A0A096N466_PAPAN Loading...

Family with sequence similarity 53 member C

AlphaFold DB (A0A2K5TUZ9), UniProt , Accession A0A096N466, Species PAPAN (Papio anubis, Olive baboon), Gene FAM53C, Length 392 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
1M61.9Low72.1Confident179 Ų179120.3 Ų120.388%0.88261%0.607SS**  0-55.30-161.1177.5-69.200111T3 L4 I5M1-T3 VanDerWaalsContact C-N 3.32Å; M1-T3 PolarHBondContact O-N 2.76Å; M1-L4 PolarHBondContact O-N 3.29Å; M1-I5 HydrophobicContact CG-CD1 4.44Å; M1-I5 WeakPolarHBondContact O-CG1 3.26Å; M1-I5 PolarHBondContact O-N 3.31Å
2I70.4Confident71.5Confident139 Ų139122.8 Ų122.871%0.71362%0.615SS**Hα-helixtrans-59.8-39.3178.6-61.5167.1000112.5L4 I5 T6I2-L4 PolarHBondContact O-N 3.25Å; I2-I5 PolarHBondContact O-N 3.32Å; I2-T6 PolarHBondContact O-N 3.39Å; I2-T6 VanDerWaalsContact O-N 3.16Å; I2-T6 PolarHBondContact O-OG1 2.85Å
3T75.3Confident70.8Confident105 Ų105120.6 Ų120.664%0.64461%0.612SS**Hα-helixtrans-66.8-31.2178.250.70000114.2M1 T6 E7M1-T3 VanDerWaalsContact C-N 3.32Å; M1-T3 PolarHBondContact O-N 2.76Å; T3-T6 PolarHBondContact O-OG1 3.39Å; T3-E7 WeakPolarHBondContact O-CB 3.23Å; T3-E7 PolarHBondContact O-N 2.97Å
4L78.1Confident69.9Low110 Ų110123.9 Ų123.958%0.57663%0.63SS**Hα-helixtrans-73.8-33.3177.2-65.2171000111.1M1 I2 Q8M1-L4 PolarHBondContact O-N 3.29Å; I2-L4 PolarHBondContact O-N 3.25Å; L4-Q8 WeakPolarHBondContact O-CB 3.49Å; L4-Q8 WeakPolarHBondContact O-CG 3.32Å; L4-Q8 PolarHBondContact O-N 2.99Å
5I76.5Confident69.3Low95 Ų95126.3 Ų126.349%0.48765%0.646SS.*Hα-helixtrans-70.9-41.8178.5-62.6165.4000110M1 I2 Q8 L9M1-I5 HydrophobicContact CG-CD1 4.44Å; M1-I5 WeakPolarHBondContact O-CG1 3.26Å; M1-I5 PolarHBondContact O-N 3.31Å; I2-I5 PolarHBondContact O-N 3.32Å; I5-Q8 PolarHBondContact O-N 3.18Å; I5-L9 HydrophobicContact CG2-CD1 4.01Å; I5-L9 VanDerWaalsContact O-CG 3.32Å; I5-L9 WeakPolarHBondContact O-CG 3.41Å; I5-L9 PolarHBondContact O-N 3.17Å
6T78.1Confident68.6Low79 Ų79128.6 Ų128.649%0.48565%0.653SS.*Hα-helixtrans-68.1-37.4177.952.70000112.2I2 T3 L9 Q10I2-T6 PolarHBondContact O-N 3.39Å; I2-T6 VanDerWaalsContact O-N 3.16Å; I2-T6 PolarHBondContact O-OG1 2.85Å; T3-T6 PolarHBondContact O-OG1 3.39Å; T6-L9 PolarHBondContact O-N 3.4Å; T6-Q10 WeakPolarHBondContact O-CB 3.18Å; T6-Q10 PolarHBondContact O-N 3.35Å; T6-Q10 VanDerWaalsContact O-N 3.09Å
7E73.2Confident68.1Low92 Ų92131.1 Ų131.143%0.4367%0.667SS.*Hα-helixtrans-68.2-38.2176.4-157.5-149.2160.900111.9T3 K11T3-E7 WeakPolarHBondContact O-CB 3.23Å; T3-E7 PolarHBondContact O-N 2.97Å; E7-K11 WeakPolarHBondContact O-CG 3.43Å; E7-K11 PolarHBondContact O-N 2.95Å; E7-K11 WeakPolarHBondContact OE1-CE 3.34Å; E7-K11 IonicContact OE1-NZ 2.65Å; E7-K11 PolarHBondContact OE1-NZ 3.21Å
8Q73.6Confident67.4Low125 Ų125134.6 Ų134.658%0.58468%0.677SS**Hα-helixtrans-65.5-42.6175.3-78.3-82.5-900112.2L4 I5 Q10 K11L4-Q8 WeakPolarHBondContact O-CB 3.49Å; L4-Q8 WeakPolarHBondContact O-CG 3.32Å; L4-Q8 PolarHBondContact O-N 2.99Å; I5-Q8 PolarHBondContact O-N 3.18Å; Q8-Q10 PolarHBondContact O-N 3.02Å; Q8-K11 PolarHBondContact O-N 2.95Å
9L69.6Low66.4Low100 Ų100133.9 Ų133.952%0.52469%0.685SS.*Hα-helixtrans-67.3-35.7178.6-73.2169.9000112.4I5 T6 K11 Q12I5-L9 HydrophobicContact CG2-CD1 4.01Å; I5-L9 VanDerWaalsContact O-CG 3.32Å; I5-L9 WeakPolarHBondContact O-CG 3.41Å; I5-L9 PolarHBondContact O-N 3.17Å; T6-L9 PolarHBondContact O-N 3.4Å; L9-K11 VanDerWaalsContact C-N 3.28Å; L9-K11 PolarHBondContact O-N 3.35Å; L9-Q12 PolarHBondContact O-N 2.8Å; L9-Q12 VanDerWaalsContact O-N 3.16Å
10Q68.3Low65.8Low152 Ų152132.5 Ų132.571%0.7168%0.683SS**Hα-helixtrans-70.6-25.1179.4-158.71724.400112.7T6 Q8 Q12 T13T6-Q10 WeakPolarHBondContact O-CB 3.18Å; T6-Q10 PolarHBondContact O-N 3.35Å; T6-Q10 VanDerWaalsContact O-N 3.09Å; Q8-Q10 PolarHBondContact O-N 3.02Å; Q10-Q12 VanDerWaalsContact C-N 3.31Å; Q10-T13 PolarHBondContact O-OG1 3Å
11K67.9Low64.7Low147 Ų147137.8 Ų137.864%0.63969%0.694SS**THydrogen-bonded Turntrans-79.7-10173-68.8176.8-173.5176.40113.6E7 Q8 L9E7-K11 WeakPolarHBondContact O-CG 3.43Å; E7-K11 PolarHBondContact O-N 2.95Å; E7-K11 WeakPolarHBondContact OE1-CE 3.34Å; E7-K11 IonicContact OE1-NZ 2.65Å; E7-K11 PolarHBondContact OE1-NZ 3.21Å; Q8-K11 PolarHBondContact O-N 2.95Å; L9-K11 VanDerWaalsContact C-N 3.28Å; L9-K11 PolarHBondContact O-N 3.35Å
12Q64.7Low64Low150 Ų150137.8 Ų137.870%0.70169%0.69SS**SBendtrans-99-6179.1-72.5-169-25.200114L9 Q10 L14L9-Q12 PolarHBondContact O-N 2.8Å; L9-Q12 VanDerWaalsContact O-N 3.16Å; Q10-Q12 VanDerWaalsContact C-N 3.31Å; Q12-L14 PolarHBondContact O-N 3.2Å
13T62.3Low63Low95 Ų95136.1 Ų136.158%0.58369%0.69SS**SBendtrans-91.2111.6-177.144.70000112.4Q10Q10-T13 PolarHBondContact O-OG1 3Å
14L59.2Low61.6Low166 Ų166138 Ų13887%0.86970%0.695SS**SBendtrans74.961.2146-72.2157.8000117.4Q12Q12-L14 PolarHBondContact O-N 3.2Å
15D60.4Low60.2Low161 Ų161138 Ų13886%0.86170%0.704SS**SBendtrans-129.1139.4138.7-108.4-26.4000108.7
16E57.7Low58.9Low163 Ų163140.5 Ų140.576%0.76272%0.717SS**  trans74.972171.5-54.7-169146.300118.9
17L60.8Low57.4Low170 Ų170142.5 Ų142.589%0.8973%0.732SS**  trans-129.281.4137-71173.2000108.8C19L17-C19 VanDerWaalsContact C-N 3.27Å; L17-C19 PolarHBondContact O-N 2.73Å
18K54.5Low56.3Low194 Ų194145.5 Ų145.584%0.84375%0.75SS**  trans-64.492.5163.4-73.4177.2-179169.50107.4T20K18-T20 PolarHBondContact O-N 2.83Å
19C49.6Very low55Low123 Ų123145.1 Ų145.183%0.83176%0.758SS**  trans-60.2100.8171.9-77.70000109.6L17 R21L17-C19 VanDerWaalsContact C-N 3.27Å; L17-C19 PolarHBondContact O-N 2.73Å; C19-R21 PolarHBondContact O-N 2.87Å
20T54.3Low54.3Low105 Ų105146.9 Ų146.964%0.64477%0.768SS**  trans-67.1116.3165.938.50000108.4K18 F22K18-T20 PolarHBondContact O-N 2.83Å; T20-F22 WeakPolarHBondContact O-CD2 3.15Å; T20-F22 PolarHBondContact O-N 3.28Å
21R42.8Very low53.7Low243 Ų243148 Ų14892%0.91777%0.773SS**  trans-71.7106.5178.8-175.6177.8-172.699.2-0.7108.7C19 S23C19-R21 PolarHBondContact O-N 2.87Å; R21-S23 PolarHBondContact O-N 2.62Å
22F46.2Very low52.4Low180 Ų180145.4 Ų145.479%0.78978%0.779SS**  trans-75114.3169.8-63.2-79.6000109.4T20T20-F22 WeakPolarHBondContact O-CD2 3.15Å; T20-F22 PolarHBondContact O-N 3.28Å
23S49.9Very low51.8Low103 Ų103146 Ų14672%0.7279%0.787SS**  trans-84.5114.2166.358.90000108.6R21R21-S23 PolarHBondContact O-N 2.62Å
24I46.3Very low50.9Low146 Ų146147.3 Ų147.375%0.74979%0.79SS**  trans-90.3108.7174.4-58.2171.3000107.2L26I24-L26 HydrophobicContact CG2-CD2 4.12Å; I24-L26 HydrophobicContact CG2-CG 4.22Å
25S48.7Very low50.7Low108 Ų108145 Ų14576%0.75579%0.787SS**  trans-92.4112.3169-49.50000107.7
26L48Very low50.2Low149 Ų149145.3 Ų145.378%0.7879%0.789SS**PPolyproline II helixtrans-88.8136.8172.1-67173.7000109.3I24 L28I24-L26 HydrophobicContact CG2-CD2 4.12Å; I24-L26 HydrophobicContact CG2-CG 4.22Å; L26-L28 PolarHBondContact O-N 3.15Å
27P48.1Very low49.4Very low121 Ų121141.7 Ų141.779%0.78678%0.78SS**PPolyproline II helixtrans-73.7127.7177.129.7-30.5000109.8
28L50.3Low48.8Very low154 Ų154137.1 Ų137.181%0.80678%0.775SS**PPolyproline II helixtrans-74.6131.3172-168.269.5000108.5L26 D30L26-L28 PolarHBondContact O-N 3.15Å; L28-D30 PolarHBondContact O-N 2.7Å
29P45.8Very low48.3Very low118 Ų118134 Ų13477%0.76677%0.767SS**PPolyproline II helixtrans-70.7118173.4-13.928.6000109.8
30D54Low48.2Very low136 Ų136133 Ų13373%0.72776%0.76SS**PPolyproline II helixtrans-67.3135166.3-94.5-29.5000109.9L28L28-D30 PolarHBondContact O-N 2.7Å
31H55.8Low47.8Very low175 Ų175136.1 Ų136.181%0.8176%0.764SS**  trans72.8102.1166.1-56-68.4000118.9
32A41.2Very low47.8Very low94 Ų94132.6 Ų132.678%0.77776%0.758SS**  trans-152.4117.7132.500000109.7I34A32-I34 PolarHBondContact O-N 3.4Å
33D51.4Low47.9Very low162 Ų162132.1 Ų132.187%0.86676%0.763SS**  trans-58.1116.1171.6-70.4-52.4000111.1
34I44.2Very low47.7Very low123 Ų123131.8 Ų131.863%0.63176%0.756SS**  trans-139.486.1159.7-50.1177.6000108.7A32 N36A32-I34 PolarHBondContact O-N 3.4Å; I34-N36 PolarHBondContact O-N 3.35Å
35S53.9Low47.6Very low117 Ų117129.9 Ų129.982%0.81876%0.756SS**THydrogen-bonded Turntrans-51.4124.3150.9-48.50000107.9
36N50.3Low47.5Very low167 Ų167134.6 Ų134.689%0.89377%0.766SS**THydrogen-bonded Turntrans93.542.2172.8-146.623.5000118I34I34-N36 PolarHBondContact O-N 3.35Å
37C42.3Very low47.6Very low87 Ų87131.3 Ų131.359%0.58877%0.768SS**  trans-121.7116.3150.945.40000109.1N39C37-N39 PolarHBondContact O-N 3.41Å
38G48.1Very low47.5Very low75 Ų75128.7 Ų128.777%0.77376%0.757SS**  trans-52.5124.7169.800000109.5P40G38-P40 WeakPolarHBondContact O-CD 3.48Å
39N44Very low47.5Very low128 Ų128126.1 Ų126.168%0.68475%0.752SS**  trans-53.7118.4-174.1-153.2-19.7000111C37 F41C37-N39 PolarHBondContact O-N 3.41Å; N39-F41 PolarHBondContact O-N 3.16Å
40P46.5Very low47.5Very low103 Ų103130.8 Ų130.867%0.66975%0.754SS**SBendtrans-78.90.2-177.928.7-30.5000113.6G38G38-P40 WeakPolarHBondContact O-CD 3.48Å
41F46.4Very low47.2Very low170 Ų170135.3 Ų135.375%0.74676%0.761SS**  trans-133.566.5178.1-58.4-73.8000111.3N39 L43N39-F41 PolarHBondContact O-N 3.16Å; F41-L43 PolarHBondContact O-N 3.29Å
42Q42.7Very low47.1Very low169 Ų169130.3 Ų130.379%0.7976%0.757SS**  trans-79.1101157.2-153.1166.631.300107.2V44Q42-V44 PolarHBondContact O-N 3.44Å
43L47.4Very low47.2Very low169 Ų169132.5 Ų132.589%0.88576%0.755SS**  trans-61100.3171-131.8110.9000107.2F41 S45F41-L43 PolarHBondContact O-N 3.29Å; L43-S45 PolarHBondContact O-N 3.3Å
44V45.5Very low47Very low96 Ų96129.8 Ų129.858%0.58275%0.747SS**  trans-73.5117173.9-177.60000107Q42 E46 A48Q42-V44 PolarHBondContact O-N 3.44Å; V44-E46 PolarHBondContact O-N 3.2Å; V44-A48 HydrophobicContact CG1-CB 3.94Å
45S45.5Very low47Very low106 Ų106133.3 Ų133.374%0.74176%0.76SS**  trans-54136.7172.4-65.30000110.7L43 G47L43-S45 PolarHBondContact O-N 3.3Å; S45-G47 PolarHBondContact O-N 3.17Å
46E45.8Very low46.2Very low207 Ų207133.8 Ų133.897%0.96776%0.762SS**THydrogen-bonded Turntrans-51.598.1179.9-168.2171.3-173.500110.8V44V44-E46 PolarHBondContact O-N 3.2Å
47G50.6Low45.8Very low80 Ų80131.3 Ų131.383%0.82576%0.757SS**THydrogen-bonded Turntrans158.3-10.8177.200000118S45S45-G47 PolarHBondContact O-N 3.17Å
48A46.2Very low45.4Very low66 Ų66133.2 Ų133.255%0.54577%0.77SS.*  trans-89.9129.5-176.400000113.8V44V44-A48 HydrophobicContact CG1-CB 3.94Å
49S50Low44.9Very low101 Ų101134.2 Ų134.271%0.70677%0.771SS**  trans-70.1129179.7173.60000112.9R51S49-R51 PolarHBondContact O-N 3Å
50W46.2Very low44.3Very low216 Ų216137 Ų13782%0.81878%0.78SS**SBendtrans-73.327.1-177.6-68.398.5000115.9G52 L53W50-G52 PolarHBondContact O-N 3.38Å; W50-L53 HydrophobicContact CE3-CD1 4.09Å; W50-L53 HydrophobicContact CZ3-CD1 3.89Å
51R46.3Very low43.7Very low230 Ų230141.5 Ų141.587%0.86879%0.789SS**  trans-103.371.2-178.8-67.8-115.5-74.3-87.40.3110.3S49S49-R51 PolarHBondContact O-N 3Å
52G53.6Low43.2Very low71 Ų71141.9 Ų141.973%0.73279%0.794SS**  trans166.533.7174.500000118.5W50W50-G52 PolarHBondContact O-N 3.38Å
53L44.4Very low42.7Very low139 Ų139140.9 Ų140.973%0.72879%0.794SS**  trans-101.3133168.9-75.1165.9000110.4W50W50-L53 HydrophobicContact CE3-CD1 4.09Å; W50-L53 HydrophobicContact CZ3-CD1 3.89Å
54P47.6Very low42.5Very low106 Ų106138.2 Ų138.269%0.68879%0.789SS**  trans-70.5145.7177.530-32000110.1C56P54-C56 PolarHBondContact O-N 3.29Å
55H43Very low42.4Very low197 Ų197141 Ų14191%0.91280%0.8SS**  trans-57.5110.8173.5-86.3-78.8000110.3S57H55-S57 PolarHBondContact O-N 3.46Å
56C38.7Very low42.2Very low126 Ų126143.9 Ų143.985%0.85181%0.807SS**PPolyproline II helixtrans-72.8116.8169.5-79.50000110P54P54-C56 PolarHBondContact O-N 3.29Å
57S40.3Very low41.8Very low115 Ų115142 Ų14280%0.80480%0.796SS**PPolyproline II helixtrans-65.5128.5163.839.30000109.9H55 A59H55-S57 PolarHBondContact O-N 3.46Å; S57-A59 PolarHBondContact O-N 3.5Å
58C34.4Very low41.2Very low128 Ų128143.2 Ų143.287%0.86579%0.792SS**PPolyproline II helixtrans-56.4128.5173.4-810000110.3E60C58-E60 PolarHBondContact O-N 3.44Å
59A37.8Very low40.7Very low95 Ų95149.7 Ų149.779%0.78580%0.804SS**PPolyproline II helixtrans-72.2120.1166.500000108.9S57 F61S57-A59 PolarHBondContact O-N 3.5Å; A59-F61 PolarHBondContact O-N 3.3Å
60E32.3Very low40.1Very low187 Ų187153.2 Ų153.287%0.87481%0.809SS**PPolyproline II helixtrans-64.2121.2170-74.2170133.100109.6C58 Q62C58-E60 PolarHBondContact O-N 3.44Å; E60-Q62 PolarHBondContact O-N 3.11Å
61F31.9Very low39.8Very low197 Ų197148.9 Ų148.986%0.86481%0.808SS**PPolyproline II helixtrans-73.9118.6164.6-110.9-100.4000108A59 D63A59-F61 PolarHBondContact O-N 3.3Å; F61-D63 PolarHBondContact O-N 3.02Å
62Q37Very low39.4Very low179 Ų179143.3 Ų143.384%0.83681%0.805SS**  trans-77.4101.9171-72.6-162.842.700109.6E60E60-Q62 PolarHBondContact O-N 3.11Å
63D32.3Very low38.4Very low147 Ų147143.2 Ų143.279%0.78680%0.804SS**  trans-89.8118.1159.1-82.7-25.6000109.2F61 L65F61-D63 PolarHBondContact O-N 3.02Å; D63-L65 PolarHBondContact O-N 3.01Å
64S43.6Very low38Very low114 Ų114144.5 Ų144.580%0.79781%0.811SS**  trans-71.788.5-179.5-61.60000110.6
65L41.9Very low37.3Very low153 Ų153144.3 Ų144.380%0.80181%0.812SS**  trans-135.2108.1157.9-72.3176.6000109.6D63 F67D63-L65 PolarHBondContact O-N 3.01Å; L65-F67 PolarHBondContact O-N 3.42Å
66N43.3Very low37Very low167 Ų167142.8 Ų142.889%0.89381%0.809SS**  trans-54.2102.8167.4-99.3-42.8000110.2
67F36.2Very low36.9Very low167 Ų167144.7 Ų144.773%0.73281%0.806SS**  trans-140.5104.9151-80.4-73.7000108.2L65 Y69L65-F67 PolarHBondContact O-N 3.42Å; F67-Y69 HydrophobicContact CB-CD2 4.18Å; F67-Y69 HydrophobicContact CB-CE2 4.2Å; F67-Y69 PolarHBondContact O-N 3.05Å
68S39.1Very low36.6Very low107 Ų107147.3 Ų147.375%0.74881%0.81SS**  trans-62.7101.6172.154.60000109.8
69Y35.1Very low36.5Very low201 Ų201152 Ų15279%0.78881%0.809SS**  trans-125.2112.3160.3-76-81000108.2F67 P71F67-Y69 HydrophobicContact CB-CD2 4.18Å; F67-Y69 HydrophobicContact CB-CE2 4.2Å; F67-Y69 PolarHBondContact O-N 3.05Å; Y69-P71 WeakPolarHBondContact O-CD 3.28Å
70H37.6Very low36.8Very low175 Ų175152.9 Ų152.981%0.8181%0.807SS**  trans-61.8126.2170.8-67.6-84.6000109.9S72H70-S72 PolarHBondContact O-N 3.08Å
71P39Very low37.3Very low125 Ų125149.4 Ų149.481%0.81280%0.8SS**  trans-84.8103157.930.9-26.5000108.1Y69 G73Y69-P71 WeakPolarHBondContact O-CD 3.28Å; P71-G73 PolarHBondContact O-N 2.65Å
72S37.4Very low37.3Very low113 Ų113145 Ų14579%0.7980%0.795SS**  trans-62.1106163.5-66.30000108.7H70 L74H70-S72 PolarHBondContact O-N 3.08Å; S72-L74 PolarHBondContact O-N 3.22Å
73G33.2Very low37.2Very low70 Ų70148.8 Ų148.872%0.72280%0.801SS**  trans-66.2125.5173.100000111.2P71P71-G73 PolarHBondContact O-N 2.65Å
74L36.1Very low37.1Very low166 Ų166145.6 Ų145.687%0.86980%0.802SS**  trans-104.682.6161.7-66178.6000108.1S72 L76S72-L74 PolarHBondContact O-N 3.22Å; L74-L76 PolarHBondContact O-N 3.09Å
75S33.2Very low36.6Very low101 Ų101145.8 Ų145.871%0.70680%0.804SS**  trans-70.3104.2162.6-85.10000109H77S75-H77 PolarHBondContact O-N 3.31Å
76L35.7Very low36.2Very low165 Ų165143.9 Ų143.986%0.86480%0.803SS**  trans-73.582.1162.5-71.4170.7000108.9L74 L78L74-L76 PolarHBondContact O-N 3.09Å; L76-L78 PolarHBondContact O-N 3.14Å
77H38.4Very low36.4Very low166 Ų166141.1 Ų141.177%0.76980%0.795SS**  trans-77.796.8163.5-90-76.8000109.2S75S75-H77 PolarHBondContact O-N 3.31Å
78L32.4Very low36.2Very low171 Ų171141.7 Ų141.790%0.89580%0.797SS**  trans-87109.2158.3-72.3169000108.1L76L76-L78 PolarHBondContact O-N 3.14Å
79R32.3Very low36Very low227 Ų227144.5 Ų144.586%0.85780%0.798SS**  trans-120.9123.8165.8-171.3179.6-166.3150.54108
80P45.5Very low36Very low113 Ų113143.8 Ų143.873%0.73480%0.802SS**  trans-84.5153.2166.134.9-29.4000109.3
81P42.7Very low36.3Very low113 Ų113140.4 Ų140.473%0.73480%0.795SS**  -150.3149.998.436.3-17.1000117.2
82S31.3Very low35.9Very low106 Ų106140.9 Ų140.974%0.74179%0.791SS**  trans31.1118.9141.667.10000123.7
83R34.6Very low35.9Very low258 Ų258140.6 Ų140.697%0.97479%0.789SS**  46.9112.8112.4-145.7179.4-171.5-157.81.8119.3
84G30.8Very low36Very low79 Ų79145.7 Ų145.781%0.81479%0.793SS**  trans176.5134.3160.900000112.6
85S33.5Very low36.2Very low119 Ų119144.7 Ų144.783%0.83279%0.794SS**  trans-82.4141.6-165.246.90000116.9
86S32.3Very low36.4Very low112 Ų112147.7 Ų147.778%0.78380%0.801SS**  trans16.5170.3139.1-119.40000122.4
87P47.7Very low36.3Very low110 Ų110149.5 Ų149.571%0.71480%0.797SS**  cis-132.3169.8-44.129.7-10.3000112.7
88K33.2Very low36.7Very low178 Ų178147.5 Ų147.577%0.77480%0.799SS**  trans175.9126.7137.2-102.3-161.7164.8-175.20114.4
89E33.9Very low37.2Very low167 Ų167145 Ų14578%0.7878%0.782SS**  trans64.7115138.3-49.1-162.6151.400122.4
90Q35.2Very low38.4Very low185 Ų185139.3 Ų139.386%0.86477%0.774SS**  trans-67.8174.7148.1-78.4-174.2-23.600110.6
91P43.9Very low38.5Very low104 Ų104139.5 Ų139.568%0.67578%0.776SS**  cis-148179.322.939-16.2000118.5
92L30Very low38.7Very low136 Ų136139.3 Ų139.371%0.71277%0.769SS**  trans72.5113.9142.8-100.9146.4000121Q94L92-Q94 HydrophobicContact CD2-CG 4.44Å
93S37.8Very low39.4Very low107 Ų107140.1 Ų140.175%0.74877%0.772SS**  17593.8128.1-72.40000107.7
94Q36.1Very low40.3Very low176 Ų176135.7 Ų135.782%0.82276%0.762SS**  36.788.195-68.8-169.51.900114.5L92L92-Q94 HydrophobicContact CD2-CG 4.44Å
95V38.8Very low41.4Very low145 Ų145141.5 Ų141.588%0.87977%0.765SS**  trans-136.3131.5149.9178.30000108.8
96L38.4Very low42.2Very low165 Ų165143.1 Ų143.186%0.86476%0.763SS**  trans-52.5138.5-179.1-124.965.8000114.3
97R34Very low43.2Very low203 Ų203143.9 Ų143.977%0.76677%0.765SS**  trans25.6150.3141.3-110.1-158.7163.2174.3-6.3120.3
98P47Very low44Very low124 Ų124144.8 Ų144.881%0.80577%0.768SS**  cis-126.1157.248.28.416.7000115.8
99E42.4Very low45.4Very low118 Ų118141.2 Ų141.255%0.55176%0.764SS**PPolyproline II helixtrans-68.3139.4178.8173.1-100.3-172.900111.6
100P56.7Low46.7Very low107 Ų107139.3 Ų139.370%0.69577%0.766SS**PPolyproline II helixtrans-80.6140.617230.6-31.4000110.5
101P48.4Very low48.2Very low117 Ų117134.7 Ų134.776%0.7676%0.759SS**PPolyproline II helixtrans-66.2138.7-174.427.1-34.2000112.5
102D45.8Very low49.4Very low109 Ų109135.3 Ų135.358%0.58376%0.763SS**  trans-41.7121.7169.9-172.711.3000114.5E104D102-E104 VanDerWaalsContact C-N 3.28Å; D102-E104 PolarHBondContact O-N 3.48Å; D102-E104 WeakPolarHBondContact OD1-CG 3.42Å; D102-E104 PolarHBondContact OD1-N 3.44Å
103P47.8Very low51.2Low124 Ų124134.5 Ų134.581%0.80577%0.766SS**  trans-88.540170.535.7-33.3000113K105P103-K105 PolarHBondContact O-N 2.82Å; P103-K105 VanDerWaalsContact O-N 3.14Å
104E52.4Low52.7Low164 Ų164134.3 Ų134.377%0.76677%0.765SS**  trans-8371.9168.2-76.8-163.4-175.400112.8D102D102-E104 VanDerWaalsContact C-N 3.28Å; D102-E104 PolarHBondContact O-N 3.48Å; D102-E104 WeakPolarHBondContact OD1-CG 3.42Å; D102-E104 PolarHBondContact OD1-N 3.44Å
105K54.5Low54.1Low201 Ų201136.2 Ų136.287%0.87477%0.77SS**  trans174.478.6144.4-109.5179.6172.6-1750111.6P103P103-K105 PolarHBondContact O-N 2.82Å; P103-K105 VanDerWaalsContact O-N 3.14Å
106L49.8Very low55.2Low154 Ų154140 Ų14081%0.80677%0.768SS**  trans-130.3129.3146.8-71.6175.7000107.3V108L106-V108 PolarHBondContact O-N 3.17Å
107P54.1Low56.3Low127 Ų127140 Ų14083%0.82576%0.764SS**  trans-64.6108.7177.225.8-30.6000108.2
108V62.7Low57.5Low129 Ų129136.2 Ų136.278%0.78277%0.767SS**PPolyproline II helixtrans-58.7123.2170.3177.70000107.2L106L106-V108 PolarHBondContact O-N 3.17Å
109P62.9Low57.8Low104 Ų104140.7 Ų140.768%0.67577%0.768SS**PPolyproline II helixtrans-63139.1174.426.2-32.5000108.9A111P109-A111 PolarHBondContact O-N 3.31Å
110P62.4Low58.3Low127 Ų127140.8 Ų140.883%0.82578%0.781SS**PPolyproline II helixtrans-59131.3179.724.1-32.5000109.6
111A66.9Low58.2Low87 Ų87143.6 Ų143.672%0.71979%0.79SS**PPolyproline II helixtrans-53.5139.9177.300000110.4P109P109-A111 PolarHBondContact O-N 3.31Å
112P67.4Low58.3Low117 Ų117143.1 Ų143.176%0.7679%0.79SS**PPolyproline II helixtrans-59.1139.5178.224.4-32.9000109.8S114P112-S114 PolarHBondContact O-N 3.15Å
113P68.1Low58.9Low120 Ų120143.9 Ų143.978%0.77980%0.798SS**PPolyproline II helixtrans-58.6128.2-176.423.2-32.6000110K115P113-K115 PolarHBondContact O-N 2.87Å
114S70.2Confident59Low102 Ų102143.1 Ų143.171%0.71379%0.793SS**PPolyproline II helixtrans-54.1126.7175.962.60000109P112 R116P112-S114 PolarHBondContact O-N 3.15Å; S114-R116 PolarHBondContact O-N 3.16Å
115K64.6Low59.5Low217 Ų217142.1 Ų142.194%0.94380%0.798SS**  trans-43.798.3179.4-73.4179177.8175.80110.2P113 H117P113-K115 PolarHBondContact O-N 2.87Å; K115-H117 PolarHBondContact O-N 3.49Å; K115-H117 VanDerWaalsContact O-N 3.14Å
116R63Low59.6Low223 Ų223135.5 Ų135.584%0.84277%0.772SS**  trans-69.2113.7173.6-67.5-172.3-176.7-129.51.2106S114 C118S114-R116 PolarHBondContact O-N 3.16Å; R116-C118 PolarHBondContact O-N 3.42Å
117H61.6Low59.9Low167 Ų167135.2 Ų135.277%0.77377%0.77SS**  trans-46.4113.8168.3-177.879.4000108.7K115 R119K115-H117 PolarHBondContact O-N 3.49Å; K115-H117 VanDerWaalsContact O-N 3.14Å; H117-R119 VanDerWaalsContact C-N 3.35Å; H117-R119 PolarHBondContact O-N 3.35Å
118C57.9Low60Low122 Ų122133.5 Ų133.582%0.82476%0.761SS**  trans-60.998.5175.5-65.50000108.2R116 S120R116-C118 PolarHBondContact O-N 3.42Å; C118-S120 PolarHBondContact O-N 3.49Å
119R54.3Low59.7Low218 Ų218136 Ų13682%0.82376%0.757SS**  trans-69.3125164.8-61.3-174.591.8158.94.9106.4H117 L121H117-R119 VanDerWaalsContact C-N 3.35Å; H117-R119 PolarHBondContact O-N 3.35Å; R119-L121 PolarHBondContact O-N 3.32Å; R119-L121 VanDerWaalsContact O-N 3.09Å
120S53.4Low59Low120 Ų120140.8 Ų140.884%0.83976%0.761SS**  trans-47.5113171.930.20000110.1C118 S122C118-S120 PolarHBondContact O-N 3.49Å; S120-S122 PolarHBondContact O-N 3.09Å
121L54Low58.7Low166 Ų166142.3 Ų142.387%0.86976%0.758SS**  trans-65.3130.6168.8-68.2173000108R119R119-L121 PolarHBondContact O-N 3.32Å; R119-L121 VanDerWaalsContact O-N 3.09Å
122S50.2Low58.2Low108 Ų108143.4 Ų143.476%0.75576%0.757SS**  trans-40.7131.7178.143.50000113.9S120S120-S122 PolarHBondContact O-N 3.09Å
123V57.7Low57.7Low124 Ų124143 Ų14375%0.75275%0.752SS**  trans-56.2124.5160.3176.70000108.2V125V123-V125 PolarHBondContact O-N 3.48Å; V123-V125 VanDerWaalsContact O-N 3.15Å
124P51.3Low57.1Low108 Ų108147.3 Ų147.370%0.70175%0.753SS**  trans-68.6115.4169.325.8-29000108.7D126P124-D126 VanDerWaalsContact C-N 3.26Å; P124-D126 PolarHBondContact O-N 3.37Å
125V61.3Low56.8Low144 Ų144152.4 Ų152.487%0.87376%0.757SS**SBendtrans-78.972.417575.50000109.5V123V123-V125 PolarHBondContact O-N 3.48Å; V123-V125 VanDerWaalsContact O-N 3.15Å
126D57.2Low56.5Low62 Ų62146.3 Ų146.333%0.33274%0.739SS.*  trans-167.578152.8-136.6-26.2000112.7P124 S128 R129P124-D126 VanDerWaalsContact C-N 3.26Å; P124-D126 PolarHBondContact O-N 3.37Å; D126-S128 PolarHBondContact O-N 3.27Å; D126-S128 PolarHBondContact OD1-OG 2.96Å; D126-R129 IonicContact OD2-CZ 3.03Å; D126-R129 IonicContact OD2-NH1 2.73Å; D126-R129 PolarHBondContact OD2-NH1 3.32Å; D126-R129 IonicContact OD2-NH2 2.7Å; D126-R129 PolarHBondContact OD2-NH2 3.36Å
127L56.3Low56.5Low147 Ų147139.6 Ų139.677%0.7773%0.732SS**THydrogen-bonded Turntrans-80.73.4173.4-69.7169.6000113
128S55.8Low56.2Low91 Ų91138 Ų13864%0.63674%0.736SS**THydrogen-bonded Turntrans-79.7-21-179.572.70000113.7D126D126-S128 PolarHBondContact O-N 3.27Å; D126-S128 PolarHBondContact OD1-OG 2.96Å
129R57.6Low56.2Low183 Ų183135.1 Ų135.169%0.69172%0.717SS**SBendtrans-95-0.6-179.4-77.3-166.2-70-75.4-4.2115.2D126D126-R129 IonicContact OD2-CZ 3.03Å; D126-R129 IonicContact OD2-NH1 2.73Å; D126-R129 PolarHBondContact OD2-NH1 3.32Å; D126-R129 IonicContact OD2-NH2 2.7Å; D126-R129 PolarHBondContact OD2-NH2 3.36Å
130W48.2Very low56.7Low203 Ų203134.5 Ų134.577%0.76972%0.72SS**  trans-115.575.8178.9-70.986.6000110.5P132W130-P132 VanDerWaalsContact C-CD 3.42Å; W130-P132 VanDerWaalsContact O-CD 3.26Å; W130-P132 WeakPolarHBondContact O-CD 3.41Å
131Q56.4Low57.2Low160 Ų160136.2 Ų136.275%0.74872%0.719SS**  trans-103.586.7158.9-73.3-70.7-31.700107.4V133Q131-V133 VanDerWaalsContact C-N 3.25Å; Q131-V133 PolarHBondContact O-N 3.26Å
132P55Low57.1Low109 Ų109138.3 Ų138.371%0.70872%0.716SS**  trans-67.296.916527.9-28.6000106.5W130 W134W130-P132 VanDerWaalsContact C-CD 3.42Å; W130-P132 VanDerWaalsContact O-CD 3.26Å; W130-P132 WeakPolarHBondContact O-CD 3.41Å; P132-W134 PolarHBondContact O-N 3.02Å
133V56.8Low58.1Low108 Ų108138.7 Ų138.766%0.65571%0.713SS**  trans-63.594.2167.2175.70000105.8Q131 R135Q131-V133 VanDerWaalsContact C-N 3.25Å; Q131-V133 PolarHBondContact O-N 3.26Å; V133-R135 HydrophobicContact CG1-CG 3.92Å; V133-R135 PolarHBondContact O-N 3.42Å
134W55.8Low58.4Low212 Ų212138 Ų13880%0.80371%0.712SS**  trans-62.4109.7174.2-170.884.8000107.5P132 P136P132-W134 PolarHBondContact O-N 3.02Å; W134-P136 HydrophobicContact CE3-CG 4.41Å; W134-P136 HydrophobicContact CH2-CB 3.72Å; W134-P136 HydrophobicContact CH2-CG 4.14Å; W134-P136 HydrophobicContact CZ2-CB 4.29Å; W134-P136 HydrophobicContact CZ3-CB 3.89Å; W134-P136 HydrophobicContact CZ3-CG 3.79Å
135R63.6Low59.1Low209 Ų209140.7 Ų140.779%0.78972%0.718SS**  trans-109.6119.1167.6-62.3-156.4-173.5-165.74.2107V133 A137V133-R135 HydrophobicContact CG1-CG 3.92Å; V133-R135 PolarHBondContact O-N 3.42Å; R135-A137 PolarHBondContact O-N 3.45Å
136P59.5Low59.4Low89 Ų89143.2 Ų143.258%0.57872%0.718SS**  trans-61.4126.1172.422.7-27.4000108.3W134W134-P136 HydrophobicContact CE3-CG 4.41Å; W134-P136 HydrophobicContact CH2-CB 3.72Å; W134-P136 HydrophobicContact CH2-CG 4.14Å; W134-P136 HydrophobicContact CZ2-CB 4.29Å; W134-P136 HydrophobicContact CZ3-CB 3.89Å; W134-P136 HydrophobicContact CZ3-CG 3.79Å
137A63.5Low59.7Low82 Ų82148.3 Ų148.368%0.67874%0.739SS**  trans-59.8138.8169.600000108.6R135 S139R135-A137 PolarHBondContact O-N 3.45Å; A137-S139 VanDerWaalsContact C-N 3.35Å; A137-S139 PolarHBondContact O-N 3.09Å
138P54.5Low60.1Low132 Ų132152 Ų15286%0.85774%0.743SS**  trans-65.196179.726.7-33.2000109
139S59Low59.9Low62 Ų62150.1 Ų150.143%0.43474%0.738SS.*  trans-77.6129.6173.449.10000108.5A137 L141 W142A137-S139 VanDerWaalsContact C-N 3.35Å; A137-S139 PolarHBondContact O-N 3.09Å; S139-L141 PolarHBondContact O-N 3.47Å; S139-W142 PolarHBondContact O-N 3.18Å
140K63.2Low59.8Low205 Ų205147.6 Ų147.689%0.89175%0.748SS**THydrogen-bonded Turntrans-62.8-2.6179-70.9178.4177.7176.30114.1
141L64.9Low59.9Low156 Ų156141.3 Ų141.382%0.81775%0.746SS**THydrogen-bonded Turntrans-87.7-19.8178.9-61.7177.4000112.9S139S139-L141 PolarHBondContact O-N 3.47Å
142W52Low59.5Low211 Ų211137.5 Ų137.580%0.79975%0.75SS**  trans-110.778.5177-61.292.9000108.9S139 P144S139-W142 PolarHBondContact O-N 3.18Å; W142-P144 VanDerWaalsContact O-CD 3.23Å; W142-P144 WeakPolarHBondContact O-CD 3.4Å
143T71.3Confident59.2Low115 Ų115136.5 Ų136.571%0.70676%0.759SS**  trans-75.7114.2166.6-33.70000106.7I145T143-I145 PolarHBondContact O-N 3.29Å
144P64.1Low58.5Low110 Ų110135.1 Ų135.171%0.71477%0.767SS**  trans-61.5116174.924.3-31.4000107.9W142 K146W142-P144 VanDerWaalsContact O-CD 3.23Å; W142-P144 WeakPolarHBondContact O-CD 3.4Å; P144-K146 PolarHBondContact O-N 3.46Å
145I65.9Low57.9Low164 Ų164128.3 Ų128.384%0.84176%0.762SS**  trans-63.8109176-61.5172.2000106.3T143 H147T143-I145 PolarHBondContact O-N 3.29Å; I145-H147 PolarHBondContact O-N 2.96Å
146K68.1Low56.9Low197 Ų197124.8 Ų124.886%0.85777%0.767SS**  trans-66.5102171.6-71.5-176.2177.4179.80107.2P144 R148P144-K146 PolarHBondContact O-N 3.46Å; K146-R148 PolarHBondContact O-N 2.85Å
147H63.2Low56.3Low170 Ų170129.8 Ų129.879%0.78778%0.782SS**  trans-62.1105.7164.5-170.8-98.5000106.7I145 G149I145-H147 PolarHBondContact O-N 2.96Å; H147-G149 PolarHBondContact O-N 3Å
148R64Low55.4Low225 Ų225131.7 Ų131.785%0.84979%0.785SS**  trans-6494.9165.6179.2-176.3-85.3-93.95.7105K146 S150K146-R148 PolarHBondContact O-N 2.85Å; R148-S150 PolarHBondContact O-N 3.08Å
149G50.9Low54.9Low51 Ų51131 Ų13153%0.52678%0.781SS.*  trans-52.5125.5165.800000107.3H147 G151H147-G149 PolarHBondContact O-N 3Å; G149-G151 PolarHBondContact O-N 3.09Å
150S56Low54Low130 Ų130136.6 Ų136.691%0.90980%0.8SS**  trans-63.778.9169-70.60000108.9R148R148-S150 PolarHBondContact O-N 3.08Å
151G50.4Low52.8Low70 Ų70135.7 Ų135.772%0.72280%0.799SS**  trans-93.9107155.500000106.5G149G149-G151 PolarHBondContact O-N 3.09Å
152G48.1Very low51.5Low81 Ų81133.4 Ų133.484%0.83580%0.795SS**  trans-63.5153.4175.800000112.2
153G49Very low51.2Low87 Ų87128.8 Ų128.890%0.89779%0.793SS**  trans102.4112.5159.700000115.3
154G41.6Very low49.9Very low79 Ų79129.6 Ų129.681%0.81480%0.8SS**  trans142.878.9152.900000116.6
155G42.3Very low48.8Very low69 Ų69133.9 Ų133.971%0.71181%0.807SS**  trans64.4142.9138.100000121.2Q157G155-Q157 PolarHBondContact O-N 2.97Å
156P43.8Very low47.6Very low135 Ų135138 Ų13888%0.87781%0.812SS**PPolyproline II helixtrans-75117.817129.8-29.2000110.4
157Q45.5Very low46.1Very low195 Ų195134.8 Ų134.891%0.91181%0.809SS**PPolyproline II helixtrans-97.1131.3163.9-87-156.317.300110.9G155G155-Q157 PolarHBondContact O-N 2.97Å
158V46.1Very low44.9Very low121 Ų121132.2 Ų132.273%0.73381%0.81SS**PPolyproline II helixtrans-65.8143176.7176.30000110.7H160V158-H160 PolarHBondContact O-N 2.73Å
159P44.6Very low43.6Very low118 Ų118125.8 Ų125.877%0.76680%0.8SS**  trans-80108179.330.9-30.8000110.8
160H38.3Very low43.1Very low179 Ų179131.9 Ų131.983%0.82982%0.819SS**  trans-87.4107.4164.6-119.9-80.5000109.4V158V158-H160 PolarHBondContact O-N 2.73Å
161Q39.8Very low42.4Very low187 Ų187135.5 Ų135.587%0.87481%0.813SS**  trans-68.9132.3162.5-63.1-167.866.100108.7
162S37.4Very low41.8Very low107 Ų107141.8 Ų141.875%0.74882%0.821SS**  trans-145.4148.7157.554.30000110.8
163P45.6Very low41.5Very low115 Ų115145.9 Ų145.975%0.74782%0.823SS**  trans-85.5166.7-159.5-5.225.1000113.5K165P163-K165 PolarHBondContact O-N 2.89Å
164P43.5Very low40.7Very low131 Ų131150.7 Ų150.785%0.85182%0.822SS**  trans-77.8111.6-169.231.2-33.1000112
165K40.3Very low40.5Very low201 Ų201151.1 Ų151.187%0.87482%0.818SS**  trans-100.9107.6162.3-75.5-176.3178.6177.80109.7P163 V167P163-K165 PolarHBondContact O-N 2.89Å; K165-V167 PolarHBondContact O-N 3.14Å
166R42.1Very low40.5Very low250 Ų250153.8 Ų153.894%0.94382%0.823SS**  trans-55.8116.7160.1-93.5-172.7-82.7167.3-7.9108.9
167V36.6Very low40Very low130 Ų130153.2 Ų153.279%0.78882%0.822SS**  trans-138.5112.8156.3174.70000108.7K165K165-V167 PolarHBondContact O-N 3.14Å
168S37.6Very low39.6Very low116 Ų116148.3 Ų148.381%0.81181%0.814SS**  trans-67.8132.4157.8174.20000108.9
169S36.5Very low39.2Very low90 Ų90147.9 Ų147.963%0.62982%0.817SS**  trans171.299.5145.1168.40000110.6R171S169-R171 PolarHBondContact O-N 3.05Å
170L40.6Very low38.9Very low179 Ų179148.1 Ų148.194%0.93782%0.821SS**  trans-72.3104.9158.5-81.1162000108.8
171R41.1Very low38.8Very low206 Ų206148.5 Ų148.578%0.77782%0.824SS**  trans-148.6102.9163.3-73.6-68.8-164.6108.73.5109.4S169S169-R171 PolarHBondContact O-N 3.05Å
172F38.2Very low38.5Very low202 Ų202146 Ų14689%0.88683%0.825SS**  trans-145.395.9150.8-72.2-71.9000105.4
173L42.1Very low38.3Very low167 Ų167147.2 Ų147.287%0.87483%0.828SS**  67.6122.991.8-71.6176.9000113.1
174Q32Very low37.8Very low187 Ų187147.2 Ų147.287%0.87483%0.828SS**  trans-81.3134.3-176169.8177.2-35.100110.9
175A35.7Very low37.6Very low89 Ų89145.7 Ų145.774%0.73683%0.826SS**  trans65.9157.4152.500000117.7
176P43.2Very low37.4Very low125 Ų125145.3 Ų145.381%0.81283%0.827SS**  cis-137.4165.92937-15.6000118.6
177S34.2Very low37Very low122 Ų122142.9 Ų142.985%0.85382%0.818SS**  trans-44.3138.8169-54.30000116
178A35.4Very low37.1Very low92 Ų92142.6 Ų142.676%0.7682%0.819SS**  trans-154.5101.5143.300000106.3
179S38.8Very low36.9Very low113 Ų113145.7 Ų145.779%0.7981%0.814SS**  51.59295.5-176.30000113.3
180S37.7Very low37Very low122 Ų122146 Ų14685%0.85382%0.816SS**  trans-153.6101146.1-60.10000108.2
181Q36.7Very low37.4Very low188 Ų188142.9 Ų142.988%0.87981%0.807SS**  trans-70.6131.1165.4-66172.6700108.4
182C32.5Very low37.7Very low133 Ų133139.1 Ų139.190%0.89981%0.809SS**  trans-153128.6144.6-110.10000110
183V34.4Very low38.2Very low133 Ų133138.4 Ų138.481%0.80681%0.806SS**  trans-63.2144.2-173.8179.50000111.5A185V183-A185 PolarHBondContact O-N 2.91Å
184P35.7Very low38.4Very low116 Ų116139.4 Ų139.475%0.75380%0.803SS**  trans-79.9114.617530.9-30.1000110.5
185A38.8Very low38.7Very low99 Ų99136.3 Ų136.382%0.81880%0.803SS**  trans-77.6126.9161.200000109.1V183 R187V183-A185 PolarHBondContact O-N 2.91Å; A185-R187 PolarHBondContact O-N 2.85Å
186H36.1Very low38.9Very low192 Ų192140.4 Ų140.489%0.88981%0.811SS**  trans-55.8114173.8-73.1-95.7000111.6
187R33.2Very low38.8Very low199 Ų199138.8 Ų138.875%0.75181%0.808SS**  trans-146.5121.9146-123-162.8-152.6-167.510.3109.6A185 Y189A185-R187 PolarHBondContact O-N 2.85Å; R187-Y189 PolarHBondContact O-N 3.49Å
188P39.3Very low39.2Very low125 Ų125140.7 Ų140.781%0.81281%0.808SS**  trans-82.1105.1168.731.3-28.3000109.2
189Y32Very low39.2Very low181 Ų181141.3 Ų141.371%0.7181%0.813SS**  trans-91.8110.3152-98-91.6000104.7R187R187-Y189 PolarHBondContact O-N 3.49Å
190S39.9Very low39Very low95 Ų95144.1 Ų144.166%0.66481%0.813SS**  117.9149.162.657.90000107.1
191P49.3Very low38.8Very low115 Ų115145.7 Ų145.775%0.74781%0.812SS**  trans-94.2163.1-137.136.3-35.6000114.1F193P191-F193 PolarHBondContact O-N 2.62Å
192P45.6Very low38.5Very low126 Ų126141.8 Ų141.882%0.81881%0.806SS**  trans-72.3116.8168.930.3-30.9000110.2F194P192-F194 PolarHBondContact O-N 3.45Å
193F49.3Very low38.5Very low187 Ų187140.3 Ų140.382%0.8280%0.797SS**SBendtrans23.390.1142.4-135.4-95.9000116.7P191P191-F193 PolarHBondContact O-N 2.62Å
194F46.7Very low38.3Very low188 Ų188145.1 Ų145.183%0.82580%0.801SS**  trans162.380.2146-88.7-66.4000108P192P192-F194 PolarHBondContact O-N 3.45Å
195S38.4Very low38.6Very low123 Ų123144.4 Ų144.486%0.8680%0.796SS**  trans-161.377.1164.7-75.40000107.9
196L40Very low38.1Very low174 Ų174145.9 Ų145.991%0.91180%0.799SS**  trans-106.9137.6158.4-73.9174000107
197A40.1Very low37.9Very low91 Ų91141.6 Ų141.675%0.75280%0.797SS**  trans70.8114.6-176.600000113.4
198L43.2Very low37.9Very low163 Ų163136.8 Ų136.885%0.85380%0.8SS**  cis-142.893.746.9-68.2157.2000110.1
199A34.5Very low37.6Very low104 Ų104136.3 Ų136.386%0.8680%0.8SS**  trans-106.187.9154.500000105.3D201A199-D201 PolarHBondContact O-N 2.77Å
200Q35.3Very low38.7Very low172 Ų172132.8 Ų132.880%0.80480%0.799SS**  trans-82102.2175.5-160166.13.500107.1S202Q200-S202 PolarHBondContact O-N 3.22Å
201D33.5Very low38.4Very low155 Ų155137 Ų13783%0.82981%0.808SS**  trans-79.1105.1168.5-158.36.6000107A199A199-D201 PolarHBondContact O-N 2.77Å
202S31.4Very low37.6Very low106 Ų106137.3 Ų137.374%0.74181%0.813SS**  trans-132.695.7162.265.80000109.7Q200Q200-S202 PolarHBondContact O-N 3.22Å
203S31.7Very low36.9Very low103 Ų103134.7 Ų134.772%0.7281%0.809SS**  trans-79.4143.7160.462.40000111.1
204R31.3Very low36Very low234 Ų234130.7 Ų130.788%0.88380%0.804SS**  trans108.6154.2153-107.5-174.1137.8165-4.7118.8
205P40.6Very low35.4Very low101 Ų101132.3 Ų132.366%0.65681%0.805SS**  -127.9164.8-102.940.5-23.4000116
206C28.9Very low35Very low129 Ų129134.1 Ų134.187%0.87280%0.8SS**  trans53.7144145.3-70.30000124.4
207A31.9Very low34.8Very low103 Ų103131.2 Ų131.285%0.85179%0.794SS**  trans83.5126.2164.200000115.9
208A33.2Very low34.4Very low98 Ų98134.4 Ų134.481%0.8180%0.798SS**  cis-155.1146.79.300000110.3
209S33.7Very low34.3Very low115 Ų115130.3 Ų130.380%0.80479%0.788SS**  trans-59.4-179.4161.1-62.40000111.8
210P54.3Low34.4Very low107 Ų107133.8 Ų133.870%0.69579%0.786SS**  cis-133.4-179.112.638.3-15.6000112.8
211Q33.6Very low34.3Very low182 Ų182129.9 Ų129.985%0.8578%0.778SS**  cis179.7137.647.2-14916964.500108.6
212S32.5Very low34.3Very low123 Ų123130 Ų13086%0.8678%0.778SS**  168.6130.8121.9-1650000109.1
213G31Very low34.8Very low71 Ų71130.6 Ų130.673%0.73278%0.782SS**  trans-81172.9-159.400000115
214S30.4Very low35.5Very low102 Ų102131.1 Ų131.171%0.71378%0.783SS**  172.9136.497.7-169.30000110.6
215W33.2Very low35.7Very low222 Ų222126 Ų12684%0.84178%0.781SS**  trans49.6106.6150.579-53.8000120.9
216E30.5Very low36.3Very low162 Ų162126.8 Ų126.876%0.75779%0.787SS**  72.2105.691.8-84.7-97.4125.500114.9
217S35.7Very low36.9Very low112 Ų112126.8 Ų126.878%0.78379%0.785SS**  176.8120.1115.3-75.80000110.4
218D32.4Very low37.4Very low158 Ų158131 Ų13185%0.84579%0.787SS**  trans-65.8147.8179.7-79.4-48.5000113.9
219A40.8Very low37.9Very low77 Ų77136.8 Ų136.864%0.63679%0.788SS**  trans-63157.4159.100000109.8
220E36.7Very low38.3Very low177 Ų177143 Ų14383%0.82779%0.794SS**  165.4146.982.9-150116.597.700103.5
221S32.8Very low37.7Very low90 Ų90147 Ų14763%0.62980%0.801SS**  165.2152.877.173.50000111.2
222L34.1Very low37.7Very low158 Ų158144.3 Ų144.383%0.82780%0.802SS**  trans78.1106.8151-52.6177.7000121.4
223S40.6Very low38.1Very low118 Ų118146.3 Ų146.383%0.82580%0.802SS**  124.7153.7115.992.90000116.7
224P47.2Very low38.3Very low115 Ų115148.8 Ų148.875%0.74781%0.808SS**  trans-105.4140.7-156.337.5-27.5000112.8
225C35.5Very low38.8Very low125 Ų125150.1 Ų150.185%0.84581%0.814SS**  trans-160.1140.4158.4-960000111.6
226P52.5Low38.8Very low119 Ų119145.4 Ų145.477%0.77382%0.815SS**  trans-91.5145.8179.136.3-30.2000110.6
227P42.8Very low39.3Very low128 Ų128146.1 Ų146.183%0.83182%0.823SS**  trans-101.1113.6166.129.8-23.8000111.8R229P227-R229 PolarHBondContact O-N 3.2Å
228Q42.9Very low39.1Very low191 Ų191144.2 Ų144.289%0.89382%0.822SS**  trans-58.1127.3156.9-75.8172.9-56.600110.7
229R42.3Very low39.7Very low220 Ų220142.4 Ų142.483%0.8382%0.818SS**  trans17.9110131.1-157-167.3-55.4164.32.9116.3P227P227-R229 PolarHBondContact O-N 3.2Å
230R42.1Very low39.5Very low245 Ų245147.9 Ų147.993%0.92583%0.831SS**  trans-160.3133.8137.2-108.9165.2-172.1-121.12.3112.6
231F42Very low39.3Very low193 Ų193142.8 Ų142.885%0.84682%0.819SS**  trans-77139177.3-73-99.3000110.9
232S34.6Very low39.3Very low124 Ų124143.4 Ų143.487%0.86782%0.823SS**  trans-164.6122.1143.847.10000111
233L39.7Very low39.4Very low166 Ų166145.2 Ų145.287%0.86982%0.819SS**  trans-90.2139.5171.9-67.4164.3000109.1
234S34.7Very low39.1Very low122 Ų122148.2 Ų148.285%0.85382%0.817SS**  trans176.6135140.4-76.60000111
235P42.2Very low38.8Very low131 Ų131150.7 Ų150.785%0.85182%0.823SS**  trans-111.1124.9152.45.715000110.5
236S33.4Very low39.3Very low122 Ų122150 Ų15085%0.85382%0.817SS**  trans-77.4129.3171.350.10000111.3
237L39.8Very low38.3Very low177 Ų177149.7 Ų149.793%0.92782%0.818SS**  trans-66.6139.1170.1-131.581.1000110.9
238G32.1Very low37.8Very low73 Ų73148 Ų14875%0.75381%0.814SS**  trans-131.5128168.100000110.3
239P46Very low37.3Very low120 Ų120150.3 Ų150.378%0.77982%0.815SS**  trans-108.1159.2-17039-31.1000113.8
240Q34.8Very low37Very low192 Ų192144.9 Ų144.990%0.89781%0.811SS**  trans123.2146.7160.4-84.5-140.93700113
241A33.6Very low36.7Very low69 Ų69139.2 Ų139.257%0.5781%0.809SS**  cis-177.5143.4-18.900000105.1
242S33.2Very low36.7Very low103 Ų103135.7 Ų135.772%0.7281%0.805SS**  trans59.8114.2140.7-144.30000117.7
243R34.6Very low36.8Very low197 Ų197134.6 Ų134.674%0.74380%0.804SS**  169.1151.385.5-77.3-179.6-83.1-1540.2110.5
244F34.6Very low36.4Very low181 Ų181132.1 Ų132.179%0.79480%0.801SS**  trans86.7107.7156.7-48.8-64.1000119.7
245L40.4Very low36.6Very low166 Ų166132.2 Ų132.287%0.86980%0.801SS**  trans-104.8166.9136.9-64.5175.7000106.7
246P46.3Very low36.8Very low111 Ų111131 Ų13172%0.72179%0.794SS**  cis-139.4-173.21338.9-17.9000115.3
247S31.3Very low37.1Very low113 Ų113134 Ų13479%0.7979%0.794SS**  trans105.2120.8146.9-72.90000120.6
248A33.8Very low37.4Very low91 Ų91132 Ų13275%0.75278%0.783SS**  trans77.4122.4132.800000120.2
249R32.1Very low37.9Very low240 Ų240134.4 Ų134.491%0.90679%0.786SS**  trans94.2133136.4-115.9172.3168-162.7-4.8117.6
250S34.7Very low37.8Very low106 Ų106138.8 Ų138.874%0.74179%0.787SS**  trans67101158.149.80000118.2P252S250-P252 WeakPolarHBondContact O-CD 3.28Å
251S36.6Very low38.3Very low127 Ų127140.8 Ų140.889%0.88879%0.786SS**  trans-68.6132.5150.9-52.80000110.3
252P43.1Very low39.1Very low118 Ų118143 Ų14377%0.76680%0.795SS**  trans-118.5156.2141.134.9-25.7000110.8S250S250-P252 WeakPolarHBondContact O-CD 3.28Å
253A35.8Very low39.6Very low102 Ų102149.8 Ų149.884%0.84381%0.805SS**  trans-54135.5-175.700000114.6
254S32.2Very low40.4Very low114 Ų114143.8 Ų143.880%0.79780%0.804SS**  172.1137.2128.864.20000108.9
255S37.6Very low41Very low124 Ų124143.1 Ų143.187%0.86781%0.808SS**  trans-118.1110.4171.3-168.10000107.4
256P47.6Very low41.5Very low106 Ų106146.6 Ų146.669%0.68881%0.81SS**  trans-99.8121.1160.832-24.5000110.4
257E38.5Very low41.9Very low183 Ų183149.4 Ų149.486%0.85582%0.819SS**  trans36.7111.6137.7-56.1-171.9162.400120.8
258L46.4Very low43.4Very low135 Ų135150.9 Ų150.971%0.70782%0.817SS**  trans-2.3141147.3-52.8172.4000119.7W260L258-W260 VanDerWaalsContact CD1-NE1 3.26Å
259P43.5Very low44.4Very low125 Ų125152.6 Ų152.681%0.81282%0.82SS**  -131106.1122.532.8-22.1000112.5R261P259-R261 PolarHBondContact O-N 2.8Å
260W42.7Very low45.5Very low211 Ų211151.5 Ų151.580%0.79982%0.816SS**  trans-68.8125.7165.5-64.482.4000109.5L258L258-W260 VanDerWaalsContact CD1-NE1 3.26Å
261R45.1Very low46.5Very low234 Ų234151.1 Ų151.188%0.88381%0.814SS**  trans-117.7125.4158.8-73.1-65.9-110.2-98.31.6110.1P259P259-R261 PolarHBondContact O-N 2.8Å
262P50.4Low47.7Very low117 Ų117156.9 Ų156.976%0.7682%0.816SS**  trans-97.4113.1-178.534.5-27.2000110
263R45Very low48.6Very low245 Ų245156 Ų15693%0.92581%0.813SS**  trans-142.4103.3167-78.5-82.8-103.5-85.5-11.8110.1
264G49.8Very low49.9Very low70 Ų70158.5 Ų158.572%0.72281%0.807SS**  trans10166.5138.500000117.1
265L48.3Very low51Low168 Ų168158.8 Ų158.888%0.8881%0.806SS**SBendtrans-142.8106.1138.8-75.5-179.4000108.7
266R51.3Low51.9Low239 Ų239157.2 Ų157.290%0.90279%0.794SS**  trans27.5108.7148.8-60.1-178.6-175.5-112.90.2116.3L268R266-L268 PolarHBondContact O-N 2.77Å
267N55.2Low52.3Low170 Ų170159.8 Ų159.891%0.90980%0.802SS**  trans-39102.3162.2-56-44.7000112
268L62.7Low53.5Low144 Ų144157.9 Ų157.975%0.75480%0.797SS**  trans-114.7125.2149-147.775000104.5R266 R270R266-L268 PolarHBondContact O-N 2.77Å; L268-R270 PolarHBondContact O-N 3.27Å
269P53.9Low54Low126 Ų126159.1 Ų159.182%0.81880%0.804SS**  trans-66.787.7169.427.8-30.3000106.9S271P269-S271 PolarHBondContact O-N 2.93Å; P269-S271 VanDerWaalsContact O-N 3.08Å
270R55.8Low54.8Low217 Ų217157.5 Ų157.582%0.81980%0.801SS**  trans-68.6108.2171.7-166.3169.5-173.789.1-0.6105.3L268 R272L268-R270 PolarHBondContact O-N 3.27Å; R270-R272 PolarHBondContact O-N 3.05Å
271S55.1Low55.6Low99 Ų99158.9 Ų158.969%0.69281%0.806SS**  trans-44.7112.8174.449.10000109P269 S273P269-S271 PolarHBondContact O-N 2.93Å; P269-S271 VanDerWaalsContact O-N 3.08Å; S271-S273 PolarHBondContact O-N 3.27Å
272R61.2Low56.3Low247 Ų247157 Ų15793%0.93280%0.804SS**  trans-70.580.5171.4-74.5-175.7166.1-151.2-2.4108R270 Q274R270-R272 PolarHBondContact O-N 3.05Å; R272-Q274 VanDerWaalsContact C-N 3.34Å; R272-Q274 PolarHBondContact O-N 3.31Å; R272-Q274 VanDerWaalsContact O-N 3.09Å
273S63.3Low56.5Low101 Ų101157.8 Ų157.871%0.70681%0.807SS**  trans-75.293.2165.353.10000108.6S271S271-S273 PolarHBondContact O-N 3.27Å
274Q62.2Low57.1Low154 Ų154149.5 Ų149.572%0.7280%0.799SS**  trans54.2143.1148.5-62.1-170.7-28.400121.5R272R272-Q274 VanDerWaalsContact C-N 3.34Å; R272-Q274 PolarHBondContact O-N 3.31Å; R272-Q274 VanDerWaalsContact O-N 3.09Å
275P54.7Low57.8Low119 Ų119152.5 Ų152.577%0.77380%0.802SS**  trans-94.8122.2133.932.2-21.6000109.4D277P275-D277 PolarHBondContact O-N 2.86Å
276C58.3Low58.8Low91 Ų91153.4 Ų153.462%0.61580%0.799SS**  trans-76.999.8161.3-62.30000107.5L278C276-L278 PolarHBondContact O-N 3.21Å
277D55.7Low59.6Low160 Ų160152.7 Ų152.786%0.85680%0.797SS**  trans-79.176.5161.3-100.4-16.1000108.1P275P275-D277 PolarHBondContact O-N 2.86Å
278L62.2Low59.8Low144 Ų144156 Ų15675%0.75480%0.796SS**  trans-10092160.2-68175.6000106.1C276C276-L278 PolarHBondContact O-N 3.21Å
279D57.6Low59.9Low160 Ų160156.1 Ų156.186%0.85679%0.793SS**  trans167.199.8130.9-84.1-24.5000110.7
280A59.4Low60.2Low91 Ų91156.7 Ų156.775%0.75278%0.784SS**SBendtrans-162.9102.3134.600000109.1
281R60.6Low60.5Low240 Ų240150.3 Ų150.391%0.90676%0.764SS**SBendtrans93.6104.3151.3-54.1171.4142.2-112.4-13.7116.2
282K58.8Low60.8Low194 Ų194149.2 Ų149.284%0.84375%0.75SS**  trans92.286.3153.5-66.7-172.7171.5-170.90117.8
283T56.2Low60.7Low134 Ų134143.4 Ų143.482%0.82275%0.745SS**  31.392.7118.829.30000118.1
284G57.8Low60.5Low72 Ų72148.6 Ų148.674%0.74275%0.749SS**  trans-91.8116.3133.600000107.7K286G284-K286 VanDerWaalsContact C-N 3.35Å; G284-K286 PolarHBondContact O-N 3.41Å
285V64.1Low60.3Low132 Ų132147.3 Ų147.380%0.874%0.737SS**  trans-57.4102.4167.21730000106.7R287V285-R287 PolarHBondContact O-N 2.86Å
286K68.9Low60.8Low188 Ų188149.7 Ų149.782%0.81774%0.743SS**  trans-64.1104.1169.2-170.7171.5-179.2179.30105.4G284 R288G284-K286 VanDerWaalsContact C-N 3.35Å; G284-K286 PolarHBondContact O-N 3.41Å; K286-R288 PolarHBondContact O-N 3.3Å
287R67Low61.2Low224 Ų224152.3 Ų152.385%0.84574%0.74SS**  trans-50.3133.9167.1-66.4-172.5-179.2110-1106.4V285 H289V285-R287 PolarHBondContact O-N 2.86Å; R287-H289 PolarHBondContact O-N 3.2Å
288R59.8Low62Low239 Ų239150.7 Ų150.790%0.90274%0.738SS**  trans-51106.6176.6-70.4-173.6165.3141.5-2.3108.4K286 E290K286-R288 PolarHBondContact O-N 3.3Å; R288-E290 PolarHBondContact O-N 3.36Å
289H65.5Low62.5Low147 Ų147149 Ų14968%0.68174%0.738SS**  trans-92.975.2156.8-173.2-91.4000106.1R287 E291R287-H289 PolarHBondContact O-N 3.2Å; H289-E291 VanDerWaalsContact C-N 3.32Å; H289-E291 VanDerWaalsContact CE1-CG 3.45Å; H289-E291 WeakPolarHBondContact CE1-CG 3.27Å; H289-E291 PolarHBondContact O-N 2.92Å
290E60.8Low63.7Low137 Ų137147 Ų14764%0.6473%0.727SS**  trans-82.788.1171.5-133.9-86.3167.200105.9R288R288-E290 PolarHBondContact O-N 3.36Å
291E61.9Low64.7Low84 Ų84146.6 Ų146.639%0.39371%0.712SS.*  trans-107.890.4154.9-71.9-134.613400107.5H289 R295 R297H289-E291 VanDerWaalsContact C-N 3.32Å; H289-E291 VanDerWaalsContact CE1-CG 3.45Å; H289-E291 WeakPolarHBondContact CE1-CG 3.27Å; H289-E291 PolarHBondContact O-N 2.92Å; E291-R295 VanDerWaalsContact OE1-CD 3.27Å; E291-R295 WeakPolarHBondContact OE1-CD 3.45Å; E291-R295 IonicContact OE1-CZ 3.67Å; E291-R295 IonicContact OE1-NE 3.84Å; E291-R295 IonicContact OE1-NH1 2.77Å; E291-R295 PolarHBondContact OE1-NH1 2.97Å; E291-R297 IonicContact OE1-CZ 3.46Å; E291-R297 IonicContact OE1-NH1 2.62Å; E291-R297 PolarHBondContact OE1-NH1 3.18Å; E291-R297 IonicContact OE1-NH2 3.45Å; E291-R297 PolarHBondContact OE1-NH2 3.01Å; E291-R297 IonicContact OE2-NH1 3.92Å
292D60.1Low65.8Low75 Ų75141.2 Ų141.240%0.40170%0.695SS.*  trans-42.8133.2162.3-178.825000111R294D292-R294 PolarHBondContact O-N 2.85Å
293P59.6Low66.6Low126 Ų126137.8 Ų137.882%0.81869%0.686SS**THydrogen-bonded Turntrans-68.615.9-166.4-21.235.1000118
294R59.9Low67.6Low210 Ų210138.9 Ų138.979%0.79268%0.68SS**THydrogen-bonded Turntrans-106.35.3177.2-70.8-170.3177.285.2-1.6114.3D292 L296D292-R294 PolarHBondContact O-N 2.85Å; R294-L296 PolarHBondContact O-N 3.14Å
295R57.3Low68.6Low127 Ų127140.7 Ų140.748%0.47967%0.67SS.*  trans-75.769.5-179.1-71.5-175160.1173.55.3112.1E291 R297E291-R295 VanDerWaalsContact OE1-CD 3.27Å; E291-R295 WeakPolarHBondContact OE1-CD 3.45Å; E291-R295 IonicContact OE1-CZ 3.67Å; E291-R295 IonicContact OE1-NE 3.84Å; E291-R295 IonicContact OE1-NH1 2.77Å; E291-R295 PolarHBondContact OE1-NH1 2.97Å; R295-R297 HydrophobicContact CB-CG 4.45Å; R295-R297 PolarHBondContact O-N 3.36Å
296L64.5Low69.2Low169 Ų169140.1 Ų140.189%0.88566%0.663SS**  trans-66.266148.4-72.7161.2000108R294 P298R294-L296 PolarHBondContact O-N 3.14Å; L296-P298 VanDerWaalsContact O-CD 3.28Å; L296-P298 WeakPolarHBondContact O-CD 3.46Å
297R68.3Low69.8Low145 Ų145137.5 Ų137.555%0.54765%0.653SS.*  trans-66.8124.4167.1-74.1-150.1-174.186.9-4.8106.6E291 R295 S299E291-R297 IonicContact OE1-CZ 3.46Å; E291-R297 IonicContact OE1-NH1 2.62Å; E291-R297 PolarHBondContact OE1-NH1 3.18Å; E291-R297 IonicContact OE1-NH2 3.45Å; E291-R297 PolarHBondContact OE1-NH2 3.01Å; E291-R297 IonicContact OE2-NH1 3.92Å; R295-R297 HydrophobicContact CB-CG 4.45Å; R295-R297 PolarHBondContact O-N 3.36Å; R297-S299 PolarHBondContact O-N 3.01Å
298P71.9Confident70.3Confident127 Ų127135.6 Ų135.683%0.82565%0.651SS**  trans-55.8113.5166.5-19.431.9000107L296 L300L296-P298 VanDerWaalsContact O-CD 3.28Å; L296-P298 WeakPolarHBondContact O-CD 3.46Å; P298-L300 PolarHBondContact O-N 3.05Å
299S72.8Confident70.8Confident107 Ų107130.1 Ų130.175%0.74865%0.646SS**  trans-62.3125.4168.952.20000106.8R297 D301R297-S299 PolarHBondContact O-N 3.01Å; S299-D301 PolarHBondContact O-N 3.27Å
300L82.6Confident70.6Confident119 Ų119133.5 Ų133.562%0.62366%0.655SS**  trans-60.6110.3173.1-175.662.4000108.1P298 F302 M305P298-L300 PolarHBondContact O-N 3.05Å; L300-F302 HydrophobicContact CD2-CE1 4.09Å; L300-F302 HydrophobicContact CD2-CZ 4.14Å; L300-F302 PolarHBondContact O-N 3.48Å; L300-M305 HydrophobicContact CD1-CE 3.79Å; L300-M305 HydrophobicContact CD2-CE 3.67Å; L300-M305 HydrophobicContact CG-CE 3.77Å
301D80Confident70.7Confident82 Ų82133.2 Ų133.244%0.43967%0.668SS.*  trans-84.4106177.2-179.16.8000109.3S299 D303 K304 M305S299-D301 PolarHBondContact O-N 3.27Å; D301-D303 PolarHBondContact O-N 3.42Å; D301-D303 VanDerWaalsContact OD1-CB 3.28Å; D301-D303 WeakPolarHBondContact OD1-CB 3.34Å; D301-D303 PolarHBondContact OD1-N 3.04Å; D301-K304 HydrophobicContact CB-CB 4.19Å; D301-K304 PolarHBondContact O-N 3.48Å; D301-M305 PolarHBondContact O-N 3.46Å
302F83.4Confident70.1Confident128 Ų128132.6 Ų132.656%0.56168%0.684SS**Hα-helixtrans-66.6-19.5177.5-65.6-78.6000112.4L300 M305 N306L300-F302 HydrophobicContact CD2-CE1 4.09Å; L300-F302 HydrophobicContact CD2-CZ 4.14Å; L300-F302 PolarHBondContact O-N 3.48Å; F302-M305 HydrophobicContact CD1-CE 3.88Å; F302-M305 HydrophobicContact CD1-SD 4.32Å; F302-M305 HydrophobicContact CE1-CE 4.09Å; F302-M305 PolarHBondContact O-N 3.43Å; F302-N306 PolarHBondContact O-N 3.23Å; F302-N306 VanDerWaalsContact O-N 3.17Å; F302-N306 PolarHBondContact O-ND2 3.36Å
303D76.1Confident69.5Low121 Ų121132.8 Ų132.865%0.64770%0.704SS**Hα-helixtrans-73.9-35.6175.3-66.4-35.1000111.2D301 M305 N306 Q307D301-D303 PolarHBondContact O-N 3.42Å; D301-D303 VanDerWaalsContact OD1-CB 3.28Å; D301-D303 WeakPolarHBondContact OD1-CB 3.34Å; D301-D303 PolarHBondContact OD1-N 3.04Å; D303-M305 VanDerWaalsContact C-N 3.3Å; D303-N306 PolarHBondContact O-N 3.47Å; D303-Q307 WeakPolarHBondContact O-CG 3.37Å; D303-Q307 PolarHBondContact O-N 3.26Å
304K77.6Confident69Low158 Ų158135 Ų13569%0.68771%0.708SS**Hα-helixtrans-66-34.3170.6-168.6177.3-179.8-177.10112.1D301 N306D301-K304 HydrophobicContact CB-CB 4.19Å; D301-K304 PolarHBondContact O-N 3.48Å; K304-N306 VanDerWaalsContact C-N 3.34Å
305M78.4Confident68Low109 Ų109131.6 Ų131.654%0.53772%0.715SS.*Hα-helixtrans-71.5-27179.1-163.2-173.1-59.200113.1L300 D301 F302 D303L300-M305 HydrophobicContact CD1-CE 3.79Å; L300-M305 HydrophobicContact CD2-CE 3.67Å; L300-M305 HydrophobicContact CG-CE 3.77Å; D301-M305 PolarHBondContact O-N 3.46Å; F302-M305 HydrophobicContact CD1-CE 3.88Å; F302-M305 HydrophobicContact CD1-SD 4.32Å; F302-M305 HydrophobicContact CE1-CE 4.09Å; F302-M305 PolarHBondContact O-N 3.43Å; D303-M305 VanDerWaalsContact C-N 3.3Å
306N77Confident67.5Low121 Ų121133.4 Ų133.465%0.64773%0.733SS**THydrogen-bonded Turntrans-95.81.7-178.4-74.5-62.5000114.5F302 D303 K304 K308F302-N306 PolarHBondContact O-N 3.23Å; F302-N306 VanDerWaalsContact O-N 3.17Å; F302-N306 PolarHBondContact O-ND2 3.36Å; D303-N306 PolarHBondContact O-N 3.47Å; K304-N306 VanDerWaalsContact C-N 3.34Å; N306-K308 PolarHBondContact O-N 3.27Å
307Q81Confident66.3Low133 Ų133133.2 Ų133.262%0.62173%0.727SS**  trans-72.9110.4172.2-75.2177.937.300110D303D303-Q307 WeakPolarHBondContact O-CG 3.37Å; D303-Q307 PolarHBondContact O-N 3.26Å
308K76.9Confident65Low184 Ų184135 Ų13580%0.874%0.742SS**PPolyproline II helixtrans-62.1124.7169.1-58.2-78.3179.7176.10107.5N306 Y310N306-K308 PolarHBondContact O-N 3.27Å; K308-Y310 PolarHBondContact O-N 3.27Å; K308-Y310 VanDerWaalsContact O-N 3.08Å
309P71.1Confident63.3Low123 Ų123134.8 Ų134.880%0.79974%0.738SS**PPolyproline II helixtrans-58120.8172.822-29.8000108S311P309-S311 PolarHBondContact O-N 2.92Å; P309-S311 VanDerWaalsContact O-N 3.11Å
310Y62.1Low61.9Low219 Ų219134.3 Ų134.386%0.85974%0.741SS**PPolyproline II helixtrans-49.3118.4-179.3-79.6-95.6000110.3K308 G312K308-Y310 PolarHBondContact O-N 3.27Å; K308-Y310 VanDerWaalsContact O-N 3.08Å; Y310-G312 PolarHBondContact O-N 3.47Å
311S61Low59.6Low131 Ų131140.5 Ų140.592%0.91676%0.756SS**  trans-69.4107.9153.3-72.60000107P309P309-S311 PolarHBondContact O-N 2.92Å; P309-S311 VanDerWaalsContact O-N 3.11Å
312G50.8Low57.9Low71 Ų71145.8 Ų145.873%0.73278%0.778SS**  trans170.476.2178.500000114.4Y310Y310-G312 PolarHBondContact O-N 3.47Å
313G46.3Very low55.9Low79 Ų79143.1 Ų143.181%0.81479%0.787SS**  trans8098.4141.200000117.5
314L48.8Very low54.1Low173 Ų173142.4 Ų142.491%0.90679%0.791SS**  trans-53.4134.7159.8-60.4165.6000111
315C39.8Very low53Low138 Ų138140.4 Ų140.493%0.93280%0.797SS**  trans-136.181.1152.3-92.30000109.1
316L47.1Very low51.4Low164 Ų164142 Ų14286%0.85981%0.806SS**  trans-89.8107.8151.2-176.9132.6000106.5
317Q39.5Very low50Low165 Ų165141.2 Ų141.277%0.77181%0.81SS**  trans-164.5108.9142.7-132.9178.783.300111.5
318E41.2Very low48.4Very low184 Ų184139.9 Ų139.986%0.8681%0.813SS**  trans-65.5121.5148.9174170.8-167.800108.5
319T35.4Very low47.3Very low121 Ų121136.9 Ų136.974%0.74281%0.812SS**  trans-158.5141.5139.547.50000110
320A43.1Very low46.4Very low98 Ų98141 Ų14181%0.8181%0.812SS**  trans-67.2142.2-177.600000113.9
321R35.7Very low45.8Very low249 Ų249138.1 Ų138.194%0.9480%0.804SS**  -170.7132.3125.1-128.5175.4170.4-132.8-0.3112.6
322E42.6Very low45Very low193 Ų193139.7 Ų139.790%0.90280%0.799SS**  trans-41.3138.4171.1-152.195.2-155.700114.8
323G43.2Very low44.3Very low72 Ų72140.7 Ų140.774%0.74280%0.8SS**  trans96.791.9149.700000117.3
324S38.2Very low43.8Very low105 Ų105142.8 Ų142.873%0.73480%0.801SS**  -178.5143.8115670000110.5I326S324-I326 PolarHBondContact O-N 2.91Å
325S54.1Low43.3Very low116 Ų116140 Ų14081%0.81180%0.796SS**  trans-55.9119.7-179.950.90000113.3
326I45.1Very low44.3Very low144 Ų144139 Ų13974%0.73879%0.788SS**  trans-136.399.3165.7-54.9173.1000108.6S324S324-I326 PolarHBondContact O-N 2.91Å
327S46.2Very low44.4Very low104 Ų104136.9 Ų136.973%0.72778%0.784SS**  trans-67.9141.7163.1-56.60000109.5
328P48.7Very low44.6Very low105 Ų105134.7 Ų134.768%0.68278%0.784SS**  trans-65129.7-175.2-21.132.2000113W330P328-W330 PolarHBondContact O-N 3.3Å
329P54Low45Very low120 Ų120133.8 Ų133.878%0.77978%0.784SS**  trans-99.758.6-171.739.6-34.6000112.2
330W52.4Low45Very low210 Ų210134.3 Ų134.380%0.79579%0.793SS**  trans-111.11.8172.568.9-90.9000113.9P328P328-W330 PolarHBondContact O-N 3.3Å
331F48.8Very low44.6Very low159 Ų159134.5 Ų134.570%0.69779%0.794SS**  trans-84.2134.6160.7-100.4-100.4000109.3
332M44.3Very low44.4Very low164 Ų164128 Ų12881%0.80879%0.787SS**  trans90.5129.4-179.2-49.6-7396.900113.6
333A35.4Very low43.8Very low91 Ų91124.5 Ų124.575%0.75278%0.783SS**  cis-169.1153.7-4.900000107.8
334C35.6Very low43.6Very low123 Ų123126.5 Ų126.583%0.83179%0.785SS**  trans-71144.6168.6-68.80000112.2
335S38.3Very low44.1Very low114 Ų114127 Ų12780%0.79779%0.786SS**  trans107.4139.2144.4-55.60000119.4
336P62Low43Very low119 Ų119127.9 Ų127.977%0.77379%0.787SS**  trans-88.9175.3-173.641.4-36.7000111.8
337P47.8Very low42.3Very low118 Ų118125 Ų12577%0.76679%0.792SS**  cis-154.5-14246.541.8-15.2000112.3
338P45.3Very low41.6Very low120 Ų120123.5 Ų123.578%0.77979%0.793SS**  cis-131.9-177.5-18.638.1-17000116.2
339L48.6Very low40.8Very low165 Ų165123.9 Ų123.986%0.86480%0.798SS**  trans-59.9149.3178.9-56.4162.1000115.3
340S35.9Very low39.8Very low131 Ų131122.9 Ų122.992%0.91679%0.794SS**  trans-165131.8143.1-80.50000112.3
341A35.2Very low39.1Very low102 Ų102121.6 Ų121.684%0.84380%0.797SS**  trans-86.9162.3-176.400000112.9
342S29.7Very low38.5Very low112 Ų112120 Ų12078%0.78380%0.8SS**  trans-164.9111.2142.6-159.20000113.3
343C31.6Very low38.1Very low121 Ų121119.6 Ų119.682%0.81880%0.801SS**  trans40120.2134.9-55.10000122.8
344S38.2Very low38.2Very low114 Ų114120.6 Ų120.680%0.79780%0.802SS**  trans-63.8171.6150.4-27.40000111.5
345P48.5Very low38.1Very low114 Ų114123.4 Ų123.474%0.7480%0.803SS**  -154.3177.458.835.8-11.6000117.5
346T31.3Very low37.9Very low136 Ų136122.7 Ų122.783%0.83480%0.798SS**  140.1124.2126.1-47.10000115.8
347G31.3Very low36.9Very low82 Ų82126 Ų12685%0.84580%0.803SS**  trans89.3128.3152.100000116.5
348G30.7Very low36.5Very low73 Ų73129 Ų12975%0.75381%0.807SS**  cis162.2164.54.800000108.5
349S32.8Very low36.4Very low113 Ų113132.2 Ų132.279%0.7981%0.811SS**  trans80.397168.4-169.50000116.9
350S32.9Very low36.3Very low100 Ų100133.7 Ų133.770%0.69981%0.814SS**  89.9118.360.970.80000115.3
351Q37.7Very low36.6Very low183 Ų183136.4 Ų136.486%0.85581%0.812SS**  trans165.9105.1138.7-94.6-179.6-16.300108.2
352V34.9Very low36.6Very low125 Ų125135.2 Ų135.276%0.75881%0.81SS**  62109.380-171.30000109.7
353L35.5Very low37.1Very low156 Ų156134.8 Ų134.882%0.81781%0.813SS**  -153.7140.375-77.4162.8000113
354S38.1Very low37.5Very low111 Ų111135.9 Ų135.978%0.77682%0.815SS**  trans-87.6148.1162.2-63.10000110
355E34.7Very low37.5Very low182 Ų182140.3 Ų140.385%0.8582%0.815SS**  trans-159.7146.4136.138.9-167.390.100110.1
356S33.7Very low36.8Very low100 Ų100146.4 Ų146.470%0.69982%0.823SS**  trans-137.9137.6-157.542.30000106.5
357E39.7Very low36.9Very low189 Ų189143.2 Ų143.288%0.88382%0.817SS**  trans-158.1159.9157.744.8-171.210900110.5
358E40.9Very low37.5Very low179 Ų179151 Ų15184%0.83682%0.821SS**  trans-127.1-179.5-137.647.2-155.9103.100110.3
359E42.1Very low37.9Very low189 Ų189156.4 Ų156.488%0.88383%0.827SS**  trans-60.3153.6-164.5-56.8168119.600115.5
360E45.8Very low38.3Very low195 Ų195155.6 Ų155.691%0.91183%0.827SS**  -161.1138.1124.4-148.6-178.312800112.8
361E43Very low38.8Very low188 Ų188157.5 Ų157.588%0.87983%0.829SS**  trans-85142.9177.3-156.5-177.6-172.700110.4
362G36.3Very low39Very low77 Ų77154.2 Ų154.279%0.79483%0.826SS**  trans-173.592.117800000114.8
363A39.5Very low39.6Very low103 Ų103157 Ų15785%0.85183%0.828SS**  trans-66.7126.3178.400000113.6
364V39.9Very low39.8Very low144 Ų144160.7 Ų160.787%0.87383%0.831SS**  trans-145.3125.2150.4-178.50000111.4
365R38.2Very low40.2Very low208 Ų208161.6 Ų161.679%0.78583%0.832SS**  trans-68.1141.1171.6-172.5-168.6-50.1-173.74.6110.4
366W34.5Very low40.7Very low242 Ų242161 Ų16192%0.91783%0.833SS**  trans155.5142137.2-83.9110.4000111.7
367G33.1Very low41.2Very low69 Ų69161.5 Ų161.571%0.71184%0.836SS**  trans112.699.7142.700000117
368R42.8Very low41.5Very low244 Ų244160.7 Ų160.792%0.92183%0.832SS**  trans-47.4135.2156.9-76.5-171.8-83.7-100.42.9110.9
369Q39.1Very low42.2Very low187 Ų187159.7 Ų159.787%0.87483%0.827SS**  trans-154.7121.9140.1-113.917238.800111.4
370A42.3Very low42.8Very low96 Ų96156.9 Ų156.979%0.79382%0.818SS**  trans-66137.3167.300000109.7
371L42.2Very low43.4Very low141 Ų141155.5 Ų155.574%0.73881%0.81SS**  trans-141.8110.8161.3-139.992.6000109.8
372S42.5Very low44.1Very low113 Ų113149.5 Ų149.579%0.7980%0.799SS**  trans-67.6130.8170.764.20000110.9
373K47.2Very low45.4Very low184 Ų184153.7 Ų153.780%0.880%0.803SS**  trans-147.799154-68.3-167.6-179.7174.40111.3
374R40.2Very low46.5Very low234 Ų234155.2 Ų155.288%0.88380%0.796SS**  trans35.2109.1131.4-72.5178.1172.6131.9-2.3119.5
375T46.9Very low47.9Very low129 Ų129153.6 Ų153.679%0.79178%0.782SS**  28.9111.9119.259.10000120
376L45.3Very low49.2Very low169 Ų169149.8 Ų149.889%0.88578%0.777SS**  trans-169123.8147.2-143.780000104.1
377C43.3Very low50.6Low111 Ų111144.6 Ų144.675%0.7577%0.767SS**  cis-147.3130.238.5-57.50000109.9
378Q46.5Very low51.8Low173 Ų173148.5 Ų148.581%0.80877%0.771SS**  trans-93.2115.1156.8-175.3165.78.500105.1
379Q55.3Low52.8Low158 Ų158142.8 Ų142.874%0.73876%0.757SS**  trans-94.398.8177.7-161.4165.726.600106.9F381Q379-F381 HydrophobicContact CB-CE2 4.46Å; Q379-F381 HydrophobicContact CG-CE2 4.47Å; Q379-F381 WeakPolarHBondContact O-CD2 3.36Å; Q379-F381 PolarHBondContact O-N 3Å
380D55.7Low53.8Low130 Ų130142.7 Ų142.770%0.69576%0.757SS**  trans-70.6114.1176.6-65.6-40.8000109.3G382D380-G382 PolarHBondContact O-N 3.23Å; D380-G382 VanDerWaalsContact O-N 3.15Å
381F56.9Low54.7Low165 Ų165146.5 Ų146.572%0.72476%0.758SS**  trans-86.356.4172.5-73.7-87000110.6Q379Q379-F381 HydrophobicContact CB-CE2 4.46Å; Q379-F381 HydrophobicContact CG-CE2 4.47Å; Q379-F381 WeakPolarHBondContact O-CD2 3.36Å; Q379-F381 PolarHBondContact O-N 3Å
382G59.4Low54.8Low63 Ų63151.1 Ų151.165%0.64978%0.784SS**  trans-84.4-14.5-171.800000116.5D380D380-G382 PolarHBondContact O-N 3.23Å; D380-G382 VanDerWaalsContact O-N 3.15Å
383D62Low55.4Low165 Ų165153 Ų15388%0.88278%0.783SS**  trans-143.286.8-176.5-85.5-34.9000110.7
384L62.9Low55.8Low134 Ų134151.4 Ų151.470%0.70278%0.782SS**  trans-98.4103.6152-95.8104.8000107.1L386L384-L386 PolarHBondContact O-N 3.07Å; L384-L386 VanDerWaalsContact O-N 3.09Å
385D69.3Low56.7Low110 Ų110146.8 Ų146.859%0.58878%0.777SS**  trans-68.1103.2171.6-168.7-3.5000109N387 L388D385-N387 PolarHBondContact O-N 3.26Å; D385-N387 VanDerWaalsContact O-N 3.14Å; D385-N387 WeakPolarHBondContact OD1-CB 3.48Å; D385-N387 PolarHBondContact OD1-N 3.32Å; D385-N387 PolarHBondContact OD1-ND2 3.49Å; D385-L388 PolarHBondContact O-N 3.36Å
386L65.8Low57.3Low129 Ų129147.8 Ų147.868%0.67578%0.776SS**G310 helixtrans-65.5-10.8-178.7-69.1169.2000112.8L384 L388 I389L384-L386 PolarHBondContact O-N 3.07Å; L384-L386 VanDerWaalsContact O-N 3.09Å; L386-L388 PolarHBondContact O-N 2.94Å; L386-I389 HydrophobicContact CD2-CD1 3.77Å; L386-I389 PolarHBondContact O-N 3.34Å
387N63.3Low58Low132 Ų132146.5 Ų146.571%0.70677%0.769SS**G310 helixtrans-73.3-12.9177.1-63-46.8000113.4D385 I389D385-N387 PolarHBondContact O-N 3.26Å; D385-N387 VanDerWaalsContact O-N 3.14Å; D385-N387 WeakPolarHBondContact OD1-CB 3.48Å; D385-N387 PolarHBondContact OD1-N 3.32Å; D385-N387 PolarHBondContact OD1-ND2 3.49Å; N387-I389 VanDerWaalsContact C-N 3.31Å
388L60Low59Low152 Ų152148.9 Ų148.980%0.79677%0.77SS**G310 helixtrans-83.9-5.2178.3-157.967.3000113.5D385 L386D385-L388 PolarHBondContact O-N 3.36Å; L386-L388 PolarHBondContact O-N 2.94Å
389I62.2Low59.9Low124 Ų124147.1 Ų147.164%0.63677%0.768SS**G310 helixtrans-97.9-5.3-173.6-35.9176.8000111.9L386 N387L386-I389 HydrophobicContact CD2-CD1 3.77Å; L386-I389 PolarHBondContact O-N 3.34Å; N387-I389 VanDerWaalsContact C-N 3.31Å
390E61.7Low60.3Low185 Ų185146.3 Ų146.386%0.86477%0.77SS**SBendtrans-91.6-2.2-179.1-161.6167.4-161.200113.9
391E59.5Low60.6Low176 Ų176147.7 Ų147.782%0.82278%0.776SS**  trans-120.371176.8-158.5177.1-174.400111.9
392N44.8Very low61Low237 Ų237146.1 Ų146.1100%1.26778%0.781SS**  trans-154.90150.4-119.8-84.5000112.7

Retrieved 392 of 392 residues in 196.8 ms (Link to these results)