7-73.1169.7-170.4172.95.1110.9Q143 L144 N150 K151Q143-R147 VanDerWaalsContact O-CG 3.24Å; Q143-R147 WeakPolarHBondContact O-CG 3.46Å; Q143-R147 PolarHBondContact O-N 2.77Å; L144-R147 WeakPolarHBondContact O-CB 3.32Å; L144-R147 PolarHBondContact O-N 3.19Å; R147-N150 PolarHBondContact O-N 3.46Å; R147-K151 VanDerWaalsContact O-CG 3.29Å; R147-K151 WeakPolarHBondContact O-CG 3.35Å; R147-K151 PolarHBondContact O-N 3.15Å
148E90.7Very high88.5Confident109 Ų10991.5 Ų91.551%0.50947%0.469SS..Hα-helixtrans-62.4-47.3175.6-71.4174.7-179.500111.7L144 N150 K151 A152L144-E148 WeakPolarHBondContact O-CG 3.37Å; L144-E148 PolarHBondContact O-N 3.14Å; E148-N150 VanDerWaalsContact C-N 3.27Å; E148-N150 PolarHBondContact O-N 2.97Å; E148-K151 PolarHBondContact O-N 2.82Å; E148-A152 WeakPolarHBondContact O-CB 3.37Å; E148-A152 PolarHBondContact O-N 2.91Å
149K89.3Confident88.6Confident85 Ų8590.1 Ų90.137%0.3747%0.468SS..Hα-helixtrans-56.3-41.5173-75.5170178.9174.10111.8R145 L146 A152 K153R145-K149 HydrophobicContact CG-CD 4.34Å; R145-K149 VanDerWaalsContact NE-NZ 3.18Å; R145-K149 WeakPolarHBondContact O-CB 3.28Å; R145-K149 WeakPolarHBondContact O-CG 3.42Å; R145-K149 PolarHBondContact O-N 2.72Å; L146-K149 HydrophobicContact CD2-CD 4.35Å; L146-K149 PolarHBondContact O-N 3.34Å; K149-A152 PolarHBondContact O-N 2.98Å; K149-K153 VanDerWaalsContact O-CG 3.26Å; K149-K153 WeakPolarHBondContact O-CG 3.46Å; K149-K153 PolarHBondContact O-N 3.19Å
150N86.2Confident88.7Confident81 Ų8192.6 Ų92.643%0.43348%0.478SS..Hα-helixtrans-73.4-31.3179.9-71.1-18.5000113L146 R147 E148 K153L146-N150 VanDerWaalsContact O-CB 3.3Å; L146-N150 WeakPolarHBondContact O-CB 3.38Å; L146-N150 PolarHBondContact O-N 3.33Å; L146-N150 PolarHBondContact O-ND2 3.45Å; R147-N150 PolarHBondContact O-N 3.46Å; E148-N150 VanDerWaalsContact C-N 3.27Å; E148-N150 PolarHBondContact O-N 2.97Å; N150-K153 PolarHBondContact OD1-NZ 3.05Å
151K84.7Confident88.8Confident179 Ų17993.1 Ų93.178%0.77848%0.481SS*.Hα-helixtrans-68.6-38170.6-72.6172.9-179.9-176.80111.9R147 E148 K153R147-K151 VanDerWaalsContact O-CG 3.29Å; R147-K151 WeakPolarHBondContact O-CG 3.35Å; R147-K151 PolarHBondContact O-N 3.15Å; E148-K151 PolarHBondContact O-N 2.82Å; K151-K153 VanDerWaalsContact C-N 3.34Å
152A84.9Confident88.8Confident89 Ų8988.4 Ų88.474%0.73646%0.459SS*.Hα-helixtrans-72.1-27.7177.600000112.7E148 K149 A154E148-A152 WeakPolarHBondContact O-CB 3.37Å; E148-A152 PolarHBondContact O-N 2.91Å; K149-A152 PolarHBondContact O-N 2.98Å; A152-A154 PolarHBondContact O-N 2.99Å
153K83Confident88.9Confident130 Ų13088 Ų8857%0.56546%0.462SS*.SBendtrans-65.2126.7172.3-75.3169.1-165169.50109.4K149 N150 K151K149-K153 VanDerWaalsContact O-CG 3.26Å; K149-K153 WeakPolarHBondContact O-CG 3.46Å; K149-K153 PolarHBondContact O-N 3.19Å; N150-K153 PolarHBondContact OD1-NZ 3.05Å; K151-K153 VanDerWaalsContact C-N 3.34Å
154A77.2Confident89Confident87 Ų8785.9 Ų85.972%0.71945%0.453SS*.PPolyproline II helixtrans-57.3146.417300000110.7A152A152-A154 PolarHBondContact O-N 2.99Å
155S80.3Confident88.9Confident82 Ų8285.7 Ų85.757%0.57346%0.458SS*.PPolyproline II helixtrans-52.7140.8174.953.60000110.8T157S155-T157 PolarHBondContact O-N 2.92Å
156P81.7Confident88.7Confident98 Ų9881.9 Ų81.964%0.63645%0.448SS*.PPolyproline II helixtrans-57.8131.8179.824.1-33.5000110.2Q158P156-Q158 PolarHBondContact O-N 3.4Å; P156-Q158 VanDerWaalsContact O-N 3.11Å
157T87.4Confident88.6Confident74 Ų7483.5 Ų83.545%0.45447%0.474SS..  trans-65.1111.7174-65.60000108.6S155 K187S155-T157 PolarHBondContact O-N 2.92Å; T157-K187 WeakPolarHBondContact CG2-O 3.39Å; T157-K187 PolarHBondContact OG1-O 3Å
158Q91.1Very high88.7Confident95 Ų9578.9 Ų78.944%0.44446%0.459SS..PPolyproline II helixtrans-93.4151.8173.6-65.1-179.8-3.300110.1P156 H188 H189P156-Q158 PolarHBondContact O-N 3.4Å; P156-Q158 VanDerWaalsContact O-N 3.11Å; Q158-H188 PolarHBondContact N-ND1 3.21Å; Q158-H188 WeakPolarHBondContact O-CB 3.43Å; Q158-H189 PolarHBondContact O-N 3.01Å
159V93.9Very high88.9Confident82 Ų8276.8 Ų76.850%0.49746%0.46SS..EExtended strand (participates in β ladder)trans-90.4116.3168.2-173.40000107.7H189 R191V159-H189 CarbonylContact C-O 2.99Å; V159-H189 WeakPolarHBondContact CA-O 3.31Å; V159-H189 HydrophobicContact CG2-CB 4.16Å; V159-R191 HydrophobicContact CG1-CB 4.15Å
160K95.4Very high89.1Confident63 Ų6377.6 Ų77.627%0.27448%0.477SS..EExtended strand (participates in β ladder)trans-97.2142.8173.5-60.2-62.9177.2-174.20109W183 H188 H189 V190 R191K160-W183 HydrophobicContact CB-CD2 3.86Å; K160-W183 HydrophobicContact CB-CE3 3.53Å; K160-W183 HydrophobicContact CB-CG 4.48Å; K160-W183 HydrophobicContact CB-CH2 4.24Å; K160-W183 HydrophobicContact CB-CZ3 3.74Å; K160-W183 HydrophobicContact CG-CD2 4.03Å; K160-W183 HydrophobicContact CG-CE3 4.23Å; K160-W183 HydrophobicContact CG-CG 4.25Å; K160-H188 HydrophobicContact CG-CB 4.31Å; K160-H189 PolarHBondContact N-O 2.87Å; K160-V190 CarbonylContact O-C 3.54Å; K160-V190 WeakPolarHBondContact O-CA 3.36Å; K160-R191 PolarHBondContact O-N 3.25Å
161E95.4Very high89.4Confident116 Ų11680.5 Ų80.554%0.54249%0.487SS..EExtended strand (participates in β ladder)trans-113.4133.2-176.7-55.9-174.8-172.100109.8R191E161-R191 WeakPolarHBondContact CA-O 3.35Å; E161-R191 HydrophobicContact CG-CB 4.34Å; E161-R191 IonicContact OE1-CZ 3.52Å; E161-R191 IonicContact OE1-NE 3.9Å; E161-R191 IonicContact OE1-NH1 3.76Å; E161-R191 IonicContact OE1-NH2 2.69Å; E161-R191 PolarHBondContact OE1-NH2 2.93Å; E161-R191 IonicContact OE2-CZ 2.66Å; E161-R191 IonicContact OE2-NE 3.75Å; E161-R191 IonicContact OE2-NH2 3.66Å; E161-R191 PolarHBondContact OE2-NH2 3.47Å
162L95.6Very high89.9Confident14 Ų1475.1 Ų75.17%0.07347%0.467CS..EExtended strand (participates in β ladder)trans-130.5125.7176.7-16459.3000109.3F164 K176 A180 W183 R191 L192 T193L162-F164 HydrophobicContact CB-CE2 4.34Å; L162-F164 HydrophobicContact CD2-CE1 4.42Å; L162-F164 HydrophobicContact CD2-CE2 3.95Å; L162-F164 HydrophobicContact CD2-CZ 3.52Å; L162-F164 HydrophobicContact CG-CE2 3.92Å; L162-F164 HydrophobicContact CG-CZ 3.86Å; L162-K176 HydrophobicContact CD1-CG 4.4Å; L162-K176 HydrophobicContact CD2-CB 4.07Å; L162-K176 VanDerWaalsContact CD2-O 3.28Å; L162-K176 WeakPolarHBondContact CD2-O 3.39Å; L162-A180 HydrophobicContact CD2-CB 4.09Å; L162-W183 HydrophobicContact CB-CZ3 4.11Å; L162-W183 HydrophobicContact CD1-CH2 4.28Å; L162-W183 HydrophobicContact CD1-CZ3 4.32Å; L162-W183 HydrophobicContact CD2-CZ3 4.49Å; L162-R191 PolarHBondContact N-O 3.06Å; L162-L192 HydrophobicContact CB-CD2 3.89Å; L162-L192 HydrophobicContact CD2-CD2 4.12Å; L162-L192 CarbonylContact O-C 3.49Å; L162-L192 WeakPolarHBondContact O-CA 3.42Å; L162-T193 PolarHBondContact O-N 3.37Å
163S93.6Very high90.4Very high46 Ų4672 Ų7232%0.32244%0.438SS..EExtended strand (participates in β ladder)trans-112.6134.8-179.7-164.90000111.6T193 R195S163-T193 CarbonylContact C-O 3.59Å; S163-T193 WeakPolarHBondContact CA-O 3.4Å; S163-T193 PolarHBondContact OG-O 3.07Å; S163-T193 VanDerWaalsContact OG-O 3.11Å; S163-R195 PolarHBondContact OG-NE 3.26Å
164F93.6Very high90.9Very high1 Ų167.8 Ų67.80%0.00443%0.425CS..EExtended strand (participates in β ladder)trans-113.3155.2175.9-58.1-90000109.8L162 I168 K176 L177 L192 T193 L194 R195 M212L162-F164 HydrophobicContact CB-CE2 4.34Å; L162-F164 HydrophobicContact CD2-CE1 4.42Å; L162-F164 HydrophobicContact CD2-CE2 3.95Å; L162-F164 HydrophobicContact CD2-CZ 3.52Å; L162-F164 HydrophobicContact CG-CE2 3.92Å; L162-F164 HydrophobicContact CG-CZ 3.86Å; F164-I168 HydrophobicContact CD1-CD1 3.9Å; F164-K176 HydrophobicContact CD1-CB 4.42Å; F164-K176 HydrophobicContact CD1-CD 3.95Å; F164-K176 HydrophobicContact CE1-CB 3.45Å; F164-K176 VanDerWaalsContact CE1-CB 3.45Å; F164-K176 HydrophobicContact CE1-CD 3.78Å; F164-K176 HydrophobicContact CE1-CG 4.25Å; F164-K176 HydrophobicContact CZ-CB 3.96Å; F164-L177 HydrophobicContact CZ-CD2 4.47Å; F164-L192 HydrophobicContact CE2-CB 4.25Å; F164-L192 HydrophobicContact CE2-CD2 3.96Å; F164-L192 HydrophobicContact CE2-CG 4.46Å; F164-T193 PolarHBondContact N-O 3.04Å; F164-L194 HydrophobicContact CB-CD1 3.64Å; F164-R195 PolarHBondContact O-N 2.78Å; F164-M212 HydrophobicContact CD1-SD 4.49Å; F164-M212 HydrophobicContact CG-SD 4.35Å
165S91.3Very high91.8Very high74 Ų7467 Ų6752%0.51741%0.411SS..EExtended strand (participates in β ladder)trans-115.6144.5170.6-59.60000108.9G167 I168 R195S165-G167 PolarHBondContact O-N 3.48Å; S165-I168 PolarHBondContact O-N 3.5Å; S165-R195 WeakPolarHBondContact CA-O 3.49Å
166V88.8Confident92.4Very high44 Ų4465.3 Ų65.327%0.26739%0.393SS..THydrogen-bonded Turntrans-63.6125.4174.4172.50000110L194 R195 K197 L205V166-L194 HydrophobicContact CG2-CD1 4.1Å; V166-L194 HydrophobicContact CG2-CD2 4.45Å; V166-L194 HydrophobicContact CG2-CG 4.19Å; V166-R195 WeakPolarHBondContact CG2-O 3.25Å; V166-R195 PolarHBondContact N-O 3.32Å; V166-K197 HydrophobicContact CB-CG 4.37Å; V166-K197 HydrophobicContact CG1-CG 4.4Å; V166-L205 HydrophobicContact CG2-CD2 3.51Å
167G86.9Confident93Very high71 Ų7161.1 Ų61.173%0.73237%0.366SS*.THydrogen-bonded Turntrans94.217.2-174.400000114.7S165S165-G167 PolarHBondContact O-N 3.48Å
168I91.8Very high93.4Very high36 Ų3664.2 Ų64.219%0.18537%0.373CS..  trans-55.8140.2169.5-172.7170.5000111.4F164 S165 D172 L173 K176F164-I168 HydrophobicContact CD1-CD1 3.9Å; S165-I168 PolarHBondContact O-N 3.5Å; I168-D172 HydrophobicContact CD1-CB 4.09Å; I168-D172 WeakPolarHBondContact CD1-OD2 3.49Å; I168-D172 HydrophobicContact CG1-CB 3.9Å; I168-D172 WeakPolarHBondContact CG1-OD2 3.33Å; I168-L173 HydrophobicContact CD1-CB 4.11Å; I168-L173 HydrophobicContact CG1-CB 4.3Å; I168-L173 HydrophobicContact CG2-CB 4.1Å; I168-L173 HydrophobicContact CG2-CD1 3.64Å; I168-K176 HydrophobicContact CD1-CD 3.93Å
169A94.7Very high93.6Very high65 Ų6563.6 Ų63.654%0.53737%0.37SS..  trans-66.5145.7174.500000111H171 D172 L173A169-H171 VanDerWaalsContact C-N 3.25Å; A169-H171 PolarHBondContact O-N 3.11Å; A169-D172 PolarHBondContact O-N 3.29Å; A169-D172 VanDerWaalsContact O-N 3.14Å; A169-L173 PolarHBondContact O-N 3.35Å
170S93.3Very high93.6Very high103 Ų10359.7 Ų59.772%0.7235%0.346SS*.Hα-helixtrans-54.5-39.6-178.554.20000113.2S174S170-S174 PolarHBondContact O-N 3.02Å
171H93.8Very high93.5Very high142 Ų14258.3 Ų58.366%0.65734%0.341SS*.Hα-helixtrans-66.4-45.7178.2-174.665000113A169 L173 S174 T175A169-H171 VanDerWaalsContact C-N 3.25Å; A169-H171 PolarHBondContact O-N 3.11Å; H171-L173 VanDerWaalsContact C-N 3.35Å; H171-S174 PolarHBondContact O-N 3.44Å; H171-S174 PolarHBondContact O-OG 3.12Å; H171-T175 PolarHBondContact O-N 2.93Å; H171-T175 VanDerWaalsContact O-N 3.09Å; H171-T175 PolarHBondContact O-OG1 3.26Å
172D94.9Very high93.4Very high65 Ų6554.6 Ų54.635%0.34833%0.328SS..Hα-helixtrans-65.6-40.3178.1-17835000111.1I168 A169 S174 T175 K176I168-D172 HydrophobicContact CD1-CB 4.09Å; I168-D172 WeakPolarHBondContact CD1-OD2 3.49Å; I168-D172 HydrophobicContact CG1-CB 3.9Å; I168-D172 WeakPolarHBondContact CG1-OD2 3.33Å; A169-D172 PolarHBondContact O-N 3.29Å; A169-D172 VanDerWaalsContact O-N 3.14Å; D172-S174 PolarHBondContact O-N 3.36Å; D172-T175 PolarHBondContact O-N 3.26Å; D172-K176 PolarHBondContact O-N 3.14Å; D172-K176 VanDerWaalsContact OD1-CE 3.31Å; D172-K176 WeakPolarHBondContact OD1-CE 3.48Å; D172-K176 IonicContact OD1-NZ 3.44Å; D172-K176 PolarHBondContact OD1-NZ 3.42Å; D172-K176 IonicContact OD2-NZ 2.73Å; D172-K176 PolarHBondContact OD2-NZ 3.19Å
173L94.3Very high93.4Very high24 Ų2456.1 Ų56.113%0.12633%0.332CS..Hα-helixtrans-56.6-51.5173.1-178.7123.4000111.2I168 A169 H171 T175 K176 L177 M212I168-L173 HydrophobicContact CD1-CB 4.11Å; I168-L173 HydrophobicContact CG1-CB 4.3Å; I168-L173 HydrophobicContact CG2-CB 4.1Å; I168-L173 HydrophobicContact CG2-CD1 3.64Å; A169-L173 PolarHBondContact O-N 3.35Å; H171-L173 VanDerWaalsContact C-N 3.35Å; L173-T175 PolarHBondContact O-N 3.1Å; L173-K176 PolarHBondContact O-N 3.48Å; L173-L177 HydrophobicContact CD2-CD1 3.72Å; L173-L177 HydrophobicContact CG-CD1 4.15Å; L173-L177 HydrophobicContact CG-CG 4.46Å; L173-L177 WeakPolarHBondContact O-CG 3.43Å; L173-L177 PolarHBondContact O-N 3.3Å; L173-M212 HydrophobicContact CD1-CE 3.48Å; L173-M212 VanDerWaalsContact CD1-CE 3.48Å; L173-M212 HydrophobicContact CD1-CG 4.05Å; L173-M212 HydrophobicContact CD1-SD 4.01Å
174S94Very high93.3Very high42 Ų4254.1 Ų54.129%0.29432%0.318SS..Hα-helixtrans-59.5-35.5179.474.90000112.8S170 H171 D172 K178S170-S174 PolarHBondContact O-N 3.02Å; H171-S174 PolarHBondContact O-N 3.44Å; H171-S174 PolarHBondContact O-OG 3.12Å; D172-S174 PolarHBondContact O-N 3.36Å; S174-K178 VanDerWaalsContact O-CG 3.32Å; S174-K178 WeakPolarHBondContact O-CG 3.31Å; S174-K178 PolarHBondContact O-N 2.89Å
175T95Very high93.2Very high69 Ų6960.6 Ų60.642%0.42335%0.348SS..Hα-helixtrans-70.7-43.3179.8-58.60000111.3H171 D172 L173 K178 Q179H171-T175 PolarHBondContact O-N 2.93Å; H171-T175 VanDerWaalsContact O-N 3.09Å; H171-T175 PolarHBondContact O-OG1 3.26Å; D172-T175 PolarHBondContact O-N 3.26Å; L173-T175 PolarHBondContact O-N 3.1Å; T175-K178 PolarHBondContact O-N 3.48Å; T175-Q179 PolarHBondContact O-N 3.41Å
176K94.5Very high93.1Very high48 Ų4863.4 Ų63.421%0.20935%0.351CS..Hα-helixtrans-67-36.8175.6-77.3176.6-177.4156.90112.5L162 F164 I168 D172 L173 Q179 A180L162-K176 HydrophobicContact CD1-CG 4.4Å; L162-K176 HydrophobicContact CD2-CB 4.07Å; L162-K176 VanDerWaalsContact CD2-O 3.28Å; L162-K176 WeakPolarHBondContact CD2-O 3.39Å; F164-K176 HydrophobicContact CD1-CB 4.42Å; F164-K176 HydrophobicContact CD1-CD 3.95Å; F164-K176 HydrophobicContact CE1-CB 3.45Å; F164-K176 VanDerWaalsContact CE1-CB 3.45Å; F164-K176 HydrophobicContact CE1-CD 3.78Å; F164-K176 HydrophobicContact CE1-CG 4.25Å; F164-K176 HydrophobicContact CZ-CB 3.96Å; I168-K176 HydrophobicContact CD1-CD 3.93Å; D172-K176 PolarHBondContact O-N 3.14Å; D172-K176 VanDerWaalsContact OD1-CE 3.31Å; D172-K176 WeakPolarHBondContact OD1-CE 3.48Å; D172-K176 IonicContact OD1-NZ 3.44Å; D172-K176 PolarHBondContact OD1-NZ 3.42Å; D172-K176 IonicContact OD2-NZ 2.73Å; D172-K176 PolarHBondContact OD2-NZ 3.19Å; L173-K176 PolarHBondContact O-N 3.48Å; K176-Q179 WeakPolarHBondContact O-CB 3.35Å; K176-Q179 PolarHBondContact O-N 3.29Å; K176-A180 PolarHBondContact O-N 2.83Å
177L94.6Very high93.2Very high10 Ų1068.1 Ų68.15%0.05237%0.368CS..Hα-helixtrans-63.7-46.8173.3-69.6178.3000111.2F164 L173 Q179 A180 E181 M212 Q215 M216F164-L177 HydrophobicContact CZ-CD2 4.47Å; L173-L177 HydrophobicContact CD2-CD1 3.72Å; L173-L177 HydrophobicContact CG-CD1 4.15Å; L173-L177 HydrophobicContact CG-CG 4.46Å; L173-L177 WeakPolarHBondContact O-CG 3.43Å; L173-L177 PolarHBondContact O-N 3.3Å; L177-Q179 PolarHBondContact O-N 3.04Å; L177-A180 WeakPolarHBondContact O-CA 3.46Å; L177-A180 WeakPolarHBondContact O-CB 3.49Å; L177-A180 PolarHBondContact O-N 3.12Å; L177-E181 WeakPolarHBondContact O-CG 3.49Å; L177-E181 PolarHBondContact O-N 3.19Å; L177-M212 HydrophobicContact CD2-CB 4.45Å; L177-Q215 HydrophobicContact CD1-CB 4.09Å; L177-M216 HydrophobicContact CD2-CG 3.99Å; L177-M216 HydrophobicContact CD2-SD 4.36Å
178K94.7Very high93.5Very high139 Ų13966 Ų6660%0.60434%0.339SS*.Hα-helixtrans-57.2-36.9172.7-73.2174.7-177.8179.30112.7S174 T175 E181 S182S174-K178 VanDerWaalsContact O-CG 3.32Å; S174-K178 WeakPolarHBondContact O-CG 3.31Å; S174-K178 PolarHBondContact O-N 2.89Å; T175-K178 PolarHBondContact O-N 3.48Å; K178-E181 PolarHBondContact O-N 3.23Å; K178-S182 PolarHBondContact O-N 3.34Å
179Q95.1Very high93.6Very high82 Ų8265.5 Ų65.538%0.38334%0.336SS..Hα-helixtrans-63.9-44.7174-176.4178.513.100111.5T175 K176 L177 S182 W183T175-Q179 PolarHBondContact O-N 3.41Å; K176-Q179 WeakPolarHBondContact O-CB 3.35Å; K176-Q179 PolarHBondContact O-N 3.29Å; L177-Q179 PolarHBondContact O-N 3.04Å; Q179-S182 PolarHBondContact O-N 3.49Å; Q179-S182 PolarHBondContact O-OG 2.94Å; Q179-W183 HydrophobicContact CG-CD2 4.32Å; Q179-W183 HydrophobicContact CG-CH2 4.01Å; Q179-W183 HydrophobicContact CG-CZ2 3.69Å; Q179-W183 HydrophobicContact CG-CZ3 4.43Å; Q179-W183 PolarHBondContact O-N 3.04Å
180A94.8Very high93.7Very high0 Ų062.4 Ų62.40%031%0.31CS..Hα-helixtrans-61.4-43.6175.100000111.9L162 K176 L177 S182 W183 L184 V190 L192 M216L162-A180 HydrophobicContact CD2-CB 4.09Å; K176-A180 PolarHBondContact O-N 2.83Å; L177-A180 WeakPolarHBondContact O-CA 3.46Å; L177-A180 WeakPolarHBondContact O-CB 3.49Å; L177-A180 PolarHBondContact O-N 3.12Å; A180-S182 PolarHBondContact O-N 2.99Å; A180-W183 WeakPolarHBondContact O-CB 3.32Å; A180-W183 PolarHBondContact O-N 3.39Å; A180-W183 VanDerWaalsContact O-N 3.14Å; A180-L184 WeakPolarHBondContact O-CG 3.44Å; A180-L184 PolarHBondContact O-N 2.93Å; A180-V190 HydrophobicContact CB-CG1 4.26Å; A180-L192 HydrophobicContact CB-CD2 4.4Å; A180-M216 HydrophobicContact CB-SD 4.39Å
181E93.8Very high93.8Very high34 Ų3461.3 Ų61.316%0.15929%0.29CS..Hα-helixtrans-56.1-49174-69.9176.3161.600111.4L177 K178 W183 L184 E185 M216 N217 V218L177-E181 WeakPolarHBondContact O-CG 3.49Å; L177-E181 PolarHBondContact O-N 3.19Å; K178-E181 PolarHBondContact O-N 3.23Å; E181-W183 PolarHBondContact O-N 2.98Å; E181-W183 VanDerWaalsContact O-N 3.15Å; E181-L184 WeakPolarHBondContact O-CB 3.14Å; E181-L184 PolarHBondContact O-N 3.38Å; E181-E185 WeakPolarHBondContact O-CG 3.5Å; E181-E185 PolarHBondContact O-N 3.04Å; E181-M216 HydrophobicContact CG-CB 4.33Å; E181-M216 HydrophobicContact CG-CG 4.42Å; E181-M216 WeakPolarHBondContact OE1-CA 3.39Å; E181-N217 PolarHBondContact OE1-N 3.17Å; E181-V218 HydrophobicContact CB-CG2 3.84Å; E181-V218 HydrophobicContact CG-CB 4.28Å; E181-V218 HydrophobicContact CG-CG2 3.73Å
182S93.4Very high93.8Very high38 Ų3854.6 Ų54.627%0.26626%0.259SS..Hα-helixtrans-60.7-28178.581.40000113.6K178 Q179 A180 K186K178-S182 PolarHBondContact O-N 3.34Å; Q179-S182 PolarHBondContact O-N 3.49Å; Q179-S182 PolarHBondContact O-OG 2.94Å; A180-S182 PolarHBondContact O-N 2.99Å; S182-K186 WeakPolarHBondContact O-CD 3.34Å; S182-K186 WeakPolarHBondContact O-CG 3.45Å; S182-K186 PolarHBondContact O-N 3.07Å
183W94.3Very high93.8Very high46 Ų4652.2 Ų52.217%0.17425%0.247CC..Hα-helixtrans-79.5-37.7175.5-67.7-18.3000112K160 L162 Q179 A180 E181 K186 K187 H188 V190K160-W183 HydrophobicContact CB-CD2 3.86Å; K160-W183 HydrophobicContact CB-CE3 3.53Å; K160-W183 HydrophobicContact CB-CG 4.48Å; K160-W183 HydrophobicContact CB-CH2 4.24Å; K160-W183 HydrophobicContact CB-CZ3 3.74Å; K160-W183 HydrophobicContact CG-CD2 4.03Å; K160-W183 HydrophobicContact CG-CE3 4.23Å; K160-W183 HydrophobicContact CG-CG 4.25Å; L162-W183 HydrophobicContact CB-CZ3 4.11Å; L162-W183 HydrophobicContact CD1-CH2 4.28Å; L162-W183 HydrophobicContact CD1-CZ3 4.32Å; L162-W183 HydrophobicContact CD2-CZ3 4.49Å; Q179-W183 HydrophobicContact CG-CD2 4.32Å; Q179-W183 HydrophobicContact CG-CH2 4.01Å; Q179-W183 HydrophobicContact CG-CZ2 3.69Å; Q179-W183 HydrophobicContact CG-CZ3 4.43Å; Q179-W183 PolarHBondContact O-N 3.04Å; A180-W183 WeakPolarHBondContact O-CB 3.32Å; A180-W183 PolarHBondContact O-N 3.39Å; A180-W183 VanDerWaalsContact O-N 3.14Å; E181-W183 PolarHBondContact O-N 2.98Å; E181-W183 VanDerWaalsContact O-N 3.15Å; W183-K186 CarbonylContact O-C 3.4Å; W183-K186 PolarHBondContact O-N 3.35Å; W183-K187 PolarHBondContact O-N 3.39Å; W183-H188 HydrophobicContact CB-CB 4.43Å; W183-H188 WeakPolarHBondContact O-CB 3.4Å; W183-H188 PolarHBondContact O-N 3.41Å; W183-V190 HydrophobicContact CB-CG2 3.77Å; W183-V190 HydrophobicContact CE3-CG1 3.95Å; W183-V190 HydrophobicContact CE3-CG2 4.06Å; W183-V190 HydrophobicContact CZ3-CG1 4.31Å
184L91.9Very high93.7Very high4 Ų451.1 Ų51.12%0.02124%0.241CC..Hα-helixtrans-65.6-39.8175.6-69.2161.9000111.2A180 E181 K186 K187 V190 M216 T220 L239A180-L184 WeakPolarHBondContact O-CG 3.44Å; A180-L184 PolarHBondContact O-N 2.93Å; E181-L184 WeakPolarHBondContact O-CB 3.14Å; E181-L184 PolarHBondContact O-N 3.38Å; L184-K186 VanDerWaalsContact C-N 3.28Å; L184-K186 PolarHBondContact O-N 3.48Å; L184-K187 WeakPolarHBondContact O-CA 3.07Å; L184-K187 PolarHBondContact O-N 3.41Å; L184-V190 HydrophobicContact CD2-CG2 4.05Å; L184-V190 HydrophobicContact CG-CG2 3.95Å; L184-M216 HydrophobicContact CD1-SD 4.37Å; L184-T220 HydrophobicContact CD1-CG2 3.49Å; L184-T220 VanDerWaalsContact CD1-CG2 3.49Å; L184-L239 HydrophobicContact CD2-CB 4.15Å
185E90.8Very high93.6Very high137 Ų13755.9 Ų55.964%0.6425%0.253SS*.Hα-helixtrans-58.2-39.3172.6-73.1177.5174.900112.3E181 K187E181-E185 WeakPolarHBondContact O-CG 3.5Å; E181-E185 PolarHBondContact O-N 3.04Å; E185-K187 PolarHBondContact O-N 3.27Å; E185-K187 VanDerWaalsContact O-N 3.12Å
186K90.4Very high93.2Very high132 Ų13253.6 Ų53.657%0.57424%0.243SC*.THydrogen-bonded Turntrans-75.710174.8-67.5172.9-174.7173.50113.5S182 W183 L184 H188S182-K186 WeakPolarHBondContact O-CD 3.34Å; S182-K186 WeakPolarHBondContact O-CG 3.45Å; S182-K186 PolarHBondContact O-N 3.07Å; W183-K186 CarbonylContact O-C 3.4Å; W183-K186 PolarHBondContact O-N 3.35Å; L184-K186 VanDerWaalsContact C-N 3.28Å; L184-K186 PolarHBondContact O-N 3.48Å; K186-H188 VanDerWaalsContact C-N 3.27Å; K186-H188 PolarHBondContact O-N 3.09Å
187K89.9Confident92.7Very high143 Ų14356.7 Ų56.762%0.62226%0.256SS*.THydrogen-bonded Turntrans5933.6-179.7-55179.9179.6177.10113.7T157 W183 L184 E185 P241T157-K187 WeakPolarHBondContact CG2-O 3.39Å; T157-K187 PolarHBondContact OG1-O 3Å; W183-K187 PolarHBondContact O-N 3.39Å; L184-K187 WeakPolarHBondContact O-CA 3.07Å; L184-K187 PolarHBondContact O-N 3.41Å; E185-K187 PolarHBondContact O-N 3.27Å; E185-K187 VanDerWaalsContact O-N 3.12Å; K187-P241 HydrophobicContact CB-CG 4.31Å
188H93.2Very high91.7Very high26 Ų2666.9 Ų66.912%0.1229%0.294CS..  trans-90.2153.8170.7-62.9-38.9000111.1Q158 K160 W183 K186 P241Q158-H188 PolarHBondContact N-ND1 3.21Å; Q158-H188 WeakPolarHBondContact O-CB 3.43Å; K160-H188 HydrophobicContact CG-CB 4.31Å; W183-H188 HydrophobicContact CB-CB 4.43Å; W183-H188 WeakPolarHBondContact O-CB 3.4Å; W183-H188 PolarHBondContact O-N 3.41Å; K186-H188 VanDerWaalsContact C-N 3.27Å; K186-H188 PolarHBondContact O-N 3.09Å; H188-P241 WeakPolarHBondContact O-CD 3.33Å
189H94Very high90.5Very high27 Ų2768.5 Ų68.513%0.12530%0.303CS..EExtended strand (participates in β ladder)trans-85.1143.5167.6-67.5171.8000108.5Q158 V159 K160 L239 R240Q158-H189 PolarHBondContact O-N 3.01Å; V159-H189 CarbonylContact C-O 2.99Å; V159-H189 WeakPolarHBondContact CA-O 3.31Å; V159-H189 HydrophobicContact CG2-CB 4.16Å; K160-H189 PolarHBondContact N-O 2.87Å; H189-L239 VanDerWaalsContact CA-O 3.31Å; H189-L239 WeakPolarHBondContact CA-O 3.44Å; H189-R240 PolarHBondContact CE1-NH1 2.97Å; H189-R240 PolarHBondContact NE2-NE 3.01Å
190V96.1Very high89.3Confident0 Ų069.6 Ų69.60%031%0.309CS..EExtended strand (participates in β ladder)trans-122.6119.5-178.8-173.10000108.9K160 A180 W183 L184 L192 V238 L239K160-V190 CarbonylContact O-C 3.54Å; K160-V190 WeakPolarHBondContact O-CA 3.36Å; A180-V190 HydrophobicContact CB-CG1 4.26Å; W183-V190 HydrophobicContact CB-CG2 3.77Å; W183-V190 HydrophobicContact CE3-CG1 3.95Å; W183-V190 HydrophobicContact CE3-CG2 4.06Å; W183-V190 HydrophobicContact CZ3-CG1 4.31Å; L184-V190 HydrophobicContact CD2-CG2 4.05Å; L184-V190 HydrophobicContact CG-CG2 3.95Å; V190-L192 HydrophobicContact CG1-CD2 3.51Å; V190-L192 HydrophobicContact CG1-CG 4.42Å; V190-V238 WeakPolarHBondContact O-CA 3.18Å; V190-L239 PolarHBondContact N-O 2.97Å; V190-L239 PolarHBondContact O-N 3.32Å
191R95.7Very high88Confident80 Ų8075.3 Ų75.330%0.30234%0.335SS..EExtended strand (participates in β ladder)trans-93110.5171.9-175.6168.483.1-171.96.8108.7V159 K160 E161 L162 M236 C237 V238V159-R191 HydrophobicContact CG1-CB 4.15Å; K160-R191 PolarHBondContact O-N 3.25Å; E161-R191 WeakPolarHBondContact CA-O 3.35Å; E161-R191 HydrophobicContact CG-CB 4.34Å; E161-R191 IonicContact OE1-CZ 3.52Å; E161-R191 IonicContact OE1-NE 3.9Å; E161-R191 IonicContact OE1-NH1 3.76Å; E161-R191 IonicContact OE1-NH2 2.69Å; E161-R191 PolarHBondContact OE1-NH2 2.93Å; E161-R191 IonicContact OE2-CZ 2.66Å; E161-R191 IonicContact OE2-NE 3.75Å; E161-R191 IonicContact OE2-NH2 3.66Å; E161-R191 PolarHBondContact OE2-NH2 3.47Å; L162-R191 PolarHBondContact N-O 3.06Å; R191-M236 HydrophobicContact CG-CE 4.06Å; R191-C237 CarbonylContact C-O 3.57Å; R191-C237 WeakPolarHBondContact CA-O 3.35Å; R191-V238 HydrophobicContact CB-CG2 4.22Å; R191-V238 HydrophobicContact CG-CG2 4Å
192L95.1Very high86.9Confident0 Ų075.5 Ų75.50%034%0.337CS..EExtended strand (participates in β ladder)trans-90.6138.7173.5-50.5-176.8000109L162 F164 A180 V190 L209 V213 M236 C237 L239L162-L192 HydrophobicContact CB-CD2 3.89Å; L162-L192 HydrophobicContact CD2-CD2 4.12Å; L162-L192 CarbonylContact O-C 3.49Å; L162-L192 WeakPolarHBondContact O-CA 3.42Å; F164-L192 HydrophobicContact CE2-CB 4.25Å; F164-L192 HydrophobicContact CE2-CD2 3.96Å; F164-L192 HydrophobicContact CE2-CG 4.46Å; A180-L192 HydrophobicContact CB-CD2 4.4Å; V190-L192 HydrophobicContact CG1-CD2 3.51Å; V190-L192 HydrophobicContact CG1-CG 4.42Å; L192-L209 HydrophobicContact CB-CD1 4.07Å; L192-L209 HydrophobicContact CD1-CD1 4.45Å; L192-V213 HydrophobicContact CD1-CG2 4.27Å; L192-M236 WeakPolarHBondContact O-CA 3.21Å; L192-C237 PolarHBondContact N-O 3.07Å; L192-C237 PolarHBondContact O-N 3.36Å; L192-C237 VanDerWaalsContact O-N 3.09Å; L192-L239 HydrophobicContact CD1-CD1 3.58Å; L192-L239 HydrophobicContact CD1-CG 4.44Å; L192-L239 HydrophobicContact CG-CD1 4.01Å
193T94.3Very high85.9Confident15 Ų1579.5 Ų79.59%0.09236%0.355CS..EExtended strand (participates in β ladder)trans-135.2107.6180-60.20000109.7L162 S163 F164 R195 V234 A235 M236L162-T193 PolarHBondContact O-N 3.37Å; S163-T193 CarbonylContact C-O 3.59Å; S163-T193 WeakPolarHBondContact CA-O 3.4Å; S163-T193 PolarHBondContact OG-O 3.07Å; S163-T193 VanDerWaalsContact OG-O 3.11Å; F164-T193 PolarHBondContact N-O 3.04Å; T193-R195 HydrophobicContact CG2-CG 4.41Å; T193-V234 HydrophobicContact CG2-CG1 3.42Å; T193-V234 VanDerWaalsContact CG2-CG1 3.42Å; T193-A235 CarbonylContact C-O 3.58Å; T193-A235 WeakPolarHBondContact CA-O 3.34Å; T193-M236 HydrophobicContact CG2-CG 4.08Å
194L92.9Very high85.4Confident1 Ų181.6 Ų81.61%0.00537%0.37CS..EExtended strand (participates in β ladder)trans-92.3118.8175.5-178.862.9000109.5F164 V166 L205 T208 L209 M212 V234 A235F164-L194 HydrophobicContact CB-CD1 3.64Å; V166-L194 HydrophobicContact CG2-CD1 4.1Å; V166-L194 HydrophobicContact CG2-CD2 4.45Å; V166-L194 HydrophobicContact CG2-CG 4.19Å; L194-L205 HydrophobicContact CD2-CB 4.45Å; L194-L205 HydrophobicContact CD2-CD2 3.92Å; L194-L205 HydrophobicContact CG-CD2 4.23Å; L194-T208 HydrophobicContact CD2-CG2 4.09Å; L194-L209 HydrophobicContact CB-CD1 4.4Å; L194-M212 HydrophobicContact CD1-CE 4.06Å; L194-V234 CarbonylContact O-C 3.52Å; L194-V234 WeakPolarHBondContact O-CA 3.21Å; L194-A235 HydrophobicContact CB-CB 4.48Å; L194-A235 PolarHBondContact N-O 3.18Å; L194-A235 PolarHBondContact O-N 2.98Å
195R90.6Very high85.2Confident143 Ų14381.6 Ų81.654%0.5437%0.37SS..EExtended strand (participates in β ladder)trans-97.1124.3177.3-61.3-176.9-175.5-175.90.4109.9S163 F164 S165 V166 T193 V234S163-R195 PolarHBondContact OG-NE 3.26Å; F164-R195 PolarHBondContact O-N 2.78Å; S165-R195 WeakPolarHBondContact CA-O 3.49Å; V166-R195 WeakPolarHBondContact CG2-O 3.25Å; V166-R195 PolarHBondContact N-O 3.32Å; T193-R195 HydrophobicContact CG2-CG 4.41Å; R195-V234 HydrophobicContact CG-CG2 4.49Å
196G87.4Confident85.1Confident21 Ų2177.3 Ų77.322%0.21635%0.352CS..PPolyproline II helixtrans-65.6169.1172.400000113.2Q233G196-Q233 WeakPolarHBondContact CA-O 3.4Å; G196-Q233 PolarHBondContact N-O 2.84Å
197K84Confident85.1Confident112 Ų11276.9 Ų76.949%0.48735%0.35SS..PPolyproline II helixtrans-72.2142.2170.7-70.5-179.2-180176.10110.1V166 H199 Q200V166-K197 HydrophobicContact CB-CG 4.37Å; V166-K197 HydrophobicContact CG1-CG 4.4Å; K197-H199 PolarHBondContact O-N 3.43Å; K197-Q200 HydrophobicContact CB-CB 4.43Å; K197-Q200 PolarHBondContact O-N 3.31Å
198R73.8Confident85.1Confident225 Ų22572.5 Ų72.585%0.84934%0.335SS*.THydrogen-bonded Turntrans-58.6129.9178.7-159.6174.5-171.8160.91.8109.4Q200R198-Q200 VanDerWaalsContact C-N 3.34Å; R198-Q200 PolarHBondContact O-N 2.87Å
199H68.4Low85Confident172 Ų17271.3 Ų71.380%0.79633%0.329SS*.THydrogen-bonded Turntrans69.712.1-178.3-54-57.2000117.5K197K197-H199 PolarHBondContact O-N 3.43Å
200Q70.1Confident84.9Confident105 Ų10574.1 Ų74.149%0.49134%0.343SS..  trans-115118.2170.5-71.6179.3-4.900110.1K197 R198 N202K197-Q200 HydrophobicContact CB-CB 4.43Å; K197-Q200 PolarHBondContact O-N 3.31Å; R198-Q200 VanDerWaalsContact C-N 3.34Å; R198-Q200 PolarHBondContact O-N 2.87Å; Q200-N202 PolarHBondContact O-N 3.18Å; Q200-N202 PolarHBondContact O-ND2 3.47Å; Q200-N202 VanDerWaalsContact O-ND2 3.1Å
201H68.2Low84.6Confident121 Ų12179.3 Ų79.356%0.5637%0.367SS*.  trans-70.9116.2165.1-167.4-77.4000107.3D203 E231 G232H201-D203 IonicContact CE1-OD1 2.86Å; H201-D203 PolarHBondContact CE1-OD1 3.42Å; H201-D203 IonicContact ND1-OD1 2.69Å; H201-D203 PolarHBondContact ND1-OD1 2.88Å; H201-E231 PolarHBondContact CD2-O 3.19Å; H201-G232 WeakPolarHBondContact NE2-CA 3.44Å
202N70.9Confident84.4Confident37 Ų3776 Ų7620%0.19836%0.355CS..  trans-107.3102.1-179.3-70.6-70.8000107.7Q200 N204 L205Q200-N202 PolarHBondContact O-N 3.18Å; Q200-N202 PolarHBondContact O-ND2 3.47Å; Q200-N202 VanDerWaalsContact O-ND2 3.1Å; N202-N204 PolarHBondContact O-N 3.02Å; N202-L205 HydrophobicContact CB-CD1 4.1Å; N202-L205 HydrophobicContact CB-CD2 3.72Å; N202-L205 HydrophobicContact CB-CG 3.6Å; N202-L205 WeakPolarHBondContact O-CG 3.29Å
203D72.1Confident84.2Confident122 Ų12276.5 Ų76.565%0.65236%0.358SS*.THydrogen-bonded Turntrans-67.3-16.7-179.9-62.6-34.1000112.9H201H201-D203 IonicContact CE1-OD1 2.86Å; H201-D203 PolarHBondContact CE1-OD1 3.42Å; H201-D203 IonicContact ND1-OD1 2.69Å; H201-D203 PolarHBondContact ND1-OD1 2.88Å
204N84.4Confident84Confident91 Ų9183.3 Ų83.349%0.48739%0.389SS..THydrogen-bonded Turntrans-104.211.7-171.7-62.8-49.2000114.4N202 D206 K207 T208N202-N204 PolarHBondContact O-N 3.02Å; N204-D206 PolarHBondContact O-N 2.95Å; N204-K207 PolarHBondContact O-N 3.01Å; N204-T208 PolarHBondContact O-N 3.33Å; N204-T208 VanDerWaalsContact O-N 3.11Å; N204-T208 PolarHBondContact O-OG1 3.41Å
205L87.3Confident83.9Confident4 Ų489 Ų892%0.02142%0.415CS..Hα-helixtrans-60.9-34.6-178.7-65.4177.1000112.9V166 L194 N202 L209 V228 G232 A235V166-L205 HydrophobicContact CG2-CD2 3.51Å; L194-L205 HydrophobicContact CD2-CB 4.45Å; L194-L205 HydrophobicContact CD2-CD2 3.92Å; L194-L205 HydrophobicContact CG-CD2 4.23Å; N202-L205 HydrophobicContact CB-CD1 4.1Å; N202-L205 HydrophobicContact CB-CD2 3.72Å; N202-L205 HydrophobicContact CB-CG 3.6Å; N202-L205 WeakPolarHBondContact O-CG 3.29Å; L205-L209 WeakPolarHBondContact O-CB 3.24Å; L205-L209 PolarHBondContact O-N 3.36Å; L205-V228 HydrophobicContact CB-CG2 4.42Å; L205-V228 HydrophobicContact CD1-CG1 4.35Å; L205-G232 WeakPolarHBondContact CD1-O 3.32Å; L205-A235 HydrophobicContact CB-CB 3.65Å
206D88.5Confident83.8Confident47 Ų4782.7 Ų82.725%0.25139%0.392SS..Hα-helixtrans-63.5-49.2178.3-70.6-20.1000111.1N204 T208 L209 E210 P226 K227 V228N204-D206 PolarHBondContact O-N 2.95Å; D206-T208 PolarHBondContact O-N 3.11Å; D206-L209 WeakPolarHBondContact O-CB 3.26Å; D206-L209 PolarHBondContact O-N 3Å; D206-L209 VanDerWaalsContact O-N 3.09Å; D206-E210 WeakPolarHBondContact O-CG 3.33Å; D206-E210 PolarHBondContact O-N 2.86Å; D206-P226 HydrophobicContact CB-CB 4.48Å; D206-K227 VanDerWaalsContact OD1-C 3.28Å; D206-V228 WeakPolarHBondContact OD1-CG2 3.46Å; D206-V228 PolarHBondContact OD1-N 2.85Å; D206-V228 VanDerWaalsContact OD2-CG2 3.29Å; D206-V228 WeakPolarHBondContact OD2-CG2 3.42Å
207K89.9Confident83.4Confident123 Ų12389.2 Ų89.254%0.53542%0.422SS..Hα-helixtrans-61.3-44.7179-64.1178.4-178169.70112N204 L209 E210 E211N204-K207 PolarHBondContact O-N 3.01Å; K207-L209 PolarHBondContact O-N 2.95Å; K207-E210 WeakPolarHBondContact O-CB 3.3Å; K207-E210 PolarHBondContact O-N 3.24Å; K207-E210 VanDerWaalsContact O-N 3.11Å; K207-E211 WeakPolarHBondContact O-CG 3.45Å; K207-E211 PolarHBondContact O-N 3.24Å
208T90.6Very high83.3Confident50 Ų5085.8 Ų85.831%0.30741%0.41SS..Hα-helixtrans-61.8-35.8176.6-53.90000111.4L194 N204 D206 M212L194-T208 HydrophobicContact CD2-CG2 4.09Å; N204-T208 PolarHBondContact O-N 3.33Å; N204-T208 VanDerWaalsContact O-N 3.11Å; N204-T208 PolarHBondContact O-OG1 3.41Å; D206-T208 PolarHBondContact O-N 3.11Å; T208-M212 HydrophobicContact CG2-CE 3.9Å; T208-M212 VanDerWaalsContact O-CG 3.26Å; T208-M212 WeakPolarHBondContact O-CG 3.48Å; T208-M212 PolarHBondContact O-N 2.91Å
209L91Very high83.7Confident1 Ų178.4 Ų78.41%0.00539%0.387CS..Hα-helixtrans-70.6-34.7176.4-168.361.9000111.8L192 L194 L205 D206 K207 V213 P226 A235 C237L192-L209 HydrophobicContact CB-CD1 4.07Å; L192-L209 HydrophobicContact CD1-CD1 4.45Å; L194-L209 HydrophobicContact CB-CD1 4.4Å; L205-L209 WeakPolarHBondContact O-CB 3.24Å; L205-L209 PolarHBondContact O-N 3.36Å; D206-L209 WeakPolarHBondContact O-CB 3.26Å; D206-L209 PolarHBondContact O-N 3Å; D206-L209 VanDerWaalsContact O-N 3.09Å; K207-L209 PolarHBondContact O-N 2.95Å; L209-V213 VanDerWaalsContact O-CG2 3.28Å; L209-V213 WeakPolarHBondContact O-CG2 3.4Å; L209-V213 PolarHBondContact O-N 3.39Å; L209-P226 HydrophobicContact CB-CB 4.4Å; L209-P226 HydrophobicContact CD2-CB 3.99Å; L209-P226 HydrophobicContact CG-CB 4.44Å; L209-A235 HydrophobicContact CD2-CB 4.11Å; L209-C237 HydrophobicContact CD2-CB 3.76Å; L209-C237 HydrophobicContact CG-CB 4.43Å
210E91.1Very high84.5Confident87 Ų8772 Ų7241%0.40736%0.36SS..Hα-helixtrans-63.3-50171.6-69.4174.1173.400111.4D206 K207 M212 V213 E214 P226D206-E210 WeakPolarHBondContact O-CG 3.33Å; D206-E210 PolarHBondContact O-N 2.86Å; K207-E210 WeakPolarHBondContact O-CB 3.3Å; K207-E210 PolarHBondContact O-N 3.24Å; K207-E210 VanDerWaalsContact O-N 3.11Å; E210-M212 VanDerWaalsContact C-N 3.28Å; E210-M212 PolarHBondContact O-N 2.85Å; E210-V213 WeakPolarHBondContact O-CA 3.26Å; E210-V213 WeakPolarHBondContact O-CB 3.43Å; E210-V213 PolarHBondContact O-N 3.03Å; E210-E214 WeakPolarHBondContact O-CG 3.49Å; E210-E214 PolarHBondContact O-N 2.86Å; E210-P226 HydrophobicContact CG-CB 4.41Å; E210-P226 HydrophobicContact CG-CG 3.55Å; E210-P226 VanDerWaalsContact OE1-CG 3.23Å; E210-P226 WeakPolarHBondContact OE1-CG 3.43Å
211E91.2Very high85.4Confident108 Ų10867.8 Ų67.851%0.50534%0.343SS..Hα-helixtrans-56.1-42.1176.4-70.4167.5-173.100111.8K207 V213 E214 Q215K207-E211 WeakPolarHBondContact O-CG 3.45Å; K207-E211 PolarHBondContact O-N 3.24Å; E211-V213 VanDerWaalsContact C-N 3.27Å; E211-V213 PolarHBondContact O-N 3.07Å; E211-E214 PolarHBondContact O-N 3.23Å; E211-Q215 VanDerWaalsContact O-CG 3.29Å; E211-Q215 WeakPolarHBondContact O-CG 3.3Å; E211-Q215 PolarHBondContact O-N 3.05Å
212M91.2Very high86.4Confident11 Ų1166.4 Ų66.45%0.05434%0.335CS..Hα-helixtrans-61.7-34.9174.9-75.1-175.7-170.600112.7F164 L173 L177 L194 T208 E210F164-M212 HydrophobicContact CD1-SD 4.49Å; F164-M212 HydrophobicContact CG-SD 4.35Å; L173-M212 HydrophobicContact CD1-CE 3.48Å; L173-M212 VanDerWaalsContact CD1-CE 3.48Å; L173-M212 HydrophobicContact CD1-CG 4.05Å; L173-M212 HydrophobicContact CD1-SD 4.01Å; L177-M212 HydrophobicContact CD2-CB 4.45Å; L194-M212 HydrophobicContact CD1-CE 4.06Å; T208-M212 HydrophobicContact CG2-CE 3.9Å; T208-M212 VanDerWaalsContact O-CG 3.26Å; T208-M212 WeakPolarHBondContact O-CG 3.48Å; T208-M212 PolarHBondContact O-N 2.91Å; E210-M212 VanDerWaalsContact C-N 3.28Å; E210-M212 PolarHBondContact O-N 2.85Å
213V90.8Very high87.3Confident11 Ų1168.5 Ų68.57%0.06735%0.349CS..Hα-helixtrans-75-38.4178.5173.20000111L192 L209 E210 E211 Q215 M216 F222 L239L192-V213 HydrophobicContact CD1-CG2 4.27Å; L209-V213 VanDerWaalsContact O-CG2 3.28Å; L209-V213 WeakPolarHBondContact O-CG2 3.4Å; L209-V213 PolarHBondContact O-N 3.39Å; E210-V213 WeakPolarHBondContact O-CA 3.26Å; E210-V213 WeakPolarHBondContact O-CB 3.43Å; E210-V213 PolarHBondContact O-N 3.03Å; E211-V213 VanDerWaalsContact C-N 3.27Å; E211-V213 PolarHBondContact O-N 3.07Å; V213-Q215 VanDerWaalsContact C-N 3.28Å; V213-Q215 PolarHBondContact O-N 2.98Å; V213-M216 HydrophobicContact CB-CE 3.92Å; V213-M216 HydrophobicContact CG1-CE 3.62Å; V213-M216 HydrophobicContact CG2-CE 4Å; V213-M216 WeakPolarHBondContact O-CB 3.34Å; V213-M216 PolarHBondContact O-N 3.18Å; V213-F222 HydrophobicContact CB-CZ 4Å; V213-F222 HydrophobicContact CG1-CE1 4.15Å; V213-F222 HydrophobicContact CG1-CE2 4.11Å; V213-F222 HydrophobicContact CG1-CZ 3.48Å; V213-F222 VanDerWaalsContact CG1-CZ 3.48Å; V213-F222 HydrophobicContact CG2-CE1 4.08Å; V213-F222 HydrophobicContact CG2-CZ 4.06Å; V213-L239 HydrophobicContact CG1-CD2 4.17Å; V213-L239 HydrophobicContact CG2-CD1 4.29Å; V213-L239 HydrophobicContact CG2-CD2 4.1Å
214E90.2Very high88.2Confident157 Ų15764.6 Ų64.673%0.73433%0.332SS*.Hα-helixtrans-65.4-31.3175.2-69.8179174.400112.8E210 E211 M216E210-E214 WeakPolarHBondContact O-CG 3.49Å; E210-E214 PolarHBondContact O-N 2.86Å; E211-E214 PolarHBondContact O-N 3.23Å; E214-M216 PolarHBondContact O-N 2.97Å
215Q89.9Confident88.5Confident120 Ų12064.2 Ų64.256%0.56133%0.332SS*.THydrogen-bonded Turntrans-67.9-16.4174.3-76.5177-15.300113.9L177 E211 V213L177-Q215 HydrophobicContact CD1-CB 4.09Å; E211-Q215 VanDerWaalsContact O-CG 3.29Å; E211-Q215 WeakPolarHBondContact O-CG 3.3Å; E211-Q215 PolarHBondContact O-N 3.05Å; V213-Q215 VanDerWaalsContact C-N 3.28Å; V213-Q215 PolarHBondContact O-N 2.98Å
216M88.3Confident88.6Confident12 Ų1264.7 Ų64.76%0.05934%0.336CS..  trans-74.1133176-63.3-172.9-70.300110.3L177 A180 E181 L184 V213 E214 V218 T220 L239L177-M216 HydrophobicContact CD2-CG 3.99Å; L177-M216 HydrophobicContact CD2-SD 4.36Å; A180-M216 HydrophobicContact CB-SD 4.39Å; E181-M216 HydrophobicContact CG-CB 4.33Å; E181-M216 HydrophobicContact CG-CG 4.42Å; E181-M216 WeakPolarHBondContact OE1-CA 3.39Å; L184-M216 HydrophobicContact CD1-SD 4.37Å; V213-M216 HydrophobicContact CB-CE 3.92Å; V213-M216 HydrophobicContact CG1-CE 3.62Å; V213-M216 HydrophobicContact CG2-CE 4Å; V213-M216 WeakPolarHBondContact O-CB 3.34Å; V213-M216 PolarHBondContact O-N 3.18Å; E214-M216 PolarHBondContact O-N 2.97Å; M216-V218 PolarHBondContact O-N 3.28Å; M216-T220 HydrophobicContact CE-CG2 4Å; M216-L239 HydrophobicContact CE-CD1 3.42Å; M216-L239 VanDerWaalsContact CE-CD1 3.42Å; M216-L239 HydrophobicContact SD-CD1 4.28Å
217N79.6Confident88.6Confident157 Ų15768.6 Ų68.684%0.8435%0.351SS*.SBendtrans-82.2-7.1-178.4-161.949.5000112.4E181E181-N217 PolarHBondContact OE1-N 3.17Å
218V82.4Confident88.5Confident40 Ų4065.1 Ų65.124%0.24234%0.339CS..SBendtrans-93136.7179.2-1780000109.7E181 M216 T220E181-V218 HydrophobicContact CB-CG2 3.84Å; E181-V218 HydrophobicContact CG-CB 4.28Å; E181-V218 HydrophobicContact CG-CG2 3.73Å; M216-V218 PolarHBondContact O-N 3.28Å; V218-T220 WeakPolarHBondContact O-CG2 3.34Å; V218-T220 PolarHBondContact O-N 3.46Å
219M81.3Confident88Confident71 Ų7166 Ų6635%0.3535%0.345SS..  trans-61.2125.4171.8-66.4-177.17300109.4P242 L247 K250M219-P242 HydrophobicContact CB-CB 4.42Å; M219-P242 HydrophobicContact CB-CG 3.98Å; M219-P242 WeakPolarHBondContact O-CD 3.34Å; M219-P242 WeakPolarHBondContact O-CG 3.44Å; M219-L247 HydrophobicContact CB-CD2 4.47Å; M219-L247 HydrophobicContact CE-CD2 3.89Å; M219-L247 HydrophobicContact SD-CD2 3.54Å; M219-L247 VanDerWaalsContact SD-CD2 3.54Å; M219-K250 HydrophobicContact CE-CB 3.63Å; M219-K250 HydrophobicContact CE-CD 3.47Å; M219-K250 VanDerWaalsContact CE-CD 3.47Å; M219-K250 HydrophobicContact CE-CG 3.57Å
220T86.4Confident87.3Confident37 Ų3774.8 Ų74.823%0.22738%0.378CS..  trans-128.4151.117862.60000110.9L184 M216 V218L184-T220 HydrophobicContact CD1-CG2 3.49Å; L184-T220 VanDerWaalsContact CD1-CG2 3.49Å; M216-T220 HydrophobicContact CE-CG2 4Å; V218-T220 WeakPolarHBondContact O-CG2 3.34Å; V218-T220 PolarHBondContact O-N 3.46Å
221A87.8Confident86.6Confident16 Ų1679 Ų7913%0.13240%0.397CS..EExtended strand (participates in β ladder)trans-116.1141.817100000109.2R240 E246A221-R240 PolarHBondContact N-O 2.87Å; A221-R240 PolarHBondContact O-N 2.86Å; A221-E246 WeakPolarHBondContact CB-OE2 3.46Å
222F90.4Very high85.9Confident92 Ų9274.2 Ų74.240%0.40438%0.377SS..EExtended strand (participates in β ladder)trans-83.3126.1175.9-70.7-83.5000110.4V213 C237 L239V213-F222 HydrophobicContact CB-CZ 4Å; V213-F222 HydrophobicContact CG1-CE1 4.15Å; V213-F222 HydrophobicContact CG1-CE2 4.11Å; V213-F222 HydrophobicContact CG1-CZ 3.48Å; V213-F222 VanDerWaalsContact CG1-CZ 3.48Å; V213-F222 HydrophobicContact CG2-CE1 4.08Å; V213-F222 HydrophobicContact CG2-CZ 4.06Å; F222-C237 HydrophobicContact CE1-CB 4.46Å; F222-L239 HydrophobicContact CD1-CD2 3.65Å; F222-L239 HydrophobicContact CE1-CD2 3.56Å; F222-L239 HydrophobicContact CG-CD2 4.41Å; F222-L239 HydrophobicContact CZ-CD2 4.26Å
223V89.9Confident85.5Confident82 Ų8278.4 Ų78.450%0.49740%0.397SS..EExtended strand (participates in β ladder)trans-83.3-43.5163.6-178.90000109.2V238 R240V223-V238 HydrophobicContact CB-CB 4.28Å; V223-V238 HydrophobicContact CB-CG1 4.13Å; V223-V238 HydrophobicContact CG2-CG1 4.43Å; V223-V238 PolarHBondContact N-O 3.42Å; V223-R240 HydrophobicContact CG2-CB 3.45Å; V223-R240 VanDerWaalsContact CG2-CB 3.45Å; V223-R240 HydrophobicContact CG2-CG 4.33Å
224S90.8Very high85.5Confident40 Ų4078.9 Ų78.928%0.2840%0.4SS..EExtended strand (participates in β ladder)trans-127.2126.4170.569.10000109V238S224-V238 PolarHBondContact N-O 2.96Å; S224-V238 PolarHBondContact O-N 3.19Å; S224-V238 WeakPolarHBondContact OG-CB 3.24Å; S224-V238 WeakPolarHBondContact OG-CG2 3.41Å; S224-V238 PolarHBondContact OG-N 3.4Å
225T89.3Confident85.6Confident82 Ų8271.4 Ų71.450%0.50337%0.365SS..EExtended strand (participates in β ladder)trans-57.5155.3170.856.80000110.5K227T225-K227 PolarHBondContact O-N 2.87Å
226P89.4Confident85.7Confident15 Ų1568.3 Ų68.310%0.09735%0.351CS..EExtended strand (participates in β ladder)trans-55.7128.2172.725.1-35.1000109.8D206 L209 E210 M236 C237D206-P226 HydrophobicContact CB-CB 4.48Å; L209-P226 HydrophobicContact CB-CB 4.4Å; L209-P226 HydrophobicContact CD2-CB 3.99Å; L209-P226 HydrophobicContact CG-CB 4.44Å; E210-P226 HydrophobicContact CG-CB 4.41Å; E210-P226 HydrophobicContact CG-CG 3.55Å; E210-P226 VanDerWaalsContact OE1-CG 3.23Å; E210-P226 WeakPolarHBondContact OE1-CG 3.43Å; P226-M236 WeakPolarHBondContact CA-O 3.38Å; P226-C237 HydrophobicContact CB-CB 4.44Å
227K88.8Confident86Confident128 Ų12867.8 Ų67.856%0.55735%0.348SS*.EExtended strand (participates in β ladder)trans-139129.2177.7-68.2-179.3-178.5-176.40109.9D206 T225 T229 A235 M236D206-K227 VanDerWaalsContact OD1-C 3.28Å; T225-K227 PolarHBondContact O-N 2.87Å; K227-T229 PolarHBondContact O-N 3.46Å; K227-A235 WeakPolarHBondContact O-CA 3.5Å; K227-M236 PolarHBondContact N-O 3.33Å; K227-M236 VanDerWaalsContact N-O 3.07Å; K227-M236 PolarHBondContact O-N 3Å
228V87.9Confident86.7Confident50 Ų5061.7 Ų61.730%0.30332%0.317SS..EExtended strand (participates in β ladder)trans-70.5127.2167-159.90000110.1L205 D206 G232L205-V228 HydrophobicContact CB-CG2 4.42Å; L205-V228 HydrophobicContact CD1-CG1 4.35Å; D206-V228 WeakPolarHBondContact OD1-CG2 3.46Å; D206-V228 PolarHBondContact OD1-N 2.85Å; D206-V228 VanDerWaalsContact OD2-CG2 3.29Å; D206-V228 WeakPolarHBondContact OD2-CG2 3.42Å; V228-G232 VanDerWaalsContact CG1-CA 3.42Å
229T80.8Confident87.3Confident68 Ų6859.8 Ų59.842%0.41731%0.306SS..EExtended strand (participates in β ladder)trans-122.6157.9177.4-51.90000108.4K227 V234K227-T229 PolarHBondContact O-N 3.46Å; T229-V234 CarbonylContact C-O 3.57Å; T229-V234 WeakPolarHBondContact CA-O 3.46Å; T229-V234 PolarHBondContact N-O 3.05Å; T229-V234 PolarHBondContact O-N 2.87Å; T229-V234 VanDerWaalsContact O-N 3.16Å
230R75.6Confident87.8Confident186 Ų18662.1 Ų62.170%0.70231%0.31SS*.THydrogen-bonded Turntrans57.666.7-177.4-59-173.6174.4-174-3112.8G232 Q233R230-G232 VanDerWaalsContact C-N 3.29Å; R230-G232 PolarHBondContact O-N 2.88Å; R230-G232 VanDerWaalsContact O-N 3.12Å; R230-Q233 VanDerWaalsContact O-CB 3.27Å; R230-Q233 WeakPolarHBondContact O-CB 3.43Å; R230-Q233 WeakPolarHBondContact O-CG 3.39Å; R230-Q233 PolarHBondContact O-N 2.93Å
231E76.2Confident88Confident175 Ų17561.3 Ų61.382%0.81831%0.306SS*.THydrogen-bonded Turntrans52.342.4166.5-58.3168-167.400113.9H201 Q233H201-E231 PolarHBondContact CD2-O 3.19Å; E231-Q233 PolarHBondContact O-N 2.94Å
232G77Confident88.1Confident8 Ų862.1 Ų62.18%0.08231%0.31CS..THydrogen-bonded Turntrans862177.900000115.9H201 L205 V228 R230H201-G232 WeakPolarHBondContact NE2-CA 3.44Å; L205-G232 WeakPolarHBondContact CD1-O 3.32Å; V228-G232 VanDerWaalsContact CG1-CA 3.42Å; R230-G232 VanDerWaalsContact C-N 3.29Å; R230-G232 PolarHBondContact O-N 2.88Å; R230-G232 VanDerWaalsContact O-N 3.12Å
233Q83.5Confident87.9Confident99 Ų9960.4 Ų60.446%0.46331%0.309SS..THydrogen-bonded Turntrans-95.1-28.6-169.6-62.2-175.4-13.200114.4G196 R230 E231G196-Q233 WeakPolarHBondContact CA-O 3.4Å; G196-Q233 PolarHBondContact N-O 2.84Å; R230-Q233 VanDerWaalsContact O-CB 3.27Å; R230-Q233 WeakPolarHBondContact O-CB 3.43Å; R230-Q233 WeakPolarHBondContact O-CG 3.39Å; R230-Q233 PolarHBondContact O-N 2.93Å; E231-Q233 PolarHBondContact O-N 2.94Å
234V89.6Confident87.5Confident21 Ų2160.3 Ų60.313%0.12732%0.317CS..EExtended strand (participates in β ladder)trans-137.6121-173.1-176.80000110.3T193 L194 R195 T229 M236T193-V234 HydrophobicContact CG2-CG1 3.42Å; T193-V234 VanDerWaalsContact CG2-CG1 3.42Å; L194-V234 CarbonylContact O-C 3.52Å; L194-V234 WeakPolarHBondContact O-CA 3.21Å; R195-V234 HydrophobicContact CG-CG2 4.49Å; T229-V234 CarbonylContact C-O 3.57Å; T229-V234 WeakPolarHBondContact CA-O 3.46Å; T229-V234 PolarHBondContact N-O 3.05Å; T229-V234 PolarHBondContact O-N 2.87Å; T229-V234 VanDerWaalsContact O-N 3.16Å; V234-M236 HydrophobicContact CG1-CG 4.02Å
235A91.8Very high87.1Confident0 Ų066.1 Ų66.10%034%0.337CS..EExtended strand (participates in β ladder)trans-95.1140.6168.600000110.7T193 L194 L205 L209 K227T193-A235 CarbonylContact C-O 3.58Å; T193-A235 WeakPolarHBondContact CA-O 3.34Å; L194-A235 HydrophobicContact CB-CB 4.48Å; L194-A235 PolarHBondContact N-O 3.18Å; L194-A235 PolarHBondContact O-N 2.98Å; L205-A235 HydrophobicContact CB-CB 3.65Å; L209-A235 HydrophobicContact CD2-CB 4.11Å; K227-A235 WeakPolarHBondContact O-CA 3.5Å
236M92.9Very high86.8Confident56 Ų5666.1 Ų66.128%0.27633%0.332SS..EExtended strand (participates in β ladder)trans-132.4141.7179.8-60.7-177.569.200110.9R191 L192 T193 P226 K227 V234R191-M236 HydrophobicContact CG-CE 4.06Å; L192-M236 WeakPolarHBondContact O-CA 3.21Å; T193-M236 HydrophobicContact CG2-CG 4.08Å; P226-M236 WeakPolarHBondContact CA-O 3.38Å; K227-M236 PolarHBondContact N-O 3.33Å; K227-M236 VanDerWaalsContact N-O 3.07Å; K227-M236 PolarHBondContact O-N 3Å; V234-M236 HydrophobicContact CG1-CG 4.02Å
237C93.8Very high86.5Confident0 Ų069 Ų690%035%0.345CS..EExtended strand (participates in β ladder)trans-140.3158.2167.673.80000110.2R191 L192 L209 F222 P226R191-C237 CarbonylContact C-O 3.57Å; R191-C237 WeakPolarHBondContact CA-O 3.35Å; L192-C237 PolarHBondContact N-O 3.07Å; L192-C237 PolarHBondContact O-N 3.36Å; L192-C237 VanDerWaalsContact O-N 3.09Å; L209-C237 HydrophobicContact CD2-CB 3.76Å; L209-C237 HydrophobicContact CG-CB 4.43Å; F222-C237 HydrophobicContact CE1-CB 4.46Å; P226-C237 HydrophobicContact CB-CB 4.44Å
238V95.1Very high86.1Confident30 Ų3065.2 Ų65.218%0.18234%0.338CS..EExtended strand (participates in β ladder)trans-126118.3176.8-1780000108.3V190 R191 V223 S224V190-V238 WeakPolarHBondContact O-CA 3.18Å; R191-V238 HydrophobicContact CB-CG2 4.22Å; R191-V238 HydrophobicContact CG-CG2 4Å; V223-V238 HydrophobicContact CB-CB 4.28Å; V223-V238 HydrophobicContact CB-CG1 4.13Å; V223-V238 HydrophobicContact CG2-CG1 4.43Å; V223-V238 PolarHBondContact N-O 3.42Å; S224-V238 PolarHBondContact N-O 2.96Å; S224-V238 PolarHBondContact O-N 3.19Å; S224-V238 WeakPolarHBondContact OG-CB 3.24Å; S224-V238 WeakPolarHBondContact OG-CG2 3.41Å; S224-V238 PolarHBondContact OG-N 3.4Å
239L94.2Very high85.7Confident0 Ų068.7 Ų68.70%035%0.351CS..EExtended strand (participates in β ladder)trans-99.8148-179.1-57.5174.8000110.7L184 H189 V190 L192 V213 M216 F222L184-L239 HydrophobicContact CD2-CB 4.15Å; H189-L239 VanDerWaalsContact CA-O 3.31Å; H189-L239 WeakPolarHBondContact CA-O 3.44Å; V190-L239 PolarHBondContact N-O 2.97Å; V190-L239 PolarHBondContact O-N 3.32Å; L192-L239 HydrophobicContact CD1-CD1 3.58Å; L192-L239 HydrophobicContact CD1-CG 4.44Å; L192-L239 HydrophobicContact CG-CD1 4.01Å; V213-L239 HydrophobicContact CG1-CD2 4.17Å; V213-L239 HydrophobicContact CG2-CD1 4.29Å; V213-L239 HydrophobicContact CG2-CD2 4.1Å; M216-L239 HydrophobicContact CE-CD1 3.42Å; M216-L239 VanDerWaalsContact CE-CD1 3.42Å; M216-L239 HydrophobicContact SD-CD1 4.28Å; F222-L239 HydrophobicContact CD1-CD2 3.65Å; F222-L239 HydrophobicContact CE1-CD2 3.56Å; F222-L239 HydrophobicContact CG-CD2 4.41Å; F222-L239 HydrophobicContact CZ-CD2 4.26Å
240R93.1Very high85.4Confident119 Ų11971.4 Ų71.445%0.44936%0.357SS..EExtended strand (participates in β ladder)trans-132.5146.6177.3159171.3-143.7138.82.9110.1H189 A221 V223H189-R240 PolarHBondContact CE1-NH1 2.97Å; H189-R240 PolarHBondContact NE2-NE 3.01Å; A221-R240 PolarHBondContact N-O 2.87Å; A221-R240 PolarHBondContact O-N 2.86Å; V223-R240 HydrophobicContact CG2-CB 3.45Å; V223-R240 VanDerWaalsContact CG2-CB 3.45Å; V223-R240 HydrophobicContact CG2-CG 4.33Å
241P91.1Very high85.5Confident21 Ų2165.7 Ų65.714%0.13635%0.349CS..PPolyproline II helixtrans-58.5140.7167.428-40.1000110.5K187 H188K187-P241 HydrophobicContact CB-CG 4.31Å; H188-P241 WeakPolarHBondContact O-CD 3.33Å
242P88Confident85.5Confident32 Ų3264.4 Ų64.421%0.20834%0.341CS..PPolyproline II helixtrans-64.1139.9-173.628.8-34.2000109.7M219 L247M219-P242 HydrophobicContact CB-CB 4.42Å; M219-P242 HydrophobicContact CB-CG 3.98Å; M219-P242 WeakPolarHBondContact O-CD 3.34Å; M219-P242 WeakPolarHBondContact O-CG 3.44Å; P242-L247 HydrophobicContact CB-CD2 3.93Å; P242-L247 HydrophobicContact CB-CG 4.04Å; P242-L247 HydrophobicContact CG-CD1 4.33Å; P242-L247 HydrophobicContact CG-CD2 3.64Å; P242-L247 HydrophobicContact CG-CG 4.01Å
243S86.2Confident85.4Confident56 Ų5668.1 Ų68.139%0.39236%0.363SS..PPolyproline II helixtrans-69.1150.9175.6-1750000110.2K245 E246 L247S243-K245 PolarHBondContact O-N 3.35Å; S243-K245 VanDerWaalsContact O-N 3.07Å; S243-E246 PolarHBondContact N-OE2 2.83Å; S243-E246 WeakPolarHBondContact O-CB 3.4Å; S243-E246 PolarHBondContact O-N 3.02Å; S243-L247 PolarHBondContact O-N 2.95Å
244A83.1Confident84.6Confident80 Ų8073.2 Ų73.266%0.66138%0.378SS*.Hα-helixtrans-55-31.1176.500000112.6A248A244-A248 PolarHBondContact O-N 2.95Å
245K82.7Confident83.4Confident162 Ų16276.3 Ų76.370%0.70441%0.405SS*.Hα-helixtrans-69-41.4175.1-64.9-175.6178.1-177.10112.5S243 A248 Q249S243-K245 PolarHBondContact O-N 3.35Å; S243-K245 VanDerWaalsContact O-N 3.07Å; K245-A248 PolarHBondContact O-N 3.33Å; K245-Q249 WeakPolarHBondContact O-CG 3.42Å; K245-Q249 PolarHBondContact O-N 3.32Å
246E83.1Confident82Confident83 Ų8384.2 Ų84.239%0.38844%0.442SS..Hα-helixtrans-70.5-37.9-179.7-65.9166.5172.400110.9A221 S243 A248 Q249 K250A221-E246 WeakPolarHBondContact CB-OE2 3.46Å; S243-E246 PolarHBondContact N-OE2 2.83Å; S243-E246 WeakPolarHBondContact O-CB 3.4Å; S243-E246 PolarHBondContact O-N 3.02Å; E246-A248 VanDerWaalsContact C-N 3.34Å; E246-A248 PolarHBondContact O-N 2.99Å; E246-Q249 PolarHBondContact O-N 2.85Å; E246-K250 WeakPolarHBondContact O-CB 3.37Å; E246-K250 PolarHBondContact O-N 3.08Å
247L81.4Confident79.7Confident74 Ų7488.5 Ų88.539%0.38746%0.462SS..Hα-helixtrans-59.2-45.5171.2-69.6174.9000111.4M219 P242 S243 A251M219-L247 HydrophobicContact CB-CD2 4.47Å; M219-L247 HydrophobicContact CE-CD2 3.89Å; M219-L247 HydrophobicContact SD-CD2 3.54Å; M219-L247 VanDerWaalsContact SD-CD2 3.54Å; P242-L247 HydrophobicContact CB-CD2 3.93Å; P242-L247 HydrophobicContact CB-CG 4.04Å; P242-L247 HydrophobicContact CG-CD1 4.33Å; P242-L247 HydrophobicContact CG-CD2 3.64Å; P242-L247 HydrophobicContact CG-CG 4.01Å; S243-L247 PolarHBondContact O-N 2.95Å; L247-A251 WeakPolarHBondContact O-CB 3.37Å; L247-A251 PolarHBondContact O-N 3.3Å
248A81.4Confident77.5Confident49 Ų4994.3 Ų94.341%0.40550%0.499SS..Hα-helixtrans-67-36.7178.500000112.9A244 K245 E246 K252A244-A248 PolarHBondContact O-N 2.95Å; K245-A248 PolarHBondContact O-N 3.33Å; E246-A248 VanDerWaalsContact C-N 3.34Å; E246-A248 PolarHBondContact O-N 2.99Å; A248-K252 WeakPolarHBondContact O-CG 3.18Å; A248-K252 PolarHBondContact O-N 2.92Å
249Q79.5Confident75.1Confident123 Ų123101.2 Ų101.258%0.57553%0.53SS*.Hα-helixtrans-66.9-46.8176-75.5171.3-5.900111.4K245 E246 A251 K252 T253K245-Q249 WeakPolarHBondContact O-CG 3.42Å; K245-Q249 PolarHBondContact O-N 3.32Å; E246-Q249 PolarHBondContact O-N 2.85Å; Q249-A251 VanDerWaalsContact C-N 3.3Å; Q249-A251 PolarHBondContact O-N 3.23Å; Q249-K252 WeakPolarHBondContact O-CB 3.32Å; Q249-K252 PolarHBondContact O-N 3.01Å; Q249-K252 VanDerWaalsContact O-N 3.07Å; Q249-T253 PolarHBondContact O-N 3.26Å; Q249-T253 PolarHBondContact O-OG1 3.12Å; Q249-T253 VanDerWaalsContact O-OG1 3.06Å
250K74.4Confident72.8Confident126 Ų126107.2 Ų107.255%0.54857%0.568SS.*Hα-helixtrans-68.1-31-179-160135.5177.4-102.50112.3M219 E246 K252 T253 R254M219-K250 HydrophobicContact CE-CB 3.63Å; M219-K250 HydrophobicContact CE-CD 3.47Å; M219-K250 VanDerWaalsContact CE-CD 3.47Å; M219-K250 HydrophobicContact CE-CG 3.57Å; E246-K250 WeakPolarHBondContact O-CB 3.37Å; E246-K250 PolarHBondContact O-N 3.08Å; K250-K252 VanDerWaalsContact C-N 3.34Å; K250-T253 PolarHBondContact O-N 3.33Å; K250-R254 WeakPolarHBondContact O-CB 3.46Å; K250-R254 PolarHBondContact O-N 2.93Å
251A77.4Confident70.4Confident65 Ų65110.3 Ų110.354%0.53759%0.588SS.*Hα-helixtrans-64.8-36.8170.500000112.6L247 Q249 A255L247-A251 WeakPolarHBondContact O-CB 3.37Å; L247-A251 PolarHBondContact O-N 3.3Å; Q249-A251 VanDerWaalsContact C-N 3.3Å; Q249-A251 PolarHBondContact O-N 3.23Å; A251-A255 PolarHBondContact O-N 3.25Å
252K75.6Confident68.2Low148 Ų148113.6 Ų113.664%0.64362%0.617SS**Hα-helixtrans-69-45.8173.6-68.8172.6-179.5-1710111.5A248 Q249 K250 R254 A255 E256A248-K252 WeakPolarHBondContact O-CG 3.18Å; A248-K252 PolarHBondContact O-N 2.92Å; Q249-K252 WeakPolarHBondContact O-CB 3.32Å; Q249-K252 PolarHBondContact O-N 3.01Å; Q249-K252 VanDerWaalsContact O-N 3.07Å; K250-K252 VanDerWaalsContact C-N 3.34Å; K252-R254 VanDerWaalsContact C-N 3.32Å; K252-R254 PolarHBondContact O-N 2.87Å; K252-A255 WeakPolarHBondContact O-CB 3.34Å; K252-A255 PolarHBondContact O-N 3.36Å; K252-E256 PolarHBondContact O-N 3.32Å
253T75.3Confident65.9Low87 Ų87123.8 Ų123.853%0.53465%0.651SS.*Hα-helixtrans-61.4-38.9177.2-47.60000112.2Q249 K250 A255 E256 E257Q249-T253 PolarHBondContact O-N 3.26Å; Q249-T253 PolarHBondContact O-OG1 3.12Å; Q249-T253 VanDerWaalsContact O-OG1 3.06Å; K250-T253 PolarHBondContact O-N 3.33Å; T253-A255 VanDerWaalsContact C-N 3.28Å; T253-A255 PolarHBondContact O-N 3.02Å; T253-E256 PolarHBondContact O-N 3.39Å; T253-E257 PolarHBondContact O-N 3.18Å
254R67.6Low63.8Low206 Ų206130.6 Ų130.678%0.77767%0.674SS**Hα-helixtrans-69.8-22.6175.5-169.9173.6-177.6-178.21.8113.4K250 K252K250-R254 WeakPolarHBondContact O-CB 3.46Å; K250-R254 PolarHBondContact O-N 2.93Å; K252-R254 VanDerWaalsContact C-N 3.32Å; K252-R254 PolarHBondContact O-N 2.87Å
255A64.1Low61.7Low86 Ų86133.1 Ų133.171%0.71168%0.681SS**Hα-helixtrans-83.3-18.3174.700000113A251 K252 T253A251-A255 PolarHBondContact O-N 3.25Å; K252-A255 WeakPolarHBondContact O-CB 3.34Å; K252-A255 PolarHBondContact O-N 3.36Å; T253-A255 VanDerWaalsContact C-N 3.28Å; T253-A255 PolarHBondContact O-N 3.02Å
256E61.3Low60Low165 Ų165133 Ų13377%0.77169%0.687SS**Hα-helixtrans-97.6-4.2179.1-89.3177.1152.100114.2K252 T253 P258K252-E256 PolarHBondContact O-N 3.32Å; T253-E256 PolarHBondContact O-N 3.39Å; E256-P258 VanDerWaalsContact O-CD 3.25Å; E256-P258 WeakPolarHBondContact O-CD 3.43Å
257E45.7Very low58.1Low147 Ų147134.8 Ų134.869%0.68771%0.706SS**SBendtrans-69.6116.5170.8-81.5-175.116100110.3T253 Q259T253-E257 PolarHBondContact O-N 3.18Å; E257-Q259 PolarHBondContact O-N 3.28Å
258P46.6Very low56.2Low121 Ų121137.4 Ų137.479%0.78673%0.725SS**PPolyproline II helixtrans-69.1129.2173.928.5-30.7000108.6E256E256-P258 VanDerWaalsContact O-CD 3.25Å; E256-P258 WeakPolarHBondContact O-CD 3.43Å
259Q45.1Very low54.2Low176 Ų176139.9 Ų139.982%0.82274%0.74SS**PPolyproline II helixtrans-55.8136.5174.1-64.9-156.2-5.800110.1E257 E261E257-Q259 PolarHBondContact O-N 3.28Å; Q259-E261 PolarHBondContact O-N 2.94Å; Q259-E261 VanDerWaalsContact O-N 3.09Å
260P46.4Very low52.5Low125 Ų125141.5 Ų141.581%0.81275%0.752SS**PPolyproline II helixtrans-62.6118.5171.125.5-30.6000108.1A262P260-A262 PolarHBondContact O-N 2.97Å
261E42.8Very low50.8Low184 Ų184141.3 Ų141.386%0.8676%0.762SS**PPolyproline II helixtrans-46127.4177-67-178.1153.200110.7Q259 R263Q259-E261 PolarHBondContact O-N 2.94Å; Q259-E261 VanDerWaalsContact O-N 3.09Å; E261-R263 PolarHBondContact O-N 3.06Å
262A44.1Very low49.1Very low91 Ų91145.5 Ų145.575%0.75278%0.775SS**  trans-48.2115.2166.300000109.1P260 K264P260-A262 PolarHBondContact O-N 2.97Å; A262-K264 VanDerWaalsContact C-N 3.34Å; A262-K264 PolarHBondContact O-N 3.26Å
263R39.7Very low47.6Very low246 Ų246144.7 Ų144.793%0.92878%0.783SS**  trans-55100.5166-83.9-179.3174.6-171.4-2107.8E261 T265E261-R263 PolarHBondContact O-N 3.06Å; R263-T265 PolarHBondContact O-N 3.49Å; R263-T265 VanDerWaalsContact O-N 3.12Å
264K42.6Very low46.4Very low198 Ų198146 Ų14686%0.86179%0.791SS**  trans-58.6111.9166.1-73.5175.2179.41740107.4A262 L266A262-K264 VanDerWaalsContact C-N 3.34Å; A262-K264 PolarHBondContact O-N 3.26Å; K264-L266 PolarHBondContact O-N 2.8Å
265T39.9Very low45.2Very low134 Ų134144.4 Ų144.482%0.82279%0.792SS**PPolyproline II helixtrans-58.3120.9162.744.30000108.2R263R263-T265 PolarHBondContact O-N 3.49Å; R263-T265 VanDerWaalsContact O-N 3.12Å
266L45.4Very low44.4Very low158 Ų158148.9 Ų148.983%0.82780%0.798SS**PPolyproline II helixtrans-59.9135.2171.9-65.8164.9000109.3K264 V268K264-L266 PolarHBondContact O-N 2.8Å; L266-V268 PolarHBondContact O-N 2.62Å
267P43.3Very low43.5Very low121 Ų121145.2 Ų145.279%0.78680%0.796SS**PPolyproline II helixtrans-74.1125.2169.929.4-29.6000109.2S269P267-S269 PolarHBondContact O-N 3.44Å
268V42.7Very low43.7Very low129 Ų129143.6 Ų143.678%0.78280%0.796SS**  trans-64.4113.8166.5176.70000107.3L266 N270L266-V268 PolarHBondContact O-N 2.62Å; V268-N270 PolarHBondContact O-N 3.28Å
269S39.3Very low43.9Very low102 Ų102145.8 Ų145.871%0.71380%0.796SS**  trans-73.9113.5171.552.70000109.3P267P267-S269 PolarHBondContact O-N 3.44Å
270N42.9Very low44.1Very low156 Ų156149.7 Ų149.783%0.83481%0.814SS**  trans-79.1121.6161.6-67-19.6000107.9V268V268-N270 PolarHBondContact O-N 3.28Å
271T39Very low44Very low122 Ų122150.9 Ų150.975%0.74881%0.814SS**  trans-107.2119.5162.747.80000108.3
272D41.3Very low44Very low154 Ų154149.2 Ų149.282%0.82481%0.812SS**  trans-55.2139.8161.9-95.6-49.2000110.8
273T45.6Very low44Very low131 Ų131152.4 Ų152.480%0.80482%0.815SS**  trans-140.4100.7153-62.90000107.2
274T49Very low44.3Very low114 Ų114146.9 Ų146.970%0.69981%0.808SS**  trans-63.5131.2159.8-45.50000108.9
275E42.6Very low44.4Very low173 Ų173143.7 Ų143.781%0.80881%0.805SS**  172.8136.2122.6-94.4178.5166.600112.6
276E46.5Very low44.7Very low180 Ų180144.3 Ų144.384%0.84180%0.804SS**  trans15.8136.2156.5-63-173.6125.100121.7
277A43.9Very low44.6Very low88 Ų88143.4 Ų143.473%0.72780%0.802SS**  159128.1106.100000113.6
278V48.5Very low44.7Very low113 Ų113145.1 Ų145.169%0.68580%0.804SS**  83.2115.5129.8173.50000120.4
279Q50.8Low44.9Very low167 Ų167146.4 Ų146.478%0.7881%0.805SS**  trans54.8137.6138.3-62.3165.6-7.300118.1
280Q49.8Very low45.4Very low257 Ų257150.5 Ų150.5100%1.20181%0.814SS**  cis-165.2032.9-133.2169.719.800108.3

Retrieved 280 of 280 residues in 41.4 ms (Link to these results)