A0A060X3E9_ONCMY Loading...

Cyclic AMP-dependent transcription factor ATF-2

Transcriptional activator which regulates the transcription of various genes, including those involved in anti-apoptosis, cell growth, and DNA damage response. Dependent on its binding partner, binds to CRE (cAMP response element) consensus sequences (5'-TGACGTCA-3') or to AP-1 (activator protein 1) consensus sequences (5'-TGACTCA-3').

AlphaFold DB , UniProt , Accession A0A060X3E9, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 499 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
1M43.8Very low73.9Confident236 Ų23695.3 Ų95.3100%1.16354%0.542SS*.  0117.60-62.4-54.7-174.400106.4
2S48.1Very low74.7Confident99 Ų9996.8 Ų96.869%0.69256%0.558SS**  trans-75.3128.3179-46.20000109.3D4S2-D4 WeakPolarHBondContact CB-OD2 3.45Å; S2-D4 PolarHBondContact O-N 3.07Å
3D59.8Low75.1Confident148 Ų14896.4 Ų96.479%0.79159%0.588SS**  trans-74.452.8165.8-81.2-67.3000110.5K5D3-K5 PolarHBondContact O-N 3.32Å; D3-K5 VanDerWaalsContact O-N 3.12Å
4D70.2Confident76Confident123 Ų12391.7 Ų91.766%0.65856%0.561SS**  trans-67.2113.9175.9-85.3-55.6000108.8S2 P6S2-D4 WeakPolarHBondContact CB-OD2 3.45Å; S2-D4 PolarHBondContact O-N 3.07Å; D4-P6 VanDerWaalsContact C-CD 3.4Å; D4-P6 WeakPolarHBondContact O-CD 3.39Å
5K79.3Confident76.5Confident91 Ų9189.6 Ų89.640%0.39657%0.565SS.*  trans-105.780173.4-67.3-179.4-173.6-179.10107.5D3 F7 R17 F18 T19D3-K5 PolarHBondContact O-N 3.32Å; D3-K5 VanDerWaalsContact O-N 3.12Å; K5-F7 VanDerWaalsContact C-N 3.26Å; K5-F7 PolarHBondContact O-N 3.17Å; K5-R17 HydrophobicContact CB-CB 3.68Å; K5-R17 HydrophobicContact CD-CB 4.39Å; K5-F18 CarbonylContact C-O 3.6Å; K5-F18 VanDerWaalsContact CA-O 3.31Å; K5-F18 WeakPolarHBondContact CA-O 3.1Å; K5-F18 WeakPolarHBondContact CB-O 3.47Å; K5-T19 HydrophobicContact CD-CG2 4.28Å; K5-T19 HydrophobicContact CG-CG2 3.84Å
6P82.4Confident77.1Confident86 Ų8689.9 Ų89.956%0.55856%0.557SS**  trans-71.4-21.7-170.929.2-36.3000112.6D4 L8D4-P6 VanDerWaalsContact C-CD 3.4Å; D4-P6 WeakPolarHBondContact O-CD 3.39Å; P6-L8 PolarHBondContact O-N 3.11Å
7F84.7Confident77.8Confident62 Ų6293.9 Ų93.927%0.27256%0.559SS.*EExtended strand (participates in β ladder)trans-85.3107.7-175.4-59-76.6000111K5 R17 F18 T19 N20 E21 L24K5-F7 VanDerWaalsContact C-N 3.26Å; K5-F7 PolarHBondContact O-N 3.17Å; F7-R17 CarbonylContact O-C 3.6Å; F7-R17 WeakPolarHBondContact O-CA 3.39Å; F7-F18 HydrophobicContact CB-CB 4.25Å; F7-F18 PolarHBondContact N-O 2.65Å; F7-F18 PolarHBondContact O-N 3.46Å; F7-T19 WeakPolarHBondContact CD2-O 3.36Å; F7-T19 WeakPolarHBondContact CE2-O 3.38Å; F7-N20 VanDerWaalsContact CD2-C 3.47Å; F7-E21 HydrophobicContact CD1-CB 3.83Å; F7-E21 HydrophobicContact CD1-CG 4.17Å; F7-E21 HydrophobicContact CE1-CB 3.65Å; F7-E21 HydrophobicContact CE1-CG 4.18Å; F7-E21 HydrophobicContact CG-CB 4.37Å; F7-E21 HydrophobicContact CZ-CB 4.03Å; F7-L24 HydrophobicContact CB-CB 4.15Å; F7-L24 HydrophobicContact CB-CD2 3.84Å
8L88.1Confident78.4Confident77 Ų7790.5 Ų90.540%0.40354%0.536SS..EExtended strand (participates in β ladder)trans-105139.1-176.3-51.7-177000112.2P6 A10 R17 L24P6-L8 PolarHBondContact O-N 3.11Å; L8-A10 PolarHBondContact O-N 3.5Å; L8-R17 HydrophobicContact CD2-CB 3.82Å; L8-R17 HydrophobicContact CD2-CG 3.39Å; L8-R17 VanDerWaalsContact CD2-CZ 3.46Å; L8-L24 WeakPolarHBondContact O-CD2 3.49Å
9C88.8Confident79Confident9 Ų989.1 Ų89.16%0.06153%0.529CS..  trans-76.6108.2169.4-1680000111.1A11 C14 Q16 F18 L24 H27C9-A11 PolarHBondContact O-N 3.47Å; C9-C14 HydrophobicContact CB-CB 4.31Å; C9-Q16 PolarHBondContact N-O 3.1Å; C9-F18 HydrophobicContact CB-CE2 4.49Å; C9-L24 HydrophobicContact CB-CD1 3.83Å; C9-H27 VanDerWaalsContact SG-CD2 3.54Å
10A85.9Confident79.4Confident95 Ų9588.7 Ų88.779%0.78552%0.524SS*.  trans-73.34.2176.700000114.5L8L8-A10 PolarHBondContact O-N 3.5Å
11A81.9Confident79.9Confident22 Ų2289.9 Ų89.918%0.18252%0.524CS..SBendtrans-67.4130.6176.400000110.5C9 G13 C14C9-A11 PolarHBondContact O-N 3.47Å; A11-G13 PolarHBondContact O-N 2.63Å; A11-C14 HydrophobicContact CB-CB 3.91Å; A11-C14 VanDerWaalsContact O-CB 3.31Å; A11-C14 WeakPolarHBondContact O-CB 3.38Å; A11-C14 PolarHBondContact O-N 3.02Å
12P84.1Confident82.1Confident113 Ų11384.4 Ų84.473%0.73450%0.499SS*.THydrogen-bonded Turntrans-53.1125.2-179.7-28.635.1000112.3C14P12-C14 VanDerWaalsContact C-N 3.33Å; P12-C14 PolarHBondContact O-N 3.18Å
13G79.3Confident84.1Confident92 Ų9284.6 Ų84.695%0.94849%0.489SS*.THydrogen-bonded Turntrans79.21.5-179.200000116.2A11A11-G13 PolarHBondContact O-N 2.63Å
14C87.5Confident85.5Confident31 Ų3177.9 Ų77.921%0.20945%0.453CS..THydrogen-bonded Turntrans-86.5-54.2-176.3-174.60000114.6C9 A11 P12 Q16 H27 H31C9-C14 HydrophobicContact CB-CB 4.31Å; A11-C14 HydrophobicContact CB-CB 3.91Å; A11-C14 VanDerWaalsContact O-CB 3.31Å; A11-C14 WeakPolarHBondContact O-CB 3.38Å; A11-C14 PolarHBondContact O-N 3.02Å; P12-C14 VanDerWaalsContact C-N 3.33Å; P12-C14 PolarHBondContact O-N 3.18Å; C14-Q16 PolarHBondContact O-N 3.34Å; C14-H27 PolarHBondContact SG-NE2 3.16Å; C14-H31 VanDerWaalsContact SG-CE1 3.58Å; C14-H31 PolarHBondContact SG-NE2 3.12Å
15G83.3Confident86.4Confident60 Ų6074.4 Ų74.462%0.61944%0.442SS*.  trans63.40.8174.800000117.5
16Q86.3Confident86.8Confident94 Ų9475.5 Ų75.544%0.43946%0.456SS..  trans-68.2140-176.7-68-158.9-15.400112.5C9 C14 F18 H27C9-Q16 PolarHBondContact N-O 3.1Å; C14-Q16 PolarHBondContact O-N 3.34Å; Q16-F18 HydrophobicContact CB-CE2 3.75Å; Q16-F18 HydrophobicContact CB-CZ 3.77Å; Q16-H27 PolarHBondContact OE1-CE1 2.9Å; Q16-H27 PolarHBondContact OE1-ND1 3.38Å
17R89.3Confident87.1Confident159 Ų15972.2 Ų72.260%0.643%0.433SS*.EExtended strand (participates in β ladder)trans-114.3136.8-179.3-44.2-156.3160.3-139.3-3.7110.9K5 F7 L8K5-R17 HydrophobicContact CB-CB 3.68Å; K5-R17 HydrophobicContact CD-CB 4.39Å; F7-R17 CarbonylContact O-C 3.6Å; F7-R17 WeakPolarHBondContact O-CA 3.39Å; L8-R17 HydrophobicContact CD2-CB 3.82Å; L8-R17 HydrophobicContact CD2-CG 3.39Å; L8-R17 VanDerWaalsContact CD2-CZ 3.46Å
18F88.6Confident87.1Confident32 Ų3274 Ų7414%0.1444%0.441CS..EExtended strand (participates in β ladder)trans-123.5147.9-178-58.8-82.5000110.9K5 F7 C9 Q16 N20 H23 L24 H27K5-F18 CarbonylContact C-O 3.6Å; K5-F18 VanDerWaalsContact CA-O 3.31Å; K5-F18 WeakPolarHBondContact CA-O 3.1Å; K5-F18 WeakPolarHBondContact CB-O 3.47Å; F7-F18 HydrophobicContact CB-CB 4.25Å; F7-F18 PolarHBondContact N-O 2.65Å; F7-F18 PolarHBondContact O-N 3.46Å; C9-F18 HydrophobicContact CB-CE2 4.49Å; Q16-F18 HydrophobicContact CB-CE2 3.75Å; Q16-F18 HydrophobicContact CB-CZ 3.77Å; F18-N20 VanDerWaalsContact C-N 3.34Å; F18-H23 HydrophobicContact CB-CB 4.04Å; F18-H23 HydrophobicContact CD1-CB 3.65Å; F18-H23 HydrophobicContact CG-CB 4.09Å; F18-L24 HydrophobicContact CB-CB 4.25Å; F18-L24 HydrophobicContact CD2-CB 3.75Å; F18-L24 HydrophobicContact CD2-CD1 3.83Å; F18-L24 HydrophobicContact CD2-CG 4.38Å; F18-L24 HydrophobicContact CE2-CD1 3.98Å; F18-L24 HydrophobicContact CG-CB 4.16Å; F18-H27 HydrophobicContact CE1-CB 4.17Å; F18-H27 HydrophobicContact CE2-CB 3.96Å; F18-H27 AromaticContact CE2-CD2 3.96Å; F18-H27 AromaticContact CE2-CG 3.77Å; F18-H27 HydrophobicContact CZ-CB 3.57Å; F18-H27 AromaticContact CZ-CD2 3.98Å; F18-H27 AromaticContact CZ-CG 3.39Å; F18-H27 AromaticContact CZ-ND1 3.47Å; F18-H27 WeakPolarHBondContact CZ-ND1 3.4Å
19T90.2Very high86.9Confident64 Ų6475 Ų7539%0.39344%0.443SS..SBendtrans-71.1-32.7174.653.40000111.8K5 F7K5-T19 HydrophobicContact CD-CG2 4.28Å; K5-T19 HydrophobicContact CG-CG2 3.84Å; F7-T19 WeakPolarHBondContact CD2-O 3.36Å; F7-T19 WeakPolarHBondContact CE2-O 3.38Å
20N87.5Confident86.6Confident80 Ų8080.5 Ų80.543%0.42847%0.466SS..SBendtrans-129.1150.2-172.3-58.433.4000110F7 F18 D22 H23 L24F7-N20 VanDerWaalsContact CD2-C 3.47Å; F18-N20 VanDerWaalsContact C-N 3.34Å; N20-D22 PolarHBondContact O-N 3.2Å; N20-H23 PolarHBondContact O-N 3.35Å; N20-L24 PolarHBondContact O-N 3.38Å
21E88.3Confident86.3Confident114 Ų11478.7 Ų78.753%0.53344%0.441SS..Hα-helixtrans-65.1-37.2178.7-169.9153.3-16200113F7 H23 L24 A25F7-E21 HydrophobicContact CD1-CB 3.83Å; F7-E21 HydrophobicContact CD1-CG 4.17Å; F7-E21 HydrophobicContact CE1-CB 3.65Å; F7-E21 HydrophobicContact CE1-CG 4.18Å; F7-E21 HydrophobicContact CG-CB 4.37Å; F7-E21 HydrophobicContact CZ-CB 4.03Å; E21-H23 VanDerWaalsContact C-N 3.32Å; E21-H23 PolarHBondContact O-N 2.99Å; E21-L24 CarbonylContact O-C 3.58Å; E21-L24 WeakPolarHBondContact O-CA 3.5Å; E21-L24 WeakPolarHBondContact O-CB 3.26Å; E21-L24 PolarHBondContact O-N 3.32Å; E21-A25 PolarHBondContact O-N 2.93Å
22D89.8Confident85.8Confident121 Ų12184.1 Ų84.165%0.64746%0.463SS*.Hα-helixtrans-57.6-42.2177.3-70.4-23.3000112.8N20 L24 A25 V26N20-D22 PolarHBondContact O-N 3.2Å; D22-L24 VanDerWaalsContact C-N 3.28Å; D22-L24 PolarHBondContact O-N 3.4Å; D22-A25 PolarHBondContact O-N 2.98Å; D22-A25 VanDerWaalsContact O-N 3.15Å; D22-V26 WeakPolarHBondContact O-CG2 3.09Å; D22-V26 PolarHBondContact O-N 3.46Å
23H90.6Very high84.6Confident104 Ų10484.8 Ų84.848%0.48146%0.458SS..Hα-helixtrans-64.7-35.6176.7-64.7166.8000111.4F18 N20 E21 H27F18-H23 HydrophobicContact CB-CB 4.04Å; F18-H23 HydrophobicContact CD1-CB 3.65Å; F18-H23 HydrophobicContact CG-CB 4.09Å; N20-H23 PolarHBondContact O-N 3.35Å; E21-H23 VanDerWaalsContact C-N 3.32Å; E21-H23 PolarHBondContact O-N 2.99Å; H23-H27 WeakPolarHBondContact O-CB 3.43Å; H23-H27 PolarHBondContact O-N 2.92Å; H23-H27 VanDerWaalsContact O-N 3.11Å
24L89.8Confident83.8Confident6 Ų684.5 Ų84.53%0.03144%0.437CS..Hα-helixtrans-69.4-38.2171.9173.161.6000111.8F7 L8 C9 F18 N20 E21 D22 H27 K28F7-L24 HydrophobicContact CB-CB 4.15Å; F7-L24 HydrophobicContact CB-CD2 3.84Å; L8-L24 WeakPolarHBondContact O-CD2 3.49Å; C9-L24 HydrophobicContact CB-CD1 3.83Å; F18-L24 HydrophobicContact CB-CB 4.25Å; F18-L24 HydrophobicContact CD2-CB 3.75Å; F18-L24 HydrophobicContact CD2-CD1 3.83Å; F18-L24 HydrophobicContact CD2-CG 4.38Å; F18-L24 HydrophobicContact CE2-CD1 3.98Å; F18-L24 HydrophobicContact CG-CB 4.16Å; N20-L24 PolarHBondContact O-N 3.38Å; E21-L24 CarbonylContact O-C 3.58Å; E21-L24 WeakPolarHBondContact O-CA 3.5Å; E21-L24 WeakPolarHBondContact O-CB 3.26Å; E21-L24 PolarHBondContact O-N 3.32Å; D22-L24 VanDerWaalsContact C-N 3.28Å; D22-L24 PolarHBondContact O-N 3.4Å; L24-H27 CarbonylContact O-C 3.48Å; L24-H27 PolarHBondContact O-N 3.1Å; L24-K28 HydrophobicContact CD1-CD 4.35Å; L24-K28 HydrophobicContact CD1-CG 4.07Å; L24-K28 HydrophobicContact CG-CD 4.15Å; L24-K28 HydrophobicContact CG-CG 4.35Å; L24-K28 WeakPolarHBondContact O-CB 3.38Å; L24-K28 VanDerWaalsContact O-CG 3.3Å; L24-K28 WeakPolarHBondContact O-CG 3.49Å; L24-K28 PolarHBondContact O-N 3.37Å
25A89Confident82.1Confident51 Ų5188 Ų8842%0.42145%0.454SS..Hα-helixtrans-65.2-49.7179.200000111.7E21 D22 H27 K28 H29E21-A25 PolarHBondContact O-N 2.93Å; D22-A25 PolarHBondContact O-N 2.98Å; D22-A25 VanDerWaalsContact O-N 3.15Å; A25-H27 VanDerWaalsContact C-N 3.25Å; A25-H27 PolarHBondContact O-N 3.48Å; A25-K28 WeakPolarHBondContact O-CB 3.48Å; A25-K28 PolarHBondContact O-N 3.19Å; A25-K28 VanDerWaalsContact O-N 3.15Å; A25-H29 PolarHBondContact O-N 2.94Å; A25-H29 VanDerWaalsContact O-N 3.08Å
26V87.1Confident80.9Confident114 Ų11492.6 Ų92.669%0.69146%0.457SS*.Hα-helixtrans-59-39.3173.5175.30000110.9D22 H29 K30D22-V26 WeakPolarHBondContact O-CG2 3.09Å; D22-V26 PolarHBondContact O-N 3.46Å; V26-H29 PolarHBondContact O-N 3.38Å; V26-K30 PolarHBondContact O-N 3.42Å
27H88.5Confident79Confident17 Ų1793.8 Ų93.88%0.07946%0.46CS..Hα-helixtrans-68.6-39.1175.7178.595.7000113.3C9 C14 Q16 F18 H23 L24 A25 H29 K30 H31C9-H27 VanDerWaalsContact SG-CD2 3.54Å; C14-H27 PolarHBondContact SG-NE2 3.16Å; Q16-H27 PolarHBondContact OE1-CE1 2.9Å; Q16-H27 PolarHBondContact OE1-ND1 3.38Å; F18-H27 HydrophobicContact CE1-CB 4.17Å; F18-H27 HydrophobicContact CE2-CB 3.96Å; F18-H27 AromaticContact CE2-CD2 3.96Å; F18-H27 AromaticContact CE2-CG 3.77Å; F18-H27 HydrophobicContact CZ-CB 3.57Å; F18-H27 AromaticContact CZ-CD2 3.98Å; F18-H27 AromaticContact CZ-CG 3.39Å; F18-H27 AromaticContact CZ-ND1 3.47Å; F18-H27 WeakPolarHBondContact CZ-ND1 3.4Å; H23-H27 WeakPolarHBondContact O-CB 3.43Å; H23-H27 PolarHBondContact O-N 2.92Å; H23-H27 VanDerWaalsContact O-N 3.11Å; L24-H27 CarbonylContact O-C 3.48Å; L24-H27 PolarHBondContact O-N 3.1Å; A25-H27 VanDerWaalsContact C-N 3.25Å; A25-H27 PolarHBondContact O-N 3.48Å; H27-H29 VanDerWaalsContact C-N 3.31Å; H27-H29 PolarHBondContact O-N 2.93Å; H27-K30 VanDerWaalsContact O-CB 3.28Å; H27-K30 WeakPolarHBondContact O-CB 3.34Å; H27-K30 PolarHBondContact O-N 3.41Å; H27-K30 VanDerWaalsContact O-N 3.09Å; H27-H31 AromaticContact CD2-CD2 3.78Å; H27-H31 AromaticContact CD2-NE2 3.56Å; H27-H31 AromaticContact CE1-NE2 3.83Å; H27-H31 AromaticContact NE2-CD2 3.62Å; H27-H31 AromaticContact NE2-NE2 2.92Å; H27-H31 PolarHBondContact NE2-NE2 3.17Å; H27-H31 PolarHBondContact O-CD2 3.11Å
28K85.9Confident77Confident100 Ų10088.9 Ų88.944%0.43546%0.46SS..Hα-helixtrans-59.1-42.7174.8-80.6169.7176173.10110.8L24 A25 K30 H31 E32L24-K28 HydrophobicContact CD1-CD 4.35Å; L24-K28 HydrophobicContact CD1-CG 4.07Å; L24-K28 HydrophobicContact CG-CD 4.15Å; L24-K28 HydrophobicContact CG-CG 4.35Å; L24-K28 WeakPolarHBondContact O-CB 3.38Å; L24-K28 VanDerWaalsContact O-CG 3.3Å; L24-K28 WeakPolarHBondContact O-CG 3.49Å; L24-K28 PolarHBondContact O-N 3.37Å; A25-K28 WeakPolarHBondContact O-CB 3.48Å; A25-K28 PolarHBondContact O-N 3.19Å; A25-K28 VanDerWaalsContact O-N 3.15Å; K28-K30 PolarHBondContact O-N 3.3Å; K28-H31 WeakPolarHBondContact O-CB 3.22Å; K28-H31 PolarHBondContact O-N 2.87Å; K28-E32 PolarHBondContact O-N 3.05Å
29H83.8Confident74.9Confident98 Ų9893.9 Ų93.945%0.45450%0.495SS..Hα-helixtrans-61.2-27.5176.1-164.259.9000113A25 V26 H27 H31 E32 M33A25-H29 PolarHBondContact O-N 2.94Å; A25-H29 VanDerWaalsContact O-N 3.08Å; V26-H29 PolarHBondContact O-N 3.38Å; H27-H29 VanDerWaalsContact C-N 3.31Å; H27-H29 PolarHBondContact O-N 2.93Å; H29-H31 VanDerWaalsContact C-N 3.32Å; H29-H31 PolarHBondContact O-N 3.45Å; H29-E32 IonicContact CE1-OE2 2.85Å; H29-E32 IonicContact CG-OE2 2.68Å; H29-E32 IonicContact ND1-OE2 2.93Å; H29-E32 PolarHBondContact ND1-OE2 3.01Å; H29-E32 WeakPolarHBondContact O-CB 3.23Å; H29-E32 PolarHBondContact O-N 2.94Å; H29-M33 WeakPolarHBondContact CE1-CE 3.38Å; H29-M33 WeakPolarHBondContact O-CG 3.25Å; H29-M33 PolarHBondContact O-N 2.94Å
30K81.6Confident72.6Confident124 Ų12495.3 Ų95.354%0.53951%0.514SS..Hα-helixtrans-66.7-30.5172.1-163176.566.7174.50113.1V26 H27 K28 T34V26-K30 PolarHBondContact O-N 3.42Å; H27-K30 VanDerWaalsContact O-CB 3.28Å; H27-K30 WeakPolarHBondContact O-CB 3.34Å; H27-K30 PolarHBondContact O-N 3.41Å; H27-K30 VanDerWaalsContact O-N 3.09Å; K28-K30 PolarHBondContact O-N 3.3Å; K30-T34 WeakPolarHBondContact O-CB 3.23Å; K30-T34 PolarHBondContact O-N 3.05Å; K30-T34 PolarHBondContact O-OG1 3.26Å
31H78.9Confident70.5Confident56 Ų56102.5 Ų102.526%0.25954%0.535SS..Hα-helixtrans-74.4-33.2172.2-68.5-82.7000112.2C14 H27 K28 H29 T34C14-H31 VanDerWaalsContact SG-CE1 3.58Å; C14-H31 PolarHBondContact SG-NE2 3.12Å; H27-H31 AromaticContact CD2-CD2 3.78Å; H27-H31 AromaticContact CD2-NE2 3.56Å; H27-H31 AromaticContact CE1-NE2 3.83Å; H27-H31 AromaticContact NE2-CD2 3.62Å; H27-H31 AromaticContact NE2-NE2 2.92Å; H27-H31 PolarHBondContact NE2-NE2 3.17Å; H27-H31 PolarHBondContact O-CD2 3.11Å; K28-H31 WeakPolarHBondContact O-CB 3.22Å; K28-H31 PolarHBondContact O-N 2.87Å; H29-H31 VanDerWaalsContact C-N 3.32Å; H29-H31 PolarHBondContact O-N 3.45Å; H31-T34 PolarHBondContact O-N 3.23Å
32E72.7Confident68.5Low136 Ų136103 Ų10364%0.63654%0.541SS*.Hα-helixtrans-65.3-41.9175.1-169.2-179-177.800111.4K28 H29 T34K28-E32 PolarHBondContact O-N 3.05Å; H29-E32 IonicContact CE1-OE2 2.85Å; H29-E32 IonicContact CG-OE2 2.68Å; H29-E32 IonicContact ND1-OE2 2.93Å; H29-E32 PolarHBondContact ND1-OE2 3.01Å; H29-E32 WeakPolarHBondContact O-CB 3.23Å; H29-E32 PolarHBondContact O-N 2.94Å; E32-T34 VanDerWaalsContact C-N 3.32Å; E32-T34 PolarHBondContact O-N 3.2Å
33M59.3Low66.2Low128 Ų128104.4 Ų104.463%0.63155%0.549SS*.SBendtrans-84-1178.5-62.8-60.1146.400114.5H29H29-M33 WeakPolarHBondContact CE1-CE 3.38Å; H29-M33 WeakPolarHBondContact O-CG 3.25Å; H29-M33 PolarHBondContact O-N 2.94Å
34T61.6Low63.8Low85 Ų85104.5 Ų104.552%0.52156%0.561SS.*SBendtrans-100.9101.8174.1-57.80000109.4K30 H31 E32 K36K30-T34 WeakPolarHBondContact O-CB 3.23Å; K30-T34 PolarHBondContact O-N 3.05Å; K30-T34 PolarHBondContact O-OG1 3.26Å; H31-T34 PolarHBondContact O-N 3.23Å; E32-T34 VanDerWaalsContact C-N 3.32Å; E32-T34 PolarHBondContact O-N 3.2Å; T34-K36 PolarHBondContact O-N 3.48Å
35L52.2Low61.6Low105 Ų105110.5 Ų110.555%0.5560%0.598SS.*  trans-50124.7172.1-71.1173000110F37L35-F37 VanDerWaalsContact C-N 3.29Å; L35-F37 HydrophobicContact CB-CD2 4.35Å; L35-F37 HydrophobicContact CB-CE2 3.78Å; L35-F37 HydrophobicContact CB-CZ 4.21Å; L35-F37 HydrophobicContact CD1-CZ 4.39Å; L35-F37 VanDerWaalsContact O-CD2 3.23Å; L35-F37 WeakPolarHBondContact O-CD2 3.44Å; L35-F37 PolarHBondContact O-N 3.12Å
36K57.8Low59.5Low157 Ų157115.5 Ų115.568%0.68362%0.616SS**  trans-77.278.5-176.5-69.2-145.6172.8-167.10111.8T34 G38T34-K36 PolarHBondContact O-N 3.48Å; K36-G38 PolarHBondContact O-N 2.93Å
37F47.2Very low57.3Low118 Ų118115.2 Ų115.252%0.51861%0.614SS.*  trans-62.2127158.5-58.7-77000108.4L35 V64L35-F37 VanDerWaalsContact C-N 3.29Å; L35-F37 HydrophobicContact CB-CD2 4.35Å; L35-F37 HydrophobicContact CB-CE2 3.78Å; L35-F37 HydrophobicContact CB-CZ 4.21Å; L35-F37 HydrophobicContact CD1-CZ 4.39Å; L35-F37 VanDerWaalsContact O-CD2 3.23Å; L35-F37 WeakPolarHBondContact O-CD2 3.44Å; L35-F37 PolarHBondContact O-N 3.12Å; F37-V64 HydrophobicContact CD1-CG1 4.21Å; F37-V64 HydrophobicContact CE1-CG1 4.02Å; F37-V64 HydrophobicContact CE1-CG2 4.27Å
38G46.1Very low55.2Low57 Ų57119.1 Ų119.159%0.58865%0.649SS**  trans-61.1170.2175.600000111.9K36 A40K36-G38 PolarHBondContact O-N 2.93Å; G38-A40 PolarHBondContact O-N 3.42Å
39P44.6Very low53.3Low136 Ų136121.1 Ų121.188%0.88367%0.665SS**  trans-53.2104.4-175.4-26.335.2000111.8R41P39-R41 PolarHBondContact O-N 2.95Å
40A43.1Very low51.4Low95 Ų95124 Ų12479%0.78568%0.678SS**PPolyproline II helixtrans-61.2132.4173.400000107.7G38 D42G38-A40 PolarHBondContact O-N 3.42Å; A40-D42 PolarHBondContact O-N 3.23Å
41R43.2Very low50Low230 Ų230124.1 Ų124.187%0.86869%0.69SS**PPolyproline II helixtrans-56.9140.9175.9-59.3-175.270-174.61.5108.5P39P39-R41 PolarHBondContact O-N 2.95Å
42D46.5Very low48.7Very low124 Ų124123.9 Ų123.966%0.66369%0.693SS**SBendtrans-51.7160.8-176.553.3-44.2000113.2A40A40-D42 PolarHBondContact O-N 3.23Å
43N40.1Very low48.1Very low152 Ų152122.1 Ų122.181%0.81369%0.692SS**  trans91.138.1178.5-45.4-63000117.5
44S39.8Very low48.1Very low105 Ų105120.3 Ų120.373%0.73469%0.69SS**  trans-136.2122.9149-153.90000111.8I46S44-I46 PolarHBondContact O-N 3.32Å; S44-I46 VanDerWaalsContact O-N 3.15Å
45V44.2Very low48.1Very low132 Ų132121.4 Ų121.480%0.870%0.696SS**  trans-63.4111.9178174.90000109V47V45-V47 HydrophobicContact CG1-CG2 4.27Å; V45-V47 PolarHBondContact O-N 3.37Å
46I45.3Very low48.9Very low156 Ų156123.9 Ų123.980%0.870%0.698SS**  trans-76.485.4-175.1-50177.6000109.9S44 A48S44-I46 PolarHBondContact O-N 3.32Å; S44-I46 VanDerWaalsContact O-N 3.15Å; I46-A48 PolarHBondContact O-N 3Å
47V40Very low49.3Very low109 Ų109121 Ų12166%0.66169%0.686SS**  trans-80.8100.8164.7-177.60000108V45 D49V45-V47 HydrophobicContact CG1-CG2 4.27Å; V45-V47 PolarHBondContact O-N 3.37Å; V47-D49 PolarHBondContact O-N 2.92Å
48A46.4Very low50.5Low99 Ų99119.9 Ų119.982%0.81869%0.685SS**SBendtrans-77.329.1-168.300000115.7I46I46-A48 PolarHBondContact O-N 3Å
49D45.4Very low51.5Low142 Ų142123.5 Ų123.576%0.75969%0.685SS**  trans-136.444.4-176.4-164.230.4000112.8V47V47-D49 PolarHBondContact O-N 2.92Å
50Q44.1Very low52.6Low158 Ų158119.8 Ų119.874%0.73866%0.657SS**  trans-125.299.8167.1-75.2-75.85.300108P52Q50-P52 WeakPolarHBondContact O-CD 3.38Å
51T51.7Low53.8Low127 Ų127115.7 Ų115.778%0.77962%0.623SS**  trans-56.5110.3160.6-45.70000106.5T53T51-T53 PolarHBondContact O-N 3.43Å; T51-T53 VanDerWaalsContact O-N 3.14Å
52P50.9Low55.1Low51 Ų51111.2 Ų111.233%0.33161%0.611SS.*  trans-62.1126.8-175.325.1-32.4000107.7Q50 R56 F57Q50-P52 WeakPolarHBondContact O-CD 3.38Å; P52-R56 HydrophobicContact CB-CB 4.32Å; P52-R56 HydrophobicContact CB-CG 4.47Å; P52-F57 HydrophobicContact CG-CB 4.27Å; P52-F57 HydrophobicContact CG-CD2 4.45Å
53T60.1Low56.1Low98 Ų98112.6 Ų112.660%0.60161%0.614SS**  trans-43.8133172.2-41.80000108T51 T55 R56 F57T51-T53 PolarHBondContact O-N 3.43Å; T51-T53 VanDerWaalsContact O-N 3.14Å; T53-T55 PolarHBondContact O-N 2.94Å; T53-R56 WeakPolarHBondContact O-CA 3.49Å; T53-R56 WeakPolarHBondContact O-CB 3.46Å; T53-R56 PolarHBondContact O-N 2.92Å; T53-F57 PolarHBondContact O-N 3.5Å
54P60.8Low57.4Low91 Ų91109.1 Ų109.159%0.59160%0.598SS**Hα-helixtrans-51.4-33.6-16812.2-28.3000113.4R56 F57 L58P54-R56 VanDerWaalsContact C-N 3.33Å; P54-R56 PolarHBondContact O-N 3.43Å; P54-F57 PolarHBondContact O-N 3.33Å; P54-F57 VanDerWaalsContact O-N 3.15Å; P54-L58 HydrophobicContact CB-CD1 4.44Å; P54-L58 WeakPolarHBondContact O-CD1 3.46Å; P54-L58 PolarHBondContact O-N 3.3Å
55T61.4Low58.5Low108 Ų108105.9 Ų105.966%0.66358%0.581SS**Hα-helixtrans-54.6-39.3171.7-28.50000114.7T53 K59T53-T55 PolarHBondContact O-N 2.94Å; T55-K59 WeakPolarHBondContact O-CB 3.17Å; T55-K59 PolarHBondContact O-N 3.28Å; T55-K59 VanDerWaalsContact O-N 3.11Å
56R68.1Low59.4Low157 Ų157104.1 Ų104.159%0.59257%0.567SS**Hα-helixtrans-75.3-35.9176.2-174.7176.7-175.5-109.3-1.1111.5P52 T53 P54 N60P52-R56 HydrophobicContact CB-CB 4.32Å; P52-R56 HydrophobicContact CB-CG 4.47Å; T53-R56 WeakPolarHBondContact O-CA 3.49Å; T53-R56 WeakPolarHBondContact O-CB 3.46Å; T53-R56 PolarHBondContact O-N 2.92Å; P54-R56 VanDerWaalsContact C-N 3.33Å; P54-R56 PolarHBondContact O-N 3.43Å; R56-N60 WeakPolarHBondContact O-CB 3.34Å; R56-N60 PolarHBondContact O-N 3.27Å; R56-N60 PolarHBondContact O-OD1 3.36Å
57F67Low59.8Low97 Ų97101.1 Ų101.143%0.42555%0.548SS..Hα-helixtrans-64.5-49.7174.1-177.7-98.5000111P52 T53 P54 K59 N60 C61P52-F57 HydrophobicContact CG-CB 4.27Å; P52-F57 HydrophobicContact CG-CD2 4.45Å; T53-F57 PolarHBondContact O-N 3.5Å; P54-F57 PolarHBondContact O-N 3.33Å; P54-F57 VanDerWaalsContact O-N 3.15Å; F57-K59 VanDerWaalsContact C-N 3.33Å; F57-K59 PolarHBondContact O-N 3.07Å; F57-N60 PolarHBondContact O-N 2.89Å; F57-C61 VanDerWaalsContact CE1-SG 3.6Å; F57-C61 PolarHBondContact O-N 3.01Å; F57-C61 PolarHBondContact O-SG 2.91Å
58L72.4Confident60.8Low93 Ų93102.1 Ų102.149%0.48755%0.55SS..Hα-helixtrans-58.6-42.5176-86.891.1000112.1P54 C61 E62P54-L58 HydrophobicContact CB-CD1 4.44Å; P54-L58 WeakPolarHBondContact O-CD1 3.46Å; P54-L58 PolarHBondContact O-N 3.3Å; L58-C61 WeakPolarHBondContact O-CB 3.32Å; L58-C61 PolarHBondContact O-N 3.01Å; L58-E62 WeakPolarHBondContact O-CB 3.48Å; L58-E62 PolarHBondContact O-N 3.08Å
59K67.6Low61.2Low134 Ų134106 Ų10658%0.58355%0.551SS**Hα-helixtrans-63.9-40.5176.9-171.3175.6-179.6-178.40112.6T55 F57 C61 E62 E63T55-K59 WeakPolarHBondContact O-CB 3.17Å; T55-K59 PolarHBondContact O-N 3.28Å; T55-K59 VanDerWaalsContact O-N 3.11Å; F57-K59 VanDerWaalsContact C-N 3.33Å; F57-K59 PolarHBondContact O-N 3.07Å; K59-C61 VanDerWaalsContact C-N 3.32Å; K59-C61 PolarHBondContact O-N 3.36Å; K59-E62 WeakPolarHBondContact O-CB 3.47Å; K59-E62 PolarHBondContact O-N 3.36Å; K59-E63 WeakPolarHBondContact O-CB 3.31Å; K59-E63 PolarHBondContact O-N 3.18Å
60N67Low61.4Low58 Ų58105.3 Ų105.331%0.3155%0.547SS..Hα-helixtrans-66-35174-75.927.1000111.7R56 F57 E63 V64R56-N60 WeakPolarHBondContact O-CB 3.34Å; R56-N60 PolarHBondContact O-N 3.27Å; R56-N60 PolarHBondContact O-OD1 3.36Å; F57-N60 PolarHBondContact O-N 2.89Å; N60-E63 PolarHBondContact O-N 3.46Å; N60-V64 WeakPolarHBondContact O-CG2 3.23Å; N60-V64 PolarHBondContact O-N 2.96Å
61C68.6Low61.7Low9 Ų9102 Ų1026%0.06154%0.537CS..Hα-helixtrans-67.5-39174.6-690000112.5F57 L58 K59 G65 L66 F67F57-C61 VanDerWaalsContact CE1-SG 3.6Å; F57-C61 PolarHBondContact O-N 3.01Å; F57-C61 PolarHBondContact O-SG 2.91Å; L58-C61 WeakPolarHBondContact O-CB 3.32Å; L58-C61 PolarHBondContact O-N 3.01Å; K59-C61 VanDerWaalsContact C-N 3.32Å; K59-C61 PolarHBondContact O-N 3.36Å; C61-G65 PolarHBondContact O-N 2.87Å; C61-L66 HydrophobicContact CB-CB 4.32Å; C61-L66 HydrophobicContact CB-CD1 3.96Å; C61-L66 WeakPolarHBondContact O-CB 3.45Å; C61-L66 PolarHBondContact O-N 3.36Å; C61-F67 HydrophobicContact CB-CE2 3.88Å
62E69.6Low61.8Low135 Ų13598.7 Ų98.763%0.63152%0.519SS*.Hα-helixtrans-61-44.9170.5-175.9178.4-153.300111.1L58 K59 V64 G65 F67L58-E62 WeakPolarHBondContact O-CB 3.48Å; L58-E62 PolarHBondContact O-N 3.08Å; K59-E62 WeakPolarHBondContact O-CB 3.47Å; K59-E62 PolarHBondContact O-N 3.36Å; E62-V64 PolarHBondContact O-N 2.95Å; E62-G65 PolarHBondContact O-N 2.88Å; E62-F67 HydrophobicContact CB-CD2 4.27Å
63E67.1Low62Low154 Ų154100.9 Ų100.972%0.7253%0.534SS*.Hα-helixtrans-67.6-29.4179.5-168.8168.7-163.600113.9K59 N60 G65K59-E63 WeakPolarHBondContact O-CB 3.31Å; K59-E63 PolarHBondContact O-N 3.18Å; N60-E63 PolarHBondContact O-N 3.46Å; E63-G65 VanDerWaalsContact C-N 3.32Å
64V67.1Low61.2Low79 Ų79103.8 Ų103.848%0.47954%0.538SS..THydrogen-bonded Turntrans-89.911170.1-55.30000113.9F37 N60 E62 L66F37-V64 HydrophobicContact CD1-CG1 4.21Å; F37-V64 HydrophobicContact CE1-CG1 4.02Å; F37-V64 HydrophobicContact CE1-CG2 4.27Å; N60-V64 WeakPolarHBondContact O-CG2 3.23Å; N60-V64 PolarHBondContact O-N 2.96Å; E62-V64 PolarHBondContact O-N 2.95Å; V64-L66 VanDerWaalsContact C-N 3.35Å; V64-L66 HydrophobicContact CG2-CD1 3.87Å; V64-L66 HydrophobicContact CG2-CG 4.08Å; V64-L66 PolarHBondContact O-N 2.97Å
65G63.5Low60.9Low37 Ų37106.1 Ų106.138%0.38154%0.541SS..THydrogen-bonded Turntrans74.712.7171.700000116C61 E62 E63 F67 N68C61-G65 PolarHBondContact O-N 2.87Å; E62-G65 PolarHBondContact O-N 2.88Å; E63-G65 VanDerWaalsContact C-N 3.32Å; G65-F67 PolarHBondContact O-N 3.2Å; G65-F67 VanDerWaalsContact O-N 3.08Å; G65-N68 VanDerWaalsContact O-CB 3.23Å; G65-N68 WeakPolarHBondContact O-CB 3.46Å; G65-N68 PolarHBondContact O-N 3.26Å
66L62.7Low60.8Low94 Ų94107.3 Ų107.349%0.49254%0.539SS..THydrogen-bonded Turntrans-61.2-20.2-179.3-87.1163.1000114C61 V64C61-L66 HydrophobicContact CB-CB 4.32Å; C61-L66 HydrophobicContact CB-CD1 3.96Å; C61-L66 WeakPolarHBondContact O-CB 3.45Å; C61-L66 PolarHBondContact O-N 3.36Å; V64-L66 VanDerWaalsContact C-N 3.35Å; V64-L66 HydrophobicContact CG2-CD1 3.87Å; V64-L66 HydrophobicContact CG2-CG 4.08Å; V64-L66 PolarHBondContact O-N 2.97Å
67F54.9Low60.3Low93 Ų93104.9 Ų104.941%0.40854%0.538SS..THydrogen-bonded Turntrans-91.5-5.9175.2-67.5-76.9000113.7C61 E62 G65 E69 L70 T71C61-F67 HydrophobicContact CB-CE2 3.88Å; E62-F67 HydrophobicContact CB-CD2 4.27Å; G65-F67 PolarHBondContact O-N 3.2Å; G65-F67 VanDerWaalsContact O-N 3.08Å; F67-E69 VanDerWaalsContact C-N 3.28Å; F67-E69 PolarHBondContact O-N 3.3Å; F67-L70 HydrophobicContact CD1-CD1 3.75Å; F67-L70 HydrophobicContact CE1-CD1 4.14Å; F67-L70 PolarHBondContact O-N 3.44Å; F67-T71 PolarHBondContact O-N 3.04Å
68N59.6Low59.7Low130 Ų130108 Ų10870%0.69555%0.551SS**THydrogen-bonded Turntrans-72.4-20.4-177.1-154.887.6000113G65G65-N68 VanDerWaalsContact O-CB 3.23Å; G65-N68 WeakPolarHBondContact O-CB 3.46Å; G65-N68 PolarHBondContact O-N 3.26Å
69E56.5Low59.1Low180 Ų180111 Ų11184%0.84156%0.561SS**THydrogen-bonded Turntrans-83.5-18.2167.3-75.5-172.3130.900113.4F67F67-E69 VanDerWaalsContact C-N 3.28Å; F67-E69 PolarHBondContact O-N 3.3Å
70L48.8Very low58.9Low128 Ų128109.6 Ų109.667%0.6756%0.555SS**THydrogen-bonded Turntrans-89.2-12.5178-69.4170.7000112.6F67 S72F67-L70 HydrophobicContact CD1-CD1 3.75Å; F67-L70 HydrophobicContact CE1-CD1 4.14Å; F67-L70 PolarHBondContact O-N 3.44Å; L70-S72 VanDerWaalsContact C-N 3.28Å; L70-S72 PolarHBondContact O-N 3.03Å
71T50.9Low58.4Low89 Ų89110 Ų11055%0.54657%0.566SS.*SBendtrans-68.990.4161.7-54.30000108.4F67F67-T71 PolarHBondContact O-N 3.04Å
72S53.1Low58.2Low57 Ų57113.7 Ų113.740%0.39959%0.588SS.*  trans-40.9137.4-168.7-174.10000115.5L70 F74 E75L70-S72 VanDerWaalsContact C-N 3.28Å; L70-S72 PolarHBondContact O-N 3.03Å; S72-F74 PolarHBondContact O-N 3.22Å; S72-F74 PolarHBondContact OG-N 3.47Å; S72-E75 PolarHBondContact O-N 3.36Å; S72-E75 VanDerWaalsContact O-N 3.12Å
73P54.6Low57.8Low97 Ų97112.2 Ų112.263%0.6358%0.581SS**THydrogen-bonded Turntrans-48.3-26.3171.4-30.236.2000115E75 H76 D77P73-E75 VanDerWaalsContact C-N 3.28Å; P73-E75 PolarHBondContact O-N 3.45Å; P73-H76 PolarHBondContact O-N 2.99Å; P73-H76 VanDerWaalsContact O-N 3.11Å; P73-D77 PolarHBondContact O-N 3.17Å
74F44.5Very low57.4Low159 Ų159108.8 Ų108.870%0.69757%0.568SS**Hα-helixtrans-55.3-32.6177.2-88.5-96.6000114.9S72 H76 F78S72-F74 PolarHBondContact O-N 3.22Å; S72-F74 PolarHBondContact OG-N 3.47Å; F74-H76 VanDerWaalsContact C-N 3.33Å; F74-F78 PolarHBondContact O-N 2.88Å
75E54.1Low56.8Low140 Ų140111 Ų11165%0.65458%0.577SS**Hα-helixtrans-70.7-32178.6-72.1-151.6167.800112.4S72 P73 K79S72-E75 PolarHBondContact O-N 3.36Å; S72-E75 VanDerWaalsContact O-N 3.12Å; P73-E75 VanDerWaalsContact C-N 3.28Å; P73-E75 PolarHBondContact O-N 3.45Å; E75-K79 WeakPolarHBondContact O-CB 3.35Å; E75-K79 PolarHBondContact O-N 3.23Å
76H59Low56.6Low134 Ų134116.5 Ų116.562%0.6260%0.597SS**Hα-helixtrans-70-42.8179.7-170.6-89.1000111.2P73 F74 K79 K80P73-H76 PolarHBondContact O-N 2.99Å; P73-H76 VanDerWaalsContact O-N 3.11Å; F74-H76 VanDerWaalsContact C-N 3.33Å; H76-K79 PolarHBondContact O-N 3.4Å; H76-K80 WeakPolarHBondContact O-CB 3.46Å; H76-K80 PolarHBondContact O-N 3.37Å
77D57.7Low56.2Low105 Ų105118.7 Ų118.756%0.56160%0.602SS**Hα-helixtrans-66.1-40.1178.5-67.7-28.7000112.3P73 K79 K80 A81P73-D77 PolarHBondContact O-N 3.17Å; D77-K79 VanDerWaalsContact C-N 3.34Å; D77-K79 PolarHBondContact O-N 3.01Å; D77-K80 PolarHBondContact O-N 3.24Å; D77-A81 WeakPolarHBondContact O-CB 3.47Å; D77-A81 PolarHBondContact O-N 3.01Å
78F54.1Low56.1Low163 Ų163122.2 Ų122.272%0.71562%0.618SS**Hα-helixtrans-64.2-39176.8-126.3-88.4000112.6F74 T82F74-F78 PolarHBondContact O-N 2.88Å; F78-T82 PolarHBondContact O-N 3.36Å; F78-T82 PolarHBondContact O-OG1 3.4Å
79K61.1Low55.1Low157 Ų157124 Ų12468%0.68362%0.624SS**Hα-helixtrans-74.6-35.1179.4-160.3168.3-172.71750112.1E75 H76 D77 T82 E83E75-K79 WeakPolarHBondContact O-CB 3.35Å; E75-K79 PolarHBondContact O-N 3.23Å; H76-K79 PolarHBondContact O-N 3.4Å; D77-K79 VanDerWaalsContact C-N 3.34Å; D77-K79 PolarHBondContact O-N 3.01Å; K79-T82 WeakPolarHBondContact CA-OG1 3.44Å; K79-T82 PolarHBondContact O-N 2.98Å; K79-T82 PolarHBondContact O-OG1 3.47Å; K79-T82 VanDerWaalsContact O-OG1 3.1Å; K79-E83 PolarHBondContact O-N 2.83Å; K79-E83 VanDerWaalsContact O-N 3.16Å
80K62.5Low54.5Low104 Ų104121.3 Ų121.345%0.45262%0.622SS.*Hα-helixtrans-68.8-41.1174.9-164.8-179.3-175.9-60.70111.9H76 D77 T82 E83 D84H76-K80 WeakPolarHBondContact O-CB 3.46Å; H76-K80 PolarHBondContact O-N 3.37Å; D77-K80 PolarHBondContact O-N 3.24Å; K80-T82 VanDerWaalsContact C-N 3.27Å; K80-T82 PolarHBondContact O-N 2.93Å; K80-E83 PolarHBondContact O-N 3.39Å; K80-D84 IonicContact NZ-OD1 3.53Å; K80-D84 IonicContact NZ-OD2 3.54Å; K80-D84 PolarHBondContact NZ-OD2 3.38Å; K80-D84 PolarHBondContact O-N 2.93Å
81A56.5Low54.5Low67 Ų67123.6 Ų123.655%0.55463%0.634SS**Hα-helixtrans-60.6-34.217600000113.2D77D77-A81 WeakPolarHBondContact O-CB 3.47Å; D77-A81 PolarHBondContact O-N 3.01Å
82T63.6Low53.7Low85 Ų85126.3 Ų126.352%0.52165%0.645SS.*Hα-helixtrans-78.3-28.6175.630.10000113.5F78 K79 K80 L86F78-T82 PolarHBondContact O-N 3.36Å; F78-T82 PolarHBondContact O-OG1 3.4Å; K79-T82 WeakPolarHBondContact CA-OG1 3.44Å; K79-T82 PolarHBondContact O-N 2.98Å; K79-T82 PolarHBondContact O-OG1 3.47Å; K79-T82 VanDerWaalsContact O-OG1 3.1Å; K80-T82 VanDerWaalsContact C-N 3.27Å; K80-T82 PolarHBondContact O-N 2.93Å; T82-L86 WeakPolarHBondContact O-CD1 3.48Å; T82-L86 WeakPolarHBondContact O-CG 3.47Å
83E61.8Low52.8Low104 Ų104130.6 Ų130.649%0.48666%0.663SS.*Hα-helixtrans-76.3-33174.5-110-159.7112.500114.1K79 K80 K87K79-E83 PolarHBondContact O-N 2.83Å; K79-E83 VanDerWaalsContact O-N 3.16Å; K80-E83 PolarHBondContact O-N 3.39Å; E83-K87 WeakPolarHBondContact O-CD 3.31Å; E83-K87 WeakPolarHBondContact O-CG 3.47Å; E83-K87 WeakPolarHBondContact OE1-CE 3.37Å; E83-K87 IonicContact OE1-NZ 3.82Å; E83-K87 PolarHBondContact OE1-NZ 2.92Å
84D58.1Low52Low83 Ų83131.2 Ų131.244%0.44467%0.67SS.*Hα-helixtrans-73.7-26.5179.4-79.6-47.4000112.5K80K80-D84 IonicContact NZ-OD1 3.53Å; K80-D84 IonicContact NZ-OD2 3.54Å; K80-D84 PolarHBondContact NZ-OD2 3.38Å; K80-D84 PolarHBondContact O-N 2.93Å
85D55.8Low51.8Low125 Ų125130 Ų13067%0.66868%0.678SS**Hα-helixtrans-76.5-40.2177-155.844.1000111.9K87 K88D85-K87 PolarHBondContact O-N 2.89Å; D85-K87 VanDerWaalsContact O-N 3.17Å; D85-K88 PolarHBondContact O-N 3.49Å
86L57.8Low50.6Low152 Ų152131.7 Ų131.780%0.79669%0.69SS**THydrogen-bonded Turntrans-65.6-16.6176.7-70.5171.3000114.2T82T82-L86 WeakPolarHBondContact O-CD1 3.48Å; T82-L86 WeakPolarHBondContact O-CG 3.47Å
87K55.3Low49.3Very low140 Ų140128.9 Ų128.961%0.60969%0.69SS**THydrogen-bonded Turntrans-98.24.7-177.8-70169.7-169.9165.90113.7E83 D85E83-K87 WeakPolarHBondContact O-CD 3.31Å; E83-K87 WeakPolarHBondContact O-CG 3.47Å; E83-K87 WeakPolarHBondContact OE1-CE 3.37Å; E83-K87 IonicContact OE1-NZ 3.82Å; E83-K87 PolarHBondContact OE1-NZ 2.92Å; D85-K87 PolarHBondContact O-N 2.89Å; D85-K87 VanDerWaalsContact O-N 3.17Å
88K52.7Low48.1Very low167 Ų167129.7 Ų129.773%0.72670%0.699SS**SBendtrans-1131.1-167.3-130.5176-175.1177.90116.9D85D85-K88 PolarHBondContact O-N 3.49Å
89M39.2Very low47.5Very low168 Ų168128.1 Ų128.183%0.82871%0.705SS**SBendtrans-107.6119.3175.6-66.8-62.6-74.600110.9
90P44Very low46.1Very low123 Ų123128.2 Ų128.280%0.79971%0.71SS**  trans-65.1146.1174.1-21.934.2000112.8
91L47.3Very low44.6Very low176 Ų176131.1 Ų131.192%0.92173%0.729SS**  trans-64.4137.1177.3-62.2161.9000112.1
92D35.3Very low43.6Very low146 Ų146135.3 Ų135.378%0.78174%0.74SS**  trans-154.7158.8140.4-158.19.9000112.4
93L34.5Very low42Very low148 Ų148138.9 Ų138.978%0.77575%0.751SS**  trans80.695.6168.5-51.3-175.9000118.3
94S37.2Very low40.5Very low110 Ų110140.8 Ų140.877%0.76976%0.764SS**  trans-57.7156.1165.8-510000114.1L96S94-L96 PolarHBondContact O-N 3.18Å
95P40.7Very low39.4Very low134 Ų134145.3 Ų145.387%0.8778%0.78SS**  trans-76.594.5172.531.8-33.5000111.1
96L29.1Very low38.5Very low175 Ų175145.8 Ų145.892%0.91678%0.781SS**  trans-79.3140.7168.2-17162.5000110.3S94S94-L96 PolarHBondContact O-N 3.18Å
97A30.6Very low37.3Very low75 Ų75145.7 Ų145.762%0.6278%0.777SS**  trans-103.1160.9-166.200000114.8
98T33.7Very low36Very low122 Ų122145.6 Ų145.675%0.74878%0.783SS**  trans74.5154.9153.618.10000117.6M100T98-M100 HydrophobicContact CG2-CG 4.4Å
99P41.2Very low34.9Very low130 Ų130146 Ų14684%0.84479%0.787SS**  cis-122.3158.241.734.7-17.9000118.7
100M32.1Very low34.3Very low159 Ų159143.9 Ų143.978%0.78379%0.789SS**  trans-85.6162.1167-61-17969.900112T98T98-M100 HydrophobicContact CG2-CG 4.4Å
101I31.2Very low33.5Very low164 Ų164142.3 Ų142.384%0.84179%0.786SS**  trans177.3126156.3-100.4153.3000105.1
102I35.2Very low32.8Very low156 Ų156140.1 Ų140.180%0.878%0.78SS**  cis-135.515917.5-61.6-176.9000111.6
103Q29.9Very low32.4Very low160 Ų160141.4 Ų141.475%0.74878%0.781SS**  trans-75.2157.9179.2-59168.4-19.900115.2
104N30.6Very low32.1Very low143 Ų143137.4 Ų137.477%0.76577%0.769SS**  -170106.2109.5-89.7-17.9000109.1
105K35.2Very low31.8Very low178 Ų178140.4 Ų140.477%0.77477%0.771SS**  65.3112.998.6-125.7-162.8-179.4-151.90111.8
106I36.2Very low31.3Very low136 Ų136146 Ų14670%0.69778%0.775SS**  -168.6161.377.8-94.9152.4000111.3
107E31.7Very low31.1Very low149 Ų149141.4 Ų141.470%0.69677%0.77SS**  trans-16.1158172-67.1122.9110.300120.5
108D28.7Very low31Very low139 Ų139143.6 Ų143.674%0.74378%0.781SS**  cis-154.2171.518-144.9-40.8000113.2
109H29.4Very low31.4Very low175 Ų175143.1 Ų143.181%0.8178%0.78SS**  trans-80.6157.4171-66.3-106.7000111.4
110S26Very low31.3Very low124 Ų124144.6 Ų144.687%0.86778%0.779SS**  176168.990.6-170.70000111.6
111A28.2Very low31.4Very low89 Ų89143 Ų14374%0.73678%0.781SS**  trans-103.1-153.6-168.800000114.5
112V32.3Very low31.3Very low130 Ų130143.1 Ų143.179%0.78878%0.778SS**  trans95.9103.8178.3-176.40000112.6
113E26.2Very low31.8Very low173 Ų173140.8 Ų140.881%0.80877%0.773SS**  70125.663.5-165.1-178.8-168.400112.7
114A29.6Very low31.7Very low64 Ų64142.6 Ų142.653%0.52978%0.781SS.*  cis-161.8-161.1-14.500000110.5
115H29.5Very low31.7Very low173 Ų173141.4 Ų141.480%0.80178%0.784SS**  trans67118159.728.2-97.7000123.2
116R29.9Very low31.5Very low252 Ų252138.9 Ų138.995%0.95178%0.784SS**  trans37.5124.6147-74-173.4179.3-952.4121.3
117G25.8Very low31.4Very low79 Ų79138.8 Ų138.881%0.81479%0.79SS**  trans159.2112144.400000116.3
118S27.4Very low31.2Very low121 Ų121137.6 Ų137.685%0.84680%0.798SS**  trans-94.8166.4154.4-63.10000109.3
119P44.1Very low31.4Very low112 Ų112137.5 Ų137.573%0.72780%0.797SS**  cis-131-179.62.340.4-23.2000115.3
120L37.7Very low31.6Very low160 Ų160136.8 Ų136.884%0.83880%0.799SS**  trans16.7137.8149.4-80.5156.8000121.1
121P35.4Very low31.9Very low125 Ų125138.5 Ų138.581%0.81279%0.791SS**  trans-117.2150.4145.435.9-26.7000114.5
122H29.1Very low32Very low168 Ų168141.7 Ų141.778%0.77879%0.791SS**  trans-93.4153.5166.8-177.8-77.6000108.8
123P45.9Very low31.8Very low107 Ų107141.4 Ų141.470%0.69579%0.789SS**  trans-69.2152.3-179.727.9-37.7000114.1
124E27.9Very low31.7Very low197 Ų197137.8 Ų137.892%0.92178%0.783SS**  trans-105.4153.7163.7-69.1-165.7103.900111.2
125S30.3Very low31.6Very low118 Ų118142.8 Ų142.883%0.82580%0.8SS**  trans-113.2136.9177.8-64.80000111.3
126T29.5Very low31.5Very low126 Ų126142.2 Ų142.277%0.77380%0.798SS**  trans-149.5104.3156.556.10000108.9
127T34.2Very low32Very low134 Ų134135.3 Ų135.382%0.82279%0.785SS**  55115.599.663.30000116.5
128S27.8Very low32Very low124 Ų124137 Ų13787%0.86778%0.78SS**  -171.2155.2114.7-1640000111.9
129D33.7Very low32Very low136 Ų136136.8 Ų136.873%0.72778%0.779SS**  trans-73.7153.8172-145.4-86.6000111.4
130D32.5Very low31.1Very low161 Ų161139.1 Ų139.186%0.86178%0.784SS**  -177.2170.3128.5-117.3-55.3000114.1
131K33.8Very low31.7Very low159 Ų159136.6 Ų136.669%0.69178%0.777SS**  trans-116.7143.4-155.9-147.7-174.9175.5-114.10115.9
132E30Very low31.3Very low156 Ų156136.1 Ų136.173%0.72977%0.772SS**  trans82.7156.4144.8-121-177.7126.200124
133V26.5Very low31.3Very low125 Ų125133.8 Ų133.876%0.75877%0.774SS**  trans89.592.7166.6-168.90000120.6
134S25.4Very low30.7Very low97 Ų97134.8 Ų134.868%0.67878%0.779SS**  52.1125.5125-154.30000122.7
135L26.7Very low30.8Very low169 Ų169133.1 Ų133.189%0.88578%0.775SS**  -175.6139.199.9-92.2170.8000113.3
136Q28.8Very low30.8Very low161 Ų161133.7 Ų133.775%0.75277%0.773SS**  trans-98.2-172.7162.1-121-162.440.400108.4
137P40.4Very low30.9Very low106 Ų106135.9 Ų135.969%0.68877%0.774SS**  cis-148.6174.223.339.8-16.2000119.4
138T25Very low31.4Very low116 Ų116135.7 Ų135.771%0.71278%0.775SS**  trans24.2136133-46.30000123.4
139S26.7Very low31.6Very low116 Ų116134.1 Ų134.181%0.81177%0.77SS**  179.2147.5118.151.60000117.9
140L26.6Very low31.4Very low161 Ų161132.9 Ų132.984%0.84377%0.772SS**  trans-86.8-170.1158.2-94.4137000109.2
141P48.9Very low31.3Very low106 Ų106132 Ų13269%0.68877%0.766SS**  cis-133-170.8-16.925.2-0.7000113.9
142T27Very low31.2Very low116 Ų116132.2 Ų132.271%0.71277%0.77SS**  152.3122.2115.1-620000117.4
143S30.6Very low31.2Very low118 Ų118130.9 Ų130.983%0.82577%0.772SS**  trans77.7153.8147.7-69.50000126
144T31.7Very low31.8Very low129 Ų129130.1 Ų130.179%0.79177%0.769SS**  trans-125.5156.3-162.6-49.10000111
145I29.7Very low32.1Very low161 Ų161133 Ų13383%0.82678%0.777SS**  trans-151.1117.2156-102.1147.4000113.4
146V30.2Very low32.2Very low130 Ų130130.9 Ų130.979%0.78877%0.771SS**  trans44.6132.3137.9-165.20000123.5
147H33.2Very low32.3Very low173 Ų173131.1 Ų131.180%0.80178%0.777SS**  trans-90.7169.2170.1-89.7-102.7000114.1
148P44.2Very low31.7Very low130 Ų130133.3 Ų133.384%0.84478%0.781SS**  -141.3179.9103.734.6-18.1000114.8
149A31.1Very low32Very low91 Ų91132.2 Ų132.275%0.75279%0.785SS**  trans-119.3162.6-167.200000114.8
150S30.4Very low32.1Very low110 Ų110133.3 Ų133.377%0.76979%0.787SS**  trans-163.7115155-85.30000114.7
151L31.2Very low32.6Very low141 Ų141130.7 Ų130.774%0.73878%0.781SS**  50128.3126.1-64.1175.6000123.9
152Q29.9Very low31.8Very low165 Ų165133.2 Ų133.277%0.77179%0.789SS**  trans71.4150.4146.6-57.2164.43100116.4
153V31.4Very low32Very low127 Ų127131.9 Ų131.977%0.7779%0.79SS**  cis-146.3154.717.4-178.70000109.4
154P39.6Very low32.1Very low109 Ų109131.7 Ų131.771%0.70879%0.789SS**  trans-96.3161.2176.337-35.7000116.3
155N30.7Very low32.1Very low158 Ų158132.2 Ų132.285%0.84579%0.791SS**  trans60130.2164.7-81.9-8.4000120
156V28.9Very low32.2Very low125 Ų125130.6 Ų130.676%0.75879%0.789SS**  -161.6126109.5173.20000108.2L158V156-L158 HydrophobicContact CG1-CB 4.23Å; V156-L158 HydrophobicContact CG1-CD1 4.07Å
157L30.6Very low32.3Very low166 Ų166132.3 Ų132.387%0.86979%0.792SS**  trans-125114.1155.1-153.4170.2000107
158L28.6Very low32.1Very low151 Ų151132 Ų13279%0.79179%0.791SS**  trans-91.6113.8-170.1-152.378.4000109.9V156V156-L158 HydrophobicContact CG1-CB 4.23Å; V156-L158 HydrophobicContact CG1-CD1 4.07Å
159A31.6Very low31.2Very low94 Ų94135.1 Ų135.178%0.77779%0.794SS**  trans-145.7118.2165.500000109
160T28.6Very low31.1Very low139 Ų139135.2 Ų135.285%0.85380%0.795SS**  trans-77.1142.5-173.343.60000112.8
161S37.1Very low31.2Very low105 Ų105137.5 Ų137.573%0.73480%0.797SS**  trans-88.5147.1175.549.60000113.2
162D31.1Very low31.5Very low160 Ų160136.7 Ų136.786%0.85680%0.801SS**  174.2154.7127.8-106.4-41.9000109.9
163A32.5Very low31.4Very low88 Ų88133.6 Ų133.673%0.72780%0.797SS**  cis-147.4159.3-4.500000110.3
164S31.2Very low32.7Very low114 Ų114132.8 Ų132.880%0.79780%0.795SS**  trans-93.1149.1179.6-56.50000113.4
165V32.2Very low32.2Very low139 Ų139134 Ų13484%0.84280%0.801SS**  trans-141.8132.3142.3-176.70000110.4
166V32.3Very low32.3Very low128 Ų128132 Ų13278%0.77680%0.798SS**  trans-112.4132.5174.8168.70000109
167I31.8Very low32.4Very low166 Ų166131.3 Ų131.385%0.85180%0.799SS**  trans-138.9142.8158.4-59.6-175.5000109.2
168Q28.6Very low32.5Very low167 Ų167128.3 Ų128.378%0.7879%0.792SS**  trans-138137-171.8169.6167.988.700110.8
169Q27Very low32.6Very low194 Ų194127.6 Ų127.691%0.90779%0.794SS**  trans164.3164.7162.7-96.516239.200108.4
170A28.7Very low32.6Very low93 Ų93130.1 Ų130.177%0.76979%0.793SS**  cis-163.8152.2-42.500000107.1
171L31.5Very low32.8Very low158 Ų158129.5 Ų129.583%0.82779%0.789SS**  trans-83.6150.5177.8-86.8163.3000111.6
172P37.4Very low32.5Very low125 Ų125133.5 Ų133.581%0.81280%0.796SS**  -147.9164.589.238-20000117.2
173S27.8Very low33.1Very low100 Ų100131.6 Ų131.670%0.69979%0.79SS**  trans-100.5-169.3169.1-33.20000110.3
174P58.2Low33.1Very low109 Ų109133.4 Ų133.471%0.70880%0.795SS**  cis-133.9178.8-18.540.6-25000113.8
175T30.9Very low33.1Very low136 Ų136133.7 Ų133.783%0.83480%0.796SS**  trans-175.4141.5130.117.60000115.2
176S31.4Very low33.6Very low114 Ų114131.7 Ų131.780%0.79779%0.788SS**  trans78.6109.3148.5-58.50000123.6
177S32.3Very low34Very low112 Ų112132.7 Ų132.778%0.78379%0.79SS**  trans80.780.5133.2-159.10000122.6
178S31.5Very low34.1Very low103 Ų103135.7 Ų135.772%0.7279%0.79SS**  51.4110.7115.4-720000123.1
179V31.3Very low34.4Very low135 Ų135134.1 Ų134.182%0.81879%0.794SS**  trans58142.3140.9-110.60000119.2
180I32Very low34.9Very low147 Ų147132.4 Ų132.475%0.75479%0.79SS**  cis-146.4152.220.2-41.8166.9000111.1
181T32.1Very low35.3Very low127 Ų127133.9 Ų133.978%0.77979%0.789SS**  trans8296.5157.5-28.80000118.2
182Q30.5Very low35.8Very low188 Ų188131.7 Ų131.788%0.87978%0.784SS**  trans-154.7150.8135.4-77.8-145.88.400112.6
183V43.9Very low35.9Very low120 Ų120132.5 Ų132.573%0.72779%0.787SS**  trans-18.7139.8168.4-161.70000118.6
184P31.7Very low36.4Very low127 Ų127133.2 Ų133.283%0.82579%0.792SS**  trans-90.4114.1158.532.9-26.3000111.8
185S32.8Very low35.9Very low119 Ų119130 Ų13083%0.83278%0.779SS**  trans-82.5-179.2160.3-167.20000111
186S41.5Very low36.7Very low97 Ų97128.1 Ų128.168%0.67877%0.767SS**SBendtrans-59.9164.7-167.3-166.10000117
187N40.1Very low37.5Very low150 Ų150130.2 Ų130.280%0.80276%0.762SS**  trans84.7108168.6-68.1-65.5000119.6
188R34.8Very low38.7Very low229 Ų229129.8 Ų129.886%0.86476%0.756SS**  trans-136.7142.1141.1-72.4-169.6177.9-139.7-0.6109
189P35.2Very low40.4Very low133 Ų133128.6 Ų128.686%0.86475%0.745SS**  trans-73.8137.2174.530.6-33.4000110.8
190I36.4Very low42.4Very low159 Ų159127.8 Ų127.882%0.81574%0.735SS**  trans-105.7128.8176.6-65.2172.1000108.4
191V38.8Very low43.9Very low123 Ų123126.9 Ų126.975%0.74573%0.726SS**  trans-75.1129.2172.3-178.80000108.8
192P41Very low45.1Very low112 Ų112125.9 Ų125.973%0.72771%0.712SS**  trans-74.2128.9178.429.4-33.3000111.2
193V40.1Very low47.5Very low143 Ų143119.9 Ų119.987%0.86769%0.686SS**  trans-93.4112.8165.71740000108
194S38.3Very low48.1Very low115 Ų115121 Ų12180%0.80470%0.695SS**  trans-73.8125.9175.6-60.20000110.9
195G47.7Very low50.2Low42 Ų42120 Ų12043%0.43368%0.683SS.*  trans-141.3129.2173.900000111.5
196T47.7Very low52Low95 Ų95117.1 Ų117.158%0.58367%0.673SS**PPolyproline II helixtrans-93.8131.717429.20000110.5
197F48.5Very low53.4Low158 Ų158118.1 Ų118.169%0.69367%0.667SS**EExtended strand (participates in β ladder)trans-99.6124.8170.9-69-81.3000109.7
198P56.9Low54.7Low104 Ų104114.4 Ų114.468%0.67565%0.649SS**EExtended strand (participates in β ladder)trans-77.6127.7174.230.5-32.1000110.4
199V67.6Low56Low78 Ų78108.4 Ų108.447%0.47363%0.632SS.*EExtended strand (participates in β ladder)trans-110.9126.6173.1-179.70000108.4I211 I213V199-I211 PolarHBondContact N-O 3.24Å; V199-I211 PolarHBondContact O-N 3.22Å; V199-I213 HydrophobicContact CG2-CD1 4.24Å
200L72.6Confident57.2Low118 Ų118106.1 Ų106.162%0.61862%0.618SS**EExtended strand (participates in β ladder)trans-86.7120.6177.3-72.3163.7000109.9P210L200-P210 HydrophobicContact CD2-CB 3.89Å
201F62.8Low58.6Low128 Ų128102.7 Ų102.756%0.56160%0.6SS**EExtended strand (participates in β ladder)trans-102.9128.8175.8-165.2-97.4000110.2L203 T208 M209 I211F201-L203 HydrophobicContact CD1-CD1 4.29Å; F201-T208 WeakPolarHBondContact O-CA 3.3Å; F201-M209 PolarHBondContact N-O 2.89Å; F201-M209 PolarHBondContact O-N 3.25Å; F201-I211 HydrophobicContact CB-CD1 3.9Å; F201-I211 HydrophobicContact CB-CG1 4.47Å; F201-I211 HydrophobicContact CG-CD1 4.39Å
202Q57Low59.1Low106 Ų106100.3 Ų100.350%0.49559%0.593SS.*EExtended strand (participates in β ladder)trans-94.5115.7-177-173.274.380.800109.7G206 Q207Q202-G206 PolarHBondContact NE2-O 2.92Å; Q202-Q207 PolarHBondContact NE2-O 3.44Å; Q202-Q207 VanDerWaalsContact NE2-O 3.13Å
203L81.8Confident59.5Low62 Ų6299.7 Ų99.733%0.32558%0.583SS.*  trans-79157.1176.4-7878.2000111.1F201 N205 G206 Q207 M209F201-L203 HydrophobicContact CD1-CD1 4.29Å; L203-N205 VanDerWaalsContact CB-OD1 3.22Å; L203-N205 WeakPolarHBondContact CB-OD1 3.38Å; L203-N205 PolarHBondContact O-N 2.88Å; L203-G206 PolarHBondContact O-N 2.74Å; L203-Q207 PolarHBondContact N-O 2.99Å; L203-M209 HydrophobicContact CD1-CB 3.93Å; L203-M209 HydrophobicContact CD1-CG 3.68Å
204P57.1Low59.6Low142 Ų14297.8 Ų97.892%0.92257%0.574SS**THydrogen-bonded Turntrans-60.7-14.5-178.6-24.935.1000115.5G206P204-G206 VanDerWaalsContact C-N 3.3Å
205N75.8Confident60Low107 Ų10794.5 Ų94.557%0.57255%0.553SS**THydrogen-bonded Turntrans-855.1174.467.4-9000113.6L203 Q207L203-N205 VanDerWaalsContact CB-OD1 3.22Å; L203-N205 WeakPolarHBondContact CB-OD1 3.38Å; L203-N205 PolarHBondContact O-N 2.88Å; N205-Q207 VanDerWaalsContact C-N 3.34Å; N205-Q207 PolarHBondContact O-N 3.41Å; N205-Q207 WeakPolarHBondContact OD1-CB 3.44Å; N205-Q207 PolarHBondContact OD1-N 2.69Å; N205-Q207 VanDerWaalsContact OD1-N 3.08Å
206G70.6Confident59.8Low59 Ų5999.1 Ų99.161%0.60857%0.573SS**SBendtrans81.45.4-178.800000115Q202 L203 P204Q202-G206 PolarHBondContact NE2-O 2.92Å; L203-G206 PolarHBondContact O-N 2.74Å; P204-G206 VanDerWaalsContact C-N 3.3Å
207Q70.2Confident59.6Low118 Ų118102 Ų10255%0.55158%0.584SS**  trans-94.8132.9178.3-152.8172.134.100111.7Q202 L203 N205Q202-Q207 PolarHBondContact NE2-O 3.44Å; Q202-Q207 VanDerWaalsContact NE2-O 3.13Å; L203-Q207 PolarHBondContact N-O 2.99Å; N205-Q207 VanDerWaalsContact C-N 3.34Å; N205-Q207 PolarHBondContact O-N 3.41Å; N205-Q207 WeakPolarHBondContact OD1-CB 3.44Å; N205-Q207 PolarHBondContact OD1-N 2.69Å; N205-Q207 VanDerWaalsContact OD1-N 3.08Å
208T68.3Low59Low72 Ų7298.5 Ų98.544%0.44258%0.584SS.*EExtended strand (participates in β ladder)trans-93.2127.5176.550.60000111.4F201F201-T208 WeakPolarHBondContact O-CA 3.3Å
209M60.4Low57.9Low102 Ų10299.4 Ų99.450%0.50259%0.592SS.*EExtended strand (participates in β ladder)trans-111.8128.1173.1-72.1-66.4-71.200110.6F201 L203F201-M209 PolarHBondContact N-O 2.89Å; F201-M209 PolarHBondContact O-N 3.25Å; L203-M209 HydrophobicContact CD1-CB 3.93Å; L203-M209 HydrophobicContact CD1-CG 3.68Å
210P60.8Low56.4Low86 Ų86101.2 Ų101.256%0.55861%0.608SS**EExtended strand (participates in β ladder)trans-75.9129.2173.329.8-32.2000110.9L200L200-P210 HydrophobicContact CD2-CB 3.89Å
211I65.9Low54.5Low86 Ų86102.1 Ų102.144%0.44162%0.619SS.*EExtended strand (participates in β ladder)trans-113.8126.7172.5-60.8178000107.9V199 F201 I213V199-I211 PolarHBondContact N-O 3.24Å; V199-I211 PolarHBondContact O-N 3.22Å; F201-I211 HydrophobicContact CB-CD1 3.9Å; F201-I211 HydrophobicContact CB-CG1 4.47Å; F201-I211 HydrophobicContact CG-CD1 4.39Å; I211-I213 HydrophobicContact CG2-CG1 4.35Å
212A49.7Very low53.2Low73 Ų73104.7 Ų104.760%0.60363%0.632SS**EExtended strand (participates in β ladder)trans-94.2119.5174.100000109.7
213I49.1Very low52.1Low99 Ų99106.1 Ų106.151%0.50864%0.642SS.*EExtended strand (participates in β ladder)trans-101.2121.5177.8-56.3176.7000108.5V199 I211 A215V199-I213 HydrophobicContact CG2-CD1 4.24Å; I211-I213 HydrophobicContact CG2-CG1 4.35Å; I213-A215 PolarHBondContact O-N 2.95Å
214P42.4Very low49.9Very low104 Ų104108.7 Ų108.768%0.67566%0.662SS**PPolyproline II helixtrans-66.8123.2174.2-19.132.1000111.2
215A46.5Very low48.8Very low46 Ų46108.7 Ų108.738%0.3866%0.659SS.*  trans-97.694.6177.500000111.3I213 I217I213-A215 PolarHBondContact O-N 2.95Å; A215-I217 HydrophobicContact CB-CG1 4.39Å
216T44.8Very low46.8Very low139 Ų139108.1 Ų108.185%0.85367%0.67SS**  trans-93.993.6163.939.20000109.4A218T216-A218 PolarHBondContact O-N 2.75Å
217I43.2Very low45.1Very low156 Ų156112.7 Ų112.780%0.868%0.679SS**  trans-84.7102.6-174.8-47.3176.4000110.4A215A215-I217 HydrophobicContact CB-CG1 4.39Å
218A35.1Very low43.4Very low84 Ų84112.6 Ų112.669%0.69469%0.688SS**  trans-135.1115.4159.600000109.3T216T216-A218 PolarHBondContact O-N 2.75Å
219S33.5Very low41.8Very low122 Ų122116.2 Ų116.285%0.85370%0.704SS**SBendtrans68.1159.6-177.377.90000117.2
220S36.1Very low40.6Very low116 Ų116117.7 Ų117.781%0.81172%0.719SS**  trans-108.2127.3-154.353.30000114.6
221V32.6Very low39.4Very low138 Ų138123.2 Ų123.284%0.83673%0.728SS**  trans-137.7128.8164.9-176.30000108.9
222H36.2Very low37.9Very low182 Ų182125 Ų12584%0.84375%0.745SS**  trans-110129.4175.2-172.9-76.5000110.5
223I33.3Very low37.1Very low136 Ų136127.6 Ų127.670%0.69775%0.753SS**PPolyproline II helixtrans-90.1141.9-172.3-61.7164.5000110.3
224P37.1Very low36.4Very low116 Ų116129.1 Ų129.175%0.75377%0.768SS**PPolyproline II helixtrans-90.2131.7171.233.5-31.2000112.4
225T32.7Very low36.2Very low141 Ų141130 Ų13087%0.86577%0.771SS**PPolyproline II helixtrans-82.9126171.6-530000110.6
226A34.4Very low35.5Very low95 Ų95133.7 Ų133.779%0.78579%0.788SS**  trans-110.6145.317500000111.8
227I34Very low35Very low156 Ų156132.7 Ų132.780%0.878%0.784SS**  trans-121.1127.2174.3-59.3172.8000107.3
228P36.2Very low34.6Very low115 Ų115132.4 Ų132.475%0.74778%0.784SS**  trans-81.9133.5178.932.1-32.6000111.4
229L32.8Very low34.7Very low149 Ų149134.4 Ų134.478%0.7879%0.788SS**  trans-128.3111167.4-174.467.2000109.3
230V36.8Very low34.9Very low133 Ų133134.4 Ų134.481%0.80679%0.785SS**  trans-82.7132.1-176.9-174.50000110.4
231R34.5Very low35.1Very low201 Ų201132.4 Ų132.476%0.75878%0.783SS**  trans-143.1148.1163-80.9-163.2159.1107.20.6110.6
232P34.7Very low35.5Very low124 Ų124133.6 Ų133.681%0.80578%0.783SS**PPolyproline II helixtrans-77.8148.8-170.831.8-35.8000112.6
233V32.2Very low35.6Very low127 Ų127131 Ų13177%0.7778%0.782SS**PPolyproline II helixtrans-97.9119.4173.5174.30000109
234T34.5Very low35.7Very low132 Ų132127.6 Ų127.681%0.8178%0.781SS**PPolyproline II helixtrans-80120.2167.2-40.80000108.6
235V38.3Very low36Very low122 Ų122128 Ų12874%0.73978%0.783SS**PPolyproline II helixtrans-90.6128.5-179.2-168.90000109.4
236V33.3Very low36.3Very low124 Ų124127.3 Ų127.375%0.75278%0.781SS**  trans-108.6127.3170.8-179.60000108.5
237P34.6Very low36.3Very low118 Ų118128 Ų12877%0.76678%0.78SS**  trans-69.9136177.3-16.931000111.8
238N32.8Very low36.6Very low149 Ų149126.3 Ų126.380%0.79778%0.779SS**  trans-105.2122.2176.2-175.260.6000110.9
239V37.6Very low36.6Very low126 Ų126129.5 Ų129.576%0.76478%0.784SS**  trans-89.1130.5175.9179.60000109.7
240P37.9Very low36.9Very low122 Ų122127 Ų12779%0.79279%0.785SS**  trans-75.7133.7179-15.930.9000113.3
241G40.1Very low37.2Very low75 Ų75127.1 Ų127.177%0.77379%0.786SS**  trans133.456.1155.100000119.1
242I41.1Very low38Very low162 Ų162123.5 Ų123.583%0.83178%0.778SS**  trans-141.3134161.4-43.8176.6000109.7
243P38.6Very low39.3Very low127 Ų127121.1 Ų121.183%0.82576%0.764SS**PPolyproline II helixtrans-69.7129.3172.8-17.731.8000112.3
244G36Very low40.6Very low66 Ų66121.1 Ų121.168%0.6876%0.755SS**PPolyproline II helixtrans-79.8152.6174.500000113.3
245P43.7Very low41.8Very low124 Ų124118.1 Ų118.181%0.80574%0.744SS**PPolyproline II helixtrans-73.8157.7-178.631.6-36000112.7
246P37.5Very low43.2Very low127 Ų127118.4 Ų118.483%0.82574%0.735SS**PPolyproline II helixtrans-71.1143.9-177.929-34.9000113.3
247S36.1Very low44.9Very low109 Ų109118.1 Ų118.176%0.76273%0.729SS**PPolyproline II helixtrans-71.1140.4176.8-175.40000112.2Q249S247-Q249 PolarHBondContact O-N 3.21Å
248P38.9Very low46.5Very low120 Ų120118.4 Ų118.478%0.77972%0.718SS**PPolyproline II helixtrans-73.3125.1-179.829.5-34.2000112.1
249Q36.7Very low48Very low182 Ų182117.2 Ų117.285%0.8571%0.711SS**PPolyproline II helixtrans-71.3144.5170.8-71.2-174.8-26.700111.6S247 V251S247-Q249 PolarHBondContact O-N 3.21Å; Q249-V251 PolarHBondContact O-N 3.34Å
250A38.2Very low49.6Very low97 Ų97119.1 Ų119.180%0.80271%0.709SS**  trans-76.388.4-177.200000112.6Q252A250-Q252 PolarHBondContact O-N 2.92Å
251V43.6Very low50.8Low135 Ų135116.4 Ų116.482%0.81870%0.697SS**  trans-73.6108.7169.4-172.40000109.2Q249 S253Q249-V251 PolarHBondContact O-N 3.34Å; V251-S253 PolarHBondContact O-N 3.42Å
252Q51.4Low52Low126 Ų126118 Ų11859%0.58969%0.692SS**  trans-70.4112172-64.7-90.7-6.600108.6A250A250-Q252 PolarHBondContact O-N 2.92Å
253S62.4Low52.7Low73 Ų73116.9 Ų116.951%0.5169%0.686SS.*  trans-63.7138.4-178.856.80000112.5V251 A255 K256V251-S253 PolarHBondContact O-N 3.42Å; S253-A255 PolarHBondContact O-N 3.48Å; S253-K256 WeakPolarHBondContact O-CB 3.27Å; S253-K256 PolarHBondContact O-N 3.26Å
254E60.3Low53.7Low127 Ų127115.9 Ų115.959%0.59368%0.682SS**Hα-helixtrans-51.9-33.3-177.4-140.1-162.1131.200113.5K256 L257 K258E254-K256 PolarHBondContact O-N 3.11Å; E254-L257 PolarHBondContact O-N 3.44Å; E254-K258 PolarHBondContact O-N 3.19Å; E254-K258 VanDerWaalsContact O-N 3.14Å; E254-K258 WeakPolarHBondContact OE1-CE 3.4Å; E254-K258 IonicContact OE1-NZ 2.65Å; E254-K258 PolarHBondContact OE1-NZ 3Å
255A59.9Low54.5Low69 Ų69121.1 Ų121.157%0.5769%0.689SS**Hα-helixtrans-55.4-35.4175.700000113S253 K258 L259S253-A255 PolarHBondContact O-N 3.48Å; A255-K258 PolarHBondContact O-N 3.38Å; A255-L259 WeakPolarHBondContact O-CB 3.39Å; A255-L259 PolarHBondContact O-N 3.06Å
256K66.7Low54.6Low128 Ų128123 Ų12356%0.55769%0.687SS**Hα-helixtrans-76-27.7-177.7-165.1173.8170.6-165.10112.7S253 E254 K260S253-K256 WeakPolarHBondContact O-CB 3.27Å; S253-K256 PolarHBondContact O-N 3.26Å; E254-K256 PolarHBondContact O-N 3.11Å; K256-K260 PolarHBondContact O-N 3.31Å
257L69.9Low54.4Low119 Ų119123.9 Ų123.962%0.62368%0.684SS**Hα-helixtrans-72.4-45170.5-78.6158.3000110.9E254 L259 K260 A261E254-L257 PolarHBondContact O-N 3.44Å; L257-L259 PolarHBondContact O-N 3.45Å; L257-K260 PolarHBondContact O-N 2.81Å; L257-A261 PolarHBondContact O-N 3.46Å
258K68.1Low54.4Low123 Ų123124 Ų12454%0.53568%0.683SS.*Hα-helixtrans-61.3-41.9177.2-69.9176.6-177.1166.90112.2E254 A255 K260 A261 V262E254-K258 PolarHBondContact O-N 3.19Å; E254-K258 VanDerWaalsContact O-N 3.14Å; E254-K258 WeakPolarHBondContact OE1-CE 3.4Å; E254-K258 IonicContact OE1-NZ 2.65Å; E254-K258 PolarHBondContact OE1-NZ 3Å; A255-K258 PolarHBondContact O-N 3.38Å; K258-K260 VanDerWaalsContact C-N 3.34Å; K258-K260 PolarHBondContact O-N 2.89Å; K258-A261 PolarHBondContact O-N 2.76Å; K258-V262 WeakPolarHBondContact O-CG2 3.43Å; K258-V262 PolarHBondContact O-N 3.38Å; K258-V262 VanDerWaalsContact O-N 3.08Å
259L62.6Low54Low125 Ų125126.3 Ų126.365%0.65468%0.683SS**Hα-helixtrans-65.8-34.7177.4-139.5157.5000112.4A255 L257 L263A255-L259 WeakPolarHBondContact O-CB 3.39Å; A255-L259 PolarHBondContact O-N 3.06Å; L257-L259 PolarHBondContact O-N 3.45Å; L259-L263 PolarHBondContact O-N 3.2Å
260K72.3Confident53.7Low166 Ų166124 Ų12472%0.72268%0.681SS**Hα-helixtrans-71.2-33.8174.4-164.9176.8-177.8-174.50112.7K256 L257 K258 S264K256-K260 PolarHBondContact O-N 3.31Å; L257-K260 PolarHBondContact O-N 2.81Å; K258-K260 VanDerWaalsContact C-N 3.34Å; K258-K260 PolarHBondContact O-N 2.89Å; K260-S264 PolarHBondContact O-N 3.39Å
261A63Low53.6Low64 Ų64125.2 Ų125.253%0.52968%0.678SS.*Hα-helixtrans-69.2-45176.600000112.5L257 K258 L263 S264L257-A261 PolarHBondContact O-N 3.46Å; K258-A261 PolarHBondContact O-N 2.76Å; A261-L263 PolarHBondContact O-N 2.92Å; A261-S264 PolarHBondContact O-N 3.13Å
262V65.1Low53Low110 Ų110126.7 Ų126.767%0.66768%0.682SS**Hα-helixtrans-62.9-42.3178.21740000111.5K258 S264 Q265K258-V262 WeakPolarHBondContact O-CG2 3.43Å; K258-V262 PolarHBondContact O-N 3.38Å; K258-V262 VanDerWaalsContact O-N 3.08Å; V262-S264 PolarHBondContact O-N 3.11Å; V262-Q265 PolarHBondContact O-N 2.87Å
263L55.5Low51.9Low137 Ų137124.5 Ų124.572%0.71769%0.693SS**Hα-helixtrans-67.4-21.8-179.1-164.965000113.3L259 A261 Q265L259-L263 PolarHBondContact O-N 3.2Å; A261-L263 PolarHBondContact O-N 2.92Å; L263-Q265 VanDerWaalsContact C-N 3.34Å
264S60.5Low50.3Low106 Ų106128 Ų12874%0.74171%0.706SS**THydrogen-bonded Turntrans-81.3-9.9177.7-1660000114.1K260 A261 V262K260-S264 PolarHBondContact O-N 3.39Å; A261-S264 PolarHBondContact O-N 3.13Å; V262-S264 PolarHBondContact O-N 3.11Å
265Q53.3Low48.9Very low176 Ų176127 Ų12782%0.82271%0.713SS**SBendtrans-95.1-9.7-176.9-156.9172.9103.100113.2V262 L263V262-Q265 PolarHBondContact O-N 2.87Å; L263-Q265 VanDerWaalsContact C-N 3.34Å
266Q45.3Very low47.5Very low163 Ų163127 Ų12776%0.76272%0.719SS**  trans-109.858.1-171.8-159.872.434.700113.1
267L33.4Very low45.9Very low147 Ų147128 Ų12877%0.7773%0.731SS**  trans-146.7109.7165.8-16175.2000111.8Q269L267-Q269 PolarHBondContact O-N 3.34Å
268P35.5Very low44.1Very low112 Ų112127.9 Ų127.973%0.72774%0.735SS**  trans-69.1127.5172.1-18.632.6000111.3
269Q30.8Very low42.4Very low167 Ų167131.2 Ų131.278%0.7875%0.753SS**  trans-75129.6170-66-74.312.400109.5L267L267-Q269 PolarHBondContact O-N 3.34Å
270V29.9Very low41Very low135 Ų135130.2 Ų130.282%0.81876%0.756SS**  trans-99.2104.3173-166.40000108.2
271T35.9Very low39.2Very low121 Ų121128 Ų12874%0.74276%0.762SS**  trans-105116.4176.958.40000109.9G273T271-G273 PolarHBondContact O-N 3.15Å
272N30.3Very low37.6Very low166 Ų166128.8 Ų128.889%0.88877%0.768SS**  trans-69.4126169.4-70.1-20.9000109.2
273G29.6Very low35.9Very low80 Ų80129.4 Ų129.483%0.82577%0.772SS**  trans-99.6144.9169.700000111T271T271-G273 PolarHBondContact O-N 3.15Å
274D28.1Very low34.7Very low148 Ų148128.4 Ų128.479%0.79177%0.771SS**  trans-136.1154.8168.7176.655.6000109.4
275S31.4Very low33.5Very low104 Ų104130.7 Ų130.773%0.72777%0.77SS**  trans67.9113.1169.7-68.30000119.8
276G31.1Very low32.3Very low69 Ų69129.9 Ų129.971%0.71177%0.771SS**  114.697.1111.600000120.7
277D32.4Very low31.5Very low150 Ų150127.1 Ų127.180%0.80278%0.776SS**  trans66.6105.1140.5-73.8-71.1000125.2
278V32.3Very low31.4Very low117 Ų117124.7 Ų124.771%0.70978%0.778SS**  54.4116.5113.2-178.90000120.6
279Q32.3Very low32Very low192 Ų192125.5 Ų125.590%0.89778%0.783SS**  -172.3166.1112.7-94.8-168.43900112.3
280S33.7Very low31.9Very low104 Ų104121.7 Ų121.773%0.72778%0.78SS**  trans-119.4160.3-157.3-51.30000115.8
281S33.9Very low32Very low120 Ų120123.2 Ų123.284%0.83978%0.783SS**  trans68.2162.1149.8-610000119.2
282A28.4Very low32Very low80 Ų80123.7 Ų123.766%0.66179%0.785SS**  cis-173.6168.5-32.900000109.3
283V30.4Very low32.8Very low123 Ų123121.5 Ų121.575%0.74578%0.78SS**  trans81.4131.7159.4-168.60000119.9
284T31.2Very low33Very low116 Ų116123 Ų12371%0.71278%0.778SS**  trans-25.5167.2151.8-2.80000116.2
285H33.7Very low33.4Very low154 Ų154122 Ų12271%0.71378%0.78SS**  cis-172.6152.540.623.5-103000114.8
286N28.8Very low33.4Very low159 Ų159121.7 Ų121.785%0.8578%0.777SS**  trans31.6127.7153.4-65.26.4000123.9
287A28.6Very low33.3Very low105 Ų105126.8 Ų126.887%0.86879%0.787SS**  177.5147.8103.900000113.7
288A30.8Very low33.4Very low97 Ų97124.2 Ų124.280%0.80278%0.781SS**  trans-121.2-169172.400000109.3
289P48.8Very low34.1Very low128 Ų128124.6 Ų124.683%0.83179%0.786SS**  cis-114.1-164.220.643.8-30000112.2
290A29.2Very low34Very low87 Ų87119 Ų11972%0.71978%0.78SS**  cis-141.9-1646.200000109.5
291L31Very low34.6Very low168 Ų168120 Ų12088%0.8878%0.784SS**  cis-137.6167.210.5-102.8128.8000109.8
292V37Very low34.9Very low130 Ų130120.5 Ų120.579%0.78879%0.785SS**  trans-99.1176.1-174.5-67.20000111.8
293P45.6Very low35.3Very low121 Ų121125.2 Ų125.279%0.78680%0.797SS**  cis-138.2171.612.341.8-22.4000119
294S33.7Very low35.7Very low110 Ų110123.6 Ų123.677%0.76980%0.797SS**  trans-86.9167.4178.7-330000114.4
295P37.9Very low36.2Very low129 Ų129123.6 Ų123.684%0.83880%0.799SS**  trans-95.8138.2144.135.2-27.5000110.9
296S30.5Very low36.5Very low96 Ų96122.4 Ų122.467%0.67181%0.805SS**  trans-166.6139.8165.5-176.90000111.4
297L29.2Very low36.8Very low177 Ų177124 Ų12493%0.92781%0.807SS**  trans-156125.3136.2-102168.8000108.5
298S34.8Very low37.1Very low96 Ų96126.3 Ų126.367%0.67180%0.8SS**  trans-98.6-156.7-171.2-45.20000110.4
299P47.5Very low37.3Very low124 Ų124127.1 Ų127.181%0.80580%0.798SS**  cis-144147.3-634.2-11.7000119.8
300G28.8Very low36.4Very low76 Ų76125.3 Ų125.378%0.78479%0.787SS**  trans74.2171.3137.900000120.8
301P46.7Very low36.6Very low123 Ų123126.8 Ų126.880%0.79979%0.789SS**  cis-117.2167-14.439.9-27.4000113.7
302P40.9Very low36.6Very low132 Ų132127.9 Ų127.986%0.85779%0.79SS**PPolyproline II helixtrans-90.6143.7-176.234.9-33.6000114.5
303L37.2Very low36.2Very low178 Ų178127.7 Ų127.793%0.93279%0.789SS**PPolyproline II helixtrans-92.2142.1172-83.5159.7000111.7
304A36.8Very low35.7Very low89 Ų89129 Ų12974%0.73679%0.788SS**PPolyproline II helixtrans-88.8151.8179.500000113
305P41.8Very low35.8Very low116 Ų116132.6 Ų132.675%0.75379%0.793SS**PPolyproline II helixtrans-80.5148.5159.434.4-31.8000110.8
306P41.8Very low35.8Very low130 Ų130135 Ų13584%0.84479%0.793SS**PPolyproline II helixtrans-81.5157178.332.6-34.2000113.4
307E33.5Very low36.1Very low192 Ų192136.4 Ų136.490%0.89780%0.8SS**PPolyproline II helixtrans-80.4166.2-170.4-66.2-104.3105.300115.8
308E35Very low36.3Very low153 Ų153132.3 Ų132.372%0.71579%0.792SS**PPolyproline II helixtrans-48.6159164.1-111.1-100.8125.900113.5C310E308-C310 PolarHBondContact OE1-N 2.94Å; E308-C310 VanDerWaalsContact OE1-N 3.15Å; E308-C310 PolarHBondContact OE2-N 3.38Å; E308-C310 VanDerWaalsContact OE2-N 3.14Å
309P35.2Very low36.1Very low115 Ų115134.4 Ų134.475%0.74780%0.801SS**  -150.8154.871.238.4-17.5000119.8
310C31.4Very low35.5Very low89 Ų89133.1 Ų133.160%0.60180%0.795SS**PPolyproline II helixtrans-50143.6159.7179.10000115.3E308E308-C310 PolarHBondContact OE1-N 2.94Å; E308-C310 VanDerWaalsContact OE1-N 3.15Å; E308-C310 PolarHBondContact OE2-N 3.38Å; E308-C310 VanDerWaalsContact OE2-N 3.14Å
311P32.7Very low36Very low119 Ų119135.3 Ų135.377%0.77379%0.793SS**PPolyproline II helixtrans-101.1148.5162.536.2-30.3000113.6
312Q30.5Very low35.5Very low190 Ų190136 Ų13689%0.88880%0.795SS**PPolyproline II helixtrans-87.9168-164.5-64.8158.1-46.200115.5
313T28.9Very low35.2Very low127 Ų127137.9 Ų137.978%0.77979%0.792SS**  trans-44.2157.9162.9-36.60000114.8
314L35.4Very low35.2Very low147 Ų147135.8 Ų135.877%0.7779%0.787SS**  trans85.496.7163.7-51.6172.4000118.4
315Q34.4Very low35.6Very low187 Ų187137.5 Ų137.587%0.87479%0.791SS**  -163.6144.2108.7-138.6113.8126.100112.8
316Q38.7Very low35.7Very low178 Ų178136.3 Ų136.383%0.83279%0.791SS**  trans-88.2139.9164.6-59.2172.518.200108.9A318Q316-A318 PolarHBondContact O-N 2.98Å
317P37.4Very low35.6Very low127 Ų127136.1 Ų136.183%0.82579%0.788SS**  trans-73.9105.4166.2-14.129.9000110.1T319P317-T319 PolarHBondContact O-N 2.96Å
318A32.2Very low36Very low91 Ų91136.4 Ų136.475%0.75279%0.786SS**  trans-75.2114.7166.600000109.4Q316 S320Q316-A318 PolarHBondContact O-N 2.98Å; A318-S320 PolarHBondContact O-N 3.16Å; A318-S320 VanDerWaalsContact O-N 3.16Å
319T32.1Very low36Very low139 Ų139133 Ų13385%0.85378%0.784SS**  trans-84.682.7170.655.30000109.9P317P317-T319 PolarHBondContact O-N 2.96Å
320S34.7Very low36.5Very low97 Ų97136.2 Ų136.268%0.67879%0.789SS**  trans-71.6130.4166-71.70000110.5A318A318-S320 PolarHBondContact O-N 3.16Å; A318-S320 VanDerWaalsContact O-N 3.16Å
321T38Very low37.8Very low123 Ų123137.2 Ų137.276%0.75579%0.794SS**  trans19.7116.5142.24.40000117.7
322T36.4Very low38Very low136 Ų136136 Ų13683%0.83479%0.794SS**  trans-131.3130.5150.3-600000108.7
323E36Very low38.8Very low172 Ų172135.6 Ų135.680%0.80479%0.792SS**  trans-69.3141.1-169-59.9-100.7107.900111.8
324T36.9Very low39.7Very low135 Ų135138.1 Ų138.183%0.82880%0.795SS**  trans-110.8117.7167.7-46.10000109.1
325P45.5Very low40.2Very low124 Ų124137.5 Ų137.581%0.80580%0.797SS**  trans-72.9134.4-177.828.6-33.6000111.5
326A43.8Very low40.5Very low92 Ų92132.3 Ų132.376%0.7679%0.794SS**  trans-89.3141.2-179.200000112.5
327T39.8Very low41Very low126 Ų126128.1 Ų128.177%0.77380%0.798SS**  trans-153.9106150.1-670000111.6
328K41.4Very low41.3Very low197 Ų197131.1 Ų131.186%0.85779%0.793SS**  trans30.8140.9130.9-52.1171.4-172.5175.10119.6
329A35.5Very low42.3Very low82 Ų82139 Ų13968%0.67880%0.804SS**  cis-173.7141.6-8.300000113.3
330H44.8Very low43.5Very low183 Ų183141.9 Ų141.985%0.84780%0.799SS**  trans53.9169.7143.1-78.4-65.8000123.5
331P57.5Low44.1Very low109 Ų109147.7 Ų147.771%0.70881%0.806SS**  cis-139165.3-36.837.6-21.3000115.9
332A38.2Very low44.7Very low94 Ų94146.2 Ų146.278%0.77781%0.807SS**  trans16496.8143.300000109.9
333Q47.3Very low45.9Very low181 Ų181144.3 Ų144.385%0.84680%0.795SS**  47.4105.385.1-67.3-159.13.500117
334H46.5Very low46.8Very low180 Ų180141.6 Ų141.683%0.83380%0.795SS**  trans-146.699.6139.9-103.6-72.7000112.1
335T46.8Very low48.1Very low134 Ų134138.7 Ų138.782%0.82277%0.772SS**  trans30.1101.513956.30000119.4
336G40.2Very low50.1Low79 Ų79136.8 Ų136.881%0.81476%0.755SS**  trans-147.163171.200000112.5R338G336-R338 PolarHBondContact O-N 3.02Å
337G48.8Very low52.3Low89 Ų89137.2 Ų137.292%0.91875%0.75SS**  trans-72.293.8-168.800000115.5
338R45.3Very low54.7Low191 Ų191136.4 Ų136.472%0.72174%0.741SS**  trans-146.296.3139.3-164.7172.4-177.2-154.8-1110.4G336 R340G336-R338 PolarHBondContact O-N 3.02Å; R338-R340 HydrophobicContact CG-CG 4.29Å; R338-R340 PolarHBondContact O-N 3.5Å
339R53.6Low57.2Low256 Ų256129.7 Ų129.797%0.96671%0.712SS**  trans-66.471.8170.6-150.5-178.4-157.3-120.56.9109R341R339-R341 PolarHBondContact O-N 3.21Å
340R55.6Low60Low199 Ų199130.6 Ų130.675%0.75170%0.701SS**  trans-59109.2166.7-75.3-163.6-173.3-1486.1105.3R338 A342R338-R340 HydrophobicContact CG-CG 4.29Å; R338-R340 PolarHBondContact O-N 3.5Å; R340-A342 PolarHBondContact O-N 3.27Å
341R48.1Very low62.4Low219 Ų219129.6 Ų129.683%0.82669%0.69SS**  trans-38.7108.1176.6-179.3179.5-65-143-1.1108.5R339 T343R339-R341 PolarHBondContact O-N 3.21Å; R341-T343 HydrophobicContact CG-CG2 4.4Å; R341-T343 PolarHBondContact O-N 3Å
342A50.8Low64.3Low93 Ų93132 Ų13277%0.76969%0.685SS**  trans-69.682168.100000106.5R340 S344R340-A342 PolarHBondContact O-N 3.27Å; A342-S344 VanDerWaalsContact C-N 3.3Å; A342-S344 PolarHBondContact O-N 3.38Å
343T61.1Low67Low96 Ų96130.4 Ų130.459%0.58966%0.66SS**  trans-56109.7148.247.50000104.3R341 E345R341-T343 HydrophobicContact CG-CG2 4.4Å; R341-T343 PolarHBondContact O-N 3Å; T343-E345 PolarHBondContact O-N 2.82Å
344S56Low69.4Low115 Ų115128 Ų12880%0.80465%0.647SS**  trans-69.167.4173.753.20000108.5A342 D346A342-S344 VanDerWaalsContact C-N 3.3Å; A342-S344 PolarHBondContact O-N 3.38Å; S344-D346 VanDerWaalsContact C-N 3.34Å; S344-D346 PolarHBondContact O-N 3.38Å
345E63.7Low71.8Confident74 Ų74123.5 Ų123.535%0.34663%0.629SS.*  trans-54.3109.8154.4-81.3-167.8138.400105.5T343 K350 K353T343-E345 PolarHBondContact O-N 2.82Å; E345-K350 HydrophobicContact CB-CD 4.37Å; E345-K350 HydrophobicContact CB-CG 4.03Å; E345-K350 PolarHBondContact O-NZ 3.45Å; E345-K350 WeakPolarHBondContact OE2-CE 3.41Å; E345-K353 IonicContact OE1-NZ 3.51Å; E345-K353 PolarHBondContact OE1-NZ 2.68Å
346D86.7Confident74.3Confident84 Ų84121.7 Ų121.745%0.44961%0.611SS.*  trans-42.6131.1172.9171.68000109.9S344 D348 E349 K350S344-D346 VanDerWaalsContact C-N 3.34Å; S344-D346 PolarHBondContact O-N 3.38Å; D346-D348 PolarHBondContact O-N 3.11Å; D346-D348 VanDerWaalsContact O-N 3.14Å; D346-D348 PolarHBondContact OD1-N 3.33Å; D346-E349 HydrophobicContact CB-CB 4.18Å; D346-E349 PolarHBondContact O-N 3.38Å; D346-K350 PolarHBondContact O-N 2.78Å; D346-K350 VanDerWaalsContact O-N 3.08Å
347P90.4Very high77Confident100 Ų100125.8 Ų125.865%0.64960%0.602SS**Hα-helixtrans-48.7-35.5174.819.7-33.6000113K350 R351P347-K350 PolarHBondContact O-N 3.15Å; P347-R351 WeakPolarHBondContact O-CB 3.48Å; P347-R351 PolarHBondContact O-N 3.35Å
348D91.4Very high79.4Confident110 Ų110125.9 Ų125.959%0.58858%0.582SS**Hα-helixtrans-70.1-34.5177.3-77.1-30.5000112.5D346 R351 R352D346-D348 PolarHBondContact O-N 3.11Å; D346-D348 VanDerWaalsContact O-N 3.14Å; D346-D348 PolarHBondContact OD1-N 3.33Å; D348-R351 PolarHBondContact O-N 3.15Å; D348-R352 WeakPolarHBondContact O-CB 3.3Å; D348-R352 PolarHBondContact O-N 2.98Å
349E93.7Very high81.9Confident55 Ų55124.3 Ų124.326%0.25758%0.576SS.*Hα-helixtrans-68.5-38.4175-146.8-148.8165.400112.1D346 R352 K353D346-E349 HydrophobicContact CB-CB 4.18Å; D346-E349 PolarHBondContact O-N 3.38Å; E349-R352 PolarHBondContact O-N 3.25Å; E349-R352 IonicContact OE1-NH2 2.69Å; E349-R352 PolarHBondContact OE1-NH2 3.45Å; E349-K353 VanDerWaalsContact CD-CE 3.42Å; E349-K353 WeakPolarHBondContact O-CB 3.1Å; E349-K353 VanDerWaalsContact O-CG 3.31Å; E349-K353 WeakPolarHBondContact O-CG 3.4Å; E349-K353 PolarHBondContact O-N 2.94Å; E349-K353 WeakPolarHBondContact OE1-CE 3.43Å; E349-K353 IonicContact OE1-NZ 2.74Å; E349-K353 PolarHBondContact OE1-NZ 3.09Å; E349-K353 IonicContact OE2-NZ 3.41Å; E349-K353 PolarHBondContact OE2-NZ 2.9Å
350K93.8Very high84Confident101 Ų101113.8 Ų113.844%0.43954%0.543SS..Hα-helixtrans-62.7-44.2172.2-71.3178.2175.6121.40111.3E345 D346 P347 K353 F354E345-K350 HydrophobicContact CB-CD 4.37Å; E345-K350 HydrophobicContact CB-CG 4.03Å; E345-K350 PolarHBondContact O-NZ 3.45Å; E345-K350 WeakPolarHBondContact OE2-CE 3.41Å; D346-K350 PolarHBondContact O-N 2.78Å; D346-K350 VanDerWaalsContact O-N 3.08Å; P347-K350 PolarHBondContact O-N 3.15Å; K350-K353 PolarHBondContact O-N 3.49Å; K350-F354 PolarHBondContact O-N 3.08Å
351R95.3Very high86.1Confident162 Ų162106.5 Ų106.561%0.61153%0.526SS*.Hα-helixtrans-61.2-44.9176.3-171.5172.7-177-89.6-1.4111.3P347 D348 F354 L355P347-R351 WeakPolarHBondContact O-CB 3.48Å; P347-R351 PolarHBondContact O-N 3.35Å; D348-R351 PolarHBondContact O-N 3.15Å; R351-F354 PolarHBondContact O-N 3.41Å; R351-L355 HydrophobicContact CG-CD1 4.28Å; R351-L355 WeakPolarHBondContact O-CG 3.36Å; R351-L355 PolarHBondContact O-N 2.86Å
352R96.3Very high88.5Confident159 Ų15997.8 Ų97.860%0.650%0.501SS*.Hα-helixtrans-57.1-49.1172.9-175.6179.969158.6-0.2111.8D348 E349 F354 L355 E356D348-R352 WeakPolarHBondContact O-CB 3.3Å; D348-R352 PolarHBondContact O-N 2.98Å; E349-R352 PolarHBondContact O-N 3.25Å; E349-R352 IonicContact OE1-NH2 2.69Å; E349-R352 PolarHBondContact OE1-NH2 3.45Å; R352-F354 VanDerWaalsContact C-N 3.31Å; R352-F354 PolarHBondContact O-N 3.23Å; R352-L355 PolarHBondContact O-N 3.47Å; R352-E356 PolarHBondContact O-N 2.96Å
353K96.5Very high90.8Very high61 Ų6196.7 Ų96.727%0.26549%0.487SS..Hα-helixtrans-62.7-34.1177.3-72167.9-178.3165.20112.3E345 E349 K350 R357E345-K353 IonicContact OE1-NZ 3.51Å; E345-K353 PolarHBondContact OE1-NZ 2.68Å; E349-K353 VanDerWaalsContact CD-CE 3.42Å; E349-K353 WeakPolarHBondContact O-CB 3.1Å; E349-K353 VanDerWaalsContact O-CG 3.31Å; E349-K353 WeakPolarHBondContact O-CG 3.4Å; E349-K353 PolarHBondContact O-N 2.94Å; E349-K353 WeakPolarHBondContact OE1-CE 3.43Å; E349-K353 IonicContact OE1-NZ 2.74Å; E349-K353 PolarHBondContact OE1-NZ 3.09Å; E349-K353 IonicContact OE2-NZ 3.41Å; E349-K353 PolarHBondContact OE2-NZ 2.9Å; K350-K353 PolarHBondContact O-N 3.49Å; K353-R357 VanDerWaalsContact O-CG 3.31Å; K353-R357 WeakPolarHBondContact O-CG 3.4Å; K353-R357 PolarHBondContact O-N 2.97Å; K353-R357 PolarHBondContact O-NH1 3.21Å; K353-R357 VanDerWaalsContact O-NH1 3.12Å
354F96.9Very high92.5Very high132 Ų132100.2 Ų100.258%0.57949%0.49SS*.Hα-helixtrans-69.5-47.9173.8179.1-95.8000112K350 R351 R352 E356 R357 N358K350-F354 PolarHBondContact O-N 3.08Å; R351-F354 PolarHBondContact O-N 3.41Å; R352-F354 VanDerWaalsContact C-N 3.31Å; R352-F354 PolarHBondContact O-N 3.23Å; F354-E356 VanDerWaalsContact C-N 3.32Å; F354-E356 PolarHBondContact O-N 3.27Å; F354-R357 PolarHBondContact O-N 2.97Å; F354-N358 WeakPolarHBondContact O-CB 3.48Å; F354-N358 PolarHBondContact O-N 3.26Å
355L97.9Very high94.6Very high84 Ų8499 Ų9944%0.4448%0.48SS..Hα-helixtrans-60.1-40178.4-71.5171.5000112.1R351 R352 N358 R359R351-L355 HydrophobicContact CG-CD1 4.28Å; R351-L355 WeakPolarHBondContact O-CG 3.36Å; R351-L355 PolarHBondContact O-N 2.86Å; R352-L355 PolarHBondContact O-N 3.47Å; L355-N358 PolarHBondContact O-N 3.41Å; L355-R359 WeakPolarHBondContact O-CB 3.44Å; L355-R359 PolarHBondContact O-N 2.97Å
356E97.8Very high96.2Very high97 Ų97104.6 Ų104.645%0.45350%0.498SS..Hα-helixtrans-69-39.1177.7-165.752.7-129.400112.1R352 F354 N358 R359 A360R352-E356 PolarHBondContact O-N 2.96Å; F354-E356 VanDerWaalsContact C-N 3.32Å; F354-E356 PolarHBondContact O-N 3.27Å; E356-N358 VanDerWaalsContact C-N 3.34Å; E356-N358 PolarHBondContact O-N 3.07Å; E356-R359 PolarHBondContact O-N 3.45Å; E356-R359 IonicContact OE2-CZ 2.63Å; E356-R359 IonicContact OE2-NE 3.5Å; E356-R359 IonicContact OE2-NH1 3.01Å; E356-R359 PolarHBondContact OE2-NH1 2.66Å; E356-A360 WeakPolarHBondContact O-CB 3.47Å; E356-A360 PolarHBondContact O-N 3.12Å
357R98Very high96.8Very high164 Ų164105.3 Ų105.362%0.61950%0.499SS*.Hα-helixtrans-63.2-39.5171.2-71-177.7-157.1104-8.9112.1K353 F354 A360 A361K353-R357 VanDerWaalsContact O-CG 3.31Å; K353-R357 WeakPolarHBondContact O-CG 3.4Å; K353-R357 PolarHBondContact O-N 2.97Å; K353-R357 PolarHBondContact O-NH1 3.21Å; K353-R357 VanDerWaalsContact O-NH1 3.12Å; F354-R357 PolarHBondContact O-N 2.97Å; R357-A360 PolarHBondContact O-N 2.91Å; R357-A361 WeakPolarHBondContact O-CB 3.47Å; R357-A361 PolarHBondContact O-N 3.33Å
358N98.2Very high97.2Very high92 Ų92108.5 Ų108.549%0.49250%0.502SS..Hα-helixtrans-65.4-44.7176.2-176.9-85.8000111.3F354 L355 E356 A360 A361 A362F354-N358 WeakPolarHBondContact O-CB 3.48Å; F354-N358 PolarHBondContact O-N 3.26Å; L355-N358 PolarHBondContact O-N 3.41Å; E356-N358 VanDerWaalsContact C-N 3.34Å; E356-N358 PolarHBondContact O-N 3.07Å; N358-A360 PolarHBondContact O-N 2.91Å; N358-A361 PolarHBondContact O-N 3.47Å; N358-A361 VanDerWaalsContact O-N 3.16Å; N358-A362 WeakPolarHBondContact O-CB 3.44Å; N358-A362 PolarHBondContact O-N 2.96Å
359R98.7Very high97.6Very high157 Ų157111.7 Ų111.759%0.59251%0.506SS*.Hα-helixtrans-55.7-49.8172.9-179.2-176.7-74.2170.5-12.5111.3L355 E356 A361 A362 S363L355-R359 WeakPolarHBondContact O-CB 3.44Å; L355-R359 PolarHBondContact O-N 2.97Å; E356-R359 PolarHBondContact O-N 3.45Å; E356-R359 IonicContact OE2-CZ 2.63Å; E356-R359 IonicContact OE2-NE 3.5Å; E356-R359 IonicContact OE2-NH1 3.01Å; E356-R359 PolarHBondContact OE2-NH1 2.66Å; R359-A361 VanDerWaalsContact C-N 3.35Å; R359-A361 PolarHBondContact O-N 3.44Å; R359-A362 PolarHBondContact O-N 2.73Å; R359-S363 PolarHBondContact O-N 2.92Å; R359-S363 PolarHBondContact O-OG 3.08Å
360A98.4Very high97.8Very high35 Ų35115.6 Ų115.629%0.28952%0.523SS..Hα-helixtrans-63.1-37.4176.300000113E356 R357 N358 R364E356-A360 WeakPolarHBondContact O-CB 3.47Å; E356-A360 PolarHBondContact O-N 3.12Å; R357-A360 PolarHBondContact O-N 2.91Å; N358-A360 PolarHBondContact O-N 2.91Å; A360-R364 WeakPolarHBondContact O-CG 3.36Å; A360-R364 PolarHBondContact O-N 2.92Å; A360-R364 VanDerWaalsContact O-N 3.07Å; A360-R364 PolarHBondContact O-NE 2.66Å
361A98.4Very high98Very high47 Ų47115 Ų11539%0.38853%0.527SS..Hα-helixtrans-67-43.8174.400000112.3R357 N358 R359 R364 C365R357-A361 WeakPolarHBondContact O-CB 3.47Å; R357-A361 PolarHBondContact O-N 3.33Å; N358-A361 PolarHBondContact O-N 3.47Å; N358-A361 VanDerWaalsContact O-N 3.16Å; R359-A361 VanDerWaalsContact C-N 3.35Å; R359-A361 PolarHBondContact O-N 3.44Å; A361-R364 PolarHBondContact O-N 3.33Å; A361-C365 WeakPolarHBondContact O-CB 3.42Å; A361-C365 PolarHBondContact O-N 3.15Å
362A98.5Very high98.2Very high36 Ų36114.8 Ų114.830%0.29853%0.526SS..Hα-helixtrans-62.5-43.7176.300000111.6N358 R359 C365 R366N358-A362 WeakPolarHBondContact O-CB 3.44Å; N358-A362 PolarHBondContact O-N 2.96Å; R359-A362 PolarHBondContact O-N 2.73Å; A362-C365 PolarHBondContact O-N 3.13Å; A362-R366 WeakPolarHBondContact O-CB 3.47Å; A362-R366 VanDerWaalsContact O-CG 3.3Å; A362-R366 WeakPolarHBondContact O-CG 3.25Å; A362-R366 PolarHBondContact O-N 2.91Å
363S98.6Very high98.3Very high69 Ų69109.7 Ų109.748%0.48351%0.513SS..Hα-helixtrans-60.5-45173.9-66.80000112.1R359 R366 Q367R359-S363 PolarHBondContact O-N 2.92Å; R359-S363 PolarHBondContact O-OG 3.08Å; S363-R366 PolarHBondContact O-N 3.06Å; S363-Q367 VanDerWaalsContact O-CB 3.32Å; S363-Q367 WeakPolarHBondContact O-CB 3.45Å; S363-Q367 PolarHBondContact O-N 3.14Å
364R98.6Very high98.4Very high170 Ų170110 Ų11064%0.64252%0.523SS*.Hα-helixtrans-64.7-38.6175.2-75.6-179.9-68.7-141.60.6112.8A360 A361 Q367 K368A360-R364 WeakPolarHBondContact O-CG 3.36Å; A360-R364 PolarHBondContact O-N 2.92Å; A360-R364 VanDerWaalsContact O-N 3.07Å; A360-R364 PolarHBondContact O-NE 2.66Å; A361-R364 PolarHBondContact O-N 3.33Å; R364-Q367 PolarHBondContact O-N 3.18Å; R364-K368 WeakPolarHBondContact O-CB 3.26Å; R364-K368 PolarHBondContact O-N 2.91Å
365C98.7Very high98.5Very high90 Ų90107.3 Ų107.361%0.60852%0.52SS*.Hα-helixtrans-63-49175.4-176.70000111.3A361 A362 Q367 K368 R369A361-C365 WeakPolarHBondContact O-CB 3.42Å; A361-C365 PolarHBondContact O-N 3.15Å; A362-C365 PolarHBondContact O-N 3.13Å; C365-Q367 PolarHBondContact O-N 3.23Å; C365-K368 PolarHBondContact O-N 3.49Å; C365-R369 PolarHBondContact O-N 3.32Å
366R98.8Very high98.6Very high192 Ų192107.6 Ų107.673%0.72552%0.522SS*.Hα-helixtrans-60-43.2175.2-71172.4-178.5-171.9-0.1111.9A362 S363 R369 K370A362-R366 WeakPolarHBondContact O-CB 3.47Å; A362-R366 VanDerWaalsContact O-CG 3.3Å; A362-R366 WeakPolarHBondContact O-CG 3.25Å; A362-R366 PolarHBondContact O-N 2.91Å; S363-R366 PolarHBondContact O-N 3.06Å; R366-R369 PolarHBondContact O-N 2.79Å; R366-K370 WeakPolarHBondContact O-CB 3.28Å; R366-K370 PolarHBondContact O-N 2.87Å
367Q98.7Very high98.6Very high98 Ų98108.1 Ų108.146%0.45852%0.524SS..Hα-helixtrans-67.1-42.5178.1-17463.94.100112S363 R364 C365 R369 K370 V371S363-Q367 VanDerWaalsContact O-CB 3.32Å; S363-Q367 WeakPolarHBondContact O-CB 3.45Å; S363-Q367 PolarHBondContact O-N 3.14Å; R364-Q367 PolarHBondContact O-N 3.18Å; C365-Q367 PolarHBondContact O-N 3.23Å; Q367-R369 VanDerWaalsContact C-N 3.32Å; Q367-R369 PolarHBondContact O-N 3.12Å; Q367-K370 PolarHBondContact O-N 3.45Å; Q367-V371 WeakPolarHBondContact O-CG2 3.19Å; Q367-V371 PolarHBondContact O-N 3.42Å
368K98.7Very high98.6Very high167 Ų167106.1 Ų106.173%0.72652%0.52SS*.Hα-helixtrans-60.6-42.1174.1-173.7177.1-179.5-179.80111.3R364 C365 V371 W372R364-K368 WeakPolarHBondContact O-CB 3.26Å; R364-K368 PolarHBondContact O-N 2.91Å; C365-K368 PolarHBondContact O-N 3.49Å; K368-V371 PolarHBondContact O-N 3Å; K368-W372 WeakPolarHBondContact O-CB 3.45Å; K368-W372 PolarHBondContact O-N 2.94Å
369R98.6Very high98.7Very high177 Ų177107.9 Ų107.967%0.66852%0.523SS*.Hα-helixtrans-63.6-42.3174.6-173.8172.2-179.41560.7111.9C365 R366 Q367 W372 V373C365-R369 PolarHBondContact O-N 3.32Å; R366-R369 PolarHBondContact O-N 2.79Å; Q367-R369 VanDerWaalsContact C-N 3.32Å; Q367-R369 PolarHBondContact O-N 3.12Å; R369-W372 PolarHBondContact O-N 3.41Å; R369-V373 HydrophobicContact CG-CG2 4.43Å; R369-V373 WeakPolarHBondContact O-CG2 3.22Å; R369-V373 PolarHBondContact O-N 2.99Å
370K98.8Very high98.7Very high138 Ų138103.3 Ų103.360%0.652%0.519SS*.Hα-helixtrans-60.1-48.9176.1-175-172.3-67.5-178.50111.7R366 Q367 W372 V373 S374R366-K370 WeakPolarHBondContact O-CB 3.28Å; R366-K370 PolarHBondContact O-N 2.87Å; Q367-K370 PolarHBondContact O-N 3.45Å; K370-W372 VanDerWaalsContact C-N 3.33Å; K370-W372 PolarHBondContact O-N 3.04Å; K370-V373 PolarHBondContact O-N 2.89Å; K370-S374 WeakPolarHBondContact O-CB 3.35Å; K370-S374 PolarHBondContact O-N 3.14Å
371V98.7Very high98.7Very high87 Ų87107.9 Ų107.953%0.52753%0.534SS..Hα-helixtrans-62.6-40.5177.6172.60000111.2Q367 K368 S375Q367-V371 WeakPolarHBondContact O-CG2 3.19Å; Q367-V371 PolarHBondContact O-N 3.42Å; K368-V371 PolarHBondContact O-N 3Å; V371-S375 VanDerWaalsContact O-CB 3.31Å; V371-S375 WeakPolarHBondContact O-CB 3.38Å; V371-S375 PolarHBondContact O-N 3.06Å
372W98.6Very high98.7Very high158 Ų158110 Ų11060%0.59854%0.539SS*.Hα-helixtrans-64.1-46.4176.8178.457000112.6K368 R369 K370 S375 L376K368-W372 WeakPolarHBondContact O-CB 3.45Å; K368-W372 PolarHBondContact O-N 2.94Å; R369-W372 PolarHBondContact O-N 3.41Å; K370-W372 VanDerWaalsContact C-N 3.33Å; K370-W372 PolarHBondContact O-N 3.04Å; W372-S375 PolarHBondContact O-N 3.3Å; W372-L376 HydrophobicContact CD2-CD1 4.18Å; W372-L376 HydrophobicContact CH2-CD1 4.36Å; W372-L376 HydrophobicContact CZ2-CD1 3.81Å; W372-L376 WeakPolarHBondContact O-CG 3.11Å; W372-L376 PolarHBondContact O-N 3.31Å
373V98.8Very high98.7Very high53 Ų53113.3 Ų113.332%0.32155%0.551SS.*Hα-helixtrans-61.2-49.8175.8170.30000110.8R369 K370 S375 L376 E377R369-V373 HydrophobicContact CG-CG2 4.43Å; R369-V373 WeakPolarHBondContact O-CG2 3.22Å; R369-V373 PolarHBondContact O-N 2.99Å; K370-V373 PolarHBondContact O-N 2.89Å; V373-S375 VanDerWaalsContact C-N 3.26Å; V373-S375 PolarHBondContact O-N 3.44Å; V373-L376 WeakPolarHBondContact O-CA 3.38Å; V373-L376 WeakPolarHBondContact O-CB 3.48Å; V373-L376 PolarHBondContact O-N 3.21Å; V373-E377 HydrophobicContact CG1-CG 4.29Å; V373-E377 WeakPolarHBondContact CG1-OE1 3.39Å; V373-E377 WeakPolarHBondContact O-CG 3.4Å; V373-E377 PolarHBondContact O-N 2.94Å
374S98.7Very high98.7Very high67 Ų67115.7 Ų115.747%0.46956%0.559SS.*Hα-helixtrans-59.8-34.7177.5176.90000113K370 E377 K378K370-S374 WeakPolarHBondContact O-CB 3.35Å; K370-S374 PolarHBondContact O-N 3.14Å; S374-E377 WeakPolarHBondContact CA-OE2 3.39Å; S374-K378 WeakPolarHBondContact O-CB 3.35Å; S374-K378 PolarHBondContact O-N 2.97Å
375S98.8Very high98.7Very high76 Ų76110.7 Ų110.753%0.53155%0.55SS..Hα-helixtrans-71-27.9173.6-175.60000113.4V371 W372 V373 K379V371-S375 VanDerWaalsContact O-CB 3.31Å; V371-S375 WeakPolarHBondContact O-CB 3.38Å; V371-S375 PolarHBondContact O-N 3.06Å; W372-S375 PolarHBondContact O-N 3.3Å; V373-S375 VanDerWaalsContact C-N 3.26Å; V373-S375 PolarHBondContact O-N 3.44Å; S375-K379 WeakPolarHBondContact O-CB 3.02Å; S375-K379 PolarHBondContact O-N 2.85Å
376L98.8Very high98.7Very high89 Ų89111 Ų11147%0.46654%0.543SS..Hα-helixtrans-77.8-42.2174.1-70.3174.9000111.2W372 V373 K379 A380W372-L376 HydrophobicContact CD2-CD1 4.18Å; W372-L376 HydrophobicContact CH2-CD1 4.36Å; W372-L376 HydrophobicContact CZ2-CD1 3.81Å; W372-L376 WeakPolarHBondContact O-CG 3.11Å; W372-L376 PolarHBondContact O-N 3.31Å; V373-L376 WeakPolarHBondContact O-CA 3.38Å; V373-L376 WeakPolarHBondContact O-CB 3.48Å; V373-L376 PolarHBondContact O-N 3.21Å; L376-K379 PolarHBondContact O-N 2.87Å; L376-A380 PolarHBondContact O-N 3.45Å
377E98.8Very high98.7Very high108 Ų108105.8 Ų105.851%0.50553%0.53SS..Hα-helixtrans-57-53.7173.8-70.2166.3159.200110.2V373 S374 K379 A380 E381V373-E377 HydrophobicContact CG1-CG 4.29Å; V373-E377 WeakPolarHBondContact CG1-OE1 3.39Å; V373-E377 WeakPolarHBondContact O-CG 3.4Å; V373-E377 PolarHBondContact O-N 2.94Å; S374-E377 WeakPolarHBondContact CA-OE2 3.39Å; E377-K379 VanDerWaalsContact C-N 3.31Å; E377-K379 PolarHBondContact O-N 3.38Å; E377-A380 WeakPolarHBondContact O-CB 3.31Å; E377-A380 PolarHBondContact O-N 3.24Å; E377-E381 WeakPolarHBondContact O-CG 3.36Å; E377-E381 PolarHBondContact O-N 3.2Å
378K98.8Very high98.7Very high123 Ų123103 Ų10354%0.53553%0.527SS..Hα-helixtrans-56.3-43.1174.8-179.9170.9-179.4174.20112.6S374 A380 E381 D382S374-K378 WeakPolarHBondContact O-CB 3.35Å; S374-K378 PolarHBondContact O-N 2.97Å; K378-A380 VanDerWaalsContact C-N 3.28Å; K378-A380 PolarHBondContact O-N 3.02Å; K378-E381 WeakPolarHBondContact O-CB 3.2Å; K378-E381 PolarHBondContact O-N 3.46Å; K378-D382 WeakPolarHBondContact O-CB 3.41Å; K378-D382 VanDerWaalsContact O-CG 3.25Å; K378-D382 PolarHBondContact O-N 3.22Å
379K98.7Very high98.7Very high129 Ų129100 Ų10056%0.56152%0.516SS*.Hα-helixtrans-65.1-32.9178.7-174172.7-178178.50112.3S375 L376 E377 L383S375-K379 WeakPolarHBondContact O-CB 3.02Å; S375-K379 PolarHBondContact O-N 2.85Å; L376-K379 PolarHBondContact O-N 2.87Å; E377-K379 VanDerWaalsContact C-N 3.31Å; E377-K379 PolarHBondContact O-N 3.38Å; K379-L383 HydrophobicContact CG-CD1 4.21Å; K379-L383 WeakPolarHBondContact O-CB 3.09Å; K379-L383 VanDerWaalsContact O-CG 3.26Å; K379-L383 WeakPolarHBondContact O-CG 3.43Å; K379-L383 PolarHBondContact O-N 2.85Å; K379-L383 VanDerWaalsContact O-N 3.07Å
380A98.8Very high98.7Very high61 Ų6195.7 Ų95.750%0.50451%0.506SS..Hα-helixtrans-68.9-41.2173.700000111.4L376 E377 K378 N384L376-A380 PolarHBondContact O-N 3.45Å; E377-A380 WeakPolarHBondContact O-CB 3.31Å; E377-A380 PolarHBondContact O-N 3.24Å; K378-A380 VanDerWaalsContact C-N 3.28Å; K378-A380 PolarHBondContact O-N 3.02Å; A380-N384 VanDerWaalsContact O-CB 3.25Å; A380-N384 WeakPolarHBondContact O-CB 3.42Å; A380-N384 PolarHBondContact O-N 3.37Å
381E98.8Very high98.7Very high131 Ų13194.6 Ų94.661%0.61250%0.503SS*.Hα-helixtrans-61.6-48.6173.6-67.4168.118000111.9E377 K378 L383 N384 S385E377-E381 WeakPolarHBondContact O-CG 3.36Å; E377-E381 PolarHBondContact O-N 3.2Å; K378-E381 WeakPolarHBondContact O-CB 3.2Å; K378-E381 PolarHBondContact O-N 3.46Å; E381-L383 PolarHBondContact O-N 3.01Å; E381-N384 PolarHBondContact O-N 2.95Å; E381-S385 WeakPolarHBondContact O-CB 3.43Å; E381-S385 PolarHBondContact O-N 2.92Å
382D98.8Very high98.7Very high90 Ų9093.5 Ų93.548%0.48150%0.499SS..Hα-helixtrans-58.6-45.7177.9-70.1-26.7000111.1K378 S385 M386K378-D382 WeakPolarHBondContact O-CB 3.41Å; K378-D382 VanDerWaalsContact O-CG 3.25Å; K378-D382 PolarHBondContact O-N 3.22Å; D382-S385 PolarHBondContact O-N 3.39Å; D382-M386 WeakPolarHBondContact O-CB 3.49Å; D382-M386 PolarHBondContact O-N 3.34Å
383L98.8Very high98.8Very high106 Ų10691.1 Ų91.156%0.55549%0.494SS*.Hα-helixtrans-67.9-37.5177.1-74.1172.8000112.7K379 E381 M386 N387K379-L383 HydrophobicContact CG-CD1 4.21Å; K379-L383 WeakPolarHBondContact O-CB 3.09Å; K379-L383 VanDerWaalsContact O-CG 3.26Å; K379-L383 WeakPolarHBondContact O-CG 3.43Å; K379-L383 PolarHBondContact O-N 2.85Å; K379-L383 VanDerWaalsContact O-N 3.07Å; E381-L383 PolarHBondContact O-N 3.01Å; L383-M386 PolarHBondContact O-N 3.26Å; L383-N387 VanDerWaalsContact O-CB 3.3Å; L383-N387 WeakPolarHBondContact O-CB 3.33Å; L383-N387 PolarHBondContact O-N 2.94Å
384N98.8Very high98.8Very high120 Ų12091.7 Ų91.764%0.64250%0.498SS*.Hα-helixtrans-67-40.7176.2-174.473.5000111.5A380 E381 N387 G388A380-N384 VanDerWaalsContact O-CB 3.25Å; A380-N384 WeakPolarHBondContact O-CB 3.42Å; A380-N384 PolarHBondContact O-N 3.37Å; E381-N384 PolarHBondContact O-N 2.95Å; N384-N387 PolarHBondContact O-N 3.44Å; N384-G388 PolarHBondContact O-N 2.92Å
385S98.8Very high98.8Very high64 Ų6491.9 Ų91.945%0.44850%0.496SS..Hα-helixtrans-61-47.9173-179.70000111.7E381 D382 N387 G388 Q389E381-S385 WeakPolarHBondContact O-CB 3.43Å; E381-S385 PolarHBondContact O-N 2.92Å; D382-S385 PolarHBondContact O-N 3.39Å; S385-N387 VanDerWaalsContact C-N 3.35Å; S385-N387 PolarHBondContact O-N 3.47Å; S385-G388 PolarHBondContact O-N 2.92Å; S385-Q389 WeakPolarHBondContact O-CG 3.46Å; S385-Q389 PolarHBondContact O-N 2.92Å; S385-Q389 PolarHBondContact O-NE2 3.35Å; S385-Q389 PolarHBondContact OG-NE2 3.24Å; S385-Q389 VanDerWaalsContact OG-NE2 3.12Å
386M98.7Very high98.8Very high97 Ų9794 Ų9448%0.47850%0.501SS..Hα-helixtrans-61.8-41.5177-174.65963.800112D382 L383 Q389 L390D382-M386 WeakPolarHBondContact O-CB 3.49Å; D382-M386 PolarHBondContact O-N 3.34Å; L383-M386 PolarHBondContact O-N 3.26Å; M386-Q389 PolarHBondContact O-N 2.82Å; M386-L390 HydrophobicContact CG-CD1 4.13Å; M386-L390 WeakPolarHBondContact O-CG 3.42Å; M386-L390 PolarHBondContact O-N 2.95Å; M386-L390 HydrophobicContact SD-CG 4.44Å
387N98.7Very high98.8Very high82 Ų8294.6 Ų94.644%0.43950%0.504SS..Hα-helixtrans-62.6-43.4176.1-167.7-5000111.3L383 N384 S385 Q389 L390 Q391L383-N387 VanDerWaalsContact O-CB 3.3Å; L383-N387 WeakPolarHBondContact O-CB 3.33Å; L383-N387 PolarHBondContact O-N 2.94Å; N384-N387 PolarHBondContact O-N 3.44Å; S385-N387 VanDerWaalsContact C-N 3.35Å; S385-N387 PolarHBondContact O-N 3.47Å; N387-Q389 PolarHBondContact O-N 3.22Å; N387-L390 PolarHBondContact O-N 2.89Å; N387-Q391 WeakPolarHBondContact O-CB 3.47Å; N387-Q391 VanDerWaalsContact O-CG 3.27Å; N387-Q391 WeakPolarHBondContact O-CG 3.42Å; N387-Q391 PolarHBondContact O-N 3.49Å; N387-Q391 PolarHBondContact OD1-NE2 2.89Å
388G98.8Very high98.7Very high39 Ų3998 Ų9840%0.40251%0.512SS..Hα-helixtrans-59.9-41.9173.400000113.3N384 S385 Q391 S392N384-G388 PolarHBondContact O-N 2.92Å; S385-G388 PolarHBondContact O-N 2.92Å; G388-Q391 PolarHBondContact O-N 3.29Å; G388-S392 PolarHBondContact O-N 3.3Å
389Q98.8Very high98.7Very high104 Ų10496.9 Ų96.949%0.48651%0.512SS..Hα-helixtrans-62-50.5175.4-71.317057.700111.4S385 M386 N387 Q391 S392 E393S385-Q389 WeakPolarHBondContact O-CG 3.46Å; S385-Q389 PolarHBondContact O-N 2.92Å; S385-Q389 PolarHBondContact O-NE2 3.35Å; S385-Q389 PolarHBondContact OG-NE2 3.24Å; S385-Q389 VanDerWaalsContact OG-NE2 3.12Å; M386-Q389 PolarHBondContact O-N 2.82Å; N387-Q389 PolarHBondContact O-N 3.22Å; Q389-Q391 VanDerWaalsContact C-N 3.34Å; Q389-Q391 PolarHBondContact O-N 3.44Å; Q389-S392 WeakPolarHBondContact O-CB 3.46Å; Q389-S392 PolarHBondContact O-N 3.31Å; Q389-S392 PolarHBondContact O-OG 3.3Å; Q389-E393 PolarHBondContact O-N 3.08Å
390L98.8Very high98.7Very high88 Ų8894.3 Ų94.346%0.46150%0.502SS..Hα-helixtrans-62.5-37.4178.2-68.2170000112.5M386 N387 S392 E393 V394M386-L390 HydrophobicContact CG-CD1 4.13Å; M386-L390 WeakPolarHBondContact O-CG 3.42Å; M386-L390 PolarHBondContact O-N 2.95Å; M386-L390 HydrophobicContact SD-CG 4.44Å; N387-L390 PolarHBondContact O-N 2.89Å; L390-S392 VanDerWaalsContact C-N 3.33Å; L390-E393 PolarHBondContact O-N 3.44Å; L390-V394 WeakPolarHBondContact O-CB 3.39Å; L390-V394 VanDerWaalsContact O-CG2 3.31Å; L390-V394 WeakPolarHBondContact O-CG2 3.43Å; L390-V394 PolarHBondContact O-N 3.36Å
391Q98.8Very high98.7Very high115 Ų11594.8 Ų94.854%0.53750%0.499SS..Hα-helixtrans-64.5-37.3173-74.1177.433.700112.2N387 G388 Q389 T395N387-Q391 WeakPolarHBondContact O-CB 3.47Å; N387-Q391 VanDerWaalsContact O-CG 3.27Å; N387-Q391 WeakPolarHBondContact O-CG 3.42Å; N387-Q391 PolarHBondContact O-N 3.49Å; N387-Q391 PolarHBondContact OD1-NE2 2.89Å; G388-Q391 PolarHBondContact O-N 3.29Å; Q389-Q391 VanDerWaalsContact C-N 3.34Å; Q389-Q391 PolarHBondContact O-N 3.44Å; Q391-T395 WeakPolarHBondContact O-CB 3.43Å; Q391-T395 PolarHBondContact O-N 3.47Å; Q391-T395 PolarHBondContact O-OG1 2.93Å
392S98.8Very high98.7Very high64 Ų6491 Ų9145%0.44849%0.49SS..Hα-helixtrans-66.4-41.8175.279.50000111.7G388 Q389 L390 T395 L396G388-S392 PolarHBondContact O-N 3.3Å; Q389-S392 WeakPolarHBondContact O-CB 3.46Å; Q389-S392 PolarHBondContact O-N 3.31Å; Q389-S392 PolarHBondContact O-OG 3.3Å; L390-S392 VanDerWaalsContact C-N 3.33Å; S392-T395 WeakPolarHBondContact O-CB 3.47Å; S392-T395 PolarHBondContact O-N 2.86Å; S392-L396 WeakPolarHBondContact O-CG 3.34Å; S392-L396 PolarHBondContact O-N 2.79Å
393E98.7Very high98.7Very high107 Ų10792.8 Ų92.850%0.549%0.49SS..Hα-helixtrans-63.7-47.3175.9-174.2-179.3179.600111.6Q389 L390 T395 L396 L397Q389-E393 PolarHBondContact O-N 3.08Å; L390-E393 PolarHBondContact O-N 3.44Å; E393-T395 PolarHBondContact O-N 3.45Å; E393-L396 PolarHBondContact O-N 3.25Å; E393-L396 VanDerWaalsContact O-N 3.13Å; E393-L397 HydrophobicContact CG-CD1 4.1Å; E393-L397 HydrophobicContact CG-CG 4.47Å; E393-L397 WeakPolarHBondContact O-CG 3.34Å; E393-L397 PolarHBondContact O-N 2.85Å
394V98.8Very high98.6Very high65 Ų6591.4 Ų91.439%0.39448%0.483SS..Hα-helixtrans-56.6-36.9173.5167.20000111.4L390 R398L390-V394 WeakPolarHBondContact O-CB 3.39Å; L390-V394 VanDerWaalsContact O-CG2 3.31Å; L390-V394 WeakPolarHBondContact O-CG2 3.43Å; L390-V394 PolarHBondContact O-N 3.36Å; V394-R398 WeakPolarHBondContact O-CB 3.45Å; V394-R398 WeakPolarHBondContact O-CD 3.31Å; V394-R398 WeakPolarHBondContact O-CG 3.35Å; V394-R398 PolarHBondContact O-N 2.86Å
395T98.8Very high98.5Very high71 Ų7192.4 Ų92.444%0.43648%0.481SS..Hα-helixtrans-69.3-44.3177-57.80000111.6Q391 S392 E393 R398 N399Q391-T395 WeakPolarHBondContact O-CB 3.43Å; Q391-T395 PolarHBondContact O-N 3.47Å; Q391-T395 PolarHBondContact O-OG1 2.93Å; S392-T395 WeakPolarHBondContact O-CB 3.47Å; S392-T395 PolarHBondContact O-N 2.86Å; E393-T395 PolarHBondContact O-N 3.45Å; T395-R398 PolarHBondContact O-N 3.28Å; T395-N399 VanDerWaalsContact O-CG 3.24Å; T395-N399 PolarHBondContact O-N 3.38Å; T395-N399 PolarHBondContact O-ND2 3.43Å
396L98.8Very high98.4Very high120 Ų12096.3 Ų96.363%0.62849%0.493SS*.Hα-helixtrans-61.1-46.2175.4-69.8171.9000111.8S392 E393 R398 N399 E400S392-L396 WeakPolarHBondContact O-CG 3.34Å; S392-L396 PolarHBondContact O-N 2.79Å; E393-L396 PolarHBondContact O-N 3.25Å; E393-L396 VanDerWaalsContact O-N 3.13Å; L396-R398 PolarHBondContact O-N 3.48Å; L396-N399 PolarHBondContact O-N 3.16Å; L396-E400 PolarHBondContact O-N 3.21Å
397L98.8Very high98.3Very high103 Ų10395.7 Ų95.754%0.53949%0.491SS..Hα-helixtrans-64.1-39.1177.9-68.1173.1000112.1E393 E400 V401E393-L397 HydrophobicContact CG-CD1 4.1Å; E393-L397 HydrophobicContact CG-CG 4.47Å; E393-L397 WeakPolarHBondContact O-CG 3.34Å; E393-L397 PolarHBondContact O-N 2.85Å; L397-E400 PolarHBondContact O-N 3.46Å; L397-V401 WeakPolarHBondContact O-CG2 3.36Å; L397-V401 PolarHBondContact O-N 3.23Å
398R98.6Very high98Very high178 Ų17898 Ų9867%0.67250%0.503SS*.Hα-helixtrans-62.9-42173.4-77.4169.7178.3-175.90.7112.1V394 T395 L396 V401 A402V394-R398 WeakPolarHBondContact O-CB 3.45Å; V394-R398 WeakPolarHBondContact O-CD 3.31Å; V394-R398 WeakPolarHBondContact O-CG 3.35Å; V394-R398 PolarHBondContact O-N 2.86Å; T395-R398 PolarHBondContact O-N 3.28Å; L396-R398 PolarHBondContact O-N 3.48Å; R398-V401 PolarHBondContact O-N 2.88Å; R398-A402 WeakPolarHBondContact O-CB 3.36Å; R398-A402 PolarHBondContact O-N 2.83Å
399N98.6Very high97.7Very high100 Ų100102.2 Ų102.254%0.53552%0.515SS..Hα-helixtrans-64.6-41.4176.7-70.9-20.3000111.6T395 L396 A402 R403T395-N399 VanDerWaalsContact O-CG 3.24Å; T395-N399 PolarHBondContact O-N 3.38Å; T395-N399 PolarHBondContact O-ND2 3.43Å; L396-N399 PolarHBondContact O-N 3.16Å; N399-A402 WeakPolarHBondContact O-CB 3.47Å; N399-A402 PolarHBondContact O-N 3.47Å; N399-R403 WeakPolarHBondContact O-CB 3.3Å; N399-R403 PolarHBondContact O-N 3.47Å
400E98.5Very high97.4Very high75 Ų75101.2 Ų101.235%0.3552%0.524SS..Hα-helixtrans-66.2-43.1176.6-179.757.3-166.200112L396 L397 A402 R403 L404L396-E400 PolarHBondContact O-N 3.21Å; L397-E400 PolarHBondContact O-N 3.46Å; E400-A402 VanDerWaalsContact C-N 3.28Å; E400-A402 PolarHBondContact O-N 2.9Å; E400-R403 PolarHBondContact O-N 3.24Å; E400-R403 IonicContact OE1-CZ 3.64Å; E400-R403 IonicContact OE1-NE 2.81Å; E400-R403 IonicContact OE1-NH2 3.9Å; E400-R403 PolarHBondContact OE1-NH2 3.21Å; E400-R403 IonicContact OE2-CZ 2.75Å; E400-R403 IonicContact OE2-NE 2.66Å; E400-R403 PolarHBondContact OE2-NE 2.93Å; E400-R403 IonicContact OE2-NH2 3.82Å; E400-R403 PolarHBondContact OE2-NH2 3.44Å; E400-L404 HydrophobicContact CG-CD1 4.09Å; E400-L404 HydrophobicContact CG-CG 4.45Å; E400-L404 WeakPolarHBondContact O-CB 3.38Å; E400-L404 VanDerWaalsContact O-CG 3.32Å; E400-L404 WeakPolarHBondContact O-CG 3.48Å; E400-L404 PolarHBondContact O-N 3.07Å; E400-L404 WeakPolarHBondContact OE1-CG 3.41Å
401V98.5Very high96.9Very high72 Ų72101.6 Ų101.644%0.43652%0.524SS..Hα-helixtrans-59.8-39.1172.7169.30000111.5L397 R398 K405L397-V401 WeakPolarHBondContact O-CG2 3.36Å; L397-V401 PolarHBondContact O-N 3.23Å; R398-V401 PolarHBondContact O-N 2.88Å; V401-K405 HydrophobicContact CG1-CD 4.09Å; V401-K405 WeakPolarHBondContact O-CB 3.32Å; V401-K405 VanDerWaalsContact O-CG 3.25Å; V401-K405 WeakPolarHBondContact O-CG 3.34Å; V401-K405 PolarHBondContact O-N 3.04Å
402A98.4Very high96.2Very high52 Ų52102.4 Ų102.443%0.4353%0.526SS..Hα-helixtrans-65.4-44.817500000111.9R398 N399 E400 K405 Q406R398-A402 WeakPolarHBondContact O-CB 3.36Å; R398-A402 PolarHBondContact O-N 2.83Å; N399-A402 WeakPolarHBondContact O-CB 3.47Å; N399-A402 PolarHBondContact O-N 3.47Å; E400-A402 VanDerWaalsContact C-N 3.28Å; E400-A402 PolarHBondContact O-N 2.9Å; A402-K405 PolarHBondContact O-N 2.72Å; A402-Q406 WeakPolarHBondContact O-CB 3.39Å; A402-Q406 PolarHBondContact O-N 3.28Å
403R98.1Very high95.4Very high126 Ų126105.4 Ų105.448%0.47554%0.536SS..Hα-helixtrans-60.4-45.4176.9-168.6-169.672.181.81.4112.1N399 E400 Q406 L407N399-R403 WeakPolarHBondContact O-CB 3.3Å; N399-R403 PolarHBondContact O-N 3.47Å; E400-R403 PolarHBondContact O-N 3.24Å; E400-R403 IonicContact OE1-CZ 3.64Å; E400-R403 IonicContact OE1-NE 2.81Å; E400-R403 IonicContact OE1-NH2 3.9Å; E400-R403 PolarHBondContact OE1-NH2 3.21Å; E400-R403 IonicContact OE2-CZ 2.75Å; E400-R403 IonicContact OE2-NE 2.66Å; E400-R403 PolarHBondContact OE2-NE 2.93Å; E400-R403 IonicContact OE2-NH2 3.82Å; E400-R403 PolarHBondContact OE2-NH2 3.44Å; R403-Q406 PolarHBondContact O-N 3.37Å; R403-L407 PolarHBondContact O-N 2.92Å
404L97.9Very high94.8Very high77 Ų77101.7 Ų101.740%0.40352%0.522SS..Hα-helixtrans-65.4-41.6177.2-68.8172.5000111.8E400 Q406 L407 L408E400-L404 HydrophobicContact CG-CD1 4.09Å; E400-L404 HydrophobicContact CG-CG 4.45Å; E400-L404 WeakPolarHBondContact O-CB 3.38Å; E400-L404 VanDerWaalsContact O-CG 3.32Å; E400-L404 WeakPolarHBondContact O-CG 3.48Å; E400-L404 PolarHBondContact O-N 3.07Å; E400-L404 WeakPolarHBondContact OE1-CG 3.41Å; L404-Q406 PolarHBondContact O-N 2.84Å; L404-L407 PolarHBondContact O-N 2.93Å; L404-L408 WeakPolarHBondContact O-CG 3.44Å; L404-L408 PolarHBondContact O-N 3.22Å
405K96.6Very high93.8Very high141 Ų141103.1 Ų103.161%0.61353%0.533SS*.Hα-helixtrans-61.7-41.4173.1-77174.6178.4-178.40112.3V401 A402 L408 L409V401-K405 HydrophobicContact CG1-CD 4.09Å; V401-K405 WeakPolarHBondContact O-CB 3.32Å; V401-K405 VanDerWaalsContact O-CG 3.25Å; V401-K405 WeakPolarHBondContact O-CG 3.34Å; V401-K405 PolarHBondContact O-N 3.04Å; A402-K405 PolarHBondContact O-N 2.72Å; K405-L408 PolarHBondContact O-N 2.81Å; K405-L409 WeakPolarHBondContact O-CB 3.31Å; K405-L409 PolarHBondContact O-N 2.97Å
406Q97Very high93Very high146 Ų146104 Ų10468%0.68254%0.538SS*.Hα-helixtrans-63.3-41.2175.9-176.9178-11.400111.6A402 R403 L404 L409 A410A402-Q406 WeakPolarHBondContact O-CB 3.39Å; A402-Q406 PolarHBondContact O-N 3.28Å; R403-Q406 PolarHBondContact O-N 3.37Å; L404-Q406 PolarHBondContact O-N 2.84Å; Q406-L409 PolarHBondContact O-N 3.39Å; Q406-A410 WeakPolarHBondContact O-CB 3.48Å; Q406-A410 PolarHBondContact O-N 3.42Å
407L95.5Very high91.9Very high85 Ų85101.4 Ų101.445%0.44553%0.527SS..Hα-helixtrans-65-45.1176-175.563000111.9R403 L404 L409 A410 H411R403-L407 PolarHBondContact O-N 2.92Å; L404-L407 PolarHBondContact O-N 2.93Å; L407-L409 VanDerWaalsContact C-N 3.31Å; L407-L409 PolarHBondContact O-N 3.29Å; L407-A410 PolarHBondContact O-N 2.9Å; L407-H411 PolarHBondContact O-CD2 3.31Å; L407-H411 PolarHBondContact O-N 3.29Å; L407-H411 VanDerWaalsContact O-N 3.07Å
408L92.6Very high90.6Very high131 Ų13199 Ų9969%0.68652%0.522SS*.Hα-helixtrans-60.2-40.9174.6-72.2171.4000111.9L404 K405 H411 K412L404-L408 WeakPolarHBondContact O-CG 3.44Å; L404-L408 PolarHBondContact O-N 3.22Å; K405-L408 PolarHBondContact O-N 2.81Å; L408-H411 CarbonylContact O-C 3.38Å; L408-H411 PolarHBondContact O-N 3.39Å; L408-K412 PolarHBondContact O-N 3.26Å; L408-K412 VanDerWaalsContact O-N 3.17Å
409L93.1Very high89.4Confident127 Ų12796.8 Ų96.867%0.66552%0.521SS*.Hα-helixtrans-67.6-37.9177.5-170.865.3000112.1K405 Q406 L407 H411 K412K405-L409 WeakPolarHBondContact O-CB 3.31Å; K405-L409 PolarHBondContact O-N 2.97Å; Q406-L409 PolarHBondContact O-N 3.39Å; L407-L409 VanDerWaalsContact C-N 3.31Å; L407-L409 PolarHBondContact O-N 3.29Å; L409-H411 VanDerWaalsContact C-N 3.27Å; L409-H411 PolarHBondContact O-N 3.4Å; L409-K412 VanDerWaalsContact O-CB 3.23Å; L409-K412 WeakPolarHBondContact O-CB 3.41Å; L409-K412 PolarHBondContact O-N 2.95Å
410A91.4Very high88.3Confident82 Ų8297.6 Ų97.668%0.67852%0.522SS*.Hα-helixtrans-64.1-31.8173.800000112.6Q406 L407Q406-A410 WeakPolarHBondContact O-CB 3.48Å; Q406-A410 PolarHBondContact O-N 3.42Å; L407-A410 PolarHBondContact O-N 2.9Å
411H88.6Confident87.1Confident97 Ų97100.1 Ų100.145%0.44953%0.531SS..THydrogen-bonded Turntrans-87.90.9175.9-80.6-84.2000114.8L407 L408 L409 D413 C414L407-H411 PolarHBondContact O-CD2 3.31Å; L407-H411 PolarHBondContact O-N 3.29Å; L407-H411 VanDerWaalsContact O-N 3.07Å; L408-H411 CarbonylContact O-C 3.38Å; L408-H411 PolarHBondContact O-N 3.39Å; L409-H411 VanDerWaalsContact C-N 3.27Å; L409-H411 PolarHBondContact O-N 3.4Å; H411-D413 PolarHBondContact O-N 2.93Å; H411-D413 VanDerWaalsContact O-N 3.12Å; H411-C414 HydrophobicContact CB-CB 4.33Å; H411-C414 VanDerWaalsContact O-CB 3.22Å; H411-C414 WeakPolarHBondContact O-CB 3.46Å; H411-C414 PolarHBondContact O-N 3.12Å
412K84.3Confident85.7Confident132 Ų132103.7 Ų103.757%0.57454%0.541SS*.THydrogen-bonded Turntrans-53.9-37.5-173.8-163-145.576.6-160.70113.6L408 L409L408-K412 PolarHBondContact O-N 3.26Å; L408-K412 VanDerWaalsContact O-N 3.17Å; L409-K412 VanDerWaalsContact O-CB 3.23Å; L409-K412 WeakPolarHBondContact O-CB 3.41Å; L409-K412 PolarHBondContact O-N 2.95Å
413D82.4Confident84.1Confident126 Ų126104.8 Ų104.867%0.67455%0.546SS*.THydrogen-bonded Turntrans-111.522.5-179.8-58.1-50.7000112.7H411H411-D413 PolarHBondContact O-N 2.93Å; H411-D413 VanDerWaalsContact O-N 3.12Å
414C86Confident82.3Confident29 Ų29101.9 Ų101.920%0.19655%0.548CS..  trans-65.3129.9-179.4-175.30000111.2H411 V416 T417 A418H411-C414 HydrophobicContact CB-CB 4.33Å; H411-C414 VanDerWaalsContact O-CB 3.22Å; H411-C414 WeakPolarHBondContact O-CB 3.46Å; H411-C414 PolarHBondContact O-N 3.12Å; C414-V416 VanDerWaalsContact C-N 3.25Å; C414-V416 PolarHBondContact O-N 2.76Å; C414-T417 WeakPolarHBondContact O-CB 3.38Å; C414-T417 PolarHBondContact O-N 2.95Å; C414-A418 PolarHBondContact O-N 3.15Å
415P78.5Confident80.4Confident95 Ų95105.1 Ų105.162%0.61756%0.556SS**Hα-helixtrans-61.2-31.8-175.821.7-32.9000113.2A418 M419P415-A418 PolarHBondContact O-N 3.47Å; P415-M419 WeakPolarHBondContact O-CB 3.43Å; P415-M419 WeakPolarHBondContact O-CG 3.37Å; P415-M419 PolarHBondContact O-N 3.42Å
416V80.1Confident78.4Confident90 Ų90105.5 Ų105.555%0.54556%0.56SS.*Hα-helixtrans-63.2-46.5174.8-179.90000110.9C414 A418 M419 Q420C414-V416 VanDerWaalsContact C-N 3.25Å; C414-V416 PolarHBondContact O-N 2.76Å; V416-A418 VanDerWaalsContact C-N 3.35Å; V416-M419 PolarHBondContact O-N 3.16Å; V416-Q420 WeakPolarHBondContact O-CG 3.38Å; V416-Q420 PolarHBondContact O-N 3.01Å
417T75.6Confident76.3Confident65 Ų65104.2 Ų104.240%0.39956%0.562SS.*Hα-helixtrans-65.7-38177.2-47.80000111.4C414 K421C414-T417 WeakPolarHBondContact O-CB 3.38Å; C414-T417 PolarHBondContact O-N 2.95Å; T417-K421 VanDerWaalsContact O-CB 3.26Å; T417-K421 WeakPolarHBondContact O-CB 3.36Å; T417-K421 PolarHBondContact O-N 3.14Å
418A73.4Confident74.1Confident53 Ų53105 Ų10544%0.43858%0.575SS.*Hα-helixtrans-66.1-38.7174.400000112.8C414 P415 V416 K422C414-A418 PolarHBondContact O-N 3.15Å; P415-A418 PolarHBondContact O-N 3.47Å; V416-A418 VanDerWaalsContact C-N 3.35Å; A418-K422 PolarHBondContact O-N 3.19Å
419M72.6Confident71.9Confident131 Ų131106.1 Ų106.165%0.64558%0.576SS**Hα-helixtrans-67.1-46.3175.1-67.7-118.766.600111.7P415 V416 K421 K422 S423P415-M419 WeakPolarHBondContact O-CB 3.43Å; P415-M419 WeakPolarHBondContact O-CG 3.37Å; P415-M419 PolarHBondContact O-N 3.42Å; V416-M419 PolarHBondContact O-N 3.16Å; M419-K421 VanDerWaalsContact C-N 3.33Å; M419-K421 PolarHBondContact O-N 3.34Å; M419-K422 PolarHBondContact O-N 3.08Å; M419-S423 PolarHBondContact O-N 2.94Å
420Q74.6Confident69.7Low118 Ų118109.3 Ų109.355%0.55159%0.585SS**Hα-helixtrans-60.9-40.7175.3-74.3172.5-2400112.1V416 S423 A424V416-Q420 WeakPolarHBondContact O-CG 3.38Å; V416-Q420 PolarHBondContact O-N 3.01Å; Q420-S423 WeakPolarHBondContact CA-OG 3.47Å; Q420-S423 PolarHBondContact O-N 3Å; Q420-S423 PolarHBondContact O-OG 3.14Å; Q420-A424 WeakPolarHBondContact O-CB 3.31Å; Q420-A424 PolarHBondContact O-N 2.73Å
421K73.1Confident67.7Low127 Ų127113.8 Ų113.855%0.55259%0.592SS**Hα-helixtrans-62.5-42.9175.3-173.2166.4-176.5178.10111.1T417 M419 A424 Y425T417-K421 VanDerWaalsContact O-CB 3.26Å; T417-K421 WeakPolarHBondContact O-CB 3.36Å; T417-K421 PolarHBondContact O-N 3.14Å; M419-K421 VanDerWaalsContact C-N 3.33Å; M419-K421 PolarHBondContact O-N 3.34Å; K421-A424 PolarHBondContact O-N 3.05Å; K421-Y425 HydrophobicContact CD-CE2 4.28Å; K421-Y425 HydrophobicContact CG-CD2 4.13Å; K421-Y425 HydrophobicContact CG-CE2 3.59Å; K421-Y425 WeakPolarHBondContact O-CD2 2.99Å; K421-Y425 PolarHBondContact O-N 2.85Å
422K68.9Low65.3Low148 Ų148116.8 Ų116.864%0.64361%0.611SS**Hα-helixtrans-64.6-39.2174-77.5-176.2175-174.80113.4A418 M419 A424 H426A418-K422 PolarHBondContact O-N 3.19Å; M419-K422 PolarHBondContact O-N 3.08Å; K422-A424 VanDerWaalsContact C-N 3.33Å; K422-H426 PolarHBondContact O-CD2 2.79Å; K422-H426 PolarHBondContact O-N 2.93Å
423S65.5Low63.5Low75 Ų75116.2 Ų116.252%0.52462%0.624SS.*Hα-helixtrans-69.5-30.6176.5620000113M419 Q420 T427M419-S423 PolarHBondContact O-N 2.94Å; Q420-S423 WeakPolarHBondContact CA-OG 3.47Å; Q420-S423 PolarHBondContact O-N 3Å; Q420-S423 PolarHBondContact O-OG 3.14Å; S423-T427 PolarHBondContact O-OG1 3.44Å
424A61.2Low61.5Low65 Ų65115.1 Ų115.154%0.53763%0.625SS.*Hα-helixtrans-67.7-40.5177.500000112.7Q420 K421 K422 T427Q420-A424 WeakPolarHBondContact O-CB 3.31Å; Q420-A424 PolarHBondContact O-N 2.73Å; K421-A424 PolarHBondContact O-N 3.05Å; K422-A424 VanDerWaalsContact C-N 3.33Å; A424-T427 PolarHBondContact O-N 3.01Å
425Y57.7Low59.5Low145 Ų145122.2 Ų122.257%0.56966%0.655SS**Hα-helixtrans-69-34.5178.6-72.6-66.9000113.2K421 T427 S428K421-Y425 HydrophobicContact CD-CE2 4.28Å; K421-Y425 HydrophobicContact CG-CD2 4.13Å; K421-Y425 HydrophobicContact CG-CE2 3.59Å; K421-Y425 WeakPolarHBondContact O-CD2 2.99Å; K421-Y425 PolarHBondContact O-N 2.85Å; Y425-T427 PolarHBondContact O-N 2.93Å; Y425-T427 VanDerWaalsContact O-N 3.11Å; Y425-S428 PolarHBondContact O-N 2.68Å; Y425-S428 VanDerWaalsContact O-N 3.1Å
426H54.7Low57.8Low148 Ų148126 Ų12669%0.68567%0.665SS**THydrogen-bonded Turntrans-66.4-11179.1-84.9-52000115.4K422 S428K422-H426 PolarHBondContact O-CD2 2.79Å; K422-H426 PolarHBondContact O-N 2.93Å; H426-S428 VanDerWaalsContact C-N 3.35Å
427T52.3Low55.9Low120 Ų120129.5 Ų129.574%0.73668%0.677SS**THydrogen-bonded Turntrans-84.2-10.9175-38.70000112.6S423 A424 Y425S423-T427 PolarHBondContact O-OG1 3.44Å; A424-T427 PolarHBondContact O-N 3.01Å; Y425-T427 PolarHBondContact O-N 2.93Å; Y425-T427 VanDerWaalsContact O-N 3.11Å
428S48.5Very low54.2Low101 Ų101130.8 Ų130.871%0.70669%0.689SS**SBendtrans-105.2-2.5-172.1-160.60000115.2Y425 H426Y425-S428 PolarHBondContact O-N 2.68Å; Y425-S428 VanDerWaalsContact O-N 3.1Å; H426-S428 VanDerWaalsContact C-N 3.35Å
429E47.1Very low52.8Low154 Ų154134.9 Ų134.972%0.7271%0.708SS**SBendtrans-104.417-171.6-60.6-169.9153.500114.1
430K47.8Very low51.7Low195 Ų195135 Ų13585%0.84872%0.718SS**SBendtrans-98.2-11.5-178.7-161.9164.9-177.5-177.70114.9
431E48.4Very low49.8Very low175 Ų175132.7 Ų132.782%0.81873%0.727SS**SBendtrans-136.568.6-176.5-63.5-173.6-167.700111.1
432D39.1Very low48.1Very low160 Ų160132.4 Ų132.486%0.85674%0.741SS**  trans-166.4127.9132.8-108.4-41.8000111.5
433S45.1Very low47.5Very low120 Ų120130.2 Ų130.284%0.83974%0.742SS**  trans-133.584.1-178.9164.70000109.4
434C41.1Very low46.1Very low104 Ų104136.1 Ų136.170%0.70376%0.761SS**  trans-159.8136.4160.5410000113.6
435E43.3Very low45.1Very low177 Ų177140.2 Ų140.283%0.82777%0.774SS**  trans6099.8157.3-54.2-52.910400121.2
436E44.3Very low44.3Very low176 Ų176142 Ų14282%0.82279%0.787SS**  trans-21.6134.1141.6-176.9-167.3149.100117.3
437M40.6Very low43.4Very low163 Ų163139.5 Ų139.580%0.80379%0.792SS**  trans-156107.9136.3-167.156.4172.200113.8
438S38.5Very low42.9Very low92 Ų92140.4 Ų140.464%0.64379%0.791SS**  trans63.1126.6151.4-630000122.6
439V45.5Very low42.5Very low139 Ų139144.6 Ų144.684%0.84280%0.8SS**  trans-117138.7166.91710000105.9
440P49.4Very low42Very low132 Ų132145.1 Ų145.186%0.85780%0.802SS**  -151.118075.637.9-15.6000114.8
441G33.7Very low41.2Very low71 Ų71141.5 Ų141.573%0.73280%0.801SS**  cis174.3148.7-2.800000109.7
442S36.9Very low40.8Very low120 Ų120138.7 Ų138.784%0.83980%0.801SS**  trans-69.1179.5179.7-133.90000112.6
443P57.7Low40.7Very low103 Ų103138 Ų13867%0.66980%0.802SS**  cis-141.3-1792.942.3-23.7000116.3
444Q35.2Very low40.1Very low199 Ų199137.5 Ų137.593%0.9380%0.799SS**  -171.3157.7121.8-101.6166.513.400112.1
445N40.3Very low39.9Very low151 Ų151139.4 Ų139.481%0.80781%0.807SS**  trans-133.1175.3-168.2-166.18.4000109.8
446E40.8Very low39.6Very low182 Ų182136.4 Ų136.485%0.8581%0.805SS**  trans76.1146.6176.3-45.5-166117.300115.5
447A36Very low39.3Very low96 Ų96136.3 Ų136.379%0.79381%0.811SS**  cis-144.3166.81.400000113
448I42.4Very low38.8Very low139 Ų139132 Ų13271%0.71381%0.808SS**  trans-70.8139.3176.8-63.2149.5000111.4
449Q39.1Very low38.5Very low188 Ų188134.3 Ų134.388%0.87982%0.818SS**  -170.1149.8119.6-103.8179.991.400114.6
450H36.5Very low37.7Very low166 Ų166132.8 Ų132.877%0.76981%0.814SS**  trans-97.8144.8-176.6-51.1-99.7000110.2
451S32.3Very low36.8Very low119 Ų119131.9 Ų131.983%0.83281%0.81SS**  trans-152.5109.9161.3-72.30000110.5
452S40.1Very low36.7Very low116 Ų116134.8 Ų134.881%0.81182%0.819SS**  trans-69.7141.6167.1-50.70000109.8
453V35.1Very low36.6Very low146 Ų146134.4 Ų134.489%0.88582%0.817SS**  trans-122.495.4161.7-75.90000110.1
454S33.2Very low35.7Very low109 Ų109138 Ų13876%0.76283%0.827SS**  trans-73.7152.4161.8-68.40000110.2
455T37.4Very low35.8Very low144 Ų144134.5 Ų134.588%0.88382%0.819SS**  trans-50.8136.7172.249.40000113.6
456S36.3Very low36Very low113 Ų113133.8 Ų133.879%0.7982%0.823SS**  trans-133.2138.3158.1580000110.7
457N37.8Very low35.4Very low175 Ų175129.5 Ų129.594%0.93682%0.819SS**  trans-71132170-78.2-8.4000109
458G29.7Very low35.3Very low73 Ų73129.3 Ų129.375%0.75382%0.817SS**  trans-147.299.1177.600000111.1
459V32.4Very low34.8Very low140 Ų140128.9 Ų128.985%0.84883%0.826SS**  trans-68.5138.7172.1-73.40000110.9
460S29.5Very low34.6Very low107 Ų107124.4 Ų124.475%0.74882%0.821SS**  171127125.5-77.10000114.1
461S30.8Very low35Very low112 Ų112122.3 Ų122.378%0.78382%0.822SS**  trans43.8106.6133-51.40000120.3
462S32.1Very low35Very low132 Ų132121 Ų12192%0.92382%0.819SS**  trans-91.4129.8146.7-56.80000109.6
463S33.3Very low34.6Very low113 Ų113122.1 Ų122.179%0.7982%0.821SS**  trans-143.3132.8163.256.70000110.3
464M38.4Very low34.5Very low179 Ų179119 Ų11988%0.88281%0.811SS**  trans-119.5122.2161.7-62.7-153.793.600108.2
465T37.6Very low34.2Very low125 Ų125120.3 Ų120.377%0.76781%0.809SS**  trans7.5141.415156.80000119
466P44.2Very low33.9Very low135 Ų135120.7 Ų120.788%0.87780%0.801SS**  -129-173.881.926.9-9.4000114.6
467A30Very low33.8Very low93 Ų93120.2 Ų120.277%0.76980%0.798SS**  trans-106.6166.3-149.300000116.7
468A33.2Very low33.8Very low91 Ų91117 Ų11775%0.75278%0.784SS**  trans63.4109.1148.800000119.9
469S31Very low34Very low130 Ų130121.7 Ų121.791%0.90979%0.787SS**  -173.1142.4110.8-75.90000111.2
470A35.3Very low34.1Very low94 Ų94121.9 Ų121.978%0.77778%0.783SS**  trans-112.5-177.4170.600000108.4
471P45.8Very low34.2Very low122 Ų122120.2 Ų120.279%0.79278%0.783SS**  cis-142.8-174.65.243.2-24.2000117
472A31.3Very low34.3Very low91 Ų91123.1 Ų123.175%0.75278%0.784SS**  trans73.3153.5156.300000117.7
473T32.3Very low34.4Very low140 Ų140122 Ų12286%0.85978%0.782SS**  cis-138.9-176.515.447.10000113.6
474A31.9Very low34.5Very low82 Ų82124.8 Ų124.868%0.67878%0.783SS**  trans-58.9176.8171.800000114
475D27.6Very low34.3Very low135 Ų135128.2 Ų128.272%0.72279%0.786SS**  cis-167-176.445.4-141.4-28.4000116.2
476Q32.2Very low34Very low153 Ų153125.7 Ų125.772%0.71578%0.784SS**  trans-41.4144.6179.9-76.9157.879.800119
477S34.2Very low33.5Very low103 Ų103124.4 Ų124.472%0.7279%0.785SS**  69.8152.498.1-41.30000114.5
478T36.4Very low33.7Very low107 Ų107123.8 Ų123.866%0.65678%0.78SS**  cis-168.7154.431.1-46.30000110.1
479E35.2Very low33.8Very low172 Ų172127 Ų12780%0.80478%0.784SS**  trans56.3158.1151.4-83.7162.1-179.900121.1
480D34.2Very low34Very low143 Ų143126.5 Ų126.577%0.76578%0.78SS**  cis-158.4174.6-13.9-141-27.4000110.2
481G31.2Very low34Very low72 Ų72128.3 Ų128.374%0.74278%0.782SS**  trans144.786.9157.100000118.8
482Q33.6Very low33.6Very low174 Ų174130.2 Ų130.281%0.81378%0.784SS**  trans-77.5148.9172.6-68.7167.5-79.200114.5
483A32.9Very low33.8Very low107 Ų107134.1 Ų134.188%0.88479%0.786SS**  trans-154.8114.213900000111.8
484Q36.3Very low34.1Very low172 Ų172133.9 Ų133.980%0.80479%0.785SS**  trans-96.8146171.8-71.5173.7-53.100111.7
485R34.1Very low34.6Very low252 Ų252138.4 Ų138.495%0.95179%0.792SS**  trans160.7140.8132.5-90.6168.4175.1-127.6-0.5109.4
486G31.8Very low36.1Very low71 Ų71137 Ų13773%0.73279%0.791SS**  cis148.2116.5-7.800000112.6
487A32.2Very low36.8Very low108 Ų108135.9 Ų135.989%0.89380%0.799SS**  trans62.3162.9163.900000118.6
488A34.3Very low37.3Very low80 Ų80134.5 Ų134.566%0.66180%0.801SS**  cis-170.6154.7-35.900000109
489L36.5Very low37.7Very low160 Ų160139 Ų13984%0.83884%0.838SS**  trans47.1125.1150.3-67160.6000120.7
490S33.9Very low37.9Very low119 Ų119137.4 Ų137.483%0.83284%0.839SS**  -177141108.5-78.50000114.1
491T36.2Very low38.1Very low132 Ų132137.1 Ų137.181%0.8184%0.843SS**  trans-80.4139.5175.9-51.30000111.8
492I37.5Very low38.4Very low161 Ų161140.7 Ų140.783%0.82685%0.849SS**  trans-134.9140153.2-64-173.9000110.4
493Q35.1Very low38.7Very low173 Ų173138.8 Ų138.881%0.80885%0.851SS**  trans-120.5135.6-178.4169.4-172.730.200108.4
494T39.8Very low39.1Very low136 Ų136140.8 Ų140.883%0.83485%0.849SS**  trans-148.8139.9168.611.30000112.2
495Q41.9Very low39.3Very low177 Ų177138.7 Ų138.783%0.82785%0.852SS**  trans-112.3171.7177.2-93.6-96-27.600109.2
496P58.9Low39.6Very low106 Ų106130.6 Ų130.669%0.68885%0.845SS**  trans-93.9164.8-149.936.9-37.7000115.7
497S46.1Very low40.2Very low128 Ų128135.2 Ų135.290%0.89585%0.853SS**  trans-120.9140.9160.5-66.80000109.1
498G44.3Very low40.9Very low74 Ų74137.4 Ų137.476%0.76385%0.85SS**  trans-102.3170.3-177.700000114.6
499S46.4Very low41.5Very low203 Ų203142.6 Ų142.6100%1.4287%0.867SS**  trans-160.40152-73.30000108

Retrieved 499 of 499 residues in 298.1 ms (Link to these results)

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