BRI3_HUMAN Loading...

Membrane protein BRI3

Participates in tumor necrosis factor-alpha (TNF)-induced cell death1. May be a target of Wnt/beta-catenin signaling in the liver2.

AlphaFold DB , UniProt , Accession O95415, Species HUMAN (Homo sapiens, Human), Gene BRI3, Length 125 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
1M52.9Low52.7Low218 Ų218170.1 Ų170.1100%1.07484%0.836SS**  0106.10-73.183.9164.100107.5
2D53.6Low54.3Low169 Ų169166.4 Ų166.490%0.90483%0.834SS**  trans-65.8129.7-169-61.5-91.4000113.6
3H52.1Low54.6Low187 Ų187159 Ų15987%0.86682%0.815SS**  trans-82.4116.1170.5-59.3-73.7000109.4
4K57.3Low54.8Low201 Ų201161.5 Ų161.587%0.87481%0.811SS**  trans-122.5101.4164.9-179177.3156.1-174.90109.6
5P43.9Very low55Low98 Ų98159.9 Ų159.964%0.63681%0.806SS**  trans-92.9160.8168.938-31000110.6
6L43.8Very low55.1Low153 Ų153159.7 Ų159.780%0.80181%0.807SS**  trans69.6108.2164.1-44.4-175000116.9
7L52.3Low54.6Low163 Ų163160.9 Ų160.985%0.85381%0.809SS**  -173.394.6123.7-84.9-154.1000109.9E9L7-E9 PolarHBondContact O-N 3.11Å
8Q48.4Very low54.3Low178 Ų178158 Ų15883%0.83281%0.814SS**  trans39.181.2130.1-158.2144-24.700116.9R10Q8-R10 PolarHBondContact O-N 3.44Å
9E49.9Very low53.8Low202 Ų202153.8 Ų153.894%0.94481%0.813SS**  trans-72.869.2170.8-151.9173.6131.500110.1L7L7-E9 PolarHBondContact O-N 3.11Å
10R59.9Low52.9Low202 Ų202156.1 Ų156.176%0.76282%0.819SS**PPolyproline II helixtrans-86.7122.1167.4-175.3-164.5175.6157.71.5108Q8Q8-R10 PolarHBondContact O-N 3.44Å
11P65.9Low52.2Low100 Ų100150.8 Ų150.865%0.64980%0.802SS**PPolyproline II helixtrans-64.2153.5176.924.2-31.4000111.9
12P71.3Confident51.6Low126 Ų126147.7 Ų147.782%0.81879%0.79SS**PPolyproline II helixtrans-57.6137.6-175-21.931.9000112.7Y14P12-Y14 PolarHBondContact O-N 2.83Å
13A59.2Low51.1Low70 Ų70149.4 Ų149.458%0.57979%0.785SS**PPolyproline II helixtrans-69.4123.9165.500000108.3N15A13-N15 PolarHBondContact O-N 3.17Å
14Y56.6Low50.3Low194 Ų194145.6 Ų145.676%0.76179%0.786SS**PPolyproline II helixtrans-73.9121.517256.4-88000108.4P12 L16P12-Y14 PolarHBondContact O-N 2.83Å; Y14-L16 HydrophobicContact CD2-CD1 4.25Å; Y14-L16 HydrophobicContact CE2-CD1 3.79Å; Y14-L16 HydrophobicContact CE2-CG 4.47Å
15N57.9Low49.6Very low137 Ų137141.4 Ų141.473%0.73378%0.781SS**PPolyproline II helixtrans-78.2121.4172.4-56.5-43.4000107.7A13 E17A13-N15 PolarHBondContact O-N 3.17Å; N15-E17 PolarHBondContact O-N 3.35Å
16L56.9Low49.8Very low157 Ų157138.9 Ų138.982%0.82277%0.773SS**  trans-76.266174.3-102.4133.9000109.9Y14Y14-L16 HydrophobicContact CD2-CD1 4.25Å; Y14-L16 HydrophobicContact CE2-CD1 3.79Å; Y14-L16 HydrophobicContact CE2-CG 4.47Å
17E47.1Very low49.9Very low181 Ų181138.2 Ų138.285%0.84678%0.777SS**  trans-13574.5174.2-95.7159.18600109N15N15-E17 PolarHBondContact O-N 3.35Å
18A48Very low50Low108 Ų108138.6 Ų138.689%0.89377%0.774SS**  trans-147.596.1167.900000109.5
19G45Very low49.7Very low78 Ų78134 Ų13480%0.80478%0.775SS**  trans127.855.416400000116.3G21G19-G21 PolarHBondContact O-N 3.05Å
20Q35.7Very low49.5Very low200 Ų200134.9 Ų134.994%0.93577%0.771SS**  trans-47.7120165.5-166.8153.6-5900111.6
21G39Very low48.7Very low44 Ų44128.3 Ų128.345%0.45477%0.766SS.*  trans-177.850.5-177.900000111.2G19 Y23G19-G21 PolarHBondContact O-N 3.05Å; G21-Y23 PolarHBondContact O-N 3.49Å
22D40Very low48Very low154 Ų154128.6 Ų128.682%0.82478%0.777SS**  trans-63.791.6179.3-85.8-79.3000112.1
23Y42.2Very low47.3Very low204 Ų204130.1 Ų130.180%0.878%0.776SS**  trans-111108.1147.7-15.2-77.3000106.1G21 C25G21-Y23 PolarHBondContact O-N 3.49Å; Y23-C25 PolarHBondContact O-N 3.19Å; Y23-C25 VanDerWaalsContact O-N 3.14Å
24A35.6Very low47.5Very low107 Ų107132.2 Ų132.288%0.88478%0.784SS**  trans-59110.6-171.200000112.6
25C44Very low47.8Very low113 Ų113127.8 Ų127.876%0.76479%0.788SS**  trans-117.2110.2155.3-165.40000106.1Y23Y23-C25 PolarHBondContact O-N 3.19Å; Y23-C25 VanDerWaalsContact O-N 3.14Å
26G47.1Very low48.3Very low46 Ų46125.7 Ų125.747%0.47479%0.789SS.*  trans-64.8161.6-17200000113.6H28G26-H28 PolarHBondContact O-CD2 3.4Å; G26-H28 PolarHBondContact O-N 3.35Å; G26-H28 VanDerWaalsContact O-N 3.1Å
27P46.7Very low49.2Very low138 Ų138123.7 Ų123.790%0.89679%0.786SS**  trans-78.2102.3-173.532.4-30.8000109.4G29P27-G29 PolarHBondContact O-N 2.88Å
28H54Low50.6Low171 Ų171120.8 Ų120.879%0.79278%0.783SS**  trans-79.2109.8167.3-73-88.8000108.8G26 Y30G26-H28 PolarHBondContact O-CD2 3.4Å; G26-H28 PolarHBondContact O-N 3.35Å; G26-H28 VanDerWaalsContact O-N 3.1Å; H28-Y30 PolarHBondContact O-N 3.23Å
29G41.9Very low51.9Low81 Ų81121.3 Ų121.384%0.83578%0.777SS**  trans-58117.9-177.100000113.1P27P27-G29 PolarHBondContact O-N 2.88Å
30Y45.1Very low53.5Low222 Ų222123 Ų12387%0.87177%0.774SS**  trans-88.6115.3165.652-84.6000108.2H28H28-Y30 PolarHBondContact O-N 3.23Å
31G44.2Very low55.3Low64 Ų64119.5 Ų119.566%0.6677%0.768SS**PPolyproline II helixtrans-65.3157.8-179.300000113.4I33G31-I33 PolarHBondContact O-N 3.21Å
32A51Low56.6Low105 Ų105127.2 Ų127.287%0.86879%0.785SS**PPolyproline II helixtrans-53.3127.3-178.400000112.8
33I56.2Low58Low158 Ų158125.5 Ų125.581%0.8178%0.782SS**PPolyproline II helixtrans-77.3128.6171.8-48.9165.1000107.4G31G31-I33 PolarHBondContact O-N 3.21Å
34P62.4Low58.7Low114 Ų114125.3 Ų125.374%0.7478%0.782SS**PPolyproline II helixtrans-62.6137.9174-1324.2000110.8A36P34-A36 PolarHBondContact O-N 3.48Å
35A63.1Low59.7Low102 Ų102128.5 Ų128.584%0.84378%0.783SS**PPolyproline II helixtrans-62.2128.1174.400000110.6
36A69.7Low60.1Low92 Ų92128.9 Ų128.976%0.7678%0.781SS**PPolyproline II helixtrans-70.6144.9175.300000111.1P34P34-A36 PolarHBondContact O-N 3.48Å
37P75.3Confident60.2Low116 Ų116133.3 Ų133.375%0.75380%0.8SS**PPolyproline II helixtrans-67153.1176.925.5-31.8000112.6
38P76.3Confident60.3Low120 Ų120130 Ų13078%0.77979%0.791SS**PPolyproline II helixtrans-65.7147.3-176.525.9-33.9000112.8
39P76.1Confident60.1Low118 Ų118128.4 Ų128.477%0.76679%0.786SS**PPolyproline II helixtrans-68.2149.9178.928.2-34.3000112.2
40P77.4Confident60.6Low114 Ų114130.7 Ų130.774%0.7479%0.787SS**PPolyproline II helixtrans-68.7154178.327.3-33.4000112.6Y42P40-Y42 PolarHBondContact O-N 3.37Å
41P74.7Confident61Low126 Ų126124.8 Ų124.882%0.81877%0.774SS**PPolyproline II helixtrans-64129.2178.5-16.729.7000111.7
42Y65.5Low61.3Low207 Ų207130.3 Ų130.381%0.81278%0.782SS**PPolyproline II helixtrans-73.7136.4173.833-90.4000110.7P40 Y44P40-Y42 PolarHBondContact O-N 3.37Å; Y42-Y44 PolarHBondContact O-N 3.14Å
43P70.1Confident61.5Low118 Ų118131.6 Ų131.677%0.76677%0.77SS**PPolyproline II helixtrans-70.8124.6167.928.7-29.3000108.7L45P43-L45 PolarHBondContact O-N 3.14Å
44Y55.4Low61.3Low200 Ų200129.5 Ų129.578%0.78477%0.766SS**PPolyproline II helixtrans-67.7116170.651.5-82.5000108.2Y42 V46Y42-Y44 PolarHBondContact O-N 3.14Å; Y44-V46 PolarHBondContact O-N 3.19Å
45L57.7Low60.7Low173 Ų173134.8 Ų134.891%0.90677%0.772SS**PPolyproline II helixtrans-77.8118162.7-88.5168.2000108P43 T47P43-L45 PolarHBondContact O-N 3.14Å; L45-T47 PolarHBondContact O-N 2.86Å
46V52.5Low59.9Low121 Ų121136.6 Ų136.673%0.73377%0.772SS**PPolyproline II helixtrans-47.5130.2175.1159.20000111.1Y44 G48Y44-V46 PolarHBondContact O-N 3.19Å; V46-G48 PolarHBondContact O-N 2.87Å; V46-G48 VanDerWaalsContact O-N 3.13Å
47T48.4Very low58.9Low140 Ų140141.4 Ų141.486%0.85977%0.772SS**  trans-50.8106.8173.9-50.90000111.7L45L45-T47 PolarHBondContact O-N 2.86Å
48G49.6Very low57.7Low69 Ų69140.3 Ų140.371%0.71176%0.76SS**  trans-115.299.8164.700000110V46V46-G48 PolarHBondContact O-N 2.87Å; V46-G48 VanDerWaalsContact O-N 3.13Å
49I48.8Very low56.5Low136 Ų136143 Ų14370%0.69777%0.766SS**  trans27.3112.6154.6-47.3172.2000117.4T51I49-T51 HydrophobicContact CG2-CG2 3.92Å; I49-T51 PolarHBondContact O-N 3.41Å
50P53.3Low55.6Low130 Ų130143 Ų14384%0.84476%0.755SS**  trans-84.2100.5163.930.2-23000109.8
51T53.4Low54.1Low98 Ų98143.6 Ų143.660%0.60176%0.762SS**  trans-80.3117.5165.253.30000109.9I49 H53I49-T51 HydrophobicContact CG2-CG2 3.92Å; I49-T51 PolarHBondContact O-N 3.41Å; T51-H53 WeakPolarHBondContact CB-NE2 3.38Å; T51-H53 PolarHBondContact O-CD2 3.33Å; T51-H53 PolarHBondContact O-N 3.29Å; T51-H53 VanDerWaalsContact O-N 3.15Å; T51-H53 PolarHBondContact OG1-CD2 3.1Å; T51-H53 PolarHBondContact OG1-NE2 3.38Å; T51-H53 VanDerWaalsContact OG1-NE2 3.12Å
52H50.2Low53Low180 Ų180148 Ų14883%0.83376%0.762SS**  trans-70.899.5-178.6-164-94.4000110.4
53H56.3Low52.3Low132 Ų132144.2 Ų144.261%0.61176%0.761SS**  trans-119.9112171.1-57.7-72.3000110.1T51 R55T51-H53 WeakPolarHBondContact CB-NE2 3.38Å; T51-H53 PolarHBondContact O-CD2 3.33Å; T51-H53 PolarHBondContact O-N 3.29Å; T51-H53 VanDerWaalsContact O-N 3.15Å; T51-H53 PolarHBondContact OG1-CD2 3.1Å; T51-H53 PolarHBondContact OG1-NE2 3.38Å; T51-H53 VanDerWaalsContact OG1-NE2 3.12Å; H53-R55 PolarHBondContact O-N 3.04Å; H53-R55 VanDerWaalsContact O-N 3.09Å
54P50.5Low51.4Low113 Ų113144.9 Ų144.973%0.73476%0.763SS**  trans-78.593.3168.530.7-26.9000107.7V56P54-V56 PolarHBondContact O-N 3.35Å
55R50Low51Low225 Ų225140.8 Ų140.885%0.84976%0.758SS**  trans-86.2101.4169.5-88.7-165.5159.3112.3-1109.8H53 Y57H53-R55 PolarHBondContact O-N 3.04Å; H53-R55 VanDerWaalsContact O-N 3.09Å; R55-Y57 PolarHBondContact O-N 3.47Å
56V47.7Very low50.7Low141 Ų141143 Ų14386%0.85576%0.755SS**  trans-57.7117.6157.3177.60000108P54P54-V56 PolarHBondContact O-N 3.35Å
57Y47.5Very low50.4Low192 Ų192147.2 Ų147.275%0.75376%0.759SS**  trans-137.8104.1163.6-164.8-94.9000110.7R55R55-Y57 PolarHBondContact O-N 3.47Å
58N50.1Low50.8Low93 Ų93145.5 Ų145.550%0.49775%0.75SS.*  trans40.593.5136.3-154.2-46.2000117.6H60N58-H60 PolarHBondContact ND2-CE1 3.41Å; N58-H60 PolarHBondContact O-N 2.93Å; N58-H60 PolarHBondContact OD1-CE1 3.38Å; N58-H60 PolarHBondContact OD1-N 3.32Å; N58-H60 PolarHBondContact OD1-ND1 2.77Å
59I52.2Low51Low177 Ų177146.6 Ų146.691%0.90875%0.752SS**  trans-65.576.4159.240.4166.5000110.3S61I59-S61 PolarHBondContact O-N 3.5Å
60H55.8Low51.3Low118 Ų118144.6 Ų144.655%0.54674%0.743SS.*  trans-65.2124.4161.6-83.985.6000108.6N58 R62N58-H60 PolarHBondContact ND2-CE1 3.41Å; N58-H60 PolarHBondContact O-N 2.93Å; N58-H60 PolarHBondContact OD1-CE1 3.38Å; N58-H60 PolarHBondContact OD1-N 3.32Å; N58-H60 PolarHBondContact OD1-ND1 2.77Å; H60-R62 PolarHBondContact O-N 3.42Å
61S47Very low51.1Low126 Ų126143.6 Ų143.688%0.88174%0.739SS**  trans-52.473.7161.639.80000111.5I59I59-S61 PolarHBondContact O-N 3.5Å
62R52.3Low51.2Low219 Ų219145.8 Ų145.883%0.82675%0.746SS**  trans-94.8127161.4-86.8-178.5175.4-178.7-0.6107.3H60 V64H60-R62 PolarHBondContact O-N 3.42Å; R62-V64 PolarHBondContact O-N 3.39Å
63T50.3Low51.4Low128 Ų128142.3 Ų142.379%0.78574%0.737SS**  trans-27.5110.1165.4-51.10000109.8T65T63-T65 PolarHBondContact O-N 2.89Å
64V50Low51.4Low132 Ų132142.7 Ų142.780%0.875%0.748SS**  trans-6880.41731780000105.7R62 R66R62-V64 PolarHBondContact O-N 3.39Å; V64-R66 PolarHBondContact O-N 3.1Å
65T48.1Very low51.8Low113 Ų113141.5 Ų141.569%0.69374%0.739SS**  trans-66.991.9160.3-49.40000104.3T63 Y67T63-T65 PolarHBondContact O-N 2.89Å; T65-Y67 PolarHBondContact O-N 3.31Å
66R51.5Low52.7Low219 Ų219134.4 Ų134.483%0.82674%0.736SS**  trans-41.6118.6166.3-89.6-165.5-175.3-1654.6106.9V64 P68V64-R66 PolarHBondContact O-N 3.1Å; R66-P68 WeakPolarHBondContact O-CD 3.38Å
67Y44.8Very low54.1Low210 Ų210128.8 Ų128.882%0.82471%0.706SS**  trans-52.7123.9162.8-67.5-96.9000108.6T65 A69T65-Y67 PolarHBondContact O-N 3.31Å; Y67-A69 VanDerWaalsContact C-N 3.26Å; Y67-A69 PolarHBondContact O-N 3.46Å
68P57.5Low55.5Low104 Ų104119.7 Ų119.768%0.67567%0.67SS**  trans-80.391.6132.631.2-19000105R66 N70R66-P68 WeakPolarHBondContact O-CD 3.38Å; P68-N70 VanDerWaalsContact CB-OD1 3.29Å; P68-N70 WeakPolarHBondContact CB-OD1 3.26Å; P68-N70 PolarHBondContact O-N 3.49Å; P68-N70 PolarHBondContact O-OD1 3.44Å
69A53.9Low57Low92 Ų92119.4 Ų119.476%0.7667%0.674SS**  trans-72.665.8170.700000108.6Y67Y67-A69 VanDerWaalsContact C-N 3.26Å; Y67-A69 PolarHBondContact O-N 3.46Å
70N55Low58.3Low95 Ų95115.8 Ų115.851%0.50866%0.66SS.*  trans-137.494.7165.158.4-51.9000106.3P68 I72P68-N70 VanDerWaalsContact CB-OD1 3.29Å; P68-N70 WeakPolarHBondContact CB-OD1 3.26Å; P68-N70 PolarHBondContact O-N 3.49Å; P68-N70 PolarHBondContact O-OD1 3.44Å; N70-I72 VanDerWaalsContact C-N 3.26Å; N70-I72 PolarHBondContact O-N 2.92Å
71S50.2Low59.5Low109 Ų109111.8 Ų111.876%0.76265%0.645SS**  trans-42.1106.3146.342.60000107.2V73S71-V73 WeakPolarHBondContact O-CG2 3.38Å; S71-V73 PolarHBondContact O-N 3.03Å
72I55.1Low60.9Low144 Ų144114.7 Ų114.774%0.73864%0.636SS**  trans-63.873.2167.942.1152.7000107.9N70 V74N70-I72 VanDerWaalsContact C-N 3.26Å; N70-I72 PolarHBondContact O-N 2.92Å; I72-V74 PolarHBondContact O-N 3.19Å
73V53.9Low62Low107 Ų107109.3 Ų109.365%0.64863%0.628SS**  trans-73.5107.8155.6-1260000104.3S71 V75S71-V73 WeakPolarHBondContact O-CG2 3.38Å; S71-V73 PolarHBondContact O-N 3.03Å; V73-V75 HydrophobicContact CB-CG2 3.96Å; V73-V75 HydrophobicContact CG1-CG2 4.48Å; V73-V75 PolarHBondContact O-N 3.03Å
74V56.9Low63Low139 Ų139103.5 Ų103.584%0.84259%0.593SS**  trans-6772.4169.4-178.40000107.3I72 G76I72-V74 PolarHBondContact O-N 3.19Å; V74-G76 PolarHBondContact O-N 3.49Å
75V58.7Low64.2Low89 Ų89102.1 Ų102.154%0.53959%0.585SS.*  trans-81107.6165-167.10000104.3V73 G77V73-V75 HydrophobicContact CB-CG2 3.96Å; V73-V75 HydrophobicContact CG1-CG2 4.48Å; V73-V75 PolarHBondContact O-N 3.03Å; V75-G77 PolarHBondContact O-N 3.44Å
76G69Low65.6Low76 Ų7699 Ų9978%0.78456%0.564SS**SBendtrans-65.562.9-176.300000114V74V74-G76 PolarHBondContact O-N 3.49Å
77G75.4Confident66.8Low22 Ų2293.4 Ų93.423%0.22755%0.547CS..SBendtrans-149.5-175.3-176.900000114.7V75 G84V75-G77 PolarHBondContact O-N 3.44Å; G77-G84 CarbonylContact C-O 3.44Å; G77-G84 WeakPolarHBondContact CA-O 3.39Å
78C78.8Confident68.4Low1 Ų186.4 Ų86.41%0.00752%0.524CS..  trans-55.5122.2177.6167.10000109.5V80 C81 R82 G84 C117 C120C78-V80 PolarHBondContact O-N 3.14Å; C78-V80 VanDerWaalsContact O-N 3.09Å; C78-V80 VanDerWaalsContact SG-CB 3.57Å; C78-V80 PolarHBondContact SG-N 2.75Å; C78-V80 VanDerWaalsContact SG-N 3.42Å; C78-C81 WeakPolarHBondContact CB-SG 3.42Å; C78-C81 PolarHBondContact O-N 2.79Å; C78-C81 PolarHBondContact SG-N 2.79Å; C78-C81 VanDerWaalsContact SG-N 3.38Å; C78-R82 VanDerWaalsContact O-CA 3.3Å; C78-R82 WeakPolarHBondContact O-CA 3.45Å; C78-R82 PolarHBondContact O-N 2.76Å; C78-G84 PolarHBondContact N-O 2.96Å; C78-C117 HydrophobicContact CB-CB 3.55Å; C78-C117 WeakPolarHBondContact CB-SG 3.27Å; C78-C120 WeakPolarHBondContact CB-SG 3.48Å; C78-C120 WeakPolarHBondContact SG-CB 3.04Å; C78-C120 CovalentContact SG-SG 2.13Å; C78-C120 PolarHBondContact SG-SG 2.71Å
79P79.8Confident69.4Low87 Ų8784.3 Ų84.357%0.56551%0.511SS*.THydrogen-bonded Turntrans-65.6-14.4179.327.9-36.8000113.1F124P79-F124 HydrophobicContact CG-CD1 4.07Å; P79-F124 HydrophobicContact CG-CE1 3.26Å; P79-F124 HydrophobicContact CG-CE2 3.96Å; P79-F124 HydrophobicContact CG-CZ 3.21Å
80V80.4Confident70.7Confident101 Ų10184.1 Ų84.161%0.61249%0.493SS*.THydrogen-bonded Turntrans-85.3-51.9177.4177.30000111.9C78 C120 A122 F124C78-V80 PolarHBondContact O-N 3.14Å; C78-V80 VanDerWaalsContact O-N 3.09Å; C78-V80 VanDerWaalsContact SG-CB 3.57Å; C78-V80 PolarHBondContact SG-N 2.75Å; C78-V80 VanDerWaalsContact SG-N 3.42Å; V80-C120 HydrophobicContact CB-CB 4.41Å; V80-C120 HydrophobicContact CG1-CB 4.31Å; V80-A122 HydrophobicContact CB-CB 4.19Å; V80-A122 HydrophobicContact CG2-CB 3.86Å; V80-F124 HydrophobicContact CG2-CZ 3.95Å
81C80.7Confident72.1Confident35 Ų3581.8 Ų81.824%0.23648%0.482CS..THydrogen-bonded Turntrans-100.6-14.9-177.363.30000115.3C78 V83 G84 C120C78-C81 WeakPolarHBondContact CB-SG 3.42Å; C78-C81 PolarHBondContact O-N 2.79Å; C78-C81 PolarHBondContact SG-N 2.79Å; C78-C81 VanDerWaalsContact SG-N 3.38Å; C81-V83 HydrophobicContact CB-CG2 3.7Å; C81-V83 WeakPolarHBondContact O-CG2 3.06Å; C81-V83 PolarHBondContact O-N 3.44Å; C81-G84 PolarHBondContact SG-N 3Å; C81-G84 VanDerWaalsContact SG-N 3.39Å; C81-C120 HydrophobicContact CB-CB 3.6Å; C81-C120 WeakPolarHBondContact SG-CB 3.38Å; C81-C120 VanDerWaalsContact SG-SG 3.63Å
82R77.1Confident73.6Confident186 Ų18684.8 Ų84.870%0.70248%0.482SS*.SBendtrans57.7-7.1-176.5-55-179.1178.1-175.9-1.3116.2C78C78-R82 VanDerWaalsContact O-CA 3.3Å; C78-R82 WeakPolarHBondContact O-CA 3.45Å; C78-R82 PolarHBondContact O-N 2.76Å
83V74.8Confident75.1Confident106 Ų10682.9 Ų82.964%0.64247%0.472SS*.SBendtrans-102.1-24.3-179.8-68.40000113.1C81 N119C81-V83 HydrophobicContact CB-CG2 3.7Å; C81-V83 WeakPolarHBondContact O-CG2 3.06Å; C81-V83 PolarHBondContact O-N 3.44Å; V83-N119 WeakPolarHBondContact CG2-ND2 3.34Å
84G71.8Confident76.8Confident6 Ų677.8 Ų77.86%0.06244%0.442CS..SBendtrans-91.2142.3-17600000112.7G77 C78 C81G77-G84 CarbonylContact C-O 3.44Å; G77-G84 WeakPolarHBondContact CA-O 3.39Å; C78-G84 PolarHBondContact N-O 2.96Å; C81-G84 PolarHBondContact SG-N 3Å; C81-G84 VanDerWaalsContact SG-N 3.39Å
85V73.9Confident78.2Confident104 Ų10474.8 Ų74.863%0.6342%0.42SS*.  trans-75.9145165.3-176.90000108.1P118V85-P118 WeakPolarHBondContact O-CD 3.45Å
86L77.7Confident79.8Confident47 Ų4775.8 Ų75.825%0.24642%0.418CS..  trans-91.7113.1179.7-165.864.2000108.9R115 C117 F124L86-R115 HydrophobicContact CD1-CB 4.07Å; L86-R115 HydrophobicContact CD2-CB 3.61Å; L86-R115 HydrophobicContact CD2-CG 4.01Å; L86-R115 HydrophobicContact CG-CB 3.64Å; L86-R115 HydrophobicContact CG-CG 4.15Å; L86-C117 HydrophobicContact CD1-CB 3.99Å; L86-F124 HydrophobicContact CD1-CD2 3.45Å; L86-F124 VanDerWaalsContact CD1-CD2 3.45Å; L86-F124 HydrophobicContact CD1-CE2 3.8Å; L86-F124 HydrophobicContact CD2-CD2 3.99Å; L86-F124 HydrophobicContact CG-CD2 4.39Å
87E76.4Confident80.7Confident102 Ų10274.3 Ų74.348%0.47739%0.391SS..EExtended strand (participates in β ladder)trans-89.8137.7-178.7-66.9-179.1121.400110.5C89 R115 R116 P118E87-C89 PolarHBondContact O-N 2.76Å; E87-R115 CarbonylContact O-C 3.48Å; E87-R115 WeakPolarHBondContact O-CA 3.41Å; E87-R116 PolarHBondContact N-O 2.73Å; E87-R116 PolarHBondContact O-N 3.39Å; E87-P118 WeakPolarHBondContact OE2-CG 3.15Å
88D79.9Confident81.4Confident62 Ų6273.6 Ų73.633%0.33238%0.383SS..EExtended strand (participates in β ladder)trans-85.2105.9175.3-82.8-36.2000109.6F90 R113 R115D88-F90 HydrophobicContact CB-CE2 4.4Å; D88-R113 HydrophobicContact CB-CG 3.84Å; D88-R113 WeakPolarHBondContact OD1-CD 3.41Å; D88-R113 IonicContact OD1-CZ 3.77Å; D88-R113 IonicContact OD1-NE 3.41Å; D88-R113 PolarHBondContact OD1-NE 3.33Å; D88-R113 IonicContact OD1-NH1 3.87Å; D88-R113 IonicContact OD2-CZ 3.43Å; D88-R113 IonicContact OD2-NE 3.67Å; D88-R113 IonicContact OD2-NH1 2.77Å; D88-R113 PolarHBondContact OD2-NH1 2.74Å; D88-R115 WeakPolarHBondContact OD1-CG 3.31Å; D88-R115 IonicContact OD1-NE 3.38Å; D88-R115 PolarHBondContact OD1-NE 3.21Å
89C77.8Confident82Confident60 Ų6079.7 Ų79.741%0.40541%0.414SS..EExtended strand (participates in β ladder)trans-87.5115.7172.1-58.70000109.8E87 K114E87-C89 PolarHBondContact O-N 2.76Å; C89-K114 PolarHBondContact N-O 3.26Å; C89-K114 PolarHBondContact O-N 2.86Å
90F81.4Confident82.6Confident89 Ų8980.4 Ų80.439%0.3941%0.413SS..  trans-84.1133.9169.8-63.2-82.6000109.9D88 I95 C109 F110 R113D88-F90 HydrophobicContact CB-CE2 4.4Å; F90-I95 HydrophobicContact CB-CD1 3.95Å; F90-I95 HydrophobicContact CB-CG1 3.84Å; F90-C109 WeakPolarHBondContact CD1-SG 3.49Å; F90-F110 HydrophobicContact CE1-CD1 4.23Å; F90-F110 HydrophobicContact CE1-CE1 4.27Å; F90-F110 HydrophobicContact CZ-CE1 4.32Å; F90-R113 HydrophobicContact CD1-CB 4.21Å; F90-R113 HydrophobicContact CD1-CG 4.13Å; F90-R113 HydrophobicContact CE1-CB 4.17Å; F90-R113 VanDerWaalsContact CE1-CD 3.48Å; F90-R113 HydrophobicContact CE1-CG 3.92Å; F90-R113 HydrophobicContact CZ-CG 4.28Å
91T83.6Confident82.8Confident45 Ų4580.1 Ų80.128%0.27641%0.407SS..  trans-70.6145171.7620000109.3L93 G94 I95T91-L93 PolarHBondContact O-N 3.44Å; T91-G94 WeakPolarHBondContact O-CA 3.5Å; T91-G94 PolarHBondContact O-N 3.01Å; T91-G94 PolarHBondContact OG1-N 2.77Å; T91-I95 PolarHBondContact O-N 3Å
92F83.3Confident83Confident173 Ų17385.7 Ų85.776%0.75943%0.428SS*.Hα-helixtrans-53.4-39.5173.7-177.7-95.6000111.4I95 F96F92-I95 PolarHBondContact O-N 3.38Å; F92-F96 WeakPolarHBondContact O-CB 3.35Å; F92-F96 PolarHBondContact O-N 2.9Å
93L86.3Confident83.3Confident103 Ų10380.5 Ų80.554%0.53942%0.418SS..Hα-helixtrans-59.1-46.1173.6-176.767.8000112.3T91 I95 F96 L97T91-L93 PolarHBondContact O-N 3.44Å; L93-I95 VanDerWaalsContact C-N 3.35Å; L93-I95 PolarHBondContact O-N 3.44Å; L93-F96 PolarHBondContact O-N 2.79Å; L93-L97 HydrophobicContact CD1-CD1 4.45Å; L93-L97 HydrophobicContact CG-CD1 4.16Å; L93-L97 WeakPolarHBondContact O-CB 3.09Å; L93-L97 VanDerWaalsContact O-CG 3.31Å; L93-L97 WeakPolarHBondContact O-CG 3.4Å; L93-L97 PolarHBondContact O-N 2.8Å
94G88.2Confident84Confident0 Ų082.9 Ų82.90%042%0.42CS..Hα-helixtrans-61.3-42.2177.700000112.5T91 L97 A98 C109T91-G94 WeakPolarHBondContact O-CA 3.5Å; T91-G94 PolarHBondContact O-N 3.01Å; T91-G94 PolarHBondContact OG1-N 2.77Å; G94-L97 PolarHBondContact O-N 3.3Å; G94-A98 WeakPolarHBondContact O-CB 3.39Å; G94-A98 PolarHBondContact O-N 3.38Å; G94-C109 VanDerWaalsContact C-SG 3.56Å; G94-C109 WeakPolarHBondContact O-CB 3.11Å; G94-C109 PolarHBondContact O-SG 2.74Å
95I88.2Confident84.8Confident77 Ų7782.6 Ų82.640%0.39542%0.417SS..Hα-helixtrans-64.3-45.9176.3-60.8162.9000110.5F90 T91 F92 L93 L97 A98 I99F90-I95 HydrophobicContact CB-CD1 3.95Å; F90-I95 HydrophobicContact CB-CG1 3.84Å; T91-I95 PolarHBondContact O-N 3Å; F92-I95 PolarHBondContact O-N 3.38Å; L93-I95 VanDerWaalsContact C-N 3.35Å; L93-I95 PolarHBondContact O-N 3.44Å; I95-L97 VanDerWaalsContact C-N 3.35Å; I95-L97 PolarHBondContact O-N 3.39Å; I95-A98 WeakPolarHBondContact O-CB 3.32Å; I95-A98 PolarHBondContact O-N 3.39Å; I95-I99 HydrophobicContact CG2-CD1 4.1Å; I95-I99 WeakPolarHBondContact O-CG1 3.41Å; I95-I99 PolarHBondContact O-N 3.45Å; I95-I99 VanDerWaalsContact O-N 3.11Å
96F90.3Very high85.4Confident110 Ų11082 Ų8248%0.48241%0.406SS..Hα-helixtrans-60-44177.9-176.2-104.1000112.1F92 L93 I99 I100F92-F96 WeakPolarHBondContact O-CB 3.35Å; F92-F96 PolarHBondContact O-N 2.9Å; L93-F96 PolarHBondContact O-N 2.79Å; F96-I99 PolarHBondContact O-N 3.45Å; F96-I100 HydrophobicContact CD1-CD1 3.93Å; F96-I100 HydrophobicContact CD2-CD1 4.19Å; F96-I100 HydrophobicContact CE1-CD1 3.37Å; F96-I100 HydrophobicContact CE2-CD1 3.66Å; F96-I100 HydrophobicContact CG-CD1 4.32Å; F96-I100 HydrophobicContact CZ-CD1 3.23Å; F96-I100 PolarHBondContact O-N 2.13Å
97L88.2Confident86Confident44 Ų4485.5 Ų85.523%0.2342%0.424CS..Hα-helixtrans-66.5-36.4174.9-68.4175000112.3L93 G94 I95 I99 I100 L101 G105L93-L97 HydrophobicContact CD1-CD1 4.45Å; L93-L97 HydrophobicContact CG-CD1 4.16Å; L93-L97 WeakPolarHBondContact O-CB 3.09Å; L93-L97 VanDerWaalsContact O-CG 3.31Å; L93-L97 WeakPolarHBondContact O-CG 3.4Å; L93-L97 PolarHBondContact O-N 2.8Å; G94-L97 PolarHBondContact O-N 3.3Å; I95-L97 VanDerWaalsContact C-N 3.35Å; I95-L97 PolarHBondContact O-N 3.39Å; L97-I99 VanDerWaalsContact C-N 3.28Å; L97-I99 PolarHBondContact O-N 3.42Å; L97-I100 PolarHBondContact O-N 3.09Å; L97-L101 HydrophobicContact CD2-CD1 4.1Å; L97-L101 WeakPolarHBondContact O-CB 3.33Å; L97-L101 PolarHBondContact O-N 2.9Å; L97-G105 VanDerWaalsContact O-CA 3.27Å; L97-G105 WeakPolarHBondContact O-CA 3.49Å
98A90.4Very high86.4Confident7 Ų783 Ų836%0.05842%0.417CS..Hα-helixtrans-58.9-39.617500000112.5G94 I95 G105 F106 C109G94-A98 WeakPolarHBondContact O-CB 3.39Å; G94-A98 PolarHBondContact O-N 3.38Å; I95-A98 WeakPolarHBondContact O-CB 3.32Å; I95-A98 PolarHBondContact O-N 3.39Å; A98-G105 VanDerWaalsContact CA-C 3.49Å; A98-F106 HydrophobicContact CB-CD2 4.45Å; A98-F106 HydrophobicContact CB-CG 4.49Å; A98-C109 HydrophobicContact CB-CB 3.93Å
99I91.5Very high86.6Confident129 Ų12980.5 Ų80.566%0.66240%0.404SS*.Hα-helixtrans-72.7-47.4-179.3-64.7165.8000111.2I95 F96 L97I95-I99 HydrophobicContact CG2-CD1 4.1Å; I95-I99 WeakPolarHBondContact O-CG1 3.41Å; I95-I99 PolarHBondContact O-N 3.45Å; I95-I99 VanDerWaalsContact O-N 3.11Å; F96-I99 PolarHBondContact O-N 3.45Å; L97-I99 VanDerWaalsContact C-N 3.28Å; L97-I99 PolarHBondContact O-N 3.42Å
100I91.8Very high87Confident103 Ų10382.6 Ų82.653%0.52841%0.407SS..Hα-helixtrans-77.3-35.5-171.5-65.3177.3000112.6F96 L97F96-I100 HydrophobicContact CD1-CD1 3.93Å; F96-I100 HydrophobicContact CD2-CD1 4.19Å; F96-I100 HydrophobicContact CE1-CD1 3.37Å; F96-I100 HydrophobicContact CE2-CD1 3.66Å; F96-I100 HydrophobicContact CG-CD1 4.32Å; F96-I100 HydrophobicContact CZ-CD1 3.23Å; F96-I100 PolarHBondContact O-N 2.13Å; L97-I100 PolarHBondContact O-N 3.09Å
101L85.8Confident87.1Confident94 Ų9482.3 Ų82.349%0.49242%0.42SS..THydrogen-bonded Turntrans-11028.7-169.9-64.5172.3000113L97 P103 F104 G105L97-L101 HydrophobicContact CD2-CD1 4.1Å; L97-L101 WeakPolarHBondContact O-CB 3.33Å; L97-L101 PolarHBondContact O-N 2.9Å; L101-P103 CarbonylContact O-C 3.38Å; L101-F104 PolarHBondContact O-N 3.42Å; L101-G105 PolarHBondContact O-N 2.84Å
102F83.6Confident87Confident153 Ų15383.2 Ų83.267%0.67142%0.423SS*.THydrogen-bonded Turntrans-52.2122.3177.5-170.5-108.3000110.8F106F102-F106 AromaticContact CD2-CD2 3.35Å; F102-F106 HydrophobicContact CD2-CD2 3.35Å; F102-F106 AromaticContact CD2-CE2 3.28Å; F102-F106 HydrophobicContact CD2-CE2 3.28Å; F102-F106 AromaticContact CE2-CD2 3.51Å; F102-F106 HydrophobicContact CE2-CD2 3.51Å; F102-F106 AromaticContact CE2-CE2 3.39Å; F102-F106 HydrophobicContact CE2-CE2 3.39Å; F102-F106 HydrophobicContact CE2-CZ 4.45Å
103P85.3Confident87Confident76 Ų7678 Ų7849%0.49440%0.399SS..THydrogen-bonded Turncis-96.5-17.812.336.2-35.9000116.1L101 G105 F106L101-P103 CarbonylContact O-C 3.38Å; P103-G105 PolarHBondContact O-N 3.29Å; P103-F106 PolarHBondContact O-N 3.11Å; P103-F106 VanDerWaalsContact O-N 3.14Å
104F87.8Confident86.9Confident156 Ų15679 Ų7968%0.68440%0.399SS*.Hα-helixtrans-59-31.1-177.1-66.1-77.7000113L101 F106 I107 C108L101-F104 PolarHBondContact O-N 3.42Å; F104-F106 VanDerWaalsContact C-N 3.31Å; F104-F106 PolarHBondContact O-N 3.42Å; F104-I107 PolarHBondContact O-N 3.47Å; F104-C108 PolarHBondContact O-N 2.72Å; F104-C108 VanDerWaalsContact O-N 3.14Å
105G88.7Confident86.5Confident0 Ų084.5 Ų84.50%042%0.419CS..Hα-helixtrans-58.7-38176.900000113.6L97 A98 L101 P103 C108 C109L97-G105 VanDerWaalsContact O-CA 3.27Å; L97-G105 WeakPolarHBondContact O-CA 3.49Å; A98-G105 VanDerWaalsContact CA-C 3.49Å; L101-G105 PolarHBondContact O-N 2.84Å; P103-G105 PolarHBondContact O-N 3.29Å; G105-C108 PolarHBondContact O-N 3.48Å; G105-C109 VanDerWaalsContact O-CB 3.26Å; G105-C109 WeakPolarHBondContact O-CB 3.44Å; G105-C109 PolarHBondContact O-N 3.31Å
106F88Confident86.2Confident93 Ų9386.8 Ų86.841%0.40842%0.423SS..Hα-helixtrans-66.1-40.3177.9-86.5-87.4000111.7A98 F102 P103 F104 C108 C109 F110A98-F106 HydrophobicContact CB-CD2 4.45Å; A98-F106 HydrophobicContact CB-CG 4.49Å; F102-F106 AromaticContact CD2-CD2 3.35Å; F102-F106 HydrophobicContact CD2-CD2 3.35Å; F102-F106 AromaticContact CD2-CE2 3.28Å; F102-F106 HydrophobicContact CD2-CE2 3.28Å; F102-F106 AromaticContact CE2-CD2 3.51Å; F102-F106 HydrophobicContact CE2-CD2 3.51Å; F102-F106 AromaticContact CE2-CE2 3.39Å; F102-F106 HydrophobicContact CE2-CE2 3.39Å; F102-F106 HydrophobicContact CE2-CZ 4.45Å; P103-F106 PolarHBondContact O-N 3.11Å; P103-F106 VanDerWaalsContact O-N 3.14Å; F104-F106 VanDerWaalsContact C-N 3.31Å; F104-F106 PolarHBondContact O-N 3.42Å; F106-C108 VanDerWaalsContact C-N 3.33Å; F106-C108 PolarHBondContact O-N 3.3Å; F106-C109 WeakPolarHBondContact O-CB 3.18Å; F106-C109 PolarHBondContact O-N 2.82Å; F106-F110 HydrophobicContact CB-CE2 4.4Å; F106-F110 HydrophobicContact CD1-CE2 4.25Å; F106-F110 WeakPolarHBondContact O-CD2 3.3Å; F106-F110 PolarHBondContact O-N 2.98Å
107I88.6Confident85.8Confident120 Ų12081.6 Ų81.662%0.61540%0.4SS*.Hα-helixtrans-61.4-45.7176.7-58.7171.8000109.8F104 C109 F110 A111F104-I107 PolarHBondContact O-N 3.47Å; I107-C109 VanDerWaalsContact C-N 3.34Å; I107-C109 PolarHBondContact O-N 3.47Å; I107-F110 PolarHBondContact O-N 3.41Å; I107-A111 PolarHBondContact O-N 3.12Å
108C84.9Confident85.5Confident50 Ų5083.7 Ų83.734%0.33842%0.417SS..Hα-helixtrans-62.9-40.6175.5-172.80000112F104 G105 F106 F110 A111 L112F104-C108 PolarHBondContact O-N 2.72Å; F104-C108 VanDerWaalsContact O-N 3.14Å; G105-C108 PolarHBondContact O-N 3.48Å; F106-C108 VanDerWaalsContact C-N 3.33Å; F106-C108 PolarHBondContact O-N 3.3Å; C108-F110 PolarHBondContact O-N 3.4Å; C108-A111 WeakPolarHBondContact O-CB 3.48Å; C108-A111 PolarHBondContact O-N 3.45Å; C108-L112 WeakPolarHBondContact O-CG 3.48Å; C108-L112 PolarHBondContact O-N 2.94Å
109C86Confident84.9Confident9 Ų988.3 Ų88.36%0.06144%0.44CS..Hα-helixtrans-61.8-44.2177.1-173.40000112.1F90 G94 A98 G105 F106 I107 A111 L112 R113F90-C109 WeakPolarHBondContact CD1-SG 3.49Å; G94-C109 VanDerWaalsContact C-SG 3.56Å; G94-C109 WeakPolarHBondContact O-CB 3.11Å; G94-C109 PolarHBondContact O-SG 2.74Å; A98-C109 HydrophobicContact CB-CB 3.93Å; G105-C109 VanDerWaalsContact O-CB 3.26Å; G105-C109 WeakPolarHBondContact O-CB 3.44Å; G105-C109 PolarHBondContact O-N 3.31Å; F106-C109 WeakPolarHBondContact O-CB 3.18Å; F106-C109 PolarHBondContact O-N 2.82Å; I107-C109 VanDerWaalsContact C-N 3.34Å; I107-C109 PolarHBondContact O-N 3.47Å; C109-A111 VanDerWaalsContact C-N 3.32Å; C109-A111 PolarHBondContact O-N 3.13Å; C109-L112 PolarHBondContact O-N 3.04Å; C109-R113 PolarHBondContact O-N 2.89Å; C109-R113 VanDerWaalsContact O-N 3.1Å
110F84.9Confident84.5Confident104 Ų10484.2 Ų84.246%0.45642%0.422SS..Hα-helixtrans-66-32.4174.6-75.6-61.4000112.9F90 F106 I107 C108 R113F90-F110 HydrophobicContact CE1-CD1 4.23Å; F90-F110 HydrophobicContact CE1-CE1 4.27Å; F90-F110 HydrophobicContact CZ-CE1 4.32Å; F106-F110 HydrophobicContact CB-CE2 4.4Å; F106-F110 HydrophobicContact CD1-CE2 4.25Å; F106-F110 WeakPolarHBondContact O-CD2 3.3Å; F106-F110 PolarHBondContact O-N 2.98Å; I107-F110 PolarHBondContact O-N 3.41Å; C108-F110 PolarHBondContact O-N 3.4Å; F110-R113 WeakPolarHBondContact O-CB 3.48Å
111A83.5Confident83.9Confident82 Ų8280.9 Ų80.968%0.67841%0.414SS*.Hα-helixtrans-71.1-30.9175.800000113I107 C108 C109I107-A111 PolarHBondContact O-N 3.12Å; C108-A111 WeakPolarHBondContact O-CB 3.48Å; C108-A111 PolarHBondContact O-N 3.45Å; C109-A111 VanDerWaalsContact C-N 3.32Å; C109-A111 PolarHBondContact O-N 3.13Å
112L82Confident83.6Confident65 Ų6577.4 Ų77.434%0.3440%0.399SS..Hα-helixtrans-89.3-6177.9-65.9172.5000113.6C108 C109 K114C108-L112 WeakPolarHBondContact O-CG 3.48Å; C108-L112 PolarHBondContact O-N 2.94Å; C109-L112 PolarHBondContact O-N 3.04Å; L112-K114 PolarHBondContact O-N 2.88Å
113R83.6Confident83.3Confident63 Ų6374.6 Ų74.624%0.23839%0.394CS..  trans-64.5126.9179.3-176.2175.469.4168.8-17109.8D88 F90 C109 F110D88-R113 HydrophobicContact CB-CG 3.84Å; D88-R113 WeakPolarHBondContact OD1-CD 3.41Å; D88-R113 IonicContact OD1-CZ 3.77Å; D88-R113 IonicContact OD1-NE 3.41Å; D88-R113 PolarHBondContact OD1-NE 3.33Å; D88-R113 IonicContact OD1-NH1 3.87Å; D88-R113 IonicContact OD2-CZ 3.43Å; D88-R113 IonicContact OD2-NE 3.67Å; D88-R113 IonicContact OD2-NH1 2.77Å; D88-R113 PolarHBondContact OD2-NH1 2.74Å; F90-R113 HydrophobicContact CD1-CB 4.21Å; F90-R113 HydrophobicContact CD1-CG 4.13Å; F90-R113 HydrophobicContact CE1-CB 4.17Å; F90-R113 VanDerWaalsContact CE1-CD 3.48Å; F90-R113 HydrophobicContact CE1-CG 3.92Å; F90-R113 HydrophobicContact CZ-CG 4.28Å; C109-R113 PolarHBondContact O-N 2.89Å; C109-R113 VanDerWaalsContact O-N 3.1Å; F110-R113 WeakPolarHBondContact O-CB 3.48Å
114K82.9Confident82.8Confident124 Ų12473.8 Ų73.854%0.53938%0.383SS..EExtended strand (participates in β ladder)trans-109136175.8-68.6179.6-177.7169.50109.5C89 L112C89-K114 PolarHBondContact N-O 3.26Å; C89-K114 PolarHBondContact O-N 2.86Å; L112-K114 PolarHBondContact O-N 2.88Å
115R80.2Confident82Confident115 Ų11573.1 Ų73.143%0.43441%0.407SS..EExtended strand (participates in β ladder)trans-91.9114.4178.1-83.7175.1179.6-172.36.7109.4L86 E87 D88 T123 F124L86-R115 HydrophobicContact CD1-CB 4.07Å; L86-R115 HydrophobicContact CD2-CB 3.61Å; L86-R115 HydrophobicContact CD2-CG 4.01Å; L86-R115 HydrophobicContact CG-CB 3.64Å; L86-R115 HydrophobicContact CG-CG 4.15Å; E87-R115 CarbonylContact O-C 3.48Å; E87-R115 WeakPolarHBondContact O-CA 3.41Å; D88-R115 WeakPolarHBondContact OD1-CG 3.31Å; D88-R115 IonicContact OD1-NE 3.38Å; D88-R115 PolarHBondContact OD1-NE 3.21Å; R115-T123 CarbonylContact O-C 3.5Å; R115-T123 WeakPolarHBondContact O-CA 3.42Å; R115-F124 HydrophobicContact CB-CB 4.2Å; R115-F124 WeakPolarHBondContact CB-O 3.35Å; R115-F124 PolarHBondContact N-O 3.09Å; R115-F124 PolarHBondContact O-N 3.4Å
116R81.6Confident81.7Confident126 Ų12676.8 Ų76.848%0.47543%0.427SS..EExtended strand (participates in β ladder)trans-119.6141.9178.4-172.2173.7-175.4179.6-2.2110.2E87 A122 T123E87-R116 PolarHBondContact N-O 2.73Å; E87-R116 PolarHBondContact O-N 3.39Å; R116-A122 WeakPolarHBondContact CA-O 3.14Å; R116-T123 HydrophobicContact CB-CG2 4.06Å; R116-T123 HydrophobicContact CG-CG2 3.73Å
117C83.1Confident81.4Confident0 Ų075.9 Ų75.90%043%0.428CS..  trans-99.1126.9171.4177.90000110.5C78 L86 N119 C120 G121 A122C78-C117 HydrophobicContact CB-CB 3.55Å; C78-C117 WeakPolarHBondContact CB-SG 3.27Å; L86-C117 HydrophobicContact CD1-CB 3.99Å; C117-N119 VanDerWaalsContact C-N 3.26Å; C117-N119 PolarHBondContact O-N 2.87Å; C117-N119 PolarHBondContact SG-N 3.35Å; C117-N119 VanDerWaalsContact SG-N 3.45Å; C117-C120 WeakPolarHBondContact CB-SG 3.35Å; C117-C120 PolarHBondContact SG-SG 3.09Å; C117-G121 WeakPolarHBondContact O-CA 3.45Å; C117-G121 PolarHBondContact O-N 3.39Å; C117-A122 PolarHBondContact N-O 3.38Å
118P80.8Confident81Confident89 Ų8973.5 Ų73.558%0.57842%0.417SS*.THydrogen-bonded Turntrans-72.6-18.6179.929.8-35.9000113.1V85 E87V85-P118 WeakPolarHBondContact O-CD 3.45Å; E87-P118 WeakPolarHBondContact OE2-CG 3.15Å
119N78.2Confident80.7Confident103 Ų10374.9 Ų74.955%0.55142%0.422SS*.THydrogen-bonded Turntrans-86.8-46.2-177.6-162.1-22.7000112.2V83 C117V83-N119 WeakPolarHBondContact CG2-ND2 3.34Å; C117-N119 VanDerWaalsContact C-N 3.26Å; C117-N119 PolarHBondContact O-N 2.87Å; C117-N119 PolarHBondContact SG-N 3.35Å; C117-N119 VanDerWaalsContact SG-N 3.45Å
120C83.2Confident80.4Confident43 Ų4379 Ų7929%0.29145%0.445SS..THydrogen-bonded Turntrans-95.9-14.2-179.160.70000113.4C78 V80 C81 C117 A122C78-C120 WeakPolarHBondContact CB-SG 3.48Å; C78-C120 WeakPolarHBondContact SG-CB 3.04Å; C78-C120 CovalentContact SG-SG 2.13Å; C78-C120 PolarHBondContact SG-SG 2.71Å; V80-C120 HydrophobicContact CB-CB 4.41Å; V80-C120 HydrophobicContact CG1-CB 4.31Å; C81-C120 HydrophobicContact CB-CB 3.6Å; C81-C120 WeakPolarHBondContact SG-CB 3.38Å; C81-C120 VanDerWaalsContact SG-SG 3.63Å; C117-C120 WeakPolarHBondContact CB-SG 3.35Å; C117-C120 PolarHBondContact SG-SG 3.09Å; C120-A122 HydrophobicContact CB-CB 4.45Å; C120-A122 PolarHBondContact O-N 3.15Å; C120-A122 VanDerWaalsContact O-N 3.11Å; C120-A122 WeakPolarHBondContact SG-CB 3.29Å
121G78.5Confident80.1Confident34 Ų3477.3 Ų77.335%0.35144%0.444SS..  trans70.8-6.5-170.400000114.6C117 T123C117-G121 WeakPolarHBondContact O-CA 3.45Å; C117-G121 PolarHBondContact O-N 3.39Å; G121-T123 PolarHBondContact O-N 3.35Å
122A80Confident79.9Confident21 Ų2177 Ų7717%0.17443%0.427CS..  trans-63.9131.8-177.300000111.5V80 R116 C117 C120 F124V80-A122 HydrophobicContact CB-CB 4.19Å; V80-A122 HydrophobicContact CG2-CB 3.86Å; R116-A122 WeakPolarHBondContact CA-O 3.14Å; C117-A122 PolarHBondContact N-O 3.38Å; C120-A122 HydrophobicContact CB-CB 4.45Å; C120-A122 PolarHBondContact O-N 3.15Å; C120-A122 VanDerWaalsContact O-N 3.11Å; C120-A122 WeakPolarHBondContact SG-CB 3.29Å; A122-F124 HydrophobicContact CB-CE2 3.67Å; A122-F124 HydrophobicContact CB-CZ 3.61Å
123T78.2Confident79.7Confident93 Ų9377.9 Ų77.957%0.57143%0.434SS*.EExtended strand (participates in β ladder)trans-106.5131.9174.753.90000109.8R115 R116 G121R115-T123 CarbonylContact O-C 3.5Å; R115-T123 WeakPolarHBondContact O-CA 3.42Å; R116-T123 HydrophobicContact CB-CG2 4.06Å; R116-T123 HydrophobicContact CG-CG2 3.73Å; G121-T123 PolarHBondContact O-N 3.35Å
124F74Confident79.4Confident59 Ų5979.2 Ų79.226%0.25945%0.45SS..EExtended strand (participates in β ladder)trans-116.6132.4173-52.1-84.5000107.2P79 V80 L86 R115 A122P79-F124 HydrophobicContact CG-CD1 4.07Å; P79-F124 HydrophobicContact CG-CE1 3.26Å; P79-F124 HydrophobicContact CG-CE2 3.96Å; P79-F124 HydrophobicContact CG-CZ 3.21Å; V80-F124 HydrophobicContact CG2-CZ 3.95Å; L86-F124 HydrophobicContact CD1-CD2 3.45Å; L86-F124 VanDerWaalsContact CD1-CD2 3.45Å; L86-F124 HydrophobicContact CD1-CE2 3.8Å; L86-F124 HydrophobicContact CD2-CD2 3.99Å; L86-F124 HydrophobicContact CG-CD2 4.39Å; R115-F124 HydrophobicContact CB-CB 4.2Å; R115-F124 WeakPolarHBondContact CB-O 3.35Å; R115-F124 PolarHBondContact N-O 3.09Å; R115-F124 PolarHBondContact O-N 3.4Å; A122-F124 HydrophobicContact CB-CE2 3.67Å; A122-F124 HydrophobicContact CB-CZ 3.61Å
125A72Confident79.1Confident143 Ų14375.1 Ų75.1100%1.18244%0.442SS*.  trans-85.90170.300000109.6

Retrieved 125 of 125 residues in 17.3 ms (Link to these results)