A0A5K4F3L2_SCHMA Loading...

Uncharacterized protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F3L2, Species SCHMA (Schistosoma mansoni, Blood fluke), 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
1M38.5Very low47.1Very low237 Ų237146.7 Ų146.7100%1.16781%0.807SS**  0100.10-170.4174-76.500106.5
2A41Very low47.4Very low96 Ų96147.8 Ų147.879%0.79381%0.809SS**  trans-71.5132.1-178.100000108.5S4A2-S4 VanDerWaalsContact C-N 3.31Å; A2-S4 PolarHBondContact O-N 2.99Å
3L51Low47.7Very low171 Ų171143.1 Ų143.190%0.89579%0.793SS**  trans-60.698.1172.9-62.8170.2000106.6G5L3-G5 PolarHBondContact O-N 2.92Å
4S47.7Very low47.9Very low116 Ų116142 Ų14281%0.81180%0.801SS**  trans-56113.6177.3-161.70000106.3A2A2-S4 VanDerWaalsContact C-N 3.31Å; A2-S4 PolarHBondContact O-N 2.99Å
5G42.7Very low47.9Very low46 Ų46138.3 Ų138.347%0.47479%0.786SS.*  trans-52.4145.1-17100000110.4L3 S7L3-G5 PolarHBondContact O-N 2.92Å; G5-S7 PolarHBondContact O-N 3.39Å; G5-S7 PolarHBondContact O-OG 2.84Å
6F49.7Very low47.8Very low198 Ų198139.9 Ų139.987%0.86879%0.785SS**  trans-52.883.4164.3-62.4-93.1000108.6
7S47Very low47.6Very low92 Ų92139.9 Ų139.964%0.64379%0.79SS**  trans-95.5-12.2-171.4-49.40000112.1G5G5-S7 PolarHBondContact O-N 3.39Å; G5-S7 PolarHBondContact O-OG 2.84Å
8D47.4Very low47.6Very low149 Ų149138 Ų13880%0.79778%0.776SS**  trans-110.830.3-166.6-55.5-19.2000112.2D10D8-D10 VanDerWaalsContact C-N 3.3Å; D8-D10 PolarHBondContact O-N 2.83Å; D8-D10 VanDerWaalsContact O-N 3.14Å
9F50.2Low47.8Very low177 Ų177139.3 Ų139.378%0.77678%0.78SS**  trans-79.594.1159.4-91.5-82.2000107.2E11F9-E11 PolarHBondContact O-N 3.14Å
10D54Low47.7Very low141 Ų141142.5 Ų142.575%0.75478%0.781SS**  trans-46.3113.5160.6-78.1-40.2000107D8 L12D8-D10 VanDerWaalsContact C-N 3.3Å; D8-D10 PolarHBondContact O-N 2.83Å; D8-D10 VanDerWaalsContact O-N 3.14Å; D10-L12 PolarHBondContact O-N 2.92Å
11E49.1Very low47.8Very low191 Ų191141.6 Ų141.689%0.89377%0.771SS**  trans-60.193.9174.2-170.5172.7-162.600106F9 S13F9-E11 PolarHBondContact O-N 3.14Å; E11-S13 PolarHBondContact O-N 2.85Å
12L50.2Low48.8Very low159 Ų159138.1 Ų138.183%0.83276%0.757SS**  trans-55.9107.9175.5-67.8176.2000105.5D10 S14D10-L12 PolarHBondContact O-N 2.92Å; L12-S14 PolarHBondContact O-N 2.86Å
13S52.2Low49.5Very low87 Ų87137.5 Ų137.561%0.60876%0.76SS**  trans-50.9137.2175.571.60000106.7E11 C15E11-S13 PolarHBondContact O-N 2.85Å; S13-C15 PolarHBondContact O-N 3.14Å; S13-C15 PolarHBondContact OG-SG 3.1Å
14S50.1Low49.6Very low128 Ų128135.7 Ų135.790%0.89575%0.751SS**SBendtrans-65.564.6-176.241.50000111.6L12L12-S14 PolarHBondContact O-N 2.86Å
15C47.9Very low49.7Very low87 Ų87135.6 Ų135.659%0.58875%0.75SS**  trans-106.193173.7-620000104.6S13 T17S13-C15 PolarHBondContact O-N 3.14Å; S13-C15 PolarHBondContact OG-SG 3.1Å; C15-T17 PolarHBondContact O-N 3.01Å
16E45.5Very low50.2Low163 Ų163137.1 Ų137.176%0.76276%0.759SS**  trans12.2102.6150.756.3-152.315900115.2L18E16-L18 VanDerWaalsContact C-N 3.35Å; E16-L18 PolarHBondContact O-N 2.81Å
17T45.4Very low50.8Low141 Ų141134 Ų13487%0.86575%0.749SS**  trans-65.896.7173.315.40000108.3C15 L19C15-T17 PolarHBondContact O-N 3.01Å; T17-L19 PolarHBondContact O-N 2.98Å; T17-L19 VanDerWaalsContact O-N 3.09Å
18L47.8Very low51.1Low105 Ų105133.5 Ų133.555%0.5575%0.746SS.*  trans-66.3105.5170-71.7163.3000107.9E16 Y20 A26E16-L18 VanDerWaalsContact C-N 3.35Å; E16-L18 PolarHBondContact O-N 2.81Å; L18-Y20 VanDerWaalsContact C-N 3.3Å; L18-Y20 HydrophobicContact CB-CD2 4Å; L18-Y20 HydrophobicContact CB-CE2 3.79Å; L18-Y20 HydrophobicContact CD1-CE2 4.2Å; L18-Y20 PolarHBondContact O-N 2.66Å; L18-A26 HydrophobicContact CD2-CB 4.48Å
19L51.4Low51.7Low163 Ų163134.6 Ų134.685%0.85374%0.744SS**  trans-68.592.1164.6-82.9153.6000107.7T17 H21T17-L19 PolarHBondContact O-N 2.98Å; T17-L19 VanDerWaalsContact O-N 3.09Å; L19-H21 VanDerWaalsContact C-N 3.25Å; L19-H21 PolarHBondContact O-N 3.02Å
20Y45.3Very low51.9Low202 Ų202131.5 Ų131.579%0.79274%0.74SS**  trans-68.787.3167.5-81.7-92.9000108.6L18L18-Y20 VanDerWaalsContact C-N 3.3Å; L18-Y20 HydrophobicContact CB-CD2 4Å; L18-Y20 HydrophobicContact CB-CE2 3.79Å; L18-Y20 HydrophobicContact CD1-CE2 4.2Å; L18-Y20 PolarHBondContact O-N 2.66Å
21H50.1Low51.8Low125 Ų125133.6 Ų133.658%0.57975%0.745SS**  trans-80.5117.7159.7-122.6-83.3000107.2L19 G23 L24L19-H21 VanDerWaalsContact C-N 3.25Å; L19-H21 PolarHBondContact O-N 3.02Å; H21-G23 PolarHBondContact O-N 3.49Å; H21-G23 VanDerWaalsContact O-N 3.11Å; H21-L24 HydrophobicContact CB-CD1 4.12Å; H21-L24 HydrophobicContact CB-CG 4.46Å; H21-L24 PolarHBondContact O-N 2.89Å; H21-L24 VanDerWaalsContact O-N 3.16Å
22N58.6Low51.8Low163 Ų163128.9 Ų128.987%0.87273%0.729SS**THydrogen-bonded Turntrans-47.9121.4175.5-79-14.3000110.2
23G55.5Low51.6Low83 Ų83130.9 Ų130.986%0.85673%0.731SS**THydrogen-bonded Turntrans91.4-2.2173.700000116.6H21H21-G23 PolarHBondContact O-N 3.49Å; H21-G23 VanDerWaalsContact O-N 3.11Å
24L52.9Low51.3Low133 Ų133132.9 Ų132.970%0.69674%0.735SS**PPolyproline II helixtrans-101.1125.9171-63.6-178.9000110.4H21 A26H21-L24 HydrophobicContact CB-CD1 4.12Å; H21-L24 HydrophobicContact CB-CG 4.46Å; H21-L24 PolarHBondContact O-N 2.89Å; H21-L24 VanDerWaalsContact O-N 3.16Å; L24-A26 PolarHBondContact O-N 2.88Å
25S49.8Very low51.2Low114 Ų114138.9 Ų138.980%0.79774%0.738SS**PPolyproline II helixtrans-57.1125.8168.6-51.50000108.7I27S25-I27 PolarHBondContact O-N 2.6Å
26A54.5Low51.1Low79 Ų79142.2 Ų142.265%0.65374%0.742SS**PPolyproline II helixtrans-52.8125.8174.900000109.5L18 L24 S28L18-A26 HydrophobicContact CD2-CB 4.48Å; L24-A26 PolarHBondContact O-N 2.88Å; A26-S28 PolarHBondContact O-N 3.17Å
27I61.3Low51.2Low132 Ų132143.6 Ų143.668%0.67775%0.746SS**  trans-74.6108.4175.2-62.8172.1000106.8S25 F29S25-I27 PolarHBondContact O-N 2.6Å; I27-F29 HydrophobicContact CG2-CE1 4.41Å; I27-F29 HydrophobicContact CG2-CZ 4.31Å
28S53.8Low51.2Low81 Ų81142.1 Ų142.157%0.56674%0.737SS**  trans-75.3122.3172-177.60000109.9A26 T30A26-S28 PolarHBondContact O-N 3.17Å; S28-T30 PolarHBondContact O-N 2.91Å; S28-T30 PolarHBondContact OG-N 2.88Å; S28-T30 PolarHBondContact OG-OG1 3.26Å
29F60.8Low51Low172 Ų172145.6 Ų145.675%0.75476%0.756SS**  trans-84.713.4176.1-66.8-82.2000113.6I27 H31I27-F29 HydrophobicContact CG2-CE1 4.41Å; I27-F29 HydrophobicContact CG2-CZ 4.31Å; F29-H31 PolarHBondContact O-N 3.1Å
30T53.7Low50.8Low113 Ų113144.5 Ų144.569%0.69375%0.75SS**  trans-68.47.4-174.444.30000116.3S28 V32S28-T30 PolarHBondContact O-N 2.91Å; S28-T30 PolarHBondContact OG-N 2.88Å; S28-T30 PolarHBondContact OG-OG1 3.26Å; T30-V32 PolarHBondContact O-N 2.76Å
31H51.4Low50.7Low185 Ų185140 Ų14086%0.85675%0.747SS**  trans-100.161.3170.6-76.6-84.1000112.4F29F29-H31 PolarHBondContact O-N 3.1Å
32V49.2Very low50.5Low92 Ų92140 Ų14056%0.55876%0.761SS**  trans-129.4138158.4-167.30000104.8T30T30-V32 PolarHBondContact O-N 2.76Å
33F46.8Very low49.8Very low201 Ų201140.1 Ų140.188%0.88276%0.756SS**SBendtrans78.187.7-173.4-30.9-65.9000111.8
34D46Very low49.4Very low128 Ų128140.5 Ų140.568%0.68475%0.746SS**  -163.2118.370.1-168.5-3.6000108.9K36D34-K36 PolarHBondContact O-N 3.21Å; D34-K36 WeakPolarHBondContact OD1-CB 3.31Å; D34-K36 WeakPolarHBondContact OD1-CG 3.45Å; D34-K36 PolarHBondContact OD1-N 3.38Å
35R47Very low49Very low255 Ų255141.1 Ų141.196%0.96275%0.749SS**  trans-74.121.8-178.8-161-173.3169.6-162.6-3.1111.9
36K46.9Very low48.5Very low157 Ų157141.7 Ų141.768%0.68374%0.739SS**SBendtrans-131.398.6-170.8-56-99.8-177.71660106.9D34D34-K36 PolarHBondContact O-N 3.21Å; D34-K36 WeakPolarHBondContact OD1-CB 3.31Å; D34-K36 WeakPolarHBondContact OD1-CG 3.45Å; D34-K36 PolarHBondContact OD1-N 3.38Å
37K47.1Very low48.3Very low191 Ų191144.3 Ų144.383%0.8375%0.747SS**SBendtrans83.5102.3177-50.8170.1176.1-178.90113.5
38T45.9Very low47.8Very low111 Ų111142.5 Ų142.568%0.68175%0.746SS**  176.9101.2108.325.90000109.1L40T38-L40 HydrophobicContact CG2-CB 4.26Å; T38-L40 HydrophobicContact CG2-CD1 3.54Å; T38-L40 HydrophobicContact CG2-CG 4Å; T38-L40 PolarHBondContact O-N 2.98Å
39D44.1Very low47.2Very low177 Ų177144.4 Ų144.495%0.94775%0.75SS**  trans-70.527.9158.2-68.6-48.5000111.2C41D39-C41 PolarHBondContact O-N 2.84Å; D39-C41 VanDerWaalsContact O-N 3.14Å
40L45.3Very low46.5Very low141 Ų141141.4 Ų141.474%0.73875%0.746SS**  trans-86.596.1179.3-73170.4000107.5T38T38-L40 HydrophobicContact CG2-CB 4.26Å; T38-L40 HydrophobicContact CG2-CD1 3.54Å; T38-L40 HydrophobicContact CG2-CG 4Å; T38-L40 PolarHBondContact O-N 2.98Å
41C43.4Very low46.2Very low108 Ų108140.9 Ų140.973%0.7374%0.744SS**  trans38.694.6141.5-152.40000113.1D39 Q43D39-C41 PolarHBondContact O-N 2.84Å; D39-C41 VanDerWaalsContact O-N 3.14Å; C41-Q43 PolarHBondContact O-N 3.16Å
42S46.1Very low46.1Very low125 Ų125137.5 Ų137.587%0.87474%0.742SS**  trans-55.680.2158.629.60000108.8S44S42-S44 VanDerWaalsContact C-N 3.35Å; S42-S44 PolarHBondContact O-N 2.8Å
43Q44.7Very low45.8Very low164 Ų164143.7 Ų143.777%0.76676%0.755SS**  trans-64.6105.4166.3-160.5168.156.600104C41 L45C41-Q43 PolarHBondContact O-N 3.16Å; Q43-L45 VanDerWaalsContact C-N 3.29Å; Q43-L45 PolarHBondContact O-N 3.24Å
44S46.3Very low46Very low92 Ų92143.5 Ų143.564%0.64375%0.754SS**  trans-53.3102.6169.5-179.30000106.1S42 H46S42-S44 VanDerWaalsContact C-N 3.35Å; S42-S44 PolarHBondContact O-N 2.8Å; S44-H46 PolarHBondContact O-N 2.76Å
45L44.3Very low45.8Very low145 Ų145143.8 Ų143.876%0.75976%0.76SS**  trans-66.391.1173.3-86160.8000105.8Q43 T47Q43-L45 VanDerWaalsContact C-N 3.29Å; Q43-L45 PolarHBondContact O-N 3.24Å; L45-T47 PolarHBondContact O-N 3.26Å
46H41.1Very low45.7Very low126 Ų126143.1 Ų143.158%0.58376%0.758SS**  trans-59.2124.9166.1-91-80.9000106.8S44 S48 D49S44-H46 PolarHBondContact O-N 2.76Å; H46-S48 PolarHBondContact O-N 3.07Å; H46-D49 PolarHBondContact O-N 2.86Å
47T48.6Very low45.6Very low135 Ų135140 Ų14083%0.82876%0.756SS**G310 helixtrans-59.2-6-179.351.90000113.6L45 D49L45-T47 PolarHBondContact O-N 3.26Å; T47-D49 VanDerWaalsContact C-N 3.32Å
48S51.5Low45.4Very low93 Ų93136.1 Ų136.165%0.6575%0.753SS**G310 helixtrans-72.8-19.1173.353.20000114.3H46H46-S48 PolarHBondContact O-N 3.07Å
49D42.2Very low45.2Very low121 Ų121136.1 Ų136.165%0.64775%0.752SS**G310 helixtrans-88.3-3.1-174.4-68.4-14.5000113.6H46 T47 P51H46-D49 PolarHBondContact O-N 2.86Å; T47-D49 VanDerWaalsContact C-N 3.32Å; D49-P51 WeakPolarHBondContact O-CD 3.36Å
50V46Very low45Very low110 Ų110134.4 Ų134.467%0.66774%0.742SS**SBendtrans-76.6112.7172.8-1770000107.9S52V50-S52 PolarHBondContact O-N 2.82Å; V50-S52 VanDerWaalsContact O-N 3.09Å
51P46Very low44.4Very low101 Ų101135.2 Ų135.266%0.65674%0.744SS**  trans-59.1123.1174-16.630.7000107.4D49 R53D49-P51 WeakPolarHBondContact O-CD 3.36Å; P51-R53 PolarHBondContact O-N 2.93Å
52S48.8Very low44.3Very low115 Ų115137.2 Ų137.280%0.80475%0.747SS**  trans-68.963.3173.155.50000110V50 K54V50-S52 PolarHBondContact O-N 2.82Å; V50-S52 VanDerWaalsContact O-N 3.09Å; S52-K54 VanDerWaalsContact C-N 3.27Å; S52-K54 PolarHBondContact O-N 3.12Å
53R44Very low43.9Very low221 Ų221138.6 Ų138.683%0.83475%0.745SS**  trans-67.899.6163-74.8-167.2177.8-163.51.1105.4P51 T55P51-R53 PolarHBondContact O-N 2.93Å; R53-T55 VanDerWaalsContact C-N 3.29Å; R53-T55 PolarHBondContact O-N 3.16Å
54K50.3Low44Very low197 Ų197139.4 Ų139.486%0.85775%0.748SS**  trans-44.194.9166.7-70.8164.8172.8176.80108.1S52 R56S52-K54 VanDerWaalsContact C-N 3.27Å; S52-K54 PolarHBondContact O-N 3.12Å; K54-R56 VanDerWaalsContact C-N 3.35Å; K54-R56 PolarHBondContact O-N 2.97Å
55T43Very low43.6Very low135 Ų135144.4 Ų144.483%0.82876%0.758SS**  trans-63.4105.9165.9-39.40000104.7R53 S57R53-T55 VanDerWaalsContact C-N 3.29Å; R53-T55 PolarHBondContact O-N 3.16Å; T55-S57 VanDerWaalsContact C-N 3.28Å; T55-S57 PolarHBondContact O-N 2.87Å
56R44.5Very low43.3Very low241 Ų241142.9 Ų142.991%0.90976%0.76SS**  trans-61.497.7167.7-82.6-175.5157.6178.4-5.6105.6K54 S58K54-R56 VanDerWaalsContact C-N 3.35Å; K54-R56 PolarHBondContact O-N 2.97Å; R56-S58 PolarHBondContact O-N 3.11Å
57S44.9Very low43.2Very low91 Ų91142.8 Ų142.864%0.63677%0.768SS**  trans-63.5124.2162.963.30000106.1T55 V59T55-S57 VanDerWaalsContact C-N 3.28Å; T55-S57 PolarHBondContact O-N 2.87Å; S57-V59 VanDerWaalsContact C-N 3.27Å; S57-V59 PolarHBondContact O-N 2.92Å
58S41.8Very low42.9Very low110 Ų110142 Ų14277%0.76976%0.763SS**  trans-63.298.7163.954.10000106.5R56 I60R56-S58 PolarHBondContact O-N 3.11Å; S58-I60 PolarHBondContact O-N 2.96Å; S58-I60 VanDerWaalsContact O-N 3.08Å
59V41.6Very low42.5Very low110 Ų110142.1 Ų142.167%0.66776%0.764SS**  trans-63.9110.7167.9177.60000104.9S57 M61S57-V59 VanDerWaalsContact C-N 3.27Å; S57-V59 PolarHBondContact O-N 2.92Å; V59-M61 PolarHBondContact O-N 2.96Å
60I40Very low42.7Very low142 Ų142143.9 Ų143.973%0.72877%0.773SS**  trans-62.2117.5169.9-63.5168000104.9S58 D62S58-I60 PolarHBondContact O-N 2.96Å; S58-I60 VanDerWaalsContact O-N 3.08Å; I60-D62 VanDerWaalsContact C-N 3.28Å; I60-D62 PolarHBondContact O-N 3.09Å
61M32.9Very low42.5Very low158 Ų158143.3 Ų143.378%0.77878%0.775SS**  trans-74.585.2179.9-62.2-85.1-70.700107.1V59 D63V59-M61 PolarHBondContact O-N 2.96Å; M61-D63 PolarHBondContact O-N 2.99Å
62D41Very low42.2Very low150 Ų150149.3 Ų149.380%0.80278%0.784SS**  trans-75.6109.3153.7-90.8-27.8000106.1I60 E64I60-D62 VanDerWaalsContact C-N 3.28Å; I60-D62 PolarHBondContact O-N 3.09Å; D62-E64 PolarHBondContact O-N 2.76Å
63D39Very low42.1Very low154 Ų154151.2 Ų151.282%0.82478%0.784SS**SBendtrans-57.889.4169.5-117.2-10.7000107.2M61M61-D63 PolarHBondContact O-N 2.99Å
64E45.4Very low42Very low181 Ų181146.6 Ų146.685%0.84678%0.78SS**SBendtrans168.7113.3140-89.5175.3-167.700109.6D62D62-E64 PolarHBondContact O-N 2.76Å
65K38Very low41.6Very low196 Ų196144 Ų14485%0.85278%0.775SS**  trans77.984.1162.2-132.7166.1-173.5179.80116.2V67K65-V67 PolarHBondContact O-N 3.08Å
66S37.8Very low41.7Very low114 Ų114142.5 Ų142.580%0.79777%0.768SS**  trans-59.687166.239.40000112.8T68S66-T68 PolarHBondContact O-N 3.09Å; S66-T68 VanDerWaalsContact O-N 3.12Å
67V40.3Very low41.8Very low124 Ų124140.8 Ų140.875%0.75277%0.77SS**  trans-78.693.7168.2-175.70000108.4K65 S69K65-V67 PolarHBondContact O-N 3.08Å; V67-S69 VanDerWaalsContact C-N 3.33Å; V67-S69 PolarHBondContact O-N 3.45Å
68T41Very low41.7Very low117 Ų117140.7 Ų140.772%0.71877%0.769SS**  trans-78.177.8175.4510000110.5S66 N70S66-T68 PolarHBondContact O-N 3.09Å; S66-T68 VanDerWaalsContact O-N 3.12Å; T68-N70 VanDerWaalsContact C-N 3.33Å; T68-N70 PolarHBondContact O-N 2.92Å
69S44Very low41.7Very low97 Ų97144.9 Ų144.968%0.67877%0.773SS**  trans-78.984.9171.657.40000110.3V67 S71V67-S69 VanDerWaalsContact C-N 3.33Å; V67-S69 PolarHBondContact O-N 3.45Å; S69-S71 PolarHBondContact O-N 2.78Å
70N45.6Very low41.8Very low157 Ų157144.1 Ų144.184%0.8477%0.771SS**  trans-63.778.3160.7-83.9-54.3000109.3T68 R72T68-N70 VanDerWaalsContact C-N 3.33Å; T68-N70 PolarHBondContact O-N 2.92Å; N70-R72 VanDerWaalsContact C-N 3.32Å; N70-R72 PolarHBondContact O-N 2.89Å; N70-R72 VanDerWaalsContact O-N 3.1Å
71S42.6Very low41.9Very low99 Ų99142 Ų14269%0.69277%0.768SS**  trans-81.387.6166.257.40000108.2S69 L73S69-S71 PolarHBondContact O-N 2.78Å; S71-L73 PolarHBondContact O-N 2.8Å
72R40.4Very low42.2Very low227 Ų227142.8 Ų142.886%0.85777%0.768SS**  trans-62.9106163.9-165.9178.2-174.7-159.91.6105.6N70 V74N70-R72 VanDerWaalsContact C-N 3.32Å; N70-R72 PolarHBondContact O-N 2.89Å; N70-R72 VanDerWaalsContact O-N 3.1Å; R72-V74 VanDerWaalsContact C-N 3.27Å; R72-V74 PolarHBondContact O-N 3.01Å
73L45.4Very low42.2Very low154 Ų154145.9 Ų145.981%0.80677%0.768SS**  trans-6095.2171.2-75167.5000107.4S71 L75S71-L73 PolarHBondContact O-N 2.8Å; L73-L75 PolarHBondContact O-N 2.93Å
74V41.8Very low42.3Very low124 Ų124143.7 Ų143.775%0.75276%0.76SS**  trans-72.291168.6-179.90000105.4R72 P76R72-V74 VanDerWaalsContact C-N 3.27Å; R72-V74 PolarHBondContact O-N 3.01Å; V74-P76 WeakPolarHBondContact O-CD 3.42Å
75L43.1Very low42.1Very low142 Ų142141.9 Ų141.974%0.74376%0.756SS**  trans-62.2123.4170.4-76.6155.7000107.5L73 H77L73-L75 PolarHBondContact O-N 2.93Å; L75-H77 PolarHBondContact O-N 3.19Å; L75-H77 VanDerWaalsContact O-N 3.16Å
76P44.4Very low42.3Very low104 Ų104140.9 Ų140.968%0.67575%0.754SS**  trans-61.8121.7175.222.6-30.1000109.3V74 S78V74-P76 WeakPolarHBondContact O-CD 3.42Å; P76-S78 PolarHBondContact O-N 3.18Å
77H46.3Very low42.4Very low205 Ų205143.7 Ų143.795%0.94976%0.755SS**SBendtrans-70.566.2168.6-84.5-78.5000109.9L75L75-H77 PolarHBondContact O-N 3.19Å; L75-H77 VanDerWaalsContact O-N 3.16Å
78S42.4Very low42.6Very low89 Ų89144.7 Ų144.762%0.62276%0.756SS**SBendtrans-156.3127.8169.555.80000110.3P76P76-S78 PolarHBondContact O-N 3.18Å
79K41.6Very low42.4Very low199 Ų199150.2 Ų150.287%0.86576%0.763SS**  trans-49.9131.4173.5-76.3170.7175.2173.80109.3S81K79-S81 PolarHBondContact O-N 3.38Å
80P44.2Very low42.4Very low94 Ų94153.3 Ų153.361%0.6177%0.772SS**  trans-64.699.8175.126.1-31.9000108.6F82P80-F82 VanDerWaalsContact C-N 3.32Å; P80-F82 HydrophobicContact CB-CD2 4.3Å; P80-F82 HydrophobicContact CB-CE1 4.18Å; P80-F82 HydrophobicContact CB-CE2 3.76Å; P80-F82 HydrophobicContact CB-CZ 3.7Å; P80-F82 HydrophobicContact CG-CE2 3.74Å; P80-F82 HydrophobicContact CG-CZ 3.85Å; P80-F82 WeakPolarHBondContact O-CD2 3.33Å; P80-F82 PolarHBondContact O-N 2.92Å; P80-F82 VanDerWaalsContact O-N 3.14Å
81S41.6Very low42.1Very low96 Ų96153.6 Ų153.667%0.67177%0.77SS**  trans-7493.8162.2156.20000106K79 R83K79-S81 PolarHBondContact O-N 3.38Å; S81-R83 PolarHBondContact O-N 2.7Å
82F41Very low42.3Very low176 Ų176156 Ų15677%0.77277%0.774SS**  trans-67.686170.7-58.2-82.2000108.7P80P80-F82 VanDerWaalsContact C-N 3.32Å; P80-F82 HydrophobicContact CB-CD2 4.3Å; P80-F82 HydrophobicContact CB-CE1 4.18Å; P80-F82 HydrophobicContact CB-CE2 3.76Å; P80-F82 HydrophobicContact CB-CZ 3.7Å; P80-F82 HydrophobicContact CG-CE2 3.74Å; P80-F82 HydrophobicContact CG-CZ 3.85Å; P80-F82 WeakPolarHBondContact O-CD2 3.33Å; P80-F82 PolarHBondContact O-N 2.92Å; P80-F82 VanDerWaalsContact O-N 3.14Å
83R39.7Very low42.5Very low215 Ų215148 Ų14881%0.81176%0.757SS**  trans-90.1105.1153.8-68.3-159.6179.6-161.11105.5S81 N85S81-R83 PolarHBondContact O-N 2.7Å; R83-N85 PolarHBondContact O-N 2.9Å
84V41.8Very low42.2Very low108 Ų108146.5 Ų146.566%0.65575%0.75SS**  trans-67.187.5173.7-179.40000106.7
85N40.6Very low42.4Very low142 Ų142145.5 Ų145.576%0.75975%0.748SS**  trans-80.6114.5167.1-107.5-0.6000106.9R83 E87R83-N85 PolarHBondContact O-N 2.9Å; N85-E87 PolarHBondContact O-N 2.76Å; N85-E87 VanDerWaalsContact O-N 3.12Å
86H43.4Very low42.7Very low175 Ų175147 Ų14781%0.8175%0.749SS**THydrogen-bonded Turntrans-75.612.5-172.4-92.5-62000115.2
87E39.9Very low42.7Very low173 Ų173148.6 Ų148.681%0.80875%0.751SS**THydrogen-bonded Turntrans-111.6-9.6-166.2-60-157156.500115.8N85 R89N85-E87 PolarHBondContact O-N 2.76Å; N85-E87 VanDerWaalsContact O-N 3.12Å; E87-R89 VanDerWaalsContact C-N 3.28Å; E87-R89 PolarHBondContact O-N 3.47Å
88D43.6Very low42.6Very low145 Ų145142.2 Ų142.278%0.77573%0.729SS**  trans-83.483.7171.6-65-27000108.8L90D88-L90 PolarHBondContact O-N 2.96Å
89R37.6Very low43.1Very low233 Ų233144 Ų14488%0.87974%0.739SS**  trans-38.9107.1160.6-84.1174.9149.7166.7-5.9108.1E87 M91E87-R89 VanDerWaalsContact C-N 3.28Å; E87-R89 PolarHBondContact O-N 3.47Å; R89-M91 VanDerWaalsContact C-N 3.28Å; R89-M91 PolarHBondContact O-N 2.84Å
90L43.7Very low43.6Very low162 Ų162141.1 Ų141.185%0.84873%0.733SS**  trans-55.798170.1-66.3169.5000106.7D88 L92D88-L90 PolarHBondContact O-N 2.96Å; L90-L92 PolarHBondContact O-N 3.1Å
91M38.3Very low43.7Very low164 Ų164139.7 Ų139.781%0.80873%0.729SS**  trans-63.593.1162.4-77.6-147.960.100105.5R89 A93R89-M91 VanDerWaalsContact C-N 3.28Å; R89-M91 PolarHBondContact O-N 2.84Å; M91-A93 PolarHBondContact O-N 2.88Å
92L47Very low43.8Very low148 Ų148143.1 Ų143.178%0.77573%0.734SS**  trans-55.7110.6164.3-72.9170.7000104.9L90 D94L90-L92 PolarHBondContact O-N 3.1Å; L92-D94 PolarHBondContact O-N 3.16Å
93A45.6Very low44.1Very low60 Ų60140.6 Ų140.650%0.49674%0.736SS.*  trans-53.3114.8179.600000107.9M91 S95M91-A93 PolarHBondContact O-N 2.88Å; A93-S95 PolarHBondContact O-N 3.11Å
94D39.1Very low44.8Very low123 Ų123134.5 Ų134.566%0.65873%0.731SS**G310 helixtrans-62.17.6175.2-72.6-44.5000112.9L92 F96 L97L92-D94 PolarHBondContact O-N 3.16Å; D94-F96 PolarHBondContact O-N 2.88Å; D94-L97 PolarHBondContact O-N 3.13Å
95S46.7Very low45.5Very low103 Ų103133.5 Ų133.572%0.7273%0.734SS**G310 helixtrans-63.1-8.4178.5-56.70000114.6A93A93-S95 PolarHBondContact O-N 3.11Å
96F49.3Very low46.2Very low172 Ų172133.2 Ų133.275%0.75474%0.737SS**G310 helixtrans-90.7-4.5177.5-62.7-73.1000114.2D94 S98D94-F96 PolarHBondContact O-N 2.88Å; F96-S98 VanDerWaalsContact C-N 3.34Å; F96-S98 PolarHBondContact O-N 3.27Å
97L44.4Very low47.2Very low138 Ų138135.7 Ų135.772%0.72374%0.74SS**  trans-97.555.6175.3-58.7178.1000110.5D94 P99D94-L97 PolarHBondContact O-N 3.13Å; L97-P99 WeakPolarHBondContact O-CD 3.34Å
98S44.1Very low48.8Very low71 Ų71137.1 Ų137.150%0.49774%0.743SS.*  trans-68.6119.6158-173.50000106.8F96 D100 A101F96-S98 VanDerWaalsContact C-N 3.34Å; F96-S98 PolarHBondContact O-N 3.27Å; S98-D100 PolarHBondContact O-N 2.79Å; S98-A101 VanDerWaalsContact O-CB 3.29Å; S98-A101 WeakPolarHBondContact O-CB 3.41Å; S98-A101 PolarHBondContact O-N 2.98Å
99P52.1Low50Low128 Ų128138.2 Ų138.283%0.83175%0.748SS**THydrogen-bonded Turntrans-61.5-17.6-176.622.1-31.3000113.2L97L97-P99 WeakPolarHBondContact O-CD 3.34Å
100D51.2Low51.5Low137 Ų137138.8 Ų138.873%0.73375%0.75SS**THydrogen-bonded Turntrans-92.83.6176-69.1-29.8000113.8S98 H102S98-D100 PolarHBondContact O-N 2.79Å; D100-H102 VanDerWaalsContact C-N 3.27Å; D100-H102 PolarHBondContact O-N 2.84Å
101A47.6Very low52.6Low64 Ų64134 Ų13453%0.52974%0.74SS.*  trans-69.590.6171.300000108.5S98S98-A101 VanDerWaalsContact O-CB 3.29Å; S98-A101 WeakPolarHBondContact O-CB 3.41Å; S98-A101 PolarHBondContact O-N 2.98Å
102H43.1Very low54Low168 Ų168137.1 Ų137.178%0.77874%0.743SS**  trans-40.8131.7171-69.9-62.8000109.2D100 A104D100-H102 VanDerWaalsContact C-N 3.27Å; D100-H102 PolarHBondContact O-N 2.84Å; H102-A104 PolarHBondContact O-N 3.05Å
103P48.2Very low54.9Low124 Ų124140.6 Ų140.681%0.80575%0.746SS**  trans-56.3103.6-177.721.6-31.7000107.9A105P103-A105 PolarHBondContact O-N 2.99Å
104A54Low55.9Low86 Ų86148.8 Ų148.871%0.71176%0.764SS**  trans-56.3110.7179.400000105.6H102 V106H102-A104 PolarHBondContact O-N 3.05Å; A104-V106 VanDerWaalsContact O-CG2 3.31Å; A104-V106 WeakPolarHBondContact O-CG2 3.46Å; A104-V106 PolarHBondContact O-N 3.08Å
105A55.5Low57.2Low87 Ų87154.7 Ų154.772%0.71978%0.777SS**  trans-55.7103.7-171.300000108.5P103 R107P103-A105 PolarHBondContact O-N 2.99Å; A105-R107 PolarHBondContact O-N 2.91Å
106V55.9Low57.8Low137 Ų137151.9 Ų151.983%0.8376%0.764SS**  trans-72.387.5-177.3-171.90000106.9A104 K108A104-V106 VanDerWaalsContact O-CG2 3.31Å; A104-V106 WeakPolarHBondContact O-CG2 3.46Å; A104-V106 PolarHBondContact O-N 3.08Å; V106-K108 PolarHBondContact O-N 2.97Å; V106-K108 VanDerWaalsContact O-N 3.08Å
107R64.8Low58.2Low227 Ų227153.8 Ų153.886%0.85777%0.772SS**  trans-68.4108.5174.5-71.9-171.4-64.2-128.8-0.7107.9A105 L109A105-R107 PolarHBondContact O-N 2.91Å; R107-L109 PolarHBondContact O-N 3.08Å
108K73.8Confident58.8Low202 Ų202154.1 Ų154.188%0.87877%0.77SS**  trans-61.9109.6169.8-71.3-177.9-179.9177.80108.5V106 R110V106-K108 PolarHBondContact O-N 2.97Å; V106-K108 VanDerWaalsContact O-N 3.08Å; K108-R110 PolarHBondContact O-N 3.09Å; K108-R110 VanDerWaalsContact O-N 3.08Å
109L67.1Low59.2Low169 Ų169158 Ų15889%0.88579%0.786SS**  trans-63.3111.2168.3-71.5170.3000107.9R107 G111R107-L109 PolarHBondContact O-N 3.08Å; L109-G111 VanDerWaalsContact C-N 3.31Å; L109-G111 PolarHBondContact O-N 3.29Å
110R69.5Low59.3Low245 Ų245157 Ų15793%0.92577%0.773SS**  trans-67.295.5169.9-177.8-179.1174.3-158.50.9107.7K108 R112K108-R110 PolarHBondContact O-N 3.09Å; K108-R110 VanDerWaalsContact O-N 3.08Å; R110-R112 PolarHBondContact O-N 2.87Å; R110-R112 VanDerWaalsContact O-N 3.13Å
111G66.3Low59.4Low62 Ų62155.4 Ų155.464%0.63977%0.772SS**  trans-55.5118.4172.600000110L109 R113L109-G111 VanDerWaalsContact C-N 3.31Å; L109-G111 PolarHBondContact O-N 3.29Å; G111-R113 PolarHBondContact O-N 2.89Å
112R69Low59.7Low228 Ų228158.9 Ų158.986%0.8678%0.781SS**  trans-65.299.7170.1179.3176.9176.3-120.52.7107.5R110 R114R110-R112 PolarHBondContact O-N 2.87Å; R110-R112 VanDerWaalsContact O-N 3.13Å; R112-R114 PolarHBondContact O-N 3.3Å
113R66Low60.1Low222 Ų222154 Ų15484%0.83877%0.766SS**  trans-54114170.4-77.4178.872.3-179.72.6107.6G111 R115G111-R113 PolarHBondContact O-N 2.89Å; R113-R115 PolarHBondContact O-N 2.95Å; R113-R115 VanDerWaalsContact O-N 3.08Å
114R67Low60.4Low232 Ų232152.6 Ų152.688%0.87576%0.759SS**  trans-57.1118.4163.9-73.6-176.6161.8179.8-4105.5R112 G116R112-R114 PolarHBondContact O-N 3.3Å; R114-G116 PolarHBondContact O-N 3.04Å
115R65.8Low60.3Low247 Ų247153.3 Ų153.393%0.93276%0.758SS**  trans-69.368.1163.2-68.4-176.2-178.5-177.7-0106.7R113 K117R113-R115 PolarHBondContact O-N 2.95Å; R113-R115 VanDerWaalsContact O-N 3.08Å; R115-K117 PolarHBondContact O-N 3.21Å
116G58Low60.5Low44 Ų44156 Ų15645%0.45476%0.759SS.*  trans-61.9120.2159.500000105.1R114 Q118R114-G116 PolarHBondContact O-N 3.04Å; G116-Q118 PolarHBondContact O-N 3.39Å
117K59Low60.7Low211 Ų211153.4 Ų153.492%0.91775%0.747SS**  trans-64.573.2158.3-77.8176.1171.3179.30106.2R115R115-K117 PolarHBondContact O-N 3.21Å
118Q57Low60.7Low145 Ų145147.5 Ų147.568%0.67874%0.738SS**  trans-94.1117.3172.3-52.3-163.9-38.500103.5G116 L120G116-Q118 PolarHBondContact O-N 3.39Å; Q118-L120 HydrophobicContact CB-CD2 4.22Å; Q118-L120 HydrophobicContact CB-CG 4.42Å; Q118-L120 PolarHBondContact O-N 2.77Å
119N52Low60.3Low154 Ų154144.2 Ų144.282%0.82473%0.73SS**  trans-65.885.6175.2-62-40.8000106.8S121N119-S121 PolarHBondContact O-N 2.79Å
120L54.9Low60.6Low107 Ų107144.7 Ų144.756%0.5672%0.72SS**  trans-78.334.1179.6-60.9171.6000110.9Q118 N122 C123Q118-L120 HydrophobicContact CB-CD2 4.22Å; Q118-L120 HydrophobicContact CB-CG 4.42Å; Q118-L120 PolarHBondContact O-N 2.77Å; L120-N122 PolarHBondContact O-N 3.04Å; L120-N122 VanDerWaalsContact O-N 3.1Å; L120-C123 WeakPolarHBondContact CD2-SG 3.37Å
121S52.9Low60.6Low102 Ų102138 Ų13871%0.71370%0.702SS**THydrogen-bonded Turntrans-65.5-12.1179.854.90000112.7N119N119-S121 PolarHBondContact O-N 2.79Å
122N54.7Low60.9Low137 Ų137137.9 Ų137.973%0.73369%0.687SS**THydrogen-bonded Turntrans-128.626.5-174.2-64.250.1000112.9L120 S124L120-N122 PolarHBondContact O-N 3.04Å; L120-N122 VanDerWaalsContact O-N 3.1Å; N122-S124 PolarHBondContact O-N 3.12Å
123C50.5Low61.3Low67 Ų67137.1 Ų137.145%0.45369%0.693SS.*  trans-80.277.8170.7-71.70000109.9L120 S125 I126L120-C123 WeakPolarHBondContact CD2-SG 3.37Å; C123-S125 PolarHBondContact O-N 3.27Å; C123-I126 HydrophobicContact CB-CG1 4.45Å
124S54.5Low61.8Low94 Ų94130.5 Ų130.566%0.65768%0.68SS**  trans-47.3122.7155-58.40000107.6N122 I126N122-S124 PolarHBondContact O-N 3.12Å; S124-I126 PolarHBondContact O-N 2.88Å
125S52.6Low61.8Low100 Ų100121.6 Ų121.670%0.69966%0.661SS**  trans5.7104.2177.957.60000115.1C123 S127C123-S125 PolarHBondContact O-N 3.27Å; S125-S127 VanDerWaalsContact C-N 3.26Å; S125-S127 PolarHBondContact O-N 2.63Å
126I59.5Low62.2Low144 Ų144115.3 Ų115.374%0.73865%0.645SS**  trans-63.692171.4-56.8166.5000107.2C123 S124C123-I126 HydrophobicContact CB-CG1 4.45Å; S124-I126 PolarHBondContact O-N 2.88Å
127S59.7Low62.6Low82 Ų82118.1 Ų118.157%0.57365%0.649SS**  trans-62.1138.8169.5-56.90000107.7S125 L129S125-S127 VanDerWaalsContact C-N 3.26Å; S125-S127 PolarHBondContact O-N 2.63Å; S127-L129 PolarHBondContact O-N 3.06Å; S127-L129 VanDerWaalsContact O-N 3.09Å
128P64.2Low62.9Low104 Ų104113.2 Ų113.268%0.67563%0.629SS**  trans-51.5124.9172.7-22.231.2000108.5R130P128-R130 PolarHBondContact O-N 2.94Å
129L65.2Low63.1Low132 Ų132112.1 Ų112.169%0.69163%0.633SS**  trans-58110.6174.3-74.6163.1000107.5S127 L137S127-L129 PolarHBondContact O-N 3.06Å; S127-L129 VanDerWaalsContact O-N 3.09Å; L129-L137 HydrophobicContact CB-CD2 3.91Å; L129-L137 HydrophobicContact CD1-CD2 4.29Å; L129-L137 HydrophobicContact CD2-CD2 4.42Å; L129-L137 HydrophobicContact CG-CD2 4.44Å
130R73.1Confident63.2Low179 Ų179108.4 Ų108.468%0.67562%0.619SS**  trans-84135.3175.2-64.8-77.6-173.5142.81.7107.2P128 Q138P128-R130 PolarHBondContact O-N 2.94Å; R130-Q138 WeakPolarHBondContact O-CB 3.31Å; R130-Q138 PolarHBondContact O-N 2.83Å
131L70.6Confident63Low106 Ų106108.1 Ų108.156%0.55563%0.626SS**BIsolated β-bridgetrans-82.5141.2164.9-61.6175.7000107.8L136 L137L131-L136 CarbonylContact C-O 3.59Å; L131-L136 WeakPolarHBondContact CA-O 3.18Å; L131-L137 HydrophobicContact CD2-CD2 3.71Å; L131-L137 HydrophobicContact CD2-CG 4.12Å
132D72.4Confident62.7Low59 Ų59111.6 Ų111.632%0.31663%0.628SS.*  trans-74.5177.9165.469.212.6000110.6S134 G135 L136 Q138D132-S134 VanDerWaalsContact CG-OG 3.22Å; D132-S134 PolarHBondContact O-N 2.87Å; D132-S134 VanDerWaalsContact O-N 3.16Å; D132-S134 WeakPolarHBondContact OD1-CA 3.35Å; D132-S134 WeakPolarHBondContact OD1-CB 3.36Å; D132-S134 PolarHBondContact OD1-N 2.88Å; D132-S134 PolarHBondContact OD1-OG 3.18Å; D132-S134 PolarHBondContact OD2-OG 2.98Å; D132-G135 PolarHBondContact O-N 2.73Å; D132-G135 PolarHBondContact OD1-N 3.08Å; D132-G135 VanDerWaalsContact OD1-N 3.11Å; D132-L136 PolarHBondContact N-O 2.74Å; D132-L136 PolarHBondContact OD1-N 3.28Å; D132-Q138 HydrophobicContact CB-CG 3.86Å
133Q78.2Confident62Low212 Ų212112.8 Ų112.899%0.99163%0.63SS**THydrogen-bonded Turntrans-63.5-18.9179.6-65.1-179.59.500113G135Q133-G135 VanDerWaalsContact C-N 3.27Å
134S76.6Confident61.5Low82 Ų82114 Ų11457%0.57364%0.639SS**THydrogen-bonded Turntrans-83.4-5.3175.378.90000112.9D132 L136D132-S134 VanDerWaalsContact CG-OG 3.22Å; D132-S134 PolarHBondContact O-N 2.87Å; D132-S134 VanDerWaalsContact O-N 3.16Å; D132-S134 WeakPolarHBondContact OD1-CA 3.35Å; D132-S134 WeakPolarHBondContact OD1-CB 3.36Å; D132-S134 PolarHBondContact OD1-N 2.88Å; D132-S134 PolarHBondContact OD1-OG 3.18Å; D132-S134 PolarHBondContact OD2-OG 2.98Å; S134-L136 VanDerWaalsContact C-N 3.28Å; S134-L136 WeakPolarHBondContact OG-CG 3.46Å
135G67.2Low60.7Low45 Ų45117.1 Ų117.146%0.46465%0.649SS.*SBendtrans78.912.6-175.600000113.2D132 Q133D132-G135 PolarHBondContact O-N 2.73Å; D132-G135 PolarHBondContact OD1-N 3.08Å; D132-G135 VanDerWaalsContact OD1-N 3.11Å; Q133-G135 VanDerWaalsContact C-N 3.27Å
136L73Confident59.9Low116 Ų116122 Ų12261%0.60766%0.658SS**  trans-92.6147.2175.6-63.5178.7000110L131 D132 S134 Q138L131-L136 CarbonylContact C-O 3.59Å; L131-L136 WeakPolarHBondContact CA-O 3.18Å; D132-L136 PolarHBondContact N-O 2.74Å; D132-L136 PolarHBondContact OD1-N 3.28Å; S134-L136 VanDerWaalsContact C-N 3.28Å; S134-L136 WeakPolarHBondContact OG-CG 3.46Å; L136-Q138 PolarHBondContact O-N 2.81Å
137L67.2Low58.5Low103 Ų103122.6 Ų122.654%0.53966%0.661SS.*BIsolated β-bridgetrans-63.8123.9179.3-70.6166.9000109.5L129 L131 T139L129-L137 HydrophobicContact CB-CD2 3.91Å; L129-L137 HydrophobicContact CD1-CD2 4.29Å; L129-L137 HydrophobicContact CD2-CD2 4.42Å; L129-L137 HydrophobicContact CG-CD2 4.44Å; L131-L137 HydrophobicContact CD2-CD2 3.71Å; L131-L137 HydrophobicContact CD2-CG 4.12Å; L137-T139 VanDerWaalsContact C-N 3.33Å; L137-T139 PolarHBondContact O-N 3.35Å
138Q64.4Low57.1Low107 Ų107124.3 Ų124.350%0.567%0.672SS.*  trans-67.897.8166.5-69.3-172.8-32.600108R130 D132 L136 S140R130-Q138 WeakPolarHBondContact O-CB 3.31Å; R130-Q138 PolarHBondContact O-N 2.83Å; D132-Q138 HydrophobicContact CB-CG 3.86Å; L136-Q138 PolarHBondContact O-N 2.81Å; Q138-S140 PolarHBondContact O-N 2.82Å; Q138-S140 VanDerWaalsContact O-N 3.1Å
139T61.5Low55.8Low122 Ų122125.6 Ų125.675%0.74868%0.683SS**  trans-72.599.3162.656.80000106.2L137 S141L137-T139 VanDerWaalsContact C-N 3.33Å; L137-T139 PolarHBondContact O-N 3.35Å; T139-S141 VanDerWaalsContact C-N 3.34Å; T139-S141 PolarHBondContact O-N 3.14Å
140S55Low54.5Low76 Ų76128.8 Ų128.853%0.53172%0.717SS.*  trans-56.1109.1158.754.90000105.7Q138 F142Q138-S140 PolarHBondContact O-N 2.82Å; Q138-S140 VanDerWaalsContact O-N 3.1Å; S140-F142 VanDerWaalsContact C-N 3.33Å; S140-F142 VanDerWaalsContact O-CD2 3.31Å; S140-F142 WeakPolarHBondContact O-CD2 3.33Å; S140-F142 PolarHBondContact O-N 2.98Å; S140-F142 WeakPolarHBondContact OG-CE2 3.29Å
141S48.9Very low53.6Low102 Ų102126.3 Ų126.371%0.71372%0.719SS**  trans-53.9103.116938.60000106.6T139 E143T139-S141 VanDerWaalsContact C-N 3.34Å; T139-S141 PolarHBondContact O-N 3.14Å; S141-E143 PolarHBondContact O-N 2.72Å
142F46.9Very low52.7Low174 Ų174127.3 Ų127.376%0.76373%0.727SS**  trans-70.386.3161.5-69.6-85.3000104.9S140 S144S140-F142 VanDerWaalsContact C-N 3.33Å; S140-F142 VanDerWaalsContact O-CD2 3.31Å; S140-F142 WeakPolarHBondContact O-CD2 3.33Å; S140-F142 PolarHBondContact O-N 2.98Å; S140-F142 WeakPolarHBondContact OG-CE2 3.29Å; F142-S144 PolarHBondContact O-N 2.7Å
143E41.5Very low51.6Low162 Ų162131.1 Ų131.176%0.75775%0.75SS**  trans-55.1129.1173-143173.6173.400107.7S141 N145S141-E143 PolarHBondContact O-N 2.72Å; E143-N145 PolarHBondContact O-N 2.97Å
144S39.4Very low50Low94 Ų94126.4 Ų126.466%0.65774%0.736SS**  trans-60.891.2-175.747.90000111.8F142 F146F142-S144 PolarHBondContact O-N 2.7Å; S144-F146 PolarHBondContact O-N 2.86Å
145N38.1Very low48.3Very low159 Ų159129.1 Ų129.185%0.8575%0.746SS**  trans-78.542.9166.9-74.1-14000112E143E143-N145 PolarHBondContact O-N 2.97Å
146F34.5Very low47.1Very low203 Ų203134.7 Ų134.789%0.8977%0.765SS**  trans-126.447.5-179-111.1-79.3000111.6S144S144-F146 PolarHBondContact O-N 2.86Å
147L31.3Very low45.2Very low155 Ų155136.1 Ų136.181%0.81278%0.776SS**  trans-141.6133.1167.2-89.2155.7000109
148C30.6Very low43.5Very low119 Ų119138.6 Ų138.680%0.80479%0.794SS**  trans88.883.1172.8-57.90000117.8
149S36.3Very low41.8Very low130 Ų130141.3 Ų141.391%0.90982%0.819SS**  -157.898.6123.1-66.50000107.5
150S37.3Very low40Very low199 Ų199143 Ų143100%1.39283%0.825SS**  trans-90.30161.6-61.20000108.8

Retrieved 150 of 150 residues in 118.6 ms (Link to these results)