A0A077Z1J6_TRITR Loading...

H/ACA ribonucleoprotein complex subunit

Required for ribosome biogenesis. Part of a complex which catalyzes pseudouridylation of rRNA. This involves the isomerization of uridine such that the ribose is subsequently attached to C5, instead of the normal N1. Pseudouridine ("psi") residues may serve to stabilize the conformation of rRNAs.

AlphaFold DB , UniProt , Accession A0A077Z1J6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 251 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
1M36.8Very low41.7Very low241 Ų241161.1 Ų161.1100%1.18782%0.818SS**  0107.20-67.5168.9177.700107.1
2S35.6Very low41.7Very low80 Ų80153.1 Ų153.156%0.55981%0.806SS**  trans171.6144.7164.453.70000112.3
3F39.4Very low42.3Very low184 Ų184159.5 Ų159.581%0.80781%0.812SS**  trans47.2105.916140.3-110000119.7
4R45.5Very low42.6Very low255 Ų255156.1 Ų156.196%0.96281%0.81SS**  trans-152.651.7149.4-122175.1-94176.6-8.3112.8R6R4-R6 PolarHBondContact O-N 3.29Å
5G38Very low43.1Very low75 Ų75162.5 Ų162.577%0.77382%0.82SS**  trans-8198.2152.200000108.2
6R42.6Very low43.3Very low237 Ų237157.5 Ų157.589%0.89482%0.821SS**  trans-163.6132.2154.1-86-128.1-169.2-86.83.4110.8R4R4-R6 PolarHBondContact O-N 3.29Å
7R43Very low43.3Very low246 Ų246152.9 Ų152.993%0.92882%0.822SS**  trans101.8123.9142-133179-165.5-175.43.2117.1
8G42.5Very low43.3Very low68 Ų68148.2 Ų148.270%0.70182%0.815SS**  trans142.844.4179.600000108.8
9S47.6Very low43.9Very low99 Ų99152.9 Ų152.969%0.69282%0.819SS**  41.5107.387.674.60000114.3
10S42Very low43.8Very low90 Ų90149 Ų14963%0.62982%0.817SS**  trans63.9109.5140.6-164.30000116.2
11F46.2Very low44.3Very low197 Ų197151.6 Ų151.686%0.86482%0.82SS**  -160100.3110.6-77.4-65.5000107.9
12G41.6Very low45.2Very low65 Ų65152.1 Ų152.167%0.6781%0.809SS**  trans-65.4131.2160.100000109.8
13R49.5Very low45.8Very low236 Ų236151.2 Ų151.289%0.89181%0.812SS**  trans-140.689.7152.7-78-63.4-142.7-104.1-4107.8
14S45.6Very low46.6Very low112 Ų112148.1 Ų148.178%0.78381%0.813SS**  trans-45.1136.7156-43.90000111.3
15R50.2Low46.5Very low253 Ų253140.1 Ų140.196%0.95581%0.811SS**  trans158.7103.8131.9-91.2171.6-177.8-171.20.6109.6
16G46.8Very low46.8Very low82 Ų82140.1 Ų140.185%0.84581%0.81SS**  trans-175.243.1171.800000111.8
17G42.4Very low47.1Very low80 Ų80131.9 Ų131.983%0.82580%0.799SS**  trans-69.1146.5164.100000110.3
18G44.6Very low47.6Very low68 Ų68124 Ų12470%0.70179%0.794SS**  trans86.7102.5158.400000115.3
19R53.3Low48.2Very low237 Ų237132.4 Ų132.489%0.89481%0.805SS**  -170.9104.4129.7-97.9160.6-130.3-116.38.8107.4F21R19-F21 PolarHBondContact O-N 3.29Å
20G42.8Very low48.2Very low75 Ų75131.1 Ų131.177%0.77381%0.808SS**  trans-58.3126.2-179.500000111.1R22G20-R22 PolarHBondContact O-N 3.17Å
21F53.5Low48.1Very low203 Ų203129.8 Ų129.889%0.8981%0.808SS**  trans-84.178.3152.9-68.3-81000107.1R19 G23R19-F21 PolarHBondContact O-N 3.29Å; F21-G23 PolarHBondContact O-N 3.37Å; F21-G23 VanDerWaalsContact O-N 3.11Å
22R57.3Low48.4Very low253 Ų253131 Ų13196%0.95581%0.808SS**  trans-61.698.3143.6-69.1-176.9-144.8-136.92105G20G20-R22 PolarHBondContact O-N 3.17Å
23G46.3Very low49Very low60 Ų60135.5 Ų135.562%0.61981%0.812SS**  trans-162.772-173.300000111.2F21F21-G23 PolarHBondContact O-N 3.37Å; F21-G23 VanDerWaalsContact O-N 3.11Å
24S56.1Low49.1Very low119 Ų119131.6 Ų131.683%0.83281%0.808SS**  trans65.257.5150.9-146.60000117
25G45Very low49.6Very low88 Ų88130.7 Ų130.791%0.90780%0.798SS**  trans-8510.8157.600000113.5
26G44.2Very low49.8Very low74 Ų74120.9 Ų120.976%0.76378%0.776SS**  trans-101.682.6-174.300000111.6
27G49.4Very low50.3Low65 Ų65121.3 Ų121.367%0.6776%0.764SS**  trans-163.643.617400000110.3R29G27-R29 PolarHBondContact O-N 3.14Å
28G52.3Low51.1Low79 Ų79118.1 Ų118.181%0.81473%0.728SS**  trans-51114.816900000108.4G30G28-G30 PolarHBondContact O-N 3.1Å
29R54.7Low52.2Low245 Ų245122.5 Ų122.593%0.92573%0.731SS**  trans-57.6117.5-176.3-65.2170179.3174.6-1109.3G27 G31G27-R29 PolarHBondContact O-N 3.14Å; R29-G31 PolarHBondContact O-N 3.34Å
30G47.9Very low53.3Low73 Ų73117.8 Ų117.875%0.75372%0.719SS**  trans34.968.5153.600000114.9G28 Y32G28-G30 PolarHBondContact O-N 3.1Å; G30-Y32 PolarHBondContact O-N 3.21Å
31G40.5Very low55.4Low61 Ų61115.9 Ų115.963%0.62969%0.692SS**  trans-54.9135.2152.500000107R29 Q33R29-G31 PolarHBondContact O-N 3.34Å; G31-Q33 VanDerWaalsContact C-N 3.3Å; G31-Q33 PolarHBondContact O-N 3.44Å
32Y52.3Low57.2Low222 Ų222108.9 Ų108.987%0.87167%0.666SS**  trans-3098.1164.8-97.9-127000108.9G30 D34G30-Y32 PolarHBondContact O-N 3.21Å; Y32-D34 VanDerWaalsContact C-N 3.31Å; Y32-D34 PolarHBondContact O-N 3.16Å; Y32-D34 VanDerWaalsContact O-N 3.11Å
33Q54.8Low58.9Low161 Ų16199.3 Ų99.375%0.75263%0.632SS**  trans-70.5111161-70.3172.81200100.9G31 T35G31-Q33 VanDerWaalsContact C-N 3.3Å; G31-Q33 PolarHBondContact O-N 3.44Å; Q33-T35 VanDerWaalsContact CB-OG1 3.32Å; Q33-T35 WeakPolarHBondContact CB-OG1 2.99Å; Q33-T35 PolarHBondContact O-N 3Å; Q33-T35 PolarHBondContact O-OG1 3.17Å
34D51.8Low61.1Low153 Ų15396.4 Ų96.482%0.81860%0.602SS**  trans-60.567.8151.7-62.7-45.5000105.7Y32 G36Y32-D34 VanDerWaalsContact C-N 3.31Å; Y32-D34 PolarHBondContact O-N 3.16Å; Y32-D34 VanDerWaalsContact O-N 3.11Å; D34-G36 PolarHBondContact O-N 2.88Å
35T55.3Low62.9Low94 Ų9490.8 Ų90.858%0.57756%0.563SS**  trans-61.8114.7173.4-52.20000102.2Q33Q33-T35 VanDerWaalsContact CB-OG1 3.32Å; Q33-T35 WeakPolarHBondContact CB-OG1 2.99Å; Q33-T35 PolarHBondContact O-N 3Å; Q33-T35 PolarHBondContact O-OG1 3.17Å
36G54.2Low65.2Low47 Ų4788.2 Ų88.249%0.48553%0.53SS..  trans-52.4-175.2172.200000111.6D34 P38D34-G36 PolarHBondContact O-N 2.88Å; G36-P38 VanDerWaalsContact O-N 3.15Å
37P57.6Low67.6Low90 Ų9085.3 Ų85.358%0.58450%0.496SS*.SBendtrans-41.5127.1-174.9-26.231.4000110.8E39 K76P37-E39 PolarHBondContact O-N 2.72Å; P37-K76 HydrophobicContact CB-CB 4.21Å; P37-K76 HydrophobicContact CB-CD 4.4Å
38P59.8Low69.7Low13 Ų1385.2 Ų85.28%0.08448%0.482CS..  trans-44.9136.9-167.9-28.730.6000112.4G36 H40 V41 Y72 K76 D116G36-P38 VanDerWaalsContact O-N 3.15Å; P38-H40 PolarHBondContact O-N 3.16Å; P38-H40 VanDerWaalsContact O-N 3.15Å; P38-V41 HydrophobicContact CB-CG1 4.02Å; P38-V41 HydrophobicContact CG-CG1 4.24Å; P38-Y72 HydrophobicContact CG-CE2 3.93Å; P38-K76 PolarHBondContact O-NZ 2.71Å; P38-D116 HydrophobicContact CB-CB 4.24Å; P38-D116 HydrophobicContact CG-CB 3.91Å
39E66.6Low71.6Confident161 Ų16185.8 Ų85.875%0.75246%0.463SS*.SBendtrans-51.4-40.7176.2-83.1-171.9149.700110.2P37 K76P37-E39 PolarHBondContact O-N 2.72Å; E39-K76 PolarHBondContact O-NZ 3.23Å; E39-K76 VanDerWaalsContact O-NZ 3.14Å
40H77.6Confident73.4Confident138 Ų13877.6 Ų77.664%0.63944%0.442SS*.  trans-129.6129.1177.7-62.6-75.4000110.7P38 P117P38-H40 PolarHBondContact O-N 3.16Å; P38-H40 VanDerWaalsContact O-N 3.15Å; H40-P117 WeakPolarHBondContact O-CD 3.4Å
41V86.6Confident75.4Confident34 Ų3476.8 Ų76.821%0.20642%0.424CS..  trans-110.3143.3167.9-630000108.3P38 Y72 F114P38-V41 HydrophobicContact CB-CG1 4.02Å; P38-V41 HydrophobicContact CG-CG1 4.24Å; V41-Y72 HydrophobicContact CG1-CD2 4.41Å; V41-F114 HydrophobicContact CB-CB 3.96Å; V41-F114 HydrophobicContact CG2-CB 4.01Å; V41-F114 HydrophobicContact CG2-CD1 4.03Å; V41-F114 HydrophobicContact CG2-CG 4.22Å
42T90.7Very high77.7Confident56 Ų5681.9 Ų81.934%0.34444%0.436SS..EExtended strand (participates in β ladder)trans-115.5147.2178.6-54.30000109.3L44 F114 I115T42-L44 PolarHBondContact O-N 2.76Å; T42-F114 CarbonylContact O-C 3.34Å; T42-F114 VanDerWaalsContact O-CA 3.29Å; T42-F114 WeakPolarHBondContact O-CA 3.46Å; T42-I115 PolarHBondContact N-O 3.22Å; T42-I115 PolarHBondContact O-N 2.88Å
43E93.1Very high79.5Confident52 Ų5278.9 Ų78.924%0.24343%0.43CS..EExtended strand (participates in β ladder)trans-58.8121.4174.3-169.6-176.2131.600110T60 T61 K112 F114E43-T60 PolarHBondContact OE1-OG1 3.46Å; E43-T61 PolarHBondContact O-OG1 2.89Å; E43-K112 HydrophobicContact CG-CD 4.34Å; E43-K112 IonicContact OE1-NZ 3.97Å; E43-K112 IonicContact OE2-NZ 2.79Å; E43-K112 PolarHBondContact OE2-NZ 3.27Å; E43-F114 HydrophobicContact CB-CE1 4.32Å
44L93Very high81.3Confident0 Ų073.4 Ų73.40%041%0.405CS..EExtended strand (participates in β ladder)trans-89.4-46.9176174.263000110.4T42 C59 T60 P65 V71 V82 V113 I115 L120T42-L44 PolarHBondContact O-N 2.76Å; L44-C59 WeakPolarHBondContact O-CA 3.27Å; L44-T60 PolarHBondContact O-N 2.86Å; L44-P65 HydrophobicContact CD1-CB 4.09Å; L44-P65 HydrophobicContact CD1-CG 3.86Å; L44-V71 HydrophobicContact CD2-CG2 4.28Å; L44-V82 HydrophobicContact CD2-CG2 4.4Å; L44-V113 HydrophobicContact CB-CG2 4.23Å; L44-V113 WeakPolarHBondContact CB-O 3.48Å; L44-V113 HydrophobicContact CD2-CG2 4.34Å; L44-V113 HydrophobicContact CG-CG2 4.47Å; L44-V113 PolarHBondContact N-O 3.23Å; L44-I115 HydrophobicContact CB-CB 4.16Å; L44-I115 HydrophobicContact CB-CG2 3.85Å; L44-I115 HydrophobicContact CD1-CG2 4.12Å; L44-I115 HydrophobicContact CD2-CB 4.37Å; L44-I115 HydrophobicContact CD2-CD1 4.38Å; L44-I115 HydrophobicContact CG-CG2 4.4Å; L44-L120 HydrophobicContact CD1-CD2 4.3Å
45G93.4Very high83.4Confident0 Ų066.1 Ų66.10%037%0.366CS..EExtended strand (participates in β ladder)trans178.1-177.8-175.400000113K58 V113G45-K58 CarbonylContact C-O 3.58Å; G45-K58 WeakPolarHBondContact CA-O 3.33Å; G45-V113 PolarHBondContact N-O 2.88Å; G45-V113 VanDerWaalsContact O-CG2 3.29Å; G45-V113 WeakPolarHBondContact O-CG2 3.42Å; G45-V113 PolarHBondContact O-N 2.65Å
46V93.7Very high85.3Confident35 Ų3562 Ų6221%0.21234%0.341CS..EExtended strand (participates in β ladder)trans-113.9136.2-177.1-173.30000109.4C57 K58 T60 A109 K112V46-C57 CarbonylContact O-C 3.58Å; V46-C57 VanDerWaalsContact O-CA 3.22Å; V46-C57 WeakPolarHBondContact O-CA 3.36Å; V46-K58 PolarHBondContact N-O 3.46Å; V46-K58 PolarHBondContact O-N 3.46Å; V46-T60 HydrophobicContact CG2-CG2 4.13Å; V46-A109 WeakPolarHBondContact CG1-O 3.42Å; V46-K112 HydrophobicContact CG2-CG 4.43Å
47F93.8Very high87.2Confident13 Ų1359.8 Ų59.86%0.05732%0.318CS..EExtended strand (participates in β ladder)trans-55.2139.2174.5174.7-98000111.2H49 P50 I55 F107 T108 D111F47-H49 VanDerWaalsContact CZ-C 3.46Å; F47-P50 HydrophobicContact CZ-CB 4.19Å; F47-P50 HydrophobicContact CZ-CG 4.4Å; F47-I55 HydrophobicContact CD2-CB 3.82Å; F47-I55 HydrophobicContact CD2-CD1 4.25Å; F47-I55 HydrophobicContact CD2-CG2 4.09Å; F47-I55 HydrophobicContact CE2-CB 3.7Å; F47-I55 HydrophobicContact CE2-CG2 3.62Å; F47-F107 HydrophobicContact CD1-CB 3.86Å; F47-F107 HydrophobicContact CD2-CB 3.59Å; F47-F107 HydrophobicContact CD2-CD1 4.28Å; F47-F107 HydrophobicContact CD2-CG 4.03Å; F47-F107 HydrophobicContact CE1-CB 3.77Å; F47-F107 WeakPolarHBondContact CE1-O 3.31Å; F47-F107 HydrophobicContact CE2-CB 3.51Å; F47-F107 HydrophobicContact CE2-CG 4.11Å; F47-F107 HydrophobicContact CG-CB 3.74Å; F47-F107 HydrophobicContact CG-CG 4.46Å; F47-F107 HydrophobicContact CZ-CB 3.57Å; F47-T108 VanDerWaalsContact CD1-C 3.49Å; F47-T108 WeakPolarHBondContact CD1-O 3.3Å; F47-D111 HydrophobicContact CB-CB 4.23Å; F47-D111 WeakPolarHBondContact CB-O 3.29Å; F47-D111 PolarHBondContact N-O 3.46Å
48T93Very high88.9Confident62 Ų6260.5 Ų60.538%0.3831%0.311SS..EExtended strand (participates in β ladder)trans-118.4-56.2-179.1-53.80000111.7V56 K58T48-V56 WeakPolarHBondContact CB-O 3.38Å; T48-V56 PolarHBondContact N-O 3.07Å; T48-K58 PolarHBondContact OG1-N 3.02Å
49H92.6Very high90.4Very high91 Ų9160.1 Ų60.142%0.42131%0.309SS..EExtended strand (participates in β ladder)trans-154.4150.5178.757.4-84.9000111.2F47 V56F47-H49 VanDerWaalsContact CZ-C 3.46Å; H49-V56 PolarHBondContact O-N 3.32Å
50P93Very high91.5Very high73 Ų7356.3 Ų56.347%0.47430%0.297SS..EExtended strand (participates in β ladder)trans-76.9145.8174.732.2-32.4000110.7F47 A104F47-P50 HydrophobicContact CZ-CB 4.19Å; F47-P50 HydrophobicContact CZ-CG 4.4Å; P50-A104 HydrophobicContact CB-CB 3.75Å
51C90.5Very high91.9Very high57 Ų5751.2 Ų51.239%0.38528%0.275SS..EExtended strand (participates in β ladder)trans-136.782.2178.3-171.20000110.2E53 Q54 V56C51-E53 PolarHBondContact O-N 3.09Å; C51-Q54 CarbonylContact C-O 3.51Å; C51-Q54 WeakPolarHBondContact CA-O 3.46Å; C51-Q54 HydrophobicContact CB-CB 4.47Å; C51-Q54 PolarHBondContact N-O 3.09Å; C51-Q54 WeakPolarHBondContact O-CA 3.33Å; C51-Q54 PolarHBondContact O-N 3.1Å; C51-Q54 VanDerWaalsContact O-O 3.12Å; C51-V56 HydrophobicContact CB-CG2 4.42Å
52L89.1Confident91.9Very high168 Ų16857 Ų5788%0.8830%0.3SS*.THydrogen-bonded Turntrans54.2-108.7-176.6-58.7173.8000112.3Q54 A104L52-Q54 VanDerWaalsContact C-N 3.34Å; L52-A104 WeakPolarHBondContact O-CB 3.49Å
53E89.5Confident91.9Very high159 Ų15959.1 Ų59.174%0.74331%0.305SS*.THydrogen-bonded Turntrans-90.61.6178.9-59.2-175.616100113C51 L98C51-E53 PolarHBondContact O-N 3.09Å; E53-L98 WeakPolarHBondContact O-CB 3.48Å; E53-L98 PolarHBondContact O-N 3.3Å
54Q93.4Very high91.8Very high46 Ų4657.1 Ų57.122%0.21530%0.296CS..EExtended strand (participates in β ladder)trans-119.6163.2179-55-170.6-21.900111.1C51 L52 D83 V96 T97C51-Q54 CarbonylContact C-O 3.51Å; C51-Q54 WeakPolarHBondContact CA-O 3.46Å; C51-Q54 HydrophobicContact CB-CB 4.47Å; C51-Q54 PolarHBondContact N-O 3.09Å; C51-Q54 WeakPolarHBondContact O-CA 3.33Å; C51-Q54 PolarHBondContact O-N 3.1Å; C51-Q54 VanDerWaalsContact O-O 3.12Å; L52-Q54 VanDerWaalsContact C-N 3.34Å; Q54-D83 PolarHBondContact NE2-OD2 2.82Å; Q54-V96 CarbonylContact C-O 3.48Å; Q54-V96 WeakPolarHBondContact CA-O 3.15Å; Q54-V96 WeakPolarHBondContact CB-O 3.5Å; Q54-T97 PolarHBondContact NE2-OG1 2.74Å
55I94.5Very high91.7Very high0 Ų057.1 Ų57.10%030%0.296CS..EExtended strand (participates in β ladder)trans-120.9148.4166.961.1172.8000109.9F47 V79 S95 V96 L98 A104 F107 V113F47-I55 HydrophobicContact CD2-CB 3.82Å; F47-I55 HydrophobicContact CD2-CD1 4.25Å; F47-I55 HydrophobicContact CD2-CG2 4.09Å; F47-I55 HydrophobicContact CE2-CB 3.7Å; F47-I55 HydrophobicContact CE2-CG2 3.62Å; I55-V79 HydrophobicContact CD1-CG1 4.38Å; I55-S95 CarbonylContact O-C 3.48Å; I55-S95 WeakPolarHBondContact O-CA 3.43Å; I55-V96 HydrophobicContact CD1-CB 4.39Å; I55-V96 HydrophobicContact CG1-CB 3.79Å; I55-V96 HydrophobicContact CG1-CG2 4.43Å; I55-V96 PolarHBondContact N-O 2.9Å; I55-V96 PolarHBondContact O-N 3.12Å; I55-L98 HydrophobicContact CD1-CD2 4.01Å; I55-L98 HydrophobicContact CG1-CD2 3.98Å; I55-L98 HydrophobicContact CG2-CD1 3.96Å; I55-L98 HydrophobicContact CG2-CD2 4.02Å; I55-L98 HydrophobicContact CG2-CG 4.23Å; I55-A104 HydrophobicContact CG2-CB 3.85Å; I55-F107 HydrophobicContact CD1-CD1 4.13Å; I55-F107 HydrophobicContact CD1-CE1 3.75Å; I55-F107 HydrophobicContact CD1-CE2 4.26Å; I55-F107 HydrophobicContact CD1-CZ 3.84Å; I55-F107 HydrophobicContact CG2-CD2 3.9Å; I55-F107 HydrophobicContact CG2-CE2 4.05Å; I55-F107 HydrophobicContact CG2-CG 4.4Å; I55-V113 HydrophobicContact CD1-CG1 4.25Å
56V94.8Very high91.7Very high8 Ų861.5 Ų61.55%0.04831%0.313CS..EExtended strand (participates in β ladder)trans-104.8126.6172.6176.70000109T48 H49 C51 F86 F93T48-V56 WeakPolarHBondContact CB-O 3.38Å; T48-V56 PolarHBondContact N-O 3.07Å; H49-V56 PolarHBondContact O-N 3.32Å; C51-V56 HydrophobicContact CB-CG2 4.42Å; V56-F86 HydrophobicContact CG1-CE1 4.48Å; V56-F86 HydrophobicContact CG1-CZ 3.71Å; V56-F86 HydrophobicContact CG2-CZ 4.3Å; V56-F93 HydrophobicContact CG1-CB 4.3Å; V56-F93 HydrophobicContact CG1-CD1 4.04Å
57C94.7Very high91.7Very high0 Ų065.6 Ų65.60%033%0.328CS..EExtended strand (participates in β ladder)trans-116139.5176.8-60.20000110.6V46 F93 V94 V113V46-C57 CarbonylContact O-C 3.58Å; V46-C57 VanDerWaalsContact O-CA 3.22Å; V46-C57 WeakPolarHBondContact O-CA 3.36Å; C57-F93 CarbonylContact O-C 3.57Å; C57-F93 VanDerWaalsContact O-CA 3.27Å; C57-F93 WeakPolarHBondContact O-CA 3.41Å; C57-V94 PolarHBondContact N-O 3.37Å; C57-V94 PolarHBondContact O-N 3Å; C57-V113 HydrophobicContact CB-CG2 3.92Å
58K93.7Very high91.6Very high104 Ų10469.7 Ų69.745%0.45235%0.351SS..EExtended strand (participates in β ladder)trans-86.7119.8170.1-176.5-178.7177.4-175.60109G45 V46 T48 F93G45-K58 CarbonylContact C-O 3.58Å; G45-K58 WeakPolarHBondContact CA-O 3.33Å; V46-K58 PolarHBondContact N-O 3.46Å; V46-K58 PolarHBondContact O-N 3.46Å; T48-K58 PolarHBondContact OG1-N 3.02Å; K58-F93 HydrophobicContact CB-CD1 3.97Å; K58-F93 HydrophobicContact CB-CE1 3.71Å; K58-F93 HydrophobicContact CD-CE1 4.35Å; K58-F93 HydrophobicContact CD-CZ 4.45Å; K58-F93 HydrophobicContact CG-CD1 4.36Å; K58-F93 HydrophobicContact CG-CE1 3.87Å; K58-F93 HydrophobicContact CG-CZ 4.19Å
59C92.3Very high91.6Very high6 Ų666.9 Ų66.94%0.04133%0.334CS..EExtended strand (participates in β ladder)trans-73134179.9-73.60000112L44 H92 V94L44-C59 WeakPolarHBondContact O-CA 3.27Å; C59-H92 WeakPolarHBondContact CB-NE2 3.35Å; C59-H92 WeakPolarHBondContact CB-O 3.28Å; C59-H92 PolarHBondContact N-O 3.32Å; C59-H92 VanDerWaalsContact SG-CD2 3.56Å; C59-V94 WeakPolarHBondContact SG-CG2 3.42Å
60T88.3Confident91.7Very high80 Ų8064 Ų6449%0.49132%0.324SS..  trans-98.1-16173.749.80000111.9E43 L44 V46E43-T60 PolarHBondContact OE1-OG1 3.46Å; L44-T60 PolarHBondContact O-N 2.86Å; V46-T60 HydrophobicContact CG2-CG2 4.13Å
61T86.6Confident91.7Very high31 Ų3160.5 Ų60.519%0.1930%0.301CS..SBendtrans-92.9142.5-176.7-71.50000112.2E43 K63 L120E43-T61 PolarHBondContact O-OG1 2.89Å; T61-K63 VanDerWaalsContact C-N 3.3Å; T61-K63 HydrophobicContact CG2-CB 3.96Å; T61-K63 HydrophobicContact CG2-CG 4.38Å; T61-K63 PolarHBondContact O-N 2.91Å; T61-L120 HydrophobicContact CG2-CD1 4.32Å
62E87.2Confident91.9Very high156 Ų15659.4 Ų59.473%0.72929%0.289SS*.SBendtrans-71.7-23178.2-61.1-174.1159.300113.7
63K89.3Confident92Very high100 Ų10053.7 Ų53.744%0.43526%0.257SS..SBendtrans-84145.8178-56.5176.8-176.2169.90110.2T61 L120 L121T61-K63 VanDerWaalsContact C-N 3.3Å; T61-K63 HydrophobicContact CG2-CB 3.96Å; T61-K63 HydrophobicContact CG2-CG 4.38Å; T61-K63 PolarHBondContact O-N 2.91Å; K63-L120 HydrophobicContact CB-CB 3.82Å; K63-L120 HydrophobicContact CB-CD1 4.23Å; K63-L120 HydrophobicContact CB-CD2 4.44Å; K63-L120 HydrophobicContact CB-CG 4.4Å; K63-L120 HydrophobicContact CD-CB 3.93Å; K63-L120 HydrophobicContact CD-CD1 4.1Å; K63-L121 WeakPolarHBondContact CA-O 3.34Å; K63-L121 WeakPolarHBondContact CB-O 3.35Å
64V91.4Very high92Very high10 Ų1053.6 Ų53.66%0.06126%0.257CS..EExtended strand (participates in β ladder)trans-98.5129.5-176-1790000109.2I85 L121 L123 F126V64-I85 HydrophobicContact CG1-CD1 3.61Å; V64-I85 HydrophobicContact CG1-CG2 4.04Å; V64-L121 PolarHBondContact N-O 2.87Å; V64-L121 WeakPolarHBondContact O-CA 3.35Å; V64-L121 WeakPolarHBondContact O-CB 3.18Å; V64-L121 PolarHBondContact O-N 3.03Å; V64-L123 HydrophobicContact CG2-CD1 4.36Å; V64-F126 HydrophobicContact CB-CD2 4.36Å; V64-F126 HydrophobicContact CB-CE2 3.53Å; V64-F126 HydrophobicContact CB-CZ 3.92Å; V64-F126 HydrophobicContact CG1-CE2 3.91Å; V64-F126 HydrophobicContact CG1-CZ 3.74Å; V64-F126 HydrophobicContact CG2-CD2 3.94Å; V64-F126 HydrophobicContact CG2-CE2 3.62Å; V64-F126 HydrophobicContact CG2-CZ 4.25Å
65P92.1Very high91.7Very high1 Ų155.8 Ų55.81%0.00627%0.27CS..EExtended strand (participates in β ladder)trans-64.2160.6177.827-34.1000112.7L44 V82 I85 V94 I115 K119 L120L44-P65 HydrophobicContact CD1-CB 4.09Å; L44-P65 HydrophobicContact CD1-CG 3.86Å; P65-V82 HydrophobicContact CB-CG2 4.24Å; P65-V82 HydrophobicContact CG-CG1 4.43Å; P65-V82 HydrophobicContact CG-CG2 4.44Å; P65-I85 HydrophobicContact CG-CD1 3.72Å; P65-I85 HydrophobicContact CG-CG1 4.21Å; P65-I85 WeakPolarHBondContact O-CD1 3.45Å; P65-V94 HydrophobicContact CG-CG2 3.87Å; P65-I115 HydrophobicContact CB-CD1 3.57Å; P65-K119 WeakPolarHBondContact CA-O 3.02Å; P65-L120 HydrophobicContact CB-CD2 4.17Å
66Y92.3Very high91.3Very high91 Ų9159.6 Ų59.636%0.35729%0.286SS..PPolyproline II helixtrans-72.6146.7165.2-71.9-93.3000110.2A69 K119 L121Y66-A69 WeakPolarHBondContact O-CB 3.44Å; Y66-A69 PolarHBondContact O-N 2.86Å; Y66-K119 HydrophobicContact CD2-CB 4.19Å; Y66-K119 VanDerWaalsContact CD2-O 3.23Å; Y66-K119 WeakPolarHBondContact CD2-O 3.46Å; Y66-K119 PolarHBondContact N-O 3.43Å; Y66-L121 HydrophobicContact CD1-CD1 4.08Å; Y66-L121 HydrophobicContact CD1-CD2 4.29Å; Y66-L121 HydrophobicContact CD1-CG 4.13Å; Y66-L121 HydrophobicContact CD2-CG 4.33Å; Y66-L121 HydrophobicContact CE1-CD1 4.11Å; Y66-L121 HydrophobicContact CE1-CD2 3.51Å; Y66-L121 HydrophobicContact CE1-CG 3.82Å; Y66-L121 HydrophobicContact CE2-CD2 4.11Å; Y66-L121 HydrophobicContact CE2-CG 4.02Å; Y66-L121 HydrophobicContact CG-CD1 4.49Å; Y66-L121 HydrophobicContact CG-CG 4.37Å; Y66-L121 WeakPolarHBondContact OH-CD2 3.49Å
67F92.9Very high91.1Very high121 Ų12165 Ų6553%0.53131%0.311SS..THydrogen-bonded Turntrans-56.7141.4164.8-164.5-90.8000110A69 D83F67-A69 PolarHBondContact O-N 3.23Å; F67-D83 WeakPolarHBondContact CD2-O 3.5Å; F67-D83 VanDerWaalsContact CE2-C 3.48Å; F67-D83 WeakPolarHBondContact CE2-O 3.33Å
68N92.8Very high90.9Very high99 Ų9969.3 Ų69.353%0.52933%0.331SS..THydrogen-bonded Turntrans5919.5-175.5-66.4-39.1000115.6V82N68-V82 WeakPolarHBondContact CA-O 3.45Å; N68-V82 PolarHBondContact N-O 2.83Å
69A93.3Very high90.8Very high4 Ų464.4 Ų64.43%0.03331%0.31CS..  trans-72.4139.8175.900000111.5Y66 F67 K81 V82 I115 K119Y66-A69 WeakPolarHBondContact O-CB 3.44Å; Y66-A69 PolarHBondContact O-N 2.86Å; F67-A69 PolarHBondContact O-N 3.23Å; A69-K81 CarbonylContact O-C 3.56Å; A69-K81 VanDerWaalsContact O-CA 3.28Å; A69-K81 WeakPolarHBondContact O-CA 3.22Å; A69-V82 HydrophobicContact CB-CG2 4.35Å; A69-V82 PolarHBondContact O-N 3.27Å; A69-I115 HydrophobicContact CB-CD1 3.89Å; A69-K119 HydrophobicContact CB-CB 4.11Å
70P94Very high90.9Very high30 Ų3064.2 Ų64.220%0.19531%0.309CS..EExtended strand (participates in β ladder)trans-68138.3174.929.4-34.2000110.9Y72 G80P70-Y72 HydrophobicContact CB-CE2 4.05Å; P70-Y72 HydrophobicContact CG-CE2 4.08Å; P70-Y72 WeakPolarHBondContact CG-OH 2.75Å; P70-G80 WeakPolarHBondContact CA-O 3.43Å
71V94.2Very high91.2Very high0 Ų065.7 Ų65.70%031%0.309CS..EExtended strand (participates in β ladder)trans-113.6143.8177.3-177.30000108.6L44 V79 G80 V82 V96 V113 F114L44-V71 HydrophobicContact CD2-CG2 4.28Å; V71-V79 PolarHBondContact O-N 3.05Å; V71-G80 PolarHBondContact N-O 2.82Å; V71-G80 PolarHBondContact O-N 2.89Å; V71-V82 HydrophobicContact CG2-CG2 3.47Å; V71-V82 VanDerWaalsContact CG2-CG2 3.47Å; V71-V96 HydrophobicContact CB-CG1 4.08Å; V71-V96 HydrophobicContact CG2-CG1 4.02Å; V71-V96 HydrophobicContact CG2-CG2 4.06Å; V71-V113 HydrophobicContact CG1-CB 3.64Å; V71-V113 HydrophobicContact CG1-CG1 4.1Å; V71-V113 HydrophobicContact CG1-CG2 4.41Å; V71-F114 WeakPolarHBondContact CG1-O 3.1Å
72Y94Very high91.6Very high33 Ų3364.2 Ų64.213%0.12930%0.3CS..EExtended strand (participates in β ladder)trans-125.9155.7-173.6-54.7-86.9000111.7P38 V41 P70 K76 E77 Q78 F114P38-Y72 HydrophobicContact CG-CE2 3.93Å; V41-Y72 HydrophobicContact CG1-CD2 4.41Å; P70-Y72 HydrophobicContact CB-CE2 4.05Å; P70-Y72 HydrophobicContact CG-CE2 4.08Å; P70-Y72 WeakPolarHBondContact CG-OH 2.75Å; Y72-K76 WeakPolarHBondContact CD1-O 3.03Å; Y72-E77 CarbonylContact C-O 3.51Å; Y72-E77 WeakPolarHBondContact CA-O 2.81Å; Y72-Q78 HydrophobicContact CD1-CB 4.23Å; Y72-Q78 HydrophobicContact CE1-CB 4.21Å; Y72-F114 PolarHBondContact N-O 2.82Å; Y72-F114 PolarHBondContact O-N 2.8Å
73F92Very high92Very high48 Ų4859.2 Ų59.221%0.21128%0.278CS..  trans-79172.4164.2-78.2-58.9000110.6N75 K76 E77 V79 I102 F107F73-N75 WeakPolarHBondContact CB-OD1 3.06Å; F73-N75 PolarHBondContact O-N 2.78Å; F73-K76 WeakPolarHBondContact O-CA 3.47Å; F73-K76 PolarHBondContact O-N 3.23Å; F73-E77 HydrophobicContact CD2-CB 4.42Å; F73-E77 PolarHBondContact N-O 2.7Å; F73-V79 HydrophobicContact CB-CG2 4.18Å; F73-V79 HydrophobicContact CD1-CG2 3.61Å; F73-V79 HydrophobicContact CD2-CG2 3.36Å; F73-V79 HydrophobicContact CE1-CG2 3.78Å; F73-V79 HydrophobicContact CE2-CB 4.41Å; F73-V79 HydrophobicContact CE2-CG2 3.52Å; F73-V79 HydrophobicContact CG-CG2 3.4Å; F73-V79 VanDerWaalsContact CG-CG2 3.4Å; F73-V79 HydrophobicContact CZ-CG1 4.46Å; F73-V79 HydrophobicContact CZ-CG2 3.73Å; F73-I102 HydrophobicContact CE2-CD1 4.07Å; F73-F107 HydrophobicContact CE1-CD1 4.25Å; F73-F107 AromaticContact CE1-CE1 3.35Å; F73-F107 HydrophobicContact CE1-CE1 3.35Å; F73-F107 AromaticContact CE1-CZ 3.82Å; F73-F107 HydrophobicContact CE1-CZ 3.82Å; F73-F107 AromaticContact CZ-CE1 3.59Å; F73-F107 HydrophobicContact CZ-CE1 3.59Å; F73-F107 AromaticContact CZ-CZ 3.51Å; F73-F107 HydrophobicContact CZ-CZ 3.51Å
74E88.3Confident92.2Very high158 Ų15859.8 Ų59.874%0.73828%0.282SS*.THydrogen-bonded Turntrans-58.1-34.8174.7-172.3175.2-170.100112.2K76 F114E74-K76 PolarHBondContact O-N 3.06Å; E74-K76 VanDerWaalsContact O-N 3.13Å; E74-F114 HydrophobicContact CB-CD2 4.31Å; E74-F114 HydrophobicContact CB-CE2 3.66Å; E74-F114 HydrophobicContact CB-CZ 4.17Å; E74-F114 HydrophobicContact CG-CE2 4.22Å; E74-F114 HydrophobicContact CG-CZ 4.22Å
75N87.9Confident92.3Very high92 Ų9261.9 Ų61.949%0.49229%0.292SS..THydrogen-bonded Turntrans-72.85174.870-7000113.8F73 E77F73-N75 WeakPolarHBondContact CB-OD1 3.06Å; F73-N75 PolarHBondContact O-N 2.78Å; N75-E77 WeakPolarHBondContact ND2-CG 3.23Å; N75-E77 PolarHBondContact ND2-OE2 3.24Å; N75-E77 PolarHBondContact O-N 3.41Å; N75-E77 WeakPolarHBondContact OD1-CB 3.46Å; N75-E77 PolarHBondContact OD1-N 2.87Å
76K86.3Confident92.3Very high80 Ų8065.5 Ų65.535%0.34831%0.308SS..  trans64.513.9-176.5-51-176.2175.1-161.20115P37 P38 E39 Y72 F73 E74P37-K76 HydrophobicContact CB-CB 4.21Å; P37-K76 HydrophobicContact CB-CD 4.4Å; P38-K76 PolarHBondContact O-NZ 2.71Å; E39-K76 PolarHBondContact O-NZ 3.23Å; E39-K76 VanDerWaalsContact O-NZ 3.14Å; Y72-K76 WeakPolarHBondContact CD1-O 3.03Å; F73-K76 WeakPolarHBondContact O-CA 3.47Å; F73-K76 PolarHBondContact O-N 3.23Å; E74-K76 PolarHBondContact O-N 3.06Å; E74-K76 VanDerWaalsContact O-N 3.13Å
77E89.4Confident92.2Very high120 Ų12064.2 Ų64.256%0.56132%0.323SS*.  trans-74.3142169.1-69.3179.1165.200110.3Y72 F73 N75 V79Y72-E77 CarbonylContact C-O 3.51Å; Y72-E77 WeakPolarHBondContact CA-O 2.81Å; F73-E77 HydrophobicContact CD2-CB 4.42Å; F73-E77 PolarHBondContact N-O 2.7Å; N75-E77 WeakPolarHBondContact ND2-CG 3.23Å; N75-E77 PolarHBondContact ND2-OE2 3.24Å; N75-E77 PolarHBondContact O-N 3.41Å; N75-E77 WeakPolarHBondContact OD1-CB 3.46Å; N75-E77 PolarHBondContact OD1-N 2.87Å; E77-V79 PolarHBondContact O-N 2.8Å
78Q91.1Very high91.9Very high92 Ų9260.4 Ų60.443%0.4332%0.317SS..EExtended strand (participates in β ladder)trans-73.1118.6179.8-176.5174.77.600110.2Y72 G80Y72-Q78 HydrophobicContact CD1-CB 4.23Å; Y72-Q78 HydrophobicContact CE1-CB 4.21Å; Q78-G80 PolarHBondContact NE2-O 2.91Å
79V91.8Very high91.3Very high0 Ų059.9 Ų59.90%031%0.314CS..EExtended strand (participates in β ladder)trans-76.9-42.8174.4176.10000110.7I55 V71 F73 E77 V96 L98 A99 I102 F107I55-V79 HydrophobicContact CD1-CG1 4.38Å; V71-V79 PolarHBondContact O-N 3.05Å; F73-V79 HydrophobicContact CB-CG2 4.18Å; F73-V79 HydrophobicContact CD1-CG2 3.61Å; F73-V79 HydrophobicContact CD2-CG2 3.36Å; F73-V79 HydrophobicContact CE1-CG2 3.78Å; F73-V79 HydrophobicContact CE2-CB 4.41Å; F73-V79 HydrophobicContact CE2-CG2 3.52Å; F73-V79 HydrophobicContact CG-CG2 3.4Å; F73-V79 VanDerWaalsContact CG-CG2 3.4Å; F73-V79 HydrophobicContact CZ-CG1 4.46Å; F73-V79 HydrophobicContact CZ-CG2 3.73Å; E77-V79 PolarHBondContact O-N 2.8Å; V79-V96 HydrophobicContact CG1-CG1 4.5Å; V79-L98 HydrophobicContact CG1-CD2 3.61Å; V79-A99 PolarHBondContact O-N 3.17Å; V79-I102 WeakPolarHBondContact O-CD1 3.19Å; V79-F107 HydrophobicContact CG1-CE1 4.33Å; V79-F107 HydrophobicContact CG1-CZ 3.79Å
80G94.3Very high90.8Very high2 Ų267.6 Ų67.62%0.02135%0.346CS..EExtended strand (participates in β ladder)trans168.7-157.4-165.500000112.5P70 V71 Q78 T97P70-G80 WeakPolarHBondContact CA-O 3.43Å; V71-G80 PolarHBondContact N-O 2.82Å; V71-G80 PolarHBondContact O-N 2.89Å; Q78-G80 PolarHBondContact NE2-O 2.91Å; G80-T97 CarbonylContact C-O 3.5Å; G80-T97 WeakPolarHBondContact CA-O 3.15Å
81K95Very high90.4Very high112 Ų11271.2 Ų71.249%0.48736%0.364SS..EExtended strand (participates in β ladder)trans-130.8140.6178.1-62.5174.7-172.9169.20109.9A69 D83 V96 T97A69-K81 CarbonylContact O-C 3.56Å; A69-K81 VanDerWaalsContact O-CA 3.28Å; A69-K81 WeakPolarHBondContact O-CA 3.22Å; K81-D83 PolarHBondContact O-N 3.04Å; K81-V96 CarbonylContact O-C 3.52Å; K81-V96 WeakPolarHBondContact O-CA 3.45Å; K81-T97 PolarHBondContact N-O 2.88Å; K81-T97 PolarHBondContact O-N 3.19Å
82V95.2Very high90.4Very high0 Ų071.5 Ų71.50%037%0.366CS..EExtended strand (participates in β ladder)trans-58.9120.6168.5172.70000108.4L44 P65 N68 A69 V71 I85 V94L44-V82 HydrophobicContact CD2-CG2 4.4Å; P65-V82 HydrophobicContact CB-CG2 4.24Å; P65-V82 HydrophobicContact CG-CG1 4.43Å; P65-V82 HydrophobicContact CG-CG2 4.44Å; N68-V82 WeakPolarHBondContact CA-O 3.45Å; N68-V82 PolarHBondContact N-O 2.83Å; A69-V82 HydrophobicContact CB-CG2 4.35Å; A69-V82 PolarHBondContact O-N 3.27Å; V71-V82 HydrophobicContact CG2-CG2 3.47Å; V71-V82 VanDerWaalsContact CG2-CG2 3.47Å; V82-I85 HydrophobicContact CG1-CD1 4.47Å; V82-I85 HydrophobicContact CG1-CG1 4.07Å; V82-V94 HydrophobicContact CB-CG1 4.18Å; V82-V94 HydrophobicContact CG1-CG1 3.58Å; V82-V94 HydrophobicContact CG2-CG1 3.87Å
83D94.5Very high90.4Very high51 Ų5172.9 Ų72.927%0.27337%0.373SS..EExtended strand (participates in β ladder)trans-92.2-88.2169.1-171.330.9000106.6Q54 F67 K81 S95Q54-D83 PolarHBondContact NE2-OD2 2.82Å; F67-D83 WeakPolarHBondContact CD2-O 3.5Å; F67-D83 VanDerWaalsContact CE2-C 3.48Å; F67-D83 WeakPolarHBondContact CE2-O 3.33Å; K81-D83 PolarHBondContact O-N 3.04Å; D83-S95 PolarHBondContact N-O 2.81Å
84E94Very high90.5Very high112 Ų11270.6 Ų70.652%0.52336%0.363SS..EExtended strand (participates in β ladder)trans-102.4147.9-172.5-168.1172.3-15800113.4F86 V94 S95E84-F86 HydrophobicContact CG-CD1 4.44Å; E84-V94 CarbonylContact O-C 3.57Å; E84-V94 WeakPolarHBondContact O-CA 3.45Å; E84-S95 WeakPolarHBondContact CA-OG 3.08Å; E84-S95 WeakPolarHBondContact CB-OG 3.45Å; E84-S95 PolarHBondContact N-OG 2.88Å; E84-S95 PolarHBondContact O-N 2.89Å; E84-S95 PolarHBondContact O-OG 2.85Å
85I92.9Very high90.9Very high53 Ų5363.3 Ų63.327%0.27233%0.329SS..EExtended strand (participates in β ladder)trans-117.4120.7171.7-51.1171.5000107.4V64 P65 V82 H92 F93 V94V64-I85 HydrophobicContact CG1-CD1 3.61Å; V64-I85 HydrophobicContact CG1-CG2 4.04Å; P65-I85 HydrophobicContact CG-CD1 3.72Å; P65-I85 HydrophobicContact CG-CG1 4.21Å; P65-I85 WeakPolarHBondContact O-CD1 3.45Å; V82-I85 HydrophobicContact CG1-CD1 4.47Å; V82-I85 HydrophobicContact CG1-CG1 4.07Å; I85-H92 HydrophobicContact CG2-CB 4.15Å; I85-F93 WeakPolarHBondContact CA-O 3.44Å; I85-V94 HydrophobicContact CG1-CG2 4.25Å; I85-V94 HydrophobicContact CG2-CG2 4.28Å
86F93Very high91.2Very high78 Ų7859 Ų5934%0.34231%0.306SS..EExtended strand (participates in β ladder)trans-136.5167.5-175.560.1-87000111.7V56 E84 H92 F93V56-F86 HydrophobicContact CG1-CE1 4.48Å; V56-F86 HydrophobicContact CG1-CZ 3.71Å; V56-F86 HydrophobicContact CG2-CZ 4.3Å; E84-F86 HydrophobicContact CG-CD1 4.44Å; F86-H92 CarbonylContact O-C 3.51Å; F86-H92 VanDerWaalsContact O-CA 3.3Å; F86-H92 WeakPolarHBondContact O-CA 3.47Å; F86-H92 WeakPolarHBondContact O-CB 3.44Å; F86-F93 HydrophobicContact CD1-CB 4.35Å; F86-F93 HydrophobicContact CD2-CB 3.78Å; F86-F93 HydrophobicContact CD2-CG 4.5Å; F86-F93 HydrophobicContact CE1-CB 3.97Å; F86-F93 HydrophobicContact CE2-CB 3.36Å; F86-F93 HydrophobicContact CE2-CD2 4.34Å; F86-F93 AromaticContact CE2-CG 3.96Å; F86-F93 HydrophobicContact CE2-CG 3.96Å; F86-F93 HydrophobicContact CG-CB 4.27Å; F86-F93 HydrophobicContact CZ-CB 3.47Å; F86-F93 VanDerWaalsContact CZ-CB 3.47Å; F86-F93 HydrophobicContact CZ-CG 4.36Å; F86-F93 PolarHBondContact N-O 2.97Å; F86-F93 PolarHBondContact O-N 2.87Å
87G90.5Very high91.6Very high64 Ų6457.7 Ų57.766%0.6631%0.305SS*.EExtended strand (participates in β ladder)trans96.7-158.9-178.300000114.3
88G86Confident91.8Very high40 Ų4053 Ų5341%0.41228%0.283SS..EExtended strand (participates in β ladder)trans-86.9155.9-173.900000113.1K90 N91 H92G88-K90 VanDerWaalsContact C-N 3.26Å; G88-K90 PolarHBondContact O-N 3.19Å; G88-K90 VanDerWaalsContact O-N 3.1Å; G88-N91 PolarHBondContact N-O 2.79Å; G88-N91 CarbonylContact O-C 3.19Å; G88-N91 PolarHBondContact O-N 3.39Å; G88-N91 VanDerWaalsContact O-N 3.09Å; G88-H92 WeakPolarHBondContact O-CA 3.21Å; G88-H92 WeakPolarHBondContact O-CB 3.34Å; G88-H92 PolarHBondContact O-N 2.82Å; G88-H92 VanDerWaalsContact O-N 3.09Å
89L80.2Confident91.8Very high88 Ų8850.4 Ų50.446%0.46128%0.278SS..THydrogen-bonded Turntrans-50.6-40.2-178.2-75.9174.2000114.4L123 F126 L127L89-L123 HydrophobicContact CB-CD1 4.16Å; L89-L123 HydrophobicContact CD2-CD1 4.23Å; L89-L123 VanDerWaalsContact O-CD1 3.31Å; L89-L123 WeakPolarHBondContact O-CD1 3.08Å; L89-F126 HydrophobicContact CD2-CB 3.75Å; L89-L127 HydrophobicContact CD1-CD2 4.03Å
90K81.6Confident91.6Very high166 Ų16658.7 Ų58.772%0.72232%0.322SS*.THydrogen-bonded Turntrans-93.9-19.9-179.5-64.9-172.7177.6-171.60114.3G88G88-K90 VanDerWaalsContact C-N 3.26Å; G88-K90 PolarHBondContact O-N 3.19Å; G88-K90 VanDerWaalsContact O-N 3.1Å
91N87.3Confident91.2Very high107 Ų10762.5 Ų62.557%0.57236%0.362SS*.EExtended strand (participates in β ladder)trans-135.766.8-174.4-66.2-51000107.5G88G88-N91 PolarHBondContact N-O 2.79Å; G88-N91 CarbonylContact O-C 3.19Å; G88-N91 PolarHBondContact O-N 3.39Å; G88-N91 VanDerWaalsContact O-N 3.09Å
92H92.1Very high90.8Very high6 Ų659.4 Ų59.43%0.02835%0.35CS..EExtended strand (participates in β ladder)trans-88.9154.9177.956.4-81.1000109.9C59 I85 F86 G88C59-H92 WeakPolarHBondContact CB-NE2 3.35Å; C59-H92 WeakPolarHBondContact CB-O 3.28Å; C59-H92 PolarHBondContact N-O 3.32Å; C59-H92 VanDerWaalsContact SG-CD2 3.56Å; I85-H92 HydrophobicContact CG2-CB 4.15Å; F86-H92 CarbonylContact O-C 3.51Å; F86-H92 VanDerWaalsContact O-CA 3.3Å; F86-H92 WeakPolarHBondContact O-CA 3.47Å; F86-H92 WeakPolarHBondContact O-CB 3.44Å; G88-H92 WeakPolarHBondContact O-CA 3.21Å; G88-H92 WeakPolarHBondContact O-CB 3.34Å; G88-H92 PolarHBondContact O-N 2.82Å; G88-H92 VanDerWaalsContact O-N 3.09Å
93F94.6Very high90.4Very high62 Ų6266.6 Ų66.627%0.27238%0.381SS..EExtended strand (participates in β ladder)trans-110.7152.6171.5-68-95000108.2V56 C57 K58 I85 F86V56-F93 HydrophobicContact CG1-CB 4.3Å; V56-F93 HydrophobicContact CG1-CD1 4.04Å; C57-F93 CarbonylContact O-C 3.57Å; C57-F93 VanDerWaalsContact O-CA 3.27Å; C57-F93 WeakPolarHBondContact O-CA 3.41Å; K58-F93 HydrophobicContact CB-CD1 3.97Å; K58-F93 HydrophobicContact CB-CE1 3.71Å; K58-F93 HydrophobicContact CD-CE1 4.35Å; K58-F93 HydrophobicContact CD-CZ 4.45Å; K58-F93 HydrophobicContact CG-CD1 4.36Å; K58-F93 HydrophobicContact CG-CE1 3.87Å; K58-F93 HydrophobicContact CG-CZ 4.19Å; I85-F93 WeakPolarHBondContact CA-O 3.44Å; F86-F93 HydrophobicContact CD1-CB 4.35Å; F86-F93 HydrophobicContact CD2-CB 3.78Å; F86-F93 HydrophobicContact CD2-CG 4.5Å; F86-F93 HydrophobicContact CE1-CB 3.97Å; F86-F93 HydrophobicContact CE2-CB 3.36Å; F86-F93 HydrophobicContact CE2-CD2 4.34Å; F86-F93 AromaticContact CE2-CG 3.96Å; F86-F93 HydrophobicContact CE2-CG 3.96Å; F86-F93 HydrophobicContact CG-CB 4.27Å; F86-F93 HydrophobicContact CZ-CB 3.47Å; F86-F93 VanDerWaalsContact CZ-CB 3.47Å; F86-F93 HydrophobicContact CZ-CG 4.36Å; F86-F93 PolarHBondContact N-O 2.97Å; F86-F93 PolarHBondContact O-N 2.87Å
94V95.1Very high90.1Very high0 Ų064.6 Ų64.60%037%0.372CS..EExtended strand (participates in β ladder)trans-129128-179.5176.90000108.3C57 C59 P65 V82 E84 I85 V96C57-V94 PolarHBondContact N-O 3.37Å; C57-V94 PolarHBondContact O-N 3Å; C59-V94 WeakPolarHBondContact SG-CG2 3.42Å; P65-V94 HydrophobicContact CG-CG2 3.87Å; V82-V94 HydrophobicContact CB-CG1 4.18Å; V82-V94 HydrophobicContact CG1-CG1 3.58Å; V82-V94 HydrophobicContact CG2-CG1 3.87Å; E84-V94 CarbonylContact O-C 3.57Å; E84-V94 WeakPolarHBondContact O-CA 3.45Å; I85-V94 HydrophobicContact CG1-CG2 4.25Å; I85-V94 HydrophobicContact CG2-CG2 4.28Å; V94-V96 HydrophobicContact CG1-CG2 4.11Å
95S95.1Very high89.8Confident5 Ų564 Ų644%0.03538%0.38CS..EExtended strand (participates in β ladder)trans-85.6134.6164.363.70000109.3I55 D83 E84I55-S95 CarbonylContact O-C 3.48Å; I55-S95 WeakPolarHBondContact O-CA 3.43Å; D83-S95 PolarHBondContact N-O 2.81Å; E84-S95 WeakPolarHBondContact CA-OG 3.08Å; E84-S95 WeakPolarHBondContact CB-OG 3.45Å; E84-S95 PolarHBondContact N-OG 2.88Å; E84-S95 PolarHBondContact O-N 2.89Å; E84-S95 PolarHBondContact O-OG 2.85Å
96V95.8Very high89.5Confident0 Ų065.1 Ų65.10%039%0.393CS..EExtended strand (participates in β ladder)trans-118.3117177.1-177.90000107.6Q54 I55 V71 V79 K81 V94 L98Q54-V96 CarbonylContact C-O 3.48Å; Q54-V96 WeakPolarHBondContact CA-O 3.15Å; Q54-V96 WeakPolarHBondContact CB-O 3.5Å; I55-V96 HydrophobicContact CD1-CB 4.39Å; I55-V96 HydrophobicContact CG1-CB 3.79Å; I55-V96 HydrophobicContact CG1-CG2 4.43Å; I55-V96 PolarHBondContact N-O 2.9Å; I55-V96 PolarHBondContact O-N 3.12Å; V71-V96 HydrophobicContact CB-CG1 4.08Å; V71-V96 HydrophobicContact CG2-CG1 4.02Å; V71-V96 HydrophobicContact CG2-CG2 4.06Å; V79-V96 HydrophobicContact CG1-CG1 4.5Å; K81-V96 CarbonylContact O-C 3.52Å; K81-V96 WeakPolarHBondContact O-CA 3.45Å; V94-V96 HydrophobicContact CG1-CG2 4.11Å; V96-L98 PolarHBondContact O-N 3.43Å
97T94.5Very high89.1Confident53 Ų5362.1 Ų62.133%0.32538%0.379SS..EExtended strand (participates in β ladder)trans-71118.4168.2-61.10000108.6Q54 G80 K81Q54-T97 PolarHBondContact NE2-OG1 2.74Å; G80-T97 CarbonylContact C-O 3.5Å; G80-T97 WeakPolarHBondContact CA-O 3.15Å; K81-T97 PolarHBondContact N-O 2.88Å; K81-T97 PolarHBondContact O-N 3.19Å
98L94Very high88.9Confident21 Ų2163 Ų6311%0.1137%0.372CS..EExtended strand (participates in β ladder)trans-71.9147.8-178.4-62.4177.9000111E53 I55 V79 V96 I102 A104 F107E53-L98 WeakPolarHBondContact O-CB 3.48Å; E53-L98 PolarHBondContact O-N 3.3Å; I55-L98 HydrophobicContact CD1-CD2 4.01Å; I55-L98 HydrophobicContact CG1-CD2 3.98Å; I55-L98 HydrophobicContact CG2-CD1 3.96Å; I55-L98 HydrophobicContact CG2-CD2 4.02Å; I55-L98 HydrophobicContact CG2-CG 4.23Å; V79-L98 HydrophobicContact CG1-CD2 3.61Å; V96-L98 PolarHBondContact O-N 3.43Å; L98-I102 HydrophobicContact CD1-CG2 4.27Å; L98-I102 HydrophobicContact CD2-CG2 4.09Å; L98-A104 HydrophobicContact CD1-CB 3.75Å; L98-A104 VanDerWaalsContact CD1-N 3.32Å; L98-F107 HydrophobicContact CD1-CE2 4.2Å; L98-F107 HydrophobicContact CD2-CE2 3.88Å; L98-F107 HydrophobicContact CD2-CZ 3.95Å
99A90.7Very high88.9Confident38 Ų3864.1 Ų64.131%0.31438%0.378SS..PPolyproline II helixtrans-77.1160.2169.900000111.3V79 G101 I102V79-A99 PolarHBondContact O-N 3.17Å; A99-G101 PolarHBondContact O-N 3.19Å; A99-I102 PolarHBondContact O-N 3.06Å
100D86.7Confident89.2Confident174 Ų17466.6 Ų66.693%0.9339%0.391SS*.THydrogen-bonded Turntrans-56.7129.2179.9-63-37.4000111.5
101G85.5Confident89.7Confident83 Ų8361.2 Ų61.286%0.85637%0.37SS*.THydrogen-bonded Turntrans98.1-12.9179.300000115.1A99A99-G101 PolarHBondContact O-N 3.19Å
102I86.9Confident90Very high46 Ų4660.8 Ų60.824%0.23636%0.363CS..  trans-96.6127.3175.6-60.3173.9000109.2F73 V79 L98 A99 F107F73-I102 HydrophobicContact CE2-CD1 4.07Å; V79-I102 WeakPolarHBondContact O-CD1 3.19Å; L98-I102 HydrophobicContact CD1-CG2 4.27Å; L98-I102 HydrophobicContact CD2-CG2 4.09Å; A99-I102 PolarHBondContact O-N 3.06Å; I102-F107 HydrophobicContact CG2-CE2 3.61Å; I102-F107 HydrophobicContact CG2-CZ 3.82Å
103K87.5Confident90Very high151 Ų15160.5 Ų60.566%0.65736%0.362SS*.  trans-97.8132.1-179.8-67.4-176.8179.1179.40110.5S105 S106 F107K103-S105 PolarHBondContact O-N 2.85Å; K103-S105 VanDerWaalsContact O-N 3.12Å; K103-S106 PolarHBondContact O-N 2.94Å; K103-S106 VanDerWaalsContact O-N 3.09Å; K103-S106 PolarHBondContact O-OG 3.11Å; K103-F107 WeakPolarHBondContact O-CD2 3.29Å
104A88.7Confident90Very high10 Ų1059 Ų598%0.08336%0.355CS..G310 helixtrans-58.6-28.1174.300000112.8P50 L52 I55 L98 S106P50-A104 HydrophobicContact CB-CB 3.75Å; L52-A104 WeakPolarHBondContact O-CB 3.49Å; I55-A104 HydrophobicContact CG2-CB 3.85Å; L98-A104 HydrophobicContact CD1-CB 3.75Å; L98-A104 VanDerWaalsContact CD1-N 3.32Å; A104-S106 VanDerWaalsContact C-N 3.32Å; A104-S106 PolarHBondContact O-N 3.32Å
105S86.9Confident90Very high98 Ų9859 Ų5969%0.68536%0.355SS*.G310 helixtrans-76.4-10.7179.465.90000115K103 F107K103-S105 PolarHBondContact O-N 2.85Å; K103-S105 VanDerWaalsContact O-N 3.12Å; S105-F107 VanDerWaalsContact C-N 3.31Å
106S85.9Confident89.8Confident78 Ų7859.9 Ų59.955%0.54536%0.36SS..G310 helixtrans-83.8-10.2176.560.60000113.1K103 A104K103-S106 PolarHBondContact O-N 2.94Å; K103-S106 VanDerWaalsContact O-N 3.09Å; K103-S106 PolarHBondContact O-OG 3.11Å; A104-S106 VanDerWaalsContact C-N 3.32Å; A104-S106 PolarHBondContact O-N 3.32Å
107F86.5Confident89.5Confident15 Ų1561.7 Ų61.77%0.06637%0.372CS..  trans-81.8139.3179-68.2-96.1000111.3F47 I55 F73 V79 L98 I102 K103 S105 D111F47-F107 HydrophobicContact CD1-CB 3.86Å; F47-F107 HydrophobicContact CD2-CB 3.59Å; F47-F107 HydrophobicContact CD2-CD1 4.28Å; F47-F107 HydrophobicContact CD2-CG 4.03Å; F47-F107 HydrophobicContact CE1-CB 3.77Å; F47-F107 WeakPolarHBondContact CE1-O 3.31Å; F47-F107 HydrophobicContact CE2-CB 3.51Å; F47-F107 HydrophobicContact CE2-CG 4.11Å; F47-F107 HydrophobicContact CG-CB 3.74Å; F47-F107 HydrophobicContact CG-CG 4.46Å; F47-F107 HydrophobicContact CZ-CB 3.57Å; I55-F107 HydrophobicContact CD1-CD1 4.13Å; I55-F107 HydrophobicContact CD1-CE1 3.75Å; I55-F107 HydrophobicContact CD1-CE2 4.26Å; I55-F107 HydrophobicContact CD1-CZ 3.84Å; I55-F107 HydrophobicContact CG2-CD2 3.9Å; I55-F107 HydrophobicContact CG2-CE2 4.05Å; I55-F107 HydrophobicContact CG2-CG 4.4Å; F73-F107 HydrophobicContact CE1-CD1 4.25Å; F73-F107 AromaticContact CE1-CE1 3.35Å; F73-F107 HydrophobicContact CE1-CE1 3.35Å; F73-F107 AromaticContact CE1-CZ 3.82Å; F73-F107 HydrophobicContact CE1-CZ 3.82Å; F73-F107 AromaticContact CZ-CE1 3.59Å; F73-F107 HydrophobicContact CZ-CE1 3.59Å; F73-F107 AromaticContact CZ-CZ 3.51Å; F73-F107 HydrophobicContact CZ-CZ 3.51Å; V79-F107 HydrophobicContact CG1-CE1 4.33Å; V79-F107 HydrophobicContact CG1-CZ 3.79Å; L98-F107 HydrophobicContact CD1-CE2 4.2Å; L98-F107 HydrophobicContact CD2-CE2 3.88Å; L98-F107 HydrophobicContact CD2-CZ 3.95Å; I102-F107 HydrophobicContact CG2-CE2 3.61Å; I102-F107 HydrophobicContact CG2-CZ 3.82Å; K103-F107 WeakPolarHBondContact O-CD2 3.29Å; S105-F107 VanDerWaalsContact C-N 3.31Å; F107-D111 VanDerWaalsContact CA-OD2 3.26Å; F107-D111 WeakPolarHBondContact CA-OD2 3.45Å; F107-D111 HydrophobicContact CD1-CB 4.22Å
108T86.4Confident89.2Confident81 Ų8168.5 Ų68.550%0.49739%0.393SS..  trans-108.2156.9173.569.50000110.5F47 D110 D111F47-T108 VanDerWaalsContact CD1-C 3.49Å; F47-T108 WeakPolarHBondContact CD1-O 3.3Å; T108-D110 PolarHBondContact O-N 3.44Å; T108-D111 PolarHBondContact N-OD2 2.87Å; T108-D111 WeakPolarHBondContact O-CB 3.42Å; T108-D111 PolarHBondContact O-N 2.81Å; T108-D111 PolarHBondContact OG1-OD1 2.79Å; T108-D111 PolarHBondContact OG1-OD2 3.12Å
109A84.3Confident89Confident65 Ų6571.8 Ų71.854%0.53741%0.406SS..THydrogen-bonded Turntrans-59.7-12.5-174.700000115V46V46-A109 WeakPolarHBondContact CG1-O 3.42Å
110D87.5Confident89Confident140 Ų14070.7 Ų70.775%0.74940%0.395SS*.THydrogen-bonded Turntrans-100.2-2.8178.1-65.5-44000113.1T108 K112T108-D110 PolarHBondContact O-N 3.44Å; D110-K112 PolarHBondContact O-N 2.84Å
111D91.5Very high89.1Confident52 Ų5263.5 Ų63.528%0.27836%0.356SS..  trans-70.4128.2-177.6-70.6-21.8000111.3F47 F107 T108F47-D111 HydrophobicContact CB-CB 4.23Å; F47-D111 WeakPolarHBondContact CB-O 3.29Å; F47-D111 PolarHBondContact N-O 3.46Å; F107-D111 VanDerWaalsContact CA-OD2 3.26Å; F107-D111 WeakPolarHBondContact CA-OD2 3.45Å; F107-D111 HydrophobicContact CD1-CB 4.22Å; T108-D111 PolarHBondContact N-OD2 2.87Å; T108-D111 WeakPolarHBondContact O-CB 3.42Å; T108-D111 PolarHBondContact O-N 2.81Å; T108-D111 PolarHBondContact OG1-OD1 2.79Å; T108-D111 PolarHBondContact OG1-OD2 3.12Å
112K93.3Very high89.1Confident98 Ų9862.3 Ų62.343%0.42633%0.334SS..EExtended strand (participates in β ladder)trans-96.7137.3179.6-65-178.2173.7-160.60110.8E43 V46 D110 F114E43-K112 HydrophobicContact CG-CD 4.34Å; E43-K112 IonicContact OE1-NZ 3.97Å; E43-K112 IonicContact OE2-NZ 2.79Å; E43-K112 PolarHBondContact OE2-NZ 3.27Å; V46-K112 HydrophobicContact CG2-CG 4.43Å; D110-K112 PolarHBondContact O-N 2.84Å; K112-F114 HydrophobicContact CB-CE2 3.82Å; K112-F114 HydrophobicContact CB-CZ 4.17Å
113V93.3Very high88.6Confident1 Ų161.9 Ų61.91%0.00633%0.331CS..EExtended strand (participates in β ladder)trans-104.9142.2171-69.30000110.3L44 G45 I55 C57 V71L44-V113 HydrophobicContact CB-CG2 4.23Å; L44-V113 WeakPolarHBondContact CB-O 3.48Å; L44-V113 HydrophobicContact CD2-CG2 4.34Å; L44-V113 HydrophobicContact CG-CG2 4.47Å; L44-V113 PolarHBondContact N-O 3.23Å; G45-V113 PolarHBondContact N-O 2.88Å; G45-V113 VanDerWaalsContact O-CG2 3.29Å; G45-V113 WeakPolarHBondContact O-CG2 3.42Å; G45-V113 PolarHBondContact O-N 2.65Å; I55-V113 HydrophobicContact CD1-CG1 4.25Å; C57-V113 HydrophobicContact CB-CG2 3.92Å; V71-V113 HydrophobicContact CG1-CB 3.64Å; V71-V113 HydrophobicContact CG1-CG1 4.1Å; V71-V113 HydrophobicContact CG1-CG2 4.41Å
114F94.7Very high88.3Confident29 Ų2961.5 Ų61.513%0.12733%0.332CS..EExtended strand (participates in β ladder)trans-119.2152.2-175.4-64.9-97.7000111.3V41 T42 E43 V71 Y72 E74 K112V41-F114 HydrophobicContact CB-CB 3.96Å; V41-F114 HydrophobicContact CG2-CB 4.01Å; V41-F114 HydrophobicContact CG2-CD1 4.03Å; V41-F114 HydrophobicContact CG2-CG 4.22Å; T42-F114 CarbonylContact O-C 3.34Å; T42-F114 VanDerWaalsContact O-CA 3.29Å; T42-F114 WeakPolarHBondContact O-CA 3.46Å; E43-F114 HydrophobicContact CB-CE1 4.32Å; V71-F114 WeakPolarHBondContact CG1-O 3.1Å; Y72-F114 PolarHBondContact N-O 2.82Å; Y72-F114 PolarHBondContact O-N 2.8Å; E74-F114 HydrophobicContact CB-CD2 4.31Å; E74-F114 HydrophobicContact CB-CE2 3.66Å; E74-F114 HydrophobicContact CB-CZ 4.17Å; E74-F114 HydrophobicContact CG-CE2 4.22Å; E74-F114 HydrophobicContact CG-CZ 4.22Å; K112-F114 HydrophobicContact CB-CE2 3.82Å; K112-F114 HydrophobicContact CB-CZ 4.17Å
115I94.3Very high87.7Confident0 Ų068.6 Ų68.60%036%0.357CS..EExtended strand (participates in β ladder)trans-139.8153.9179.7-165.3170.1000110.7T42 L44 P65 A69 K119 L120T42-I115 PolarHBondContact N-O 3.22Å; T42-I115 PolarHBondContact O-N 2.88Å; L44-I115 HydrophobicContact CB-CB 4.16Å; L44-I115 HydrophobicContact CB-CG2 3.85Å; L44-I115 HydrophobicContact CD1-CG2 4.12Å; L44-I115 HydrophobicContact CD2-CB 4.37Å; L44-I115 HydrophobicContact CD2-CD1 4.38Å; L44-I115 HydrophobicContact CG-CG2 4.4Å; P65-I115 HydrophobicContact CB-CD1 3.57Å; A69-I115 HydrophobicContact CB-CD1 3.89Å; I115-K119 HydrophobicContact CD1-CB 4.22Å; I115-K119 HydrophobicContact CG1-CB 4.25Å; I115-L120 HydrophobicContact CD1-CD2 4.29Å; I115-L120 HydrophobicContact CG2-CD1 4.18Å; I115-L120 HydrophobicContact CG2-CD2 3.76Å; I115-L120 HydrophobicContact CG2-CG 4.04Å
116D91.9Very high87.2Confident24 Ų2468.3 Ų68.313%0.12834%0.343CS..  trans-62125167.81763.8000110.4P38 Y118 K119P38-D116 HydrophobicContact CB-CB 4.24Å; P38-D116 HydrophobicContact CG-CB 3.91Å; D116-Y118 PolarHBondContact O-N 3.33Å; D116-Y118 WeakPolarHBondContact OD1-CB 3.21Å; D116-Y118 WeakPolarHBondContact OD1-CD2 3.32Å; D116-Y118 PolarHBondContact OD1-N 2.91Å; D116-K119 HydrophobicContact CB-CB 4.35Å; D116-K119 HydrophobicContact CB-CG 3.88Å; D116-K119 WeakPolarHBondContact O-CA 3.26Å; D116-K119 WeakPolarHBondContact O-CB 3.38Å; D116-K119 PolarHBondContact O-N 2.9Å
117P88.1Confident86.8Confident38 Ų3868.5 Ų68.525%0.24734%0.338CS..G310 helixtrans-60-24.5176.725.7-35.7000113.9H40 K119 L120H40-P117 WeakPolarHBondContact O-CD 3.4Å; P117-K119 PolarHBondContact O-N 3.49Å; P117-L120 PolarHBondContact O-N 2.82Å
118Y88.2Confident86Confident196 Ų19674.2 Ų74.277%0.76938%0.377SS*.G310 helixtrans-71.8-14.8173.5-63.3-69.6000112.7D116D116-Y118 PolarHBondContact O-N 3.33Å; D116-Y118 WeakPolarHBondContact OD1-CB 3.21Å; D116-Y118 WeakPolarHBondContact OD1-CD2 3.32Å; D116-Y118 PolarHBondContact OD1-N 2.91Å
119K90.9Very high85Confident91 Ų9174 Ų7440%0.39639%0.391SS..G310 helixtrans-9824.6174-53.8-62.6-178.6179.20112.7P65 Y66 A69 I115 D116 P117P65-K119 WeakPolarHBondContact CA-O 3.02Å; Y66-K119 HydrophobicContact CD2-CB 4.19Å; Y66-K119 VanDerWaalsContact CD2-O 3.23Å; Y66-K119 WeakPolarHBondContact CD2-O 3.46Å; Y66-K119 PolarHBondContact N-O 3.43Å; A69-K119 HydrophobicContact CB-CB 4.11Å; I115-K119 HydrophobicContact CD1-CB 4.22Å; I115-K119 HydrophobicContact CG1-CB 4.25Å; D116-K119 HydrophobicContact CB-CB 4.35Å; D116-K119 HydrophobicContact CB-CG 3.88Å; D116-K119 WeakPolarHBondContact O-CA 3.26Å; D116-K119 WeakPolarHBondContact O-CB 3.38Å; D116-K119 PolarHBondContact O-N 2.9Å; P117-K119 PolarHBondContact O-N 3.49Å
120L90.1Very high83.7Confident14 Ų1472.7 Ų72.77%0.07338%0.38CS..EExtended strand (participates in β ladder)trans-113130.8172.5-65.9176.3000111.3L44 T61 K63 P65 I115 P117L44-L120 HydrophobicContact CD1-CD2 4.3Å; T61-L120 HydrophobicContact CG2-CD1 4.32Å; K63-L120 HydrophobicContact CB-CB 3.82Å; K63-L120 HydrophobicContact CB-CD1 4.23Å; K63-L120 HydrophobicContact CB-CD2 4.44Å; K63-L120 HydrophobicContact CB-CG 4.4Å; K63-L120 HydrophobicContact CD-CB 3.93Å; K63-L120 HydrophobicContact CD-CD1 4.1Å; P65-L120 HydrophobicContact CB-CD2 4.17Å; I115-L120 HydrophobicContact CD1-CD2 4.29Å; I115-L120 HydrophobicContact CG2-CD1 4.18Å; I115-L120 HydrophobicContact CG2-CD2 3.76Å; I115-L120 HydrophobicContact CG2-CG 4.04Å; P117-L120 PolarHBondContact O-N 2.82Å
121L89.4Confident82.3Confident24 Ų2472.3 Ų72.313%0.12638%0.382CS..EExtended strand (participates in β ladder)trans-88130.9171.1-69.9167.6000110.4K63 V64 Y66 R125 F126K63-L121 WeakPolarHBondContact CA-O 3.34Å; K63-L121 WeakPolarHBondContact CB-O 3.35Å; V64-L121 PolarHBondContact N-O 2.87Å; V64-L121 WeakPolarHBondContact O-CA 3.35Å; V64-L121 WeakPolarHBondContact O-CB 3.18Å; V64-L121 PolarHBondContact O-N 3.03Å; Y66-L121 HydrophobicContact CD1-CD1 4.08Å; Y66-L121 HydrophobicContact CD1-CD2 4.29Å; Y66-L121 HydrophobicContact CD1-CG 4.13Å; Y66-L121 HydrophobicContact CD2-CG 4.33Å; Y66-L121 HydrophobicContact CE1-CD1 4.11Å; Y66-L121 HydrophobicContact CE1-CD2 3.51Å; Y66-L121 HydrophobicContact CE1-CG 3.82Å; Y66-L121 HydrophobicContact CE2-CD2 4.11Å; Y66-L121 HydrophobicContact CE2-CG 4.02Å; Y66-L121 HydrophobicContact CG-CD1 4.49Å; Y66-L121 HydrophobicContact CG-CG 4.37Å; Y66-L121 WeakPolarHBondContact OH-CD2 3.49Å; L121-R125 VanDerWaalsContact CD2-NH1 3.31Å; L121-F126 HydrophobicContact CB-CE2 3.97Å; L121-F126 HydrophobicContact CB-CZ 4.43Å; L121-F126 HydrophobicContact CD1-CE2 4.28Å; L121-F126 HydrophobicContact CD1-CZ 3.9Å
122P85.2Confident80.7Confident58 Ų5877.9 Ų77.938%0.37741%0.407SS..  trans-60.2138.3170.8-22.532.9000111.7E124 R125P122-E124 PolarHBondContact O-N 3.11Å; P122-E124 VanDerWaalsContact O-N 3.12Å; P122-R125 WeakPolarHBondContact O-CB 3.33Å; P122-R125 PolarHBondContact O-N 3.3Å
123L77.2Confident78.8Confident36 Ų3677.6 Ų77.619%0.18842%0.417CS..G310 helixtrans-54.1-33.5178.8-172.366.5000112.8V64 L89 R125 F126V64-L123 HydrophobicContact CG2-CD1 4.36Å; L89-L123 HydrophobicContact CB-CD1 4.16Å; L89-L123 HydrophobicContact CD2-CD1 4.23Å; L89-L123 VanDerWaalsContact O-CD1 3.31Å; L89-L123 WeakPolarHBondContact O-CD1 3.08Å; L123-R125 PolarHBondContact O-N 2.7Å; L123-R125 VanDerWaalsContact O-N 3.07Å; L123-F126 PolarHBondContact O-N 2.74Å
124E79.4Confident76.8Confident143 Ų14389.2 Ų89.267%0.66846%0.461SS*.G310 helixtrans-54-29.4177.8-64.1179.5179.800112.9P122 F126 L127 A130P122-E124 PolarHBondContact O-N 3.11Å; P122-E124 VanDerWaalsContact O-N 3.12Å; E124-F126 PolarHBondContact O-N 3.19Å; E124-L127 PolarHBondContact O-N 2.96Å; E124-L127 VanDerWaalsContact O-N 3.16Å; E124-A130 WeakPolarHBondContact O-CB 3.44Å
125R76.2Confident74.7Confident159 Ų15998.9 Ų98.960%0.650%0.497SS*.G310 helixtrans-64.5-23.3176.2-69.5-173.6174.8-150.25.7113.5L121 P122 L123L121-R125 VanDerWaalsContact CD2-NH1 3.31Å; P122-R125 WeakPolarHBondContact O-CB 3.33Å; P122-R125 PolarHBondContact O-N 3.3Å; L123-R125 PolarHBondContact O-N 2.7Å; L123-R125 VanDerWaalsContact O-N 3.07Å
126F76.9Confident72.5Confident93 Ų93101.9 Ų101.941%0.40853%0.527SS..G310 helixtrans-95.9-8.4178.4-59.3-86.2000112.6V64 L89 L121 L123 E124V64-F126 HydrophobicContact CB-CD2 4.36Å; V64-F126 HydrophobicContact CB-CE2 3.53Å; V64-F126 HydrophobicContact CB-CZ 3.92Å; V64-F126 HydrophobicContact CG1-CE2 3.91Å; V64-F126 HydrophobicContact CG1-CZ 3.74Å; V64-F126 HydrophobicContact CG2-CD2 3.94Å; V64-F126 HydrophobicContact CG2-CE2 3.62Å; V64-F126 HydrophobicContact CG2-CZ 4.25Å; L89-F126 HydrophobicContact CD2-CB 3.75Å; L121-F126 HydrophobicContact CB-CE2 3.97Å; L121-F126 HydrophobicContact CB-CZ 4.43Å; L121-F126 HydrophobicContact CD1-CE2 4.28Å; L121-F126 HydrophobicContact CD1-CZ 3.9Å; L123-F126 PolarHBondContact O-N 2.74Å; E124-F126 PolarHBondContact O-N 3.19Å
127L76.8Confident70.3Confident81 Ų81113.1 Ų113.142%0.42457%0.568SS.*SBendtrans-85.1138.5176.5-64.6178.3000111.1L89 E124 G129 A130L89-L127 HydrophobicContact CD1-CD2 4.03Å; E124-L127 PolarHBondContact O-N 2.96Å; E124-L127 VanDerWaalsContact O-N 3.16Å; L127-G129 PolarHBondContact O-N 3.44Å; L127-A130 PolarHBondContact O-N 3.19Å; L127-A130 VanDerWaalsContact O-N 3.16Å
128P71.2Confident68.2Low136 Ų136114.6 Ų114.688%0.88359%0.59SS**THydrogen-bonded Turntrans-66.3106.3175.727.6-32.9000109.1
129G65.9Low66.3Low77 Ų77117.6 Ų117.679%0.79460%0.6SS**THydrogen-bonded Turntrans126.2-0.6-17500000114.3L127 T131L127-G129 PolarHBondContact O-N 3.44Å; G129-T131 PolarHBondContact O-N 2.76Å
130A55.9Low63.9Low37 Ų37117.4 Ų117.431%0.30662%0.624SS.*  trans-51.5111164.400000108E124 L127 Q132E124-A130 WeakPolarHBondContact O-CB 3.44Å; L127-A130 PolarHBondContact O-N 3.19Å; L127-A130 VanDerWaalsContact O-N 3.16Å; A130-Q132 PolarHBondContact O-N 2.96Å
131T58.6Low61.7Low131 Ų131120.5 Ų120.580%0.80466%0.66SS**  trans-60.490.3165178.60000105.4G129 S133G129-T131 PolarHBondContact O-N 2.76Å; T131-S133 PolarHBondContact O-N 3.4Å
132Q56.6Low59.4Low169 Ų169122.2 Ų122.279%0.7968%0.683SS**  trans-54104.9166.3-71.9-173.9-45.700103.4A130 R134A130-Q132 PolarHBondContact O-N 2.96Å; Q132-R134 VanDerWaalsContact C-N 3.3Å; Q132-R134 PolarHBondContact O-N 3.09Å
133S54.7Low57.8Low92 Ų92125.9 Ų125.964%0.64370%0.699SS**  trans-44.1105.3175.7175.20000105.3T131 R135T131-S133 PolarHBondContact O-N 3.4Å; S133-R135 PolarHBondContact O-N 2.83Å
134R51.8Low56.3Low245 Ų245133.8 Ų133.893%0.92573%0.732SS**  trans-67.675.5-175.6-75.7-168.2-165.3172.14.6106.7Q132 G136Q132-R134 VanDerWaalsContact C-N 3.3Å; Q132-R134 PolarHBondContact O-N 3.09Å; R134-G136 VanDerWaalsContact C-N 3.26Å; R134-G136 PolarHBondContact O-N 2.94Å
135R50.4Low54.8Low233 Ų233138.4 Ų138.488%0.87974%0.744SS**  trans-9571.6175.3-153.6138.5178.7152.3-4107.2S133S133-R135 PolarHBondContact O-N 2.83Å
136G46.4Very low53.8Low63 Ų63134.7 Ų134.765%0.64975%0.747SS**SBendtrans90.793.6156.900000116.4R134R134-G136 VanDerWaalsContact C-N 3.26Å; R134-G136 PolarHBondContact O-N 2.94Å
137R46.3Very low52.5Low260 Ų260142.6 Ų142.698%0.98177%0.774SS**  169.7131.1115.7-97.8174.9164.6-135.4-0.8110.9
138G45Very low51Low69 Ų69142.7 Ų142.771%0.71180%0.795SS**  trans107.179.916700000112.8
139R46.9Very low49.6Very low258 Ų258139.4 Ų139.497%0.97479%0.785SS**  66.910995.8-82.5-175.1169.3176.1-2.9114
140G42.2Very low48.8Very low88 Ų88146.5 Ų146.591%0.90779%0.788SS**  trans94.796.313400000116.9
141G42Very low48.7Very low79 Ų79155.3 Ų155.381%0.81482%0.82SS**  trans162.287.215600000113.5
142G40.8Very low48.1Very low59 Ų59153.1 Ų153.161%0.60882%0.823SS**SBendtrans65.5143.9162.400000115.5
143D51.8Low47.5Very low135 Ų135147.8 Ų147.872%0.72281%0.814SS**  cis-156.387.1-0.1-79.6-66.1000104.4
144F46Very low47Very low202 Ų202150.7 Ų150.789%0.88682%0.822SS**  trans-116.451.9164.8-62.6-76.1000109.3A146F144-A146 PolarHBondContact O-N 3.29Å
145R48.8Very low46.9Very low241 Ų241150.9 Ų150.991%0.90982%0.823SS**  trans-77.744.8155-71.4-174.6-179.1157.30.8110.7
146A54.1Low46.8Very low81 Ų81143.1 Ų143.167%0.66982%0.815SS**SBendtrans-149.5100.3171.700000108F144F144-A146 PolarHBondContact O-N 3.29Å
147R50.3Low46.9Very low259 Ų259151.8 Ų151.898%0.97783%0.828SS**SBendtrans118.664.5161.1-153.4172.3-160.3161.72.7114.6
148G44.7Very low46.8Very low83 Ų83151.7 Ų151.786%0.85683%0.828SS**  trans-17535.2166.100000112.3
149G43Very low47.1Very low66 Ų66153.5 Ų153.568%0.6883%0.83SS**  trans-80.2152171.900000110.9
150R48.8Very low46.9Very low227 Ų227143.4 Ų143.486%0.85781%0.806SS**  trans94.677.8162.3-50.2-171.7-122.1-126.35.3116.2
151F53.4Low47Very low222 Ų222142.5 Ų142.597%0.97480%0.797SS**  -149.776.1128.3-79-67.6000108.5
152G45.3Very low47.3Very low84 Ų84150.1 Ų150.187%0.86680%0.801SS**  trans-84.8111.4156.500000107.5
153G44.4Very low47.5Very low58 Ų58152.5 Ų152.560%0.59880%0.804SS**  trans-110.3155.6164.100000109
154D44.2Very low47Very low153 Ų153153 Ų15382%0.81880%0.802SS**  trans81.283.1165.5-43.3-46.5000116.9
155R50.6Low46.9Very low249 Ų249153.9 Ų153.994%0.9480%0.799SS**  -166.899.7124.9-104.4173.5-77173.5-4.5111.8
156G47.3Very low46.4Very low70 Ų70145.7 Ų145.772%0.72279%0.79SS**  trans-75-174.2164.200000113.7
157R48.4Very low45.8Very low244 Ų244152 Ų15292%0.92180%0.803SS**  trans9986.2-177.5-58.4-175.3-168.9-82-0.1112.4
158W44.2Very low45.6Very low258 Ų258145.6 Ų145.698%0.97779%0.792SS**  62.495.773.4-157.3-38.1000112.7
159S51.8Low45.9Very low107 Ų107147.2 Ų147.275%0.74879%0.788SS**  trans-170133.1142.5-174.10000110.5
160G42.9Very low45.8Very low46 Ų46147.7 Ų147.747%0.47479%0.793SS.*  trans123.164.915700000115.5
161G43.7Very low45.5Very low69 Ų69149 Ų14971%0.71180%0.797SS**  trans-69.7173.615100000111.7
162R50Low44.9Very low240 Ų240141.6 Ų141.691%0.90678%0.784SS**  trans91.296.5168.8-56.6-156.9-63.8-163.1-0.1115.7
163T43.1Very low44.7Very low108 Ų108142.1 Ų142.166%0.66377%0.774SS**  138.7108.3103.6-66.50000112.9
164Q41.5Very low44.5Very low147 Ų147145.6 Ų145.669%0.68778%0.779SS**  trans94.5131132.3-80176.57.200123.1
165R45.3Very low44.6Very low219 Ų219150 Ų15083%0.82678%0.784SS**  trans83.882140.7-71.6167-171.3-156.52.4116.8
166G37.6Very low44Very low70 Ų70141.4 Ų141.472%0.72277%0.774SS**  58.6120106.400000118.5
167F41.3Very low43.7Very low213 Ų213144.1 Ų144.193%0.93477%0.772SS**  -163.3147.5116.8-127.3-99.2000110.2
168T46.8Very low43.5Very low124 Ų124142.5 Ų142.576%0.76177%0.767SS**  trans-99.7-171.1-161-14.50000111.3
169P50.4Low43.4Very low118 Ų118134 Ų13477%0.76676%0.76SS**  trans-118.6157.5-13431.1-7.8000114.8
170G41.7Very low43.1Very low75 Ų75140.7 Ų140.777%0.77377%0.769SS**  trans-131.6113.5160.800000107.7
171R42Very low42.8Very low254 Ų254141.9 Ų141.996%0.95878%0.781SS**  74.3117.850.1-154.6-174.6-159.3-1656.1111.8
172G40.2Very low42.8Very low67 Ų67150 Ų15069%0.69179%0.79SS**  trans121.38617500000111.2
173S41.4Very low42.3Very low95 Ų95142 Ų14266%0.66478%0.783SS**  cis72.5124.347.388.50000114.2
174D39.9Very low42.4Very low132 Ų132147.1 Ų147.171%0.70679%0.792SS**  trans83.7112.4149.1-39.1-51.1000119.4
175R45.6Very low42.3Very low244 Ų244142.8 Ų142.892%0.92179%0.787SS**  157.113898.2-79.3-173.6-159.8168.56.1113.2
176G39.9Very low42Very low70 Ų70143.4 Ų143.472%0.72279%0.789SS**  trans99.9101163.700000112.4
177D39.7Very low42.2Very low127 Ų127146 Ų14668%0.67979%0.786SS**  cis62140.346.3-156.5-147.9000115.4
178Y44Very low42.1Very low210 Ų210146.2 Ų146.282%0.82479%0.787SS**  trans88.797.7176-43.7-68.1000118.5
179G43.5Very low41.9Very low80 Ų80149.3 Ų149.383%0.82579%0.79SS**  trans170.573.8162.800000114.1
180R44.1Very low41.4Very low246 Ų246150.3 Ų150.393%0.92879%0.789SS**  trans-37.9134.9-174.3-74.9-165.3-176.4-85.73.3116.5
181G37.2Very low41.4Very low72 Ų72150.8 Ų150.874%0.74278%0.781SS**  trans-63.4133.9171.800000114.5
182R44.1Very low41.2Very low238 Ų238145.5 Ų145.590%0.89877%0.771SS**  trans-137.966.9143.6-82.5-166.7178.5-172.50.6107.4
183G39.3Very low41.1Very low74 Ų74150.2 Ų150.276%0.76378%0.775SS**  trans-10797.6170.800000109
184Y45.1Very low40.8Very low215 Ų215154.4 Ų154.484%0.84378%0.784SS**  trans-66.8141.216724-84.5000108.8
185G39.6Very low40.6Very low56 Ų56151.9 Ų151.958%0.57779%0.789SS**  trans-58.2153.3-161.100000115.8
186R39.3Very low40.1Very low232 Ų232144.1 Ų144.188%0.87579%0.785SS**  83.3116.698.8-74.2-177.3-151.9172.15.7109.3
187D40.1Very low39.6Very low124 Ų124143.8 Ų143.866%0.66378%0.781SS**  cis-158.4117.828.6-69.4-68000108.9
188F39.9Very low39.6Very low218 Ų218147.5 Ų147.596%0.95679%0.792SS**  trans-114.487.7151.1-80.9-82.9000106.9N190F188-N190 PolarHBondContact O-N 2.88Å
189K42.7Very low39.8Very low188 Ų188141.7 Ų141.782%0.81779%0.787SS**  trans-60.388.7161.8-84.7175.4173.6171.20108.1
190N40.9Very low39.9Very low140 Ų140143.4 Ų143.475%0.74978%0.778SS**  trans-101.176.9153-162.6-8000107.1F188 N192F188-N190 PolarHBondContact O-N 2.88Å; N190-N192 PolarHBondContact O-N 3.3Å
191S41.1Very low39.6Very low85 Ų85139.8 Ų139.859%0.59476%0.764SS**  trans-90.693.5169.745.60000108.3
192N36.8Very low39.7Very low142 Ų142146.9 Ų146.976%0.75977%0.768SS**  trans4.5112.9145.1-61-40.8000115.5N190N190-N192 PolarHBondContact O-N 3.3Å
193H38.1Very low39.4Very low166 Ų166139.3 Ų139.377%0.76977%0.765SS**  trans-133.9102.7141.6-7766.8000104.3
194E35.2Very low39.2Very low184 Ų184143 Ų14386%0.8676%0.762SS**  86.712681.8-169.317214400111.8
195G36.2Very low39Very low79 Ų79142.4 Ų142.481%0.81476%0.764SS**  trans103.8103.5174.900000112.6
196G34.8Very low39.1Very low81 Ų81145.7 Ų145.784%0.83577%0.769SS**  cis113.7100.629.300000109.2
197G30.1Very low39Very low62 Ų62147.2 Ų147.264%0.63977%0.774SS**  79.3118.1129.900000121.3
198F40.2Very low38.6Very low205 Ų205144.2 Ų144.290%0.89977%0.773SS**  trans79.1112.2130.5-61.7-79.1000121.2
199A47.1Very low38.5Very low88 Ų88145 Ų14573%0.72777%0.769SS**  trans-38.1141.314800000114.8
200N45.4Very low38.3Very low116 Ų116141.4 Ų141.462%0.6277%0.768SS**  trans-179.2130.3151.2-86.9-51.1000106
201R38.6Very low37.8Very low171 Ų171137.4 Ų137.465%0.64576%0.76SS**  cis-173.3161.74.9-133.2-176.1-83-170.70.5107.1
202R39.1Very low37.4Very low220 Ų220142.1 Ų142.183%0.8377%0.77SS**  trans83.791.9157.5-72.4-178176174.1-1.2119.8
203G38.4Very low37.5Very low80 Ų80145.5 Ų145.583%0.82578%0.778SS**  trans-152.453.714400000109.4F205G203-F205 PolarHBondContact O-N 3.29Å; G203-F205 VanDerWaalsContact O-N 3.14Å
204E35.3Very low37.7Very low152 Ų152146.1 Ų146.171%0.7178%0.782SS**  trans-61.2105.5161.7-85.9170.7105.700108.4
205F39.6Very low37.7Very low201 Ų201149 Ų14988%0.88278%0.784SS**  trans-133.284.8137.3-85.3-80.3000107.1G203G203-F205 PolarHBondContact O-N 3.29Å; G203-F205 VanDerWaalsContact O-N 3.14Å
206N42.6Very low37.5Very low125 Ų125148.3 Ų148.367%0.66878%0.778SS**  trans29.697.3138.5-72.3-67.6000116.5G208N206-G208 VanDerWaalsContact C-N 3.29Å; N206-G208 PolarHBondContact O-N 3.15Å
207R36Very low37.5Very low265 Ų265156.9 Ų156.9100%179%0.785SS**SBendtrans-62.4100132.1-74.2-174-160170.75.4107.1
208G33.6Very low37.6Very low61 Ų61157.9 Ų157.963%0.62980%0.796SS**  trans-179.348.4-178.800000115N206N206-G208 VanDerWaalsContact C-N 3.29Å; N206-G208 PolarHBondContact O-N 3.15Å
209R37.8Very low37.3Very low234 Ų234151.1 Ų151.188%0.88378%0.783SS**  trans-157.383.6153.1-149.6174.1-178.7-168.8-0.1108.1
210S38.1Very low36.6Very low112 Ų112156.4 Ų156.478%0.78379%0.79SS**  39.5111.693.268.80000112.3
211G29.6Very low36.4Very low57 Ų57158.4 Ų158.459%0.58880%0.801SS**  trans157.169.217500000115.6
212F33.2Very low36.3Very low183 Ų183161.9 Ų161.980%0.80381%0.814SS**  trans43.998.5143.4-70.8-96.9000118.9
213F39.6Very low36.2Very low214 Ų214154.7 Ų154.794%0.93981%0.808SS**  -143.467.7127-58.4-70.2000107.4
214E41.3Very low36Very low179 Ų179162.5 Ų162.584%0.83681%0.813SS**  trans-70.2134.2166.6-163148.9-173.500108.9G216E214-G216 PolarHBondContact O-N 3.14Å
215R35.2Very low36.1Very low243 Ų243160.3 Ų160.392%0.91782%0.821SS**SBendtrans-27.8117.2167.5-171.4-176-163.1-153.24.3114.4
216G31.6Very low36.2Very low66 Ų66154.9 Ų154.968%0.6881%0.813SS**  trans83.9103.614200000117.4E214E214-G216 PolarHBondContact O-N 3.14Å
217R35.9Very low35.7Very low261 Ų261152.5 Ų152.599%0.98582%0.818SS**  trans170.3125.7131.3-99.5178.8179-133.81.8109.8
218G32.4Very low36Very low83 Ų83150.2 Ų150.286%0.85681%0.811SS**  trans128.3116.5146.400000117.4
219G32.4Very low36.2Very low62 Ų62155 Ų15564%0.63982%0.822SS**  trans86.692.8151.300000114.8
220F32.7Very low36.2Very low199 Ų199155.1 Ų155.187%0.87382%0.823SS**  41.3102.472.1-59-75.7000113.7
221D41.2Very low35.9Very low158 Ų158153.4 Ų153.485%0.84582%0.823SS**  trans-177.398.2137.7-82.2-40.5000105.8
222R36.2Very low36.3Very low245 Ų245153.6 Ų153.693%0.92583%0.825SS**  52.550.674.4-133.8-160.8-74.4-172.9-1.4114.8
223G38.7Very low36.4Very low69 Ų69154 Ų15471%0.71183%0.83SS**  trans-11790.4150.900000108.7
224R33Very low36.4Very low243 Ų243155.4 Ų155.492%0.91783%0.828SS**  22.7127.690-89.3-166.2179.1-171.80.6115.2
225A37.9Very low36.4Very low106 Ų106155.6 Ų155.688%0.87683%0.827SS**  trans78.8122.3173.800000113.7
226A42.1Very low36.2Very low87 Ų87156 Ų15672%0.71983%0.828SS**  cis-143.2125.131.100000110.8
227G31.7Very low36.5Very low76 Ų76163.2 Ų163.278%0.78484%0.841SS**  trans-65.5129156.300000108.9
228Y41.7Very low36.3Very low217 Ų217153.6 Ų153.685%0.85182%0.823SS**  trans-112.983148.752.7-85.4000106.6R230Y228-R230 PolarHBondContact O-N 3.4Å
229D38.6Very low36.5Very low160 Ų160156.4 Ų156.486%0.85682%0.819SS**  trans-60.4114.3150.6-88.6-70.7000107.9
230R38.2Very low36.7Very low237 Ų237160.3 Ų160.389%0.89482%0.82SS**  trans-144.784.4149.4-163.7179.1-74-174.1-2.5108.7Y228 G232Y228-R230 PolarHBondContact O-N 3.4Å; R230-G232 PolarHBondContact O-N 3.04Å
231G31.7Very low37.2Very low76 Ų76160.1 Ų160.178%0.78482%0.822SS**  trans-48.3124.9157.700000109.7
232G36.8Very low37.2Very low62 Ų62160 Ų16064%0.63982%0.816SS**  trans-136.270.2175.600000108.4R230 R234R230-G232 PolarHBondContact O-N 3.04Å; G232-R234 PolarHBondContact O-N 3.07Å; G232-R234 VanDerWaalsContact O-N 3.1Å
233E35.7Very low37.5Very low192 Ų192157.5 Ų157.590%0.89782%0.818SS**  trans-54.8111163.1-70.2-174.5138.900109
234R40.1Very low38Very low242 Ų242159.9 Ų159.991%0.91382%0.818SS**  trans-117.585.7164-72.2-170-176.1177.62.6109.5G232G232-R234 PolarHBondContact O-N 3.07Å; G232-R234 VanDerWaalsContact O-N 3.1Å
235K40.1Very low38.9Very low184 Ų184154 Ų15480%0.881%0.812SS**  trans38.9105.7138.4-63.9-175.1178-179.10117.3F237K235-F237 PolarHBondContact O-N 2.83Å
236R32.5Very low40.1Very low251 Ų251158.8 Ų158.895%0.94781%0.813SS**  trans-53.2118153.6-62.9175.7-178173.90.4109.1G238R236-G238 PolarHBondContact O-N 3.13Å
237F37.5Very low40.7Very low217 Ų217164.2 Ų164.295%0.95282%0.82SS**  trans-78.992.9160.8-84.1-89.9000107.5K235K235-F237 PolarHBondContact O-N 2.83Å
238G31.3Very low42.1Very low59 Ų59167.8 Ų167.861%0.60882%0.82SS**  trans-124.4137.2166.300000108.8R236R236-G238 PolarHBondContact O-N 3.13Å
239N35.7Very low42.8Very low143 Ų143166.8 Ų166.877%0.76582%0.82SS**  trans100.3107162.8-62.82.8000118.8
240E37.2Very low43.4Very low143 Ų143168.9 Ų168.967%0.66882%0.822SS**  73.2108.4124.3-67174.613900118.8
241Q43.7Very low44.8Very low196 Ų196170.2 Ų170.292%0.91684%0.838SS**  -143.2110.8122.3-105.3167.339.700110
242Q40.3Very low45.5Very low155 Ų155174.9 Ų174.972%0.72484%0.841SS**  trans-65.8123.8167.3-60.4167.621.200108.2
243M43.5Very low45.9Very low193 Ų193180.8 Ų180.895%0.95185%0.851SS**  trans-112.5104.8157.9-85.6-167.7139.200107.8
244T48.7Very low46.5Very low118 Ų118180.2 Ų180.272%0.72485%0.849SS**  trans-80.1159.717548.80000111.2
245P50.8Low46.9Very low120 Ų120176.6 Ų176.678%0.77985%0.845SS**  trans-88.9146.8-150.532.9-34.6000114.7K247P245-K247 PolarHBondContact O-N 3.02Å
246K63.5Low47.3Very low206 Ų206176.1 Ų176.190%0.89685%0.848SS**  trans-71.8115174.2-69.6-178.3179.2178.80110.2
247K55.1Low48.3Very low202 Ų202171.1 Ų171.188%0.87884%0.841SS**PPolyproline II helixtrans-61.1129.7170.1-68.2178.2177.6-179.60110.3P245P245-K247 PolarHBondContact O-N 3.02Å
248I61.9Low49.1Very low151 Ų151167.9 Ų167.977%0.77483%0.833SS**PPolyproline II helixtrans-88.3123.8167.7-64.2165.3000106.8
249K56.3Low50.4Low195 Ų195176.2 Ų176.285%0.84885%0.85SS**PPolyproline II helixtrans-79.5130.1175.8-73.8-178.1175.5-176.40108.9
250F51Low51.7Low205 Ų205179 Ų17990%0.89986%0.858SS**PPolyproline II helixtrans-90.1120.6158.6-77.7-93.4000106.8
251E67.9Low53Low264 Ų264182.3 Ų182.3100%1.23488%0.875SS**  trans-94.70153-86.2-176.8158.300108.3

Retrieved 251 of 251 residues in 257 ms (Link to these results)