A0A096MUF9_PAPAN Loading...

DAZ-associated protein 2

In unstressed cells, promotes SIAH1-mediated polyubiquitination and degradation of the serine/threonine-protein kinase HIPK2, probably by acting as a loading factor that potentiates complex formation between HIPK2 and ubiquitin ligase SIAH1. In response to DNA damage, localizes to the nucleus following phosphorylation by HIPK2 and modulates the expression of a subset of TP53/p53 target genes by binding to TP53 at target gene promoters. This limits the expression of a number of cell death-mediating TP53 target genes, reducing DNA damage-induced cell death. Enhances the binding of transcription factor TCF7L2/TCF4, a Wnt signaling pathway effector, to the promoters of target genes. Plays a role in stress granule formation.

AlphaFold DB (A0A2K5ZK52), UniProt , Accession A0A096MUF9, Species PAPAN (Papio anubis, Olive baboon), Gene DAZAP2, Length 168 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
1M38.9Very low53.1Low234 Ų234153.9 Ų153.9100%1.15383%0.829SS**  0113.50-75.1148.983.900107.2
2N44.3Very low53.9Low157 Ų157152.8 Ų152.884%0.8483%0.831SS**  trans-85.8109.1-174.8-79.9-22.8000110.1K4N2-K4 PolarHBondContact O-N 3.23Å
3S50.3Low52.9Low124 Ų124154.6 Ų154.687%0.86782%0.821SS**  trans-89.275.9174.5-45.30000109.7G5S3-G5 PolarHBondContact O-N 2.91Å
4K56.2Low53.1Low193 Ų193152.6 Ų152.684%0.83982%0.821SS**  trans-76.5112.1168.2-69.7-167.7179.3-177.20108N2 Q6N2-K4 PolarHBondContact O-N 3.23Å; K4-Q6 PolarHBondContact O-N 3.23Å
5G57.5Low53.5Low64 Ų64151.6 Ų151.666%0.6682%0.821SS**PPolyproline II helixtrans-55.1133.9175.800000111.3S3 Y7S3-G5 PolarHBondContact O-N 2.91Å; G5-Y7 PolarHBondContact O-N 2.97Å
6Q58.9Low53.3Low190 Ų190153.2 Ų153.289%0.88882%0.822SS**PPolyproline II helixtrans-60.4127.5172.5-73.2-87.810.300109.4K4K4-Q6 PolarHBondContact O-N 3.23Å
7Y48.2Very low53.6Low209 Ų209150.2 Ų150.282%0.8281%0.813SS**PPolyproline II helixtrans-74.7146.2171.8-74.5-88.8000110.1G5G5-Y7 PolarHBondContact O-N 2.97Å
8P57.5Low53.7Low123 Ų123149.7 Ų149.780%0.79982%0.818SS**PPolyproline II helixtrans-65.7136.2175.326.1-31.7000110.7
9T61.4Low53.4Low136 Ų136145 Ų14583%0.83481%0.808SS**PPolyproline II helixtrans-73.4136175.646.60000110.5
10Q52.1Low53.1Low161 Ų161145.1 Ų145.175%0.75281%0.807SS**PPolyproline II helixtrans-69.5136.9179.4-163.2-177.422.800110.2
11P59.2Low52.9Low102 Ų102142.6 Ų142.666%0.66280%0.797SS**PPolyproline II helixtrans-69.9135.6172.126.3-30.7000110.9
12T62Low53.6Low140 Ų140137.8 Ų137.886%0.85978%0.781SS**PPolyproline II helixtrans-66.6127.8173.4-87.90000110.4
13Y40.9Very low53.6Low177 Ų177139 Ų13969%0.69478%0.775SS**PPolyproline II helixtrans-77.1145.1172-69.9-84.8000111.1V15Y13-V15 PolarHBondContact O-N 3.34Å
14P56.5Low53.7Low127 Ų127139.1 Ų139.183%0.82577%0.772SS**PPolyproline II helixtrans-67.7127.2174.424.8-29.2000110.6
15V58.3Low53.4Low137 Ų137138.1 Ų138.183%0.8377%0.771SS**PPolyproline II helixtrans-82.8127.5172.6177.20000108.6Y13Y13-V15 PolarHBondContact O-N 3.34Å
16Q50.4Low53.3Low177 Ų177139.3 Ų139.383%0.82777%0.766SS**PPolyproline II helixtrans-67.9125.8176.4-169.6170.7-300109.7
17P58.8Low53Low103 Ų103137.8 Ų137.867%0.66976%0.762SS**PPolyproline II helixtrans-65.1150.3176.224.6-30.4000110.3G19P17-G19 PolarHBondContact O-N 3Å
18P55Low53.5Low140 Ų140135.8 Ų135.891%0.90976%0.76SS**  trans-73.179.4176.129.9-30.4000109.1
19G47.9Very low53.4Low61 Ų61136.2 Ų136.263%0.62976%0.755SS**  trans-99.2118.8171.300000109P17P17-G19 PolarHBondContact O-N 3Å
20N46.6Very low53.3Low147 Ų147135.7 Ų135.779%0.78675%0.754SS**  trans-49.2133.9171.4-70.2-30.7000110.1V22N20-V22 PolarHBondContact O-N 3.4Å
21P50.5Low54Low92 Ų92137.3 Ų137.360%0.59776%0.762SS**  trans-67.3101.3171.227.2-31.2000108.3Y23P21-Y23 HydrophobicContact CB-CD2 4.09Å; P21-Y23 HydrophobicContact CB-CE2 3.66Å; P21-Y23 HydrophobicContact CG-CD2 4.38Å; P21-Y23 HydrophobicContact CG-CE2 3.71Å; P21-Y23 WeakPolarHBondContact O-CD2 2.93Å; P21-Y23 PolarHBondContact O-N 2.91Å
22V52Low54.1Low134 Ų134136.3 Ų136.381%0.81276%0.762SS**  trans-74.786.7161.7-177.40000105.8N20N20-V22 PolarHBondContact O-N 3.4Å
23Y45.8Very low54.7Low183 Ų183134.9 Ų134.972%0.71876%0.755SS**  trans-60.1129.5161.2-63.4-83.9000107.2P21 Q25P21-Y23 HydrophobicContact CB-CD2 4.09Å; P21-Y23 HydrophobicContact CB-CE2 3.66Å; P21-Y23 HydrophobicContact CG-CD2 4.38Å; P21-Y23 HydrophobicContact CG-CE2 3.71Å; P21-Y23 WeakPolarHBondContact O-CD2 2.93Å; P21-Y23 PolarHBondContact O-N 2.91Å; Y23-Q25 PolarHBondContact O-N 2.85Å
24P51.3Low56Low125 Ų125131.5 Ų131.581%0.81276%0.755SS**  trans-60.5114.4165.724.3-29.9000107.4T26P24-T26 PolarHBondContact O-N 2.72Å
25Q50.2Low55.8Low173 Ų173136.1 Ų136.181%0.80876%0.757SS**  trans-59.3132.1170.5-91.6-155.5-47.200109.5Y23Y23-Q25 PolarHBondContact O-N 2.85Å
26T56Low55.9Low89 Ų89135.7 Ų135.755%0.54676%0.756SS.*  trans52.983.3149.460.80000116.1P24 H28P24-T26 PolarHBondContact O-N 2.72Å; T26-H28 VanDerWaalsContact C-N 3.32Å; T26-H28 PolarHBondContact O-N 3.18Å; T26-H28 PolarHBondContact O-ND1 3.09Å
27L52.5Low56.6Low157 Ų157133.8 Ų133.882%0.82275%0.751SS**  trans-59.7101.8149.5-149.979.4000106.9L29L27-L29 VanDerWaalsContact C-N 3.3Å; L27-L29 HydrophobicContact CB-CD1 4.2Å; L27-L29 HydrophobicContact CD2-CD1 3.86Å; L27-L29 HydrophobicContact CG-CD1 4.27Å; L27-L29 PolarHBondContact O-N 3.07Å
28H58.1Low57Low167 Ų167132.5 Ų132.577%0.77375%0.749SS**  trans-67.492.8172.8-75.484.7000107.7T26T26-H28 VanDerWaalsContact C-N 3.32Å; T26-H28 PolarHBondContact O-N 3.18Å; T26-H28 PolarHBondContact O-ND1 3.09Å
29L56.1Low57.4Low133 Ų133131.2 Ų131.270%0.69674%0.741SS**PPolyproline II helixtrans-69.2133.3166.2-91.875.8000108L27 Q31L27-L29 VanDerWaalsContact C-N 3.3Å; L27-L29 HydrophobicContact CB-CD1 4.2Å; L27-L29 HydrophobicContact CD2-CD1 3.86Å; L27-L29 HydrophobicContact CG-CD1 4.27Å; L27-L29 PolarHBondContact O-N 3.07Å; L29-Q31 PolarHBondContact O-N 3.01Å
30P58.9Low58.1Low125 Ų125133.1 Ų133.181%0.81274%0.742SS**PPolyproline II helixtrans-53.3127.6167.5-20.530.6000109.2A32P30-A32 PolarHBondContact O-N 3.45Å
31Q67.9Low58.6Low194 Ų194129 Ų12991%0.90773%0.728SS**PPolyproline II helixtrans-59127168.2-97.3-176.5-37.100108.2L29L29-Q31 PolarHBondContact O-N 3.01Å
32A60.5Low58.6Low82 Ų82134.5 Ų134.568%0.67874%0.738SS**PPolyproline II helixtrans-58139.5172.400000108.9P30P30-A32 PolarHBondContact O-N 3.45Å
33P73.9Confident58.7Low109 Ų109132.8 Ų132.871%0.70873%0.732SS**PPolyproline II helixtrans-53.2141.2175.8-2129.8000110.1Y35P33-Y35 PolarHBondContact O-N 2.87Å
34P68.3Low59.1Low106 Ų106128.6 Ų128.669%0.68872%0.719SS**PPolyproline II helixtrans-56.4128.5171.522.3-30.8000109T36P34-T36 HydrophobicContact CB-CG2 4.44Å; P34-T36 HydrophobicContact CG-CG2 4.47Å; P34-T36 PolarHBondContact O-N 3.24Å
35Y51.9Low59.1Low224 Ų224128.7 Ų128.788%0.87871%0.713SS**  trans-66.297.6172.7-92-91.2000108.2P33P33-Y35 PolarHBondContact O-N 2.87Å
36T62Low59Low129 Ų129130.5 Ų130.579%0.79171%0.714SS**  trans-95.9-5.9178.154.10000113P34P34-T36 HydrophobicContact CB-CG2 4.44Å; P34-T36 HydrophobicContact CG-CG2 4.47Å; P34-T36 PolarHBondContact O-N 3.24Å
37D64.8Low58.6Low137 Ų137133.2 Ų133.273%0.73371%0.714SS**SBendtrans-102.3120.6-178.4-149.135.7000110.4
38A66.8Low58.4Low75 Ų75130.9 Ų130.962%0.6271%0.708SS**PPolyproline II helixtrans-63.3138.7172.400000108.4
39P63.1Low57.9Low114 Ų114128 Ų12874%0.7471%0.707SS**PPolyproline II helixtrans-54.6138177.322.7-32.2000109.3A41P39-A41 PolarHBondContact O-N 3.45Å
40P62.2Low57.4Low100 Ų100129 Ų12965%0.64971%0.706SS**PPolyproline II helixtrans-50.8128.9-179.9-25.431.8000110.2Y42P40-Y42 PolarHBondContact O-N 3.46Å
41A58.8Low56.6Low61 Ų61128.6 Ų128.650%0.50470%0.701SS.*PPolyproline II helixtrans-57.9134.8174.100000108.7P39 S43 E44P39-A41 PolarHBondContact O-N 3.45Å; A41-S43 PolarHBondContact O-N 2.89Å; A41-E44 PolarHBondContact O-N 2.92Å
42Y48.6Very low55.4Low207 Ų207127.5 Ų127.581%0.81270%0.695SS**THydrogen-bonded Turntrans-52.3-25.2-175.8-127.9-95.6000113.3P40P40-Y42 PolarHBondContact O-N 3.46Å
43S54.9Low54.4Low98 Ų98129.4 Ų129.469%0.68570%0.701SS**THydrogen-bonded Turntrans-69.6-28.7177.6-40.80000114.4A41 L45 Y46A41-S43 PolarHBondContact O-N 2.89Å; S43-L45 VanDerWaalsContact C-N 3.28Å; S43-L45 PolarHBondContact O-N 3.22Å; S43-Y46 PolarHBondContact O-N 2.9Å
44E55.1Low53.1Low95 Ų95128.2 Ų128.244%0.44471%0.708SS.*G310 helixtrans-74.7-19.6179.9-73.8-77.611300112A41 Y46 R47A41-E44 PolarHBondContact O-N 2.92Å; E44-Y46 PolarHBondContact O-N 3.44Å; E44-R47 PolarHBondContact O-N 3.41Å; E44-R47 IonicContact OE1-CZ 3.91Å; E44-R47 IonicContact OE1-NE 3.4Å; E44-R47 PolarHBondContact OE1-NE 3.35Å
45L51.5Low51.5Low128 Ų128126.3 Ų126.367%0.6770%0.701SS**G310 helixtrans-69.4-10.6175.2-69.6169.1000113.8S43S43-L45 VanDerWaalsContact C-N 3.28Å; S43-L45 PolarHBondContact O-N 3.22Å
46Y48.1Very low51.2Low211 Ų211120.8 Ų120.883%0.82770%0.702SS**G310 helixtrans-108.910.7-178.5-120.1-88.5000113.6S43 E44 P48S43-Y46 PolarHBondContact O-N 2.9Å; E44-Y46 PolarHBondContact O-N 3.44Å; Y46-P48 VanDerWaalsContact O-CD 3.31Å; Y46-P48 WeakPolarHBondContact O-CD 3.31Å
47R47.4Very low50Low146 Ų146120 Ų12055%0.55170%0.697SS**  trans-71121.5174.9-93.1-171.8177.1-152.8-2.4110.7E44 S49 F50E44-R47 PolarHBondContact O-N 3.41Å; E44-R47 IonicContact OE1-CZ 3.91Å; E44-R47 IonicContact OE1-NE 3.4Å; E44-R47 PolarHBondContact OE1-NE 3.35Å; R47-S49 PolarHBondContact O-N 3.12Å; R47-F50 HydrophobicContact CB-CD2 4.12Å; R47-F50 HydrophobicContact CB-CE2 4.43Å; R47-F50 PolarHBondContact O-N 3.39Å
48P48.1Very low48.7Very low108 Ų108120 Ų12070%0.70170%0.701SS**G310 helixtrans-65.8-3.3177.1-17.830.3000114.6Y46 F50 V51Y46-P48 VanDerWaalsContact O-CD 3.31Å; Y46-P48 WeakPolarHBondContact O-CD 3.31Å; P48-F50 VanDerWaalsContact C-N 3.3Å; P48-V51 WeakPolarHBondContact O-CG2 3.27Å
49S47.7Very low47.5Very low106 Ų106121.3 Ų121.374%0.74170%0.704SS**G310 helixtrans-80.8-8.9177.9-56.80000113.6R47R47-S49 PolarHBondContact O-N 3.12Å
50F44.4Very low46.5Very low155 Ų155121.6 Ų121.668%0.6870%0.704SS**G310 helixtrans-98.62.6177.2-69.9-74.4000114.3R47 P48 H52R47-F50 HydrophobicContact CB-CD2 4.12Å; R47-F50 HydrophobicContact CB-CE2 4.43Å; R47-F50 PolarHBondContact O-N 3.39Å; P48-F50 VanDerWaalsContact C-N 3.3Å; F50-H52 PolarHBondContact O-N 3.28Å
51V43Very low45.4Very low116 Ų116125.6 Ų125.670%0.70372%0.716SS**  trans-72.895.7167.4-970000108.8P48P48-V51 WeakPolarHBondContact O-CG2 3.27Å
52H41.3Very low44.6Very low170 Ų170126.6 Ų126.679%0.78772%0.719SS**  trans-54.3128.6163.7-100.4-145.4000109.5F50 G54F50-H52 PolarHBondContact O-N 3.28Å; H52-G54 PolarHBondContact O-N 3.37Å
53P40Very low44.1Very low123 Ų123120 Ų12080%0.79971%0.708SS**  trans-66.1120.3169.6-5.219.5000108.3A55P53-A55 PolarHBondContact O-N 2.66Å
54G47.7Very low43.6Very low84 Ų84119.3 Ų119.387%0.86671%0.708SS**  trans24.480.2161.400000117.1H52H52-G54 PolarHBondContact O-N 3.37Å
55A34.1Very low43.2Very low66 Ų66122.2 Ų122.255%0.54572%0.719SS.*  trans-107.3106.8155.300000107.7P53 T57P53-A55 PolarHBondContact O-N 2.66Å; A55-T57 VanDerWaalsContact C-N 3.29Å; A55-T57 HydrophobicContact CB-CG2 4.4Å; A55-T57 PolarHBondContact O-N 2.99Å
56A46.3Very low43.3Very low108 Ų108118.9 Ų118.989%0.89371%0.706SS**  trans-60.592.4164.300000108.7
57T36.3Very low43.8Very low112 Ų112109.9 Ų109.969%0.68768%0.677SS**  trans-137.7102.2172.956.20000110.3A55A55-T57 VanDerWaalsContact C-N 3.29Å; A55-T57 HydrophobicContact CB-CG2 4.4Å; A55-T57 PolarHBondContact O-N 2.99Å
58V36.5Very low44.4Very low136 Ų136105.2 Ų105.282%0.82467%0.669SS**  trans-9.5164.1147.9-69.80000118.7
59P43Very low44.9Very low103 Ų103103.8 Ų103.867%0.66966%0.662SS**  cis-116.5160.4-49.233.9-19.6000110.3M61P59-M61 PolarHBondContact O-N 3.36Å
60T41.3Very low45.6Very low121 Ų121103.3 Ų103.374%0.74265%0.651SS**  trans-54.5105162.4-90.30000108.2S62T60-S62 WeakPolarHBondContact CG2-OG 3.15Å; T60-S62 PolarHBondContact O-N 2.9Å
61M38.4Very low46.2Very low183 Ų183101.9 Ų101.990%0.90164%0.642SS**  trans-7367.7162.2-82.1-165.3163.700107.9P59 A63P59-M61 PolarHBondContact O-N 3.36Å; M61-A63 PolarHBondContact O-N 3.38Å
62S42.2Very low46.9Very low83 Ų83101.5 Ų101.558%0.5864%0.635SS**  trans-65.8120.8148.3-690000104.6T60 A64T60-S62 WeakPolarHBondContact CG2-OG 3.15Å; T60-S62 PolarHBondContact O-N 2.9Å; S62-A64 PolarHBondContact O-N 2.95Å
63A38.3Very low47.3Very low69 Ų6997.2 Ų97.257%0.5762%0.622SS**  trans-44.3118168.800000107.3M61 F65M61-A63 PolarHBondContact O-N 3.38Å; A63-F65 HydrophobicContact CB-CD2 4.13Å; A63-F65 HydrophobicContact CB-CE2 3.85Å; A63-F65 WeakPolarHBondContact O-CD2 3.12Å; A63-F65 PolarHBondContact O-N 3.36Å
64A44.3Very low48.2Very low83 Ų8395.5 Ų95.569%0.68661%0.605SS**  trans-70.675.8-175.400000108.2S62 P66S62-A64 PolarHBondContact O-N 2.95Å; A64-P66 WeakPolarHBondContact O-CD 3.4Å
65F46.2Very low48.7Very low155 Ų15594.6 Ų94.668%0.6859%0.589SS**  trans-62.7122.4164.3-74.9-79.6000106.2A63 G67 A68A63-F65 HydrophobicContact CB-CD2 4.13Å; A63-F65 HydrophobicContact CB-CE2 3.85Å; A63-F65 WeakPolarHBondContact O-CD2 3.12Å; A63-F65 PolarHBondContact O-N 3.36Å; F65-G67 PolarHBondContact O-N 2.89Å; F65-G67 VanDerWaalsContact O-N 3.08Å; F65-A68 WeakPolarHBondContact O-CB 3.21Å; F65-A68 PolarHBondContact O-N 3.35Å
66P53.9Low49.4Very low59 Ų5995 Ų9538%0.38358%0.58SS.*THydrogen-bonded Turntrans-55.8119.2178.1-22.832.3000109.5A64 Y98 V104A64-P66 WeakPolarHBondContact O-CD 3.4Å; P66-Y98 HydrophobicContact CB-CD1 4.32Å; P66-V104 HydrophobicContact CB-CG2 3.78Å
67G58.6Low49.7Very low22 Ų2295.5 Ų95.523%0.22758%0.577CS.*THydrogen-bonded Turntrans94.213.8-17800000115.9F65 S69 Y98F65-G67 PolarHBondContact O-N 2.89Å; F65-G67 VanDerWaalsContact O-N 3.08Å; G67-S69 PolarHBondContact O-N 3.23Å; G67-Y98 VanDerWaalsContact N-CE1 3.34Å
68A60.8Low50.4Low47 Ų4794.5 Ų94.539%0.38857%0.57SS.*PPolyproline II helixtrans-64.9127.2169.800000111.1F65 L70F65-A68 WeakPolarHBondContact O-CB 3.21Å; F65-A68 PolarHBondContact O-N 3.35Å; A68-L70 PolarHBondContact O-N 3.21Å
69S58.9Low51Low79 Ų7993.4 Ų93.455%0.55258%0.575SS**EExtended strand (participates in β ladder)trans-70.8123.6171.2-55.90000109.3G67G67-S69 PolarHBondContact O-N 3.23Å
70L62.2Low51.2Low95 Ų9592.8 Ų92.850%0.49757%0.57SS.*EExtended strand (participates in β ladder)trans-82.7142.6171.9-70.6164.5000109.1A68 V94 I97A68-L70 PolarHBondContact O-N 3.21Å; L70-V94 HydrophobicContact CB-CG1 3.73Å; L70-V94 WeakPolarHBondContact O-CA 3.45Å; L70-V94 WeakPolarHBondContact O-CB 3.33Å; L70-V94 PolarHBondContact O-N 2.98Å; L70-I97 HydrophobicContact CD1-CD1 3.75Å
71Y57.6Low51.7Low126 Ų12689.4 Ų89.449%0.49456%0.559SS.*EExtended strand (participates in β ladder)trans-111.4123.1177-153-131.5000108.9Y91 Y92 P93Y71-Y91 AromaticContact CD1-CD1 3.1Å; Y71-Y91 HydrophobicContact CD1-CD1 3.1Å; Y71-Y91 AromaticContact CD1-CE1 3.82Å; Y71-Y91 HydrophobicContact CD1-CE1 3.82Å; Y71-Y91 AromaticContact CD1-CG 3.6Å; Y71-Y91 HydrophobicContact CD1-CG 3.6Å; Y71-Y91 AromaticContact CE1-CD1 3.13Å; Y71-Y91 HydrophobicContact CE1-CD1 3.13Å; Y71-Y91 AromaticContact CE1-CD2 3.89Å; Y71-Y91 HydrophobicContact CE1-CD2 3.89Å; Y71-Y91 HydrophobicContact CE1-CE1 4.08Å; Y71-Y91 AromaticContact CE1-CG 3.02Å; Y71-Y91 HydrophobicContact CE1-CG 3.02Å; Y71-Y91 WeakPolarHBondContact CE2-O 3.5Å; Y71-Y91 HydrophobicContact CG-CD1 4.26Å; Y71-Y91 AromaticContact CZ-CG 3.87Å; Y71-Y91 WeakPolarHBondContact OH-CB 3.42Å; Y71-Y91 PolarHBondContact OH-O 3.17Å; Y71-Y92 WeakPolarHBondContact CD2-O 3.1Å; Y71-Y92 WeakPolarHBondContact CE2-O 3.21Å; Y71-P93 HydrophobicContact CD2-CB 4.44Å; Y71-P93 HydrophobicContact CE2-CB 4.36Å; Y71-P93 VanDerWaalsContact CE2-N 3.32Å
72L56.3Low52.2Low108 Ų10887.3 Ų87.357%0.56556%0.559SS**EExtended strand (participates in β ladder)trans-97.8120180-76.8158000109.1M74 Y92 V94L72-M74 PolarHBondContact O-N 3.23Å; L72-Y92 PolarHBondContact N-O 3.27Å; L72-Y92 PolarHBondContact O-N 3.24Å; L72-V94 HydrophobicContact CD1-CB 4.36Å; L72-V94 HydrophobicContact CD1-CG2 3.66Å
73P50.6Low52.4Low80 Ų8090 Ų9052%0.51957%0.567SS.*EExtended strand (participates in β ladder)trans-73.4122170.228.2-30000109.2Y91P73-Y91 HydrophobicContact CB-CD1 4.21Å; P73-Y91 HydrophobicContact CB-CE1 3.85Å
74M59.7Low53.2Low86 Ų8691.3 Ų91.342%0.42459%0.586SS.*EExtended strand (participates in β ladder)trans-103.9115.7167.9135.9169.9165.600107.7L72 Q76 A90 Y92L72-M74 PolarHBondContact O-N 3.23Å; M74-Q76 HydrophobicContact CE-CG 3.74Å; M74-Q76 HydrophobicContact CG-CG 4.5Å; M74-Q76 PolarHBondContact O-N 2.9Å; M74-A90 PolarHBondContact N-O 3.21Å; M74-A90 PolarHBondContact O-N 3.41Å; M74-Y92 HydrophobicContact SD-CE2 4.04Å
75A58Low53.2Low66 Ų6690.9 Ų90.955%0.54558%0.578SS.*EExtended strand (participates in β ladder)trans-68.5114.7166.600000107.8S77 M89A75-S77 PolarHBondContact O-N 2.93Å; A75-S77 VanDerWaalsContact O-N 3.09Å; A75-M89 HydrophobicContact CB-SD 4.28Å
76Q48.7Very low53.6Low73 Ų7390.3 Ų90.334%0.34159%0.588SS.*  trans-71.2103.7169.4-71.8-173.6-42.300107.8M74 V78 I87 A90M74-Q76 HydrophobicContact CE-CG 3.74Å; M74-Q76 HydrophobicContact CG-CG 4.5Å; M74-Q76 PolarHBondContact O-N 2.9Å; Q76-V78 VanDerWaalsContact C-N 3.26Å; Q76-V78 PolarHBondContact O-N 3.32Å; Q76-I87 VanDerWaalsContact O-CG2 3.27Å; Q76-I87 WeakPolarHBondContact O-CG2 3.47Å; Q76-A90 HydrophobicContact CG-CB 4.15Å
77S52.3Low53.6Low120 Ų12091.3 Ų91.384%0.83959%0.589SS**  trans-73.883.2172.461.20000109.2A75A75-S77 PolarHBondContact O-N 2.93Å; A75-S77 VanDerWaalsContact O-N 3.09Å
78V50.5Low53.3Low90 Ų9094 Ų9455%0.54560%0.602SS.*  trans-84.6117.7162.2-79.20000107.6Q76 V80Q76-V78 VanDerWaalsContact C-N 3.26Å; Q76-V78 PolarHBondContact O-N 3.32Å; V78-V80 HydrophobicContact CB-CG2 4.09Å; V78-V80 HydrophobicContact CG2-CG2 4.21Å; V78-V80 PolarHBondContact O-N 3.49Å
79A50.1Low53.4Low113 Ų11396.5 Ų96.593%0.93461%0.607SS**  trans-70.382.1171.400000108.6
80V45.8Very low53.7Low90 Ų9093.7 Ų93.755%0.54559%0.588SS.*  trans-105.5126175.1169.60000107.3V78V78-V80 HydrophobicContact CB-CG2 4.09Å; V78-V80 HydrophobicContact CG2-CG2 4.21Å; V78-V80 PolarHBondContact O-N 3.49Å
81G53.3Low53.6Low51 Ų5195 Ų9553%0.52659%0.588SS.*  trans-58.5-178.717700000113.1L83G81-L83 VanDerWaalsContact C-N 3.32Å; G81-L83 PolarHBondContact O-N 2.67Å
82P48.3Very low53.8Low139 Ų13995.5 Ų95.590%0.90359%0.59SS**SBendtrans-6983.6-161.829.9-35.4000112.1
83L46Very low53.9Low140 Ų14095.2 Ų95.273%0.73359%0.594SS**SBendtrans-140.2123.4169.3-67.9173.6000106G81 S85G81-L83 VanDerWaalsContact C-N 3.32Å; G81-L83 PolarHBondContact O-N 2.67Å; L83-S85 PolarHBondContact O-N 3.3Å; L83-S85 PolarHBondContact O-OG 2.94Å
84G54.3Low54.8Low95 Ų9593.7 Ų93.798%0.97958%0.583SS**  trans-52.6114.5-176.900000111.2
85S44.6Very low55.2Low74 Ų7493.9 Ų93.952%0.51759%0.593SS.*  trans-138110.3-172.348.50000110.5L83 I87L83-S85 PolarHBondContact O-N 3.3Å; L83-S85 PolarHBondContact O-OG 2.94Å; S85-I87 PolarHBondContact O-N 2.86Å
86T54.3Low55.9Low144 Ų14492.3 Ų92.388%0.88358%0.577SS**  trans-54105155.8-62.80000107.2
87I54.2Low57Low79 Ų7992.9 Ų92.941%0.40558%0.582SS.*  trans-63.9125.6176.8-58.6-170.3000107.5Q76 S85 M89Q76-I87 VanDerWaalsContact O-CG2 3.27Å; Q76-I87 WeakPolarHBondContact O-CG2 3.47Å; S85-I87 PolarHBondContact O-N 2.86Å; I87-M89 PolarHBondContact O-N 3.49Å; I87-M89 VanDerWaalsContact O-N 3.12Å
88P53.3Low58.2Low78 Ų7887.9 Ų87.951%0.50655%0.545SS..  trans-63.6116.2173.624.6-30.7000108.9A90P88-A90 PolarHBondContact O-N 3.06Å
89M63.5Low59.3Low101 Ų10186.3 Ų86.350%0.49854%0.536SS..EExtended strand (participates in β ladder)trans-78115.7173.6-77.2-65.6-152.500108.9A75 I87 Y91A75-M89 HydrophobicContact CB-SD 4.28Å; I87-M89 PolarHBondContact O-N 3.49Å; I87-M89 VanDerWaalsContact O-N 3.12Å; M89-Y91 HydrophobicContact CB-CD2 4.29Å; M89-Y91 HydrophobicContact CB-CE2 3.96Å; M89-Y91 WeakPolarHBondContact O-CD2 3.19Å
90A64.4Low60.3Low19 Ų1986.6 Ų86.616%0.15753%0.529CS..EExtended strand (participates in β ladder)trans-91.4153.9168.200000109.3M74 Q76 P88 Y92M74-A90 PolarHBondContact N-O 3.21Å; M74-A90 PolarHBondContact O-N 3.41Å; Q76-A90 HydrophobicContact CG-CB 4.15Å; P88-A90 PolarHBondContact O-N 3.06Å; A90-Y92 HydrophobicContact CB-CE2 4.29Å
91Y59.8Low61.6Low122 Ų12284.9 Ų84.948%0.47853%0.529SS..EExtended strand (participates in β ladder)trans-157.1104.2-141.4-113-26.1000102.1Y71 P73 M89Y71-Y91 AromaticContact CD1-CD1 3.1Å; Y71-Y91 HydrophobicContact CD1-CD1 3.1Å; Y71-Y91 AromaticContact CD1-CE1 3.82Å; Y71-Y91 HydrophobicContact CD1-CE1 3.82Å; Y71-Y91 AromaticContact CD1-CG 3.6Å; Y71-Y91 HydrophobicContact CD1-CG 3.6Å; Y71-Y91 AromaticContact CE1-CD1 3.13Å; Y71-Y91 HydrophobicContact CE1-CD1 3.13Å; Y71-Y91 AromaticContact CE1-CD2 3.89Å; Y71-Y91 HydrophobicContact CE1-CD2 3.89Å; Y71-Y91 HydrophobicContact CE1-CE1 4.08Å; Y71-Y91 AromaticContact CE1-CG 3.02Å; Y71-Y91 HydrophobicContact CE1-CG 3.02Å; Y71-Y91 WeakPolarHBondContact CE2-O 3.5Å; Y71-Y91 HydrophobicContact CG-CD1 4.26Å; Y71-Y91 AromaticContact CZ-CG 3.87Å; Y71-Y91 WeakPolarHBondContact OH-CB 3.42Å; Y71-Y91 PolarHBondContact OH-O 3.17Å; P73-Y91 HydrophobicContact CB-CD1 4.21Å; P73-Y91 HydrophobicContact CB-CE1 3.85Å; M89-Y91 HydrophobicContact CB-CD2 4.29Å; M89-Y91 HydrophobicContact CB-CE2 3.96Å; M89-Y91 WeakPolarHBondContact O-CD2 3.19Å
92Y61.2Low62.7Low138 Ų13883.5 Ų83.554%0.54151%0.511SS..EExtended strand (participates in β ladder)trans-115.7133.1-171.5-73.4-80.9000110.8Y71 L72 M74 A90 V94Y71-Y92 WeakPolarHBondContact CD2-O 3.1Å; Y71-Y92 WeakPolarHBondContact CE2-O 3.21Å; L72-Y92 PolarHBondContact N-O 3.27Å; L72-Y92 PolarHBondContact O-N 3.24Å; M74-Y92 HydrophobicContact SD-CE2 4.04Å; A90-Y92 HydrophobicContact CB-CE2 4.29Å; Y92-V94 PolarHBondContact O-N 3.34Å
93P60Low64.1Low102 Ų10281 Ų8166%0.66249%0.494SS*.EExtended strand (participates in β ladder)trans-69.9120.7176.829.6-32.2000109.3Y71Y71-P93 HydrophobicContact CD2-CB 4.44Å; Y71-P93 HydrophobicContact CE2-CB 4.36Å; Y71-P93 VanDerWaalsContact CE2-N 3.32Å
94V68.3Low65.7Low47 Ų4774.7 Ų74.729%0.28546%0.461SS..EExtended strand (participates in β ladder)trans-85.1144.7165.2122.40000108.6L70 L72 Y92 I97L70-V94 HydrophobicContact CB-CG1 3.73Å; L70-V94 WeakPolarHBondContact O-CA 3.45Å; L70-V94 WeakPolarHBondContact O-CB 3.33Å; L70-V94 PolarHBondContact O-N 2.98Å; L72-V94 HydrophobicContact CD1-CB 4.36Å; L72-V94 HydrophobicContact CD1-CG2 3.66Å; Y92-V94 PolarHBondContact O-N 3.34Å; V94-I97 HydrophobicContact CG1-CD1 4.11Å
95S68.6Low67Low90 Ų9075.7 Ų75.763%0.62944%0.443SS*.EExtended strand (participates in β ladder)trans-55.6152.4176.8-57.80000111.6I97S95-I97 PolarHBondContact O-N 3.45Å
96P71.6Confident68.7Low33 Ų3373.6 Ų73.621%0.21443%0.427CS..EExtended strand (participates in β ladder)trans-51.8130176.7-26.634.6000111.8Y98 Q143P96-Y98 HydrophobicContact CB-CE2 4.05Å; P96-Q143 PolarHBondContact O-NE2 3.4Å
97I72.5Confident69.9Low86 Ų8674.7 Ų74.744%0.44142%0.422SS..  trans-105.5126.6173.2-74.9162.7000108.6L70 V94 S95L70-I97 HydrophobicContact CD1-CD1 3.75Å; V94-I97 HydrophobicContact CG1-CD1 4.11Å; S95-I97 PolarHBondContact O-N 3.45Å
98Y77.9Confident71Confident15 Ų1572.4 Ų72.46%0.05942%0.418CS..  trans-106.1109.7174.7-59.1-79000107.5P66 G67 P96 V104 L139 A140P66-Y98 HydrophobicContact CB-CD1 4.32Å; G67-Y98 VanDerWaalsContact N-CE1 3.34Å; P96-Y98 HydrophobicContact CB-CE2 4.05Å; Y98-V104 HydrophobicContact CD1-CG2 3.28Å; Y98-V104 HydrophobicContact CE1-CB 4.48Å; Y98-V104 HydrophobicContact CE1-CG1 4.02Å; Y98-V104 HydrophobicContact CE1-CG2 3.58Å; Y98-V104 HydrophobicContact CG-CG2 4.2Å; Y98-L139 HydrophobicContact CE2-CB 4.01Å; Y98-A140 HydrophobicContact CD1-CB 4.05Å; Y98-A140 VanDerWaalsContact CD2-CA 3.49Å; Y98-A140 HydrophobicContact CD2-CB 3.9Å; Y98-A140 HydrophobicContact CE1-CB 4.04Å; Y98-A140 HydrophobicContact CE2-CB 3.92Å; Y98-A140 HydrophobicContact CG-CB 3.96Å
99P74Confident72.2Confident56 Ų5671 Ų7136%0.36442%0.419SS..  trans-56.1140.9177.7-25.634.4000111.4G101 S102P99-G101 PolarHBondContact O-N 2.97Å; P99-S102 WeakPolarHBondContact O-CB 3.35Å; P99-S102 PolarHBondContact O-N 3.3Å; P99-S102 PolarHBondContact O-OG 3.4Å
100P70.6Confident72.8Confident120 Ų12067.9 Ų67.978%0.77940%0.401SS*.THydrogen-bonded Turntrans-54.8132.5176.2-25.734000111.5S102P100-S102 VanDerWaalsContact C-N 3.25Å; P100-S102 PolarHBondContact O-N 3.45Å
101G72.2Confident73.5Confident54 Ų5470.7 Ų70.756%0.55741%0.414SS*.THydrogen-bonded Turntrans78.9-0.9-177.300000115.3P99 G144P99-G101 PolarHBondContact O-N 2.97Å; G101-G144 PolarHBondContact N-O 3.04Å
102S76.9Confident74.1Confident21 Ų2165.2 Ų65.215%0.14739%0.394CS..  trans-65153.7170.863.70000111.8P99 P100 A145 N146P99-S102 WeakPolarHBondContact O-CB 3.35Å; P99-S102 PolarHBondContact O-N 3.3Å; P99-S102 PolarHBondContact O-OG 3.4Å; P100-S102 VanDerWaalsContact C-N 3.25Å; P100-S102 PolarHBondContact O-N 3.45Å; S102-A145 CarbonylContact O-C 3.58Å; S102-A145 WeakPolarHBondContact O-CA 3.37Å; S102-A145 WeakPolarHBondContact OG-CB 3.44Å; S102-N146 PolarHBondContact O-N 3.15Å
103T77.4Confident74.6Confident86 Ų8659.9 Ų59.953%0.52838%0.381SS..EExtended strand (participates in β ladder)trans-105.5121.6171.432.80000110.5N146 L148T103-N146 CarbonylContact C-O 3.55Å; T103-N146 VanDerWaalsContact CA-O 3.24Å; T103-N146 WeakPolarHBondContact CA-O 3.44Å; T103-N146 HydrophobicContact CG2-CB 3.64Å; T103-L148 HydrophobicContact CG2-CD1 4.36Å
104V79.2Confident75.3Confident9 Ų956.1 Ų56.16%0.05536%0.358CS..EExtended strand (participates in β ladder)trans-107.1123.5177.81800000108.9P66 Y98 V106 A140 A145 N146 V147 L148P66-V104 HydrophobicContact CB-CG2 3.78Å; Y98-V104 HydrophobicContact CD1-CG2 3.28Å; Y98-V104 HydrophobicContact CE1-CB 4.48Å; Y98-V104 HydrophobicContact CE1-CG1 4.02Å; Y98-V104 HydrophobicContact CE1-CG2 3.58Å; Y98-V104 HydrophobicContact CG-CG2 4.2Å; V104-V106 HydrophobicContact CG1-CG2 4.01Å; V104-A140 HydrophobicContact CB-CB 4.09Å; V104-A140 HydrophobicContact CG1-CB 4.19Å; V104-A140 HydrophobicContact CG2-CB 3.79Å; V104-A145 HydrophobicContact CG2-CB 3.99Å; V104-N146 PolarHBondContact N-O 2.88Å; V104-V147 HydrophobicContact CB-CG2 4.45Å; V104-V147 CarbonylContact O-C 3.59Å; V104-V147 WeakPolarHBondContact O-CA 3.36Å; V104-L148 PolarHBondContact O-N 2.58Å
105L82.4Confident75.4Confident116 Ų11661.7 Ų61.761%0.60737%0.374SS*.EExtended strand (participates in β ladder)trans-95.8121.7172.3-172.4143.2000109.7E107 L148L105-E107 HydrophobicContact CD2-CB 4.26Å; L105-L148 CarbonylContact C-O 3.48Å; L105-L148 VanDerWaalsContact CA-O 3.28Å; L105-L148 WeakPolarHBondContact CA-O 3.42Å
106V80Confident75.5Confident29 Ų2961.5 Ų61.518%0.17636%0.362CS..EExtended strand (participates in β ladder)trans-112107.1174.8-1760000108.3V104 A137 V147 L148 V149 T150V104-V106 HydrophobicContact CG1-CG2 4.01Å; V106-A137 HydrophobicContact CG1-CB 4.48Å; V106-A137 HydrophobicContact CG2-CB 3.92Å; V106-V147 HydrophobicContact CG2-CG1 3.93Å; V106-L148 PolarHBondContact N-O 2.9Å; V106-V149 HydrophobicContact CB-CB 4.44Å; V106-V149 HydrophobicContact CB-CG1 4.27Å; V106-V149 HydrophobicContact CB-CG2 3.93Å; V106-V149 HydrophobicContact CG1-CG1 4.46Å; V106-V149 HydrophobicContact CG2-CG2 4.34Å; V106-V149 CarbonylContact O-C 3.49Å; V106-V149 VanDerWaalsContact O-CA 3.29Å; V106-V149 WeakPolarHBondContact O-CA 3.5Å; V106-T150 PolarHBondContact O-N 2.99Å
107E79.8Confident75.3Confident167 Ų16762.6 Ų62.678%0.7838%0.379SS*.EExtended strand (participates in β ladder)trans-76.9133.7-178.3-164.3175.4172.200111.3L105 G109 T150L105-E107 HydrophobicContact CD2-CB 4.26Å; E107-G109 PolarHBondContact O-N 3.01Å; E107-T150 VanDerWaalsContact CA-OG1 3.27Å; E107-T150 WeakPolarHBondContact CA-OG1 3.5Å; E107-T150 WeakPolarHBondContact CG-OG1 3.39Å
108G78.1Confident74.2Confident31 Ų3164.2 Ų64.232%0.3241%0.406SS..EExtended strand (participates in β ladder)trans67.315174.200000115.4Y110 T150G108-Y110 VanDerWaalsContact C-N 3.26Å; G108-Y110 PolarHBondContact O-N 3.08Å; G108-T150 CarbonylContact C-O 3.34Å; G108-T150 VanDerWaalsContact CA-O 3.31Å; G108-T150 WeakPolarHBondContact CA-O 3.27Å; G108-T150 PolarHBondContact N-O 3.11Å; G108-T150 PolarHBondContact N-OG1 3.09Å
109G76.9Confident73.1Confident50 Ų5066.8 Ų66.852%0.51544%0.437SS..EExtended strand (participates in β ladder)trans-72.1-17.8-178.100000114.2E107 V149 T150E107-G109 PolarHBondContact O-N 3.01Å; G109-V149 VanDerWaalsContact CA-CG1 3.45Å; G109-T150 PolarHBondContact N-O 2.97Å
110Y77.6Confident72.2Confident34 Ų3466.5 Ų66.513%0.13344%0.439CS..EExtended strand (participates in β ladder)trans-99.3150.8171.5-68.8-61.6000112.3G108 A114 F116 V149 T150 R152G108-Y110 VanDerWaalsContact C-N 3.26Å; G108-Y110 PolarHBondContact O-N 3.08Å; Y110-A114 HydrophobicContact CG-CB 4.42Å; Y110-F116 HydrophobicContact CD1-CE1 4.08Å; Y110-F116 AromaticContact CD1-CZ 3.97Å; Y110-F116 HydrophobicContact CD1-CZ 3.97Å; Y110-F116 AromaticContact CD2-CE1 3.63Å; Y110-F116 HydrophobicContact CD2-CE1 3.63Å; Y110-F116 HydrophobicContact CD2-CE2 4.13Å; Y110-F116 AromaticContact CD2-CZ 3.15Å; Y110-F116 HydrophobicContact CD2-CZ 3.15Å; Y110-F116 AromaticContact CE1-CE1 3.89Å; Y110-F116 HydrophobicContact CE1-CE1 3.89Å; Y110-F116 HydrophobicContact CE1-CZ 4.24Å; Y110-F116 HydrophobicContact CE2-CD1 4.42Å; Y110-F116 AromaticContact CE2-CE1 3.33Å; Y110-F116 HydrophobicContact CE2-CE1 3.33Å; Y110-F116 HydrophobicContact CE2-CE2 4.48Å; Y110-F116 AromaticContact CE2-CZ 3.39Å; Y110-F116 HydrophobicContact CE2-CZ 3.39Å; Y110-F116 AromaticContact CG-CE1 3.97Å; Y110-F116 HydrophobicContact CG-CE1 3.97Å; Y110-F116 AromaticContact CG-CZ 3.45Å; Y110-F116 HydrophobicContact CG-CZ 3.45Å; Y110-F116 VanDerWaalsContact CG-CZ 3.45Å; Y110-F116 AromaticContact CZ-CE1 3.53Å; Y110-F116 AromaticContact CZ-CZ 3.98Å; Y110-V149 HydrophobicContact CD2-CB 3.65Å; Y110-V149 HydrophobicContact CD2-CG1 3.46Å; Y110-V149 VanDerWaalsContact CD2-CG1 3.46Å; Y110-V149 WeakPolarHBondContact CD2-O 3.29Å; Y110-V149 HydrophobicContact CE2-CB 3.38Å; Y110-V149 HydrophobicContact CE2-CG1 3.7Å; Y110-V149 HydrophobicContact CE2-CG2 4.39Å; Y110-V149 WeakPolarHBondContact CE2-O 3.31Å; Y110-V149 HydrophobicContact CG-CG1 3.97Å; Y110-T150 PolarHBondContact N-O 3.05Å; Y110-T150 VanDerWaalsContact N-O 3.14Å; Y110-R152 WeakPolarHBondContact O-CG 3.43Å; Y110-R152 PolarHBondContact O-N 2.79Å
111D78.6Confident71.3Confident78 Ų7866.1 Ų66.142%0.41744%0.435SS..  trans-57.5153.7168.3-172.7-94000111.3G113 A114 Q151 R152D111-G113 PolarHBondContact O-N 3Å; D111-G113 WeakPolarHBondContact OD1-CA 3.49Å; D111-G113 PolarHBondContact OD1-N 2.75Å; D111-A114 VanDerWaalsContact O-CB 3.29Å; D111-A114 WeakPolarHBondContact O-CB 3.24Å; D111-A114 PolarHBondContact O-N 2.9Å; D111-A114 VanDerWaalsContact O-N 3.09Å; D111-Q151 PolarHBondContact O-OE1 3.25Å; D111-Q151 VanDerWaalsContact O-OE1 3.11Å; D111-R152 IonicContact OD2-CZ 2.97Å; D111-R152 IonicContact OD2-NE 3.04Å; D111-R152 PolarHBondContact OD2-NE 2.71Å; D111-R152 IonicContact OD2-NH1 3.92Å; D111-R152 IonicContact OD2-NH2 2.63Å; D111-R152 PolarHBondContact OD2-NH2 3.4Å
112A72.9Confident70.4Confident8 Ų866 Ų667%0.06643%0.428CS..THydrogen-bonded Turntrans-70.5-16.3-178.200000112.2Q151 R152 S161A112-Q151 PolarHBondContact O-OE1 3.22Å; A112-R152 HydrophobicContact CB-CG 3.77Å; A112-R152 WeakPolarHBondContact CB-O 3.36Å; A112-S161 PolarHBondContact O-OG 2.86Å
113G71.5Confident69.4Low26 Ų2667.6 Ų67.627%0.26845%0.448SS..THydrogen-bonded Turntrans-95.8-1.2173.500000114.4D111 R115 S161D111-G113 PolarHBondContact O-N 3Å; D111-G113 WeakPolarHBondContact OD1-CA 3.49Å; D111-G113 PolarHBondContact OD1-N 2.75Å; G113-R115 PolarHBondContact O-N 3.27Å; G113-R115 PolarHBondContact O-NH1 3.35Å; G113-R115 VanDerWaalsContact O-NH1 3.15Å; G113-S161 WeakPolarHBondContact CA-OG 3.47Å
114A74.2Confident68.8Low22 Ų2268.6 Ų68.618%0.18245%0.45CS..  trans-61.6138.1-178.500000110.8Y110 D111 F116 Q151Y110-A114 HydrophobicContact CG-CB 4.42Å; D111-A114 VanDerWaalsContact O-CB 3.29Å; D111-A114 WeakPolarHBondContact O-CB 3.24Å; D111-A114 PolarHBondContact O-N 2.9Å; D111-A114 VanDerWaalsContact O-N 3.09Å; A114-F116 HydrophobicContact CB-CE2 4.21Å; A114-F116 HydrophobicContact CB-CZ 3.77Å; A114-Q151 HydrophobicContact CB-CG 4.41Å; A114-Q151 PolarHBondContact O-NE2 3.11Å; A114-Q151 VanDerWaalsContact O-NE2 3.13Å; A114-Q151 PolarHBondContact O-OE1 2.85Å
115R70.2Confident68.5Low165 Ų16569.5 Ų69.562%0.62345%0.454SS*.  trans-118.1125.4-180-61.9-65.3177.2-102.72109.1G113 S161G113-R115 PolarHBondContact O-N 3.27Å; G113-R115 PolarHBondContact O-NH1 3.35Å; G113-R115 VanDerWaalsContact O-NH1 3.15Å; R115-S161 PolarHBondContact NH1-OG 3.21Å; R115-S161 VanDerWaalsContact NH2-CB 3.33Å; R115-S161 PolarHBondContact NH2-OG 3.03Å
116F72Confident68.1Low86 Ų8668 Ų6838%0.37745%0.452SS..  trans-105105.9176.3-52.7-71.1000107.2Y110 A114 A120 Q151Y110-F116 HydrophobicContact CD1-CE1 4.08Å; Y110-F116 AromaticContact CD1-CZ 3.97Å; Y110-F116 HydrophobicContact CD1-CZ 3.97Å; Y110-F116 AromaticContact CD2-CE1 3.63Å; Y110-F116 HydrophobicContact CD2-CE1 3.63Å; Y110-F116 HydrophobicContact CD2-CE2 4.13Å; Y110-F116 AromaticContact CD2-CZ 3.15Å; Y110-F116 HydrophobicContact CD2-CZ 3.15Å; Y110-F116 AromaticContact CE1-CE1 3.89Å; Y110-F116 HydrophobicContact CE1-CE1 3.89Å; Y110-F116 HydrophobicContact CE1-CZ 4.24Å; Y110-F116 HydrophobicContact CE2-CD1 4.42Å; Y110-F116 AromaticContact CE2-CE1 3.33Å; Y110-F116 HydrophobicContact CE2-CE1 3.33Å; Y110-F116 HydrophobicContact CE2-CE2 4.48Å; Y110-F116 AromaticContact CE2-CZ 3.39Å; Y110-F116 HydrophobicContact CE2-CZ 3.39Å; Y110-F116 AromaticContact CG-CE1 3.97Å; Y110-F116 HydrophobicContact CG-CE1 3.97Å; Y110-F116 AromaticContact CG-CZ 3.45Å; Y110-F116 HydrophobicContact CG-CZ 3.45Å; Y110-F116 VanDerWaalsContact CG-CZ 3.45Å; Y110-F116 AromaticContact CZ-CE1 3.53Å; Y110-F116 AromaticContact CZ-CZ 3.98Å; A114-F116 HydrophobicContact CB-CE2 4.21Å; A114-F116 HydrophobicContact CB-CZ 3.77Å; F116-A120 HydrophobicContact CB-CB 3.7Å; F116-A120 HydrophobicContact CD1-CB 4.28Å; F116-A120 HydrophobicContact CG-CB 4.49Å; F116-Q151 HydrophobicContact CE2-CG 3.73Å; F116-Q151 HydrophobicContact CZ-CG 4.25Å
117G66.6Low67.8Low55 Ų5571.9 Ų71.957%0.56748%0.478SS*.  trans-68.9166.6175.800000112G119 A120G117-G119 PolarHBondContact O-N 3.15Å; G117-A120 VanDerWaalsContact O-CB 3.31Å; G117-A120 WeakPolarHBondContact O-CB 3.36Å; G117-A120 PolarHBondContact O-N 2.84Å
118A49.6Very low67.8Low121 Ų12166.3 Ų66.3100%146%0.456SS*.THydrogen-bonded Turntrans-59.8109.3169.400000109.1
119G54.1Low68Low69 Ų6968.4 Ų68.471%0.71146%0.464SS*.THydrogen-bonded Turntrans111.4-0.8-172.500000115.2G117 T121G117-G119 PolarHBondContact O-N 3.15Å; G119-T121 VanDerWaalsContact C-N 3.27Å; G119-T121 PolarHBondContact O-N 3.17Å
120A54.8Low68.3Low49 Ų4972.5 Ų72.541%0.40548%0.481SS..  trans-68.785.4169.700000110.1F116 G117F116-A120 HydrophobicContact CB-CB 3.7Å; F116-A120 HydrophobicContact CD1-CB 4.28Å; F116-A120 HydrophobicContact CG-CB 4.49Å; G117-A120 VanDerWaalsContact O-CB 3.31Å; G117-A120 WeakPolarHBondContact O-CB 3.36Å; G117-A120 PolarHBondContact O-N 2.84Å
121T52.6Low68.6Low113 Ų11375.1 Ų75.169%0.69352%0.518SS*.  trans-70.6167.9171.546.60000110.8G119 G123G119-T121 VanDerWaalsContact C-N 3.27Å; G119-T121 PolarHBondContact O-N 3.17Å; T121-G123 PolarHBondContact O-N 2.68Å
122A52.6Low68.8Low51 Ų5174.7 Ų74.742%0.42152%0.521SS..THydrogen-bonded Turntrans-54.518.2176.600000116.7V147A122-V147 WeakPolarHBondContact CB-O 3.29Å
123G55.8Low69Low55 Ų5579.8 Ų79.857%0.56755%0.553SS**THydrogen-bonded Turntrans-117.79-174.800000115.2T121 I125T121-G123 PolarHBondContact O-N 2.68Å; G123-I125 PolarHBondContact O-N 2.8Å; G123-I125 VanDerWaalsContact O-N 3.17Å
124N64.9Low69.5Low106 Ų10680.9 Ų80.957%0.56756%0.556SS**  trans-82.922.3176.9-147.276.6000113.4P126N124-P126 WeakPolarHBondContact O-CD 3.35Å
125I73.8Confident69.8Low28 Ų2883.9 Ų83.914%0.14457%0.569CS.*  trans-76.1114.7173-53.3-59.8000107.2G123 A137 Q138 V141 V149G123-I125 PolarHBondContact O-N 2.8Å; G123-I125 VanDerWaalsContact O-N 3.17Å; I125-A137 HydrophobicContact CD1-CB 4.03Å; I125-A137 HydrophobicContact CG1-CB 4.45Å; I125-A137 HydrophobicContact CG2-CB 4.18Å; I125-Q138 HydrophobicContact CG2-CB 4.47Å; I125-Q138 HydrophobicContact CG2-CG 3.49Å; I125-Q138 VanDerWaalsContact CG2-CG 3.49Å; I125-V141 HydrophobicContact CB-CG2 4.35Å; I125-V141 HydrophobicContact CG1-CG2 3.94Å; I125-V149 HydrophobicContact CD1-CB 4.31Å; I125-V149 HydrophobicContact CD1-CG2 3.43Å; I125-V149 VanDerWaalsContact CD1-CG2 3.43Å
126P73.3Confident70.2Confident86 Ų8678.4 Ų78.456%0.55856%0.559SS**PPolyproline II helixtrans-63.9150.8179.627.3-33.8000110.1N124 Q138N124-P126 WeakPolarHBondContact O-CD 3.35Å; P126-Q138 PolarHBondContact O-NE2 2.92Å
127P74.9Confident70.6Confident110 Ų11074.5 Ų74.571%0.71454%0.543SS*.PPolyproline II helixtrans-59.9153.4173.326.3-34000111
128P78.9Confident71.3Confident49 Ų4972.6 Ų72.632%0.31852%0.519SS..PPolyproline II helixtrans-56.6136.5175.9-20.930.4000111.2P134 Q138P128-P134 HydrophobicContact CB-CB 4.47Å; P128-P134 HydrophobicContact CB-CG 4.33Å; P128-P134 HydrophobicContact CG-CB 3.88Å; P128-P134 HydrophobicContact CG-CG 3.86Å; P128-Q138 HydrophobicContact CG-CB 4.41Å; P128-Q138 HydrophobicContact CG-CG 4.4Å
129P81.6Confident72.9Confident75 Ų7569.2 Ų69.249%0.48748%0.484SS..PPolyproline II helixtrans-59.1146.3171.6-22.132.5000111.3G131 C132P129-G131 PolarHBondContact O-N 3Å; P129-C132 HydrophobicContact CB-CB 4.12Å; P129-C132 HydrophobicContact CG-CB 4.35Å; P129-C132 PolarHBondContact O-N 2.9Å
130P83.4Confident74Confident136 Ų13666 Ų6688%0.88345%0.45SS*.THydrogen-bonded Turntrans-54.6128.1175-25.534.6000111.7C132P130-C132 VanDerWaalsContact C-N 3.26Å; P130-C132 PolarHBondContact O-N 3.01Å
131G84.1Confident75.2Confident89 Ų8966.5 Ų66.592%0.91845%0.448SS*.THydrogen-bonded Turntrans80.5-5.2179.700000115.5P129P129-G131 PolarHBondContact O-N 3Å
132C82.3Confident76.6Confident69 Ų6967.7 Ų67.747%0.46645%0.447SS..SBendtrans-97.7134.2172.8-66.30000110.6P129 P130P129-C132 HydrophobicContact CB-CB 4.12Å; P129-C132 HydrophobicContact CG-CB 4.35Å; P129-C132 PolarHBondContact O-N 2.9Å; P130-C132 VanDerWaalsContact C-N 3.26Å; P130-C132 PolarHBondContact O-N 3.01Å
133P79.1Confident78Confident115 Ų11568.3 Ų68.375%0.74744%0.442SS*.PPolyproline II helixtrans-62.8145.5172.826.7-32.9000110.5
134P80.4Confident78.9Confident50 Ų5068 Ų6833%0.32544%0.438SS..PPolyproline II helixtrans-60.8143177.3-21.532000112.4P128 Q138 L139P128-P134 HydrophobicContact CB-CB 4.47Å; P128-P134 HydrophobicContact CB-CG 4.33Å; P128-P134 HydrophobicContact CG-CB 3.88Å; P128-P134 HydrophobicContact CG-CG 3.86Å; P134-Q138 VanDerWaalsContact CA-OE1 3.31Å; P134-Q138 HydrophobicContact CB-CB 3.99Å; P134-L139 HydrophobicContact CB-CD2 3.89Å; P134-L139 HydrophobicContact CB-CG 4.04Å; P134-L139 HydrophobicContact CG-CD2 4.29Å
135N80.8Confident79.6Confident84 Ų8463.4 Ų63.445%0.44942%0.415SS..PPolyproline II helixtrans-80.4171.4173.373.622.5000111.9A137 Q138 L139N135-A137 VanDerWaalsContact C-N 3.29Å; N135-A137 PolarHBondContact O-N 3.26Å; N135-A137 WeakPolarHBondContact OD1-CB 3.24Å; N135-A137 PolarHBondContact OD1-N 3.37Å; N135-A137 VanDerWaalsContact OD1-N 3.15Å; N135-Q138 WeakPolarHBondContact O-CB 3.5Å; N135-Q138 PolarHBondContact O-N 3.06Å; N135-Q138 VanDerWaalsContact O-N 3.11Å; N135-Q138 WeakPolarHBondContact OD1-CB 3.43Å; N135-Q138 VanDerWaalsContact OD1-CG 3.24Å; N135-Q138 WeakPolarHBondContact OD1-CG 3.3Å; N135-Q138 PolarHBondContact OD1-N 2.78Å; N135-L139 WeakPolarHBondContact O-CG 3.37Å; N135-L139 PolarHBondContact O-N 2.79Å
136A78.5Confident79.9Confident50 Ų5066 Ų6641%0.41343%0.429SS..Hα-helixtrans-57.8-37.5-177.500000113.7A140A136-A140 VanDerWaalsContact O-CB 3.3Å; A136-A140 WeakPolarHBondContact O-CB 3.43Å; A136-A140 PolarHBondContact O-N 2.78Å
137A81.5Confident80.1Confident5 Ų562.1 Ų62.14%0.04140%0.404CS..Hα-helixtrans-64.9-45.2176.400000111.2V106 I125 N135 A140 V141 V147 V149V106-A137 HydrophobicContact CG1-CB 4.48Å; V106-A137 HydrophobicContact CG2-CB 3.92Å; I125-A137 HydrophobicContact CD1-CB 4.03Å; I125-A137 HydrophobicContact CG1-CB 4.45Å; I125-A137 HydrophobicContact CG2-CB 4.18Å; N135-A137 VanDerWaalsContact C-N 3.29Å; N135-A137 PolarHBondContact O-N 3.26Å; N135-A137 WeakPolarHBondContact OD1-CB 3.24Å; N135-A137 PolarHBondContact OD1-N 3.37Å; N135-A137 VanDerWaalsContact OD1-N 3.15Å; A137-A140 PolarHBondContact O-N 2.83Å; A137-V141 WeakPolarHBondContact O-CG2 3.35Å; A137-V141 PolarHBondContact O-N 3.39Å; A137-V147 HydrophobicContact CB-CG1 4.01Å; A137-V149 HydrophobicContact CB-CG2 4.26Å
138Q80.6Confident80.5Confident14 Ų1461.8 Ų61.87%0.06540%0.396CS..Hα-helixtrans-64.2-44.2178.5-70.6164.1-20.200111I125 P126 P128 P134 N135 A140 V141 M142I125-Q138 HydrophobicContact CG2-CB 4.47Å; I125-Q138 HydrophobicContact CG2-CG 3.49Å; I125-Q138 VanDerWaalsContact CG2-CG 3.49Å; P126-Q138 PolarHBondContact O-NE2 2.92Å; P128-Q138 HydrophobicContact CG-CB 4.41Å; P128-Q138 HydrophobicContact CG-CG 4.4Å; P134-Q138 VanDerWaalsContact CA-OE1 3.31Å; P134-Q138 HydrophobicContact CB-CB 3.99Å; N135-Q138 WeakPolarHBondContact O-CB 3.5Å; N135-Q138 PolarHBondContact O-N 3.06Å; N135-Q138 VanDerWaalsContact O-N 3.11Å; N135-Q138 WeakPolarHBondContact OD1-CB 3.43Å; N135-Q138 VanDerWaalsContact OD1-CG 3.24Å; N135-Q138 WeakPolarHBondContact OD1-CG 3.3Å; N135-Q138 PolarHBondContact OD1-N 2.78Å; Q138-A140 VanDerWaalsContact C-N 3.33Å; Q138-A140 PolarHBondContact O-N 3.14Å; Q138-V141 PolarHBondContact O-N 2.94Å; Q138-M142 WeakPolarHBondContact O-CB 3.42Å; Q138-M142 WeakPolarHBondContact O-CG 3.28Å; Q138-M142 PolarHBondContact O-N 3.46Å
139L82.5Confident80.6Confident51 Ų5160.5 Ų60.527%0.26739%0.387SS..Hα-helixtrans-61.3-41.8175.7-69.8175.6000112Y98 P134 N135 M142 Q143Y98-L139 HydrophobicContact CE2-CB 4.01Å; P134-L139 HydrophobicContact CB-CD2 3.89Å; P134-L139 HydrophobicContact CB-CG 4.04Å; P134-L139 HydrophobicContact CG-CD2 4.29Å; N135-L139 WeakPolarHBondContact O-CG 3.37Å; N135-L139 PolarHBondContact O-N 2.79Å; L139-M142 PolarHBondContact O-N 3.24Å; L139-Q143 WeakPolarHBondContact O-CG 3.45Å; L139-Q143 PolarHBondContact O-N 3.26Å; L139-Q143 VanDerWaalsContact O-N 3.17Å
140A78.7Confident80.5Confident0 Ų059.6 Ų59.60%038%0.38CS..Hα-helixtrans-64.6-44.4177.300000112.3Y98 V104 A136 A137 Q138 M142 Q143 G144 A145 V147Y98-A140 HydrophobicContact CD1-CB 4.05Å; Y98-A140 VanDerWaalsContact CD2-CA 3.49Å; Y98-A140 HydrophobicContact CD2-CB 3.9Å; Y98-A140 HydrophobicContact CE1-CB 4.04Å; Y98-A140 HydrophobicContact CE2-CB 3.92Å; Y98-A140 HydrophobicContact CG-CB 3.96Å; V104-A140 HydrophobicContact CB-CB 4.09Å; V104-A140 HydrophobicContact CG1-CB 4.19Å; V104-A140 HydrophobicContact CG2-CB 3.79Å; A136-A140 VanDerWaalsContact O-CB 3.3Å; A136-A140 WeakPolarHBondContact O-CB 3.43Å; A136-A140 PolarHBondContact O-N 2.78Å; A137-A140 PolarHBondContact O-N 2.83Å; Q138-A140 VanDerWaalsContact C-N 3.33Å; Q138-A140 PolarHBondContact O-N 3.14Å; A140-M142 PolarHBondContact O-N 3.13Å; A140-Q143 PolarHBondContact O-N 2.9Å; A140-G144 PolarHBondContact O-N 2.63Å; A140-A145 HydrophobicContact CB-CB 4.2Å; A140-A145 WeakPolarHBondContact O-CB 3.31Å; A140-A145 PolarHBondContact O-N 2.75Å; A140-V147 HydrophobicContact CB-CG2 3.49Å; A140-V147 VanDerWaalsContact CB-CG2 3.49Å
141V79.4Confident80.3Confident61 Ų6156.5 Ų56.537%0.3735%0.353SS..Hα-helixtrans-61.3-44.8175172.70000111I125 A137 Q138 Q143 G144 V147I125-V141 HydrophobicContact CB-CG2 4.35Å; I125-V141 HydrophobicContact CG1-CG2 3.94Å; A137-V141 WeakPolarHBondContact O-CG2 3.35Å; A137-V141 PolarHBondContact O-N 3.39Å; Q138-V141 PolarHBondContact O-N 2.94Å; V141-Q143 PolarHBondContact O-N 3.17Å; V141-G144 PolarHBondContact O-N 3.06Å; V141-V147 HydrophobicContact CB-CG2 4.48Å; V141-V147 HydrophobicContact CG2-CB 4.04Å; V141-V147 HydrophobicContact CG2-CG2 3.52Å
142M82.6Confident80.1Confident137 Ų13756.6 Ų56.668%0.67533%0.326SS*.Hα-helixtrans-60.9-27.9179.4-73175.173.900113Q138 L139 A140Q138-M142 WeakPolarHBondContact O-CB 3.42Å; Q138-M142 WeakPolarHBondContact O-CG 3.28Å; Q138-M142 PolarHBondContact O-N 3.46Å; L139-M142 PolarHBondContact O-N 3.24Å; A140-M142 PolarHBondContact O-N 3.13Å
143Q80.4Confident79.7Confident65 Ų6562.3 Ų62.330%0.30434%0.343SS..THydrogen-bonded Turntrans-92.65.5179-65.3-17930.600113.5P96 L139 A140 V141P96-Q143 PolarHBondContact O-NE2 3.4Å; L139-Q143 WeakPolarHBondContact O-CG 3.45Å; L139-Q143 PolarHBondContact O-N 3.26Å; L139-Q143 VanDerWaalsContact O-N 3.17Å; A140-Q143 PolarHBondContact O-N 2.9Å; V141-Q143 PolarHBondContact O-N 3.17Å
144G75.7Confident79Confident48 Ų4858.8 Ų58.850%0.49533%0.327SS..THydrogen-bonded Turntrans79.321.7177.100000114.3G101 A140 V141G101-G144 PolarHBondContact N-O 3.04Å; A140-G144 PolarHBondContact O-N 2.63Å; V141-G144 PolarHBondContact O-N 3.06Å
145A79.4Confident78Confident9 Ų960.6 Ų60.67%0.07433%0.334CS..  trans-83.1148.9169.700000111.2S102 V104 A140S102-A145 CarbonylContact O-C 3.58Å; S102-A145 WeakPolarHBondContact O-CA 3.37Å; S102-A145 WeakPolarHBondContact OG-CB 3.44Å; V104-A145 HydrophobicContact CG2-CB 3.99Å; A140-A145 HydrophobicContact CB-CB 4.2Å; A140-A145 WeakPolarHBondContact O-CB 3.31Å; A140-A145 PolarHBondContact O-N 2.75Å
146N79.9Confident77Confident84 Ų8466.6 Ų66.645%0.44936%0.357SS..EExtended strand (participates in β ladder)trans-75.9120.7168.2-68.5-65.4000108.8S102 T103 V104S102-N146 PolarHBondContact O-N 3.15Å; T103-N146 CarbonylContact C-O 3.55Å; T103-N146 VanDerWaalsContact CA-O 3.24Å; T103-N146 WeakPolarHBondContact CA-O 3.44Å; T103-N146 HydrophobicContact CG2-CB 3.64Å; V104-N146 PolarHBondContact N-O 2.88Å
147V78.5Confident76.1Confident3 Ų373.6 Ų73.62%0.01838%0.378CS..EExtended strand (participates in β ladder)trans-109117.5-177-169.80000111V104 V106 A122 A137 A140 V141 V149V104-V147 HydrophobicContact CB-CG2 4.45Å; V104-V147 CarbonylContact O-C 3.59Å; V104-V147 WeakPolarHBondContact O-CA 3.36Å; V106-V147 HydrophobicContact CG2-CG1 3.93Å; A122-V147 WeakPolarHBondContact CB-O 3.29Å; A137-V147 HydrophobicContact CB-CG1 4.01Å; A140-V147 HydrophobicContact CB-CG2 3.49Å; A140-V147 VanDerWaalsContact CB-CG2 3.49Å; V141-V147 HydrophobicContact CB-CG2 4.48Å; V141-V147 HydrophobicContact CG2-CB 4.04Å; V141-V147 HydrophobicContact CG2-CG2 3.52Å; V147-V149 HydrophobicContact CG1-CG2 3.55Å
148L82.4Confident74.9Confident104 Ų10479.6 Ų79.655%0.54541%0.407SS..EExtended strand (participates in β ladder)trans-97.4115.5171.4-79.3148.9000108.1T103 V104 L105 V106T103-L148 HydrophobicContact CG2-CD1 4.36Å; V104-L148 PolarHBondContact O-N 2.58Å; L105-L148 CarbonylContact C-O 3.48Å; L105-L148 VanDerWaalsContact CA-O 3.28Å; L105-L148 WeakPolarHBondContact CA-O 3.42Å; V106-L148 PolarHBondContact N-O 2.9Å
149V81Confident73.7Confident22 Ų2281.2 Ų81.213%0.13343%0.427CS..EExtended strand (participates in β ladder)trans-116129.2-179.9-175.80000109.6V106 G109 Y110 I125 A137 V147V106-V149 HydrophobicContact CB-CB 4.44Å; V106-V149 HydrophobicContact CB-CG1 4.27Å; V106-V149 HydrophobicContact CB-CG2 3.93Å; V106-V149 HydrophobicContact CG1-CG1 4.46Å; V106-V149 HydrophobicContact CG2-CG2 4.34Å; V106-V149 CarbonylContact O-C 3.49Å; V106-V149 VanDerWaalsContact O-CA 3.29Å; V106-V149 WeakPolarHBondContact O-CA 3.5Å; G109-V149 VanDerWaalsContact CA-CG1 3.45Å; Y110-V149 HydrophobicContact CD2-CB 3.65Å; Y110-V149 HydrophobicContact CD2-CG1 3.46Å; Y110-V149 VanDerWaalsContact CD2-CG1 3.46Å; Y110-V149 WeakPolarHBondContact CD2-O 3.29Å; Y110-V149 HydrophobicContact CE2-CB 3.38Å; Y110-V149 HydrophobicContact CE2-CG1 3.7Å; Y110-V149 HydrophobicContact CE2-CG2 4.39Å; Y110-V149 WeakPolarHBondContact CE2-O 3.31Å; Y110-V149 HydrophobicContact CG-CG1 3.97Å; I125-V149 HydrophobicContact CD1-CB 4.31Å; I125-V149 HydrophobicContact CD1-CG2 3.43Å; I125-V149 VanDerWaalsContact CD1-CG2 3.43Å; A137-V149 HydrophobicContact CB-CG2 4.26Å; V147-V149 HydrophobicContact CG1-CG2 3.55Å
150T80.1Confident72.3Confident55 Ų5579.7 Ų79.734%0.33742%0.424SS..EExtended strand (participates in β ladder)trans-95.2155.7178.672.40000111V106 E107 G108 G109 Y110V106-T150 PolarHBondContact O-N 2.99Å; E107-T150 VanDerWaalsContact CA-OG1 3.27Å; E107-T150 WeakPolarHBondContact CA-OG1 3.5Å; E107-T150 WeakPolarHBondContact CG-OG1 3.39Å; G108-T150 CarbonylContact C-O 3.34Å; G108-T150 VanDerWaalsContact CA-O 3.31Å; G108-T150 WeakPolarHBondContact CA-O 3.27Å; G108-T150 PolarHBondContact N-O 3.11Å; G108-T150 PolarHBondContact N-OG1 3.09Å; G109-T150 PolarHBondContact N-O 2.97Å; Y110-T150 PolarHBondContact N-O 3.05Å; Y110-T150 VanDerWaalsContact N-O 3.14Å
151Q78.3Confident71.4Confident71 Ų7182 Ų8233%0.33244%0.44SS..EExtended strand (participates in β ladder)trans-73144172.4-65.8-171.65600110.3D111 A112 A114 F116D111-Q151 PolarHBondContact O-OE1 3.25Å; D111-Q151 VanDerWaalsContact O-OE1 3.11Å; A112-Q151 PolarHBondContact O-OE1 3.22Å; A114-Q151 HydrophobicContact CB-CG 4.41Å; A114-Q151 PolarHBondContact O-NE2 3.11Å; A114-Q151 VanDerWaalsContact O-NE2 3.13Å; A114-Q151 PolarHBondContact O-OE1 2.85Å; F116-Q151 HydrophobicContact CE2-CG 3.73Å; F116-Q151 HydrophobicContact CZ-CG 4.25Å
152R79.5Confident70.1Confident92 Ų9286 Ų8635%0.34746%0.459SS..PPolyproline II helixtrans-60.5144.2169.871.2-171.1-175.1153.41.9109.4Y110 D111 A112 G154Y110-R152 WeakPolarHBondContact O-CG 3.43Å; Y110-R152 PolarHBondContact O-N 2.79Å; D111-R152 IonicContact OD2-CZ 2.97Å; D111-R152 IonicContact OD2-NE 3.04Å; D111-R152 PolarHBondContact OD2-NE 2.71Å; D111-R152 IonicContact OD2-NH1 3.92Å; D111-R152 IonicContact OD2-NH2 2.63Å; D111-R152 PolarHBondContact OD2-NH2 3.4Å; A112-R152 HydrophobicContact CB-CG 3.77Å; A112-R152 WeakPolarHBondContact CB-O 3.36Å; R152-G154 PolarHBondContact O-N 3.47Å
153K74.2Confident68.7Low189 Ų18982.7 Ų82.782%0.82246%0.461SS*.PPolyproline II helixtrans-64.4120.9174.3-170.7166.6-178.4174.90109
154G64.6Low67.1Low40 Ų4082.7 Ų82.741%0.41248%0.478SS..PPolyproline II helixtrans-70.613017300000110.5R152R152-G154 PolarHBondContact O-N 3.47Å
155N60.5Low65.7Low88 Ų8891 Ų9147%0.47150%0.496SS..  trans-112.4148.9168.9-7839.6000109F157 M158 G159N155-F157 PolarHBondContact O-N 2.66Å; N155-M158 HydrophobicContact CB-CB 4.45Å; N155-M158 PolarHBondContact O-N 3.3Å; N155-G159 PolarHBondContact O-N 3.2Å
156F58.3Low64.3Low210 Ų21096.6 Ų96.692%0.92153%0.529SS*.THydrogen-bonded Turntrans-53.8-29.2-178.1-156-94.5000113.4
157F59.2Low62.8Low198 Ų198100.2 Ų100.287%0.86855%0.547SS*.THydrogen-bonded Turntrans-87.3-20.3177.2-62.8-79.7000114.8N155N155-F157 PolarHBondContact O-N 2.66Å
158M56.8Low61.6Low131 Ų131114.8 Ų114.865%0.64560%0.602SS**THydrogen-bonded Turntrans-108.37.2-173.9-74.7179.66600113.3N155N155-M158 HydrophobicContact CB-CB 4.45Å; N155-M158 PolarHBondContact O-N 3.3Å
159G56.5Low60.5Low47 Ų47115.3 Ų115.349%0.48561%0.605SS.*  trans65.480.3173.200000112.4N155N155-G159 PolarHBondContact O-N 3.2Å
160G53.2Low59.5Low19 Ų19120.2 Ų120.220%0.19663%0.629CS.*  trans-92.1118.7164.700000109.6D162G160-D162 PolarHBondContact O-N 3.47Å
161S59.2Low58.3Low49 Ų49123.8 Ų123.834%0.34365%0.646SS.*SBendtrans50.4-27.5159.4-86.50000122A112 G113 R115 G163A112-S161 PolarHBondContact O-OG 2.86Å; G113-S161 WeakPolarHBondContact CA-OG 3.47Å; R115-S161 PolarHBondContact NH1-OG 3.21Å; R115-S161 VanDerWaalsContact NH2-CB 3.33Å; R115-S161 PolarHBondContact NH2-OG 3.03Å; S161-G163 PolarHBondContact O-N 2.9Å
162D52.9Low57.1Low145 Ų145126.9 Ų126.978%0.77566%0.664SS**SBendtrans-103.280.3-169.7-61.1-58.2000108.5G160 G164G160-D162 PolarHBondContact O-N 3.47Å; D162-G164 VanDerWaalsContact C-N 3.34Å; D162-G164 PolarHBondContact O-N 3.47Å
163G52.1Low55.7Low68 Ų68129.1 Ų129.170%0.70168%0.684SS**  trans24.365161.500000116S161 Y165S161-G163 PolarHBondContact O-N 2.9Å; G163-Y165 PolarHBondContact O-N 3.4Å
164G47.3Very low54.5Low65 Ų65125.1 Ų125.167%0.6768%0.675SS**  trans-61.8120.6-179.800000110.1D162 T166D162-G164 VanDerWaalsContact C-N 3.34Å; D162-G164 PolarHBondContact O-N 3.47Å; G164-T166 PolarHBondContact O-N 3.36Å
165Y46.6Very low53.8Low222 Ų222131.2 Ų131.287%0.87169%0.694SS**  trans-59.3125.1177.2-60.9-85.4000110.3G163 I167G163-Y165 PolarHBondContact O-N 3.4Å; Y165-I167 PolarHBondContact O-N 3.25Å
166T49.9Very low53.3Low126 Ų126134.5 Ų134.577%0.77371%0.711SS**  trans-76.5111.8163.5-46.90000107.8G164G164-T166 PolarHBondContact O-N 3.36Å
167I47.8Very low52.9Low160 Ų160128.3 Ų128.382%0.82169%0.693SS**  trans-81.1121.8158.346.2172.8000107.1Y165Y165-I167 PolarHBondContact O-N 3.25Å
168W52.8Low52.3Low309 Ų309121.9 Ų121.9100%1.1768%0.677SS**  trans-69.50174.749.267.8000111.8

Retrieved 168 of 168 residues in 23.7 ms (Link to these results)