A0A077Z983_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z983, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 150 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
1M39.3Very low38.4Very low232 Ų232150.5 Ų150.5100%1.14380%0.803SS**  092.60-68.5-170175.700108
2A40.9Very low38Very low94 Ų94146.5 Ų146.578%0.77779%0.788SS**  trans-93.1103.6-179.900000108.2L4A2-L4 VanDerWaalsContact C-N 3.32Å; A2-L4 PolarHBondContact O-N 3.07Å
3F39.3Very low37.5Very low186 Ų186146.8 Ų146.882%0.81678%0.782SS**  trans-63.795.1168.9-89-99.7000107.8L5F3-L5 PolarHBondContact O-N 2.84Å
4L42.4Very low37.1Very low165 Ų165147.1 Ų147.186%0.86478%0.782SS**  trans-6983162.5-69.5172.3000106.2A2 S6A2-L4 VanDerWaalsContact C-N 3.32Å; A2-L4 PolarHBondContact O-N 3.07Å; L4-S6 PolarHBondContact O-N 2.62Å
5L42Very low36.6Very low148 Ų148148.7 Ų148.778%0.77578%0.775SS**  trans-54.199.1164.7-77.1164.6000105.8F3 L7F3-L5 PolarHBondContact O-N 2.84Å; L5-L7 PolarHBondContact O-N 3.07Å
6S39.8Very low36.6Very low90 Ų90146.6 Ų146.663%0.62977%0.773SS**  trans-50.4109.3172.557.80000106.4L4 R8L4-S6 PolarHBondContact O-N 2.62Å; S6-R8 PolarHBondContact O-N 3.23Å
7L38.4Very low36.4Very low174 Ų174143.9 Ų143.991%0.91176%0.764SS**  trans-59.880.7166.5-80138.8000106.4L5 P9L5-L7 PolarHBondContact O-N 3.07Å; L7-P9 WeakPolarHBondContact O-CD 3.14Å
8R38.6Very low36.1Very low210 Ų210144.7 Ų144.779%0.79277%0.768SS**  trans-63.8120.7165.7-74.4-167.4174.6172.8-1104.6S6 L10S6-R8 PolarHBondContact O-N 3.23Å; R8-L10 PolarHBondContact O-N 2.89Å
9P38.4Very low35.9Very low106 Ų106143.7 Ų143.769%0.68876%0.763SS**  trans-55.1122.4172.122.6-30.5000106.4L7 C11L7-P9 WeakPolarHBondContact O-CD 3.14Å; P9-C11 PolarHBondContact O-N 2.85Å
10L33.7Very low35.7Very low163 Ų163146.1 Ų146.185%0.85376%0.763SS**  trans-65.482.3169.2-79.1160.3000106.1R8 V12R8-L10 PolarHBondContact O-N 2.89Å; L10-V12 HydrophobicContact CB-CG2 4.45Å; L10-V12 PolarHBondContact O-N 3.05Å
11C29.1Very low35.5Very low87 Ų87148.7 Ų148.759%0.58877%0.768SS**  trans-6884.8162.8-72.70000105.8P9 Q13P9-C11 PolarHBondContact O-N 2.85Å; C11-Q13 PolarHBondContact O-N 2.92Å
12V33.5Very low35.2Very low103 Ų103143.7 Ų143.762%0.62474%0.742SS**  trans-66106.9167-177.30000104.8L10 L14L10-V12 HydrophobicContact CB-CG2 4.45Å; L10-V12 PolarHBondContact O-N 3.05Å; V12-L14 HydrophobicContact CG1-CD1 4.24Å; V12-L14 PolarHBondContact O-N 3.27Å
13Q32.2Very low34.8Very low151 Ų151143 Ų14371%0.70673%0.731SS**  trans-55.599.9160-86.2-179.5-28.100105.6C11 Y15C11-Q13 PolarHBondContact O-N 2.92Å; Q13-Y15 HydrophobicContact CB-CE2 4.37Å; Q13-Y15 PolarHBondContact O-N 2.85Å
14L32.1Very low34.5Very low150 Ų150141.2 Ų141.279%0.78573%0.729SS**  trans-70.983.8178.6-137.984.2000105.9V12V12-L14 HydrophobicContact CG1-CD1 4.24Å; V12-L14 PolarHBondContact O-N 3.27Å
15Y29.6Very low34.3Very low172 Ų172137.3 Ų137.368%0.67572%0.716SS**  trans-54.8137.5158.3-77.7-87.9000106.5Q13 T17Q13-Y15 HydrophobicContact CB-CE2 4.37Å; Q13-Y15 PolarHBondContact O-N 2.85Å; Y15-T17 PolarHBondContact O-N 3.35Å
16P35.8Very low34.1Very low114 Ų114136.9 Ų136.974%0.7472%0.715SS**  trans-69.877.6-178.728.6-34.3000109.5
17T33.6Very low34Very low102 Ų102138 Ų13863%0.62671%0.712SS**  trans-80.7123.1161.356.80000106.3Y15 D19Y15-T17 PolarHBondContact O-N 3.35Å; T17-D19 PolarHBondContact O-N 2.77Å; T17-D19 PolarHBondContact OG1-OD2 2.91Å
18N31.5Very low33.9Very low157 Ų157135.1 Ų135.184%0.8470%0.698SS**SBendtrans-6949.1-171.5-70.4-72.7000113.4
19D32.5Very low33.9Very low126 Ų126129.5 Ų129.567%0.67469%0.691SS**  trans-101.919.7-175.9-62-41.8000112.7T17 K21T17-D19 PolarHBondContact O-N 2.77Å; T17-D19 PolarHBondContact OG1-OD2 2.91Å; D19-K21 PolarHBondContact O-N 2.98Å
20Y31.7Very low33.8Very low192 Ų192130.7 Ų130.775%0.75369%0.691SS**  trans-74.756166-146.5-92.8000110.9Q22Y20-Q22 HydrophobicContact CD1-CB 4.26Å; Y20-Q22 HydrophobicContact CD2-CB 4.4Å; Y20-Q22 HydrophobicContact CE1-CB 3.95Å; Y20-Q22 HydrophobicContact CE2-CB 4.08Å; Y20-Q22 HydrophobicContact CE2-CG 4.42Å; Y20-Q22 HydrophobicContact CG-CB 4.49Å; Y20-Q22 VanDerWaalsContact CZ-OE1 3.22Å; Y20-Q22 PolarHBondContact OH-OE1 2.91Å
21K31.4Very low34Very low200 Ų200131.7 Ų131.787%0.8769%0.692SS**  trans-90.251148-65.9-172.1-178.1179.70107.4D19 S23D19-K21 PolarHBondContact O-N 2.98Å; K21-S23 PolarHBondContact O-N 2.92Å; K21-S23 VanDerWaalsContact O-N 3.15Å
22Q32.7Very low34.5Very low127 Ų127133.6 Ų133.659%0.59370%0.695SS**  trans-69.2115165.3-111.3178.55.700106.6Y20 L24Y20-Q22 HydrophobicContact CD1-CB 4.26Å; Y20-Q22 HydrophobicContact CD2-CB 4.4Å; Y20-Q22 HydrophobicContact CE1-CB 3.95Å; Y20-Q22 HydrophobicContact CE2-CB 4.08Å; Y20-Q22 HydrophobicContact CE2-CG 4.42Å; Y20-Q22 HydrophobicContact CG-CB 4.49Å; Y20-Q22 VanDerWaalsContact CZ-OE1 3.22Å; Y20-Q22 PolarHBondContact OH-OE1 2.91Å; Q22-L24 PolarHBondContact O-N 2.99Å
23S31.7Very low34.3Very low79 Ų79138.8 Ų138.855%0.55271%0.705SS**  trans-45110.5-177.9-166.70000110.2K21 S25K21-S23 PolarHBondContact O-N 2.92Å; K21-S23 VanDerWaalsContact O-N 3.15Å; S23-S25 WeakPolarHBondContact CB-OG 3.07Å; S23-S25 PolarHBondContact O-N 2.91Å; S23-S25 WeakPolarHBondContact OG-CB 3.39Å; S23-S25 PolarHBondContact OG-OG 3.21Å
24L34.5Very low34.5Very low149 Ų149137.5 Ų137.578%0.7871%0.71SS**G310 helixtrans-63.98.4169.6-106.2110000112.6Q22 D26 I27Q22-L24 PolarHBondContact O-N 2.99Å; L24-D26 VanDerWaalsContact C-N 3.27Å; L24-D26 PolarHBondContact O-N 3.17Å; L24-I27 HydrophobicContact CD2-CD1 4.45Å; L24-I27 HydrophobicContact CG-CD1 4.47Å
25S36.9Very low34.5Very low84 Ų84133.1 Ų133.159%0.58770%0.701SS**G310 helixtrans-70.3-21.117659.90000113.8S23S23-S25 WeakPolarHBondContact CB-OG 3.07Å; S23-S25 PolarHBondContact O-N 2.91Å; S23-S25 WeakPolarHBondContact OG-CB 3.39Å; S23-S25 PolarHBondContact OG-OG 3.21Å
26D38.1Very low34.9Very low138 Ų138133.7 Ų133.774%0.73871%0.707SS**G310 helixtrans-100.4-1.4-170.1-620.1000112.9L24 D28L24-D26 VanDerWaalsContact C-N 3.27Å; L24-D26 PolarHBondContact O-N 3.17Å; D26-D28 VanDerWaalsContact C-N 3.32Å; D26-D28 PolarHBondContact O-N 2.88Å
27I37.7Very low35Very low114 Ų114134.2 Ų134.259%0.58571%0.708SS**SBendtrans-80.194167.1-58.9173.6000106.2L24 S29L24-I27 HydrophobicContact CD2-CD1 4.45Å; L24-I27 HydrophobicContact CG-CD1 4.47Å; I27-S29 PolarHBondContact O-N 2.65Å
28D36.8Very low35.2Very low113 Ų113138.8 Ų138.860%0.60472%0.715SS**  trans-44.8104.7173.4-138.7-26.8000108.6D26 N30 E31D26-D28 VanDerWaalsContact C-N 3.32Å; D26-D28 PolarHBondContact O-N 2.88Å; D28-N30 PolarHBondContact O-N 3.07Å; D28-E31 PolarHBondContact O-N 3.28Å
29S38.1Very low35.5Very low92 Ų92141 Ų14164%0.64371%0.712SS**G310 helixtrans-60.8-5.8-174.949.20000113.2I27 E31 L32I27-S29 PolarHBondContact O-N 2.65Å; S29-E31 VanDerWaalsContact C-N 3.31Å; S29-E31 PolarHBondContact O-N 3.09Å; S29-L32 WeakPolarHBondContact O-CB 3.29Å; S29-L32 PolarHBondContact O-N 3.02Å
30N36Very low36.1Very low131 Ų131139.8 Ų139.870%0.70171%0.713SS**G310 helixtrans-70.8-18.8176.8-75.3-30000114.3D28 L32D28-N30 PolarHBondContact O-N 3.07Å; N30-L32 VanDerWaalsContact C-N 3.32Å
31E39.2Very low36.8Very low184 Ų184141.1 Ų141.186%0.8672%0.717SS**G310 helixtrans-85-7.6172.3-68.3-162.116300113.3D28 S29 Y33D28-E31 PolarHBondContact O-N 3.28Å; S29-E31 VanDerWaalsContact C-N 3.31Å; S29-E31 PolarHBondContact O-N 3.09Å; E31-Y33 PolarHBondContact O-N 2.9Å
32L38.3Very low37.3Very low127 Ų127137.7 Ų137.767%0.66571%0.708SS**SBendtrans-80.640.9-176.1-126.391.2000113.4S29 N30S29-L32 WeakPolarHBondContact O-CB 3.29Å; S29-L32 PolarHBondContact O-N 3.02Å; N30-L32 VanDerWaalsContact C-N 3.32Å
33Y29Very low38Very low212 Ų212135.9 Ų135.983%0.83171%0.705SS**SBendtrans81.1116.1-179.2-55-91.9000114.1E31E31-Y33 PolarHBondContact O-N 2.9Å
34P37.1Very low39Very low125 Ų125139.6 Ų139.681%0.81272%0.719SS**SBend-152.8104.280.835.7-14.4000113.8
35G33.1Very low39.9Very low58 Ų58136.2 Ų136.260%0.59870%0.702SS**SBendtrans16047.6171.400000117.2V37G35-V37 VanDerWaalsContact C-N 3.28Å; G35-V37 PolarHBondContact O-N 2.71Å
36K36.2Very low40.8Very low183 Ų183135 Ų13580%0.79669%0.691SS**  trans40.145.1152.3-56.9-175-179.5-179.20116.7Y38K36-Y38 HydrophobicContact CB-CD2 4.18Å; K36-Y38 HydrophobicContact CB-CE2 4.2Å; K36-Y38 HydrophobicContact CG-CE2 4.27Å; K36-Y38 PolarHBondContact O-N 2.9Å
37V38.8Very low41.7Very low126 Ų126134 Ų13476%0.76470%0.703SS**  trans-81.977.6158.3-171.10000105.7G35 R39G35-V37 VanDerWaalsContact C-N 3.28Å; G35-V37 PolarHBondContact O-N 2.71Å; V37-R39 HydrophobicContact CG1-CG 4.27Å; V37-R39 PolarHBondContact O-N 3.48Å
38Y37.2Very low42.8Very low198 Ų198138.6 Ų138.678%0.77671%0.713SS**  trans-63.989.8160.3-74.4-90.7000105K36 S40K36-Y38 HydrophobicContact CB-CD2 4.18Å; K36-Y38 HydrophobicContact CB-CE2 4.2Å; K36-Y38 HydrophobicContact CG-CE2 4.27Å; K36-Y38 PolarHBondContact O-N 2.9Å; Y38-S40 PolarHBondContact O-N 3.4Å
39R39.5Very low43.8Very low204 Ų204136 Ų13677%0.7770%0.696SS**  trans-55.7104.4157-77.9-172.6177.7179.11103.5V37 W41V37-R39 HydrophobicContact CG1-CG 4.27Å; V37-R39 PolarHBondContact O-N 3.48Å; R39-W41 VanDerWaalsContact C-N 3.34Å; R39-W41 PolarHBondContact O-N 2.82Å; R39-W41 PolarHBondContact O-NE1 2.86Å
40S44.6Very low44.7Very low99 Ų99136.3 Ų136.369%0.69269%0.691SS**  trans-61106169.651.90000104.5Y38 N42Y38-S40 PolarHBondContact O-N 3.4Å; S40-N42 VanDerWaalsContact C-N 3.27Å; S40-N42 PolarHBondContact O-N 2.84Å
41W45.6Very low45.6Very low220 Ų220138.7 Ų138.783%0.83369%0.69SS**  trans-65105.5170.7-49.8-9.8000102.6R39 V43R39-W41 VanDerWaalsContact C-N 3.34Å; R39-W41 PolarHBondContact O-N 2.82Å; R39-W41 PolarHBondContact O-NE1 2.86Å; W41-V43 HydrophobicContact CB-CG2 3.94Å; W41-V43 PolarHBondContact O-N 3.28Å
42N41.3Very low46.7Very low129 Ų129138.4 Ų138.469%0.6969%0.688SS**  trans-66.976.4164.6-101.4-8.2000104.7S40 D44S40-N42 VanDerWaalsContact C-N 3.27Å; S40-N42 PolarHBondContact O-N 2.84Å; N42-D44 PolarHBondContact O-N 3.49Å
43V48Very low47.6Very low88 Ų88135.9 Ų135.953%0.53369%0.686SS.*  trans-71.1116.8161.3-174.60000102.7W41 L45W41-V43 HydrophobicContact CB-CG2 3.94Å; W41-V43 PolarHBondContact O-N 3.28Å; V43-L45 HydrophobicContact CB-CG 4.48Å; V43-L45 WeakPolarHBondContact O-CD1 3.48Å; V43-L45 WeakPolarHBondContact O-CG 3.42Å; V43-L45 PolarHBondContact O-N 2.84Å
44D53.9Low48.4Very low158 Ų158133.2 Ų133.285%0.84568%0.676SS**  trans-59.991.2166.4-70.3-39.2000106.4N42N42-D44 PolarHBondContact O-N 3.49Å
45L53.6Low49Very low78 Ų78135.2 Ų135.241%0.40867%0.674SS.*  trans-68.1138.6-178.9-74.2131.1000106.9V43 F49V43-L45 HydrophobicContact CB-CG 4.48Å; V43-L45 WeakPolarHBondContact O-CD1 3.48Å; V43-L45 WeakPolarHBondContact O-CG 3.42Å; V43-L45 PolarHBondContact O-N 2.84Å; L45-F49 HydrophobicContact CB-CB 4.1Å; L45-F49 HydrophobicContact CB-CD1 4.07Å; L45-F49 HydrophobicContact CB-CG 4.21Å; L45-F49 HydrophobicContact CD1-CD1 4.5Å; L45-F49 HydrophobicContact CD2-CB 4.46Å; L45-F49 HydrophobicContact CD2-CD1 3.55Å; L45-F49 HydrophobicContact CD2-CD2 4.04Å; L45-F49 HydrophobicContact CD2-CE1 3.62Å; L45-F49 HydrophobicContact CD2-CE2 4.1Å; L45-F49 HydrophobicContact CD2-CG 3.74Å; L45-F49 HydrophobicContact CD2-CZ 3.87Å; L45-F49 HydrophobicContact CG-CD1 4.24Å
46P54.1Low49.9Very low58 Ų58137.8 Ų137.838%0.37768%0.68SS.*  trans-53.3149.4-179.5-22.930.2000111.4W48 F49P46-W48 VanDerWaalsContact CB-CD1 3.44Å; P46-W48 HydrophobicContact CB-CD2 3.99Å; P46-W48 VanDerWaalsContact CB-CE2 3.45Å; P46-W48 HydrophobicContact CB-CG 3.99Å; P46-W48 HydrophobicContact CB-CZ2 4.03Å; P46-W48 HydrophobicContact CG-CZ2 3.74Å; P46-W48 PolarHBondContact O-N 2.89Å; P46-F49 VanDerWaalsContact O-CB 3.23Å; P46-F49 WeakPolarHBondContact O-CB 3.35Å; P46-F49 PolarHBondContact O-N 2.76Å
47A58.5Low50.4Low118 Ų118137 Ų13798%0.97568%0.682SS**THydrogen-bonded Turntrans-58.8-19.6-179.600000114.4F49A47-F49 VanDerWaalsContact C-N 3.34Å
48W60.4Low50.9Low209 Ų209139.2 Ų139.279%0.79268%0.683SS**THydrogen-bonded Turntrans-82.7-9.8174.158.7-101.1000113.6P46 D50P46-W48 VanDerWaalsContact CB-CD1 3.44Å; P46-W48 HydrophobicContact CB-CD2 3.99Å; P46-W48 VanDerWaalsContact CB-CE2 3.45Å; P46-W48 HydrophobicContact CB-CG 3.99Å; P46-W48 HydrophobicContact CB-CZ2 4.03Å; P46-W48 HydrophobicContact CG-CZ2 3.74Å; P46-W48 PolarHBondContact O-N 2.89Å; W48-D50 PolarHBondContact O-N 2.84Å
49F58.2Low51.1Low60 Ų60140.3 Ų140.326%0.26369%0.688SS.*SBendtrans-82.4103.7179.1-168.2-87000109.5L45 P46 A47 R51 Y54L45-F49 HydrophobicContact CB-CB 4.1Å; L45-F49 HydrophobicContact CB-CD1 4.07Å; L45-F49 HydrophobicContact CB-CG 4.21Å; L45-F49 HydrophobicContact CD1-CD1 4.5Å; L45-F49 HydrophobicContact CD2-CB 4.46Å; L45-F49 HydrophobicContact CD2-CD1 3.55Å; L45-F49 HydrophobicContact CD2-CD2 4.04Å; L45-F49 HydrophobicContact CD2-CE1 3.62Å; L45-F49 HydrophobicContact CD2-CE2 4.1Å; L45-F49 HydrophobicContact CD2-CG 3.74Å; L45-F49 HydrophobicContact CD2-CZ 3.87Å; L45-F49 HydrophobicContact CG-CD1 4.24Å; P46-F49 VanDerWaalsContact O-CB 3.23Å; P46-F49 WeakPolarHBondContact O-CB 3.35Å; P46-F49 PolarHBondContact O-N 2.76Å; A47-F49 VanDerWaalsContact C-N 3.34Å; F49-R51 PolarHBondContact O-N 3.15Å; F49-Y54 HydrophobicContact CE1-CD2 4.11Å; F49-Y54 HydrophobicContact CE1-CG 4Å; F49-Y54 HydrophobicContact CE2-CD2 4.19Å; F49-Y54 HydrophobicContact CE2-CE2 4.46Å; F49-Y54 HydrophobicContact CZ-CD1 4.45Å; F49-Y54 AromaticContact CZ-CD2 3.37Å; F49-Y54 HydrophobicContact CZ-CD2 3.37Å; F49-Y54 AromaticContact CZ-CE2 3.85Å; F49-Y54 HydrophobicContact CZ-CE2 3.85Å; F49-Y54 AromaticContact CZ-CG 3.69Å; F49-Y54 HydrophobicContact CZ-CG 3.69Å
50D56.4Low51.3Low98 Ų98136.6 Ų136.652%0.52468%0.683SS.*  trans-70.899.7176.6-168.4-13000110W48 E52 A53 Y54W48-D50 PolarHBondContact O-N 2.84Å; D50-E52 PolarHBondContact O-N 2.79Å; D50-E52 WeakPolarHBondContact OD1-CB 3.44Å; D50-E52 PolarHBondContact OD1-N 2.9Å; D50-A53 HydrophobicContact CB-CB 3.91Å; D50-A53 PolarHBondContact O-N 2.63Å; D50-A53 PolarHBondContact OD1-N 3.05Å; D50-Y54 PolarHBondContact O-N 3.06Å
51R54.6Low51.5Low181 Ų181137.3 Ų137.368%0.68369%0.688SS**THydrogen-bonded Turntrans-64.3-25.6-179.9-158.1179.9-170.6-1785.9111.7F49F49-R51 PolarHBondContact O-N 3.15Å
52E61.5Low51.2Low177 Ų177134.5 Ų134.583%0.82769%0.686SS**THydrogen-bonded Turntrans-77.7-33.5178.8-61.1-173.7175.800111.5D50 Y54D50-E52 PolarHBondContact O-N 2.79Å; D50-E52 WeakPolarHBondContact OD1-CB 3.44Å; D50-E52 PolarHBondContact OD1-N 2.9Å; E52-Y54 VanDerWaalsContact C-N 3.26Å; E52-Y54 PolarHBondContact O-N 3.24Å
53A57.6Low51.2Low75 Ų75133.6 Ų133.662%0.6268%0.681SS**THydrogen-bonded Turntrans-68.8-25.9173.200000112.6D50 Q55D50-A53 HydrophobicContact CB-CB 3.91Å; D50-A53 PolarHBondContact O-N 2.63Å; D50-A53 PolarHBondContact OD1-N 3.05Å; A53-Q55 VanDerWaalsContact C-N 3.3Å; A53-Q55 PolarHBondContact O-N 2.78Å
54Y46.3Very low51.1Low156 Ų156140.9 Ų140.961%0.61270%0.699SS**  trans-81.474.2179.1-149.8-95.3000111.4F49 D50 E52 P56F49-Y54 HydrophobicContact CE1-CD2 4.11Å; F49-Y54 HydrophobicContact CE1-CG 4Å; F49-Y54 HydrophobicContact CE2-CD2 4.19Å; F49-Y54 HydrophobicContact CE2-CE2 4.46Å; F49-Y54 HydrophobicContact CZ-CD1 4.45Å; F49-Y54 AromaticContact CZ-CD2 3.37Å; F49-Y54 HydrophobicContact CZ-CD2 3.37Å; F49-Y54 AromaticContact CZ-CE2 3.85Å; F49-Y54 HydrophobicContact CZ-CE2 3.85Å; F49-Y54 AromaticContact CZ-CG 3.69Å; F49-Y54 HydrophobicContact CZ-CG 3.69Å; D50-Y54 PolarHBondContact O-N 3.06Å; E52-Y54 VanDerWaalsContact C-N 3.26Å; E52-Y54 PolarHBondContact O-N 3.24Å; Y54-P56 WeakPolarHBondContact O-CD 3.37Å
55Q50.1Low50.7Low166 Ų166142.8 Ų142.878%0.77670%0.695SS**  trans-61.6122.6162.2-77.3-172.77.900108A53 M57A53-Q55 VanDerWaalsContact C-N 3.3Å; A53-Q55 PolarHBondContact O-N 2.78Å; Q55-M57 PolarHBondContact O-N 2.7Å
56P50.8Low50.3Low112 Ų112144.1 Ų144.173%0.72771%0.711SS**  trans-58.8108.7171.423.9-30.7000106.6Y54 Q58Y54-P56 WeakPolarHBondContact O-CD 3.37Å; P56-Q58 PolarHBondContact O-N 2.83Å
57M48.4Very low49.9Very low168 Ų168148 Ų14883%0.82873%0.733SS**  trans-54.4109.8178.2-158168.9-174.300105.8Q55 Y59Q55-M57 PolarHBondContact O-N 2.7Å; M57-Y59 VanDerWaalsContact C-N 3.28Å; M57-Y59 WeakPolarHBondContact O-CD2 3.13Å; M57-Y59 PolarHBondContact O-N 3.21Å
58Q48.3Very low49.4Very low171 Ų171144.7 Ų144.780%0.79971%0.711SS**  trans-60.6102.6-178.7-132.7177.82.800104.2P56 N60P56-Q58 PolarHBondContact O-N 2.83Å; Q58-N60 PolarHBondContact O-N 2.85Å
59Y41.2Very low48.8Very low221 Ų221141 Ų14187%0.86770%0.7SS**  trans-62.394.3168.3-81.5-89.1000103.6M57 S61M57-Y59 VanDerWaalsContact C-N 3.28Å; M57-Y59 WeakPolarHBondContact O-CD2 3.13Å; M57-Y59 PolarHBondContact O-N 3.21Å; Y59-S61 PolarHBondContact O-N 3.01Å
60N43.8Very low48.1Very low126 Ų126145.7 Ų145.767%0.67472%0.721SS**  trans-48.2116.7162.2-86.6-17.3000103.1Q58 M62Q58-N60 PolarHBondContact O-N 2.85Å; N60-M62 HydrophobicContact CB-CG 4.47Å; N60-M62 PolarHBondContact O-N 2.84Å
61S48.8Very low47.4Very low115 Ų115142.6 Ų142.680%0.80471%0.712SS**  trans-66.771.5167.560.50000105.1Y59 D63Y59-S61 PolarHBondContact O-N 3.01Å; S61-D63 VanDerWaalsContact C-N 3.28Å; S61-D63 PolarHBondContact O-N 2.97Å
62M39.6Very low47.5Very low161 Ų161140.2 Ų140.279%0.79372%0.723SS**  trans-51.5111161.2-79.3-71.5-116.900102.9N60 R64N60-M62 HydrophobicContact CB-CG 4.47Å; N60-M62 PolarHBondContact O-N 2.84Å; M62-R64 PolarHBondContact O-N 3.48Å
63D42.4Very low47Very low109 Ų109142 Ų14258%0.58372%0.723SS**  trans-44106.9-168.7-163.2-4.4000108.4S61 R65S61-D63 VanDerWaalsContact C-N 3.28Å; S61-D63 PolarHBondContact O-N 2.97Å; D63-R65 PolarHBondContact O-N 2.73Å; D63-R65 WeakPolarHBondContact OD1-CB 3.46Å; D63-R65 WeakPolarHBondContact OD1-CD 3.47Å; D63-R65 WeakPolarHBondContact OD1-CG 3.45Å; D63-R65 IonicContact OD1-NE 3.62Å
64R44.8Very low46.4Very low242 Ų242141 Ų14191%0.91372%0.719SS**  trans-64.61179.6-75.7-175.6170.6-176.5-1.8111.8M62 S66M62-R64 PolarHBondContact O-N 3.48Å; R64-S66 PolarHBondContact O-N 2.95Å
65R46.3Very low46.4Very low198 Ų198141 Ų14175%0.74772%0.722SS**SBendtrans-66.2100.6173-68.1176-173.9-173.2-0.9108.6D63D63-R65 PolarHBondContact O-N 2.73Å; D63-R65 WeakPolarHBondContact OD1-CB 3.46Å; D63-R65 WeakPolarHBondContact OD1-CD 3.47Å; D63-R65 WeakPolarHBondContact OD1-CG 3.45Å; D63-R65 IonicContact OD1-NE 3.62Å
66S44.6Very low46.1Very low106 Ų106141.8 Ų141.874%0.74172%0.723SS**  trans71.679.8164.671.40000115.6R64 G68R64-S66 PolarHBondContact O-N 2.95Å; S66-G68 PolarHBondContact O-N 2.78Å
67V46.7Very low46Very low138 Ų138140.1 Ų140.184%0.83671%0.711SS**  trans-62.796.9137.6-158.70000104.6F69V67-F69 PolarHBondContact O-N 3.29Å
68G47.5Very low46Very low50 Ų50136.8 Ų136.852%0.51570%0.702SS.*  trans-54.1117.4-17600000109.3S66 F70S66-G68 PolarHBondContact O-N 2.78Å; G68-F70 PolarHBondContact O-N 2.96Å
69F47.6Very low46Very low130 Ų130135 Ų13557%0.5769%0.692SS**SBendtrans-67.214.3178.1-113.7-81.6000113.9V67 F79V67-F69 PolarHBondContact O-N 3.29Å; F69-F79 AromaticContact CD1-CE2 3.93Å; F69-F79 HydrophobicContact CD1-CE2 3.93Å; F69-F79 AromaticContact CD1-CZ 3.74Å; F69-F79 HydrophobicContact CD1-CZ 3.74Å; F69-F79 HydrophobicContact CE1-CD1 4.5Å; F69-F79 HydrophobicContact CE1-CD2 4.45Å; F69-F79 AromaticContact CE1-CE1 3.58Å; F69-F79 HydrophobicContact CE1-CE1 3.58Å; F69-F79 AromaticContact CE1-CE2 3.51Å; F69-F79 HydrophobicContact CE1-CE2 3.51Å; F69-F79 AromaticContact CE1-CZ 3Å; F69-F79 HydrophobicContact CE1-CZ 3Å; F69-F79 HydrophobicContact CE2-CZ 4.46Å; F69-F79 AromaticContact CZ-CE1 3.68Å; F69-F79 HydrophobicContact CZ-CE1 3.68Å; F69-F79 HydrophobicContact CZ-CE2 4.37Å; F69-F79 AromaticContact CZ-CZ 3.44Å; F69-F79 HydrophobicContact CZ-CZ 3.44Å; F69-F79 VanDerWaalsContact CZ-CZ 3.44Å
70F43.4Very low46.5Very low159 Ų159133.5 Ų133.570%0.69769%0.69SS**EExtended strand (participates in β ladder)trans-112.5102.5-179.3-60.4-80.3000107.2G68G68-F70 PolarHBondContact O-N 2.96Å
71G42.2Very low46.4Very low33 Ų33130.7 Ų130.734%0.3469%0.691SS.*EExtended strand (participates in β ladder)trans-50.1149.2159.400000108.8R73 G74G71-R73 CarbonylContact O-C 3.57Å; G71-R73 PolarHBondContact O-N 2.83Å; G71-G74 PolarHBondContact O-N 3.27Å
72S54.9Low46.3Very low132 Ų132129.4 Ų129.492%0.92369%0.687SS**THydrogen-bonded Turntrans-45.7-1.9-168.152.10000118.8
73R51.2Low46.6Very low214 Ų214133.3 Ų133.381%0.80869%0.693SS**THydrogen-bonded Turntrans-131.524174.9-67.2-171.1169.5-173.7-2.2114.5G71 K75G71-R73 CarbonylContact O-C 3.57Å; G71-R73 PolarHBondContact O-N 2.83Å; R73-K75 HydrophobicContact CB-CG 4.43Å; R73-K75 PolarHBondContact O-N 3.31Å; R73-K75 VanDerWaalsContact O-N 3.07Å
74G45.5Very low46.5Very low53 Ų53131.8 Ų131.855%0.54670%0.703SS.*THydrogen-bonded Turntrans64.613.4-176.700000113.5G71 K76G71-G74 PolarHBondContact O-N 3.27Å; G74-K76 PolarHBondContact O-N 3.44Å
75K46.5Very low46.6Very low157 Ų157129.7 Ų129.768%0.68370%0.7SS**EExtended strand (participates in β ladder)trans-74.8113.2175.1-69.1-168.3177.8-174.60107.8R73 V77R73-K75 HydrophobicContact CB-CG 4.43Å; R73-K75 PolarHBondContact O-N 3.31Å; R73-K75 VanDerWaalsContact O-N 3.07Å; K75-V77 PolarHBondContact O-N 3.33Å
76K44.8Very low46.4Very low182 Ų182131.6 Ų131.679%0.79171%0.707SS**EExtended strand (participates in β ladder)trans-50.1113.4173-153173.4-170.2178.20107.6G74G74-K76 PolarHBondContact O-N 3.44Å
77V46.8Very low46.6Very low77 Ų77133.5 Ų133.547%0.46771%0.709SS.*  trans-62.1125.2175.7-172.40000105.8K75 F79K75-V77 PolarHBondContact O-N 3.33Å; V77-F79 PolarHBondContact O-N 3.39Å
78P49.7Very low46.3Very low99 Ų99134.9 Ų134.964%0.64371%0.706SS**  trans-58.7111177.522.9-31.1000107.5F80P78-F80 VanDerWaalsContact C-N 3.32Å; P78-F80 PolarHBondContact O-N 2.71Å
79F47.9Very low46Very low133 Ų133136.9 Ų136.958%0.58370%0.703SS**  trans-61.4102.4165.6-80.7-97.9000105.9F69 V77 G81 A82F69-F79 AromaticContact CD1-CE2 3.93Å; F69-F79 HydrophobicContact CD1-CE2 3.93Å; F69-F79 AromaticContact CD1-CZ 3.74Å; F69-F79 HydrophobicContact CD1-CZ 3.74Å; F69-F79 HydrophobicContact CE1-CD1 4.5Å; F69-F79 HydrophobicContact CE1-CD2 4.45Å; F69-F79 AromaticContact CE1-CE1 3.58Å; F69-F79 HydrophobicContact CE1-CE1 3.58Å; F69-F79 AromaticContact CE1-CE2 3.51Å; F69-F79 HydrophobicContact CE1-CE2 3.51Å; F69-F79 AromaticContact CE1-CZ 3Å; F69-F79 HydrophobicContact CE1-CZ 3Å; F69-F79 HydrophobicContact CE2-CZ 4.46Å; F69-F79 AromaticContact CZ-CE1 3.68Å; F69-F79 HydrophobicContact CZ-CE1 3.68Å; F69-F79 HydrophobicContact CZ-CE2 4.37Å; F69-F79 AromaticContact CZ-CZ 3.44Å; F69-F79 HydrophobicContact CZ-CZ 3.44Å; F69-F79 VanDerWaalsContact CZ-CZ 3.44Å; V77-F79 PolarHBondContact O-N 3.39Å; F79-G81 PolarHBondContact O-N 3.4Å; F79-A82 PolarHBondContact O-N 2.92Å
80F51Low45.9Very low190 Ų190137.5 Ų137.583%0.83371%0.713SS**THydrogen-bonded Turntrans-58.487.7157.3-80.7-91.2000106.4P78 L87P78-F80 VanDerWaalsContact C-N 3.32Å; P78-F80 PolarHBondContact O-N 2.71Å; F80-L87 HydrophobicContact CD1-CD2 4.48Å; F80-L87 HydrophobicContact CE1-CD2 4.43Å
81G41.8Very low45.9Very low67 Ų67134.2 Ų134.269%0.69172%0.715SS**THydrogen-bonded Turntrans170.7-14.1-164.400000113.4F79 R83F79-G81 PolarHBondContact O-N 3.4Å; G81-R83 VanDerWaalsContact C-N 3.25Å; G81-R83 PolarHBondContact O-N 2.92Å
82A47.5Very low45.9Very low87 Ų87136.3 Ų136.372%0.71972%0.717SS**SBendtrans-63.791.5157.700000109.3F79F79-A82 PolarHBondContact O-N 2.92Å
83R45.2Very low44.9Very low243 Ų243133.8 Ų133.892%0.91770%0.698SS**SBendtrans42.389.4158.8-156.4176-172.3-178.61.8115.4G81 K85G81-R83 VanDerWaalsContact C-N 3.25Å; G81-R83 PolarHBondContact O-N 2.92Å; R83-K85 PolarHBondContact O-N 2.73Å
84G39.9Very low44.5Very low77 Ų77132.7 Ų132.779%0.79470%0.702SS**  trans78.412143.900000119R86G84-R86 PolarHBondContact O-N 2.74Å
85K48.9Very low44.2Very low198 Ų198134.6 Ų134.686%0.86171%0.707SS**  trans-76.684.6157.5-68.7-161.1-180-172.60108.2R83 L87R83-K85 PolarHBondContact O-N 2.73Å; K85-L87 PolarHBondContact O-N 2.88Å
86R41Very low43.6Very low238 Ų238135.8 Ų135.890%0.89871%0.708SS**  trans-45125.1158.7-101.5174.8158.9170.4-7.2106G84 Q88G84-R86 PolarHBondContact O-N 2.74Å; R86-Q88 PolarHBondContact O-N 3.28Å
87L48.7Very low42.9Very low147 Ų147130.8 Ų130.877%0.7769%0.688SS**  trans-48.6113.2168.3-70.2165.2000105.8F80 K85 M89F80-L87 HydrophobicContact CD1-CD2 4.48Å; F80-L87 HydrophobicContact CE1-CD2 4.43Å; K85-L87 PolarHBondContact O-N 2.88Å; L87-M89 PolarHBondContact O-N 3Å; L87-M89 VanDerWaalsContact O-N 3.07Å
88Q40.8Very low42.5Very low166 Ų166131.1 Ų131.178%0.77670%0.698SS**  trans-54.8119.2172.2-86.2174.6-26.400105.6R86 D90R86-Q88 PolarHBondContact O-N 3.28Å; Q88-D90 PolarHBondContact O-N 2.8Å; Q88-D90 VanDerWaalsContact O-N 3.09Å
89M41.2Very low41.8Very low92 Ų92133 Ų13345%0.45370%0.703SS.*G310 helixtrans-72.32.3-176.5-141.2-167.717200111.8L87 A91 I92 Q97L87-M89 PolarHBondContact O-N 3Å; L87-M89 VanDerWaalsContact O-N 3.07Å; M89-A91 VanDerWaalsContact C-N 3.25Å; M89-A91 PolarHBondContact O-N 2.82Å; M89-I92 HydrophobicContact CE-CD1 4.36Å; M89-I92 HydrophobicContact CG-CD1 4.25Å; M89-Q97 HydrophobicContact CE-CB 4.41Å; M89-Q97 HydrophobicContact CE-CG 3.92Å; M89-Q97 PolarHBondContact O-NE2 3.05Å
90D45.8Very low41Very low144 Ų144130.4 Ų130.477%0.7771%0.714SS**G310 helixtrans-82.14.7-164.3-52.2-29.6000114.1Q88Q88-D90 PolarHBondContact O-N 2.8Å; Q88-D90 VanDerWaalsContact O-N 3.09Å
91A43.2Very low40.1Very low90 Ų90130.7 Ų130.774%0.74471%0.714SS**G310 helixtrans-131.312.3178.700000114.6M89 P93M89-A91 VanDerWaalsContact C-N 3.25Å; M89-A91 PolarHBondContact O-N 2.82Å; A91-P93 VanDerWaalsContact O-CD 3.29Å; A91-P93 WeakPolarHBondContact O-CD 3.23Å
92I41.6Very low39.8Very low76 Ų76133.2 Ų133.239%0.3971%0.712SS.*SBendtrans-77.9115162.7-54.2172.3000105.3M89 E94 Q97M89-I92 HydrophobicContact CE-CD1 4.36Å; M89-I92 HydrophobicContact CG-CD1 4.25Å; I92-E94 PolarHBondContact O-N 3.25Å; I92-Q97 HydrophobicContact CB-CG 3.54Å; I92-Q97 HydrophobicContact CD1-CG 4.06Å; I92-Q97 HydrophobicContact CG1-CG 4.39Å; I92-Q97 HydrophobicContact CG2-CB 4.42Å; I92-Q97 HydrophobicContact CG2-CG 3.45Å; I92-Q97 VanDerWaalsContact CG2-CG 3.45Å
93P33Very low39.1Very low80 Ų80138.7 Ų138.752%0.51972%0.72SS.*  trans-52.6134174.722-31.5000108.2A91 S95 Y96A91-P93 VanDerWaalsContact O-CD 3.29Å; A91-P93 WeakPolarHBondContact O-CD 3.23Å; P93-S95 PolarHBondContact O-N 3.35Å; P93-Y96 HydrophobicContact CG-CD2 4.46Å; P93-Y96 PolarHBondContact O-N 3.18Å
94E43.2Very low38.6Very low191 Ų191134.4 Ų134.489%0.89372%0.715SS**THydrogen-bonded Turntrans-51.5-19.5-173.4-72.9174.1149.500113.5I92 Y96I92-E94 PolarHBondContact O-N 3.25Å; E94-Y96 VanDerWaalsContact C-N 3.3Å; E94-Y96 PolarHBondContact O-N 3.3Å
95S38.9Very low38.1Very low92 Ų92133.1 Ų133.164%0.64370%0.697SS**THydrogen-bonded Turntrans-70-17.9174.253.40000115.4P93P93-S95 PolarHBondContact O-N 3.35Å
96Y34.6Very low37.1Very low183 Ų183129.3 Ų129.372%0.71870%0.695SS**THydrogen-bonded Turntrans-123.73.6-174-78.5-82.8000114.8P93 E94 A98P93-Y96 HydrophobicContact CG-CD2 4.46Å; P93-Y96 PolarHBondContact O-N 3.18Å; E94-Y96 VanDerWaalsContact C-N 3.3Å; E94-Y96 PolarHBondContact O-N 3.3Å; Y96-A98 PolarHBondContact O-N 3.29Å
97Q29.9Very low36.5Very low77 Ų77121.5 Ų121.536%0.3668%0.676SS.*  trans-74.249.7160.4-65.3-166.114.300110.5M89 I92 D99M89-Q97 HydrophobicContact CE-CB 4.41Å; M89-Q97 HydrophobicContact CE-CG 3.92Å; M89-Q97 PolarHBondContact O-NE2 3.05Å; I92-Q97 HydrophobicContact CB-CG 3.54Å; I92-Q97 HydrophobicContact CD1-CG 4.06Å; I92-Q97 HydrophobicContact CG1-CG 4.39Å; I92-Q97 HydrophobicContact CG2-CB 4.42Å; I92-Q97 HydrophobicContact CG2-CG 3.45Å; I92-Q97 VanDerWaalsContact CG2-CG 3.45Å; Q97-D99 PolarHBondContact O-N 3.24Å
98A38.8Very low35.5Very low84 Ų84122 Ų12269%0.69468%0.675SS**  trans-77.499.3158.200000105.6Y96 G100Y96-A98 PolarHBondContact O-N 3.29Å; A98-G100 PolarHBondContact O-N 3.3Å
99D35.2Very low35.2Very low139 Ų139119.9 Ų119.974%0.74368%0.675SS**  trans-43.598.1170-79.7-45.7000110.6Q97 K101Q97-D99 PolarHBondContact O-N 3.24Å; D99-K101 PolarHBondContact O-N 2.98Å
100G30.8Very low34.7Very low78 Ų78124 Ų12480%0.80469%0.691SS**SBend54.42.2110.400000120.2A98A98-G100 PolarHBondContact O-N 3.3Å
101K32.8Very low33.9Very low195 Ų195119.5 Ų119.585%0.84867%0.67SS**  trans-154.240.7179.3-67.3-166.2-178.8179.60114.1D99D99-K101 PolarHBondContact O-N 2.98Å
102N35.1Very low33.3Very low121 Ų121117.2 Ų117.265%0.64766%0.655SS**  trans-115.963.6174-92.5-14.7000112.4A105N102-A105 WeakPolarHBondContact OD1-CB 3.46Å
103K33Very low32.9Very low202 Ų202115.7 Ų115.788%0.87865%0.654SS**SBendtrans-91.8-23.2166.3-72.2-162.9177.4-174.70114.1
104N33.1Very low33.2Very low152 Ų152116.5 Ų116.581%0.81365%0.653SS**SBendtrans-127.910.4-177.8-63.7-7.3000114.1S106N104-S106 PolarHBondContact O-N 3.21Å
105A30.2Very low32.9Very low51 Ų51112.8 Ų112.842%0.42164%0.638SS.*  trans-78.979.7166.800000107.8N102 C107N102-A105 WeakPolarHBondContact OD1-CB 3.46Å; A105-C107 VanDerWaalsContact CB-SG 3.5Å; A105-C107 PolarHBondContact O-N 3.4Å
106S28.8Very low32.9Very low117 Ų117110.4 Ų110.482%0.81862%0.622SS**  trans-62.373.2144.855.70000105.9N104 H108N104-S106 PolarHBondContact O-N 3.21Å; S106-H108 VanDerWaalsContact C-N 3.35Å; S106-H108 PolarHBondContact O-N 3.16Å
107C26.8Very low33.1Very low74 Ų74106 Ų10650%0.562%0.616SS.*  trans-58.9105.8171.3-71.20000104.8A105 P109A105-C107 VanDerWaalsContact CB-SG 3.5Å; A105-C107 PolarHBondContact O-N 3.4Å; C107-P109 WeakPolarHBondContact O-CD 3.4Å; C107-P109 VanDerWaalsContact O-N 3.11Å
108H29.1Very low33.6Very low159 Ų159108.7 Ų108.774%0.73663%0.628SS**  trans-45.6122148.2-120.8-89.9000105.2S106 F110 C111S106-H108 VanDerWaalsContact C-N 3.35Å; S106-H108 PolarHBondContact O-N 3.16Å; H108-F110 PolarHBondContact O-N 2.67Å; H108-C111 PolarHBondContact O-N 3.34Å; H108-C111 VanDerWaalsContact O-N 3.16Å
109P33.5Very low33.4Very low120 Ų120107.1 Ų107.178%0.77961%0.612SS**THydrogen-bonded Turntrans-62.45.3-160.717.5-30.2000115.6C107C107-P109 WeakPolarHBondContact O-CD 3.4Å; C107-P109 VanDerWaalsContact O-N 3.11Å
110F30.6Very low33.4Very low180 Ų180103.4 Ų103.479%0.78960%0.601SS**THydrogen-bonded Turntrans-129.30.9-179.3-101.3-86.2000116.9H108H108-F110 PolarHBondContact O-N 2.67Å
111C28.8Very low33.3Very low48 Ų48101.7 Ų101.732%0.32458%0.576SS.*  trans-12296.1175.5-92.30000111.6H108 A113 C135H108-C111 PolarHBondContact O-N 3.34Å; H108-C111 VanDerWaalsContact O-N 3.16Å; C111-A113 PolarHBondContact O-N 2.99Å; C111-C135 HydrophobicContact CB-CB 4.3Å; C111-C135 WeakPolarHBondContact CB-SG 3.14Å; C111-C135 WeakPolarHBondContact SG-CB 3.28Å; C111-C135 CovalentContact SG-SG 2.07Å; C111-C135 PolarHBondContact SG-SG 2.81Å
112G30.9Very low33.1Very low43 Ų43102 Ų10244%0.44357%0.572SS.*  trans-68.987.1156.200000108.4I114 M136G112-I114 PolarHBondContact O-N 2.8Å; G112-M136 WeakPolarHBondContact O-CG 3.32Å
113A33.9Very low33.1Very low43 Ų4399 Ų9936%0.35556%0.558SS.*EExtended strand (participates in β ladder)trans-75.2109.7175.400000108.6C111 L115 T134 L141C111-A113 PolarHBondContact O-N 2.99Å; A113-L115 PolarHBondContact O-N 3.05Å; A113-T134 WeakPolarHBondContact CA-O 3.15Å; A113-L141 HydrophobicContact CB-CD1 4.26Å
114I39.1Very low33.3Very low97 Ų9798.6 Ų98.650%0.49756%0.559SS.*EExtended strand (participates in β ladder)trans-81.3113.6176.2-63.6170.4000107.3G112 S116 T134 M136G112-I114 PolarHBondContact O-N 2.8Å; I114-S116 PolarHBondContact O-N 2.85Å; I114-T134 PolarHBondContact N-O 2.86Å; I114-M136 HydrophobicContact CD1-CG 4.45Å; I114-M136 HydrophobicContact CD1-SD 3.73Å
115L37.1Very low33.4Very low113 Ų11394.5 Ų94.559%0.59255%0.552SS**EExtended strand (participates in β ladder)trans-73.997.7173.6-82.4148.8000109.3A113 Y131 Y133A113-L115 PolarHBondContact O-N 3.05Å; L115-Y131 HydrophobicContact CD2-CD1 4.43Å; L115-Y133 HydrophobicContact CD2-CD1 4.41Å; L115-Y133 HydrophobicContact CD2-CE1 3.89Å
116S39.3Very low33.5Very low43 Ų4396 Ų9630%0.30155%0.553SS.*EExtended strand (participates in β ladder)trans-106117.1168.360.70000110.1I114 Q118I114-S116 PolarHBondContact O-N 2.85Å; S116-Q118 PolarHBondContact O-N 2.75Å
117P37.9Very low34Very low91 Ų9194.6 Ų94.659%0.59154%0.536SS*.EExtended strand (participates in β ladder)trans-65121.9167.726.5-30.5000108.4I129 Y131P117-I129 HydrophobicContact CB-CG2 4.34Å; P117-Y131 HydrophobicContact CB-CD1 4.33Å; P117-Y131 HydrophobicContact CB-CE1 4.16Å
118Q41.3Very low34.6Very low132 Ų13294.3 Ų94.362%0.61753%0.527SS*.EExtended strand (participates in β ladder)trans-94.2-37.5-179.1-84.2-169.73.600112.7S116 H130 T132S116-Q118 PolarHBondContact O-N 2.75Å; Q118-H130 PolarHBondContact N-O 2.96Å; Q118-T132 VanDerWaalsContact CG-OG1 3.29Å; Q118-T132 WeakPolarHBondContact CG-OG1 3.2Å; Q118-T132 PolarHBondContact NE2-OG1 2.94Å
119S34.3Very low35.2Very low52 Ų5289.2 Ų89.236%0.36450%0.504SS..EExtended strand (participates in β ladder)trans-153.3140.9-179.654.30000111.1H130S119-H130 PolarHBondContact O-N 2.86Å
120A34.7Very low35.6Very low61 Ų6187.3 Ų87.350%0.50449%0.485SS..EExtended strand (participates in β ladder)trans-111.3111164.600000106.7L127 E128 I129A120-L127 HydrophobicContact CB-CD2 4.4Å; A120-L127 HydrophobicContact CB-CG 4.44Å; A120-E128 WeakPolarHBondContact CA-O 3.39Å; A120-I129 HydrophobicContact CB-CG1 4.34Å
121C29.1Very low36.1Very low42 Ų4282 Ų8228%0.28446%0.46SS..EExtended strand (participates in β ladder)trans-96.4132.2173.3-75.10000108.3E128C121-E128 PolarHBondContact N-O 2.89Å; C121-E128 PolarHBondContact O-N 3.02Å
122R28.6Very low36.6Very low202 Ų20281.7 Ų81.776%0.76246%0.457SS*.EExtended strand (participates in β ladder)trans-10091.7173.9-139.4174.4-165.1-1644.5108.4L126 L127R122-L126 CarbonylContact C-O 3.59Å; R122-L126 VanDerWaalsContact CA-O 3.29Å; R122-L126 WeakPolarHBondContact CA-O 3.29Å; R122-L127 HydrophobicContact CG-CD1 4.13Å
123T36Very low37Very low56 Ų5682.6 Ų82.634%0.34445%0.448SS..EExtended strand (participates in β ladder)trans-101.8123.217929.40000108.4G125 L126 E128T123-G125 PolarHBondContact O-N 3.11Å; T123-G125 VanDerWaalsContact O-N 3.1Å; T123-L126 PolarHBondContact N-O 3.36Å; T123-L126 PolarHBondContact O-N 2.92Å; T123-E128 PolarHBondContact OG1-OE2 3.1Å; T123-E128 VanDerWaalsContact OG1-OE2 3.11Å
124H36.9Very low37Very low195 Ų19583 Ų8390%0.90345%0.446SS*.THydrogen-bonded Turntrans54.830.9175.8-58.9-84000115.9L126H124-L126 VanDerWaalsContact C-N 3.26Å; H124-L126 PolarHBondContact O-N 3.45Å
125G34.3Very low36.8Very low65 Ų6579 Ų7967%0.6743%0.426SS*.THydrogen-bonded Turntrans83.4-3.9-177.700000114.5T123T123-G125 PolarHBondContact O-N 3.11Å; T123-G125 VanDerWaalsContact O-N 3.1Å
126L32.6Very low36.8Very low82 Ų8280.4 Ų80.443%0.42943%0.431SS..EExtended strand (participates in β ladder)trans-96.4142.3173.2-62.3171.8000109.8R122 T123 H124R122-L126 CarbonylContact C-O 3.59Å; R122-L126 VanDerWaalsContact CA-O 3.29Å; R122-L126 WeakPolarHBondContact CA-O 3.29Å; T123-L126 PolarHBondContact N-O 3.36Å; T123-L126 PolarHBondContact O-N 2.92Å; H124-L126 VanDerWaalsContact C-N 3.26Å; H124-L126 PolarHBondContact O-N 3.45Å
127L39.9Very low36.9Very low88 Ų8884.6 Ų84.646%0.46145%0.451SS..EExtended strand (participates in β ladder)trans-99.9103.6178.8-161111.2000108.1A120 R122 I129A120-L127 HydrophobicContact CB-CD2 4.4Å; A120-L127 HydrophobicContact CB-CG 4.44Å; R122-L127 HydrophobicContact CG-CD1 4.13Å; L127-I129 HydrophobicContact CD2-CD1 3.8Å; L127-I129 HydrophobicContact CD2-CG1 3.66Å
128E38.3Very low36.8Very low68 Ų6883.4 Ų83.432%0.31845%0.454SS..EExtended strand (participates in β ladder)trans-91.6113.8173.8-72.5179.315600108.4A120 C121 T123A120-E128 WeakPolarHBondContact CA-O 3.39Å; C121-E128 PolarHBondContact N-O 2.89Å; C121-E128 PolarHBondContact O-N 3.02Å; T123-E128 PolarHBondContact OG1-OE2 3.1Å; T123-E128 VanDerWaalsContact OG1-OE2 3.11Å
129I43.2Very low36.5Very low52 Ų5284 Ų8427%0.26746%0.457SS..EExtended strand (participates in β ladder)trans-97.7117.2175.4-54.7173.9000107.8P117 A120 L127 Y131P117-I129 HydrophobicContact CB-CG2 4.34Å; A120-I129 HydrophobicContact CB-CG1 4.34Å; L127-I129 HydrophobicContact CD2-CD1 3.8Å; L127-I129 HydrophobicContact CD2-CG1 3.66Å; I129-Y131 HydrophobicContact CB-CE2 4.04Å; I129-Y131 HydrophobicContact CG2-CD1 4.35Å; I129-Y131 HydrophobicContact CG2-CD2 4.32Å; I129-Y131 HydrophobicContact CG2-CE1 3.78Å; I129-Y131 HydrophobicContact CG2-CE2 3.76Å; I129-Y131 VanDerWaalsContact CG2-CZ 3.45Å
130H40.4Very low36.5Very low81 Ų8185.7 Ų85.738%0.37547%0.467SS..EExtended strand (participates in β ladder)trans-90.3116172.6-86.2-99.6000109.9Q118 S119Q118-H130 PolarHBondContact N-O 2.96Å; S119-H130 PolarHBondContact O-N 2.86Å
131Y41Very low36.6Very low67 Ų6785.9 Ų85.926%0.26346%0.459SS..EExtended strand (participates in β ladder)trans-92.2137.7168.3-57.4-79.5000109.1L115 P117 I129L115-Y131 HydrophobicContact CD2-CD1 4.43Å; P117-Y131 HydrophobicContact CB-CD1 4.33Å; P117-Y131 HydrophobicContact CB-CE1 4.16Å; I129-Y131 HydrophobicContact CB-CE2 4.04Å; I129-Y131 HydrophobicContact CG2-CD1 4.35Å; I129-Y131 HydrophobicContact CG2-CD2 4.32Å; I129-Y131 HydrophobicContact CG2-CE1 3.78Å; I129-Y131 HydrophobicContact CG2-CE2 3.76Å; I129-Y131 VanDerWaalsContact CG2-CZ 3.45Å
132T39.3Very low36.9Very low43 Ų4395 Ų9526%0.26449%0.488SS..EExtended strand (participates in β ladder)trans-115.7133.3164.5400000107.5Q118Q118-T132 VanDerWaalsContact CG-OG1 3.29Å; Q118-T132 WeakPolarHBondContact CG-OG1 3.2Å; Q118-T132 PolarHBondContact NE2-OG1 2.94Å
133Y39.3Very low37.4Very low61 Ų6190.1 Ų90.124%0.23948%0.477CS..EExtended strand (participates in β ladder)trans-91.6123.9176.9-62.9-88.6000107.3L115 P140 L141 D143 T145L115-Y133 HydrophobicContact CD2-CD1 4.41Å; L115-Y133 HydrophobicContact CD2-CE1 3.89Å; Y133-P140 CarbonylContact O-C 3.51Å; Y133-P140 WeakPolarHBondContact O-CA 3.16Å; Y133-L141 HydrophobicContact CG-CB 4.28Å; Y133-L141 PolarHBondContact O-N 3.05Å; Y133-D143 HydrophobicContact CD2-CB 4.4Å; Y133-D143 VanDerWaalsContact CD2-O 3.32Å; Y133-D143 WeakPolarHBondContact CD2-O 3.29Å; Y133-D143 HydrophobicContact CE2-CB 4.4Å; Y133-D143 WeakPolarHBondContact CE2-O 3.36Å; Y133-T145 PolarHBondContact OH-OG1 2.88Å
134T35Very low37.3Very low51 Ų5193.1 Ų93.131%0.31350%0.495SS..EExtended strand (participates in β ladder)trans-112.4120.9168.948.90000107.6A113 I114A113-T134 WeakPolarHBondContact CA-O 3.15Å; I114-T134 PolarHBondContact N-O 2.86Å
135C34.3Very low37.4Very low13 Ų1387.2 Ų87.29%0.08847%0.473CS..EExtended strand (participates in β ladder)trans-71.8145.6163.5-81.70000107.6C111 N137 G138 E139 L141C111-C135 HydrophobicContact CB-CB 4.3Å; C111-C135 WeakPolarHBondContact CB-SG 3.14Å; C111-C135 WeakPolarHBondContact SG-CB 3.28Å; C111-C135 CovalentContact SG-SG 2.07Å; C111-C135 PolarHBondContact SG-SG 2.81Å; C135-N137 PolarHBondContact O-N 3.35Å; C135-G138 PolarHBondContact O-N 2.07Å; C135-E139 PolarHBondContact N-O 3.08Å; C135-E139 VanDerWaalsContact N-O 3.07Å; C135-L141 WeakPolarHBondContact SG-CD1 3.47Å
136M37.9Very low37.5Very low143 Ų14388.5 Ų88.570%0.70447%0.472SS*.THydrogen-bonded Turntrans-54.2-12.5177.1-73.7-95.9-95.400114.6G112 I114 G138G112-M136 WeakPolarHBondContact O-CG 3.32Å; I114-M136 HydrophobicContact CD1-CG 4.45Å; I114-M136 HydrophobicContact CD1-SD 3.73Å; M136-G138 PolarHBondContact O-N 3.07Å
137N41.1Very low37.6Very low132 Ų13291.7 Ų91.771%0.70649%0.485SS*.THydrogen-bonded Turntrans-79.96.7171.5-66.3-8.2000113.9C135 E139C135-N137 PolarHBondContact O-N 3.35Å; N137-E139 PolarHBondContact O-N 2.93Å
138G34.8Very low37Very low65 Ų6597.8 Ų97.867%0.6750%0.501SS*.SBendtrans78.52.9179.700000114.4C135 M136C135-G138 PolarHBondContact O-N 2.07Å; M136-G138 PolarHBondContact O-N 3.07Å
139E35Very low36.8Very low144 Ų14498.3 Ų98.367%0.67352%0.517SS*.  trans-87.3125.9176.5-71.8-106.213400110.2C135 N137 L141C135-E139 PolarHBondContact N-O 3.08Å; C135-E139 VanDerWaalsContact N-O 3.07Å; N137-E139 PolarHBondContact O-N 2.93Å; E139-L141 PolarHBondContact O-N 3.19Å
140P33.9Very low36.2Very low88 Ų88102.6 Ų102.657%0.57157%0.574SS**EExtended strand (participates in β ladder)trans-71.6118.7172.928.1-31.2000109.8Y133 R142Y133-P140 CarbonylContact O-C 3.51Å; Y133-P140 WeakPolarHBondContact O-CA 3.16Å; P140-R142 PolarHBondContact O-N 3.4Å
141L37.2Very low35.9Very low66 Ų66103.7 Ų103.735%0.34658%0.584SS.*EExtended strand (participates in β ladder)trans-66.6112168.9-106.4147.7000107.5A113 Y133 C135 E139 D143A113-L141 HydrophobicContact CB-CD1 4.26Å; Y133-L141 HydrophobicContact CG-CB 4.28Å; Y133-L141 PolarHBondContact O-N 3.05Å; C135-L141 WeakPolarHBondContact SG-CD1 3.47Å; E139-L141 PolarHBondContact O-N 3.19Å; L141-D143 PolarHBondContact O-N 2.7Å
142R35.9Very low35.7Very low233 Ų233105.6 Ų105.688%0.87960%0.601SS**  trans-76.559.4179.6-70.9-176.6172.7-177.2-0.8111.8P140P140-R142 PolarHBondContact O-N 3.4Å
143D39Very low35.5Very low100 Ų100109.1 Ų109.154%0.53562%0.62SS.*  trans-122.288.2168.9-74.6-33.8000108.7Y133 L141 T145Y133-D143 HydrophobicContact CD2-CB 4.4Å; Y133-D143 VanDerWaalsContact CD2-O 3.32Å; Y133-D143 WeakPolarHBondContact CD2-O 3.29Å; Y133-D143 HydrophobicContact CE2-CB 4.4Å; Y133-D143 WeakPolarHBondContact CE2-O 3.36Å; L141-D143 PolarHBondContact O-N 2.7Å; D143-T145 VanDerWaalsContact C-N 3.32Å; D143-T145 PolarHBondContact O-N 2.9Å; D143-T145 VanDerWaalsContact O-N 3.08Å
144T34.8Very low35.3Very low118 Ų118111.9 Ų111.972%0.72464%0.642SS**  trans-75.787.1168.444.80000108.6
145T37.3Very low35.3Very low72 Ų72115.7 Ų115.744%0.44266%0.662SS.*  trans-87.9101.3166.740.10000108.6Y133 D143 E147Y133-T145 PolarHBondContact OH-OG1 2.88Å; D143-T145 VanDerWaalsContact C-N 3.32Å; D143-T145 PolarHBondContact O-N 2.9Å; D143-T145 VanDerWaalsContact O-N 3.08Å; T145-E147 PolarHBondContact O-N 2.84Å
146S36.7Very low35.3Very low92 Ų92122.5 Ų122.564%0.64370%0.701SS**  trans-79.2107168.960.30000108.9
147E35.1Very low35.2Very low149 Ų149121.1 Ų121.170%0.69670%0.7SS**  trans-82.2117.7170.1-76.3-174.2140.900109.8T145 A149T145-E147 PolarHBondContact O-N 2.84Å; E147-A149 PolarHBondContact O-N 2.93Å
148R27.7Very low34.7Very low216 Ų216120.2 Ų120.282%0.81570%0.7SS**  trans-86.498.9175.5-139-179.6-163.8-175.13.6108G150R148-G150 PolarHBondContact O-N 2.8Å
149A32.9Very low34.7Very low79 Ų79124.8 Ų124.865%0.65370%0.703SS**  trans-71.3108.7170.700000108.7E147E147-A149 PolarHBondContact O-N 2.93Å
150G30.8Very low34.7Very low141 Ų141123.1 Ų123.1100%1.45471%0.705SS**  trans-1140174.500000111.3R148R148-G150 PolarHBondContact O-N 2.8Å

Retrieved 150 of 150 residues in 57.9 ms (Link to these results)