A0A087X7W5_POEFO Loading...

Myocyte enhancer factor 2b

AlphaFold DB , UniProt , Accession A0A087X7W5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 420 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
1M64.9Low88.2Confident235 Ų235151.7 Ų151.7100%1.15873%0.727SS**  0124.80-179.6153.754.500109
2G84.7Confident87.8Confident67 Ų67149.8 Ų149.869%0.69172%0.722SS**  trans-83.1177.5-170.300000115.6
3R88.1Confident86.2Confident262 Ų262144.8 Ų144.899%0.98970%0.702SS**PPolyproline II helixtrans-73123.5172.3-62-179.4-175.1177.72.8109.5
4K91.1Very high84.5Confident185 Ų185145.2 Ų145.280%0.80470%0.702SS**PPolyproline II helixtrans-95148.3169.3-67.3-170.1175.5-171.30110.6
5K90.8Very high82.6Confident209 Ų209147.4 Ų147.491%0.90970%0.7SS**PPolyproline II helixtrans-64.7142.9167.6-176.6-177.4176.1-170.80109.1
6I91.3Very high80.3Confident89 Ų89148.7 Ų148.746%0.45671%0.712SS.*  trans-132.4155.5171.769.8172.5000109.9I11I6-I11 HydrophobicContact CD1-CD1 4.37Å
7Q92.6Very high78.7Confident158 Ų158153.5 Ų153.574%0.73872%0.722SS**  trans-68.9153.8172.1-171.8173.2-1.100110.9S9Q7-S9 PolarHBondContact O-N 3.46Å
8I93.4Very high77.5Confident144 Ų144152.9 Ų152.974%0.73872%0.719SS**SBendtrans-88.187.2170.6-53.9-55.4000108
9S92.8Very high76.5Confident75 Ų75149.8 Ų149.852%0.52471%0.713SS.*SBendtrans-145.9171.2176.959.70000110.1Q7 I11Q7-S9 PolarHBondContact O-N 3.46Å; S9-I11 PolarHBondContact O-N 3.12Å; S9-I11 VanDerWaalsContact O-N 3.13Å
10R90.8Very high76.3Confident196 Ų196142.7 Ų142.774%0.7468%0.68SS**  trans-67.4111.2177.7-177.8173.8179.8152.7-2109.9L12R10-L12 PolarHBondContact O-N 2.84Å; R10-L12 VanDerWaalsContact O-N 3.16Å
11I89.7Confident76.4Confident49 Ų49138.3 Ų138.325%0.25166%0.663SS.*  trans-63.8116.1174.1-61.7164.4000108.7I6 S9 P21 W22 T25I6-I11 HydrophobicContact CD1-CD1 4.37Å; S9-I11 PolarHBondContact O-N 3.12Å; S9-I11 VanDerWaalsContact O-N 3.13Å; I11-P21 HydrophobicContact CG2-CB 4.44Å; I11-W22 HydrophobicContact CG2-CB 4.21Å; I11-T25 HydrophobicContact CD1-CG2 3.71Å
12L83.4Confident77.3Confident128 Ų128130.2 Ų130.267%0.6762%0.62SS**  trans-77.2147.3174.6-58.5-179.6000110.8R10 Q14R10-L12 PolarHBondContact O-N 2.84Å; R10-L12 VanDerWaalsContact O-N 3.16Å; L12-Q14 VanDerWaalsContact C-N 3.33Å; L12-Q14 PolarHBondContact O-N 3.01Å
13D67.4Low77.5Confident86 Ų86132.9 Ų132.946%0.4661%0.612SS.*  trans-85.372.9-177.2-157.2-30.6000111.3S20D13-S20 WeakPolarHBondContact OD1-CB 3.09Å; D13-S20 WeakPolarHBondContact OD2-CB 3.15Å; D13-S20 PolarHBondContact OD2-OG 3.36Å
14Q61.8Low77.6Confident150 Ų150123.3 Ų123.370%0.70158%0.583SS**  trans-109.980.4-174.8-158.8-17633.400112.5L12L12-Q14 VanDerWaalsContact C-N 3.33Å; L12-Q14 PolarHBondContact O-N 3.01Å
15R56.1Low77.7Confident178 Ų178116.3 Ų116.367%0.67256%0.556SS**  trans172.7114.5141.3-97.6178.2-14781.9-8.1111.8R17R15-R17 PolarHBondContact O-N 3.28Å
16N46.8Very low77.8Confident168 Ų168108.4 Ų108.490%0.89852%0.522SS*.THydrogen-bonded Turntrans-71.328.9179.2-64.9-1.2000115.6
17R51.7Low78Confident230 Ų230108.4 Ų108.487%0.86853%0.526SS*.THydrogen-bonded Turntrans-140.412.6-179.9-68.6-167.7178.6-174.50.4114.6R15R15-R17 PolarHBondContact O-N 3.28Å
18Q57.3Low78.1Confident144 Ų144108.3 Ų108.367%0.67352%0.523SS*.SBendtrans-143.2152.2174.9-73.8-64-52.400109.6S20Q18-S20 PolarHBondContact O-N 3.07Å
19P59.9Low78.3Confident93 Ų93108 Ų10860%0.60451%0.512SS*.SBendtrans-58.1125.3169.426.3-34000108.5V24P19-V24 HydrophobicContact CB-CG2 4.24Å; P19-V24 HydrophobicContact CG-CG2 4.27Å; P19-V24 WeakPolarHBondContact O-CG2 3.33Å
20S71.1Confident78.5Confident7 Ų7106.6 Ų106.65%0.04950%0.497CS..  trans-62.5143.7-152.8590000114.8D13 Q18 W22 K23 V24D13-S20 WeakPolarHBondContact OD1-CB 3.09Å; D13-S20 WeakPolarHBondContact OD2-CB 3.15Å; D13-S20 PolarHBondContact OD2-OG 3.36Å; Q18-S20 PolarHBondContact O-N 3.07Å; S20-W22 PolarHBondContact O-N 3.32Å; S20-W22 VanDerWaalsContact O-N 3.11Å; S20-K23 PolarHBondContact O-N 2.88Å; S20-K23 VanDerWaalsContact OG-CD 3.3Å; S20-K23 WeakPolarHBondContact OG-CD 3.44Å; S20-K23 VanDerWaalsContact OG-CG 3.29Å; S20-K23 WeakPolarHBondContact OG-CG 3.27Å; S20-V24 PolarHBondContact O-N 3.18Å
21P78.4Confident78.9Confident51 Ų51104.2 Ų104.233%0.33149%0.492SS..Hα-helixtrans-59.4-30.5-173.522.8-33.9000112.1I11 T25I11-P21 HydrophobicContact CG2-CB 4.44Å; P21-T25 WeakPolarHBondContact O-CB 3.07Å; P21-T25 PolarHBondContact O-N 3.37Å; P21-T25 PolarHBondContact O-OG1 2.64Å
22W83.7Confident79.3Confident65 Ų65103.6 Ų103.625%0.24650%0.497CS..Hα-helixtrans-64.6-52170.2179.982.9000112.4I11 S20 V24 T25 F26 N54I11-W22 HydrophobicContact CG2-CB 4.21Å; S20-W22 PolarHBondContact O-N 3.32Å; S20-W22 VanDerWaalsContact O-N 3.11Å; W22-V24 PolarHBondContact O-N 3.19Å; W22-T25 PolarHBondContact O-N 3Å; W22-F26 VanDerWaalsContact O-CB 3.28Å; W22-F26 WeakPolarHBondContact O-CB 3.43Å; W22-F26 PolarHBondContact O-N 3.44Å; W22-N54 HydrophobicContact CH2-CB 4.24Å
23K89.4Confident80Confident123 Ų123101.9 Ų101.954%0.53549%0.488SS..Hα-helixtrans-57.5-47.5178.3-71.2172.8-171.1166.90111.8S20 F26 T27S20-K23 PolarHBondContact O-N 2.88Å; S20-K23 VanDerWaalsContact OG-CD 3.3Å; S20-K23 WeakPolarHBondContact OG-CD 3.44Å; S20-K23 VanDerWaalsContact OG-CG 3.29Å; S20-K23 WeakPolarHBondContact OG-CG 3.27Å; K23-F26 PolarHBondContact O-N 3.09Å; K23-T27 PolarHBondContact O-N 3.29Å; K23-T27 PolarHBondContact O-OG1 2.98Å; K23-T27 VanDerWaalsContact O-OG1 3.12Å
24V90.7Very high81.5Confident62 Ų6299 Ų9938%0.37647%0.472SS..Hα-helixtrans-64.4-42.2179.3177.70000111.3P19 S20 W22 K28P19-V24 HydrophobicContact CB-CG2 4.24Å; P19-V24 HydrophobicContact CG-CG2 4.27Å; P19-V24 WeakPolarHBondContact O-CG2 3.33Å; S20-V24 PolarHBondContact O-N 3.18Å; W22-V24 PolarHBondContact O-N 3.19Å; V24-K28 HydrophobicContact CG1-CD 4.12Å; V24-K28 WeakPolarHBondContact O-CG 3.49Å; V24-K28 PolarHBondContact O-N 3.39Å
25T92.1Very high83.3Confident38 Ų3897 Ų9723%0.23346%0.462CS..Hα-helixtrans-69.1-41.2178.5-58.20000111.8I11 P21 W22 K28 R29I11-T25 HydrophobicContact CD1-CG2 3.71Å; P21-T25 WeakPolarHBondContact O-CB 3.07Å; P21-T25 PolarHBondContact O-N 3.37Å; P21-T25 PolarHBondContact O-OG1 2.64Å; W22-T25 PolarHBondContact O-N 3Å; T25-K28 PolarHBondContact O-N 3.04Å; T25-R29 HydrophobicContact CG2-CG 4.1Å; T25-R29 VanDerWaalsContact O-CB 3.3Å; T25-R29 WeakPolarHBondContact O-CB 3.46Å; T25-R29 WeakPolarHBondContact O-CG 3.4Å; T25-R29 PolarHBondContact O-N 3.35Å
26F93.9Very high85.3Confident43 Ų4394.9 Ų94.919%0.18946%0.457CS..Hα-helixtrans-58.7-54.5175.9177.1-99.9000110.9W22 K23 K28 R29 K30 I52 N54 F60W22-F26 VanDerWaalsContact O-CB 3.28Å; W22-F26 WeakPolarHBondContact O-CB 3.43Å; W22-F26 PolarHBondContact O-N 3.44Å; K23-F26 PolarHBondContact O-N 3.09Å; F26-K28 VanDerWaalsContact C-N 3.33Å; F26-K28 PolarHBondContact O-N 2.95Å; F26-R29 PolarHBondContact O-N 3.48Å; F26-K30 HydrophobicContact CE1-CD 4.02Å; F26-K30 HydrophobicContact CZ-CD 4.05Å; F26-K30 WeakPolarHBondContact O-CB 3.32Å; F26-K30 PolarHBondContact O-N 3.48Å; F26-I52 HydrophobicContact CE2-CG2 3.95Å; F26-I52 HydrophobicContact CZ-CG2 4.1Å; F26-N54 HydrophobicContact CE2-CB 4.3Å; F26-N54 HydrophobicContact CZ-CB 4.04Å; F26-F60 HydrophobicContact CE1-CD2 4.09Å; F26-F60 AromaticContact CE1-CE2 3.74Å; F26-F60 HydrophobicContact CE1-CE2 3.74Å; F26-F60 AromaticContact CE1-CZ 3.98Å; F26-F60 HydrophobicContact CE1-CZ 3.98Å; F26-F60 AromaticContact CZ-CD2 3.79Å; F26-F60 HydrophobicContact CZ-CD2 3.79Å; F26-F60 AromaticContact CZ-CE2 3.78Å; F26-F60 HydrophobicContact CZ-CE2 3.78Å; F26-F60 HydrophobicContact CZ-CG 4.5Å; F26-F60 HydrophobicContact CZ-CZ 4.46Å
27T95.2Very high87.8Confident88 Ų8887.4 Ų87.454%0.5442%0.419SS..Hα-helixtrans-56.2-45.7179.7-61.20000111.9K23 F31K23-T27 PolarHBondContact O-N 3.29Å; K23-T27 PolarHBondContact O-OG1 2.98Å; K23-T27 VanDerWaalsContact O-OG1 3.12Å; T27-F31 PolarHBondContact O-N 3.32Å; T27-F31 VanDerWaalsContact O-N 3.15Å
28K94.8Very high90Very high157 Ų15782.7 Ų82.768%0.68340%0.402SS*.Hα-helixtrans-70.4-40.5-179.5-68.4179.769.5166.40113.2V24 T25 F26 G32V24-K28 HydrophobicContact CG1-CD 4.12Å; V24-K28 WeakPolarHBondContact O-CG 3.49Å; V24-K28 PolarHBondContact O-N 3.39Å; T25-K28 PolarHBondContact O-N 3.04Å; F26-K28 VanDerWaalsContact C-N 3.33Å; F26-K28 PolarHBondContact O-N 2.95Å; K28-G32 PolarHBondContact O-N 2.94Å
29R97.3Very high92Very high137 Ų13778.1 Ų78.152%0.51738%0.38SS..Hα-helixtrans-70.3-41.3177-75-172.5174.9-166.4-4.2111.8T25 F26 F31 G32 L33T25-R29 HydrophobicContact CG2-CG 4.1Å; T25-R29 VanDerWaalsContact O-CB 3.3Å; T25-R29 WeakPolarHBondContact O-CB 3.46Å; T25-R29 WeakPolarHBondContact O-CG 3.4Å; T25-R29 PolarHBondContact O-N 3.35Å; F26-R29 PolarHBondContact O-N 3.48Å; R29-F31 PolarHBondContact O-N 3.44Å; R29-G32 PolarHBondContact O-N 2.87Å; R29-L33 WeakPolarHBondContact O-CB 3.31Å; R29-L33 PolarHBondContact O-N 2.64Å
30K97.8Very high93.8Very high45 Ų4578 Ų7820%0.19637%0.374CS..Hα-helixtrans-56.9-49.7175.7-169.7-173.477.871.10111.1F26 L33 M34 I52 F60F26-K30 HydrophobicContact CE1-CD 4.02Å; F26-K30 HydrophobicContact CZ-CD 4.05Å; F26-K30 WeakPolarHBondContact O-CB 3.32Å; F26-K30 PolarHBondContact O-N 3.48Å; K30-L33 PolarHBondContact O-N 2.59Å; K30-M34 HydrophobicContact CD-CE 4.15Å; K30-M34 HydrophobicContact CD-SD 4.45Å; K30-M34 HydrophobicContact CG-CE 3.91Å; K30-M34 HydrophobicContact CG-SD 3.94Å; K30-M34 PolarHBondContact NZ-SD 2.92Å; K30-M34 WeakPolarHBondContact O-CB 3.43Å; K30-M34 VanDerWaalsContact O-CG 3.28Å; K30-M34 WeakPolarHBondContact O-CG 3.29Å; K30-M34 PolarHBondContact O-N 3.08Å; K30-I52 HydrophobicContact CG-CD1 3.92Å; K30-F60 HydrophobicContact CD-CB 3.81Å; K30-F60 HydrophobicContact CD-CD1 4.01Å; K30-F60 HydrophobicContact CD-CG 3.88Å
31F98.3Very high95.1Very high147 Ų14778.1 Ų78.165%0.64538%0.375SS*.Hα-helixtrans-64.9-41.5177.1-175.1-99.7000112.5T27 R29 L33 M34 K35T27-F31 PolarHBondContact O-N 3.32Å; T27-F31 VanDerWaalsContact O-N 3.15Å; R29-F31 PolarHBondContact O-N 3.44Å; F31-L33 VanDerWaalsContact C-N 3.35Å; F31-L33 PolarHBondContact O-N 3.08Å; F31-M34 PolarHBondContact O-N 3.45Å; F31-K35 PolarHBondContact O-N 3.19Å
32G98.4Very high96.1Very high35 Ų3580.2 Ų80.236%0.36139%0.387SS..Hα-helixtrans-62.2-38.5175.700000113.7K28 R29 K36K28-G32 PolarHBondContact O-N 2.94Å; R29-G32 PolarHBondContact O-N 2.87Å; G32-K36 PolarHBondContact O-N 3.18Å; G32-K36 VanDerWaalsContact O-N 3.08Å
33L98.6Very high96.8Very high92 Ų9284 Ų8448%0.48241%0.411SS..Hα-helixtrans-69-45.2175.7-177.861.3000111.5R29 K30 F31 K35 K36 A37 L50 I52R29-L33 WeakPolarHBondContact O-CB 3.31Å; R29-L33 PolarHBondContact O-N 2.64Å; K30-L33 PolarHBondContact O-N 2.59Å; F31-L33 VanDerWaalsContact C-N 3.35Å; F31-L33 PolarHBondContact O-N 3.08Å; L33-K35 VanDerWaalsContact C-N 3.33Å; L33-K35 PolarHBondContact O-N 3.03Å; L33-K36 PolarHBondContact O-N 2.9Å; L33-K36 VanDerWaalsContact O-N 3.08Å; L33-A37 PolarHBondContact O-N 3.39Å; L33-L50 HydrophobicContact CD2-CD1 4.22Å; L33-L50 HydrophobicContact CD2-CD2 3.98Å; L33-L50 HydrophobicContact CG-CD2 3.89Å; L33-I52 HydrophobicContact CD2-CD1 4.34Å
34M98.6Very high97.2Very high25 Ų2582.1 Ų82.112%0.12341%0.413CS..Hα-helixtrans-59.6-41.1174.5-72.2167.3165.500111.9K30 F31 K36 A37 Y38 L50 Q61 Y62K30-M34 HydrophobicContact CD-CE 4.15Å; K30-M34 HydrophobicContact CD-SD 4.45Å; K30-M34 HydrophobicContact CG-CE 3.91Å; K30-M34 HydrophobicContact CG-SD 3.94Å; K30-M34 PolarHBondContact NZ-SD 2.92Å; K30-M34 WeakPolarHBondContact O-CB 3.43Å; K30-M34 VanDerWaalsContact O-CG 3.28Å; K30-M34 WeakPolarHBondContact O-CG 3.29Å; K30-M34 PolarHBondContact O-N 3.08Å; F31-M34 PolarHBondContact O-N 3.45Å; M34-K36 VanDerWaalsContact C-N 3.33Å; M34-K36 PolarHBondContact O-N 2.88Å; M34-A37 PolarHBondContact O-N 2.91Å; M34-Y38 PolarHBondContact O-N 3.24Å; M34-L50 HydrophobicContact CG-CD2 4.16Å; M34-Q61 WeakPolarHBondContact CE-O 3.23Å; M34-Y62 HydrophobicContact CG-CG 4.34Å
35K98.7Very high97.6Very high109 Ų10986.8 Ų86.847%0.47444%0.436SS..Hα-helixtrans-64-36.2173.6-168.1176.1-167.1-75.50112.3F31 L33 E39F31-K35 PolarHBondContact O-N 3.19Å; L33-K35 VanDerWaalsContact C-N 3.33Å; L33-K35 PolarHBondContact O-N 3.03Å; K35-E39 IonicContact NZ-OE1 2.72Å; K35-E39 PolarHBondContact NZ-OE1 3.03Å; K35-E39 WeakPolarHBondContact O-CB 3.48Å; K35-E39 VanDerWaalsContact O-CG 3.27Å; K35-E39 WeakPolarHBondContact O-CG 3.39Å; K35-E39 PolarHBondContact O-N 3.46Å
36K98.7Very high97.8Very high133 Ų13387.1 Ų87.158%0.57844%0.439SS*.Hα-helixtrans-72.4-35.2176.9-82.5-74.2166.1-1590113.3G32 L33 M34 E39 L40G32-K36 PolarHBondContact O-N 3.18Å; G32-K36 VanDerWaalsContact O-N 3.08Å; L33-K36 PolarHBondContact O-N 2.9Å; L33-K36 VanDerWaalsContact O-N 3.08Å; M34-K36 VanDerWaalsContact C-N 3.33Å; M34-K36 PolarHBondContact O-N 2.88Å; K36-E39 WeakPolarHBondContact CD-OE2 3.27Å; K36-E39 WeakPolarHBondContact CE-OE2 3.44Å; K36-E39 IonicContact NZ-OE2 2.71Å; K36-E39 PolarHBondContact NZ-OE2 3.48Å; K36-L40 WeakPolarHBondContact O-CB 3.25Å; K36-L40 PolarHBondContact O-N 3.49Å
37A98.7Very high98Very high11 Ų1189.3 Ų89.39%0.09145%0.45CS..Hα-helixtrans-62.2-48.7169.700000110.9L33 M34 E39 L40 S41 I48 Y62L33-A37 PolarHBondContact O-N 3.39Å; M34-A37 PolarHBondContact O-N 2.91Å; A37-E39 PolarHBondContact O-N 2.96Å; A37-L40 PolarHBondContact O-N 3.3Å; A37-S41 PolarHBondContact O-N 3.42Å; A37-S41 PolarHBondContact O-OG 2.99Å; A37-I48 HydrophobicContact CB-CG2 4.15Å; A37-Y62 HydrophobicContact CB-CD1 3.95Å; A37-Y62 HydrophobicContact CB-CE1 3.61Å
38Y98.6Very high98.2Very high131 Ų13186.7 Ų86.751%0.51443%0.432SS..Hα-helixtrans-56.6-49.6174.9171.9-100000112.9M34 L40 S41 V42 Y62M34-Y38 PolarHBondContact O-N 3.24Å; Y38-L40 VanDerWaalsContact C-N 3.29Å; Y38-L40 PolarHBondContact O-N 2.82Å; Y38-S41 WeakPolarHBondContact CA-OG 3.14Å; Y38-S41 PolarHBondContact O-N 2.93Å; Y38-S41 PolarHBondContact O-OG 2.95Å; Y38-V42 HydrophobicContact CD2-CG2 4.12Å; Y38-V42 HydrophobicContact CE1-CG2 4.43Å; Y38-V42 HydrophobicContact CE2-CG2 3.68Å; Y38-V42 WeakPolarHBondContact O-CG2 3.47Å; Y38-V42 PolarHBondContact O-N 3.44Å; Y38-V42 VanDerWaalsContact O-N 3.09Å; Y38-Y62 VanDerWaalsContact CA-OH 3.32Å; Y38-Y62 WeakPolarHBondContact CA-OH 3.38Å; Y38-Y62 WeakPolarHBondContact CB-OH 3.18Å
39E98.8Very high98.4Very high48 Ų4881 Ų8122%0.22441%0.414CS..Hα-helixtrans-57-42.4176.8-76.9168.4-167.100111.8K35 K36 A37 L43K35-E39 IonicContact NZ-OE1 2.72Å; K35-E39 PolarHBondContact NZ-OE1 3.03Å; K35-E39 WeakPolarHBondContact O-CB 3.48Å; K35-E39 VanDerWaalsContact O-CG 3.27Å; K35-E39 WeakPolarHBondContact O-CG 3.39Å; K35-E39 PolarHBondContact O-N 3.46Å; K36-E39 WeakPolarHBondContact CD-OE2 3.27Å; K36-E39 WeakPolarHBondContact CE-OE2 3.44Å; K36-E39 IonicContact NZ-OE2 2.71Å; K36-E39 PolarHBondContact NZ-OE2 3.48Å; A37-E39 PolarHBondContact O-N 2.96Å; E39-L43 VanDerWaalsContact O-CB 3.27Å; E39-L43 WeakPolarHBondContact O-CB 3.27Å; E39-L43 WeakPolarHBondContact O-CD1 3.24Å; E39-L43 WeakPolarHBondContact O-CG 3.19Å; E39-L43 PolarHBondContact O-N 3.11Å; E39-L43 VanDerWaalsContact O-N 3.07Å
40L98.7Very high98.4Very high91 Ų9176.1 Ų76.148%0.47640%0.398SS..Hα-helixtrans-67.4-47177.8-176.861.1000112.1K36 A37 Y38 V42 L43 C44 I48K36-L40 WeakPolarHBondContact O-CB 3.25Å; K36-L40 PolarHBondContact O-N 3.49Å; A37-L40 PolarHBondContact O-N 3.3Å; Y38-L40 VanDerWaalsContact C-N 3.29Å; Y38-L40 PolarHBondContact O-N 2.82Å; L40-V42 VanDerWaalsContact C-N 3.27Å; L40-V42 PolarHBondContact O-N 2.71Å; L40-L43 PolarHBondContact O-N 3.47Å; L40-C44 HydrophobicContact CD1-CB 4.34Å; L40-C44 PolarHBondContact O-N 3.05Å; L40-I48 HydrophobicContact CB-CD1 4.03Å; L40-I48 HydrophobicContact CD2-CD1 3.93Å; L40-I48 HydrophobicContact CG-CD1 4.01Å
41S98.3Very high98.4Very high10 Ų1077.9 Ų77.97%0.0741%0.409CS..Hα-helixtrans-60.3-35.4-179.653.10000113.2A37 Y38 D45 C46 S64A37-S41 PolarHBondContact O-N 3.42Å; A37-S41 PolarHBondContact O-OG 2.99Å; Y38-S41 WeakPolarHBondContact CA-OG 3.14Å; Y38-S41 PolarHBondContact O-N 2.93Å; Y38-S41 PolarHBondContact O-OG 2.95Å; S41-D45 WeakPolarHBondContact O-CA 3.43Å; S41-D45 PolarHBondContact O-N 3.23Å; S41-C46 WeakPolarHBondContact CA-O 3.32Å; S41-C46 WeakPolarHBondContact CB-O 3.39Å; S41-C46 PolarHBondContact O-N 3.24Å; S41-S64 VanDerWaalsContact CB-CB 3.42Å; S41-S64 WeakPolarHBondContact OG-CB 3.38Å
42V98.4Very high98.4Very high94 Ų9472.2 Ų72.257%0.5739%0.385SS*.Hα-helixtrans-81.6-34179.2175.70000112.3Y38 L40Y38-V42 HydrophobicContact CD2-CG2 4.12Å; Y38-V42 HydrophobicContact CE1-CG2 4.43Å; Y38-V42 HydrophobicContact CE2-CG2 3.68Å; Y38-V42 WeakPolarHBondContact O-CG2 3.47Å; Y38-V42 PolarHBondContact O-N 3.44Å; Y38-V42 VanDerWaalsContact O-N 3.09Å; L40-V42 VanDerWaalsContact C-N 3.27Å; L40-V42 PolarHBondContact O-N 2.71Å
43L98.7Very high98.4Very high145 Ų14576.9 Ų76.976%0.75940%0.396SS*.Hα-helixtrans-79.9-22.6-179-72.1171.3000113.8E39 L40E39-L43 VanDerWaalsContact O-CB 3.27Å; E39-L43 WeakPolarHBondContact O-CB 3.27Å; E39-L43 WeakPolarHBondContact O-CD1 3.24Å; E39-L43 WeakPolarHBondContact O-CG 3.19Å; E39-L43 PolarHBondContact O-N 3.11Å; E39-L43 VanDerWaalsContact O-N 3.07Å; L40-L43 PolarHBondContact O-N 3.47Å
44C98.6Very high98.2Very high84 Ų8473.5 Ų73.557%0.56838%0.378SS*.THydrogen-bonded Turntrans-125.911.7-174.2-60.40000113.8L40 C46L40-C44 HydrophobicContact CD1-CB 4.34Å; L40-C44 PolarHBondContact O-N 3.05Å; C44-C46 PolarHBondContact O-N 3.26Å
45D98Very high97.8Very high160 Ų16075.9 Ų75.986%0.85640%0.397SS*.THydrogen-bonded Turntrans44.657-178.6-162.325.2000113.3S41S41-D45 WeakPolarHBondContact O-CA 3.43Å; S41-D45 PolarHBondContact O-N 3.23Å
46C97.8Very high97.6Very high45 Ų4575 Ų7530%0.30440%0.401SS..  trans-129.4140.6-172.366.80000114.4S41 C44 S64S41-C46 WeakPolarHBondContact CA-O 3.32Å; S41-C46 WeakPolarHBondContact CB-O 3.39Å; S41-C46 PolarHBondContact O-N 3.24Å; C44-C46 PolarHBondContact O-N 3.26Å; C46-S64 PolarHBondContact O-OG 3.46Å
47E97.9Very high97.4Very high89 Ų8975.3 Ų75.342%0.41641%0.409SS..  trans-80.3125178.2-64.1-171.8113.400110.6T65 V70 K73E47-T65 PolarHBondContact OE1-OG1 2.81Å; E47-V70 HydrophobicContact CB-CG2 4.05Å; E47-K73 IonicContact OE2-NZ 2.64Å; E47-K73 PolarHBondContact OE2-NZ 2.69Å
48I98.3Very high97.3Very high33 Ų3382.4 Ų82.417%0.16943%0.433CS..  trans-132.5121.2-176.4-58.2177000109A37 L40 A63 S64A37-I48 HydrophobicContact CB-CG2 4.15Å; L40-I48 HydrophobicContact CB-CD1 4.03Å; L40-I48 HydrophobicContact CD2-CD1 3.93Å; L40-I48 HydrophobicContact CG-CD1 4.01Å; I48-A63 CarbonylContact O-C 3.52Å; I48-A63 VanDerWaalsContact O-CA 3.27Å; I48-A63 WeakPolarHBondContact O-CA 3.48Å; I48-S64 PolarHBondContact N-OG 3.31Å; I48-S64 PolarHBondContact O-N 3.29Å
49A98.4Very high97.3Very high37 Ų3780 Ų8031%0.30643%0.429SS..EExtended strand (participates in β ladder)trans-103.2143.3163.500000110.5M67 V70A49-M67 HydrophobicContact CB-CE 4.33Å; A49-M67 HydrophobicContact CB-SD 3.97Å; A49-V70 HydrophobicContact CB-CB 4.15Å; A49-V70 HydrophobicContact CB-CG1 3.6Å
50L98.5Very high97.3Very high34 Ų3480.2 Ų80.218%0.17843%0.429CS..EExtended strand (participates in β ladder)trans-139.1117.1179173.862.4000109.8L33 M34 I52 Q61 Y62L33-L50 HydrophobicContact CD2-CD1 4.22Å; L33-L50 HydrophobicContact CD2-CD2 3.98Å; L33-L50 HydrophobicContact CG-CD2 3.89Å; M34-L50 HydrophobicContact CG-CD2 4.16Å; L50-I52 HydrophobicContact CD1-CD1 4.32Å; L50-I52 HydrophobicContact CD1-CG1 4.12Å; L50-I52 HydrophobicContact CD2-CD1 4.16Å; L50-I52 HydrophobicContact CG-CD1 4.15Å; L50-I52 HydrophobicContact CG-CG1 4.19Å; L50-Q61 CarbonylContact O-C 3.53Å; L50-Q61 VanDerWaalsContact O-CA 3.28Å; L50-Q61 WeakPolarHBondContact O-CA 3.36Å; L50-Y62 HydrophobicContact CB-CD1 4.36Å; L50-Y62 PolarHBondContact N-O 2.86Å; L50-Y62 PolarHBondContact O-N 3.2Å
51I98.4Very high97.2Very high82 Ų8280.7 Ų80.742%0.42143%0.429SS..EExtended strand (participates in β ladder)trans-112.8129.3179.4-67.2174.5000109F53 L59 M67 L71I51-F53 HydrophobicContact CG2-CD2 4.01Å; I51-F53 HydrophobicContact CG2-CE2 3.56Å; I51-F53 HydrophobicContact CG2-CZ 4.29Å; I51-L59 HydrophobicContact CG2-CD1 3.8Å; I51-M67 HydrophobicContact CD1-SD 4.45Å; I51-M67 HydrophobicContact CG1-SD 4.37Å; I51-L71 HydrophobicContact CD1-CD2 4.23Å
52I98.4Very high97.3Very high29 Ų2982.3 Ų82.315%0.14943%0.434CS..EExtended strand (participates in β ladder)trans-133.8110-179.7-57.7171.2000109.2F26 K30 L33 L50 F60F26-I52 HydrophobicContact CE2-CG2 3.95Å; F26-I52 HydrophobicContact CZ-CG2 4.1Å; K30-I52 HydrophobicContact CG-CD1 3.92Å; L33-I52 HydrophobicContact CD2-CD1 4.34Å; L50-I52 HydrophobicContact CD1-CD1 4.32Å; L50-I52 HydrophobicContact CD1-CG1 4.12Å; L50-I52 HydrophobicContact CD2-CD1 4.16Å; L50-I52 HydrophobicContact CG-CD1 4.15Å; L50-I52 HydrophobicContact CG-CG1 4.19Å; I52-F60 HydrophobicContact CB-CB 4.46Å; I52-F60 PolarHBondContact N-O 2.72Å; I52-F60 PolarHBondContact O-N 2.71Å
53F97.9Very high97.3Very high133 Ų13378.9 Ų78.958%0.58342%0.416SS*.EExtended strand (participates in β ladder)trans-88.9137.5163.4-65.1-82.1000110I51 L59I51-F53 HydrophobicContact CG2-CD2 4.01Å; I51-F53 HydrophobicContact CG2-CE2 3.56Å; I51-F53 HydrophobicContact CG2-CZ 4.29Å; F53-L59 HydrophobicContact CD1-CB 4.25Å; F53-L59 HydrophobicContact CD1-CD1 4.48Å; F53-L59 HydrophobicContact CE1-CB 3.89Å; F53-L59 HydrophobicContact CE1-CD1 4Å; F53-L59 HydrophobicContact CE1-CG 4.44Å; F53-L59 HydrophobicContact CE2-CD1 4.37Å; F53-L59 HydrophobicContact CZ-CD1 3.94Å
54N94.1Very high97.2Very high21 Ų2173.8 Ų73.811%0.11239%0.392CS..  trans-91.9176.7170.382.6-16.4000111.4W22 F26 T56 N57 R58 F60W22-N54 HydrophobicContact CH2-CB 4.24Å; F26-N54 HydrophobicContact CE2-CB 4.3Å; F26-N54 HydrophobicContact CZ-CB 4.04Å; N54-T56 PolarHBondContact ND2-OG1 2.97Å; N54-T56 PolarHBondContact O-N 3.39Å; N54-T56 VanDerWaalsContact OD1-C 3.29Å; N54-T56 WeakPolarHBondContact OD1-CA 3.49Å; N54-T56 PolarHBondContact OD1-N 3.48Å; N54-T56 PolarHBondContact OD1-OG1 3.46Å; N54-N57 PolarHBondContact O-N 3.4Å; N54-N57 PolarHBondContact OD1-N 2.86Å; N54-R58 PolarHBondContact N-O 3.15Å; N54-R58 VanDerWaalsContact N-O 3.14Å; N54-R58 WeakPolarHBondContact OD1-CB 3.44Å; N54-R58 PolarHBondContact OD1-N 2.83Å; N54-F60 HydrophobicContact CB-CE2 4.14Å
55S91Very high97.1Very high75 Ų7574 Ų7452%0.52439%0.391SS..THydrogen-bonded Turntrans-69.76.8178.265.40000115.5
56T93.3Very high97.1Very high90 Ų9068.9 Ų68.955%0.55236%0.364SS*.THydrogen-bonded Turntrans-119.525.4169.765.90000110.3N54 R58N54-T56 PolarHBondContact ND2-OG1 2.97Å; N54-T56 PolarHBondContact O-N 3.39Å; N54-T56 VanDerWaalsContact OD1-C 3.29Å; N54-T56 WeakPolarHBondContact OD1-CA 3.49Å; N54-T56 PolarHBondContact OD1-N 3.48Å; N54-T56 PolarHBondContact OD1-OG1 3.46Å; T56-R58 PolarHBondContact O-N 2.87Å
57N95.1Very high97.1Very high140 Ų14067.5 Ų67.575%0.74935%0.353SS*.  trans50.323.6-178.5-60.1-11.9000115.3N54 L59N54-N57 PolarHBondContact O-N 3.4Å; N54-N57 PolarHBondContact OD1-N 2.86Å; N57-L59 PolarHBondContact O-N 3.49Å
58R96.6Very high97.1Very high160 Ų16069 Ų6960%0.60436%0.364SS*.  trans-80.2121.9173.5-67.3-176.263.5-176.60.2109.4N54 T56 F60N54-R58 PolarHBondContact N-O 3.15Å; N54-R58 VanDerWaalsContact N-O 3.14Å; N54-R58 WeakPolarHBondContact OD1-CB 3.44Å; N54-R58 PolarHBondContact OD1-N 2.83Å; T56-R58 PolarHBondContact O-N 2.87Å; R58-F60 HydrophobicContact CB-CE2 3.96Å; R58-F60 HydrophobicContact CB-CZ 4.37Å; R58-F60 WeakPolarHBondContact O-CD2 3.39Å; R58-F60 WeakPolarHBondContact O-CE2 3.28Å
59L97.9Very high97.1Very high81 Ų8173.8 Ų73.842%0.42438%0.383SS..EExtended strand (participates in β ladder)trans-69.1137.1171.8178.158.6000111.1I51 F53 N57 Q61I51-L59 HydrophobicContact CG2-CD1 3.8Å; F53-L59 HydrophobicContact CD1-CB 4.25Å; F53-L59 HydrophobicContact CD1-CD1 4.48Å; F53-L59 HydrophobicContact CE1-CB 3.89Å; F53-L59 HydrophobicContact CE1-CD1 4Å; F53-L59 HydrophobicContact CE1-CG 4.44Å; F53-L59 HydrophobicContact CE2-CD1 4.37Å; F53-L59 HydrophobicContact CZ-CD1 3.94Å; N57-L59 PolarHBondContact O-N 3.49Å; L59-Q61 HydrophobicContact CD1-CB 4.42Å
60F98.3Very high97Very high51 Ų5172.9 Ų72.922%0.22437%0.374CS..EExtended strand (participates in β ladder)trans-133.9128.1161.6-55.7-95.6000107.4F26 K30 I52 N54 R58F26-F60 HydrophobicContact CE1-CD2 4.09Å; F26-F60 AromaticContact CE1-CE2 3.74Å; F26-F60 HydrophobicContact CE1-CE2 3.74Å; F26-F60 AromaticContact CE1-CZ 3.98Å; F26-F60 HydrophobicContact CE1-CZ 3.98Å; F26-F60 AromaticContact CZ-CD2 3.79Å; F26-F60 HydrophobicContact CZ-CD2 3.79Å; F26-F60 AromaticContact CZ-CE2 3.78Å; F26-F60 HydrophobicContact CZ-CE2 3.78Å; F26-F60 HydrophobicContact CZ-CG 4.5Å; F26-F60 HydrophobicContact CZ-CZ 4.46Å; K30-F60 HydrophobicContact CD-CB 3.81Å; K30-F60 HydrophobicContact CD-CD1 4.01Å; K30-F60 HydrophobicContact CD-CG 3.88Å; I52-F60 HydrophobicContact CB-CB 4.46Å; I52-F60 PolarHBondContact N-O 2.72Å; I52-F60 PolarHBondContact O-N 2.71Å; N54-F60 HydrophobicContact CB-CE2 4.14Å; R58-F60 HydrophobicContact CB-CE2 3.96Å; R58-F60 HydrophobicContact CB-CZ 4.37Å; R58-F60 WeakPolarHBondContact O-CD2 3.39Å; R58-F60 WeakPolarHBondContact O-CE2 3.28Å
61Q98.3Very high97Very high101 Ų10174.5 Ų74.547%0.47238%0.383SS..EExtended strand (participates in β ladder)trans-126.8163.4-175.582.3-16452.100112.7M34 L50 L59 M67M34-Q61 WeakPolarHBondContact CE-O 3.23Å; L50-Q61 CarbonylContact O-C 3.53Å; L50-Q61 VanDerWaalsContact O-CA 3.28Å; L50-Q61 WeakPolarHBondContact O-CA 3.36Å; L59-Q61 HydrophobicContact CD1-CB 4.42Å; Q61-M67 HydrophobicContact CB-CE 3.73Å; Q61-M67 HydrophobicContact CG-CE 3.89Å
62Y98.6Very high96.9Very high44 Ų4475.5 Ų75.517%0.17339%0.388CS..EExtended strand (participates in β ladder)trans-150.5140.6169.4165.9-94.4000109M34 A37 Y38 L50 S64 M67M34-Y62 HydrophobicContact CG-CG 4.34Å; A37-Y62 HydrophobicContact CB-CD1 3.95Å; A37-Y62 HydrophobicContact CB-CE1 3.61Å; Y38-Y62 VanDerWaalsContact CA-OH 3.32Å; Y38-Y62 WeakPolarHBondContact CA-OH 3.38Å; Y38-Y62 WeakPolarHBondContact CB-OH 3.18Å; L50-Y62 HydrophobicContact CB-CD1 4.36Å; L50-Y62 PolarHBondContact N-O 2.86Å; L50-Y62 PolarHBondContact O-N 3.2Å; Y62-S64 WeakPolarHBondContact OH-CA 3.28Å; Y62-M67 WeakPolarHBondContact O-CE 3.42Å
63A98.4Very high96.8Very high23 Ų2378 Ų7819%0.1940%0.398CS..EExtended strand (participates in β ladder)trans-128.6150.5164.900000108.8I48 M67I48-A63 CarbonylContact O-C 3.52Å; I48-A63 VanDerWaalsContact O-CA 3.27Å; I48-A63 WeakPolarHBondContact O-CA 3.48Å; A63-M67 HydrophobicContact CB-CB 4.37Å; A63-M67 HydrophobicContact CB-CE 4.14Å
64S97.9Very high96.8Very high37 Ų3779.7 Ų79.726%0.25940%0.402SS..SBendtrans-74.6-31.5170.955.80000112.9S41 C46 I48 Y62S41-S64 VanDerWaalsContact CB-CB 3.42Å; S41-S64 WeakPolarHBondContact OG-CB 3.38Å; C46-S64 PolarHBondContact O-OG 3.46Å; I48-S64 PolarHBondContact N-OG 3.31Å; I48-S64 PolarHBondContact O-N 3.29Å; Y62-S64 WeakPolarHBondContact OH-CA 3.28Å
65T96.8Very high96.8Very high89 Ų8983.6 Ų83.655%0.54643%0.427SS..SBendtrans-116.1-74.4176.150.70000111.2E47E47-T65 PolarHBondContact OE1-OG1 2.81Å
66D97.3Very high97Very high53 Ų5386.4 Ų86.428%0.28343%0.431SS..  trans-152.9133.7-171.4-173.7-42.9000108.5D68 K69 V70D66-D68 PolarHBondContact OD1-N 3.45Å; D66-K69 HydrophobicContact CB-CB 4.06Å; D66-K69 HydrophobicContact CB-CD 3.74Å; D66-K69 HydrophobicContact CB-CG 3.91Å; D66-K69 PolarHBondContact OD1-N 3.12Å; D66-K69 WeakPolarHBondContact OD2-CE 3.35Å; D66-K69 IonicContact OD2-NZ 3.12Å; D66-K69 PolarHBondContact OD2-NZ 2.9Å; D66-K69 VanDerWaalsContact OD2-NZ 3.12Å; D66-V70 WeakPolarHBondContact O-CG2 3.41Å; D66-V70 PolarHBondContact O-N 3.36Å
67M98.2Very high97Very high16 Ų1689.7 Ų89.78%0.07944%0.435CS..Hα-helixtrans-68.7-44.5-175.6-178.761.559.300111.4A49 I51 Q61 Y62 A63 K69 V70 L71A49-M67 HydrophobicContact CB-CE 4.33Å; A49-M67 HydrophobicContact CB-SD 3.97Å; I51-M67 HydrophobicContact CD1-SD 4.45Å; I51-M67 HydrophobicContact CG1-SD 4.37Å; Q61-M67 HydrophobicContact CB-CE 3.73Å; Q61-M67 HydrophobicContact CG-CE 3.89Å; Y62-M67 WeakPolarHBondContact O-CE 3.42Å; A63-M67 HydrophobicContact CB-CB 4.37Å; A63-M67 HydrophobicContact CB-CE 4.14Å; M67-K69 VanDerWaalsContact C-N 3.34Å; M67-K69 PolarHBondContact O-N 2.97Å; M67-V70 PolarHBondContact O-N 3.42Å; M67-L71 HydrophobicContact CG-CD1 3.77Å; M67-L71 HydrophobicContact CG-CG 4.31Å; M67-L71 WeakPolarHBondContact O-CB 3.39Å; M67-L71 VanDerWaalsContact O-CG 3.31Å; M67-L71 WeakPolarHBondContact O-CG 3.3Å; M67-L71 PolarHBondContact O-N 3.02Å; M67-L71 HydrophobicContact SD-CD1 3.83Å; M67-L71 HydrophobicContact SD-CG 3.97Å
68D97.7Very high96.3Very high121 Ų12188.9 Ų88.965%0.64744%0.44SS*.Hα-helixtrans-74.9-32.2-169.5-59.8-22.4000110D66 L72D66-D68 PolarHBondContact OD1-N 3.45Å; D68-L72 VanDerWaalsContact O-CB 3.23Å; D68-L72 WeakPolarHBondContact O-CB 3.47Å; D68-L72 PolarHBondContact O-N 2.79Å
69K97.5Very high96.1Very high132 Ų13288.8 Ų88.857%0.57445%0.447SS*.Hα-helixtrans-66.1-45.2172.1-61.3-180-168.8151.70112.6D66 M67 L71 L72 K73D66-K69 HydrophobicContact CB-CB 4.06Å; D66-K69 HydrophobicContact CB-CD 3.74Å; D66-K69 HydrophobicContact CB-CG 3.91Å; D66-K69 PolarHBondContact OD1-N 3.12Å; D66-K69 WeakPolarHBondContact OD2-CE 3.35Å; D66-K69 IonicContact OD2-NZ 3.12Å; D66-K69 PolarHBondContact OD2-NZ 2.9Å; D66-K69 VanDerWaalsContact OD2-NZ 3.12Å; M67-K69 VanDerWaalsContact C-N 3.34Å; M67-K69 PolarHBondContact O-N 2.97Å; K69-L71 VanDerWaalsContact C-N 3.34Å; K69-L72 PolarHBondContact O-N 3.14Å; K69-K73 VanDerWaalsContact O-CB 3.29Å; K69-K73 WeakPolarHBondContact O-CB 3.43Å; K69-K73 PolarHBondContact O-N 2.98Å
70V97.7Very high95.9Very high19 Ų1988.8 Ų88.812%0.11545%0.451CS..Hα-helixtrans-70.7-32.9-179.9178.90000111.2E47 A49 D66 M67 Y74E47-V70 HydrophobicContact CB-CG2 4.05Å; A49-V70 HydrophobicContact CB-CB 4.15Å; A49-V70 HydrophobicContact CB-CG1 3.6Å; D66-V70 WeakPolarHBondContact O-CG2 3.41Å; D66-V70 PolarHBondContact O-N 3.36Å; M67-V70 PolarHBondContact O-N 3.42Å; V70-Y74 WeakPolarHBondContact O-CB 3.28Å; V70-Y74 PolarHBondContact O-N 2.87Å
71L97.4Very high95.7Very high68 Ų6896 Ų9636%0.35649%0.485SS..Hα-helixtrans-71.2-41.1172.7-70.5177000112.9I51 M67 K69 Y74 T75I51-L71 HydrophobicContact CD1-CD2 4.23Å; M67-L71 HydrophobicContact CG-CD1 3.77Å; M67-L71 HydrophobicContact CG-CG 4.31Å; M67-L71 WeakPolarHBondContact O-CB 3.39Å; M67-L71 VanDerWaalsContact O-CG 3.31Å; M67-L71 WeakPolarHBondContact O-CG 3.3Å; M67-L71 PolarHBondContact O-N 3.02Å; M67-L71 HydrophobicContact SD-CD1 3.83Å; M67-L71 HydrophobicContact SD-CG 3.97Å; K69-L71 VanDerWaalsContact C-N 3.34Å; L71-Y74 WeakPolarHBondContact O-CB 3.17Å; L71-Y74 PolarHBondContact O-N 3.25Å; L71-T75 PolarHBondContact O-N 3Å; L71-T75 PolarHBondContact O-OG1 2.97Å
72L97Very high95.5Very high102 Ų10297.1 Ų97.153%0.53449%0.491SS..Hα-helixtrans-59.9-50.6173.8178.661.8000110.5D68 K69 Y74 T75 E76D68-L72 VanDerWaalsContact O-CB 3.23Å; D68-L72 WeakPolarHBondContact O-CB 3.47Å; D68-L72 PolarHBondContact O-N 2.79Å; K69-L72 PolarHBondContact O-N 3.14Å; L72-Y74 VanDerWaalsContact C-N 3.27Å; L72-Y74 PolarHBondContact O-N 3.4Å; L72-T75 WeakPolarHBondContact O-CA 3.35Å; L72-T75 PolarHBondContact O-N 3.25Å; L72-T75 PolarHBondContact O-OG1 3.27Å; L72-E76 WeakPolarHBondContact O-CG 3.3Å; L72-E76 PolarHBondContact O-N 2.97Å; L72-E76 VanDerWaalsContact O-N 3.11Å
73K96.3Very high95.3Very high83 Ų8399 Ų9936%0.36151%0.51SS..Hα-helixtrans-55.8-40.7173.9-168.7-175.6-168.8-176.50112E47 K69 T75 E76 Y77E47-K73 IonicContact OE2-NZ 2.64Å; E47-K73 PolarHBondContact OE2-NZ 2.69Å; K69-K73 VanDerWaalsContact O-CB 3.29Å; K69-K73 WeakPolarHBondContact O-CB 3.43Å; K69-K73 PolarHBondContact O-N 2.98Å; K73-T75 VanDerWaalsContact C-N 3.32Å; K73-T75 PolarHBondContact O-N 2.93Å; K73-E76 PolarHBondContact O-N 2.97Å; K73-Y77 HydrophobicContact CG-CE2 4.13Å; K73-Y77 VanDerWaalsContact O-CD2 3.24Å; K73-Y77 WeakPolarHBondContact O-CD2 3.29Å
74Y96.4Very high95.2Very high167 Ų167104.7 Ų104.766%0.65553%0.526SS*.Hα-helixtrans-61.8-37.9174.5174.8-92000112.4V70 L71 L72 E76 Y77V70-Y74 WeakPolarHBondContact O-CB 3.28Å; V70-Y74 PolarHBondContact O-N 2.87Å; L71-Y74 WeakPolarHBondContact O-CB 3.17Å; L71-Y74 PolarHBondContact O-N 3.25Å; L72-Y74 VanDerWaalsContact C-N 3.27Å; L72-Y74 PolarHBondContact O-N 3.4Å; Y74-E76 VanDerWaalsContact C-N 3.32Å; Y74-E76 PolarHBondContact O-N 3.31Å; Y74-Y77 PolarHBondContact O-N 2.78Å
75T95.7Very high95.2Very high104 Ų104106.2 Ų106.264%0.63854%0.535SS*.Hα-helixtrans-75-16176.5550000114.9L71 L72 K73L71-T75 PolarHBondContact O-N 3Å; L71-T75 PolarHBondContact O-OG1 2.97Å; L72-T75 WeakPolarHBondContact O-CA 3.35Å; L72-T75 PolarHBondContact O-N 3.25Å; L72-T75 PolarHBondContact O-OG1 3.27Å; K73-T75 VanDerWaalsContact C-N 3.32Å; K73-T75 PolarHBondContact O-N 2.93Å
76E95.3Very high95.1Very high133 Ų133108.8 Ų108.862%0.62155%0.545SS*.Hα-helixtrans-79.8-20.1175-69.5167.8177.600112.8L72 K73 Y74L72-E76 WeakPolarHBondContact O-CG 3.3Å; L72-E76 PolarHBondContact O-N 2.97Å; L72-E76 VanDerWaalsContact O-N 3.11Å; K73-E76 PolarHBondContact O-N 2.97Å; Y74-E76 VanDerWaalsContact C-N 3.32Å; Y74-E76 PolarHBondContact O-N 3.31Å
77Y92.1Very high95.1Very high160 Ų160111 Ų11163%0.62756%0.56SS**  trans-94.8123.9179.1-78.9-115.8000110.6K73 Y74K73-Y77 HydrophobicContact CG-CE2 4.13Å; K73-Y77 VanDerWaalsContact O-CD2 3.24Å; K73-Y77 WeakPolarHBondContact O-CD2 3.29Å; Y74-Y77 PolarHBondContact O-N 2.78Å
78S81.8Confident95Very high123 Ų123112.7 Ų112.786%0.8657%0.57SS**SBendtrans-70.7-34.4-178.456.40000113.9
79E91.6Very high94.8Very high158 Ų158111.4 Ų111.474%0.73856%0.562SS**SBendtrans-142.5138.2-176.7-62.8-173.4144.300111
80P93.4Very high94.6Very high81 Ų81110.1 Ų110.153%0.52656%0.561SS.*  trans-79.6136.8175.632.2-34.3000111.6E82P80-E82 VanDerWaalsContact C-N 3.31Å; P80-E82 PolarHBondContact O-N 3.11Å
81H93.4Very high94.4Very high202 Ų202113.5 Ų113.594%0.93558%0.575SS**SBendtrans-62-35.6178-179.565.5000113.5
82E95.4Very high94Very high125 Ų125114.5 Ų114.558%0.58458%0.578SS**SBendtrans-134.7133.2167.5-177.5174.1-16200108.8P80 R84P80-E82 VanDerWaalsContact C-N 3.31Å; P80-E82 PolarHBondContact O-N 3.11Å; E82-R84 HydrophobicContact CG-CG 4.19Å; E82-R84 IonicContact OE1-CZ 3.14Å; E82-R84 IonicContact OE1-NE 2.68Å; E82-R84 PolarHBondContact OE1-NE 3.22Å; E82-R84 IonicContact OE1-NH2 2.75Å; E82-R84 PolarHBondContact OE1-NH2 2.67Å
83S94.6Very high93.6Very high83 Ų83113.5 Ų113.558%0.5858%0.577SS**  trans-122.9138.9171.9-173.50000109.5
84R95.9Very high93.1Very high142 Ų142114.7 Ų114.754%0.53659%0.586SS.*  trans-142.1136.1-178.7-65.6-64.2-179.2-159.8-7.6110.9E82E82-R84 HydrophobicContact CG-CG 4.19Å; E82-R84 IonicContact OE1-CZ 3.14Å; E82-R84 IonicContact OE1-NE 2.68Å; E82-R84 PolarHBondContact OE1-NE 3.22Å; E82-R84 IonicContact OE1-NH2 2.75Å; E82-R84 PolarHBondContact OE1-NH2 2.67Å
85T97.5Very high92.6Very high70 Ų70114.5 Ų114.543%0.42958%0.584SS.*  trans-119.4179.9176.977.80000110.9T87 D88 I89T85-T87 PolarHBondContact O-N 3.21Å; T85-T87 PolarHBondContact OG1-N 3.03Å; T85-T87 PolarHBondContact OG1-OG1 3.43Å; T85-D88 WeakPolarHBondContact CA-OD2 2.94Å; T85-D88 WeakPolarHBondContact CB-OD2 2.86Å; T85-D88 PolarHBondContact N-OD2 2.98Å; T85-D88 PolarHBondContact O-N 3.04Å; T85-D88 PolarHBondContact OG1-OD2 2.69Å; T85-I89 WeakPolarHBondContact O-CG1 3.38Å; T85-I89 PolarHBondContact O-N 3.33Å
86N95.8Very high91.9Very high143 Ų143118.8 Ų118.877%0.76559%0.589SS**Hα-helixtrans-63.4-27.2177.7-69.3-40.4000113.3L90N86-L90 VanDerWaalsContact O-CB 3.29Å; N86-L90 WeakPolarHBondContact O-CB 3.31Å; N86-L90 PolarHBondContact O-N 3.2Å; N86-L90 VanDerWaalsContact O-N 3.13Å
87T96.3Very high91.1Very high99 Ų99120.8 Ų120.861%0.60760%0.595SS**Hα-helixtrans-73.1-44.7177.343.60000111.2T85 I89 L90 E91T85-T87 PolarHBondContact O-N 3.21Å; T85-T87 PolarHBondContact OG1-N 3.03Å; T85-T87 PolarHBondContact OG1-OG1 3.43Å; T87-I89 VanDerWaalsContact C-N 3.31Å; T87-I89 PolarHBondContact O-N 3.13Å; T87-L90 PolarHBondContact O-N 2.89Å; T87-E91 WeakPolarHBondContact O-CB 3.45Å; T87-E91 PolarHBondContact O-N 3.5Å
88D95.2Very high89.5Confident51 Ų51116 Ų11627%0.27359%0.594SS.*Hα-helixtrans-59.1-43.6177.8-50.1-86.9000111.8T85 E91 Q92T85-D88 WeakPolarHBondContact CA-OD2 2.94Å; T85-D88 WeakPolarHBondContact CB-OD2 2.86Å; T85-D88 PolarHBondContact N-OD2 2.98Å; T85-D88 PolarHBondContact O-N 3.04Å; T85-D88 PolarHBondContact OG1-OD2 2.69Å; D88-E91 PolarHBondContact O-N 2.83Å; D88-Q92 VanDerWaalsContact O-CB 3.28Å; D88-Q92 WeakPolarHBondContact O-CB 3.29Å; D88-Q92 PolarHBondContact O-N 3.13Å
89I94.7Very high88.1Confident94 Ų94118.6 Ų118.648%0.48259%0.593SS.*Hα-helixtrans-67.3-40.5179.6-64.4166.7000110.6T85 T87 T93T85-I89 WeakPolarHBondContact O-CG1 3.38Å; T85-I89 PolarHBondContact O-N 3.33Å; T87-I89 VanDerWaalsContact C-N 3.31Å; T87-I89 PolarHBondContact O-N 3.13Å; I89-T93 VanDerWaalsContact O-CB 3.29Å; I89-T93 WeakPolarHBondContact O-CB 3.42Å; I89-T93 PolarHBondContact O-N 3.28Å; I89-T93 PolarHBondContact O-OG1 2.91Å
90L93.2Very high86.3Confident105 Ų105114 Ų11455%0.5559%0.587SS.*Hα-helixtrans-66.3-46.9176.3178.760.2000111.2N86 T87 T93 L94N86-L90 VanDerWaalsContact O-CB 3.29Å; N86-L90 WeakPolarHBondContact O-CB 3.31Å; N86-L90 PolarHBondContact O-N 3.2Å; N86-L90 VanDerWaalsContact O-N 3.13Å; T87-L90 PolarHBondContact O-N 2.89Å; L90-T93 WeakPolarHBondContact O-CB 3.28Å; L90-T93 PolarHBondContact O-N 3.37Å; L90-L94 HydrophobicContact CD1-CD1 4.22Å; L90-L94 HydrophobicContact CD1-CG 4.35Å; L90-L94 HydrophobicContact CG-CD1 4.08Å; L90-L94 WeakPolarHBondContact O-CG 3.34Å; L90-L94 PolarHBondContact O-N 3.37Å
91E92.8Very high84.4Confident90 Ų90118.6 Ų118.642%0.42161%0.607SS.*Hα-helixtrans-63.9-46.4179.9-165.7-167.6147.800111.5T87 D88 T93 L94 R95T87-E91 WeakPolarHBondContact O-CB 3.45Å; T87-E91 PolarHBondContact O-N 3.5Å; D88-E91 PolarHBondContact O-N 2.83Å; E91-T93 VanDerWaalsContact C-N 3.25Å; E91-T93 PolarHBondContact O-N 2.62Å; E91-L94 PolarHBondContact O-N 3.04Å; E91-L94 VanDerWaalsContact O-N 3.12Å; E91-R95 WeakPolarHBondContact O-CG 3.4Å; E91-R95 PolarHBondContact O-N 2.83Å; E91-R95 IonicContact OE1-CZ 2.64Å; E91-R95 IonicContact OE1-NE 2.59Å; E91-R95 PolarHBondContact OE1-NE 3.08Å; E91-R95 IonicContact OE1-NH2 3.14Å; E91-R95 PolarHBondContact OE1-NH2 2.81Å
92Q90.3Very high81.9Confident90 Ų90116.3 Ų116.342%0.42160%0.601SS.*Hα-helixtrans-60.8-36.8174.7-169-173.173.800111.5D88 R96D88-Q92 VanDerWaalsContact O-CB 3.28Å; D88-Q92 WeakPolarHBondContact O-CB 3.29Å; D88-Q92 PolarHBondContact O-N 3.13Å; Q92-R96 WeakPolarHBondContact O-CB 3.31Å; Q92-R96 VanDerWaalsContact O-CG 3.31Å; Q92-R96 WeakPolarHBondContact O-CG 3.24Å; Q92-R96 PolarHBondContact O-N 2.86Å
93T87.6Confident79.7Confident81 Ų81113.5 Ų113.550%0.49761%0.606SS.*Hα-helixtrans-66-39.8174.9-60.60000111.8I89 L90 E91 K97I89-T93 VanDerWaalsContact O-CB 3.29Å; I89-T93 WeakPolarHBondContact O-CB 3.42Å; I89-T93 PolarHBondContact O-N 3.28Å; I89-T93 PolarHBondContact O-OG1 2.91Å; L90-T93 WeakPolarHBondContact O-CB 3.28Å; L90-T93 PolarHBondContact O-N 3.37Å; E91-T93 VanDerWaalsContact C-N 3.25Å; E91-T93 PolarHBondContact O-N 2.62Å; T93-K97 WeakPolarHBondContact O-CB 3.29Å; T93-K97 PolarHBondContact O-N 2.87Å
94L86.2Confident77.3Confident108 Ų108114.4 Ų114.457%0.56561%0.612SS**Hα-helixtrans-70.2-44.1176.7-71.1169.4000112L90 E91 R96 K97 G98L90-L94 HydrophobicContact CD1-CD1 4.22Å; L90-L94 HydrophobicContact CD1-CG 4.35Å; L90-L94 HydrophobicContact CG-CD1 4.08Å; L90-L94 WeakPolarHBondContact O-CG 3.34Å; L90-L94 PolarHBondContact O-N 3.37Å; E91-L94 PolarHBondContact O-N 3.04Å; E91-L94 VanDerWaalsContact O-N 3.12Å; L94-R96 PolarHBondContact O-N 3.21Å; L94-K97 CarbonylContact O-C 3.48Å; L94-K97 VanDerWaalsContact O-CA 3.31Å; L94-K97 WeakPolarHBondContact O-CA 3.4Å; L94-K97 VanDerWaalsContact O-CB 3.24Å; L94-K97 WeakPolarHBondContact O-CB 3.35Å; L94-K97 PolarHBondContact O-N 3.19Å; L94-G98 PolarHBondContact O-N 3.48Å
95R85.7Confident74.9Confident163 Ų163116.5 Ų116.562%0.61563%0.628SS**Hα-helixtrans-57.7-45.6173.9-71.8175.1178.3-1047.8111.5E91 K97 G98 H99E91-R95 WeakPolarHBondContact O-CG 3.4Å; E91-R95 PolarHBondContact O-N 2.83Å; E91-R95 IonicContact OE1-CZ 2.64Å; E91-R95 IonicContact OE1-NE 2.59Å; E91-R95 PolarHBondContact OE1-NE 3.08Å; E91-R95 IonicContact OE1-NH2 3.14Å; E91-R95 PolarHBondContact OE1-NH2 2.81Å; R95-K97 PolarHBondContact O-N 3.17Å; R95-G98 PolarHBondContact O-N 3.31Å; R95-H99 PolarHBondContact O-CD2 3.12Å; R95-H99 PolarHBondContact O-N 2.88Å
96R82.1Confident72.5Confident193 Ų193120.6 Ų120.673%0.72865%0.646SS**Hα-helixtrans-67.1-9.2172.2-70.9-179.7-179.4-160.53114.3Q92 L94Q92-R96 WeakPolarHBondContact O-CB 3.31Å; Q92-R96 VanDerWaalsContact O-CG 3.31Å; Q92-R96 WeakPolarHBondContact O-CG 3.24Å; Q92-R96 PolarHBondContact O-N 2.86Å; L94-R96 PolarHBondContact O-N 3.21Å
97K77.3Confident69.9Low175 Ų175119 Ų11976%0.76164%0.638SS**Hα-helixtrans-97.6-29.1173.5-152.272.2-168.3149.50112.8T93 L94 R95T93-K97 WeakPolarHBondContact O-CB 3.29Å; T93-K97 PolarHBondContact O-N 2.87Å; L94-K97 CarbonylContact O-C 3.48Å; L94-K97 VanDerWaalsContact O-CA 3.31Å; L94-K97 WeakPolarHBondContact O-CA 3.4Å; L94-K97 VanDerWaalsContact O-CB 3.24Å; L94-K97 WeakPolarHBondContact O-CB 3.35Å; L94-K97 PolarHBondContact O-N 3.19Å; R95-K97 PolarHBondContact O-N 3.17Å
98G59.4Low67.2Low59 Ų59120 Ų12061%0.60865%0.649SS**Hα-helixtrans-84.1-22.1-177.600000115.2L94 R95 G100L94-G98 PolarHBondContact O-N 3.48Å; R95-G98 PolarHBondContact O-N 3.31Å; G98-G100 PolarHBondContact O-N 2.81Å
99H51.8Low64.7Low179 Ų179125.9 Ų125.983%0.82968%0.675SS**  trans-74.869.1171.7-79.5-74.2000112.1R95R95-H99 PolarHBondContact O-CD2 3.12Å; R95-H99 PolarHBondContact O-N 2.88Å
100G54.7Low62Low60 Ų60131 Ų13162%0.61970%0.696SS**SBendtrans-142.580.417100000109.1G98G98-G100 PolarHBondContact O-N 2.81Å
101L52.9Low59.5Low178 Ų178131.2 Ų131.293%0.93271%0.707SS**SBendtrans67.987.2-177.5-50.2177.4000115.4
102D40.3Very low57.1Low155 Ų155132 Ų13283%0.82973%0.729SS**  -138152.4115-167.318.4000108.9
103G50.3Low54.6Low65 Ų65136.2 Ų136.267%0.6775%0.748SS**  trans-135.3101.3-175.300000111.2
104S44.2Very low52Low102 Ų102136.5 Ų136.571%0.71376%0.759SS**  trans-129.691.6160.5-74.30000108.8L106S104-L106 PolarHBondContact O-N 2.75Å
105E45.6Very low49.5Very low186 Ų186136.1 Ų136.187%0.86977%0.771SS**  trans-56.1111.1153.7179.9-178.3136.300107.8
106L47.2Very low47.1Very low157 Ų157132.6 Ų132.682%0.82278%0.778SS**  trans-121.691.9161.1-79.6-179.9000108S104S104-L106 PolarHBondContact O-N 2.75Å
107D40.2Very low44.8Very low110 Ų110130.7 Ų130.759%0.58878%0.782SS**  trans-43.3142.4154172.730.9000111.5E109D107-E109 PolarHBondContact OD1-N 2.68Å; D107-E109 VanDerWaalsContact OD1-N 3.08Å
108S38.8Very low43Very low120 Ų120132.1 Ų132.184%0.83979%0.788SS**  trans-163.851.6168.2-75.70000109.7
109E43.4Very low41.7Very low174 Ų174139.6 Ų139.681%0.81380%0.799SS**  trans-89.1116.7159.964.7-175.966.200111.2D107D107-E109 PolarHBondContact OD1-N 2.68Å; D107-E109 VanDerWaalsContact OD1-N 3.08Å
110E39.2Very low41.3Very low200 Ų200137.3 Ų137.394%0.93580%0.801SS**  trans-158.6148.7134.2-169.6149.382.900109.9
111S39Very low40.1Very low111 Ų111137.4 Ų137.478%0.77680%0.801SS**  trans-121132.7179.6-173.80000110.4
112A43.3Very low39Very low106 Ų106133.9 Ų133.988%0.87679%0.791SS**  trans-131102.2174.500000110.8
113Q37.3Very low38.7Very low178 Ų178133.2 Ų133.283%0.83279%0.788SS**  trans-118.8126.1174.5-179.478.331.500108.9
114A32.7Very low38.2Very low88 Ų88134.3 Ų134.373%0.72779%0.785SS**  trans141143.1138.100000117
115A34.3Very low38.3Very low99 Ų99138 Ų13882%0.81879%0.794SS**  trans87.6129.8139.500000123.1
116A35.2Very low37.9Very low90 Ų90135.8 Ų135.874%0.74479%0.788SS**  trans86.299.614000000121.8
117D33.7Very low37.8Very low153 Ų153135.3 Ų135.382%0.81879%0.785SS**  trans42.1113.4130.2-67.3-49.1000122
118K39.6Very low37.7Very low204 Ų204134.5 Ų134.589%0.88779%0.788SS**  -176.1129.6100.6-97.2160-173.4174.50114.4
119Y31.4Very low37.7Very low216 Ų216135.8 Ų135.885%0.84779%0.79SS**  trans-89.1167.4156.1-96.6-84.5000109
120P43.8Very low37.5Very low132 Ų132132 Ų13286%0.85779%0.789SS**  cis-137.4169.337.141.8-23.5000118
121G29.1Very low37.3Very low61 Ų61133.9 Ų133.963%0.62979%0.787SS**  trans177.2139.7170.600000110.6
122S30.5Very low37.1Very low104 Ų104137.1 Ų137.173%0.72779%0.79SS**  trans-74.9168-175.962.20000112.1
123D35.2Very low37Very low142 Ų142143.1 Ų143.176%0.75979%0.79SS**  cis-149.4149.430-99.8-68.6000115.8
124S38Very low36.6Very low88 Ų88143.8 Ų143.862%0.61579%0.791SS**  trans38.298.2133.6-152.30000120.6
125M46Very low36.5Very low180 Ų180145 Ų14589%0.88779%0.792SS**  176148.4102.3-87.2-60.5176.200110.7
126D38.1Very low37.4Very low139 Ų139145.2 Ų145.274%0.74379%0.785SS**  trans-125.7176.8-176.1-175.126.3000111.4
127L45.8Very low37.9Very low146 Ų146145.9 Ų145.976%0.76478%0.782SS**  trans110.576.6162.7-63.2154.2000117.4
128S37.1Very low37.9Very low93 Ų93143.4 Ų143.465%0.6578%0.777SS**  68.1154.8112.1-70.10000121.9
129V38.1Very low37.8Very low147 Ų147141.1 Ų141.189%0.89177%0.773SS**  trans73.4129.1171-172.90000114.4
130A39.3Very low37.9Very low94 Ų94138.7 Ų138.778%0.77778%0.775SS**  cis-134.41533.200000112.9
131R35Very low37.6Very low241 Ų241137 Ų13791%0.90977%0.765SS**  trans-113111.2162177.1-163.6-168.2-174.88108.6
132Q35.7Very low38.2Very low179 Ų179139.9 Ų139.984%0.83677%0.773SS**  trans-152.3146.9159.5-115.9168.131.600112.5
133R41.3Very low38.2Very low232 Ų232142.7 Ų142.788%0.87578%0.775SS**  trans-86.4156.8173.6-51.9173-177.5162.2-2.7108.7
134F29.2Very low38.4Very low192 Ų192141.7 Ų141.784%0.84277%0.774SS**  trans-143.2131.7160.3-119.4-82.1000113.6
135C30.3Very low38.2Very low112 Ų112146.7 Ų146.776%0.75779%0.788SS**  trans179.9151.1172.2-167.30000107.3
136P53.5Low37.6Very low104 Ų104146.9 Ų146.968%0.67578%0.784SS**  cis-95.6-113.5-16.118.65.7000107
137P45.9Very low37.3Very low105 Ų105147.4 Ų147.468%0.68279%0.786SS**  cis-136.7152-26.339.8-21.2000118.3
138S33.4Very low36.7Very low101 Ų101146.2 Ų146.271%0.70679%0.785SS**  trans52113.5135.6-58.70000124.1
139L36.7Very low36.6Very low155 Ų155147.2 Ų147.281%0.81279%0.791SS**  84.1147.6121.4-67.5175.4000122.8
140L33.9Very low36.4Very low166 Ų166145.2 Ų145.287%0.86979%0.79SS**  trans81.8134.6155-74.9156.3000120.7
141S36.9Very low35.9Very low95 Ų95143.6 Ų143.666%0.66478%0.783SS**  trans-80.2165.2166.9-178.90000110.3
142P43.3Very low35.9Very low123 Ų123137.7 Ų137.780%0.79978%0.777SS**  -143.8174.3110.539.4-26.7000115.5
143E30.2Very low35.8Very low163 Ų163137.2 Ų137.276%0.76278%0.775SS**  trans-89.3162.7177.1-62.6166.289.100113.4
144T38.7Very low35.5Very low120 Ų120132 Ų13274%0.73677%0.765SS**  trans46.799.915053.90000121
145Q34.4Very low35.5Very low194 Ų194126.1 Ų126.191%0.90776%0.758SS**  trans-141.9123.6141.8-58.3-177.419.400105.1
146F31.9Very low35.8Very low183 Ų183129.9 Ų129.980%0.80376%0.762SS**  cis81.4111.225.2-110.4-80000116.4
147L33.3Very low35.6Very low151 Ų151130.8 Ų130.879%0.79177%0.768SS**  trans81.8138162.6-82.4158000122.7
148V33.3Very low34.7Very low121 Ų121133.1 Ų133.173%0.73378%0.775SS**  trans69.1107.9157.5156.90000116.5
149S33.7Very low34.9Very low113 Ų113133.5 Ų133.579%0.7978%0.777SS**  74.8133.767.9-64.10000113
150A33.8Very low34.8Very low105 Ų105131.2 Ų131.287%0.86877%0.774SS**  cis-155.3176.2-2.300000108.3
151G29.3Very low34.9Very low61 Ų61127.9 Ų127.963%0.62977%0.771SS**  cis177.8-172.11.600000110.8
152C34.2Very low35.7Very low117 Ų117129 Ų12979%0.79178%0.776SS**  trans30.6139.2153.955.60000121.3
153E34.3Very low35.3Very low168 Ų168130.4 Ų130.479%0.78578%0.782SS**  cis-177.1-179.40.1-123.6169.577.400108.5
154N34.5Very low35.4Very low123 Ų123127 Ų12766%0.65878%0.781SS**  cis-150.2-179.4-4.5-161.3-62.6000107
155G29.9Very low35.2Very low69 Ų69126 Ų12671%0.71179%0.785SS**  trans156.796164.700000116.4
156F35.7Very low35.2Very low191 Ų191122 Ų12284%0.83878%0.779SS**  trans-99.3172.9169.5-82.9-77.8000110.8
157P49.3Very low35.2Very low122 Ų122123.1 Ų123.179%0.79279%0.786SS**  cis-136.6171.815.842.7-25.9000117.4
158N28.9Very low35.4Very low155 Ų155126.8 Ų126.883%0.82979%0.789SS**  trans-155.9141.3154-162.33.9000112.1
159S36.8Very low36.2Very low108 Ų108126.4 Ų126.476%0.75579%0.789SS**  trans-156.7145.1176.6-70.20000107.8
160S35Very low37.2Very low107 Ų107126.7 Ų126.775%0.74879%0.789SS**  cis-165.3133.9-242.90000106.9
161A36.3Very low37.1Very low96 Ų96124.5 Ų124.579%0.79378%0.777SS**  62.6166101.500000116.1
162P52.5Low37.4Very low120 Ų120131.4 Ų131.478%0.77979%0.79SS**  cis-132.8165.2-11.240.4-24.9000115.1
163V35Very low37.6Very low151 Ų151135 Ų13592%0.91579%0.792SS**  trans-140.1145.9148.7-179.20000108
164A33.3Very low37.4Very low92 Ų92131.4 Ų131.476%0.7679%0.791SS**  trans-104.2156.5-170.400000113.8
165A33.1Very low37.3Very low99 Ų99134 Ų13482%0.81880%0.804SS**  173.5118.3123.400000113.1
166S35.6Very low37.5Very low110 Ų110136.1 Ų136.177%0.76981%0.808SS**  trans-158.4139.7153.9-84.40000107.3
167H32.5Very low37.4Very low206 Ų206133 Ų13395%0.95481%0.81SS**  trans-176.8158147-88-43.3000111.1
168R37Very low36.7Very low228 Ų228138.5 Ų138.586%0.8682%0.815SS**  trans-100.4155.2-179.6-178.8-171.2-177.2-178.14.3109
169P48.7Very low37.5Very low113 Ų113135.7 Ų135.773%0.73481%0.805SS**  -143.8-145.2124.940.9-21.6000113
170P55.3Low37.3Very low119 Ų119135.7 Ų135.777%0.77381%0.805SS**  -144.1-172-114.744.3-22000118
171G33Very low37.4Very low60 Ų60136.2 Ų136.262%0.61981%0.808SS**  97.8167.7126.200000121.1
172F34Very low37.4Very low205 Ų205135.7 Ų135.790%0.89980%0.804SS**  trans-152174.6179.7-49.1-83.9000108.2
173K38.7Very low36.7Very low193 Ų193135.4 Ų135.484%0.83981%0.805SS**  cis-148164.214.2-58173.7177.7177.30110.7
174A30.8Very low37.5Very low93 Ų93134.4 Ų134.477%0.76980%0.802SS**  trans57.9128.1143.600000122
175L32.8Very low37.6Very low177 Ų177134.5 Ų134.593%0.92780%0.802SS**  -170.7175.5119.7-103.1162.3000111.7
176S34Very low37.8Very low113 Ų113133.1 Ų133.179%0.7980%0.798SS**  trans-108.2151.7-158.6-48.90000115.6
177S32.5Very low38.7Very low126 Ų126132.8 Ų132.888%0.88179%0.793SS**  trans-156.1149.714655.50000114.1
178R34.5Very low39.1Very low238 Ų238131.7 Ų131.790%0.89879%0.788SS**  trans-123173170.9-142.9-178.8156.9-138.6-3.8104.4
179P47.1Very low39Very low96 Ų96124.9 Ų124.962%0.62378%0.78SS**  cis-143.4-167.28.644.6-24.3000116.2
180S32.9Very low38.5Very low107 Ų107123.6 Ų123.675%0.74878%0.779SS**  trans45.6140.5145.4-62.80000121
181S36.6Very low37.4Very low118 Ų118126.9 Ų126.983%0.82578%0.782SS**  cis-160.9-162.3446.20000107.7
182A35Very low37.6Very low86 Ų86131.4 Ų131.471%0.71179%0.789SS**  cis-157.6-156.411.700000111.8
183S37.6Very low38Very low113 Ų113127 Ų12779%0.7978%0.783SS**  trans-144.6163.9163.2-52.30000108.3
184P53.8Low38.7Very low130 Ų130123.9 Ų123.984%0.84478%0.783SS**  -143.6176.295.122.40.2000112.9
185A34.4Very low38.9Very low94 Ų94128.1 Ų128.178%0.77779%0.786SS**  cis-161.8168.9-2300000108.7
186G37Very low39.9Very low70 Ų70125.5 Ų125.572%0.72278%0.78SS**  trans-84.3-148.7168.500000112.8
187P54.4Low39.9Very low104 Ų104123.4 Ų123.468%0.67578%0.776SS**  cis-151.4176.341.944.3-24.9000118.9
188H40.5Very low40.2Very low182 Ų182124.6 Ų124.684%0.84377%0.771SS**  trans65.4150.8157.1-57-45000119.7
189A35.9Very low40.2Very low85 Ų85115.9 Ų115.970%0.70276%0.755SS**  cis-163.7130.5-19.300000107.1
190A37.3Very low39.9Very low86 Ų86120.9 Ų120.971%0.71176%0.763SS**  80.8155.47900000115.8
191F33.3Very low40.2Very low189 Ų189121 Ų12183%0.82976%0.764SS**  trans73.7145.7-178.4-66.7-110.4000116.7
192M37.4Very low40.3Very low155 Ų155122.1 Ų122.176%0.76477%0.766SS**  cis-161.3168.3-19.8-113.7-54.8149.600110.9
193S41.6Very low40.6Very low111 Ų111126.7 Ų126.778%0.77677%0.77SS**  trans-137138169.8-60.90000112.3
194P53.1Low40.5Very low128 Ų128127.1 Ų127.183%0.83177%0.773SS**  trans-141.2171.5143.730.5-11.3000115.5
195H34.8Very low40.1Very low183 Ų183129.5 Ų129.585%0.84777%0.772SS**  trans-83.4-165.9174.5-76.2-77.7000112.2
196P55.3Low40Very low122 Ų122128.7 Ų128.779%0.79277%0.773SS**  -134.8171.6-66.540.1-25.3000114.8
197G33.2Very low40.1Very low68 Ų68132.4 Ų132.470%0.70178%0.776SS**  trans117.9159.913700000120.4
198I39.3Very low39.9Very low151 Ų151135.3 Ų135.377%0.77479%0.785SS**  trans71.7123.4162.3-55.7166.7000116.5Y200I198-Y200 HydrophobicContact CG2-CE1 4.03Å; I198-Y200 HydrophobicContact CG2-CE2 4.17Å; I198-Y200 VanDerWaalsContact CG2-OH 3.25Å; I198-Y200 WeakPolarHBondContact CG2-OH 3.37Å
199G34.7Very low39.7Very low56 Ų56132.1 Ų132.158%0.57778%0.775SS**  cis176.4-163-2.200000115.4
200Y40.3Very low39.9Very low201 Ų201138.4 Ų138.479%0.78878%0.78SS**  trans66.3102167.2-19.5-71.7000116.4I198I198-Y200 HydrophobicContact CG2-CE1 4.03Å; I198-Y200 HydrophobicContact CG2-CE2 4.17Å; I198-Y200 VanDerWaalsContact CG2-OH 3.25Å; I198-Y200 WeakPolarHBondContact CG2-OH 3.37Å
201S39.5Very low40Very low110 Ų110139.2 Ų139.277%0.76979%0.787SS**  96139.785.7-76.40000112.3
202V38.2Very low40.7Very low141 Ų141138.3 Ų138.386%0.85579%0.79SS**  cis-145.9164.23.5-111.50000110.9
203F41.2Very low40.8Very low181 Ų181138.6 Ų138.679%0.79479%0.794SS**  trans-76.3156.7175.1-78.5-97.2000113.9
204S34.4Very low40.7Very low122 Ų122141.6 Ų141.685%0.85380%0.798SS**  trans-157.7133.4138.9-83.30000111.9
205H46Very low39.8Very low180 Ų180145.6 Ų145.683%0.83380%0.802SS**  trans-85.8144.1166.8-73.9-120.4000109.2
206G32.8Very low40.3Very low77 Ų77141.4 Ų141.479%0.79479%0.794SS**  trans-160.864.8-170.200000116.8
207N37.8Very low40.1Very low149 Ų149140.7 Ų140.780%0.79779%0.789SS**  trans34.4121.9149.3-157.95000121N209N207-N209 PolarHBondContact O-N 3.16Å
208L50.7Low40.8Very low164 Ų164143.1 Ų143.186%0.85979%0.792SS**  trans-75.6114.9165.2-73.7164.3000111.3
209N36.3Very low41.3Very low116 Ų116141.4 Ų141.462%0.6279%0.791SS**  trans-157.9117.2150.6-116.8-88.1000113.9N207N207-N209 PolarHBondContact O-N 3.16Å
210R41.3Very low41.6Very low217 Ų217147.1 Ų147.182%0.81981%0.808SS**  trans53.497134-165.5-163.9-42.2-120-4.1119.2
211A39.1Very low41.4Very low103 Ų103143.3 Ų143.385%0.85181%0.811SS**  trans-133.6144.2134.200000108.7
212L48.4Very low41.6Very low169 Ų169146.2 Ų146.289%0.88582%0.817SS**  trans-90.8140174.5-64.3164.8000108.6
213D39.3Very low41.3Very low162 Ų162143 Ų14387%0.86681%0.812SS**  -159.2152.9127.6-136-44.3000112.1
214M38.1Very low41.2Very low173 Ų173140.1 Ų140.185%0.85281%0.814SS**  trans-107.6118.5179.5-67-149.376.300111S216M214-S216 VanDerWaalsContact C-N 3.34Å; M214-S216 PolarHBondContact O-N 3.24Å
215K34.9Very low41.6Very low212 Ų212143.4 Ų143.492%0.92282%0.816SS**  trans-73.285.4178.6-168.964.2174.8-178.30111.7
216S44.8Very low41.1Very low95 Ų95141.8 Ų141.866%0.66481%0.814SS**PPolyproline II helixtrans-61.7144167.4-165.70000111.2M214M214-S216 VanDerWaalsContact C-N 3.34Å; M214-S216 PolarHBondContact O-N 3.24Å
217P51.5Low41.4Very low107 Ų107145.9 Ų145.970%0.69582%0.816SS**PPolyproline II helixtrans-69.7159.5171.530-35.3000112.3
218P48.4Very low41Very low119 Ų119150.8 Ų150.877%0.77382%0.824SS**PPolyproline II helixtrans-77150.7-170.531.2-36.2000113.8
219P50.3Low40.2Very low116 Ų116147.1 Ų147.175%0.75382%0.817SS**PPolyproline II helixtrans-77.9160.8173.133.9-35.7000112.5
220L41Very low40Very low176 Ų176149.7 Ų149.792%0.92183%0.831SS**PPolyproline II helixtrans-91.4122.8171.8-64.3171.7000110
221S36.3Very low39.6Very low121 Ų121143.5 Ų143.585%0.84683%0.826SS**PPolyproline II helixtrans-88.2116.4173.2-61.90000111.1
222L42.8Very low39.3Very low171 Ų171142.7 Ų142.790%0.89582%0.819SS**PPolyproline II helixtrans-99.3121.4154.9-88.5164.5000107.5
223G32.8Very low38.5Very low73 Ų73141.2 Ų141.275%0.75381%0.812SS**PPolyproline II helixtrans-80.1142.6179.700000112.2
224S38.9Very low38.4Very low121 Ų121141.6 Ų141.685%0.84681%0.809SS**  trans-137.1113.3168.6-66.20000108.1
225E41.5Very low38.2Very low191 Ų191137.7 Ų137.789%0.89380%0.804SS**  trans-126.3156.2175.759.5-169.596.900111.1
226N36.9Very low38.4Very low146 Ų146136.4 Ų136.478%0.78180%0.803SS**  trans-104142.9-150.3-82.2-63000115.3
227L37.9Very low37.8Very low163 Ų163135 Ų13585%0.85381%0.805SS**  trans36.4111.3137.4-59.4171.2000118.6
228R30.5Very low37.1Very low252 Ų252134 Ų13495%0.95181%0.805SS**  trans-146.5142.6136.7-160.5164.7-178.8149.1-0.8110.3
229A32.9Very low36.5Very low87 Ų87134.5 Ų134.572%0.71981%0.806SS**  trans-106148.9176.100000110.5
230D31.5Very low35.9Very low170 Ų170139.7 Ų139.791%0.90981%0.811SS**  trans-157.6178.2136-135.7-53.3000110.1
231A33.1Very low35.6Very low87 Ų87137.5 Ų137.572%0.71980%0.804SS**  trans-114.6179.6-160.300000116.2
232A32.6Very low35.5Very low86 Ų86138 Ų13871%0.71180%0.797SS**  trans94.4114.1153.700000121.2
233N32.7Very low35.3Very low138 Ų138136.9 Ų136.974%0.73879%0.787SS**  88.3128.5127.7-80.3-27.1000123.9
234Q37.7Very low35.4Very low170 Ų170140.7 Ų140.779%0.79479%0.79SS**  trans67.7110.9145.1-64.4178.494.800117.5
235A33.8Very low35.2Very low91 Ų91139.9 Ų139.975%0.75279%0.785SS**  100.9148.274.800000110.7
236M39.2Very low35.1Very low184 Ų184134.6 Ų134.691%0.90677%0.774SS**  cis-156.9145.66.5-136-84.5-8300111.8
237G31.2Very low35.3Very low67 Ų67139 Ų13969%0.69178%0.779SS**  trans82154.2161.500000118.9
238A36.4Very low35Very low84 Ų84136.2 Ų136.269%0.69477%0.774SS**  cis-165.8132.3-14.300000113.5
239T36.5Very low35.4Very low131 Ų131131.3 Ų131.380%0.80477%0.766SS**  trans60.7142.115164.70000119.6
240R37.1Very low35.7Very low225 Ų225133.1 Ų133.185%0.84976%0.763SS**  cis-140.1153.67.9-61.4-176.4-178.9-166.6-2.3107.8
241V35.5Very low35.8Very low129 Ų129135 Ų13578%0.78276%0.758SS**  cis72124.244.7178.60000111.3
242N34.3Very low35.7Very low131 Ų131139.4 Ų139.470%0.70176%0.764SS**  cis-152.817920.5-146.64.5000118.4
243H39.1Very low35.7Very low149 Ų149138.4 Ų138.469%0.6976%0.763SS**  trans-41.5151.8178.8-63.7-51000123.8
244N33.4Very low35.9Very low152 Ų152138.2 Ų138.281%0.81376%0.761SS**  -162.7141.1100.6-92.8-26.6000109.8
245S36.3Very low35.8Very low104 Ų104137.9 Ų137.973%0.72776%0.759SS**  cis80.1128.628.3-164.30000113.8
246A39.4Very low35.7Very low81 Ų81138.4 Ų138.467%0.66976%0.757SS**  cis-159.4162.6-15.500000107.5
247R40.3Very low35.3Very low237 Ų237134.9 Ų134.989%0.89475%0.75SS**  -178.4152.574.6-71171.3169.4160.1-3.4106.4
248S30.8Very low35.3Very low106 Ų106137.3 Ų137.374%0.74176%0.757SS**  cis65.7138.644.3-125.30000113
249L39.3Very low35.1Very low148 Ų148138 Ų13878%0.77576%0.757SS**  cis-139.6170.412.4-79.4168.8000107.4
250L38.7Very low35Very low125 Ų125139.6 Ų139.665%0.65476%0.757SS**  cis-148.7-163.71-111.7157.7000105.5
251Y35.2Very low35.2Very low209 Ų209135.5 Ų135.582%0.8276%0.757SS**  cis-145.1-168.15.7-131.9-51.6000108.9
252Q31.2Very low35.3Very low180 Ų180133.8 Ų133.884%0.84176%0.756SS**  trans-159.8141-165.6-172.3177.131.400115.1
253G31.1Very low35.4Very low66 Ų66136.9 Ų136.968%0.6877%0.769SS**  trans86175.2149.500000119.3
254L37.2Very low34.9Very low133 Ų133132.9 Ų132.970%0.69677%0.768SS**  cis-172152.2-16.5-112.8-178.6000110
255H35.8Very low34.9Very low164 Ų164135.8 Ų135.876%0.75977%0.773SS**  trans64.1162159.5-67.5-45.4000118
256S32.6Very low34.9Very low101 Ų101135.5 Ų135.571%0.70678%0.778SS**  cis-162.3-179.4-21.1-172.60000110.4
257S30.1Very low34.6Very low110 Ų110135.2 Ų135.277%0.76978%0.782SS**  trans67.5126.5152.855.30000122.9
258S31.9Very low34.8Very low119 Ų119132.4 Ų132.483%0.83278%0.784SS**  trans-49.2154.2166.1-36.10000117.1
259S32.3Very low35Very low99 Ų99135 Ų13569%0.69279%0.789SS**  161.7146.699.9-157.60000115.5
260M33Very low34.6Very low163 Ų163132.2 Ų132.280%0.80378%0.781SS**  trans50.2125.5155-73-166.5-57.400125
261V42.7Very low34.6Very low139 Ų139134.2 Ų134.284%0.84279%0.787SS**  trans50.3118.3138.4-46.70000124
262A35.8Very low34.5Very low94 Ų94129 Ų12978%0.77778%0.781SS**  trans-161.5130.8140.900000106.8
263M37Very low34.8Very low196 Ų196128.7 Ų128.797%0.96678%0.784SS**  52.5131.575.6-154.7173.7-165.400113.2
264G29.1Very low34.9Very low65 Ų65129.6 Ų129.667%0.6779%0.794SS**  cis156.6129.5-1.200000109.8
265K32.7Very low34.7Very low212 Ų212125.9 Ų125.992%0.92279%0.787SS**  trans-153.5143.3178.1-89.8-175.4175.3176.80109.4
266A36.3Very low34.8Very low99 Ų99129.7 Ų129.782%0.81880%0.797SS**  cis-151142.8-14.100000109.2
267G34.2Very low34.8Very low74 Ų74128.8 Ų128.876%0.76380%0.804SS**  trans-141.6124.2171.100000108.6
268L44.2Very low35.3Very low179 Ų179131.6 Ų131.694%0.93781%0.809SS**  trans-93127-175.1-73.8171.5000111.6
269L35.7Very low36.3Very low161 Ų161131.2 Ų131.284%0.84380%0.804SS**  trans-70.3160.1158.3-70.3175.5000109.2
270S29Very low37.5Very low88 Ų88131.7 Ų131.762%0.61581%0.805SS**  cis-167.2-144.6-6.3173.40000107.1
271H39.5Very low37.8Very low168 Ų168128.9 Ų128.978%0.77881%0.807SS**  trans79.6139.5174.2-35.4-63.2000115.5
272S33.1Very low37.3Very low98 Ų98125.7 Ų125.769%0.68580%0.802SS**  cis-169.7162.6-20.8-108.30000110.1
273L38.5Very low37.3Very low174 Ų174125.8 Ų125.891%0.91180%0.803SS**  trans60.8115.6157.2-70158.8000119.1
274G32.9Very low37.2Very low86 Ų86121.4 Ų121.489%0.88779%0.792SS**  trans-81.4-171.4174.800000116.7
275G32.2Very low37.3Very low54 Ų54126 Ų12656%0.55780%0.796SS**  trans151.1114.9167.200000114.3
276Y38Very low37.4Very low244 Ų244125.4 Ų125.496%0.95779%0.789SS**  trans64.9126.2154.8-40.9-74.9000118.8
277G33.3Very low37.1Very low83 Ų83126 Ų12686%0.85679%0.787SS**  trans156.366174.400000116.2
278L39.7Very low37.3Very low169 Ų169130.7 Ų130.789%0.88579%0.789SS**  trans-99.3163.6163.1-83.7171.6000109.1
279P54.1Low37.5Very low110 Ų110127.7 Ų127.771%0.71478%0.781SS**  cis-128.2-129.8-7.927.3-0.3000112.2
280P56.8Low37.3Very low110 Ų110122.9 Ų122.971%0.71477%0.77SS**  -136.6177.2-99.345.4-28.8000117.6
281A38.5Very low37.4Very low103 Ų103127.7 Ų127.785%0.85178%0.78SS**  trans48.8154.7136.100000124.2
282G33Very low37Very low72 Ų72129.3 Ų129.374%0.74279%0.785SS**  trans114.3108.5176.400000111.4
283A35.8Very low37Very low96 Ų96133.4 Ų133.479%0.79379%0.793SS**  cis80.912124.900000115.6
284S35.8Very low36.7Very low105 Ų105130.8 Ų130.873%0.73479%0.789SS**  trans63.8153.5169.2-80.90000116.6
285E30.9Very low36.7Very low160 Ų160133.5 Ų133.575%0.74879%0.788SS**  cis-163.3172.6-20.8-135.4166119.500111.2
286Y33.5Very low36.8Very low201 Ų201136.3 Ų136.379%0.78880%0.799SS**  trans56.4106.9145.4-144.5-91.8000121.2
287S30.1Very low36.7Very low110 Ų110132.6 Ų132.677%0.76980%0.795SS**  -175.5145.3119.6-80.50000114.2
288Q39.8Very low36.7Very low174 Ų174138 Ų13881%0.81380%0.798SS**  trans-94.3-179.2170.5-80.7-87.3-15.100109.7
289P46.4Very low36.4Very low116 Ų116141.6 Ų141.675%0.75380%0.8SS**  cis-134172.17.941.4-24.5000117.1
290G32Very low35.5Very low59 Ų59139.5 Ų139.561%0.60880%0.798SS**  trans-175.299.9165.100000113.7
291F32.3Very low35.2Very low189 Ų189139.7 Ų139.783%0.82980%0.8SS**  trans-76.9130.9-179.7-74.4-92.8000112.6
292F30.6Very low35.1Very low203 Ų203140.8 Ų140.889%0.8980%0.796SS**  trans-136.7126.5159.1-79.1-82.3000109.9
293H33.4Very low35.3Very low183 Ų183144.2 Ų144.285%0.84780%0.797SS**  trans-118.8143.3166.9-96-77.2000110.2
294S31.5Very low36Very low120 Ų120145 Ų14584%0.83979%0.794SS**  trans-77.2149.5-174.7-42.10000112.8
295V32.5Very low35.6Very low142 Ų142151.3 Ų151.386%0.86180%0.802SS**  trans-124.2134.1156-71.90000109.7
296S34Very low35.6Very low113 Ų113151.6 Ų151.679%0.7980%0.803SS**  trans-94.5142.8176.1-176.80000109.9
297L36.3Very low35.4Very low166 Ų166149.4 Ų149.487%0.86980%0.8SS**  trans-129.399.2172.8-78.7176.4000111
298Q33.4Very low35.2Very low198 Ų198151.5 Ų151.593%0.92580%0.797SS**  trans-89.9129.9163.9-166.6175.152.600108.1
299R34.5Very low34.6Very low243 Ų243147.5 Ų147.592%0.91779%0.789SS**  trans-114.1122.7-169.6-177.3-172.9-83.2-172.2-5.3112.6
300G35Very low33.8Very low66 Ų66150.8 Ų150.868%0.6879%0.794SS**  trans-123.7157.5156.700000109.7
301P49.2Very low33.6Very low115 Ų115153.2 Ų153.275%0.74780%0.802SS**  -142.4177.594.639.4-22.1000113.1
302V36.6Very low34.4Very low126 Ų126148.7 Ų148.776%0.76479%0.791SS**  cis76.2132.332.21450000111.9
303N38Very low34.3Very low144 Ų144147 Ų14777%0.7779%0.786SS**  cis-152.8-169.117.7-12711.4000113.8
304P50.6Low34.2Very low113 Ų113146.6 Ų146.673%0.73479%0.788SS**  trans-108.5-152.1-159.746-42.5000118.1
305W26.8Very low34.2Very low237 Ų237145.7 Ų145.790%0.89878%0.782SS**  trans-98.4166.5-166.8-98.173.3000116.4
306Q31.2Very low34.1Very low166 Ų166145 Ų14578%0.77678%0.784SS**  trans71.8152.4170.5-65.7-174.2-16.600116.4
307H29.5Very low33.9Very low155 Ų155143.6 Ų143.672%0.71879%0.787SS**  cis-139.9-176.516.4-158.9-100000114.3
308E26Very low33.9Very low153 Ų153144.6 Ų144.672%0.71579%0.789SS**  trans-68.6150.3-166.7-168.8-175.796.700119.4
309S27.8Very low34.1Very low90 Ų90140.7 Ų140.763%0.62978%0.784SS**  144.4150.812268.90000118
310Q29.4Very low34.1Very low185 Ų185134.2 Ų134.286%0.86478%0.776SS**  trans72.8112.4159.9-70174.693.900122.7
311S26.6Very low34.1Very low111 Ų111135.2 Ų135.278%0.77679%0.786SS**  trans-74.8-179.4150.1-46.70000110.4
312P48.8Very low33.2Very low93 Ų93133.2 Ų133.260%0.60479%0.786SS**  cis-152-179.120.644.4-22.5000120
313H29.4Very low33.1Very low169 Ų169133.2 Ų133.278%0.78279%0.79SS**  trans59.9127.5158.1-46.5-50.6000121.6
314I31.3Very low32.7Very low173 Ų173132 Ų13289%0.88779%0.793SS**  176.9163.1117.7-90160.8000109.6
315S30.5Very low32.1Very low102 Ų102136.2 Ų136.271%0.71380%0.8SS**  trans-116.5167-159.2-470000115.6
316S31.5Very low33.2Very low128 Ų128130.4 Ų130.490%0.89579%0.793SS**  trans78.7135.9153.1-54.70000119.2
317G29.8Very low34.6Very low83 Ų83127.3 Ų127.386%0.85679%0.787SS**  trans-17554.8-177.200000114.7
318M36.6Very low34.8Very low187 Ų187128.3 Ų128.392%0.92179%0.792SS**  trans-63.9132.5-176.945.81666200115.3
319S37.3Very low35.2Very low116 Ų116126 Ų12681%0.81179%0.793SS**  trans-173.6-178.1151.7-126.90000111.2
320S35.3Very low35.3Very low107 Ų107127 Ų12775%0.74880%0.799SS**  -174.4123.9-93.452.30000112.3
321G34.6Very low35.4Very low87 Ų87124.2 Ų124.290%0.89780%0.8SS**  trans107.3154.8174.400000114.7
322G30.5Very low35.7Very low72 Ų72124.4 Ų124.474%0.74280%0.801SS**  cis178.4105.3-5.100000114.7
323C33.1Very low34.9Very low126 Ų126128.4 Ų128.485%0.85182%0.818SS**  trans43.9137.1144.2-48.60000123.6
324S30.5Very low35.1Very low120 Ų120125 Ų12584%0.83981%0.813SS**  trans95.8110.1137.3-60.20000122.7
325F38.5Very low35.2Very low200 Ų200122.7 Ų122.788%0.87781%0.812SS**  trans-64.7179.2138.9-63.1-81.1000110.3
326P50Low35.4Very low115 Ų115126.1 Ų126.175%0.74782%0.816SS**  cis-152.7-137.63239.7-11.6000114.4
327P58.8Low35.7Very low102 Ų102127.1 Ų127.166%0.66281%0.811SS**  -123.4-167.8-65.825.4-3.6000114.5
328Q35.1Very low35.8Very low176 Ų176128.1 Ų128.182%0.82281%0.811SS**  trans91.7151.9153.9-54.7-16463.700119
329S33Very low35.7Very low104 Ų104124.6 Ų124.673%0.72781%0.805SS**  cis-162.7167.7-28.5-97.30000110.5
330C30.3Very low35.6Very low112 Ų112126.7 Ų126.776%0.75781%0.806SS**  trans-66.3162.9-172.555.60000118
331S31.1Very low35.5Very low125 Ų125128.3 Ų128.387%0.87481%0.806SS**  trans-163.4148134.5-80.90000111.3
332S34.3Very low35.7Very low116 Ų116131.7 Ų131.781%0.81180%0.803SS**  trans-128156.2-177.6-53.60000110.7
333N31.1Very low36Very low177 Ų177133.2 Ų133.295%0.94780%0.802SS**  trans-155.3164.9155.4-121.5-26.9000113.9
334S35Very low36.2Very low98 Ų98134.9 Ų134.969%0.68580%0.801SS**  trans-121.2161.1-160.8-177.60000114.2
335S32.8Very low36.4Very low124 Ų124138.2 Ų138.287%0.86780%0.8SS**  trans-156.4150.7161.7-74.90000109.8
336H34.7Very low36.4Very low173 Ų173133.8 Ų133.880%0.80180%0.795SS**  trans-126.8173.7-161.8-160.8-102.4000114.1
337L36.8Very low35.7Very low149 Ų149136.8 Ų136.878%0.7880%0.798SS**  trans-62.5147.4-168.9-58.5167.6000116.5
338A32.3Very low34.6Very low104 Ų104143.3 Ų143.386%0.8681%0.81SS**  trans-159.315313700000111.5
339S33.9Very low34.6Very low114 Ų114140.4 Ų140.480%0.79781%0.809SS**  trans-98.9165.5-171.8-48.30000113.9
340L35.3Very low34.7Very low159 Ų159140.9 Ų140.983%0.83281%0.812SS**  -176.7108.2124.2-99.1170.9000115.4
341N33.7Very low35.7Very low142 Ų142141.6 Ų141.676%0.75982%0.815SS**  trans61.2165.2133-130.5-35.4000123.5
342L38.7Very low35.8Very low158 Ų158141.4 Ų141.483%0.82781%0.805SS**  trans72.1133.9174.6-55.3169.8000116.8
343S38.2Very low36Very low103 Ų103145.2 Ų145.272%0.7281%0.809SS**  cis-156.1144.6-17.756.50000110.3
344I36.7Very low36.1Very low162 Ų162144 Ų14483%0.83180%0.799SS**  trans-98.8124.4177-63.1171.3000108.7
345K33.3Very low35.9Very low189 Ų189145 Ų14582%0.82281%0.806SS**  trans-105.695.7165.2-90.3-173.362.8170.40110.5
346S39.6Very low36.2Very low108 Ų108144.7 Ų144.776%0.75580%0.803SS**  trans-88.8138.1157.947.70000109.3
347E34.4Very low37Very low177 Ų177142.4 Ų142.483%0.82780%0.804SS**  trans-143.2158.4164.2-146.2176.2117.200109.6
348R36.1Very low36.7Very low240 Ų240141 Ų14191%0.90681%0.806SS**  trans-153.5119.2-160.9-172.5-170.7-162.4-169.17109.1
349S35.2Very low36.9Very low115 Ų115141.6 Ų141.680%0.80480%0.804SS**  trans-135.3112.2-176.444.10000112.4
350S35.8Very low37.6Very low114 Ų114141.9 Ų141.980%0.79780%0.804SS**PPolyproline II helixtrans-103148156.7-61.10000108.4
351P51.1Low37.4Very low126 Ų126145.1 Ų145.182%0.81881%0.805SS**PPolyproline II helixtrans-87.7158.9166.234.7-32.3000112.5
352D33Very low37.4Very low122 Ų122143.9 Ų143.965%0.65280%0.797SS**PPolyproline II helixtrans-76.8159.1-162.5-55.6-105.4000117.8M354D352-M354 HydrophobicContact CB-CE 4.34Å
353H37.6Very low37.2Very low196 Ų196143.7 Ų143.791%0.90779%0.792SS**  trans-125.6143.7143.9-73.2-58.9000109.5
354M34.2Very low37Very low150 Ų150146 Ų14674%0.73979%0.791SS**  trans-103.8162-164.6-86.8-74.512100115D352D352-M354 HydrophobicContact CB-CE 4.34Å
355C30.5Very low36.8Very low121 Ų121144.7 Ų144.782%0.81879%0.785SS**  trans72105.9159.5-66.70000120.5
356S38.5Very low36.6Very low117 Ų117145.2 Ų145.282%0.81878%0.782SS**  trans-101.3161137.4-48.60000107.4
357P53.1Low36.3Very low124 Ų124146.2 Ų146.281%0.80578%0.775SS**  -154.1160.960.841.1-21000118.5
358S30.2Very low36.2Very low120 Ų120146.5 Ų146.584%0.83978%0.775SS**  trans-174.3143.3136.453.10000112.5
359S36.4Very low36.3Very low117 Ų117140 Ų14082%0.81877%0.767SS**  trans-152143.7171.4-58.60000109.1
360P48.3Very low37Very low120 Ų120140 Ų14078%0.77976%0.764SS**  -133.3161.795.514.39.2000112.4
361R31.3Very low37.1Very low226 Ų226141.4 Ų141.485%0.85377%0.768SS**  63.3135.859.5-86.3-169.3-178.6-155.32112.5
362L32.7Very low36.2Very low116 Ų116138.7 Ų138.761%0.60776%0.763SS**  cis-162.8166.720.7-108.9160.2000112.7
363H34.8Very low36.3Very low155 Ų155140.9 Ų140.972%0.71878%0.775SS**  trans61.7170.7153.2-72.3-48.4000120.8
364H33.8Very low36.2Very low152 Ų152135.7 Ų135.770%0.70477%0.766SS**  cis-170.2165.4-49.1-147.516.9000110.1
365L32.1Very low36Very low133 Ų133135.4 Ų135.470%0.69677%0.767SS**  trans59.9128.6174-82.560.9000116.4
366R30.9Very low36.2Very low200 Ų200135.5 Ų135.576%0.75576%0.764SS**  71.299.156.2-170.4-136.4-179.5175.60.1113.6
367Q32.9Very low36Very low130 Ų130133.5 Ų133.561%0.60776%0.755SS**  167.6153.4125.6-96.6174.7-17.300116
368H32.7Very low35.1Very low182 Ų182138.3 Ų138.384%0.84376%0.757SS**  trans65.3117154.7-58.4-47.7000123.6
369S37.5Very low35.2Very low105 Ų105141.3 Ų141.373%0.73476%0.757SS**  trans-79.8167.7140.9-34.60000110.1
370P50.7Low35.1Very low113 Ų113141.1 Ų141.173%0.73476%0.756SS**  -155.9-170.387.840-18.9000116.8
371T36.9Very low35.3Very low144 Ų144141.2 Ų141.288%0.88376%0.757SS**  trans71.9139.1167.567.20000119.7
372G31.4Very low36.1Very low70 Ų70136.5 Ų136.572%0.72276%0.755SS**  cis-171.6174.4-3.900000117.2
373N35.3Very low36.2Very low168 Ų168140 Ų14090%0.89877%0.768SS**  trans-38.9158.2173.4-55.95.2000115.9
374A36Very low36.1Very low87 Ų87137.2 Ų137.272%0.71977%0.773SS**  cis-168.1-148.7-11.100000107.9
375D31Very low36.2Very low143 Ų143138.4 Ų138.477%0.76578%0.778SS**  cis-162.6146.45.9-143.39.2000116.6
376V34.7Very low37.1Very low124 Ų124137.5 Ų137.575%0.75278%0.78SS**  trans38.8128.7139.2166.80000126.4
377A34Very low37.3Very low75 Ų75132.4 Ų132.462%0.6278%0.78SS**  trans77.6118.214400000125.7
378R32.8Very low37.3Very low225 Ų225132.2 Ų132.285%0.84978%0.784SS**  59.8134.1128.5-60.4174-178.9162.81121
379H33.1Very low37.3Very low183 Ų183134 Ų13485%0.84778%0.783SS**  -177.6167.3103.4-100.3-79.3000112.4
380S35.3Very low37.1Very low113 Ų113135.2 Ų135.279%0.7979%0.786SS**  trans-127.7175.3-171.1-53.40000111.2
381P52Low36.4Very low122 Ų122138.2 Ų138.279%0.79279%0.788SS**  trans-95176.5-147.539.6-40.8000116.8
382P47.9Very low36.1Very low127 Ų127139.5 Ų139.583%0.82578%0.784SS**  trans-106.1153.216538.1-30.1000114.6
383E34.5Very low36.2Very low188 Ų188143.8 Ų143.888%0.87979%0.789SS**  trans-98.4164.3165-77.1-175.389.400112.3
384A32.5Very low37Very low98 Ų98140.6 Ų140.681%0.8178%0.777SS**  trans-152.7128.3159.700000113.8
385H35.1Very low37Very low177 Ų177146.1 Ų146.182%0.81979%0.785SS**  trans-108.4-174.7164.7-94.8-27.6000108.5
386P52.9Low37.1Very low113 Ų113144.1 Ų144.173%0.73479%0.788SS**  cis-145.9-179.614.144.8-25.6000118.9
387A34.6Very low36.7Very low93 Ų93141.7 Ų141.777%0.76979%0.789SS**  trans69.4165.7150.200000118.9
388N32.3Very low36.6Very low126 Ų126149.1 Ų149.167%0.67480%0.803SS**  cis-163.1138.719.9-166.816000114.7
389R32Very low37.6Very low221 Ų221143.3 Ų143.383%0.83479%0.794SS**  trans58.3164.4158.5-75.8164-168.3-154.81.2118.5
390T34.1Very low37.7Very low130 Ų130143.7 Ų143.780%0.79880%0.796SS**  cis-140.7178.416.3-36.60000113
391K35.5Very low37.6Very low176 Ų176145.7 Ų145.777%0.76580%0.798SS**  trans-77-173.7-179.5-45.7168.9-173.8172.30112.6
392E31Very low36.6Very low170 Ų170143.6 Ų143.679%0.79480%0.798SS**  cis-151.3173.232.9-70.5-163.9145.200116.2
393L33Very low35.9Very low161 Ų161146.7 Ų146.784%0.84380%0.802SS**  trans-124.3168.6170.4-98.3157.3000106.4
394P52.7Low35.8Very low100 Ų100144.1 Ų144.165%0.64979%0.79SS**  cis-160.1-176.443.145.6-23.7000119.7
395K35.4Very low35.9Very low204 Ų204149.6 Ų149.689%0.88779%0.789SS**  trans64.8155.8147.1-79171.5177.3-178.70119.6
396A32.9Very low35.9Very low100 Ų100144.7 Ų144.783%0.82679%0.787SS**  cis-163.3161-14.800000110.8
397G28.1Very low35.1Very low74 Ų74147.9 Ų147.976%0.76379%0.792SS**  trans164.4121.4166.900000115.5
398Y31.5Very low35.4Very low231 Ų231149.4 Ų149.491%0.90679%0.794SS**  trans-158167.9175.4-97.7-64.9000107.1
399P53.8Low35.6Very low103 Ų103149 Ų14967%0.66980%0.796SS**  cis-127.4-178-26.440.6-26.7000111.9
400Q34Very low35.7Very low190 Ų190149.4 Ų149.489%0.88880%0.797SS**  trans-155.4149.6141-157.1160.711.600111.1
401D33Very low35.7Very low156 Ų156151.9 Ų151.983%0.83480%0.8SS**  trans-88.4162.4-167.7-50.3-89.9000114.8
402G31.3Very low35.5Very low77 Ų77150.2 Ų150.279%0.79480%0.798SS**  trans173.6122.8171.800000115.4
403E33.4Very low35.8Very low192 Ų192150.1 Ų150.190%0.89780%0.798SS**  trans-65168.6174.3-58.2156103.200112.7
404E33.7Very low35.9Very low135 Ų135149.9 Ų149.963%0.63179%0.794SS**  cis-153.6167.2-0.1-145.4-151.6137.300110.3
405R34.4Very low35Very low212 Ų212150.6 Ų150.680%0.880%0.802SS**  trans37.4113.9144.2-173.6-172-57.1-112-5.7120.8
406G34.6Very low35Very low74 Ų74148.6 Ų148.676%0.76380%0.801SS**  trans158.7102.2148.500000117.3
407Q36.9Very low35.1Very low181 Ų181147.3 Ų147.385%0.84680%0.797SS**  trans-100.2137.3169.2-66.5-175.98.500112.2
408P39.2Very low35.4Very low124 Ų124154.9 Ų154.981%0.80580%0.803SS**  trans-105.7126.7148.633.3-26.1000110.6R410P408-R410 PolarHBondContact O-N 3.38Å
409V36.7Very low35.6Very low118 Ų118152.8 Ų152.872%0.71580%0.802SS**  trans-87.1109-173.6176.90000112.4
410R34.6Very low35Very low230 Ų230162.2 Ų162.287%0.86882%0.824SS**  trans37.8102.4146.1-63.9-179174.4167.4-1.8118.5P408P408-R410 PolarHBondContact O-N 3.38Å
411Q33.1Very low35Very low181 Ų181160.9 Ų160.985%0.84682%0.821SS**  trans-64.8139.9140178.4176.6-18.700109.3
412L33Very low35.1Very low141 Ų141161.1 Ų161.174%0.73882%0.82SS**  trans-123106.7178.9-178.864.7000110.3M414L412-M414 HydrophobicContact CD1-CG 4.13Å; L412-M414 HydrophobicContact CD1-SD 4.39Å; L412-M414 HydrophobicContact CD2-CG 4.5Å; L412-M414 HydrophobicContact CD2-SD 4.12Å; L412-M414 HydrophobicContact CG-CG 4.1Å; L412-M414 HydrophobicContact CG-SD 4.35Å
413E36.6Very low35.3Very low168 Ų168165.8 Ų165.879%0.78582%0.821SS**  trans-84.7134.2164.2-72.1-170.493.300110.1
414M34.7Very low35.5Very low156 Ų156164.2 Ų164.277%0.76882%0.817SS**  trans-141.279.8167.5-69.5-170.972.600110.9L412L412-M414 HydrophobicContact CD1-CG 4.13Å; L412-M414 HydrophobicContact CD1-SD 4.39Å; L412-M414 HydrophobicContact CD2-CG 4.5Å; L412-M414 HydrophobicContact CD2-SD 4.12Å; L412-M414 HydrophobicContact CG-CG 4.1Å; L412-M414 HydrophobicContact CG-SD 4.35Å
415S33.7Very low35.6Very low116 Ų116166.1 Ų166.181%0.81183%0.828SS**  trans30.9122.2142.5-47.60000120.9
416D35.7Very low35.6Very low161 Ų161163 Ų16386%0.86183%0.83SS**  trans-58.7140.1155.1-85.6-63.6000111.7
417G34.3Very low35.7Very low73 Ų73169.4 Ų169.475%0.75384%0.835SS**  trans-135112.7174.700000112.3
418W34.4Very low35.6Very low234 Ų234168.5 Ų168.589%0.88683%0.834SS**  trans-102.5109.9178.1-87.373.3000112.1
419Q37.3Very low35.3Very low187 Ų187172.2 Ų172.287%0.87484%0.837SS**  trans174.7145.4152.5-98.2150.673.700108
420R39.8Very low35.2Very low301 Ų301177.1 Ų177.1100%1.13685%0.848SS**  cis-13301.2167.7-179.2-71.4-138.7-1.2109.3

Retrieved 420 of 420 residues in 200.1 ms (Link to these results)