A0A096M2Y7_POEFO 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 A0A096M2Y7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 211 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
1M34.5Very low36.9Very low227 Ų227134.4 Ų134.4100%1.11885%0.849SS**  091.20-57.6157.5-169.700104.8
2S37.2Very low36.9Very low81 Ų81128.1 Ų128.157%0.56683%0.829SS**  67.7145103.853.20000110.8
3F37.3Very low36.8Very low183 Ų183133 Ų13380%0.80383%0.83SS**  cis-168.3130.342.4-45.2-98.1000104.8
4R39.7Very low37.1Very low252 Ų252134.2 Ų134.295%0.95183%0.828SS**  57.9119.980.3-164.3-177.8-91.2176.4-5.7116.4
5G33.4Very low37.8Very low82 Ų82142.1 Ų142.185%0.84584%0.836SS**  trans80151.4150.500000115.7
6G36.5Very low37.7Very low78 Ų78138.2 Ų138.280%0.80484%0.836SS**  cis167.8134.49.600000104.7
7G33.4Very low37.9Very low84 Ų84134.8 Ų134.887%0.86684%0.836SS**  100103.89700000113.6
8G37.2Very low37.9Very low73 Ų73131.5 Ų131.575%0.75383%0.832SS**  trans77.5124.7137.400000120.5
9R43.4Very low38.1Very low256 Ų256127.9 Ų127.997%0.96682%0.823SS**  -174.4111.3120.3-98.9162.5-169.5-154.12.7110.4
10G35.3Very low38Very low84 Ų84131.8 Ų131.887%0.86683%0.827SS**  trans-72.6166.7164.300000111.8
11G37.9Very low38.4Very low78 Ų78133.5 Ų133.580%0.80483%0.83SS**  trans170.184.5173.500000110.2
12G36.6Very low39.1Very low59 Ų59134.6 Ų134.661%0.60882%0.822SS**  trans-78.4-163.5174.300000113.6
13F35.4Very low39Very low192 Ų192134.7 Ų134.784%0.84284%0.836SS**  trans101.295163.8-41.1-59.8000117.6
14N42.2Very low39.1Very low150 Ų150130 Ų13080%0.80284%0.84SS**  62.3112118-82.3-30.2000121
15R46.3Very low39.1Very low252 Ų252121.5 Ų121.595%0.95183%0.83SS**  -154.4125.5119.5-98.7-164.7-97.6-175.1-6.4106
16G37.2Very low39.6Very low80 Ų80127.3 Ų127.383%0.82583%0.832SS**  cis118.2112.926.500000108.4
17G41.2Very low40.2Very low81 Ų81135.8 Ų135.884%0.83584%0.84SS**  trans135.794.7170.800000111
18G38.2Very low40.5Very low75 Ų75135.6 Ų135.677%0.77384%0.838SS**  cis87.6111.746.700000107.9
19G41.7Very low41Very low64 Ų64136.3 Ų136.366%0.6685%0.846SS**  cis125100.314.300000107.6
20F35.7Very low41Very low204 Ų204128.1 Ų128.190%0.89584%0.841SS**  trans-145.6118.1167.7-51.2-72.1000112.1
21N47Very low41.2Very low168 Ų168127.6 Ų127.690%0.89884%0.835SS**  trans-58.1133.3169.3-76.2-56.9000112.5
22R47.4Very low41.7Very low250 Ų250134.4 Ų134.494%0.94384%0.843SS**  trans-143.4120.4146.6-93.3-123.6-115.5-174.1-3108.3
23G36.8Very low42.1Very low83 Ų83135.3 Ų135.386%0.85685%0.852SS**  trans-77.2-178.6-167.200000116.2
24G39Very low42.8Very low86 Ų86138.3 Ų138.389%0.88786%0.858SS**  trans99.8114.2155.600000115.2
25G38.3Very low43.1Very low72 Ų72134.9 Ų134.974%0.74286%0.858SS**  trans135.367.8150.500000116.6R27G25-R27 PolarHBondContact O-N 3.14Å
26F44.1Very low43.1Very low204 Ų204127 Ų12790%0.89586%0.855SS**  trans-41.1130.8160-58.3-94.7000113
27R49.5Very low43.5Very low256 Ų256126.6 Ų126.697%0.96685%0.851SS**  trans171.668.7140.4-91.5160.5-166.3-168.46.4111.2G25G25-R27 PolarHBondContact O-N 3.14Å
28G40.5Very low44.4Very low80 Ų80135.3 Ų135.383%0.82586%0.859SS**  trans-106126.8146.300000106
29G47.3Very low44.8Very low89 Ų89135 Ų13592%0.91886%0.855SS**  cis93.675.736.900000108.4
30G43.1Very low45Very low84 Ų84135.2 Ų135.287%0.86686%0.858SS**  trans135.6103.8170.800000113.7
31G40.1Very low45.6Very low73 Ų73134.2 Ų134.275%0.75385%0.853SS**  trans179.181.4175.500000112.9G33G31-G33 PolarHBondContact O-N 2.89Å
32F47.8Very low45.5Very low221 Ų221132.4 Ų132.497%0.96984%0.843SS**  trans-57.3104.5169.6-69-99.7000110.5
33G45.6Very low45.9Very low77 Ų77129 Ų12979%0.79483%0.831SS**  trans-121.556.5175.700000111.7G31 G35G31-G33 PolarHBondContact O-N 2.89Å; G33-G35 PolarHBondContact O-N 2.95Å
34R50Low46.4Very low255 Ų255130.5 Ų130.596%0.96282%0.816SS**  trans-78.8106173.7-153.1-177.3-162.9-172.55.2107.8
35G47.7Very low47.2Very low79 Ų79130.5 Ų130.581%0.81479%0.792SS**  trans81.397.1159.900000116.9G33G33-G35 PolarHBondContact O-N 2.95Å
36G46.7Very low48.1Very low86 Ų86134.1 Ų134.189%0.88780%0.795SS**  trans-123.796.3142.500000105.6
37G46.5Very low48.7Very low71 Ų71132.3 Ų132.373%0.73279%0.787SS**  90.876.57200000108.1G39G37-G39 PolarHBondContact O-N 3.35Å; G37-G39 VanDerWaalsContact O-N 3.15Å
38R59.7Low49.3Very low265 Ų265122.6 Ų122.6100%177%0.766SS**SBendtrans-42.9118.4151.2-100174167.6169.3-3.5107.7
39G47.1Very low50.4Low68 Ų68123.3 Ų123.370%0.70176%0.756SS**  trans143.488170.400000113.3G37G37-G39 PolarHBondContact O-N 3.35Å; G37-G39 VanDerWaalsContact O-N 3.15Å
40G44.3Very low51.5Low69 Ų69119.6 Ų119.671%0.71172%0.716SS**  trans-150.153.2164.600000108.8N42G40-N42 PolarHBondContact O-N 2.93Å
41F48.7Very low53.1Low183 Ų183124.7 Ų124.780%0.80372%0.717SS**  trans-6628.1173.5-83.6-94.8000112.9R43F41-R43 PolarHBondContact O-N 2.9Å
42N45.8Very low55.1Low129 Ų129129.4 Ų129.469%0.6971%0.712SS**  trans-77.360.2162.7-93.23000109.5G40 Q44G40-N42 PolarHBondContact O-N 2.93Å; N42-Q44 PolarHBondContact O-N 3.01Å; N42-Q44 PolarHBondContact OD1-NE2 3.43Å; N42-Q44 PolarHBondContact OD1-OE1 2.86Å
43R54.3Low57Low179 Ų179120.4 Ų120.468%0.67568%0.675SS**  trans-74.952152.4-79.5-163.9-69.8161.8-5108.6F41 Q45F41-R43 PolarHBondContact O-N 2.9Å; R43-Q45 HydrophobicContact CB-CG 4.19Å; R43-Q45 PolarHBondContact O-N 3.48Å
44Q48.7Very low59.2Low115 Ų115118.9 Ų118.954%0.53765%0.651SS.*  trans-61.785.4141.3-75.975.515.200103.7N42 D46N42-Q44 PolarHBondContact O-N 3.01Å; N42-Q44 PolarHBondContact OD1-NE2 3.43Å; N42-Q44 PolarHBondContact OD1-OE1 2.86Å; Q44-D46 PolarHBondContact O-N 3.39Å
45Q55.7Low61.2Low86 Ų86109.2 Ų109.240%0.40263%0.625SS.*  trans-6867165.7-75.5169.9-19.300106R43 F47R43-Q45 HydrophobicContact CB-CG 4.19Å; R43-Q45 PolarHBondContact O-N 3.48Å; Q45-F47 HydrophobicContact CB-CD2 3.83Å; Q45-F47 HydrophobicContact CB-CE2 4.44Å; Q45-F47 HydrophobicContact CG-CD2 3.9Å; Q45-F47 HydrophobicContact CG-CE2 4.02Å; Q45-F47 PolarHBondContact O-N 3.41Å
46D57.9Low63.3Low147 Ų147105.4 Ų105.479%0.78659%0.586SS**  trans-75.254.5152.9-58.5-39.2000105.9Q44 G48Q44-D46 PolarHBondContact O-N 3.39Å; D46-G48 PolarHBondContact O-N 2.97Å
47F55.4Low65.5Low167 Ų167101.5 Ų101.573%0.73255%0.545SS*.  trans-65.9126.9159.5-85.1-96.4000103.8Q45Q45-F47 HydrophobicContact CB-CD2 3.83Å; Q45-F47 HydrophobicContact CB-CE2 4.44Å; Q45-F47 HydrophobicContact CG-CD2 3.9Å; Q45-F47 HydrophobicContact CG-CE2 4.02Å; Q45-F47 PolarHBondContact O-N 3.41Å
48G61.6Low67.7Low51 Ų5199.8 Ų99.853%0.52652%0.518SS..  trans-50.7177.3174.900000112.4D46D46-G48 PolarHBondContact O-N 2.97Å
49P63.9Low69.3Low96 Ų9687.7 Ų87.762%0.62347%0.473SS*.SBendtrans-43.4127.4-170.713.8-28.2000111.3K90P49-K90 HydrophobicContact CB-CB 4.45Å
50P71.3Confident71.5Confident11 Ų1187.8 Ų87.87%0.07146%0.456CS..  trans-58.9146.6-166.123.7-35.9000111.6R52 V53 Y86 K90 D130P50-R52 PolarHBondContact O-N 2.96Å; P50-R52 VanDerWaalsContact O-N 3.16Å; P50-V53 HydrophobicContact CG-CG1 3.56Å; P50-Y86 VanDerWaalsContact CD-CZ 3.5Å; P50-Y86 HydrophobicContact CG-CD2 4.22Å; P50-Y86 HydrophobicContact CG-CE2 3.82Å; P50-K90 PolarHBondContact O-NZ 3.16Å; P50-D130 HydrophobicContact CB-CB 3.94Å; P50-D130 HydrophobicContact CG-CB 4.12Å
51E75.7Confident73.7Confident191 Ų19188.8 Ų88.889%0.89344%0.442SS*.SBendtrans-55.3-37.1-179.6-170.4177.9-176.500111.2K90E51-K90 PolarHBondContact O-NZ 2.68Å
52R82.5Confident75.9Confident172 Ų17283.2 Ų83.265%0.64942%0.424SS*.  trans-138.5145.5172.963.8-179.1-175.3159.93.5111P50 P131P50-R52 PolarHBondContact O-N 2.96Å; P50-R52 VanDerWaalsContact O-N 3.16Å; R52-P131 HydrophobicContact CG-CG 3.97Å; R52-P131 WeakPolarHBondContact O-CD 3.39Å
53V88.4Confident78Confident31 Ų3179.5 Ų79.519%0.18841%0.408CS..  trans-115.4144.2172.2-63.60000109P50 Y86 K90 Y128 I129P50-V53 HydrophobicContact CG-CG1 3.56Å; V53-Y86 HydrophobicContact CG1-CD2 4.29Å; V53-Y86 HydrophobicContact CG1-CG 4.4Å; V53-K90 HydrophobicContact CG1-CG 4.24Å; V53-K90 HydrophobicContact CG2-CG 4.44Å; V53-Y128 HydrophobicContact CB-CD1 4.45Å; V53-Y128 HydrophobicContact CB-CG 4.41Å; V53-Y128 HydrophobicContact CG2-CD1 3.86Å; V53-Y128 HydrophobicContact CG2-CG 3.96Å; V53-I129 CarbonylContact C-O 3.55Å; V53-I129 WeakPolarHBondContact CA-O 3.36Å
54V91.3Very high79.5Confident46 Ų4679.9 Ų79.928%0.27942%0.417SS..EExtended strand (participates in β ladder)trans-114.2148.2176-63.20000109.7L56 Y128 I129 P131 L134V54-L56 PolarHBondContact O-N 2.9Å; V54-Y128 CarbonylContact O-C 3.49Å; V54-Y128 WeakPolarHBondContact O-CA 3.48Å; V54-Y128 WeakPolarHBondContact O-CB 3.29Å; V54-I129 HydrophobicContact CG2-CG2 3.85Å; V54-I129 WeakPolarHBondContact CG2-O 3.33Å; V54-I129 PolarHBondContact N-O 2.72Å; V54-I129 PolarHBondContact O-N 2.76Å; V54-P131 HydrophobicContact CG1-CB 4.04Å; V54-P131 HydrophobicContact CG1-CG 4.28Å; V54-P131 HydrophobicContact CG2-CB 4.15Å; V54-L134 HydrophobicContact CG2-CD1 3.8Å
55A91.8Very high81.4Confident51 Ų5180.9 Ų80.942%0.42143%0.426SS..EExtended strand (participates in β ladder)trans-62.8126.8178.800000110.1Y128A55-Y128 HydrophobicContact CB-CD1 4.39Å; A55-Y128 HydrophobicContact CB-CE1 4.3Å
56L91.6Very high83.1Confident0 Ų078.6 Ų78.60%042%0.417CS..EExtended strand (participates in β ladder)trans-100.5-49.7-180177.163.5000110.8V54 M72 T73 P79 V85 F108 F127 I129 L134V54-L56 PolarHBondContact O-N 2.9Å; L56-M72 PolarHBondContact O-N 2.96Å; L56-T73 PolarHBondContact O-OG1 3.26Å; L56-P79 HydrophobicContact CD1-CB 4.05Å; L56-P79 HydrophobicContact CD1-CG 4.01Å; L56-V85 HydrophobicContact CD2-CG2 4.38Å; L56-F108 HydrophobicContact CB-CZ 4.45Å; L56-F108 HydrophobicContact CD2-CD2 4.31Å; L56-F108 HydrophobicContact CD2-CE1 4.16Å; L56-F108 HydrophobicContact CD2-CE2 3.53Å; L56-F108 HydrophobicContact CD2-CZ 3.45Å; L56-F108 VanDerWaalsContact CD2-CZ 3.45Å; L56-F108 HydrophobicContact CG-CE1 3.87Å; L56-F108 HydrophobicContact CG-CE2 4.15Å; L56-F108 HydrophobicContact CG-CZ 3.52Å; L56-F127 PolarHBondContact N-O 2.96Å; L56-I129 HydrophobicContact CB-CB 4.22Å; L56-I129 HydrophobicContact CB-CG2 3.97Å; L56-I129 HydrophobicContact CD1-CG2 4.1Å; L56-I129 HydrophobicContact CD2-CB 4.18Å; L56-I129 HydrophobicContact CD2-CD1 4.2Å; L56-I129 HydrophobicContact CG-CG2 4.41Å; L56-L134 HydrophobicContact CD1-CD2 4.18Å
57G92.4Very high84.8Confident3 Ų371.6 Ų71.63%0.03138%0.379CS..EExtended strand (participates in β ladder)trans-176.2179-173.800000113.8K70 F127G57-K70 CarbonylContact C-O 3.52Å; G57-K70 WeakPolarHBondContact CA-O 3.34Å; G57-F127 PolarHBondContact N-O 3.07Å; G57-F127 PolarHBondContact O-N 2.99Å
58E93.5Very high86.7Confident36 Ų3664.1 Ų64.117%0.16835%0.347CS..EExtended strand (participates in β ladder)trans-114.5143.7-178.362.9-177.8174.800111.6M60 C69 K70 M72 Q125E58-M60 PolarHBondContact O-N 2.86Å; E58-C69 CarbonylContact O-C 3.53Å; E58-C69 WeakPolarHBondContact O-CA 3.24Å; E58-C69 WeakPolarHBondContact O-CB 3.39Å; E58-K70 HydrophobicContact CG-CB 4.02Å; E58-K70 PolarHBondContact N-O 3.41Å; E58-K70 PolarHBondContact O-N 2.93Å; E58-M72 HydrophobicContact CB-SD 4Å; E58-M72 VanDerWaalsContact CD-SD 3.51Å; E58-M72 HydrophobicContact CG-CE 4.44Å; E58-M72 HydrophobicContact CG-CG 4.08Å; E58-M72 HydrophobicContact CG-SD 3.83Å; E58-M72 WeakPolarHBondContact OE1-CE 3.05Å; E58-Q125 CarbonylContact C-O 3.5Å; E58-Q125 WeakPolarHBondContact CA-O 3.42Å
59F94.3Very high88.2Confident10 Ų1061.7 Ų61.74%0.04432%0.322CS..EExtended strand (participates in β ladder)trans-62.6127.3174.5-178.1-105.4000111.3P62 I67 F121 K122 M124 Q125 F127F59-P62 HydrophobicContact CZ-CB 4.31Å; F59-P62 HydrophobicContact CZ-CG 4.44Å; F59-I67 HydrophobicContact CD2-CB 4.04Å; F59-I67 HydrophobicContact CD2-CD1 4.36Å; F59-I67 HydrophobicContact CD2-CG2 4.27Å; F59-I67 HydrophobicContact CE2-CB 3.76Å; F59-I67 HydrophobicContact CE2-CG2 3.64Å; F59-F121 HydrophobicContact CD1-CB 4.43Å; F59-F121 HydrophobicContact CD2-CB 4.05Å; F59-F121 HydrophobicContact CE1-CB 4.43Å; F59-F121 HydrophobicContact CE2-CB 4.05Å; F59-F121 HydrophobicContact CG-CB 4.23Å; F59-F121 HydrophobicContact CZ-CB 4.22Å; F59-K122 WeakPolarHBondContact CD1-O 3.46Å; F59-M124 PolarHBondContact O-N 3.3Å; F59-Q125 HydrophobicContact CB-CB 4.11Å; F59-Q125 PolarHBondContact N-O 2.87Å; F59-F127 HydrophobicContact CB-CE2 3.61Å; F59-F127 HydrophobicContact CB-CZ 4.15Å; F59-F127 HydrophobicContact CD2-CE2 4.09Å; F59-F127 HydrophobicContact CD2-CZ 4.26Å; F59-F127 HydrophobicContact CG-CE2 4.33Å
60M92.8Very high89.6Confident71 Ų7160.2 Ų60.235%0.3531%0.306SS..EExtended strand (participates in β ladder)trans-100-66.7175.6-71-73.7-64.300111.2E58 V68 K70 Y107E58-M60 PolarHBondContact O-N 2.86Å; M60-V68 WeakPolarHBondContact CB-O 3.29Å; M60-V68 PolarHBondContact N-O 2.97Å; M60-K70 HydrophobicContact CG-CB 3.74Å; M60-K70 HydrophobicContact SD-CB 3.9Å; M60-K70 HydrophobicContact SD-CD 4.45Å; M60-Y107 HydrophobicContact CE-CE1 4.19Å; M60-Y107 HydrophobicContact CG-CE1 4.37Å
61H90.9Very high90.4Very high90 Ų9060.3 Ų60.342%0.41731%0.307SS..EExtended strand (participates in β ladder)trans-155.9153.7-177.759.2-83.8000111.2C63 V68H61-C63 PolarHBondContact CD2-SG 3.08Å; H61-C63 PolarHBondContact NE2-SG 2.89Å; H61-C63 VanDerWaalsContact NE2-SG 3.43Å; H61-V68 PolarHBondContact N-O 3.45Å; H61-V68 PolarHBondContact O-N 2.9Å
62P93.1Very high90.9Very high66 Ų6655.8 Ų55.843%0.42929%0.287SS..EExtended strand (participates in β ladder)trans-76.1145.2172.932.5-32.4000110.7F59 A118F59-P62 HydrophobicContact CZ-CB 4.31Å; F59-P62 HydrophobicContact CZ-CG 4.44Å; P62-A118 HydrophobicContact CB-CB 3.67Å
63C89.9Confident90.6Very high50 Ų5048.9 Ų48.934%0.33826%0.264SS..EExtended strand (participates in β ladder)trans-133.493.3175.4-74.10000109H61 D65 D66 V68H61-C63 PolarHBondContact CD2-SG 3.08Å; H61-C63 PolarHBondContact NE2-SG 2.89Å; H61-C63 VanDerWaalsContact NE2-SG 3.43Å; C63-D65 PolarHBondContact O-N 2.94Å; C63-D65 VanDerWaalsContact O-N 3.14Å; C63-D66 CarbonylContact C-O 3.52Å; C63-D66 PolarHBondContact N-O 3.47Å; C63-D66 CarbonylContact O-C 3.57Å; C63-D66 WeakPolarHBondContact O-CA 3.47Å; C63-D66 PolarHBondContact O-N 2.8Å; C63-D66 VanDerWaalsContact O-O 3.1Å; C63-V68 HydrophobicContact CB-CG2 4.21Å; C63-V68 WeakPolarHBondContact SG-CG2 3.09Å
64E87.8Confident89.6Confident188 Ų18856.3 Ų56.388%0.87930%0.297SS*.THydrogen-bonded Turntrans55.4-114.7-176.4-56.5-179.7175.900111.8
65D87.5Confident88.5Confident135 Ų13560 Ų6072%0.72231%0.311SS*.THydrogen-bonded Turntrans-89-6.9178.7-64.3-35.1000113C63C63-D65 PolarHBondContact O-N 2.94Å; C63-D65 VanDerWaalsContact O-N 3.14Å
66D91.2Very high87.8Confident39 Ų3962.2 Ų62.221%0.20932%0.316CS..EExtended strand (participates in β ladder)trans-109.2166-178.3-65-15.8000111.5C63 V110 K111 A118C63-D66 CarbonylContact C-O 3.52Å; C63-D66 PolarHBondContact N-O 3.47Å; C63-D66 CarbonylContact O-C 3.57Å; C63-D66 WeakPolarHBondContact O-CA 3.47Å; C63-D66 PolarHBondContact O-N 2.8Å; C63-D66 VanDerWaalsContact O-O 3.1Å; D66-V110 WeakPolarHBondContact CA-O 3.35Å; D66-K111 VanDerWaalsContact OD1-CA 3.29Å; D66-K111 WeakPolarHBondContact OD1-CA 3.19Å; D66-A118 WeakPolarHBondContact O-CB 3.43Å
67I94.2Very high87.6Confident0 Ų065.3 Ų65.30%033%0.329CS..EExtended strand (participates in β ladder)trans-119.7140.5171.159.8170.6000110.4F59 I93 S109 V110 L112 A118 F121 F127F59-I67 HydrophobicContact CD2-CB 4.04Å; F59-I67 HydrophobicContact CD2-CD1 4.36Å; F59-I67 HydrophobicContact CD2-CG2 4.27Å; F59-I67 HydrophobicContact CE2-CB 3.76Å; F59-I67 HydrophobicContact CE2-CG2 3.64Å; I67-I93 HydrophobicContact CD1-CD1 4.24Å; I67-S109 CarbonylContact O-C 3.46Å; I67-S109 VanDerWaalsContact O-CA 3.28Å; I67-S109 WeakPolarHBondContact O-CA 3.49Å; I67-V110 HydrophobicContact CD1-CB 4.13Å; I67-V110 HydrophobicContact CD1-CG2 4.47Å; I67-V110 HydrophobicContact CG1-CB 3.66Å; I67-V110 HydrophobicContact CG1-CG2 4.25Å; I67-V110 PolarHBondContact N-O 3.46Å; I67-V110 VanDerWaalsContact N-O 3.08Å; I67-V110 PolarHBondContact O-N 2.85Å; I67-L112 HydrophobicContact CD1-CD2 4.05Å; I67-L112 HydrophobicContact CG1-CD2 4.17Å; I67-L112 HydrophobicContact CG2-CD1 3.85Å; I67-L112 HydrophobicContact CG2-CD2 4.39Å; I67-L112 HydrophobicContact CG2-CG 4.27Å; I67-A118 HydrophobicContact CG2-CB 3.67Å; I67-F121 HydrophobicContact CG2-CD2 4.05Å; I67-F121 HydrophobicContact CG2-CE2 4.41Å; I67-F127 HydrophobicContact CD1-CD2 4.45Å; I67-F127 HydrophobicContact CD1-CE1 4.04Å; I67-F127 HydrophobicContact CD1-CE2 3.63Å; I67-F127 HydrophobicContact CD1-CZ 3.39Å
68V94.1Very high87.5Confident10 Ų1065.5 Ų65.56%0.06133%0.33CS..EExtended strand (participates in β ladder)trans-98.4130.6172.2175.90000109.1M60 H61 C63 F100 Y107M60-V68 WeakPolarHBondContact CB-O 3.29Å; M60-V68 PolarHBondContact N-O 2.97Å; H61-V68 PolarHBondContact N-O 3.45Å; H61-V68 PolarHBondContact O-N 2.9Å; C63-V68 HydrophobicContact CB-CG2 4.21Å; C63-V68 WeakPolarHBondContact SG-CG2 3.09Å; V68-F100 HydrophobicContact CG1-CZ 3.87Å; V68-F100 HydrophobicContact CG2-CZ 4.28Å; V68-Y107 HydrophobicContact CG1-CD1 4.41Å
69C93.8Very high87.4Confident0 Ų063.8 Ų63.80%032%0.322CS..EExtended strand (participates in β ladder)trans-124.5143-178.6-61.70000110.3E58 Y107 F108 F127E58-C69 CarbonylContact O-C 3.53Å; E58-C69 WeakPolarHBondContact O-CA 3.24Å; E58-C69 WeakPolarHBondContact O-CB 3.39Å; C69-Y107 VanDerWaalsContact O-CA 3.29Å; C69-Y107 WeakPolarHBondContact O-CA 3.13Å; C69-F108 HydrophobicContact CB-CD1 4.15Å; C69-F108 HydrophobicContact CB-CD2 4.01Å; C69-F108 HydrophobicContact CB-CE1 3.61Å; C69-F108 HydrophobicContact CB-CE2 3.47Å; C69-F108 VanDerWaalsContact CB-CE2 3.47Å; C69-F108 HydrophobicContact CB-CG 4.33Å; C69-F108 HydrophobicContact CB-CZ 3.24Å; C69-F108 PolarHBondContact N-O 3.22Å; C69-F108 PolarHBondContact O-N 2.77Å; C69-F127 HydrophobicContact CB-CD2 4.47Å; C69-F127 WeakPolarHBondContact SG-CD2 3.42Å; C69-F127 WeakPolarHBondContact SG-CE2 3.43Å
70K92.8Very high87.3Confident64 Ų6468.4 Ų68.428%0.27834%0.34SS..EExtended strand (participates in β ladder)trans-89.6129.1171-174.8-178.9178.3-1720109G57 E58 M60 M72 Y107G57-K70 CarbonylContact C-O 3.52Å; G57-K70 WeakPolarHBondContact CA-O 3.34Å; E58-K70 HydrophobicContact CG-CB 4.02Å; E58-K70 PolarHBondContact N-O 3.41Å; E58-K70 PolarHBondContact O-N 2.93Å; M60-K70 HydrophobicContact CG-CB 3.74Å; M60-K70 HydrophobicContact SD-CB 3.9Å; M60-K70 HydrophobicContact SD-CD 4.45Å; K70-M72 PolarHBondContact O-N 3.23Å; K70-Y107 HydrophobicContact CB-CD1 4.03Å; K70-Y107 HydrophobicContact CB-CE1 3.9Å; K70-Y107 HydrophobicContact CD-CE1 4.35Å; K70-Y107 HydrophobicContact CG-CD1 4.29Å; K70-Y107 HydrophobicContact CG-CE1 3.9Å
71C89.7Confident87.2Confident14 Ų1470.5 Ų70.510%0.09535%0.347CS..EExtended strand (participates in β ladder)trans-67131.9175.4-172.30000110.4T73 F106 F108C71-T73 PolarHBondContact SG-OG1 3.14Å; C71-F106 HydrophobicContact CB-CD1 4.44Å; C71-F106 HydrophobicContact CB-CD2 3.81Å; C71-F106 HydrophobicContact CB-CE1 4.22Å; C71-F106 HydrophobicContact CB-CE2 3.57Å; C71-F106 HydrophobicContact CB-CG 4.24Å; C71-F106 HydrophobicContact CB-CZ 3.8Å; C71-F106 WeakPolarHBondContact CB-O 3.42Å; C71-F106 PolarHBondContact N-O 3.37Å; C71-F106 VanDerWaalsContact N-O 3.08Å; C71-F106 WeakPolarHBondContact SG-CZ 3.47Å; C71-F108 HydrophobicContact CB-CD1 4.42Å; C71-F108 HydrophobicContact CB-CE1 4.4Å
72M86.3Confident87.3Confident96 Ų9670.5 Ų70.547%0.47335%0.35SS..  trans-120.816.8173.5-62.8-164.4115.400111.8L56 E58 K70 E74L56-M72 PolarHBondContact O-N 2.96Å; E58-M72 HydrophobicContact CB-SD 4Å; E58-M72 VanDerWaalsContact CD-SD 3.51Å; E58-M72 HydrophobicContact CG-CE 4.44Å; E58-M72 HydrophobicContact CG-CG 4.08Å; E58-M72 HydrophobicContact CG-SD 3.83Å; E58-M72 WeakPolarHBondContact OE1-CE 3.05Å; K70-M72 PolarHBondContact O-N 3.23Å; M72-E74 PolarHBondContact O-N 3.21Å
73T74.8Confident87.3Confident26 Ų2667.5 Ų67.516%0.1633%0.331CS..  trans-71119.1-173-460000109.9L56 C71 E75 K77L56-T73 PolarHBondContact O-OG1 3.26Å; C71-T73 PolarHBondContact SG-OG1 3.14Å; T73-E75 PolarHBondContact O-N 3.16Å; T73-K77 HydrophobicContact CG2-CB 4.42Å
74E67.8Low87.4Confident188 Ų18866.3 Ų66.388%0.87932%0.323SS*.THydrogen-bonded Turntrans-69.1-20.6-175.9-62.8179.2-178.200113.5M72 N76M72-E74 PolarHBondContact O-N 3.21Å; E74-N76 PolarHBondContact O-N 2.86Å
75E68.2Low87.7Confident123 Ų12357.4 Ų57.458%0.57528%0.281SS*.THydrogen-bonded Turntrans-95.417.1-164.3-60.9-175.216900115.2T73 K77T73-E75 PolarHBondContact O-N 3.16Å; E75-K77 HydrophobicContact CB-CD 4Å; E75-K77 HydrophobicContact CB-CG 4.14Å; E75-K77 PolarHBondContact O-N 2.92Å; E75-K77 WeakPolarHBondContact OE2-CE 3.11Å; E75-K77 IonicContact OE2-NZ 2.61Å; E75-K77 PolarHBondContact OE2-NZ 2.82Å
76N77.9Confident88Confident98 Ų9851.8 Ų51.852%0.52425%0.249SC..SBendtrans47.949.8-173.3-65.4-62000111.7E74 L137E74-N76 PolarHBondContact O-N 2.86Å; N76-L137 HydrophobicContact CB-CB 4.14Å; N76-L137 HydrophobicContact CB-CD2 4.25Å; N76-L137 WeakPolarHBondContact O-CB 3.34Å; N76-L137 PolarHBondContact O-N 3.16Å
77K87Confident88Confident64 Ų6451.1 Ų51.128%0.27825%0.246SC..EExtended strand (participates in β ladder)trans-117144.4178.3-71.5176.3-175.8173.90110.3T73 E75 L134 L135T73-K77 HydrophobicContact CG2-CB 4.42Å; E75-K77 HydrophobicContact CB-CD 4Å; E75-K77 HydrophobicContact CB-CG 4.14Å; E75-K77 PolarHBondContact O-N 2.92Å; E75-K77 WeakPolarHBondContact OE2-CE 3.11Å; E75-K77 IonicContact OE2-NZ 2.61Å; E75-K77 PolarHBondContact OE2-NZ 2.82Å; K77-L134 HydrophobicContact CB-CB 4.02Å; K77-L134 HydrophobicContact CB-CD1 4.29Å; K77-L134 HydrophobicContact CB-CD2 4.41Å; K77-L134 HydrophobicContact CB-CG 4.49Å; K77-L134 HydrophobicContact CD-CB 3.94Å; K77-L134 HydrophobicContact CD-CD1 4.03Å; K77-L134 HydrophobicContact CG-CB 4.44Å; K77-L135 CarbonylContact C-O 3.19Å; K77-L135 WeakPolarHBondContact CA-O 3.2Å
78V90.1Very high87.8Confident8 Ų857.7 Ų57.75%0.04828%0.277CS..EExtended strand (participates in β ladder)trans-112.8130.4-179.5-177.10000108I99 F106 L135 L137 F140V78-I99 HydrophobicContact CG1-CD1 3.67Å; V78-I99 HydrophobicContact CG1-CG2 4.34Å; V78-F106 HydrophobicContact CB-CZ 4.44Å; V78-F106 HydrophobicContact CG1-CZ 4.47Å; V78-F106 HydrophobicContact CG2-CE1 4.15Å; V78-F106 HydrophobicContact CG2-CZ 4.23Å; V78-L135 PolarHBondContact N-O 2.98Å; V78-L135 WeakPolarHBondContact O-CB 3.12Å; V78-L135 PolarHBondContact O-N 2.92Å; V78-L137 HydrophobicContact CG2-CD1 3.55Å; V78-F140 HydrophobicContact CB-CD2 4.27Å; V78-F140 HydrophobicContact CB-CE2 3.59Å; V78-F140 HydrophobicContact CB-CZ 4.11Å; V78-F140 HydrophobicContact CG1-CE2 3.89Å; V78-F140 HydrophobicContact CG1-CZ 3.9Å; V78-F140 HydrophobicContact CG2-CD2 3.88Å; V78-F140 HydrophobicContact CG2-CE2 3.73Å
79P91.8Very high87.5Confident0 Ų062.1 Ų62.10%030%0.3CS..EExtended strand (participates in β ladder)trans-63.4152.8177.827-33.8000112L56 V96 I99 I129 L134L56-P79 HydrophobicContact CD1-CB 4.05Å; L56-P79 HydrophobicContact CD1-CG 4.01Å; P79-V96 HydrophobicContact CB-CG2 4.22Å; P79-V96 HydrophobicContact CG-CG1 4.4Å; P79-V96 HydrophobicContact CG-CG2 4.49Å; P79-I99 HydrophobicContact CG-CD1 3.8Å; P79-I99 HydrophobicContact CG-CG1 4.45Å; P79-I99 WeakPolarHBondContact O-CD1 3.28Å; P79-I129 HydrophobicContact CB-CD1 3.68Å; P79-L134 HydrophobicContact CB-CD2 4.22Å
80Y91.5Very high87.2Confident107 Ų10766 Ų6642%0.4232%0.317SS..PPolyproline II helixtrans-66.4143.7167.6-82.2-112.8000109.8A83 K133 L135Y80-A83 WeakPolarHBondContact O-CB 3.29Å; Y80-A83 PolarHBondContact O-N 3.11Å; Y80-A83 VanDerWaalsContact O-N 3.16Å; Y80-K133 HydrophobicContact CD2-CB 4.49Å; Y80-K133 VanDerWaalsContact CD2-O 3.3Å; Y80-K133 WeakPolarHBondContact CD2-O 3.42Å; Y80-K133 PolarHBondContact N-O 3.48Å; Y80-L135 HydrophobicContact CD1-CD1 4.4Å; Y80-L135 HydrophobicContact CD2-CD1 4.11Å; Y80-L135 HydrophobicContact CD2-CD2 4.12Å; Y80-L135 HydrophobicContact CD2-CG 3.62Å; Y80-L135 HydrophobicContact CE1-CD1 4.46Å; Y80-L135 HydrophobicContact CE1-CD2 4.02Å; Y80-L135 HydrophobicContact CE1-CG 4.36Å; Y80-L135 HydrophobicContact CE2-CD1 4.24Å; Y80-L135 HydrophobicContact CE2-CD2 3.41Å; Y80-L135 VanDerWaalsContact CE2-CD2 3.41Å; Y80-L135 HydrophobicContact CE2-CG 3.42Å; Y80-L135 VanDerWaalsContact CE2-CG 3.42Å; Y80-L135 HydrophobicContact CG-CD1 4.23Å; Y80-L135 HydrophobicContact CG-CG 4.24Å; Y80-L135 WeakPolarHBondContact OH-CD2 3.37Å
81F91.9Very high87.1Confident115 Ų11567 Ų6750%0.50432%0.322SS..THydrogen-bonded Turntrans-58.7141.7164.9-69.4-73.9000110.4A83 D97 I99F81-A83 PolarHBondContact O-N 3.27Å; F81-D97 VanDerWaalsContact CD1-O 3.29Å; F81-D97 WeakPolarHBondContact CD1-O 3.4Å; F81-I99 HydrophobicContact CD1-CD1 4.45Å; F81-I99 HydrophobicContact CD1-CG1 4.5Å; F81-I99 HydrophobicContact CE1-CB 4.28Å; F81-I99 HydrophobicContact CE1-CD1 4.11Å; F81-I99 HydrophobicContact CE1-CG1 3.97Å; F81-I99 HydrophobicContact CZ-CB 4.42Å; F81-I99 HydrophobicContact CZ-CD1 4.2Å; F81-I99 HydrophobicContact CZ-CG1 4.38Å
82N92.4Very high87.2Confident89 Ų8971.2 Ų71.248%0.47634%0.341SS..THydrogen-bonded Turntrans58.219-173.7-63.7-80.8000114.7K95 V96N82-K95 HydrophobicContact CB-CD 4.45Å; N82-K95 PolarHBondContact OD1-NZ 3.32Å; N82-V96 WeakPolarHBondContact CA-O 3.29Å; N82-V96 PolarHBondContact N-O 2.91Å
83A92.6Very high87.5Confident3 Ų366.6 Ų66.63%0.02532%0.318CS..  trans-69.3137.6173.500000110.7Y80 F81 K95 V96 I129 K133Y80-A83 WeakPolarHBondContact O-CB 3.29Å; Y80-A83 PolarHBondContact O-N 3.11Å; Y80-A83 VanDerWaalsContact O-N 3.16Å; F81-A83 PolarHBondContact O-N 3.27Å; A83-K95 CarbonylContact O-C 3.48Å; A83-K95 WeakPolarHBondContact O-CA 3.44Å; A83-V96 HydrophobicContact CB-CG2 4.41Å; A83-V96 PolarHBondContact O-N 3.09Å; A83-I129 HydrophobicContact CB-CD1 3.78Å; A83-K133 HydrophobicContact CB-CB 3.96Å
84P93.2Very high88.4Confident26 Ų2665.5 Ų65.517%0.16931%0.312CS..EExtended strand (participates in β ladder)trans-65.7137175.427.9-34000110.6Y86 Q92 G94P84-Y86 HydrophobicContact CB-CE1 4.47Å; P84-Y86 HydrophobicContact CB-CE2 3.93Å; P84-Y86 WeakPolarHBondContact CB-OH 3.36Å; P84-Y86 HydrophobicContact CG-CE2 3.9Å; P84-Y86 WeakPolarHBondContact CG-OH 3.43Å; P84-Y86 WeakPolarHBondContact O-CE2 3.18Å; P84-Q92 HydrophobicContact CB-CG 4.25Å; P84-G94 WeakPolarHBondContact CA-O 3.18Å
85V93.8Very high89.7Confident0 Ų060.4 Ų60.40%029%0.287CS..EExtended strand (participates in β ladder)trans-109.5139.3177.2-177.80000108.7L56 Q92 I93 G94 V96 V110 F127L56-V85 HydrophobicContact CD2-CG2 4.38Å; V85-Q92 WeakPolarHBondContact O-CA 3.21Å; V85-I93 HydrophobicContact CB-CG1 4.19Å; V85-I93 HydrophobicContact CG1-CD1 3.97Å; V85-I93 HydrophobicContact CG1-CG1 4.12Å; V85-I93 WeakPolarHBondContact O-CG1 3.19Å; V85-I93 PolarHBondContact O-N 3.23Å; V85-G94 PolarHBondContact N-O 2.86Å; V85-V96 HydrophobicContact CG2-CG2 3.54Å; V85-V110 HydrophobicContact CB-CG1 4.02Å; V85-V110 HydrophobicContact CG1-CG2 4.45Å; V85-V110 HydrophobicContact CG2-CG1 3.94Å; V85-V110 HydrophobicContact CG2-CG2 3.95Å; V85-F127 HydrophobicContact CG1-CB 3.81Å; V85-F127 HydrophobicContact CG1-CD1 4.41Å; V85-F127 HydrophobicContact CG1-CG 4.3Å
86Y92.9Very high90.9Very high17 Ų1754.6 Ų54.67%0.06726%0.259CS..EExtended strand (participates in β ladder)trans-123.8157.8-173.4-53.9-86.9000111.9P50 V53 P84 K90 E91 Q92 Y128P50-Y86 VanDerWaalsContact CD-CZ 3.5Å; P50-Y86 HydrophobicContact CG-CD2 4.22Å; P50-Y86 HydrophobicContact CG-CE2 3.82Å; V53-Y86 HydrophobicContact CG1-CD2 4.29Å; V53-Y86 HydrophobicContact CG1-CG 4.4Å; P84-Y86 HydrophobicContact CB-CE1 4.47Å; P84-Y86 HydrophobicContact CB-CE2 3.93Å; P84-Y86 WeakPolarHBondContact CB-OH 3.36Å; P84-Y86 HydrophobicContact CG-CE2 3.9Å; P84-Y86 WeakPolarHBondContact CG-OH 3.43Å; P84-Y86 WeakPolarHBondContact O-CE2 3.18Å; Y86-K90 WeakPolarHBondContact CD1-O 3.48Å; Y86-E91 CarbonylContact C-O 3.59Å; Y86-E91 WeakPolarHBondContact CA-O 3.15Å; Y86-Q92 HydrophobicContact CD1-CB 3.88Å; Y86-Q92 HydrophobicContact CD1-CG 4.47Å; Y86-Q92 HydrophobicContact CE1-CB 3.79Å; Y86-Q92 HydrophobicContact CE1-CG 4.21Å; Y86-Y128 PolarHBondContact N-O 2.74Å; Y86-Y128 PolarHBondContact O-N 3.08Å
87L91.9Very high91.8Very high25 Ų2553.2 Ų53.213%0.13125%0.252CS..  trans-85.8175.1163.2-72170.4000110.7N89 K90 E91 I93 F121 Q125 F127L87-N89 WeakPolarHBondContact CB-OD1 3.44Å; L87-N89 PolarHBondContact O-N 2.81Å; L87-K90 WeakPolarHBondContact O-CA 3.39Å; L87-K90 PolarHBondContact O-N 2.91Å; L87-E91 PolarHBondContact N-O 3.47Å; L87-I93 HydrophobicContact CD1-CG2 3.63Å; L87-I93 HydrophobicContact CD2-CG2 4.33Å; L87-I93 HydrophobicContact CG-CG2 3.54Å; L87-F121 HydrophobicContact CD2-CE1 4.44Å; L87-Q125 HydrophobicContact CD2-CG 4.46Å; L87-F127 HydrophobicContact CD2-CD1 4.03Å; L87-F127 HydrophobicContact CD2-CE1 3.91Å
88E88.6Confident92.1Very high139 Ų13955.6 Ų55.665%0.6526%0.264SS*.THydrogen-bonded Turntrans-59.7-33.5178.1-172.7172.7-162.400112.5K90 Y128E88-K90 PolarHBondContact O-N 3Å; E88-K90 VanDerWaalsContact O-N 3.14Å; E88-Y128 HydrophobicContact CB-CD2 4.34Å; E88-Y128 HydrophobicContact CB-CE2 3.67Å; E88-Y128 HydrophobicContact CG-CE2 4.3Å
89N88.7Confident92.2Very high103 Ų10357 Ų5755%0.55127%0.271SS*.THydrogen-bonded Turntrans-72.44.6173.668.7-11.6000113.6L87 E91L87-N89 WeakPolarHBondContact CB-OD1 3.44Å; L87-N89 PolarHBondContact O-N 2.81Å; N89-E91 PolarHBondContact ND2-OE2 2.91Å; N89-E91 PolarHBondContact O-N 3.31Å; N89-E91 WeakPolarHBondContact OD1-CB 3.49Å; N89-E91 PolarHBondContact OD1-N 2.96Å
90K88.1Confident92.3Very high82 Ų8260.7 Ų60.736%0.35729%0.287SS..  trans64.216.8-175-50.4178.9175.9-169.20114.6P49 P50 E51 V53 Y86 L87 E88P49-K90 HydrophobicContact CB-CB 4.45Å; P50-K90 PolarHBondContact O-NZ 3.16Å; E51-K90 PolarHBondContact O-NZ 2.68Å; V53-K90 HydrophobicContact CG1-CG 4.24Å; V53-K90 HydrophobicContact CG2-CG 4.44Å; Y86-K90 WeakPolarHBondContact CD1-O 3.48Å; L87-K90 WeakPolarHBondContact O-CA 3.39Å; L87-K90 PolarHBondContact O-N 2.91Å; E88-K90 PolarHBondContact O-N 3Å; E88-K90 VanDerWaalsContact O-N 3.14Å
91E90.2Very high92.3Very high84 Ų8458.3 Ų58.339%0.39330%0.296SS..  trans-74.9129172.6-173.3179.6172.400109.9Y86 L87 N89 I93 M116Y86-E91 CarbonylContact C-O 3.59Å; Y86-E91 WeakPolarHBondContact CA-O 3.15Å; L87-E91 PolarHBondContact N-O 3.47Å; N89-E91 PolarHBondContact ND2-OE2 2.91Å; N89-E91 PolarHBondContact O-N 3.31Å; N89-E91 WeakPolarHBondContact OD1-CB 3.49Å; N89-E91 PolarHBondContact OD1-N 2.96Å; E91-I93 PolarHBondContact O-N 2.87Å; E91-M116 WeakPolarHBondContact OE1-CE 3.29Å
92Q91.6Very high92.1Very high102 Ų10259.6 Ų59.648%0.47730%0.303SS..EExtended strand (participates in β ladder)trans-76.5123.7177.3-175.4-179.2-11.100109.9P84 V85 Y86P84-Q92 HydrophobicContact CB-CG 4.25Å; V85-Q92 WeakPolarHBondContact O-CA 3.21Å; Y86-Q92 HydrophobicContact CD1-CB 3.88Å; Y86-Q92 HydrophobicContact CD1-CG 4.47Å; Y86-Q92 HydrophobicContact CE1-CB 3.79Å; Y86-Q92 HydrophobicContact CE1-CG 4.21Å
93I92.6Very high91.5Very high0 Ų059.3 Ų59.30%030%0.301CS..EExtended strand (participates in β ladder)trans-100-21.6179.558.6167.5000113.4I67 V85 L87 E91 L112 S113 M116 F121 F127I67-I93 HydrophobicContact CD1-CD1 4.24Å; V85-I93 HydrophobicContact CB-CG1 4.19Å; V85-I93 HydrophobicContact CG1-CD1 3.97Å; V85-I93 HydrophobicContact CG1-CG1 4.12Å; V85-I93 WeakPolarHBondContact O-CG1 3.19Å; V85-I93 PolarHBondContact O-N 3.23Å; L87-I93 HydrophobicContact CD1-CG2 3.63Å; L87-I93 HydrophobicContact CD2-CG2 4.33Å; L87-I93 HydrophobicContact CG-CG2 3.54Å; E91-I93 PolarHBondContact O-N 2.87Å; I93-L112 HydrophobicContact CB-CD2 4.48Å; I93-L112 HydrophobicContact CD1-CD2 4.45Å; I93-S113 PolarHBondContact O-N 3.14Å; I93-S113 PolarHBondContact O-OG 2.85Å; I93-M116 HydrophobicContact CG2-CE 4.05Å; I93-F121 HydrophobicContact CB-CZ 4.46Å; I93-F121 HydrophobicContact CD1-CZ 4.46Å; I93-F121 HydrophobicContact CG2-CE1 4.39Å; I93-F121 HydrophobicContact CG2-CZ 4.34Å; I93-F127 HydrophobicContact CD1-CD1 3.32Å; I93-F127 HydrophobicContact CD1-CE1 3.26Å; I93-F127 HydrophobicContact CD1-CG 4.3Å; I93-F127 HydrophobicContact CD1-CZ 4.2Å
94G93.6Very high90.9Very high2 Ų268.8 Ų68.82%0.02134%0.336CS..EExtended strand (participates in β ladder)trans167.3-158.6-169.600000112.2P84 V85 K111P84-G94 WeakPolarHBondContact CA-O 3.18Å; V85-G94 PolarHBondContact N-O 2.86Å; G94-K111 CarbonylContact C-O 3.55Å; G94-K111 WeakPolarHBondContact CA-O 3.4Å
95K94.6Very high90.6Very high82 Ų8271.8 Ų71.836%0.35735%0.351SS..EExtended strand (participates in β ladder)trans-140.9150-179.460.1176.9-175.6156.80111.7N82 A83 D97 V110 K111N82-K95 HydrophobicContact CB-CD 4.45Å; N82-K95 PolarHBondContact OD1-NZ 3.32Å; A83-K95 CarbonylContact O-C 3.48Å; A83-K95 WeakPolarHBondContact O-CA 3.44Å; K95-D97 PolarHBondContact O-N 2.91Å; K95-V110 CarbonylContact O-C 3.59Å; K95-V110 WeakPolarHBondContact O-CA 3.3Å; K95-V110 WeakPolarHBondContact O-CG1 3.5Å; K95-K111 HydrophobicContact CG-CB 4.27Å; K95-K111 PolarHBondContact N-O 2.92Å; K95-K111 PolarHBondContact O-N 3.32Å
96V94.9Very high90.4Very high0 Ų072.5 Ų72.50%035%0.354CS..EExtended strand (participates in β ladder)trans-65.2128.8174.6-179.40000109.6P79 N82 A83 V85 I99 F108P79-V96 HydrophobicContact CB-CG2 4.22Å; P79-V96 HydrophobicContact CG-CG1 4.4Å; P79-V96 HydrophobicContact CG-CG2 4.49Å; N82-V96 WeakPolarHBondContact CA-O 3.29Å; N82-V96 PolarHBondContact N-O 2.91Å; A83-V96 HydrophobicContact CB-CG2 4.41Å; A83-V96 PolarHBondContact O-N 3.09Å; V85-V96 HydrophobicContact CG2-CG2 3.54Å; V96-I99 HydrophobicContact CG1-CD1 4.37Å; V96-I99 HydrophobicContact CG1-CG1 4.04Å; V96-F108 HydrophobicContact CG1-CB 4.46Å; V96-F108 HydrophobicContact CG2-CD2 4.49Å
97D94.8Very high90.5Very high69 Ų6975.4 Ų75.437%0.36937%0.365SS..EExtended strand (participates in β ladder)trans-108.4-57177.7-161.525.7000111.4F81 K95 S109 K111F81-D97 VanDerWaalsContact CD1-O 3.29Å; F81-D97 WeakPolarHBondContact CD1-O 3.4Å; K95-D97 PolarHBondContact O-N 2.91Å; D97-S109 PolarHBondContact N-O 3.04Å; D97-K111 HydrophobicContact CB-CB 4.28Å
98E94Very high90.6Very high115 Ų11574.2 Ų74.254%0.53736%0.359SS..EExtended strand (participates in β ladder)trans-123147.5-177.1-161.7173.4-174.400112F100 F108 S109E98-F100 HydrophobicContact CB-CD1 4.41Å; E98-F100 HydrophobicContact CG-CD1 4.16Å; E98-F108 CarbonylContact O-C 3.46Å; E98-F108 WeakPolarHBondContact O-CA 3.33Å; E98-F108 WeakPolarHBondContact O-CB 3.38Å; E98-S109 VanDerWaalsContact CB-OG 3.24Å; E98-S109 WeakPolarHBondContact CB-OG 3.19Å; E98-S109 PolarHBondContact N-OG 3.04Å; E98-S109 PolarHBondContact O-N 3.45Å
99I92.7Very high90.9Very high36 Ų3668 Ų6819%0.18533%0.331CS..EExtended strand (participates in β ladder)trans-128.2121.3174.7-55.2173.7000107.2V78 P79 F81 V96 F106 Y107 F108V78-I99 HydrophobicContact CG1-CD1 3.67Å; V78-I99 HydrophobicContact CG1-CG2 4.34Å; P79-I99 HydrophobicContact CG-CD1 3.8Å; P79-I99 HydrophobicContact CG-CG1 4.45Å; P79-I99 WeakPolarHBondContact O-CD1 3.28Å; F81-I99 HydrophobicContact CD1-CD1 4.45Å; F81-I99 HydrophobicContact CD1-CG1 4.5Å; F81-I99 HydrophobicContact CE1-CB 4.28Å; F81-I99 HydrophobicContact CE1-CD1 4.11Å; F81-I99 HydrophobicContact CE1-CG1 3.97Å; F81-I99 HydrophobicContact CZ-CB 4.42Å; F81-I99 HydrophobicContact CZ-CD1 4.2Å; F81-I99 HydrophobicContact CZ-CG1 4.38Å; V96-I99 HydrophobicContact CG1-CD1 4.37Å; V96-I99 HydrophobicContact CG1-CG1 4.04Å; I99-F106 HydrophobicContact CG2-CB 4.43Å; I99-F106 HydrophobicContact CG2-CD2 3.55Å; I99-F106 HydrophobicContact CG2-CE2 4.04Å; I99-F106 HydrophobicContact CG2-CG 4.18Å; I99-Y107 WeakPolarHBondContact CA-O 3.49Å; I99-F108 HydrophobicContact CG1-CB 4.27Å
100F93.1Very high91.2Very high78 Ų7863.1 Ų63.134%0.34231%0.305SS..EExtended strand (participates in β ladder)trans-145.2169.2-171.859.1-89.6000111.8V68 E98 F106 Y107V68-F100 HydrophobicContact CG1-CZ 3.87Å; V68-F100 HydrophobicContact CG2-CZ 4.28Å; E98-F100 HydrophobicContact CB-CD1 4.41Å; E98-F100 HydrophobicContact CG-CD1 4.16Å; F100-F106 CarbonylContact O-C 3.47Å; F100-F106 WeakPolarHBondContact O-CA 3.12Å; F100-F106 WeakPolarHBondContact O-CB 3.01Å; F100-Y107 VanDerWaalsContact CE2-CB 3.46Å; F100-Y107 HydrophobicContact CE2-CD2 4.43Å; F100-Y107 HydrophobicContact CE2-CG 4.12Å; F100-Y107 PolarHBondContact N-O 3.06Å; F100-Y107 PolarHBondContact O-N 2.98Å
101G91.4Very high91.5Very high58 Ų5864.1 Ų64.160%0.59831%0.309SS*.EExtended strand (participates in β ladder)trans98.7-157.3-177.600000113.5
102Q88.4Confident91.7Very high142 Ų14261 Ų6166%0.66430%0.295SS*.  trans-83.4154.2-173.9-63.2-176.312.300111.4R104 D105 F106Q102-R104 PolarHBondContact O-N 2.8Å; Q102-R104 VanDerWaalsContact O-N 3.11Å; Q102-D105 PolarHBondContact N-O 2.84Å; Q102-D105 CarbonylContact O-C 3.53Å; Q102-D105 PolarHBondContact O-N 2.8Å; Q102-F106 WeakPolarHBondContact O-CA 3.2Å; Q102-F106 VanDerWaalsContact O-CB 3.29Å; Q102-F106 WeakPolarHBondContact O-CB 3.09Å; Q102-F106 PolarHBondContact O-N 3Å; Q102-F106 VanDerWaalsContact O-N 3.09Å
103L80.3Confident91.6Very high83 Ų8358.2 Ų58.244%0.43529%0.287SS..SBendtrans-55.5-35.9-174.6-166.985.3000114.1L137 L141L103-L137 HydrophobicContact CD1-CD1 3.98Å; L103-L137 HydrophobicContact CD2-CD2 4.03Å; L103-L137 HydrophobicContact CD2-CG 4.37Å; L103-L137 HydrophobicContact CG-CD1 3.94Å; L103-L137 HydrophobicContact CG-CD2 4.07Å; L103-L137 HydrophobicContact CG-CG 4.25Å; L103-L141 HydrophobicContact CD1-CD2 4.46Å; L103-L141 HydrophobicContact CD2-CD2 3.48Å; L103-L141 VanDerWaalsContact CD2-CD2 3.48Å; L103-L141 HydrophobicContact CD2-CG 4.27Å
104R79.8Confident91.3Very high201 Ų20168.2 Ų68.276%0.75833%0.334SS*.SBendtrans-97.2-31.6-179.8-67.8-177.8176.2175.6-1.3113Q102Q102-R104 PolarHBondContact O-N 2.8Å; Q102-R104 VanDerWaalsContact O-N 3.11Å
105D86Confident90.9Very high89 Ų8974.2 Ų74.248%0.47637%0.365SS..SBendtrans-120.171.4-179.6-64.8-55.2000109Q102Q102-D105 PolarHBondContact N-O 2.84Å; Q102-D105 CarbonylContact O-C 3.53Å; Q102-D105 PolarHBondContact O-N 2.8Å
106F90.7Very high90.5Very high16 Ų1672.2 Ų72.27%0.0736%0.357CS..EExtended strand (participates in β ladder)trans-94.9156.8178.163.4-91.1000111.5C71 V78 I99 F100 Q102C71-F106 HydrophobicContact CB-CD1 4.44Å; C71-F106 HydrophobicContact CB-CD2 3.81Å; C71-F106 HydrophobicContact CB-CE1 4.22Å; C71-F106 HydrophobicContact CB-CE2 3.57Å; C71-F106 HydrophobicContact CB-CG 4.24Å; C71-F106 HydrophobicContact CB-CZ 3.8Å; C71-F106 WeakPolarHBondContact CB-O 3.42Å; C71-F106 PolarHBondContact N-O 3.37Å; C71-F106 VanDerWaalsContact N-O 3.08Å; C71-F106 WeakPolarHBondContact SG-CZ 3.47Å; V78-F106 HydrophobicContact CB-CZ 4.44Å; V78-F106 HydrophobicContact CG1-CZ 4.47Å; V78-F106 HydrophobicContact CG2-CE1 4.15Å; V78-F106 HydrophobicContact CG2-CZ 4.23Å; I99-F106 HydrophobicContact CG2-CB 4.43Å; I99-F106 HydrophobicContact CG2-CD2 3.55Å; I99-F106 HydrophobicContact CG2-CE2 4.04Å; I99-F106 HydrophobicContact CG2-CG 4.18Å; F100-F106 CarbonylContact O-C 3.47Å; F100-F106 WeakPolarHBondContact O-CA 3.12Å; F100-F106 WeakPolarHBondContact O-CB 3.01Å; Q102-F106 WeakPolarHBondContact O-CA 3.2Å; Q102-F106 VanDerWaalsContact O-CB 3.29Å; Q102-F106 WeakPolarHBondContact O-CB 3.09Å; Q102-F106 PolarHBondContact O-N 3Å; Q102-F106 VanDerWaalsContact O-N 3.09Å
107Y94.1Very high90.1Very high78 Ų7879.6 Ų79.631%0.30639%0.389SS..EExtended strand (participates in β ladder)trans-108.9158.5172.1-60.3-91.3000108.7M60 V68 C69 K70 I99 F100M60-Y107 HydrophobicContact CE-CE1 4.19Å; M60-Y107 HydrophobicContact CG-CE1 4.37Å; V68-Y107 HydrophobicContact CG1-CD1 4.41Å; C69-Y107 VanDerWaalsContact O-CA 3.29Å; C69-Y107 WeakPolarHBondContact O-CA 3.13Å; K70-Y107 HydrophobicContact CB-CD1 4.03Å; K70-Y107 HydrophobicContact CB-CE1 3.9Å; K70-Y107 HydrophobicContact CD-CE1 4.35Å; K70-Y107 HydrophobicContact CG-CD1 4.29Å; K70-Y107 HydrophobicContact CG-CE1 3.9Å; I99-Y107 WeakPolarHBondContact CA-O 3.49Å; F100-Y107 VanDerWaalsContact CE2-CB 3.46Å; F100-Y107 HydrophobicContact CE2-CD2 4.43Å; F100-Y107 HydrophobicContact CE2-CG 4.12Å; F100-Y107 PolarHBondContact N-O 3.06Å; F100-Y107 PolarHBondContact O-N 2.98Å
108F94.6Very high89.7Confident0 Ų076.7 Ų76.70%038%0.375CS..EExtended strand (participates in β ladder)trans-140.1145.6172.961-84.3000110.3L56 C69 C71 V96 E98 I99 V110L56-F108 HydrophobicContact CB-CZ 4.45Å; L56-F108 HydrophobicContact CD2-CD2 4.31Å; L56-F108 HydrophobicContact CD2-CE1 4.16Å; L56-F108 HydrophobicContact CD2-CE2 3.53Å; L56-F108 HydrophobicContact CD2-CZ 3.45Å; L56-F108 VanDerWaalsContact CD2-CZ 3.45Å; L56-F108 HydrophobicContact CG-CE1 3.87Å; L56-F108 HydrophobicContact CG-CE2 4.15Å; L56-F108 HydrophobicContact CG-CZ 3.52Å; C69-F108 HydrophobicContact CB-CD1 4.15Å; C69-F108 HydrophobicContact CB-CD2 4.01Å; C69-F108 HydrophobicContact CB-CE1 3.61Å; C69-F108 HydrophobicContact CB-CE2 3.47Å; C69-F108 VanDerWaalsContact CB-CE2 3.47Å; C69-F108 HydrophobicContact CB-CG 4.33Å; C69-F108 HydrophobicContact CB-CZ 3.24Å; C69-F108 PolarHBondContact N-O 3.22Å; C69-F108 PolarHBondContact O-N 2.77Å; C71-F108 HydrophobicContact CB-CD1 4.42Å; C71-F108 HydrophobicContact CB-CE1 4.4Å; V96-F108 HydrophobicContact CG1-CB 4.46Å; V96-F108 HydrophobicContact CG2-CD2 4.49Å; E98-F108 CarbonylContact O-C 3.46Å; E98-F108 WeakPolarHBondContact O-CA 3.33Å; E98-F108 WeakPolarHBondContact O-CB 3.38Å; I99-F108 HydrophobicContact CG1-CB 4.27Å; F108-V110 HydrophobicContact CD2-CG2 3.65Å; F108-V110 HydrophobicContact CE2-CG2 3.53Å
109S94.8Very high89.3Confident8 Ų875.8 Ų75.86%0.05638%0.382CS..EExtended strand (participates in β ladder)trans-91.5143.7168.565.70000110I67 D97 E98I67-S109 CarbonylContact O-C 3.46Å; I67-S109 VanDerWaalsContact O-CA 3.28Å; I67-S109 WeakPolarHBondContact O-CA 3.49Å; D97-S109 PolarHBondContact N-O 3.04Å; E98-S109 VanDerWaalsContact CB-OG 3.24Å; E98-S109 WeakPolarHBondContact CB-OG 3.19Å; E98-S109 PolarHBondContact N-OG 3.04Å; E98-S109 PolarHBondContact O-N 3.45Å
110V95.3Very high89Confident0 Ų077.7 Ų77.70%040%0.398CS..EExtended strand (participates in β ladder)trans-117.7120.6171.1-176.10000107.8D66 I67 V85 K95 F108 L112D66-V110 WeakPolarHBondContact CA-O 3.35Å; I67-V110 HydrophobicContact CD1-CB 4.13Å; I67-V110 HydrophobicContact CD1-CG2 4.47Å; I67-V110 HydrophobicContact CG1-CB 3.66Å; I67-V110 HydrophobicContact CG1-CG2 4.25Å; I67-V110 PolarHBondContact N-O 3.46Å; I67-V110 VanDerWaalsContact N-O 3.08Å; I67-V110 PolarHBondContact O-N 2.85Å; V85-V110 HydrophobicContact CB-CG1 4.02Å; V85-V110 HydrophobicContact CG1-CG2 4.45Å; V85-V110 HydrophobicContact CG2-CG1 3.94Å; V85-V110 HydrophobicContact CG2-CG2 3.95Å; K95-V110 CarbonylContact O-C 3.59Å; K95-V110 WeakPolarHBondContact O-CA 3.3Å; K95-V110 WeakPolarHBondContact O-CG1 3.5Å; F108-V110 HydrophobicContact CD2-CG2 3.65Å; F108-V110 HydrophobicContact CE2-CG2 3.53Å; V110-L112 PolarHBondContact O-N 2.91Å
111K94.8Very high88.6Confident104 Ų10475.2 Ų75.245%0.45239%0.387SS..EExtended strand (participates in β ladder)trans-75113169.1-174.4162.2-170.4154.60109.3D66 G94 K95 D97D66-K111 VanDerWaalsContact OD1-CA 3.29Å; D66-K111 WeakPolarHBondContact OD1-CA 3.19Å; G94-K111 CarbonylContact C-O 3.55Å; G94-K111 WeakPolarHBondContact CA-O 3.4Å; K95-K111 HydrophobicContact CG-CB 4.27Å; K95-K111 PolarHBondContact N-O 2.92Å; K95-K111 PolarHBondContact O-N 3.32Å; D97-K111 HydrophobicContact CB-CB 4.28Å
112L93.6Very high88.4Confident19 Ų1980.2 Ų80.210%0.09939%0.392CS..EExtended strand (participates in β ladder)trans-72.1151.1-179.7-64.9178.6000111I67 I93 V110 M116 A118 F121I67-L112 HydrophobicContact CD1-CD2 4.05Å; I67-L112 HydrophobicContact CG1-CD2 4.17Å; I67-L112 HydrophobicContact CG2-CD1 3.85Å; I67-L112 HydrophobicContact CG2-CD2 4.39Å; I67-L112 HydrophobicContact CG2-CG 4.27Å; I93-L112 HydrophobicContact CB-CD2 4.48Å; I93-L112 HydrophobicContact CD1-CD2 4.45Å; V110-L112 PolarHBondContact O-N 2.91Å; L112-M116 HydrophobicContact CB-CB 4.23Å; L112-M116 HydrophobicContact CD1-CB 4.43Å; L112-M116 HydrophobicContact CD2-CB 4.48Å; L112-A118 VanDerWaalsContact CD1-CA 3.49Å; L112-A118 HydrophobicContact CD1-CB 3.87Å; L112-A118 VanDerWaalsContact CD1-N 3.31Å; L112-F121 HydrophobicContact CD1-CE2 3.81Å; L112-F121 HydrophobicContact CD2-CE2 3.76Å; L112-F121 HydrophobicContact CD2-CZ 4.1Å; L112-F121 HydrophobicContact CG-CE2 4.47Å
113S89.8Confident88.3Confident42 Ų4281.4 Ų81.429%0.29440%0.395SS..  trans-67.8151.5166.8-63.40000110.1I93 N115 M116I93-S113 PolarHBondContact O-N 3.14Å; I93-S113 PolarHBondContact O-OG 2.85Å; S113-N115 WeakPolarHBondContact CB-OD1 3.43Å; S113-N115 PolarHBondContact O-N 3.29Å; S113-M116 PolarHBondContact O-N 2.94Å
114E85.4Confident88.6Confident211 Ų21184.1 Ų84.199%0.98641%0.408SS*.THydrogen-bonded Turntrans-56.2-20.8-175.3-63.6177.2-175.700114.4
115N85.1Confident89.1Confident127 Ų12777.7 Ų77.768%0.67939%0.386SS*.THydrogen-bonded Turntrans-86.9-5.2178.962.9-24.1000114.3S113S113-N115 WeakPolarHBondContact CB-OD1 3.43Å; S113-N115 PolarHBondContact O-N 3.29Å
116M86.4Confident89.5Confident40 Ų4078.9 Ų78.920%0.19739%0.387CS..  trans-113.1142.1-176.5-75.8-74.1-17200111E91 I93 L112 S113 F121E91-M116 WeakPolarHBondContact OE1-CE 3.29Å; I93-M116 HydrophobicContact CG2-CE 4.05Å; L112-M116 HydrophobicContact CB-CB 4.23Å; L112-M116 HydrophobicContact CD1-CB 4.43Å; L112-M116 HydrophobicContact CD2-CB 4.48Å; S113-M116 PolarHBondContact O-N 2.94Å; M116-F121 HydrophobicContact SD-CZ 4.1Å
117K87.5Confident89.6Confident155 Ų15578.1 Ų78.167%0.67438%0.384SS*.  trans-109.9131.1177-67.4-174.3178.6-177.80110.7S119 S120K117-S119 PolarHBondContact O-N 2.89Å; K117-S119 VanDerWaalsContact O-N 3.16Å; K117-S120 WeakPolarHBondContact O-CB 3.43Å; K117-S120 PolarHBondContact O-N 2.97Å; K117-S120 PolarHBondContact O-OG 3.15Å
118A86.7Confident89.6Confident8 Ų876.1 Ų76.17%0.06638%0.376CS..G310 helixtrans-55.6-34.9178.300000112.9P62 D66 I67 L112 S120P62-A118 HydrophobicContact CB-CB 3.67Å; D66-A118 WeakPolarHBondContact O-CB 3.43Å; I67-A118 HydrophobicContact CG2-CB 3.67Å; L112-A118 VanDerWaalsContact CD1-CA 3.49Å; L112-A118 HydrophobicContact CD1-CB 3.87Å; L112-A118 VanDerWaalsContact CD1-N 3.31Å; A118-S120 VanDerWaalsContact C-N 3.31Å; A118-S120 PolarHBondContact O-N 3.3Å
119S85.8Confident89.5Confident97 Ų9776.1 Ų76.168%0.67838%0.376SS*.G310 helixtrans-75.8-10.6178.855.90000115.2K117 F121K117-S119 PolarHBondContact O-N 2.89Å; K117-S119 VanDerWaalsContact O-N 3.16Å; S119-F121 VanDerWaalsContact C-N 3.31Å
120S84.8Confident89.4Confident75 Ų7577.2 Ų77.252%0.52438%0.381SS..G310 helixtrans-79.1-14.7178.667.90000113.8K117 A118K117-S120 WeakPolarHBondContact O-CB 3.43Å; K117-S120 PolarHBondContact O-N 2.97Å; K117-S120 PolarHBondContact O-OG 3.15Å; A118-S120 VanDerWaalsContact C-N 3.31Å; A118-S120 PolarHBondContact O-N 3.3Å
121F86.4Confident89.1Confident26 Ų2678.2 Ų78.211%0.11439%0.387CS..SBendtrans-83.6139.2-179.1-60.3-73.9000111.4F59 I67 L87 I93 L112 M116 S119 F127F59-F121 HydrophobicContact CD1-CB 4.43Å; F59-F121 HydrophobicContact CD2-CB 4.05Å; F59-F121 HydrophobicContact CE1-CB 4.43Å; F59-F121 HydrophobicContact CE2-CB 4.05Å; F59-F121 HydrophobicContact CG-CB 4.23Å; F59-F121 HydrophobicContact CZ-CB 4.22Å; I67-F121 HydrophobicContact CG2-CD2 4.05Å; I67-F121 HydrophobicContact CG2-CE2 4.41Å; L87-F121 HydrophobicContact CD2-CE1 4.44Å; I93-F121 HydrophobicContact CB-CZ 4.46Å; I93-F121 HydrophobicContact CD1-CZ 4.46Å; I93-F121 HydrophobicContact CG2-CE1 4.39Å; I93-F121 HydrophobicContact CG2-CZ 4.34Å; L112-F121 HydrophobicContact CD1-CE2 3.81Å; L112-F121 HydrophobicContact CD2-CE2 3.76Å; L112-F121 HydrophobicContact CD2-CZ 4.1Å; L112-F121 HydrophobicContact CG-CE2 4.47Å; M116-F121 HydrophobicContact SD-CZ 4.1Å; S119-F121 VanDerWaalsContact C-N 3.31Å; F121-F127 HydrophobicContact CD1-CE1 4.02Å; F121-F127 HydrophobicContact CD1-CZ 4.02Å; F121-F127 HydrophobicContact CE1-CE1 4.09Å; F121-F127 HydrophobicContact CE1-CZ 4.45Å; F121-F127 HydrophobicContact CG-CZ 4.2Å
122K87.1Confident88.7Confident163 Ų16380.1 Ų80.171%0.70940%0.4SS*.PPolyproline II helixtrans-81.7150.6176-66.3-179.6-178.5176.60110.5F59 Q125F59-K122 WeakPolarHBondContact CD1-O 3.46Å; K122-Q125 WeakPolarHBondContact O-CB 3.18Å; K122-Q125 PolarHBondContact O-N 3.48Å; K122-Q125 VanDerWaalsContact O-N 3.14Å
123K85.3Confident88.6Confident168 Ų16881.7 Ų81.773%0.7341%0.406SS*.THydrogen-bonded Turntrans-53.7139168.6-72.5-173.2178.2-178.60110.7Q125K123-Q125 PolarHBondContact O-N 3.38Å
124M86.1Confident88.6Confident140 Ų14080.5 Ų80.569%0.6940%0.396SS*.THydrogen-bonded Turntrans63.915.2-178.1-52.2176.1-69.400114.8F59 K126F59-M124 PolarHBondContact O-N 3.3Å; M124-K126 PolarHBondContact O-N 3.01Å
125Q91.9Very high88.8Confident66 Ų6672.2 Ų72.231%0.30836%0.358SS..  trans-61.7128.4170.1-176.365.33500109.2E58 F59 L87 K122 K123 F127E58-Q125 CarbonylContact C-O 3.5Å; E58-Q125 WeakPolarHBondContact CA-O 3.42Å; F59-Q125 HydrophobicContact CB-CB 4.11Å; F59-Q125 PolarHBondContact N-O 2.87Å; L87-Q125 HydrophobicContact CD2-CG 4.46Å; K122-Q125 WeakPolarHBondContact O-CB 3.18Å; K122-Q125 PolarHBondContact O-N 3.48Å; K122-Q125 VanDerWaalsContact O-N 3.14Å; K123-Q125 PolarHBondContact O-N 3.38Å; Q125-F127 HydrophobicContact CG-CE1 4.42Å; Q125-F127 HydrophobicContact CG-CZ 4.44Å
126K93.1Very high89Confident114 Ų11469.1 Ų69.150%0.49635%0.345SS..EExtended strand (participates in β ladder)trans-82.2138.7178.2-66.5-176.9-179.5-179.30110.9M124 Y128M124-K126 PolarHBondContact O-N 3.01Å; K126-Y128 HydrophobicContact CB-CE2 3.98Å
127F93.4Very high88.9Confident0 Ų068.1 Ų68.10%034%0.341CS..EExtended strand (participates in β ladder)trans-114.6152.1172.1-61.3-66.9000110.6L56 G57 F59 I67 C69 V85 L87 I93 F121 Q125L56-F127 PolarHBondContact N-O 2.96Å; G57-F127 PolarHBondContact N-O 3.07Å; G57-F127 PolarHBondContact O-N 2.99Å; F59-F127 HydrophobicContact CB-CE2 3.61Å; F59-F127 HydrophobicContact CB-CZ 4.15Å; F59-F127 HydrophobicContact CD2-CE2 4.09Å; F59-F127 HydrophobicContact CD2-CZ 4.26Å; F59-F127 HydrophobicContact CG-CE2 4.33Å; I67-F127 HydrophobicContact CD1-CD2 4.45Å; I67-F127 HydrophobicContact CD1-CE1 4.04Å; I67-F127 HydrophobicContact CD1-CE2 3.63Å; I67-F127 HydrophobicContact CD1-CZ 3.39Å; C69-F127 HydrophobicContact CB-CD2 4.47Å; C69-F127 WeakPolarHBondContact SG-CD2 3.42Å; C69-F127 WeakPolarHBondContact SG-CE2 3.43Å; V85-F127 HydrophobicContact CG1-CB 3.81Å; V85-F127 HydrophobicContact CG1-CD1 4.41Å; V85-F127 HydrophobicContact CG1-CG 4.3Å; L87-F127 HydrophobicContact CD2-CD1 4.03Å; L87-F127 HydrophobicContact CD2-CE1 3.91Å; I93-F127 HydrophobicContact CD1-CD1 3.32Å; I93-F127 HydrophobicContact CD1-CE1 3.26Å; I93-F127 HydrophobicContact CD1-CG 4.3Å; I93-F127 HydrophobicContact CD1-CZ 4.2Å; F121-F127 HydrophobicContact CD1-CE1 4.02Å; F121-F127 HydrophobicContact CD1-CZ 4.02Å; F121-F127 HydrophobicContact CE1-CE1 4.09Å; F121-F127 HydrophobicContact CE1-CZ 4.45Å; F121-F127 HydrophobicContact CG-CZ 4.2Å; Q125-F127 HydrophobicContact CG-CE1 4.42Å; Q125-F127 HydrophobicContact CG-CZ 4.44Å
128Y93.6Very high88.7Confident35 Ų3566.6 Ų66.614%0.13734%0.336CS..EExtended strand (participates in β ladder)trans-128.5158-172.5-57-104.9000111.3V53 V54 A55 Y86 E88 K126V53-Y128 HydrophobicContact CB-CD1 4.45Å; V53-Y128 HydrophobicContact CB-CG 4.41Å; V53-Y128 HydrophobicContact CG2-CD1 3.86Å; V53-Y128 HydrophobicContact CG2-CG 3.96Å; V54-Y128 CarbonylContact O-C 3.49Å; V54-Y128 WeakPolarHBondContact O-CA 3.48Å; V54-Y128 WeakPolarHBondContact O-CB 3.29Å; A55-Y128 HydrophobicContact CB-CD1 4.39Å; A55-Y128 HydrophobicContact CB-CE1 4.3Å; Y86-Y128 PolarHBondContact N-O 2.74Å; Y86-Y128 PolarHBondContact O-N 3.08Å; E88-Y128 HydrophobicContact CB-CD2 4.34Å; E88-Y128 HydrophobicContact CB-CE2 3.67Å; E88-Y128 HydrophobicContact CG-CE2 4.3Å; K126-Y128 HydrophobicContact CB-CE2 3.98Å
129I92.9Very high88.5Confident0 Ų073.4 Ų73.40%036%0.36CS..EExtended strand (participates in β ladder)trans-139.7158.2-179.5-165.8166.8000110.1V53 V54 L56 P79 A83 K133 L134V53-I129 CarbonylContact C-O 3.55Å; V53-I129 WeakPolarHBondContact CA-O 3.36Å; V54-I129 HydrophobicContact CG2-CG2 3.85Å; V54-I129 WeakPolarHBondContact CG2-O 3.33Å; V54-I129 PolarHBondContact N-O 2.72Å; V54-I129 PolarHBondContact O-N 2.76Å; L56-I129 HydrophobicContact CB-CB 4.22Å; L56-I129 HydrophobicContact CB-CG2 3.97Å; L56-I129 HydrophobicContact CD1-CG2 4.1Å; L56-I129 HydrophobicContact CD2-CB 4.18Å; L56-I129 HydrophobicContact CD2-CD1 4.2Å; L56-I129 HydrophobicContact CG-CG2 4.41Å; P79-I129 HydrophobicContact CB-CD1 3.68Å; A83-I129 HydrophobicContact CB-CD1 3.78Å; I129-K133 HydrophobicContact CD1-CB 4.15Å; I129-K133 HydrophobicContact CG1-CB 4.17Å; I129-L134 HydrophobicContact CD1-CD2 4.32Å; I129-L134 HydrophobicContact CG2-CD1 4.17Å; I129-L134 HydrophobicContact CG2-CD2 3.9Å; I129-L134 HydrophobicContact CG2-CG 4.02Å
130D91.6Very high88.3Confident31 Ų3173.3 Ų73.317%0.16635%0.347CS..  trans-65.3126.1166.4178-4.2000109.8P50 M132 K133P50-D130 HydrophobicContact CB-CB 3.94Å; P50-D130 HydrophobicContact CG-CB 4.12Å; D130-M132 PolarHBondContact O-N 3.45Å; D130-M132 VanDerWaalsContact O-N 3.09Å; D130-M132 WeakPolarHBondContact OD1-CB 3.41Å; D130-M132 PolarHBondContact OD1-N 2.89Å; D130-K133 HydrophobicContact CB-CB 4.43Å; D130-K133 HydrophobicContact CB-CG 3.94Å; D130-K133 WeakPolarHBondContact O-CB 3.38Å; D130-K133 PolarHBondContact O-N 3.09Å
131P89.1Confident88.2Confident21 Ų2173.5 Ų73.514%0.13634%0.342CS..G310 helixtrans-57.5-23176.523.6-34.9000114.1R52 V54 K133R52-P131 HydrophobicContact CG-CG 3.97Å; R52-P131 WeakPolarHBondContact O-CD 3.39Å; V54-P131 HydrophobicContact CG1-CB 4.04Å; V54-P131 HydrophobicContact CG1-CG 4.28Å; V54-P131 HydrophobicContact CG2-CB 4.15Å; P131-K133 PolarHBondContact O-N 2.85Å
132M88.2Confident87.8Confident145 Ų14577.8 Ų77.871%0.71437%0.373SS*.G310 helixtrans-73.6-16175.3-63-59.9-65.800113D130 L134D130-M132 PolarHBondContact O-N 3.45Å; D130-M132 VanDerWaalsContact O-N 3.09Å; D130-M132 WeakPolarHBondContact OD1-CB 3.41Å; D130-M132 PolarHBondContact OD1-N 2.89Å; M132-L134 VanDerWaalsContact C-N 3.33Å
133K90.6Very high86.8Confident51 Ų5177.5 Ų77.522%0.22237%0.367CS..G310 helixtrans-99.828.7177.7-55.5-65.2-174.6175.80112Y80 A83 I129 D130 P131Y80-K133 HydrophobicContact CD2-CB 4.49Å; Y80-K133 VanDerWaalsContact CD2-O 3.3Å; Y80-K133 WeakPolarHBondContact CD2-O 3.42Å; Y80-K133 PolarHBondContact N-O 3.48Å; A83-K133 HydrophobicContact CB-CB 3.96Å; I129-K133 HydrophobicContact CD1-CB 4.15Å; I129-K133 HydrophobicContact CG1-CB 4.17Å; D130-K133 HydrophobicContact CB-CB 4.43Å; D130-K133 HydrophobicContact CB-CG 3.94Å; D130-K133 WeakPolarHBondContact O-CB 3.38Å; D130-K133 PolarHBondContact O-N 3.09Å; P131-K133 PolarHBondContact O-N 2.85Å
134L90.1Very high86.1Confident17 Ų1772.8 Ų72.89%0.08935%0.354CS..EExtended strand (participates in β ladder)trans-116.4135.6173.3-70.7179000110.8V54 L56 K77 P79 I129 M132V54-L134 HydrophobicContact CG2-CD1 3.8Å; L56-L134 HydrophobicContact CD1-CD2 4.18Å; K77-L134 HydrophobicContact CB-CB 4.02Å; K77-L134 HydrophobicContact CB-CD1 4.29Å; K77-L134 HydrophobicContact CB-CD2 4.41Å; K77-L134 HydrophobicContact CB-CG 4.49Å; K77-L134 HydrophobicContact CD-CB 3.94Å; K77-L134 HydrophobicContact CD-CD1 4.03Å; K77-L134 HydrophobicContact CG-CB 4.44Å; P79-L134 HydrophobicContact CB-CD2 4.22Å; I129-L134 HydrophobicContact CD1-CD2 4.32Å; I129-L134 HydrophobicContact CG2-CD1 4.17Å; I129-L134 HydrophobicContact CG2-CD2 3.9Å; I129-L134 HydrophobicContact CG2-CG 4.02Å; M132-L134 VanDerWaalsContact C-N 3.33Å
135L89.8Confident84.8Confident37 Ų3772.9 Ų72.919%0.19437%0.365CS..EExtended strand (participates in β ladder)trans-104.3138.3177.1-69.2167.5000110.2K77 V78 Y80 F140K77-L135 CarbonylContact C-O 3.19Å; K77-L135 WeakPolarHBondContact CA-O 3.2Å; V78-L135 PolarHBondContact N-O 2.98Å; V78-L135 WeakPolarHBondContact O-CB 3.12Å; V78-L135 PolarHBondContact O-N 2.92Å; Y80-L135 HydrophobicContact CD1-CD1 4.4Å; Y80-L135 HydrophobicContact CD2-CD1 4.11Å; Y80-L135 HydrophobicContact CD2-CD2 4.12Å; Y80-L135 HydrophobicContact CD2-CG 3.62Å; Y80-L135 HydrophobicContact CE1-CD1 4.46Å; Y80-L135 HydrophobicContact CE1-CD2 4.02Å; Y80-L135 HydrophobicContact CE1-CG 4.36Å; Y80-L135 HydrophobicContact CE2-CD1 4.24Å; Y80-L135 HydrophobicContact CE2-CD2 3.41Å; Y80-L135 VanDerWaalsContact CE2-CD2 3.41Å; Y80-L135 HydrophobicContact CE2-CG 3.42Å; Y80-L135 VanDerWaalsContact CE2-CG 3.42Å; Y80-L135 HydrophobicContact CG-CD1 4.23Å; Y80-L135 HydrophobicContact CG-CG 4.24Å; Y80-L135 WeakPolarHBondContact OH-CD2 3.37Å; L135-F140 HydrophobicContact CB-CE2 4.07Å; L135-F140 HydrophobicContact CD1-CE2 4.3Å; L135-F140 HydrophobicContact CD1-CZ 3.92Å
136P88.3Confident83.6Confident63 Ų6373.5 Ų73.541%0.40939%0.389SS..EExtended strand (participates in β ladder)trans-67.7136173.625.8-30000110.8Q138 R139P136-Q138 PolarHBondContact O-N 2.86Å; P136-R139 HydrophobicContact CG-CG 3.97Å; P136-R139 WeakPolarHBondContact O-CB 3.4Å; P136-R139 WeakPolarHBondContact O-CG 3.49Å; P136-R139 PolarHBondContact O-N 3.31Å
137L84.2Confident82.3Confident19 Ų1973.7 Ų73.710%0.09939%0.392CS..G310 helixtrans-55.8-29-176.9-173.566000113.5N76 V78 L103 R139 F140 L141N76-L137 HydrophobicContact CB-CB 4.14Å; N76-L137 HydrophobicContact CB-CD2 4.25Å; N76-L137 WeakPolarHBondContact O-CB 3.34Å; N76-L137 PolarHBondContact O-N 3.16Å; V78-L137 HydrophobicContact CG2-CD1 3.55Å; L103-L137 HydrophobicContact CD1-CD1 3.98Å; L103-L137 HydrophobicContact CD2-CD2 4.03Å; L103-L137 HydrophobicContact CD2-CG 4.37Å; L103-L137 HydrophobicContact CG-CD1 3.94Å; L103-L137 HydrophobicContact CG-CD2 4.07Å; L103-L137 HydrophobicContact CG-CG 4.25Å; L137-R139 PolarHBondContact O-N 3.29Å; L137-F140 WeakPolarHBondContact O-CB 3.15Å; L137-F140 PolarHBondContact O-N 3.43Å; L137-L141 PolarHBondContact O-N 3.24Å
138Q82.9Confident80.7Confident122 Ų12283.5 Ų83.557%0.5743%0.434SS*.G310 helixtrans-55.1-22.9175.1-170.4-179-4.100113.3P136 F140 L141P136-Q138 PolarHBondContact O-N 2.86Å; Q138-F140 PolarHBondContact O-N 3.28Å; Q138-L141 PolarHBondContact O-N 3.38Å
139R83.9Confident79.3Confident151 Ų15183 Ų8357%0.5744%0.44SS*.G310 helixtrans-64.7-23.3173.9-68.4-75-178.6169.3-0.1113.3P136 L137P136-R139 HydrophobicContact CG-CG 3.97Å; P136-R139 WeakPolarHBondContact O-CB 3.4Å; P136-R139 WeakPolarHBondContact O-CG 3.49Å; P136-R139 PolarHBondContact O-N 3.31Å; L137-R139 PolarHBondContact O-N 3.29Å
140F81.8Confident78Confident95 Ų9586.7 Ų86.742%0.41746%0.464SS..THydrogen-bonded Turntrans-102.7-9.1-177.7-56.9-86000112.7V78 L135 L137 Q138V78-F140 HydrophobicContact CB-CD2 4.27Å; V78-F140 HydrophobicContact CB-CE2 3.59Å; V78-F140 HydrophobicContact CB-CZ 4.11Å; V78-F140 HydrophobicContact CG1-CE2 3.89Å; V78-F140 HydrophobicContact CG1-CZ 3.9Å; V78-F140 HydrophobicContact CG2-CD2 3.88Å; V78-F140 HydrophobicContact CG2-CE2 3.73Å; L135-F140 HydrophobicContact CB-CE2 4.07Å; L135-F140 HydrophobicContact CD1-CE2 4.3Å; L135-F140 HydrophobicContact CD1-CZ 3.92Å; L137-F140 WeakPolarHBondContact O-CB 3.15Å; L137-F140 PolarHBondContact O-N 3.43Å; Q138-F140 PolarHBondContact O-N 3.28Å
141L81.3Confident76.5Confident80 Ų8091.3 Ų91.342%0.41950%0.496SS..SBendtrans-84.7146.7172.2-70.6176.1000110.7L103 L137 Q138 R143L103-L141 HydrophobicContact CD1-CD2 4.46Å; L103-L141 HydrophobicContact CD2-CD2 3.48Å; L103-L141 VanDerWaalsContact CD2-CD2 3.48Å; L103-L141 HydrophobicContact CD2-CG 4.27Å; L137-L141 PolarHBondContact O-N 3.24Å; Q138-L141 PolarHBondContact O-N 3.38Å; L141-R143 PolarHBondContact O-N 3.07Å
142P78.8Confident75.1Confident116 Ų116101.6 Ų101.675%0.75353%0.532SS*.PPolyproline II helixtrans-55.9133.1170.223.6-31.4000108.7
143R67.1Low73.6Confident156 Ų15698.9 Ų98.959%0.58954%0.541SS*.PPolyproline II helixtrans-63.5138.4-178.9-65.5-175.7-174.6171.62.4109.1L141 G149L141-R143 PolarHBondContact O-N 3.07Å; R143-G149 VanDerWaalsContact NH1-CA 3.31Å
144P69.4Low71.5Confident70 Ų7099.6 Ų99.646%0.45556%0.563SS.*PPolyproline II helixtrans-55.5140.5167.423.4-30.7000108.8G146 E147P144-G146 PolarHBondContact O-N 2.85Å; P144-E147 PolarHBondContact O-N 3.1Å
145P59.6Low69.9Low142 Ų142102.6 Ų102.692%0.92260%0.597SS**THydrogen-bonded Turntrans-54.7117.8179.5-21.330.2000110.2
146G65.6Low68.2Low79 Ų79112.8 Ų112.881%0.81463%0.633SS**THydrogen-bonded Turntrans116.9-16.217300000117P144 K148P144-G146 PolarHBondContact O-N 2.85Å; G146-K148 PolarHBondContact O-N 3.2Å
147E65.8Low65.9Low118 Ų118113.7 Ų113.755%0.55165%0.654SS**  trans-81.4101.7176.6-98-170.9147.800112P144 G149P144-E147 PolarHBondContact O-N 3.1Å; E147-G149 PolarHBondContact O-N 3.46Å; E147-G149 VanDerWaalsContact O-N 3.1Å
148K60.4Low64.1Low206 Ų206116.3 Ų116.390%0.89669%0.685SS**  trans-63110.1165-74.6178.2-179.8173.30108.1G146G146-K148 PolarHBondContact O-N 3.2Å
149G63.5Low62.2Low25 Ų25114.5 Ų114.526%0.25870%0.699SS.*  trans-58.3167.4178.500000112.9R143 E147R143-G149 VanDerWaalsContact NH1-CA 3.31Å; E147-G149 PolarHBondContact O-N 3.46Å; E147-G149 VanDerWaalsContact O-N 3.1Å
150P65.3Low60.6Low77 Ų77119.8 Ų119.850%0.572%0.719SS.*SBendtrans-54.3140-179.322.1-32.1000109.6R152P150-R152 PolarHBondContact O-N 3.05Å
151P60.3Low58.7Low128 Ų128118.7 Ų118.783%0.83174%0.735SS**  trans-57108.9-174.622.2-31.5000108.2G153P151-G153 PolarHBondContact O-N 2.61Å
152R60.9Low56.7Low237 Ų237118.6 Ų118.689%0.89475%0.754SS**  trans-58111.3163.9-92.6-179.9168.1163.8-4.1104.8P150 G154P150-R152 PolarHBondContact O-N 3.05Å; R152-G154 PolarHBondContact O-N 2.75Å
153G56.5Low54.8Low88 Ų88116.8 Ų116.891%0.90776%0.756SS**SBendtrans-47.5108.8173.700000108.7P151P151-G153 PolarHBondContact O-N 2.61Å
154G45.8Very low53.6Low66 Ų66121.5 Ų121.568%0.6877%0.773SS**  trans179.458.1-164.100000108.4R152 R156R152-G154 PolarHBondContact O-N 2.75Å; G154-R156 PolarHBondContact O-N 3.49Å
155G56.2Low52.2Low79 Ų79121.6 Ų121.681%0.81479%0.787SS**  trans-58.4103.7165.700000108.8
156R54Low51.3Low252 Ų252119 Ų11995%0.95179%0.786SS**  trans-17696.3155.7-105.8163.3-176.7-176.30.6107.8G154G154-R156 PolarHBondContact O-N 3.49Å
157G40.9Very low50Low81 Ų81118.7 Ų118.784%0.83578%0.783SS**SBendtrans-179.850.8-178.800000113.7
158G45.6Very low48.9Very low74 Ų74125.3 Ų125.376%0.76380%0.803SS**  trans5369.7147.600000118.9R160G158-R160 VanDerWaalsContact C-N 3.31Å; G158-R160 PolarHBondContact O-N 3.19Å
159G43.2Very low47.8Very low84 Ų84119.4 Ų119.487%0.86680%0.801SS**  trans-66.393.1149.900000109.6G161G159-G161 VanDerWaalsContact C-N 3.32Å; G159-G161 PolarHBondContact O-N 3.01Å
160R50Low46.7Very low262 Ų262122.3 Ų122.399%0.98983%0.83SS**  trans-7989.3160.6-93.1-179.4176.5171.8-1107.7G158G158-R160 VanDerWaalsContact C-N 3.31Å; G158-R160 PolarHBondContact O-N 3.19Å
161G42.7Very low45.4Very low72 Ų72122.1 Ų122.174%0.74284%0.842SS**  trans-163.248.9174.600000110.3G159 G163G159-G161 VanDerWaalsContact C-N 3.32Å; G159-G161 PolarHBondContact O-N 3.01Å; G161-G163 PolarHBondContact O-N 3.32Å; G161-G163 VanDerWaalsContact O-N 3.1Å
162G38.9Very low44.2Very low79 Ų79126.2 Ų126.281%0.81485%0.847SS**  trans-78.284.6-179.900000112R164G162-R164 PolarHBondContact O-N 3.1Å
163G39.8Very low43.3Very low77 Ų77126.7 Ų126.779%0.79485%0.849SS**  trans-77.497.216100000110G161 G165G161-G163 PolarHBondContact O-N 3.32Å; G161-G163 VanDerWaalsContact O-N 3.1Å; G163-G165 PolarHBondContact O-N 3.28Å
164R41.2Very low42.3Very low255 Ų255126.5 Ų126.596%0.96285%0.848SS**  trans-73.5105.2167.2-80.9176.4175173.7-2.1108.7G162G162-R164 PolarHBondContact O-N 3.1Å
165G39.5Very low41.9Very low72 Ų72127.4 Ų127.474%0.74286%0.857SS**  trans-145.769.3170.100000109.9G163 G167G163-G165 PolarHBondContact O-N 3.28Å; G165-G167 PolarHBondContact O-N 3.23Å
166G40.3Very low41Very low88 Ų88135.7 Ų135.791%0.90786%0.864SS**  trans-74.4101.5175.400000110.7
167G40Very low40.1Very low73 Ų73127.3 Ų127.375%0.75386%0.856SS**  trans-103.984.2171.400000111.3G165G165-G167 PolarHBondContact O-N 3.23Å
168R41.2Very low39.8Very low257 Ų257127.6 Ų127.697%0.9786%0.858SS**  trans-151.7103.5158-71.8-166.1-179.8171.8-1.1109.8
169G37.9Very low39.2Very low82 Ų82127.9 Ų127.985%0.84586%0.861SS**  trans-155.975.9172.300000109.6
170G40.3Very low39.1Very low85 Ų85129.3 Ų129.388%0.87686%0.858SS**  trans-70.8124.4165.500000109.3
171G37.5Very low38.5Very low73 Ų73128.4 Ų128.475%0.75386%0.855SS**  trans-137.199.5174.800000109.8
172F35.1Very low38.1Very low214 Ų214129.1 Ų129.194%0.93986%0.862SS**  trans-77.9112.6161.7-72.3-91.1000108.7
173R43Very low38Very low247 Ų247128.1 Ų128.193%0.93285%0.852SS**  trans-174.199.9157.1-104.8173.4-176.5-173.70.6104.6
174G35.5Very low37.6Very low85 Ų85135 Ų13588%0.87686%0.86SS**  87.8109.483.100000108.6
175G37Very low37.3Very low84 Ų84126.7 Ų126.787%0.86685%0.854SS**  trans16477.917700000114.5
176R37.5Very low37.3Very low254 Ų254127.4 Ų127.496%0.95886%0.861SS**  trans-84.6138.6166-177177.8-172.3170.51.7108.2
177G34.2Very low37Very low76 Ų76126.7 Ų126.778%0.78485%0.854SS**  trans95.7133.2172.300000112.3
178G35.1Very low37Very low86 Ų86135.7 Ų135.789%0.88787%0.865SS**  cis115.113031.300000107.8
179G33.7Very low36.7Very low80 Ų80127.3 Ų127.383%0.82586%0.858SS**  trans114.3108.8160.100000116.8
180S41.1Very low36.6Very low115 Ų115127.6 Ų127.680%0.80486%0.861SS**  trans-48.9153156.6-47.80000113.4
181R36.9Very low36.3Very low243 Ų243127.2 Ų127.292%0.91786%0.858SS**  153.3122.9127-83.4161.7-173-175.63.1112.6
182G35.4Very low36.2Very low87 Ų87128 Ų12890%0.89787%0.865SS**  trans64.2140.7143.500000118
183G35.7Very low36.2Very low58 Ų58121.4 Ų121.460%0.59886%0.857SS**  cis152.3154.512.500000108.3
184F31.3Very low36Very low222 Ų222119.2 Ų119.297%0.97486%0.855SS**  trans71.8129.8165.9-51.9-85.6000117
185G35.9Very low36.2Very low80 Ų80127.7 Ų127.783%0.82586%0.861SS**  cis167.7153.44.300000110.1
186G38.2Very low36.3Very low87 Ų87127 Ų12790%0.89785%0.854SS**  trans109.3113.7167.800000114
187G35.4Very low36.4Very low73 Ų73127.2 Ų127.275%0.75385%0.854SS**  cis124.81251300000110.4
188R39.1Very low36.4Very low262 Ų262127.5 Ų127.599%0.98986%0.857SS**  trans87.4120.7178-64.4175.8173.5165.9-1.8115.5
189G34.8Very low36.7Very low80 Ų80127.3 Ų127.383%0.82586%0.855SS**  cis117.1122.512.400000110.8
190G36Very low36.8Very low89 Ų89127.7 Ų127.792%0.91886%0.859SS**  trans97.6131.6167.300000113.5
191G34.8Very low36.8Very low77 Ų77126.2 Ų126.279%0.79486%0.862SS**  cis161.7138.613.200000105.4
192G35.4Very low36.8Very low88 Ų88118.5 Ų118.591%0.90786%0.859SS**  trans-72.2-170.7-171.100000115.5
193G34.2Very low36.9Very low76 Ų76118.4 Ų118.478%0.78486%0.857SS**  trans133.7110.5153.700000115.8
194F39.1Very low37Very low202 Ų202119 Ų11989%0.88686%0.863SS**  trans-49.1147.6160.4-63.8-100.2000113.9
195R39.9Very low37.7Very low262 Ų262119.5 Ų119.599%0.98986%0.859SS**  trans153.6127.7147.2-86.3161.5-166-161.26.3107.5
196G37.8Very low37.9Very low70 Ų70119 Ų11972%0.72285%0.854SS**  cis169.4-178.34.400000108.6
197R40.1Very low38.1Very low258 Ų258123.9 Ų123.997%0.97485%0.851SS**  trans66.7113.1148.3-151.2173.3-169.7-151.42.4115.7
198G33.8Very low38.5Very low82 Ų82132 Ų13285%0.84586%0.859SS**  cis111.4119.143.500000108.7
199G42.5Very low38.4Very low82 Ų82123.3 Ų123.385%0.84585%0.851SS**  trans145118.1172.900000109.9
200G36.3Very low38.9Very low88 Ų88122.9 Ų122.991%0.90785%0.846SS**  cis117.7106.122.400000108.6
201G40.3Very low39.2Very low84 Ų84134.2 Ų134.287%0.86686%0.861SS**  trans138.4117.5171.600000111.6
202G36.3Very low39.4Very low82 Ų82137.1 Ų137.185%0.84587%0.865SS**  cis119.4114.416.200000109.8
203G38.1Very low39.6Very low84 Ų84139.6 Ų139.687%0.86686%0.862SS**  trans92.7118.816800000114
204G37.8Very low39.9Very low70 Ų70143.2 Ų143.272%0.72287%0.867SS**  cis98.5112.632.100000109.3
205R45.6Very low40Very low233 Ų233139.7 Ų139.788%0.87987%0.866SS**  trans163.9111.2142.3-88156.9-162.1-158.95.8111.1F207R205-F207 HydrophobicContact CB-CE2 4.25Å; R205-F207 HydrophobicContact CG-CE2 4.43Å
206G39.4Very low40Very low71 Ų71132.1 Ų132.173%0.73286%0.858SS**  trans-79.8157.9156.100000111.3
207F42.8Very low40.1Very low188 Ų188136.2 Ų136.283%0.82587%0.867SS**  trans-149.392.7160.8-80.1-85.7000104.6R205R205-F207 HydrophobicContact CB-CE2 4.25Å; R205-F207 HydrophobicContact CG-CE2 4.43Å
208R44.5Very low40.1Very low244 Ų244127.5 Ų127.592%0.92186%0.86SS**  45.411183.8-146.2-178.9-163.5-169.44.9113.7
209G36.1Very low40.6Very low79 Ų79131 Ų13181%0.81486%0.861SS**  trans-66.7167.1171.700000113.7
210G46.3Very low40.4Very low71 Ų71135.1 Ų135.173%0.73286%0.862SS**  trans-148120.3177.700000111
211R41.6Very low40.8Very low327 Ų327139.4 Ų139.4100%1.23486%0.858SS**  trans630151-59.1-172.1-175.9-151.31118.6

Retrieved 211 of 211 residues in 35.3 ms (Link to these results)